flow_filelinking.yaml0000644000000000000000000001212414664572124013775 0ustar rootroot- parameter: inputfeatures target: inputfeatures/fbmn_quant.csv - parameter: inputspectra target: inputspectra/fbmn.mgf - parameter: metadata_filename target: metadata_filename/fbmn_metadata.tsv - parameter: input_libraries target: input_libraries/MMV_POSITIVE.mgf - parameter: input_libraries target: input_libraries/GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_NEGATIVE.mgf - parameter: input_libraries target: input_libraries/GNPS-COLLECTIONS-PESTICIDES-POSITIVE.mgf - parameter: input_libraries target: input_libraries/BMDMS-NP.mgf - parameter: input_libraries target: input_libraries/MSNLIB-POSITIVE.mgf - parameter: input_libraries target: input_libraries/CMMC-REFRAME-NEGATIVE-LIBRARY.mgf - parameter: input_libraries target: input_libraries/LEAFBOT.mgf - parameter: input_libraries target: input_libraries/BIRMINGHAM-UHPLC-MS-NEG.mgf - parameter: input_libraries target: input_libraries/DEREPLICATOR_IDENTIFIED_LIBRARY.mgf - parameter: input_libraries target: input_libraries/GNPS-NIH-NATURALPRODUCTSLIBRARY.mgf - parameter: input_libraries target: input_libraries/RESPECT.mgf - parameter: input_libraries target: input_libraries/MIADB.mgf - parameter: input_libraries target: input_libraries/NEO-MSMS.mgf - parameter: input_libraries target: input_libraries/HCE-CELL-LYSATE-LIPIDS.mgf - parameter: input_libraries target: input_libraries/CASMI.mgf - parameter: input_libraries target: input_libraries/GNPS-COLLECTIONS-PESTICIDES-NEGATIVE.mgf - parameter: input_libraries target: input_libraries/MSNLIB-NEGATIVE.mgf - parameter: input_libraries target: input_libraries/PSU-MSMLS.mgf - parameter: input_libraries target: input_libraries/IQAMDB.mgf - parameter: input_libraries target: input_libraries/GNPS-SELLECKCHEM-FDA-PART1.mgf - parameter: input_libraries target: input_libraries/XANTHONES-DB.mgf - parameter: input_libraries target: input_libraries/GNPS-D2-AMINO-LIPID-LIBRARY.mgf - parameter: input_libraries target: input_libraries/HMDB.mgf - parameter: input_libraries target: input_libraries/BIRMINGHAM-UHPLC-MS-POS.mgf - parameter: input_libraries target: input_libraries/MMV_NEGATIVE.mgf - parameter: input_libraries target: input_libraries/GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE.mgf - parameter: input_libraries target: input_libraries/DRUGS-OF-ABUSE-LIBRARY.mgf - parameter: input_libraries target: input_libraries/MASSBANK.mgf - parameter: input_libraries target: input_libraries/BILELIB19.mgf - parameter: input_libraries target: input_libraries/GNPS-IOBA-NHC.mgf - parameter: input_libraries target: input_libraries/GNPS-MSMLS.mgf - parameter: input_libraries target: input_libraries/GNPS-EMBL-MCF.mgf - parameter: input_libraries target: input_libraries/GNPS-NIH-CLINICALCOLLECTION2.mgf - parameter: input_libraries target: input_libraries/GNPS-LIBRARY.mgf - parameter: input_libraries target: input_libraries/ECG-ACYL-AMIDES-C4-C24-LIBRARY.mgf - parameter: input_libraries target: input_libraries/MONA.mgf - parameter: input_libraries target: input_libraries/GNPS-NUTRI-METAB-FEM-POS.mgf - parameter: input_libraries target: input_libraries/GNPS-SAM-SIK-KANG-LEGACY-LIBRARY.mgf - parameter: input_libraries target: input_libraries/PNNL-LIPIDS-POSITIVE.mgf - parameter: input_libraries target: input_libraries/GNPS-NIH-CLINICALCOLLECTION1.mgf - parameter: input_libraries target: input_libraries/UM-NPDC.mgf - parameter: input_libraries target: input_libraries/LDB_POSITIVE.mgf - parameter: input_libraries target: input_libraries/MASSBANKEU.mgf - parameter: input_libraries target: input_libraries/GNPS-N-ACYL-LIPIDS-MASSQL.mgf - parameter: input_libraries target: input_libraries/GNPS-SELLECKCHEM-FDA-PART2.mgf - parameter: input_libraries target: input_libraries/GNPS-COLLECTIONS-MISC.mgf - parameter: input_libraries target: input_libraries/ECG-ACYL-ESTERS-C4-C24-LIBRARY.mgf - parameter: input_libraries target: input_libraries/DMIM-DRUG-METABOLITE-LIBRARY.mgf - parameter: input_libraries target: input_libraries/GNPS-NIST14-MATCHES.mgf - parameter: input_libraries target: input_libraries/PNNL-LIPIDS-NEGATIVE.mgf - parameter: input_libraries target: input_libraries/GNPS-FAULKNERLEGACY.mgf - parameter: input_libraries target: input_libraries/CMMC-REFRAME-POSITIVE-LIBRARY.mgf - parameter: input_libraries target: input_libraries/PHENOLICSDB.mgf - parameter: input_libraries target: input_libraries/GNPS-PRESTWICKPHYTOCHEM.mgf - parameter: input_libraries target: input_libraries/BERKELEY-LAB.mgf - parameter: input_libraries target: input_libraries/SUMNER.mgf - parameter: input_libraries target: input_libraries/CMMC-LIBRARY.mgf - parameter: input_libraries target: input_libraries/ELIXDB-LICHEN-DATABASE.mgf - parameter: input_libraries target: input_libraries/GNPS-NIH-SMALLMOLECULEPHARMACOLOGICALLYACTIVE.mgf - parameter: input_libraries target: input_libraries/LDB_NEGATIVE.mgf - parameter: input_libraries target: input_libraries/GNPS-NUTRI-METAB-FEM-NEG.mgf - parameter: input_libraries target: input_libraries/TUEBINGEN-NATURAL-PRODUCT-COLLECTION.mgf - parameter: input_libraries target: input_libraries/GNPS-SCIEX-LIBRARY.mgf input_libraries/0000755000000000000000000000000014664572124012762 5ustar rootrootinput_libraries/IQAMDB.mgf0000777000000000000000000000000014664572124027456 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/IQAMDB.mgfustar rootrootinput_libraries/CMMC-REFRAME-NEGATIVE-LIBRARY.mgf0000777000000000000000000000000014664572124035764 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/CMMC-REFRAME-NEGATIVE-LIBRARY.mgfustar rootrootinput_libraries/XANTHONES-DB.mgf0000777000000000000000000000000014664572124031250 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/XANTHONES-DB.mgfustar rootrootinput_libraries/BMDMS-NP.mgf0000777000000000000000000000000014664572124030116 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/BMDMS-NP.mgfustar rootrootinput_libraries/BIRMINGHAM-UHPLC-MS-POS.mgf0000777000000000000000000000000014664572124034270 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/BIRMINGHAM-UHPLC-MS-POS.mgfustar rootrootinput_libraries/GNPS-FAULKNERLEGACY.mgf0000777000000000000000000000000014664572124033266 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/GNPS-FAULKNERLEGACY.mgfustar rootrootinput_libraries/MMV_NEGATIVE.mgf0000777000000000000000000000000014664572124031426 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/MMV_NEGATIVE.mgfustar rootrootinput_libraries/CASMI.mgf0000777000000000000000000000000014664572124027254 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/CASMI.mgfustar rootrootinput_libraries/GNPS-NIST14-MATCHES.mgf0000777000000000000000000000000014664572124033106 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/GNPS-NIST14-MATCHES.mgfustar rootrootinput_libraries/GNPS-N-ACYL-LIPIDS-MASSQL.mgf0000777000000000000000000000000014664572124034704 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/GNPS-N-ACYL-LIPIDS-MASSQL.mgfustar rootrootinput_libraries/PNNL-LIPIDS-NEGATIVE.mgf0000777000000000000000000000000014664572124033446 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/PNNL-LIPIDS-NEGATIVE.mgfustar rootrootinput_libraries/NEO-MSMS.mgf0000777000000000000000000000000014664572124030160 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/NEO-MSMS.mgfustar rootrootinput_libraries/GNPS-NUTRI-METAB-FEM-POS.mgf0000777000000000000000000000000014664572124034464 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/GNPS-NUTRI-METAB-FEM-POS.mgfustar rootrootinput_libraries/TUEBINGEN-NATURAL-PRODUCT-COLLECTION.mgf0000777000000000000000000000000014664572124040152 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/TUEBINGEN-NATURAL-PRODUCT-COLLECTION.mgfustar rootrootinput_libraries/HCE-CELL-LYSATE-LIPIDS.mgf0000777000000000000000000000000014664572124033756 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/HCE-CELL-LYSATE-LIPIDS.mgfustar rootrootinput_libraries/MMV_POSITIVE.mgf0000777000000000000000000000000014664572124031526 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/MMV_POSITIVE.mgfustar rootrootinput_libraries/GNPS-NUTRI-METAB-FEM-NEG.mgf0000777000000000000000000000000014664572124034404 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/GNPS-NUTRI-METAB-FEM-NEG.mgfustar rootrootinput_libraries/MASSBANK.mgf0000777000000000000000000000000014664572124030162 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/MASSBANK.mgfustar rootrootinput_libraries/GNPS-SELLECKCHEM-FDA-PART2.mgf0000777000000000000000000000000014664572124034770 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/GNPS-SELLECKCHEM-FDA-PART2.mgfustar rootrootinput_libraries/LEAFBOT.mgf0000777000000000000000000000000014664572124027714 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/LEAFBOT.mgfustar rootrootinput_libraries/DRUGS-OF-ABUSE-LIBRARY.mgf0000777000000000000000000000000014664572124034036 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/DRUGS-OF-ABUSE-LIBRARY.mgfustar rootrootinput_libraries/GNPS-SAM-SIK-KANG-LEGACY-LIBRARY.mgf0000777000000000000000000000000014664572124036552 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/GNPS-SAM-SIK-KANG-LEGACY-LIBRARY.mgfustar rootrootinput_libraries/GNPS-NIH-CLINICALCOLLECTION2.mgf0000777000000000000000000000000014664572124035556 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/GNPS-NIH-CLINICALCOLLECTION2.mgfustar rootrootinput_libraries/RESPECT.mgf0000777000000000000000000000000014664572124027776 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/RESPECT.mgfustar rootrootinput_libraries/MIADB.mgf0000777000000000000000000000000014664572124027214 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/MIADB.mgfustar rootrootinput_libraries/GNPS-MSMLS.mgf0000777000000000000000000000000014664572124030664 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/GNPS-MSMLS.mgfustar rootrootinput_libraries/HMDB.mgf0000777000000000000000000000000014664572124027010 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/HMDB.mgfustar rootrootinput_libraries/PNNL-LIPIDS-POSITIVE.mgf0000777000000000000000000000000014664572124033546 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/PNNL-LIPIDS-POSITIVE.mgfustar rootrootinput_libraries/BIRMINGHAM-UHPLC-MS-NEG.mgf0000777000000000000000000000000014664572124034210 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/BIRMINGHAM-UHPLC-MS-NEG.mgfustar rootrootinput_libraries/GNPS-NIH-NATURALPRODUCTSLIBRARY.mgf0000777000000000000000000000000014664572124036764 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/GNPS-NIH-NATURALPRODUCTSLIBRARY.mgfustar rootrootinput_libraries/GNPS-COLLECTIONS-PESTICIDES-NEGATIVE.mgf0000777000000000000000000000000014664572124040116 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/GNPS-COLLECTIONS-PESTICIDES-NEGATIVE.mgfustar rootrootinput_libraries/GNPS-NIH-CLINICALCOLLECTION1.mgf0000777000000000000000000000000014664572124035554 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/GNPS-NIH-CLINICALCOLLECTION1.mgfustar rootrootinput_libraries/PSU-MSMLS.mgf0000777000000000000000000000000014664572124030464 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/PSU-MSMLS.mgfustar rootrootinput_libraries/DEREPLICATOR_IDENTIFIED_LIBRARY.mgf0000777000000000000000000000000014664572124037036 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/DEREPLICATOR_IDENTIFIED_LIBRARY.mgfustar rootroot././@LongLink0000644000000000000000000000015200000000000011600 Kustar rootroot/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE.mgfinput_libraries/GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE.mgf0000777000000000000000000000000014664572124043035 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVustar rootrootinput_libraries/MSNLIB-NEGATIVE.mgf0000777000000000000000000000000014664572124032134 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/MSNLIB-NEGATIVE.mgfustar rootrootinput_libraries/GNPS-COLLECTIONS-MISC.mgf0000777000000000000000000000000014664572124033714 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/GNPS-COLLECTIONS-MISC.mgfustar rootrootinput_libraries/SUMNER.mgf0000777000000000000000000000000014664572124027606 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/SUMNER.mgfustar rootrootinput_libraries/BILELIB19.mgf0000777000000000000000000000000014664572124030214 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/BILELIB19.mgfustar rootrootinput_libraries/GNPS-D2-AMINO-LIPID-LIBRARY.mgf0000777000000000000000000000000014664572124035214 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/GNPS-D2-AMINO-LIPID-LIBRARY.mgfustar rootrootinput_libraries/PHENOLICSDB.mgf0000777000000000000000000000000014664572124031050 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/PHENOLICSDB.mgfustar rootrootinput_libraries/MONA.mgf0000777000000000000000000000000014664572124027050 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/MONA.mgfustar rootrootinput_libraries/BERKELEY-LAB.mgf0000777000000000000000000000000014664572124031160 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/BERKELEY-LAB.mgfustar rootrootinput_libraries/GNPS-SCIEX-LIBRARY.mgf0000777000000000000000000000000014664572124033030 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/GNPS-SCIEX-LIBRARY.mgfustar rootrootinput_libraries/MASSBANKEU.mgf0000777000000000000000000000000014664572124030646 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/MASSBANKEU.mgfustar rootrootinput_libraries/LDB_NEGATIVE.mgf0000777000000000000000000000000014664572124031332 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/LDB_NEGATIVE.mgfustar rootrootinput_libraries/CMMC-LIBRARY.mgf0000777000000000000000000000000014664572124031226 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/CMMC-LIBRARY.mgfustar rootrootinput_libraries/GNPS-SELLECKCHEM-FDA-PART1.mgf0000777000000000000000000000000014664572124034766 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/GNPS-SELLECKCHEM-FDA-PART1.mgfustar rootrootinput_libraries/GNPS-PRESTWICKPHYTOCHEM.mgf0000777000000000000000000000000014664572124034566 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/GNPS-PRESTWICKPHYTOCHEM.mgfustar rootrootinput_libraries/MSNLIB-POSITIVE.mgf0000777000000000000000000000000014664572124032234 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/MSNLIB-POSITIVE.mgfustar rootrootinput_libraries/GNPS-LIBRARY.mgf0000777000000000000000000000000014664572124031306 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/GNPS-LIBRARY.mgfustar rootrootinput_libraries/GNPS-IOBA-NHC.mgf0000777000000000000000000000000014664572124031336 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/GNPS-IOBA-NHC.mgfustar rootrootinput_libraries/GNPS-EMBL-MCF.mgf0000777000000000000000000000000014664572124031342 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/GNPS-EMBL-MCF.mgfustar rootrootinput_libraries/GNPS-COLLECTIONS-PESTICIDES-POSITIVE.mgf0000777000000000000000000000000014664572124040216 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/GNPS-COLLECTIONS-PESTICIDES-POSITIVE.mgfustar rootrootinput_libraries/CMMC-REFRAME-POSITIVE-LIBRARY.mgf0000777000000000000000000000000014664572124036064 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/CMMC-REFRAME-POSITIVE-LIBRARY.mgfustar rootrootinput_libraries/ECG-ACYL-AMIDES-C4-C24-LIBRARY.mgf0000777000000000000000000000000014664572124035524 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/ECG-ACYL-AMIDES-C4-C24-LIBRARY.mgfustar rootrootinput_libraries/DMIM-DRUG-METABOLITE-LIBRARY.mgf0000777000000000000000000000000014664572124035610 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/DMIM-DRUG-METABOLITE-LIBRARY.mgfustar rootroot././@LongLink0000644000000000000000000000015200000000000011600 Kustar rootroot/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_NEGATIVE.mgfinput_libraries/GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_NEGATIVE.mgf0000777000000000000000000000000014664572124042735 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_NEGATIVustar rootrootinput_libraries/ECG-ACYL-ESTERS-C4-C24-LIBRARY.mgf0000777000000000000000000000000014664572124035632 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/ECG-ACYL-ESTERS-C4-C24-LIBRARY.mgfustar rootrootinput_libraries/LDB_POSITIVE.mgf0000777000000000000000000000000014664572124031432 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/LDB_POSITIVE.mgfustar rootrootinput_libraries/UM-NPDC.mgf0000777000000000000000000000000014664572124027672 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/UM-NPDC.mgfustar rootroot././@LongLink0000644000000000000000000000015000000000000011576 Kustar rootroot/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/GNPS-NIH-SMALLMOLECULEPHARMACOLOGICALLYACTIVE.mgfinput_libraries/GNPS-NIH-SMALLMOLECULEPHARMACOLOGICALLYACTIVE.mgf0000777000000000000000000000000014664572124042146 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/GNPS-NIH-SMALLMOLECULEPHARMACOLOGICALLYACTIVE.ustar rootrootinput_libraries/ELIXDB-LICHEN-DATABASE.mgf0000777000000000000000000000000014664572124033706 2/data/nf_data/spectrallibraries/server/MGF/LC/LIBRARY/ELIXDB-LICHEN-DATABASE.mgfustar rootrootinput_raw_spectra/0000755000000000000000000000000014664572124013320 5ustar rootrootinput_supplemental_edges/0000755000000000000000000000000014664572124014666 5ustar rootrootinputfeatures/0000755000000000000000000000000014664572124012465 5ustar rootrootinputfeatures/fbmn_quant.csv0000777000000000000000000000000014664572124031106 2/data/nf_data/useruploads/Tito_Damiani/PiperFIM/fbmn_quant.csvustar rootrootinputspectra/0000755000000000000000000000000014664572124012310 5ustar rootrootinputspectra/fbmn.mgf0000777000000000000000000000000014664572124026245 2/data/nf_data/useruploads/Tito_Damiani/PiperFIM/fbmn.mgfustar rootrootjob_dag.html0000644000000000000000000002151414664574443012053 0ustar rootroot Nextflow Cytoscape.js with Dagre

Nextflow Cytoscape.js with Dagre

job_parameters.yaml0000644000000000000000000000253114664572124013451 0ustar rootrootOMETAFLOW_SERVER: http://ometaflow-launchserver:4000 OMETALIBRARY_SERVER: http://ometalibrary-web:5000/library OMETAMASST_SERVER: http://ometamasst-web:5000/masst OMETATASK: 43853471d153488b95144abd3af36a9d OMETAUSER: Tito_Damiani create_time: 2024-08-31 03:45:05 PDT-0700 description: 20240831_PiperFIM_FBMN featurefindingtool: MZMINE fragment_tolerance: '0.01' input_libraries: /data/nf_data/server/nf_tasks/43853471d153488b95144abd3af36a9d/input_libraries input_raw_spectra: NO_FILE input_supplemental_edges: NO_FILE inputfeatures: /data/nf_data/server/nf_tasks/43853471d153488b95144abd3af36a9d/inputfeatures/fbmn_quant.csv inputspectra: /data/nf_data/server/nf_tasks/43853471d153488b95144abd3af36a9d/inputspectra library_analog_search: '1' library_min_cosine: '0.7' library_min_matched_peaks: '6' library_topk: '1' metadata_filename: /data/nf_data/server/nf_tasks/43853471d153488b95144abd3af36a9d/metadata_filename/fbmn_metadata.tsv min_peak_intensity: '0.0' networking_max_shift: '1999' networking_min_cosine: '0.7' networking_min_matched_peaks: '6' normalization: None pm_tolerance: '0.01' precursor_filter: 'yes' publishdir: /data/nf_data/server/nf_tasks/43853471d153488b95144abd3af36a9d task: 43853471d153488b95144abd3af36a9d window_filter: 'yes' workflow_version: SERVER:2024.08.28;WORKFLOW:2024.08.07 workflowname: feature_based_molecular_networking_workflow job_report.html0000644000000000000000001371537714664574443012660 0ustar rootroot [intergalactic_lichterman] Nextflow Workflow Report

Nextflow workflow report

[intergalactic_lichterman]

Workflow execution completed successfully!
Run times
31-Aug-2024 10:45:08 - 31-Aug-2024 11:05:35 (duration: 20m 27s)
  138 succeeded  
  0 cached  
  0 ignored  
  0 failed  
Nextflow command
nextflow run /app/workflows_user/feature_based_molecular_networking_workflow/nf_workflow.nf -params-file /data/nf_data/server/nf_tasks/43853471d153488b95144abd3af36a9d/job_parameters.yaml -w /data/nf_data/server/nf_work/43853471d153488b95144abd3af36a9d -with-report /data/nf_data/server/nf_tasks/43853471d153488b95144abd3af36a9d/job_report.html -with-timeline /data/nf_data/server/nf_tasks/43853471d153488b95144abd3af36a9d/job_timeline.html -with-dag /data/nf_data/server/nf_tasks/43853471d153488b95144abd3af36a9d/job_dag.html -with-weblog 'http://localhost:4000/nf_weblog/43853471d153488b95144abd3af36a9d' -c /app/launchserver/nextflow.config
CPU-Hours
1.6
Launch directory
/data/nf_data/server/nf_tasks/43853471d153488b95144abd3af36a9d
Work directory
/data/nf_data/server/nf_work/43853471d153488b95144abd3af36a9d
Project directory
/app/workflows_user/feature_based_molecular_networking_workflow
Script name
nf_workflow.nf
Script ID
7e0a32c1a85f47d9d7b672580d0f5461
Workflow session
28d04a49-d564-45c8-aaf4-cf43ec0feef5
Workflow profile
standard
Nextflow version
version 21.10.0, build 5640 (11-11-2021 18:27 UTC)

Resource Usage

These plots give an overview of the distribution of resource usage for each process.

CPU

Memory

Job Duration

I/O

Tasks

This table shows information about each task in the workflow. Use the search box on the right to filter rows for specific values. Clicking headers will sort the table by that value and scrolling side to side will reveal more columns.

(tasks table omitted because the dataset is too big)
job_timeline.html0000644000000000000000000107512714664574443013140 0ustar rootroot

Processes execution timeline

Launch time:
Elapsed time:
Legend: job wall time / memory usage (RAM)

metadata_filename/0000755000000000000000000000000014664572124013207 5ustar rootrootmetadata_filename/fbmn_metadata.tsv0000777000000000000000000000000014664572124032752 2/data/nf_data/useruploads/Tito_Damiani/PiperFIM/fbmn_metadata.tsvustar rootrootnextflow_stdout.log0000644000000000000000000024134414664574443013560 0ustar rootrootN E X T F L O W ~ version 21.10.0 Launching `/app/workflows_user/feature_based_molecular_networking_workflow/nf_workflow.nf` [intergalactic_lichterman] - revision: 7e0a32c1a8 [- ] process > filesummary - [- ] process > filesummary - [- ] process > quantification_table_reform... - [- ] process > filter_spectra - [- ] process > librarySearchData - [- ] process > librarymergeResults - [- ] process > summaryLibrary - [- ] process > librarygetGNPSAnnotations - [- ] process > networkingGNPSPrepParams - [- ] process > calculatePairs - [- ] process > filesummary - [- ] process > quantification_table_reform... - [- ] process > filter_spectra - [- ] process > librarySearchData - [- ] process > librarymergeResults - [- ] process > summaryLibrary - [- ] process > librarygetGNPSAnnotations - [- ] process > networkingGNPSPrepParams - [- ] process > calculatePairs - [- ] process > filterNetwork - [- ] process > createMetadataFile - [- ] process > calculateGroupings - [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - [- ] process > filesummary [ 0%] 0 of 1 [- ] process > quantification_table_reform... - [- ] process > filter_spectra - [- ] process > librarySearchData - [- ] process > librarymergeResults - [- ] process > summaryLibrary [ 0%] 0 of 17 [- ] process > librarygetGNPSAnnotations - [- ] process > networkingGNPSPrepParams - [- ] process > calculatePairs - [- ] process > filterNetwork - [- ] process > createMetadataFile [ 0%] 0 of 1 [- ] process > calculateGroupings - [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (14) [a7/f05d29] process > filesummary (1) [ 0%] 0 of 1 [- ] process > quantification_table_reform... [ 0%] 0 of 1 [- ] process > filter_spectra - [- ] process > librarySearchData - [- ] process > librarymergeResults - [55/ec235b] process > summaryLibrary (30) [ 0%] 0 of 63 [- ] process > librarygetGNPSAnnotations - [- ] process > networkingGNPSPrepParams - [- ] process > calculatePairs - [- ] process > filterNetwork - [- ] process > createMetadataFile [ 0%] 0 of 1 [- ] process > calculateGroupings - [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (33) [a7/f05d29] process > filesummary (1) [ 0%] 0 of 1 [- ] process > quantification_table_reform... 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[ 0%] 0 of 1 [- ] process > filter_spectra - [- ] process > librarySearchData - [- ] process > librarymergeResults - [a4/ce29fb] process > summaryLibrary (7) [ 0%] 0 of 63 [- ] process > librarygetGNPSAnnotations - [- ] process > networkingGNPSPrepParams - [- ] process > calculatePairs - [- ] process > filterNetwork - [9e/36d152] process > createMetadataFile [ 0%] 0 of 1 [- ] process > calculateGroupings - [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (61) [a7/f05d29] process > filesummary (1) [ 0%] 0 of 1 [94/bdd992] process > quantification_table_reform... 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[ 0%] 0 of 1 [- ] process > filter_spectra - [- ] process > librarySearchData - [- ] process > librarymergeResults - [df/2935cf] process > summaryLibrary (51) [ 0%] 0 of 63 [- ] process > librarygetGNPSAnnotations - [- ] process > networkingGNPSPrepParams - [- ] process > calculatePairs - [- ] process > filterNetwork - [9e/36d152] process > createMetadataFile [ 0%] 0 of 1 [- ] process > calculateGroupings - [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (66) [a7/f05d29] process > filesummary (1) [ 0%] 0 of 1 [94/bdd992] process > quantification_table_reform... [ 0%] 0 of 1 [- ] process > filter_spectra - [- ] process > librarySearchData - [- ] process > librarymergeResults - [20/c539a7] process > summaryLibrary (14) [ 0%] 0 of 63 [- ] process > librarygetGNPSAnnotations - [- ] process > networkingGNPSPrepParams - [- ] process > calculatePairs - [- ] process > filterNetwork - [9e/36d152] process > createMetadataFile [ 0%] 0 of 1 [- ] process > calculateGroupings - [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (66) [a7/f05d29] process > filesummary (1) [ 0%] 0 of 1 [94/bdd992] process > quantification_table_reform... [ 0%] 0 of 1 [- ] process > filter_spectra - [- ] process > librarySearchData - [- ] process > librarymergeResults - [20/c539a7] process > summaryLibrary (14) [ 0%] 0 of 63 [- ] process > librarygetGNPSAnnotations - [- ] process > networkingGNPSPrepParams - [- ] process > calculatePairs - [- ] process > filterNetwork - [9e/36d152] process > createMetadataFile [ 0%] 0 of 1 [- ] process > calculateGroupings - [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (66) [a7/f05d29] process > filesummary (1) [ 0%] 0 of 1 [94/bdd992] process > quantification_table_reform... [ 0%] 0 of 1 [- ] process > filter_spectra - [- ] process > librarySearchData - [- ] process > librarymergeResults - [38/7cc01f] process > summaryLibrary (23) [ 4%] 3 of 63 [- ] process > librarygetGNPSAnnotations - [- ] process > networkingGNPSPrepParams - [- ] process > calculatePairs - [- ] process > filterNetwork - [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [- ] process > calculateGroupings - [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (66) [a7/f05d29] process > filesummary (1) [ 0%] 0 of 1 [94/bdd992] process > quantification_table_reform... [ 0%] 0 of 1 [- ] process > filter_spectra - [- ] process > librarySearchData - [- ] process > librarymergeResults - [74/067ecd] process > summaryLibrary (12) [ 15%] 10 of 63 [- ] process > librarygetGNPSAnnotations - [- ] process > networkingGNPSPrepParams - [- ] process > calculatePairs - [- ] process > filterNetwork - [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [- ] process > calculateGroupings - [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (66) [a7/f05d29] process > filesummary (1) [ 0%] 0 of 1 [94/bdd992] process > quantification_table_reform... [ 0%] 0 of 1 [- ] process > filter_spectra - [- ] process > librarySearchData - [- ] process > librarymergeResults - [a5/9c8d5b] process > summaryLibrary (44) [ 26%] 17 of 63 [- ] process > librarygetGNPSAnnotations - [- ] process > networkingGNPSPrepParams - [- ] process > calculatePairs - [- ] process > filterNetwork - [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [- ] process > calculateGroupings - [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (66) [a7/f05d29] process > filesummary (1) [ 0%] 0 of 1 [94/bdd992] process > quantification_table_reform... [ 0%] 0 of 1 [- ] process > filter_spectra - [- ] process > librarySearchData - [- ] process > librarymergeResults - [0c/ddfde9] process > summaryLibrary (5) [ 47%] 30 of 63 [- ] process > librarygetGNPSAnnotations - [- ] process > networkingGNPSPrepParams - [- ] process > calculatePairs - [- ] process > filterNetwork - [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [- ] process > calculateGroupings - [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (66) [a7/f05d29] process > filesummary (1) [ 0%] 0 of 1 [94/bdd992] process > quantification_table_reform... [ 0%] 0 of 1 [- ] process > filter_spectra - [- ] process > librarySearchData - [- ] process > librarymergeResults - [90/933dad] process > summaryLibrary (20) [ 74%] 47 of 63 [- ] process > librarygetGNPSAnnotations - [- ] process > networkingGNPSPrepParams - [- ] process > calculatePairs - [- ] process > filterNetwork - [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [- ] process > calculateGroupings - [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (68) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [ 0%] 0 of 1 [- ] process > librarySearchData - [- ] process > librarymergeResults - [d6/f2d650] process > summaryLibrary (11) [ 82%] 52 of 63 [- ] process > librarygetGNPSAnnotations - [- ] process > networkingGNPSPrepParams - [- ] process > calculatePairs - [- ] process > filterNetwork - [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [ 0%] 0 of 1 [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (68) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [ 0%] 0 of 1 [- ] process > librarySearchData - [- ] process > librarymergeResults - [d0/c70aa3] process > summaryLibrary (39) [ 85%] 54 of 63 [- ] process > librarygetGNPSAnnotations - [- ] process > networkingGNPSPrepParams - [- ] process > calculatePairs - [- ] process > filterNetwork - [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [ 0%] 0 of 1 [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (68) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [ 0%] 0 of 1 [- ] process > librarySearchData - [- ] process > librarymergeResults - [ee/213509] process > summaryLibrary (57) [ 87%] 55 of 63 [- ] process > librarygetGNPSAnnotations - [- ] process > networkingGNPSPrepParams - [- ] process > calculatePairs - [- ] process > filterNetwork - [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [ 0%] 0 of 1 [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (68) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [ 0%] 0 of 1 [- ] process > librarySearchData - [- ] process > librarymergeResults - [c3/73e7db] process > summaryLibrary (62) [ 88%] 56 of 63 [- ] process > librarygetGNPSAnnotations - [- ] process > networkingGNPSPrepParams - [- ] process > calculatePairs - [- ] process > filterNetwork - [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [ 0%] 0 of 1 [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (68) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [ 0%] 0 of 1 [- ] process > librarySearchData - [- ] process > librarymergeResults - [34/2d4b1c] process > summaryLibrary (18) [ 92%] 58 of 63 [- ] process > librarygetGNPSAnnotations - [- ] process > networkingGNPSPrepParams - [- ] process > calculatePairs - [- ] process > filterNetwork - [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [ 0%] 0 of 1 [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (68) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [ 0%] 0 of 1 [- ] process > librarySearchData - [- ] process > librarymergeResults - [f9/de1071] process > summaryLibrary (28) [ 93%] 59 of 63 [- ] process > librarygetGNPSAnnotations - [- ] process > networkingGNPSPrepParams - [- ] process > calculatePairs - [- ] process > filterNetwork - [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [ 0%] 0 of 1 [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (74) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [100%] 1 of 1 ✔ [7c/ed3397] process > librarySearchData (17) [ 0%] 0 of 43 [- ] process > librarymergeResults - [df/2935cf] process > summaryLibrary (51) [ 95%] 60 of 63 [- ] process > librarygetGNPSAnnotations - [79/20da13] process > networkingGNPSPrepParams (1) [ 0%] 0 of 1 [- ] process > calculatePairs - [- ] process > filterNetwork - [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [ 0%] 0 of 1 [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (100) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [100%] 1 of 1 ✔ [c6/d32cd7] process > librarySearchData (44) [ 0%] 0 of 63 [- ] process > librarymergeResults - [4e/2aa3fb] process > summaryLibrary (50) [ 96%] 61 of 63 [- ] process > librarygetGNPSAnnotations - [79/20da13] process > networkingGNPSPrepParams (1) [ 0%] 0 of 1 [- ] process > calculatePairs - [- ] process > filterNetwork - [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [ 0%] 0 of 1 [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (124) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [100%] 1 of 1 ✔ [62/6962a6] process > librarySearchData (30) [ 0%] 0 of 63 [- ] process > librarymergeResults - [4e/2aa3fb] process > summaryLibrary (50) [ 96%] 61 of 63 [- ] process > librarygetGNPSAnnotations - [79/20da13] process > networkingGNPSPrepParams (1) [ 0%] 0 of 1 [- ] process > calculatePairs - [- ] process > filterNetwork - [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [ 0%] 0 of 1 [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (132) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [100%] 1 of 1 ✔ [ea/f64516] process > librarySearchData (54) [ 0%] 0 of 63 [- ] process > librarymergeResults - [a3/b8170f] process > summaryLibrary (4) [ 98%] 62 of 63 [- ] process > librarygetGNPSAnnotations - [79/20da13] process > networkingGNPSPrepParams (1) [ 0%] 0 of 1 [- ] process > calculatePairs - [- ] process > filterNetwork - [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [ 0%] 0 of 1 [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (133) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [100%] 1 of 1 ✔ [ea/f64516] process > librarySearchData (54) [ 0%] 0 of 63 [- ] process > librarymergeResults - [a3/b8170f] process > summaryLibrary (4) [ 98%] 62 of 63 [- ] process > librarygetGNPSAnnotations - [79/20da13] process > networkingGNPSPrepParams (1) [100%] 1 of 1 ✔ [14/4c683d] process > calculatePairs (1) [ 0%] 0 of 1 [- ] process > filterNetwork - [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [ 0%] 0 of 1 [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (133) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [100%] 1 of 1 ✔ [3d/ec0844] process > librarySearchData (37) [ 3%] 2 of 63 [- ] process > librarymergeResults - [a3/b8170f] process > summaryLibrary (4) [ 98%] 62 of 63 [- ] process > librarygetGNPSAnnotations - [79/20da13] process > networkingGNPSPrepParams (1) [100%] 1 of 1 ✔ [14/4c683d] process > calculatePairs (1) [ 0%] 0 of 1 [- ] process > filterNetwork - [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [ 0%] 0 of 1 [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (133) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [100%] 1 of 1 ✔ [a3/37477f] process > librarySearchData (40) [ 6%] 4 of 63 [- ] process > librarymergeResults - [a3/b8170f] process > summaryLibrary (4) [ 98%] 62 of 63 [- ] process > librarygetGNPSAnnotations - [79/20da13] process > networkingGNPSPrepParams (1) [100%] 1 of 1 ✔ [14/4c683d] process > calculatePairs (1) [ 0%] 0 of 1 [- ] process > filterNetwork - [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [100%] 1 of 1 ✔ [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (133) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [100%] 1 of 1 ✔ [f2/d0161c] process > librarySearchData (6) [ 7%] 5 of 63 [- ] process > librarymergeResults - [a3/b8170f] process > summaryLibrary (4) [ 98%] 62 of 63 [- ] process > librarygetGNPSAnnotations - [79/20da13] process > networkingGNPSPrepParams (1) [100%] 1 of 1 ✔ [14/4c683d] process > calculatePairs (1) [ 0%] 0 of 1 [- ] process > filterNetwork - [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [100%] 1 of 1 ✔ [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (133) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [100%] 1 of 1 ✔ [b7/7391f6] process > librarySearchData (34) [ 9%] 6 of 63 [- ] process > librarymergeResults - [a3/b8170f] process > summaryLibrary (4) [ 98%] 62 of 63 [- ] process > librarygetGNPSAnnotations - [79/20da13] process > networkingGNPSPrepParams (1) [100%] 1 of 1 ✔ [14/4c683d] process > calculatePairs (1) [ 0%] 0 of 1 [- ] process > filterNetwork - [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [100%] 1 of 1 ✔ [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (133) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [100%] 1 of 1 ✔ [f7/916f2d] process > librarySearchData (60) [ 14%] 9 of 63 [- ] process > librarymergeResults - [a3/b8170f] process > summaryLibrary (4) [ 98%] 62 of 63 [- ] process > librarygetGNPSAnnotations - [79/20da13] process > networkingGNPSPrepParams (1) [100%] 1 of 1 ✔ [14/4c683d] process > calculatePairs (1) [ 0%] 0 of 1 [- ] process > filterNetwork - [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [100%] 1 of 1 ✔ [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (133) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [100%] 1 of 1 ✔ [ae/1d11ff] process > librarySearchData (51) [ 15%] 10 of 63 [- ] process > librarymergeResults - [a3/b8170f] process > summaryLibrary (4) [ 98%] 62 of 63 [- ] process > librarygetGNPSAnnotations - [79/20da13] process > networkingGNPSPrepParams (1) [100%] 1 of 1 ✔ [14/4c683d] process > calculatePairs (1) [ 0%] 0 of 1 [- ] process > filterNetwork - [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [100%] 1 of 1 ✔ [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (133) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [100%] 1 of 1 ✔ [51/9ec7d6] process > librarySearchData (41) [ 17%] 11 of 63 [- ] process > librarymergeResults - [a3/b8170f] process > summaryLibrary (4) [ 98%] 62 of 63 [- ] process > librarygetGNPSAnnotations - [79/20da13] process > networkingGNPSPrepParams (1) [100%] 1 of 1 ✔ [14/4c683d] process > calculatePairs (1) [ 0%] 0 of 1 [- ] process > filterNetwork - [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [100%] 1 of 1 ✔ [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (133) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [100%] 1 of 1 ✔ [c6/d32cd7] process > librarySearchData (44) [ 19%] 12 of 63 [- ] process > librarymergeResults - [a3/b8170f] process > summaryLibrary (4) [ 98%] 62 of 63 [- ] process > librarygetGNPSAnnotations - [79/20da13] process > networkingGNPSPrepParams (1) [100%] 1 of 1 ✔ [14/4c683d] process > calculatePairs (1) [ 0%] 0 of 1 [- ] process > filterNetwork - [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [100%] 1 of 1 ✔ [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (133) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [100%] 1 of 1 ✔ [b2/ddce25] process > librarySearchData (22) [ 20%] 13 of 63 [- ] process > librarymergeResults - [a3/b8170f] process > summaryLibrary (4) [ 98%] 62 of 63 [- ] process > librarygetGNPSAnnotations - [79/20da13] process > networkingGNPSPrepParams (1) [100%] 1 of 1 ✔ [14/4c683d] process > calculatePairs (1) [ 0%] 0 of 1 [- ] process > filterNetwork - [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [100%] 1 of 1 ✔ [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (133) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [100%] 1 of 1 ✔ [1f/05fcaf] process > librarySearchData (1) [ 22%] 14 of 63 [- ] process > librarymergeResults - [a3/b8170f] process > summaryLibrary (4) [ 98%] 62 of 63 [- ] process > librarygetGNPSAnnotations - [79/20da13] process > networkingGNPSPrepParams (1) [100%] 1 of 1 ✔ [14/4c683d] process > calculatePairs (1) [100%] 1 of 1 ✔ [- ] process > filterNetwork - [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [100%] 1 of 1 ✔ [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (134) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [100%] 1 of 1 ✔ [1f/05fcaf] process > librarySearchData (1) [ 22%] 14 of 63 [- ] process > librarymergeResults - [a3/b8170f] process > summaryLibrary (4) [ 98%] 62 of 63 [- ] process > librarygetGNPSAnnotations - [79/20da13] process > networkingGNPSPrepParams (1) [100%] 1 of 1 ✔ [14/4c683d] process > calculatePairs (1) [100%] 1 of 1 ✔ [08/2d922e] process > filterNetwork (1) [ 0%] 0 of 1 [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [100%] 1 of 1 ✔ [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (134) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [100%] 1 of 1 ✔ [5a/a44b11] process > librarySearchData (25) [ 26%] 17 of 63 [- ] process > librarymergeResults - [a3/b8170f] process > summaryLibrary (4) [ 98%] 62 of 63 [- ] process > librarygetGNPSAnnotations - [79/20da13] process > networkingGNPSPrepParams (1) [100%] 1 of 1 ✔ [14/4c683d] process > calculatePairs (1) [100%] 1 of 1 ✔ [08/2d922e] process > filterNetwork (1) [ 0%] 0 of 1 [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [100%] 1 of 1 ✔ [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (134) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... 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[100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [100%] 1 of 1 ✔ [f5/2b3180] process > librarySearchData (62) [ 33%] 21 of 63 [- ] process > librarymergeResults - [a3/b8170f] process > summaryLibrary (4) [ 98%] 62 of 63 [- ] process > librarygetGNPSAnnotations - [79/20da13] process > networkingGNPSPrepParams (1) [100%] 1 of 1 ✔ [14/4c683d] process > calculatePairs (1) [100%] 1 of 1 ✔ [08/2d922e] process > filterNetwork (1) [ 0%] 0 of 1 [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [100%] 1 of 1 ✔ [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (134) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [100%] 1 of 1 ✔ [00/0ce6b1] process > librarySearchData (11) [ 34%] 22 of 63 [- ] process > librarymergeResults - [a3/b8170f] process > summaryLibrary (4) [ 98%] 62 of 63 [- ] process > librarygetGNPSAnnotations - [79/20da13] process > networkingGNPSPrepParams (1) [100%] 1 of 1 ✔ [14/4c683d] process > calculatePairs (1) [100%] 1 of 1 ✔ [08/2d922e] process > filterNetwork (1) [ 0%] 0 of 1 [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [100%] 1 of 1 ✔ [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (134) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [100%] 1 of 1 ✔ [97/7912b8] process > librarySearchData (63) [ 39%] 25 of 63 [- ] process > librarymergeResults - [a3/b8170f] process > summaryLibrary (4) [ 98%] 62 of 63 [- ] process > librarygetGNPSAnnotations - [79/20da13] process > networkingGNPSPrepParams (1) [100%] 1 of 1 ✔ [14/4c683d] process > calculatePairs (1) [100%] 1 of 1 ✔ [08/2d922e] process > filterNetwork (1) [ 0%] 0 of 1 [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [100%] 1 of 1 ✔ [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (134) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [100%] 1 of 1 ✔ [2b/db5560] process > librarySearchData (32) [ 41%] 26 of 63 [- ] process > librarymergeResults - [a3/b8170f] process > summaryLibrary (4) [ 98%] 62 of 63 [- ] process > librarygetGNPSAnnotations - [79/20da13] process > networkingGNPSPrepParams (1) [100%] 1 of 1 ✔ [14/4c683d] process > calculatePairs (1) [100%] 1 of 1 ✔ [08/2d922e] process > filterNetwork (1) [ 0%] 0 of 1 [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [100%] 1 of 1 ✔ [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (134) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [100%] 1 of 1 ✔ [2b/db5560] process > librarySearchData (32) [ 41%] 26 of 63 [- ] process > librarymergeResults - [f2/c0b880] process > summaryLibrary (42) [100%] 63 of 63 ✔ [- ] process > librarygetGNPSAnnotations - [79/20da13] process > networkingGNPSPrepParams (1) [100%] 1 of 1 ✔ [14/4c683d] process > calculatePairs (1) [100%] 1 of 1 ✔ [08/2d922e] process > filterNetwork (1) [ 0%] 0 of 1 [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [100%] 1 of 1 ✔ [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (134) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [100%] 1 of 1 ✔ [2b/db5560] process > librarySearchData (32) [ 41%] 26 of 63 [- ] process > librarymergeResults - [f2/c0b880] process > summaryLibrary (42) [100%] 63 of 63 ✔ [- ] process > librarygetGNPSAnnotations - [79/20da13] process > networkingGNPSPrepParams (1) [100%] 1 of 1 ✔ [14/4c683d] process > calculatePairs (1) [100%] 1 of 1 ✔ [08/2d922e] process > filterNetwork (1) [100%] 1 of 1 ✔ [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [100%] 1 of 1 ✔ [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (134) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [100%] 1 of 1 ✔ [12/835ef5] process > librarySearchData (38) [ 42%] 27 of 63 [- ] process > librarymergeResults - [f2/c0b880] process > summaryLibrary (42) [100%] 63 of 63 ✔ [- ] process > librarygetGNPSAnnotations - [79/20da13] process > networkingGNPSPrepParams (1) [100%] 1 of 1 ✔ [14/4c683d] process > calculatePairs (1) [100%] 1 of 1 ✔ [08/2d922e] process > filterNetwork (1) [100%] 1 of 1 ✔ [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [100%] 1 of 1 ✔ [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (134) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [100%] 1 of 1 ✔ [b7/34b7ed] process > librarySearchData (26) [ 44%] 28 of 63 [- ] process > librarymergeResults - [f2/c0b880] process > summaryLibrary (42) [100%] 63 of 63 ✔ [- ] process > librarygetGNPSAnnotations - [79/20da13] process > networkingGNPSPrepParams (1) [100%] 1 of 1 ✔ [14/4c683d] process > calculatePairs (1) [100%] 1 of 1 ✔ [08/2d922e] process > filterNetwork (1) [100%] 1 of 1 ✔ [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [100%] 1 of 1 ✔ [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (134) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [100%] 1 of 1 ✔ [e0/2a9b8f] process > librarySearchData (15) [ 46%] 29 of 63 [- ] process > librarymergeResults - [f2/c0b880] process > summaryLibrary (42) [100%] 63 of 63 ✔ [- ] process > librarygetGNPSAnnotations - [79/20da13] process > networkingGNPSPrepParams (1) [100%] 1 of 1 ✔ [14/4c683d] process > calculatePairs (1) [100%] 1 of 1 ✔ [08/2d922e] process > filterNetwork (1) [100%] 1 of 1 ✔ [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [100%] 1 of 1 ✔ [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (134) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [100%] 1 of 1 ✔ [ec/ac0c93] process > librarySearchData (31) [ 47%] 30 of 63 [- ] process > librarymergeResults - [f2/c0b880] process > summaryLibrary (42) [100%] 63 of 63 ✔ [- ] process > librarygetGNPSAnnotations - [79/20da13] process > networkingGNPSPrepParams (1) [100%] 1 of 1 ✔ [14/4c683d] process > calculatePairs (1) [100%] 1 of 1 ✔ [08/2d922e] process > filterNetwork (1) [100%] 1 of 1 ✔ [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [100%] 1 of 1 ✔ [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (134) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [100%] 1 of 1 ✔ [8f/6c94be] process > librarySearchData (45) [ 50%] 32 of 63 [- ] process > librarymergeResults - [f2/c0b880] process > summaryLibrary (42) [100%] 63 of 63 ✔ [- ] process > librarygetGNPSAnnotations - [79/20da13] process > networkingGNPSPrepParams (1) [100%] 1 of 1 ✔ [14/4c683d] process > calculatePairs (1) [100%] 1 of 1 ✔ [08/2d922e] process > filterNetwork (1) [100%] 1 of 1 ✔ [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [100%] 1 of 1 ✔ [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (134) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [100%] 1 of 1 ✔ [b9/295b7e] process > librarySearchData (46) [ 52%] 33 of 63 [- ] process > librarymergeResults - [f2/c0b880] process > summaryLibrary (42) [100%] 63 of 63 ✔ [- ] process > librarygetGNPSAnnotations - [79/20da13] process > networkingGNPSPrepParams (1) [100%] 1 of 1 ✔ [14/4c683d] process > calculatePairs (1) [100%] 1 of 1 ✔ [08/2d922e] process > filterNetwork (1) [100%] 1 of 1 ✔ [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [100%] 1 of 1 ✔ [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (134) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [100%] 1 of 1 ✔ [96/1ce9e7] process > librarySearchData (59) [ 53%] 34 of 63 [- ] process > librarymergeResults - [f2/c0b880] process > summaryLibrary (42) [100%] 63 of 63 ✔ [- ] process > librarygetGNPSAnnotations - [79/20da13] process > networkingGNPSPrepParams (1) [100%] 1 of 1 ✔ [14/4c683d] process > calculatePairs (1) [100%] 1 of 1 ✔ [08/2d922e] process > filterNetwork (1) [100%] 1 of 1 ✔ [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [100%] 1 of 1 ✔ [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (134) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [100%] 1 of 1 ✔ [aa/0670c8] process > librarySearchData (57) [ 55%] 35 of 63 [- ] process > librarymergeResults - [f2/c0b880] process > summaryLibrary (42) [100%] 63 of 63 ✔ [- ] process > librarygetGNPSAnnotations - [79/20da13] process > networkingGNPSPrepParams (1) [100%] 1 of 1 ✔ [14/4c683d] process > calculatePairs (1) [100%] 1 of 1 ✔ [08/2d922e] process > filterNetwork (1) [100%] 1 of 1 ✔ [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [100%] 1 of 1 ✔ [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (134) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [100%] 1 of 1 ✔ [68/dbda7a] process > librarySearchData (47) [ 57%] 36 of 63 [- ] process > librarymergeResults - [f2/c0b880] process > summaryLibrary (42) [100%] 63 of 63 ✔ [- ] process > librarygetGNPSAnnotations - [79/20da13] process > networkingGNPSPrepParams (1) [100%] 1 of 1 ✔ [14/4c683d] process > calculatePairs (1) [100%] 1 of 1 ✔ [08/2d922e] process > filterNetwork (1) [100%] 1 of 1 ✔ [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [100%] 1 of 1 ✔ [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (134) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [100%] 1 of 1 ✔ [6d/bd1ae8] process > librarySearchData (28) [ 58%] 37 of 63 [- ] process > librarymergeResults - [f2/c0b880] process > summaryLibrary (42) [100%] 63 of 63 ✔ [- ] process > librarygetGNPSAnnotations - [79/20da13] process > networkingGNPSPrepParams (1) [100%] 1 of 1 ✔ [14/4c683d] process > calculatePairs (1) [100%] 1 of 1 ✔ [08/2d922e] process > filterNetwork (1) [100%] 1 of 1 ✔ [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [100%] 1 of 1 ✔ [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (134) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [100%] 1 of 1 ✔ [3f/9a01ab] process > librarySearchData (20) [ 60%] 38 of 63 [- ] process > librarymergeResults - [f2/c0b880] process > summaryLibrary (42) [100%] 63 of 63 ✔ [- ] process > librarygetGNPSAnnotations - [79/20da13] process > networkingGNPSPrepParams (1) [100%] 1 of 1 ✔ [14/4c683d] process > calculatePairs (1) [100%] 1 of 1 ✔ [08/2d922e] process > filterNetwork (1) [100%] 1 of 1 ✔ [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [100%] 1 of 1 ✔ [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (134) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [100%] 1 of 1 ✔ [7c/ed3397] process > librarySearchData (17) [ 61%] 39 of 63 [- ] process > librarymergeResults - [f2/c0b880] process > summaryLibrary (42) [100%] 63 of 63 ✔ [- ] process > librarygetGNPSAnnotations - [79/20da13] process > networkingGNPSPrepParams (1) [100%] 1 of 1 ✔ [14/4c683d] process > calculatePairs (1) [100%] 1 of 1 ✔ [08/2d922e] process > filterNetwork (1) [100%] 1 of 1 ✔ [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [100%] 1 of 1 ✔ [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (134) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [100%] 1 of 1 ✔ [f9/1ecc47] process > librarySearchData (12) [ 63%] 40 of 63 [- ] process > librarymergeResults - [f2/c0b880] process > summaryLibrary (42) [100%] 63 of 63 ✔ [- ] process > librarygetGNPSAnnotations - [79/20da13] process > networkingGNPSPrepParams (1) [100%] 1 of 1 ✔ [14/4c683d] process > calculatePairs (1) [100%] 1 of 1 ✔ [08/2d922e] process > filterNetwork (1) [100%] 1 of 1 ✔ [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [100%] 1 of 1 ✔ [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (134) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [100%] 1 of 1 ✔ [a0/766bb8] process > librarySearchData (10) [ 65%] 41 of 63 [- ] process > librarymergeResults - [f2/c0b880] process > summaryLibrary (42) [100%] 63 of 63 ✔ [- ] process > librarygetGNPSAnnotations - [79/20da13] process > networkingGNPSPrepParams (1) [100%] 1 of 1 ✔ [14/4c683d] process > calculatePairs (1) [100%] 1 of 1 ✔ [08/2d922e] process > filterNetwork (1) [100%] 1 of 1 ✔ [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [100%] 1 of 1 ✔ [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (134) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [100%] 1 of 1 ✔ [39/3bdf7c] process > librarySearchData (55) [ 66%] 42 of 63 [- ] process > librarymergeResults - [f2/c0b880] process > summaryLibrary (42) [100%] 63 of 63 ✔ [- ] process > librarygetGNPSAnnotations - [79/20da13] process > networkingGNPSPrepParams (1) [100%] 1 of 1 ✔ [14/4c683d] process > calculatePairs (1) [100%] 1 of 1 ✔ [08/2d922e] process > filterNetwork (1) [100%] 1 of 1 ✔ [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [100%] 1 of 1 ✔ [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (134) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [100%] 1 of 1 ✔ [92/dd672e] process > librarySearchData (48) [ 68%] 43 of 63 [- ] process > librarymergeResults - [f2/c0b880] process > summaryLibrary (42) [100%] 63 of 63 ✔ [- ] process > librarygetGNPSAnnotations - [79/20da13] process > networkingGNPSPrepParams (1) [100%] 1 of 1 ✔ [14/4c683d] process > calculatePairs (1) [100%] 1 of 1 ✔ [08/2d922e] process > filterNetwork (1) [100%] 1 of 1 ✔ [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [100%] 1 of 1 ✔ [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (134) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [100%] 1 of 1 ✔ [f1/919bb8] process > librarySearchData (23) [ 69%] 44 of 63 [- ] process > librarymergeResults - [f2/c0b880] process > summaryLibrary (42) [100%] 63 of 63 ✔ [- ] process > librarygetGNPSAnnotations - [79/20da13] process > networkingGNPSPrepParams (1) [100%] 1 of 1 ✔ [14/4c683d] process > calculatePairs (1) [100%] 1 of 1 ✔ [08/2d922e] process > filterNetwork (1) [100%] 1 of 1 ✔ [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [100%] 1 of 1 ✔ [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (134) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [100%] 1 of 1 ✔ [62/6962a6] process > librarySearchData (30) [ 71%] 45 of 63 [- ] process > librarymergeResults - [f2/c0b880] process > summaryLibrary (42) [100%] 63 of 63 ✔ [- ] process > librarygetGNPSAnnotations - [79/20da13] process > networkingGNPSPrepParams (1) [100%] 1 of 1 ✔ [14/4c683d] process > calculatePairs (1) [100%] 1 of 1 ✔ [08/2d922e] process > filterNetwork (1) [100%] 1 of 1 ✔ [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [100%] 1 of 1 ✔ [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (134) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [100%] 1 of 1 ✔ [76/e0b95b] process > librarySearchData (5) [ 74%] 47 of 63 [- ] process > librarymergeResults - [f2/c0b880] process > summaryLibrary (42) [100%] 63 of 63 ✔ [- ] process > librarygetGNPSAnnotations - [79/20da13] process > networkingGNPSPrepParams (1) [100%] 1 of 1 ✔ [14/4c683d] process > calculatePairs (1) [100%] 1 of 1 ✔ [08/2d922e] process > filterNetwork (1) [100%] 1 of 1 ✔ [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [100%] 1 of 1 ✔ [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (134) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [100%] 1 of 1 ✔ [af/412321] process > librarySearchData (29) [ 76%] 48 of 63 [- ] process > librarymergeResults - [f2/c0b880] process > summaryLibrary (42) [100%] 63 of 63 ✔ [- ] process > librarygetGNPSAnnotations - [79/20da13] process > networkingGNPSPrepParams (1) [100%] 1 of 1 ✔ [14/4c683d] process > calculatePairs (1) [100%] 1 of 1 ✔ [08/2d922e] process > filterNetwork (1) [100%] 1 of 1 ✔ [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [100%] 1 of 1 ✔ [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (134) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [100%] 1 of 1 ✔ [96/99bc03] process > librarySearchData (61) [ 77%] 49 of 63 [- ] process > librarymergeResults - [f2/c0b880] process > summaryLibrary (42) [100%] 63 of 63 ✔ [- ] process > librarygetGNPSAnnotations - [79/20da13] process > networkingGNPSPrepParams (1) [100%] 1 of 1 ✔ [14/4c683d] process > calculatePairs (1) [100%] 1 of 1 ✔ [08/2d922e] process > filterNetwork (1) [100%] 1 of 1 ✔ [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [100%] 1 of 1 ✔ [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (134) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [100%] 1 of 1 ✔ [f0/095fe4] process > librarySearchData (9) [ 79%] 50 of 63 [- ] process > librarymergeResults - [f2/c0b880] process > summaryLibrary (42) [100%] 63 of 63 ✔ [- ] process > librarygetGNPSAnnotations - [79/20da13] process > networkingGNPSPrepParams (1) [100%] 1 of 1 ✔ [14/4c683d] process > calculatePairs (1) [100%] 1 of 1 ✔ [08/2d922e] process > filterNetwork (1) [100%] 1 of 1 ✔ [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [100%] 1 of 1 ✔ [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (134) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [100%] 1 of 1 ✔ [77/d0be33] process > librarySearchData (39) [ 80%] 51 of 63 [- ] process > librarymergeResults - [f2/c0b880] process > summaryLibrary (42) [100%] 63 of 63 ✔ [- ] process > librarygetGNPSAnnotations - [79/20da13] process > networkingGNPSPrepParams (1) [100%] 1 of 1 ✔ [14/4c683d] process > calculatePairs (1) [100%] 1 of 1 ✔ [08/2d922e] process > filterNetwork (1) [100%] 1 of 1 ✔ [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [100%] 1 of 1 ✔ [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (134) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [100%] 1 of 1 ✔ [dc/1f3bb0] process > librarySearchData (35) [ 82%] 52 of 63 [- ] process > librarymergeResults - [f2/c0b880] process > summaryLibrary (42) [100%] 63 of 63 ✔ [- ] process > librarygetGNPSAnnotations - [79/20da13] process > networkingGNPSPrepParams (1) [100%] 1 of 1 ✔ [14/4c683d] process > calculatePairs (1) [100%] 1 of 1 ✔ [08/2d922e] process > filterNetwork (1) [100%] 1 of 1 ✔ [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [100%] 1 of 1 ✔ [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (134) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [100%] 1 of 1 ✔ [3e/5532bc] process > librarySearchData (56) [ 84%] 53 of 63 [- ] process > librarymergeResults - [f2/c0b880] process > summaryLibrary (42) [100%] 63 of 63 ✔ [- ] process > librarygetGNPSAnnotations - [79/20da13] process > networkingGNPSPrepParams (1) [100%] 1 of 1 ✔ [14/4c683d] process > calculatePairs (1) [100%] 1 of 1 ✔ [08/2d922e] process > filterNetwork (1) [100%] 1 of 1 ✔ [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [100%] 1 of 1 ✔ [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (134) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [100%] 1 of 1 ✔ [ea/f64516] process > librarySearchData (54) [ 85%] 54 of 63 [- ] process > librarymergeResults - [f2/c0b880] process > summaryLibrary (42) [100%] 63 of 63 ✔ [- ] process > librarygetGNPSAnnotations - [79/20da13] process > networkingGNPSPrepParams (1) [100%] 1 of 1 ✔ [14/4c683d] process > calculatePairs (1) [100%] 1 of 1 ✔ [08/2d922e] process > filterNetwork (1) [100%] 1 of 1 ✔ [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [100%] 1 of 1 ✔ [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (134) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [100%] 1 of 1 ✔ [6b/f2e986] process > librarySearchData (13) [ 87%] 55 of 63 [- ] process > librarymergeResults - [f2/c0b880] process > summaryLibrary (42) [100%] 63 of 63 ✔ [- ] process > librarygetGNPSAnnotations - [79/20da13] process > networkingGNPSPrepParams (1) [100%] 1 of 1 ✔ [14/4c683d] process > calculatePairs (1) [100%] 1 of 1 ✔ [08/2d922e] process > filterNetwork (1) [100%] 1 of 1 ✔ [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [100%] 1 of 1 ✔ [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (134) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [100%] 1 of 1 ✔ [e0/94a4a4] process > librarySearchData (43) [ 88%] 56 of 63 [- ] process > librarymergeResults - [f2/c0b880] process > summaryLibrary (42) [100%] 63 of 63 ✔ [- ] process > librarygetGNPSAnnotations - [79/20da13] process > networkingGNPSPrepParams (1) [100%] 1 of 1 ✔ [14/4c683d] process > calculatePairs (1) [100%] 1 of 1 ✔ [08/2d922e] process > filterNetwork (1) [100%] 1 of 1 ✔ [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [100%] 1 of 1 ✔ [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (134) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [100%] 1 of 1 ✔ [8a/6e6479] process > librarySearchData (50) [ 90%] 57 of 63 [- ] process > librarymergeResults - [f2/c0b880] process > summaryLibrary (42) [100%] 63 of 63 ✔ [- ] process > librarygetGNPSAnnotations - [79/20da13] process > networkingGNPSPrepParams (1) [100%] 1 of 1 ✔ [14/4c683d] process > calculatePairs (1) [100%] 1 of 1 ✔ [08/2d922e] process > filterNetwork (1) [100%] 1 of 1 ✔ [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [100%] 1 of 1 ✔ [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (134) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [100%] 1 of 1 ✔ [6b/b36d78] process > librarySearchData (27) [ 92%] 58 of 63 [- ] process > librarymergeResults - [f2/c0b880] process > summaryLibrary (42) [100%] 63 of 63 ✔ [- ] process > librarygetGNPSAnnotations - [79/20da13] process > networkingGNPSPrepParams (1) [100%] 1 of 1 ✔ [14/4c683d] process > calculatePairs (1) [100%] 1 of 1 ✔ [08/2d922e] process > filterNetwork (1) [100%] 1 of 1 ✔ [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [100%] 1 of 1 ✔ [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (134) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [100%] 1 of 1 ✔ [1a/3d4fd0] process > librarySearchData (18) [ 93%] 59 of 63 [- ] process > librarymergeResults - [f2/c0b880] process > summaryLibrary (42) [100%] 63 of 63 ✔ [- ] process > librarygetGNPSAnnotations - [79/20da13] process > networkingGNPSPrepParams (1) [100%] 1 of 1 ✔ [14/4c683d] process > calculatePairs (1) [100%] 1 of 1 ✔ [08/2d922e] process > filterNetwork (1) [100%] 1 of 1 ✔ [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [100%] 1 of 1 ✔ [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (134) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [100%] 1 of 1 ✔ [b1/2d5a18] process > librarySearchData (36) [ 95%] 60 of 63 [- ] process > librarymergeResults - [f2/c0b880] process > summaryLibrary (42) [100%] 63 of 63 ✔ [- ] process > librarygetGNPSAnnotations - [79/20da13] process > networkingGNPSPrepParams (1) [100%] 1 of 1 ✔ [14/4c683d] process > calculatePairs (1) [100%] 1 of 1 ✔ [08/2d922e] process > filterNetwork (1) [100%] 1 of 1 ✔ [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [100%] 1 of 1 ✔ [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (134) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [100%] 1 of 1 ✔ [ce/9b3d6d] process > librarySearchData (42) [ 96%] 61 of 63 [- ] process > librarymergeResults - [f2/c0b880] process > summaryLibrary (42) [100%] 63 of 63 ✔ [- ] process > librarygetGNPSAnnotations - [79/20da13] process > networkingGNPSPrepParams (1) [100%] 1 of 1 ✔ [14/4c683d] process > calculatePairs (1) [100%] 1 of 1 ✔ [08/2d922e] process > filterNetwork (1) [100%] 1 of 1 ✔ [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [100%] 1 of 1 ✔ [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (134) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [100%] 1 of 1 ✔ [23/c2a7b8] process > librarySearchData (49) [ 98%] 62 of 63 [- ] process > librarymergeResults - [f2/c0b880] process > summaryLibrary (42) [100%] 63 of 63 ✔ [- ] process > librarygetGNPSAnnotations - [79/20da13] process > networkingGNPSPrepParams (1) [100%] 1 of 1 ✔ [14/4c683d] process > calculatePairs (1) [100%] 1 of 1 ✔ [08/2d922e] process > filterNetwork (1) [100%] 1 of 1 ✔ [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [100%] 1 of 1 ✔ [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (134) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [100%] 1 of 1 ✔ [9c/0458f5] process > librarySearchData (4) [100%] 63 of 63 ✔ [- ] process > librarymergeResults - [f2/c0b880] process > summaryLibrary (42) [100%] 63 of 63 ✔ [- ] process > librarygetGNPSAnnotations - [79/20da13] process > networkingGNPSPrepParams (1) [100%] 1 of 1 ✔ [14/4c683d] process > calculatePairs (1) [100%] 1 of 1 ✔ [08/2d922e] process > filterNetwork (1) [100%] 1 of 1 ✔ [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [100%] 1 of 1 ✔ [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (135) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [100%] 1 of 1 ✔ [9c/0458f5] process > librarySearchData (4) [100%] 63 of 63 ✔ [48/0cd797] process > librarymergeResults [ 0%] 0 of 1 [f2/c0b880] process > summaryLibrary (42) [100%] 63 of 63 ✔ [- ] process > librarygetGNPSAnnotations - [79/20da13] process > networkingGNPSPrepParams (1) [100%] 1 of 1 ✔ [14/4c683d] process > calculatePairs (1) [100%] 1 of 1 ✔ [08/2d922e] process > filterNetwork (1) [100%] 1 of 1 ✔ [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [100%] 1 of 1 ✔ [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (136) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [100%] 1 of 1 ✔ [9c/0458f5] process > librarySearchData (4) [100%] 63 of 63 ✔ [48/0cd797] process > librarymergeResults [100%] 1 of 1 ✔ [f2/c0b880] process > summaryLibrary (42) [100%] 63 of 63 ✔ [ca/45dc77] process > librarygetGNPSAnnotations (1) [ 0%] 0 of 1 [79/20da13] process > networkingGNPSPrepParams (1) [100%] 1 of 1 ✔ [14/4c683d] process > calculatePairs (1) [100%] 1 of 1 ✔ [08/2d922e] process > filterNetwork (1) [100%] 1 of 1 ✔ [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [100%] 1 of 1 ✔ [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (136) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [100%] 1 of 1 ✔ [9c/0458f5] process > librarySearchData (4) [100%] 63 of 63 ✔ [48/0cd797] process > librarymergeResults [100%] 1 of 1 ✔ [f2/c0b880] process > summaryLibrary (42) [100%] 63 of 63 ✔ [ca/45dc77] process > librarygetGNPSAnnotations (1) [ 0%] 0 of 1 [79/20da13] process > networkingGNPSPrepParams (1) [100%] 1 of 1 ✔ [14/4c683d] process > calculatePairs (1) [100%] 1 of 1 ✔ [08/2d922e] process > filterNetwork (1) [100%] 1 of 1 ✔ [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [100%] 1 of 1 ✔ [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (136) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [100%] 1 of 1 ✔ [9c/0458f5] process > librarySearchData (4) [100%] 63 of 63 ✔ [48/0cd797] process > librarymergeResults [100%] 1 of 1 ✔ [f2/c0b880] process > summaryLibrary (42) [100%] 63 of 63 ✔ [ca/45dc77] process > librarygetGNPSAnnotations (1) [100%] 1 of 1 ✔ [79/20da13] process > networkingGNPSPrepParams (1) [100%] 1 of 1 ✔ [14/4c683d] process > calculatePairs (1) [100%] 1 of 1 ✔ [08/2d922e] process > filterNetwork (1) [100%] 1 of 1 ✔ [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [100%] 1 of 1 ✔ [- ] process > enrichClusterSummary - [- ] process > createNetworkGraphML - executor > local (137) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [100%] 1 of 1 ✔ [9c/0458f5] process > librarySearchData (4) [100%] 63 of 63 ✔ [48/0cd797] process > librarymergeResults [100%] 1 of 1 ✔ [f2/c0b880] process > summaryLibrary (42) [100%] 63 of 63 ✔ [ca/45dc77] process > librarygetGNPSAnnotations (1) [100%] 1 of 1 ✔ [79/20da13] process > networkingGNPSPrepParams (1) [100%] 1 of 1 ✔ [14/4c683d] process > calculatePairs (1) [100%] 1 of 1 ✔ [08/2d922e] process > filterNetwork (1) [100%] 1 of 1 ✔ [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [100%] 1 of 1 ✔ [26/8fd756] process > enrichClusterSummary (1) [ 0%] 0 of 1 [- ] process > createNetworkGraphML - executor > local (137) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [100%] 1 of 1 ✔ [9c/0458f5] process > librarySearchData (4) [100%] 63 of 63 ✔ [48/0cd797] process > librarymergeResults [100%] 1 of 1 ✔ [f2/c0b880] process > summaryLibrary (42) [100%] 63 of 63 ✔ [ca/45dc77] process > librarygetGNPSAnnotations (1) [100%] 1 of 1 ✔ [79/20da13] process > networkingGNPSPrepParams (1) [100%] 1 of 1 ✔ [14/4c683d] process > calculatePairs (1) [100%] 1 of 1 ✔ [08/2d922e] process > filterNetwork (1) [100%] 1 of 1 ✔ [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [100%] 1 of 1 ✔ [26/8fd756] process > enrichClusterSummary (1) [100%] 1 of 1 ✔ [- ] process > createNetworkGraphML [ 0%] 0 of 1 executor > local (138) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [100%] 1 of 1 ✔ [9c/0458f5] process > librarySearchData (4) [100%] 63 of 63 ✔ [48/0cd797] process > librarymergeResults [100%] 1 of 1 ✔ [f2/c0b880] process > summaryLibrary (42) [100%] 63 of 63 ✔ [ca/45dc77] process > librarygetGNPSAnnotations (1) [100%] 1 of 1 ✔ [79/20da13] process > networkingGNPSPrepParams (1) [100%] 1 of 1 ✔ [14/4c683d] process > calculatePairs (1) [100%] 1 of 1 ✔ [08/2d922e] process > filterNetwork (1) [100%] 1 of 1 ✔ [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [100%] 1 of 1 ✔ [26/8fd756] process > enrichClusterSummary (1) [100%] 1 of 1 ✔ [76/ed06fc] process > createNetworkGraphML (1) [ 0%] 0 of 1 executor > local (138) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [100%] 1 of 1 ✔ [9c/0458f5] process > librarySearchData (4) [100%] 63 of 63 ✔ [48/0cd797] process > librarymergeResults [100%] 1 of 1 ✔ [f2/c0b880] process > summaryLibrary (42) [100%] 63 of 63 ✔ [ca/45dc77] process > librarygetGNPSAnnotations (1) [100%] 1 of 1 ✔ [79/20da13] process > networkingGNPSPrepParams (1) [100%] 1 of 1 ✔ [14/4c683d] process > calculatePairs (1) [100%] 1 of 1 ✔ [08/2d922e] process > filterNetwork (1) [100%] 1 of 1 ✔ [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [100%] 1 of 1 ✔ [26/8fd756] process > enrichClusterSummary (1) [100%] 1 of 1 ✔ [76/ed06fc] process > createNetworkGraphML (1) [100%] 1 of 1 ✔ executor > local (138) [a7/f05d29] process > filesummary (1) [100%] 1 of 1 ✔ [94/bdd992] process > quantification_table_reform... [100%] 1 of 1 ✔ [42/c40ee1] process > filter_spectra (1) [100%] 1 of 1 ✔ [9c/0458f5] process > librarySearchData (4) [100%] 63 of 63 ✔ [48/0cd797] process > librarymergeResults [100%] 1 of 1 ✔ [f2/c0b880] process > summaryLibrary (42) [100%] 63 of 63 ✔ [ca/45dc77] process > librarygetGNPSAnnotations (1) [100%] 1 of 1 ✔ [79/20da13] process > networkingGNPSPrepParams (1) [100%] 1 of 1 ✔ [14/4c683d] process > calculatePairs (1) [100%] 1 of 1 ✔ [08/2d922e] process > filterNetwork (1) [100%] 1 of 1 ✔ [9e/36d152] process > createMetadataFile [100%] 1 of 1 ✔ [72/e01090] process > calculateGroupings (1) [100%] 1 of 1 ✔ [26/8fd756] process > enrichClusterSummary (1) [100%] 1 of 1 ✔ [76/ed06fc] process > createNetworkGraphML (1) [100%] 1 of 1 ✔ Completed at: 31-Aug-2024 11:05:36 Duration : 20m 28s CPU hours : 1.6 Succeeded : 138 nf_cmd.sh0000644000000000000000000000120114664572124011343 0ustar rootrootnextflow run /app/workflows_user/feature_based_molecular_networking_workflow/nf_workflow.nf -params-file /data/nf_data/server/nf_tasks/43853471d153488b95144abd3af36a9d/job_parameters.yaml -w /data/nf_data/server/nf_work/43853471d153488b95144abd3af36a9d -with-report /data/nf_data/server/nf_tasks/43853471d153488b95144abd3af36a9d/job_report.html -with-timeline /data/nf_data/server/nf_tasks/43853471d153488b95144abd3af36a9d/job_timeline.html -with-dag /data/nf_data/server/nf_tasks/43853471d153488b95144abd3af36a9d/job_dag.html -with-weblog http://localhost:4000/nf_weblog/43853471d153488b95144abd3af36a9d -c /app/launchserver/nextflow.confignf_output/0000755000000000000000000000000014664574437011623 5ustar rootrootnf_output/PHENOLICSDB.mgf.tsv0000644000000000000000000000000114664572140014637 0ustar rootroot nf_output/MMV_POSITIVE.mgf.tsv0000644000000000000000000000000114664572140015066 0ustar rootroot nf_output/UM-NPDC.mgf.tsv0000644000000000000000000000000114664572140014150 0ustar rootroot nf_output/MONA.mgf.tsv0000644000000000000000000000000114664572155013645 0ustar rootroot nf_output/BIRMINGHAM-UHPLC-MS-POS.mgf.tsv0000644000000000000000000000000114664572140016347 0ustar rootroot nf_output/GNPS-COLLECTIONS-PESTICIDES-POSITIVE.mgf.tsv0000644000000000000000000000000114664572140020322 0ustar rootroot nf_output/MSNLIB-NEGATIVE.mgf.tsv0000644000000000000000000000000114664572141015272 0ustar rootroot nf_output/temp_pairs/0000755000000000000000000000000014664572154013760 5ustar rootrootnf_output/temp_pairs/0.params_aligns.tsv0000644000000000000000000046626614664572154017520 0ustar rootrootCLUSTERID1 CLUSTERID2 DeltaMZ MinRatio Cosine AlignScore2 AlignScore3 1 2 -27.995 0.000 0.8386 0.5727 1 2 28 8.008 0.000 0.8116 0.4964 1 3 6 -23.016 0.000 0.8118 0.6268 1 4 5 23.016 0.000 0.7623 0.6359 1 4 6 -27.995 0.000 0.7195 0.5851 1 8 9 41.026 0.000 0.7406 0.6252 1 8 15 -5.005 0.000 0.8295 0.5616 1 8 19 18.011 0.000 0.8251 0.5813 1 8 26 -77.960 0.000 0.7414 0.4546 1 9 13 -1.998 0.000 0.9057 0.6814 1 9 15 -46.032 0.000 0.8941 0.7262 1 9 17 -5.005 0.000 0.8215 0.5606 1 9 19 -23.016 0.000 0.9597 0.7944 1 9 21 -67.975 0.000 0.7205 0.5525 1 9 175 -92.083 0.000 0.7973 0.4396 1 9 177 -76.088 0.000 0.7850 0.5360 1 9 220 16.934 0.000 0.7466 0.5389 1 13 14 -23.016 0.000 0.8781 0.6904 1 13 175 -90.085 0.000 0.7455 0.4363 1 13 177 -74.090 0.000 0.7863 0.5242 1 14 19 1.998 0.000 0.9590 0.7541 1 15 17 41.027 0.000 0.7125 0.5583 1 15 19 23.016 0.000 0.9657 0.8474 1 15 26 -72.954 0.000 0.7800 0.4342 1 17 18 -1.001 0.000 0.8193 0.4927 1 17 19 -18.010 0.000 0.7899 0.5909 1 19 26 -95.970 0.000 0.7013 0.4193 1 21 22 -95.970 0.000 0.7535 0.5191 1 21 23 -113.981 0.000 0.7101 0.4628 1 21 25 -1.001 0.000 0.8249 0.4917 1 22 23 -18.011 0.000 0.8424 0.5117 1 27 28 -23.016 0.000 0.8177 0.5257 1 40 51 -18.935 0.000 0.9143 0.7550 1 40 90 -70.006 0.000 0.7711 0.3689 1 42 44 197.090 0.000 0.7639 0.4837 1 42 45 179.080 0.000 0.8759 0.6407 1 42 49 162.053 0.000 0.9630 0.8191 1 42 52 341.133 0.000 0.7557 0.5734 1 42 53 359.143 0.000 0.7045 0.4809 1 42 59 324.106 0.000 0.8172 0.6685 1 42 226 337.111 0.000 0.7628 0.6087 1 44 45 -18.010 0.000 0.8051 0.5220 1 44 49 -35.037 0.000 0.8149 0.5215 1 44 52 144.042 0.000 0.7649 0.4980 1 44 53 162.053 0.000 0.7501 0.4534 1 44 59 127.016 0.000 0.7455 0.5902 1 44 226 140.021 0.000 0.7397 0.4985 1 45 49 -17.027 0.000 0.9128 0.6529 1 45 52 162.053 0.000 0.8366 0.5629 1 45 53 180.063 0.000 0.8061 0.4447 1 45 59 145.026 0.000 0.7812 0.5672 1 45 117 173.042 0.000 0.7375 0.4912 1 45 226 158.032 0.000 0.8090 0.5848 1 46 615 -262.230 0.000 0.8378 0.7404 1 46 639 -238.230 0.000 0.8175 0.6229 1 47 60 162.053 0.000 0.7152 0.6242 1 49 52 179.080 0.000 0.8343 0.6167 1 49 53 197.090 0.000 0.7999 0.5227 1 49 59 162.053 0.000 0.8629 0.7018 1 49 116 204.048 0.000 0.7074 0.5437 1 49 117 190.069 0.000 0.7483 0.5743 1 49 226 175.058 0.000 0.8304 0.6868 1 51 90 -51.071 0.000 0.7554 0.3723 1 52 53 18.010 0.000 0.9069 0.5617 1 52 59 -17.026 0.000 0.8893 0.6825 1 52 116 24.969 0.000 0.7685 0.4902 1 52 117 10.989 0.000 0.8248 0.5877 1 52 131 24.969 0.000 0.7320 0.4740 1 52 226 -4.021 0.000 0.9013 0.6356 1 52 300 -45.037 0.000 0.7473 0.5667 1 53 59 -35.037 0.000 0.8468 0.5883 1 53 116 6.958 0.000 0.7514 0.5213 1 53 117 -7.021 0.000 0.8081 0.5419 1 53 131 6.958 0.000 0.7182 0.5017 1 53 226 -22.032 0.000 0.8727 0.5275 1 53 300 -63.047 0.000 0.7067 0.4881 1 56 57 47.984 0.000 0.7492 0.6001 1 57 58 -18.011 0.000 0.8709 0.7772 1 59 116 41.995 0.000 0.7938 0.6257 1 59 117 28.016 0.000 0.8135 0.6370 1 59 131 41.995 0.000 0.7624 0.6273 1 59 151 -90.047 0.000 0.7047 0.6934 1 59 226 13.005 0.000 0.8831 0.6523 1 59 300 -28.010 0.000 0.7892 0.6170 1 59 335 -172.053 0.000 0.7165 0.5501 1 64 217 -100.068 0.000 0.9117 0.4997 1 68 70 71.985 0.000 0.8725 0.6906 1 74 76 -15.995 0.000 0.8426 0.5089 1 74 81 -15.995 0.000 0.7431 0.4718 1 74 109 15.995 0.000 0.8599 0.3601 1 76 81 0.000 0.000 0.7781 0.4451 1 76 82 -41.974 0.000 0.8280 0.4064 1 76 101 15.995 0.000 0.8197 0.5172 1 76 110 15.995 0.000 0.8047 0.4669 1 77 78 71.985 0.000 0.7618 0.5966 1 79 221 -120.021 0.000 0.7084 0.5513 1 81 82 -41.974 0.000 0.7046 0.3343 1 82 101 57.969 0.000 0.8045 0.4724 1 82 110 57.969 0.000 0.7995 0.4174 1 82 155 68.011 0.000 0.7050 0.5718 1 84 155 13.032 0.000 0.7142 0.4292 1 88 99 46.006 0.000 0.7750 0.5512 1 88 106 46.006 0.000 0.7445 0.4023 1 93 98 43.990 0.000 0.8686 0.6638 1 93 102 194.991 0.000 0.7337 0.6344 1 94 108 -0.000 0.000 0.9484 0.7227 1 94 111 -14.016 0.000 0.9461 0.5992 1 94 123 162.053 0.000 0.8025 0.6469 1 94 129 15.995 0.000 0.8800 0.6566 1 94 153 162.053 0.000 0.7479 0.5731 1 94 183 -14.016 0.000 0.9012 0.7566 1 95 105 -0.000 0.000 0.9828 0.7919 1 98 102 151.001 0.000 0.7559 0.7333 1 99 106 -0.000 0.000 0.9330 0.4853 1 99 220 34.042 0.000 0.7062 0.4088 1 101 109 15.995 0.000 0.9249 0.6882 1 101 110 -0.000 0.000 0.9673 0.6906 1 102 104 -92.959 0.000 0.7731 0.7106 1 106 220 34.042 0.000 0.7123 0.3421 1 108 111 -14.016 0.000 0.9320 0.5411 1 108 123 162.053 0.000 0.7624 0.5168 1 108 129 15.995 0.000 0.8833 0.6965 1 108 183 -14.015 0.000 0.8662 0.6711 1 109 110 -15.995 0.000 0.9268 0.6272 1 109 198 10.042 0.000 0.7242 0.4355 1 111 139 15.995 0.000 0.8316 0.5683 1 111 161 162.053 0.000 0.7942 0.5456 1 111 183 0.000 0.000 0.8915 0.6141 1 111 186 162.053 0.000 0.7754 0.5197 1 111 243 162.053 0.000 0.7280 0.4486 1 112 197 79.957 0.000 0.8376 0.6044 1 113 147 0.000 0.000 0.9282 0.4906 1 113 148 -356.074 0.000 0.8116 0.4925 1 114 128 81.891 0.000 0.8598 0.3449 1 114 142 46.005 0.000 0.7636 0.6015 1 114 143 36.990 0.000 0.8017 0.3449 1 114 144 0.000 0.000 0.9547 0.7242 1 114 145 -301.074 0.000 0.7941 0.3652 1 114 146 116.928 0.000 0.8604 0.3794 1 114 149 -310.069 0.000 0.8504 0.5693 1 114 150 98.917 0.000 0.8380 0.3636 1 116 117 -13.979 0.000 0.7593 0.5255 1 116 131 0.000 0.000 0.9738 0.8457 1 116 226 -28.990 0.000 0.7941 0.4907 1 117 131 13.979 0.000 0.7347 0.5209 1 117 226 -15.010 0.000 0.8681 0.6268 1 117 300 -56.026 0.000 0.7231 0.5996 1 119 122 17.027 0.000 0.8543 0.6306 1 123 124 -1.003 0.000 0.8921 0.7508 1 123 125 2.015 0.000 0.7472 0.4295 1 123 126 -30.010 0.000 0.8746 0.6262 1 123 129 -146.058 0.000 0.7219 0.4535 1 123 134 -30.011 0.000 0.8854 0.7318 1 123 153 0.000 0.000 0.9194 0.8861 1 123 154 2.016 0.000 0.7590 0.3713 1 123 158 -25.980 0.000 0.7679 0.3484 1 123 161 -14.016 0.000 0.9784 0.8581 1 123 162 -17.024 0.000 0.7332 0.4712 1 123 163 -30.010 0.000 0.8646 0.6286 1 123 186 -14.016 0.000 0.9702 0.8307 1 123 191 -44.026 0.000 0.8136 0.6201 1 123 219 -44.026 0.000 0.8038 0.6893 1 123 227 -28.031 0.000 0.9234 0.7372 1 123 242 -44.026 0.000 0.8737 0.6311 1 123 243 -14.016 0.000 0.8836 0.7779 1 124 126 -29.008 0.000 0.8122 0.5608 1 124 134 -29.008 0.000 0.7921 0.7453 1 124 153 1.003 0.000 0.8206 0.7637 1 124 159 -25.981 0.000 0.7474 0.3229 1 124 161 -13.013 0.000 0.8681 0.7814 1 124 162 -16.021 0.000 0.8960 0.6701 1 124 163 -29.008 0.000 0.8024 0.5932 1 124 186 -13.013 0.000 0.8533 0.7775 1 124 191 -43.023 0.000 0.7127 0.4623 1 124 219 -43.023 0.000 0.7196 0.6867 1 124 227 -27.029 0.000 0.8270 0.7357 1 124 242 -43.023 0.000 0.7638 0.4511 1 124 243 -13.013 0.000 0.7821 0.7282 1 125 126 -32.026 0.000 0.7056 0.3664 1 125 135 -30.011 0.000 0.7640 0.3435 1 125 154 0.000 0.000 0.8611 0.3686 1 125 158 -27.995 0.000 0.8381 0.3277 1 125 159 -28.999 0.000 0.7638 0.3110 1 125 161 -16.031 0.000 0.7267 0.3865 1 125 186 -16.031 0.000 0.7092 0.3626 1 126 134 -0.000 0.000 0.9221 0.6460 1 126 135 2.015 0.000 0.7598 0.4475 1 126 153 30.011 0.000 0.7924 0.5964 1 126 154 32.026 0.000 0.7545 0.3422 1 126 158 4.031 0.000 0.7688 0.3455 1 126 161 15.995 0.000 0.9148 0.6219 1 126 162 12.986 0.000 0.7123 0.4588 1 126 163 0.000 0.000 0.7838 0.5029 1 126 186 15.995 0.000 0.9062 0.6208 1 126 191 -14.016 0.000 0.8473 0.6103 1 126 219 -14.015 0.000 0.8963 0.6151 1 126 227 1.979 0.000 0.7666 0.5425 1 126 235 -14.016 0.000 0.7398 0.5769 1 126 242 -14.016 0.000 0.7206 0.4995 1 126 243 15.995 0.000 0.8085 0.5690 1 128 143 -44.901 0.000 0.9169 0.5156 1 128 144 -81.890 0.000 0.8448 0.3326 1 128 145 -382.964 0.000 0.8833 0.3683 1 128 146 35.037 0.000 0.9728 0.6628 1 128 150 17.027 0.000 0.9452 0.6607 1 129 139 -14.016 0.000 0.8756 0.5762 1 130 133 -14.016 0.000 0.9103 0.7146 1 130 153 -28.031 0.000 0.7488 0.6213 1 130 185 -14.016 0.000 0.9017 0.7712 1 130 190 0.000 0.000 0.9628 0.8726 1 130 196 -28.031 0.000 0.7217 0.5856 1 130 201 3.011 0.000 0.7677 0.5214 1 130 202 -14.016 0.000 0.9464 0.7965 1 130 204 -28.031 0.000 0.7360 0.6055 1 130 254 -28.031 0.000 0.8408 0.6189 1 130 266 -28.031 0.000 0.7601 0.5985 1 130 270 -14.016 0.000 0.9283 0.7157 1 131 226 -28.990 0.000 0.7607 0.4753 1 133 153 -14.016 0.000 0.8383 0.6672 1 133 185 0.000 0.000 0.9274 0.7469 1 133 190 14.016 0.000 0.9126 0.7290 1 133 196 -14.016 0.000 0.9101 0.6153 1 133 202 0.000 0.000 0.7030 0.5944 1 133 204 -14.016 0.000 0.9173 0.6607 1 133 243 -28.031 0.000 0.7106 0.5400 1 133 266 -14.016 0.000 0.9040 0.6086 1 133 270 0.000 0.000 0.7110 0.5279 1 134 135 2.015 0.000 0.7092 0.3846 1 134 153 30.011 0.000 0.8402 0.7749 1 134 158 4.031 0.000 0.7149 0.3052 1 134 161 15.995 0.000 0.9561 0.8629 1 134 163 0.000 0.000 0.7297 0.5804 1 134 186 15.995 0.000 0.9580 0.8618 1 134 191 -14.016 0.000 0.8700 0.5921 1 134 219 -14.015 0.000 0.9688 0.8797 1 134 227 1.979 0.000 0.7493 0.7282 1 134 235 -14.015 0.000 0.8201 0.6867 1 134 243 15.995 0.000 0.8931 0.8126 1 135 154 30.011 0.000 0.8616 0.4126 1 135 158 2.016 0.000 0.8538 0.4328 1 135 159 1.012 0.000 0.7952 0.4659 1 135 161 13.980 0.000 0.7158 0.3805 1 135 229 -14.015 0.000 0.8646 0.5971 1 136 140 0.000 0.000 0.9541 0.6750 1 138 189 0.000 0.000 0.9065 0.6258 1 138 194 -30.010 0.000 0.8863 0.5800 1 139 161 146.058 0.000 0.7086 0.5226 1 139 183 -15.995 0.000 0.8017 0.5959 1 142 144 -46.005 0.000 0.7702 0.6206 1 143 144 -36.990 0.000 0.7898 0.3326 1 143 145 -338.064 0.000 0.8715 0.4497 1 143 146 79.938 0.000 0.9079 0.5071 1 143 150 61.928 0.000 0.8900 0.5166 1 144 145 -301.074 0.000 0.7724 0.3450 1 144 146 116.928 0.000 0.8463 0.3674 1 144 149 -310.069 0.000 0.8477 0.5693 1 144 150 98.917 0.000 0.8259 0.3605 1 145 146 418.002 0.000 0.8765 0.3888 1 145 150 399.991 0.000 0.8563 0.3783 1 146 150 -18.010 0.000 0.9563 0.6500 1 147 148 -356.074 0.000 0.8281 0.5653 1 152 192 -14.016 0.000 0.8688 0.6262 1 152 239 -94.953 0.000 0.8665 0.6481 1 152 337 -48.984 0.000 0.8834 0.7484 1 152 339 -78.995 0.000 0.9655 0.7880 1 152 365 3.011 0.000 0.9156 0.6671 1 153 161 -14.016 0.000 0.9203 0.8604 1 153 163 -30.010 0.000 0.8132 0.6514 1 153 185 14.016 0.000 0.8279 0.7079 1 153 186 -14.016 0.000 0.9237 0.8361 1 153 190 28.032 0.000 0.7678 0.6201 1 153 191 -44.026 0.000 0.7497 0.5775 1 153 204 -0.000 0.000 0.7218 0.7206 1 153 219 -44.026 0.000 0.7503 0.7060 1 153 227 -28.031 0.000 0.8714 0.7521 1 153 235 -44.026 0.000 0.7285 0.6736 1 153 242 -44.026 0.000 0.8227 0.5600 1 153 243 -14.016 0.000 0.9733 0.8190 1 153 266 0.000 0.000 0.7015 0.7584 1 154 158 -27.995 0.000 0.9368 0.5783 1 154 159 -28.999 0.000 0.8491 0.3653 1 154 161 -16.031 0.000 0.7312 0.3347 1 154 186 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14.016 0.000 0.8883 0.8495 1 243 270 28.031 0.000 0.8049 0.7178 1 243 283 -2.016 0.000 0.7101 0.7008 1 244 245 -215.101 0.000 0.7950 0.6754 1 244 246 -18.011 0.000 0.8840 0.7284 1 244 327 -14.016 0.000 0.8441 0.7196 1 244 348 2.015 0.000 0.9000 0.7690 1 244 366 14.015 0.000 0.8225 0.7359 1 244 414 -0.000 0.000 0.9114 0.7742 1 244 520 -14.016 0.000 0.8114 0.7601 1 244 550 2.015 0.000 0.8674 0.6644 1 244 574 2.015 0.000 0.8703 0.6558 1 245 246 197.090 0.000 0.8641 0.7630 1 245 328 148.037 0.000 0.7004 0.5743 1 245 414 215.100 0.000 0.7115 0.5559 1 246 329 -14.016 0.000 0.8749 0.6640 1 246 414 18.010 0.000 0.8169 0.6235 1 246 552 2.016 0.000 0.7574 0.5259 1 249 250 132.042 0.000 0.8594 0.4345 1 249 258 -30.011 0.000 0.9375 0.6584 1 249 276 150.073 0.000 0.7850 0.3228 1 251 310 -28.031 0.000 0.7379 0.5894 1 253 273 0.000 0.000 0.9609 0.8502 1 254 270 14.016 0.000 0.8316 0.8065 1 256 257 -14.016 0.000 0.9530 0.8616 1 256 294 1.979 0.000 0.7919 0.6257 1 256 301 176.069 0.000 0.7363 0.6787 1 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0.000 0.7006 0.4001 1 293 392 71.165 0.000 0.7364 0.4602 1 293 398 124.016 0.000 0.8444 0.4363 1 293 400 169.074 0.000 0.7609 0.6138 1 293 423 63.157 0.000 0.7944 0.4353 1 293 424 144.130 0.000 0.7757 0.4766 1 293 427 143.130 0.000 0.7633 0.4782 1 293 430 -13.935 0.000 0.7555 0.4588 1 293 433 71.165 0.000 0.7359 0.4584 1 293 438 -200.964 0.000 0.7240 0.3987 1 293 439 -245.961 0.000 0.7352 0.3987 1 293 442 -253.969 0.000 0.7718 0.4541 1 293 444 -216.000 0.000 0.7406 0.4794 1 293 448 -15.434 0.000 0.7383 0.4120 1 293 452 171.090 0.000 0.7292 0.5469 1 293 453 -18.436 0.000 0.7703 0.4471 1 293 458 183.053 0.000 0.7912 0.5839 1 293 463 169.074 0.000 0.7567 0.6112 1 293 467 22.042 0.000 0.8307 0.5430 1 293 503 185.069 0.000 0.7328 0.5638 1 293 505 -191.095 0.000 0.8161 0.5019 1 293 511 171.090 0.000 0.7391 0.5244 1 293 534 171.090 0.000 0.7442 0.5318 1 293 561 -146.037 0.000 0.8402 0.4577 1 294 314 -197.156 0.000 0.7623 0.6331 1 294 315 146.058 0.000 0.7090 0.6193 1 294 317 28.979 0.000 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323 332 15.995 0.000 0.9724 0.7477 1 323 352 137.084 0.000 0.7969 0.5979 1 323 356 4.031 0.000 0.8159 0.5578 1 323 378 108.021 0.000 0.8420 0.6009 1 323 382 45.146 0.000 0.8200 0.4750 1 323 387 153.079 0.000 0.7772 0.5805 1 323 391 125.120 0.000 0.7025 0.4053 1 323 392 53.154 0.000 0.7506 0.4911 1 323 398 106.006 0.000 0.8397 0.4869 1 323 400 151.063 0.000 0.7957 0.5951 1 323 423 45.146 0.000 0.8096 0.4615 1 323 424 126.120 0.000 0.7907 0.5265 1 323 427 125.119 0.000 0.7731 0.5218 1 323 430 -31.945 0.000 0.7276 0.4523 1 323 433 53.154 0.000 0.7513 0.4859 1 323 439 -263.972 0.000 0.7073 0.3817 1 323 442 -271.980 0.000 0.7414 0.4815 1 323 444 -234.011 0.000 0.7615 0.5375 1 323 448 -33.444 0.000 0.7151 0.3838 1 323 452 153.079 0.000 0.7764 0.5898 1 323 453 -36.447 0.000 0.7310 0.4421 1 323 458 165.043 0.000 0.7943 0.5969 1 323 463 151.064 0.000 0.7864 0.5895 1 323 467 4.031 0.000 0.8391 0.6601 1 323 503 167.058 0.000 0.7623 0.5971 1 323 505 -209.105 0.000 0.7768 0.5331 1 323 511 153.079 0.000 0.7840 0.5733 1 323 534 153.079 0.000 0.7925 0.6102 1 323 561 -164.047 0.000 0.8014 0.4730 1 326 543 0.000 0.000 0.8968 0.7514 1 326 567 0.000 0.000 0.8022 0.5584 1 327 328 -53.048 0.000 0.8102 0.6581 1 327 329 -18.011 0.000 0.9336 0.8390 1 327 330 -81.079 0.000 0.7960 0.5293 1 327 348 16.031 0.000 0.8082 0.6808 1 327 362 14.016 0.000 0.7011 0.6545 1 327 414 14.016 0.000 0.8515 0.8327 1 327 520 0.000 0.000 0.9163 0.8707 1 327 550 16.031 0.000 0.8544 0.7742 1 327 574 16.031 0.000 0.8548 0.7632 1 328 329 35.037 0.000 0.9210 0.7911 1 328 330 -28.031 0.000 0.9462 0.7187 1 328 520 53.048 0.000 0.7429 0.6833 1 329 330 -63.068 0.000 0.8798 0.6115 1 329 520 18.011 0.000 0.8771 0.8600 1 329 552 16.032 0.000 0.7734 0.7105 1 330 520 81.079 0.000 0.7192 0.5662 1 331 744 0.000 0.000 0.8802 0.4379 1 332 344 -46.042 0.000 0.8770 0.6444 1 332 352 121.089 0.000 0.8115 0.6548 1 332 356 -11.964 0.000 0.8016 0.5557 1 332 378 92.027 0.000 0.8382 0.6629 1 332 382 29.152 0.000 0.7979 0.4395 1 332 387 137.084 0.000 0.8073 0.7314 1 332 392 37.159 0.000 0.7342 0.4657 1 332 398 90.011 0.000 0.8197 0.4626 1 332 400 135.068 0.000 0.8076 0.6449 1 332 423 29.151 0.000 0.7924 0.4363 1 332 424 110.125 0.000 0.7855 0.5268 1 332 427 109.124 0.000 0.7780 0.6023 1 332 430 -47.940 0.000 0.7073 0.4523 1 332 433 37.159 0.000 0.7387 0.4984 1 332 434 138.091 0.000 0.7026 0.5499 1 332 442 -287.975 0.000 0.7088 0.4368 1 332 444 -250.006 0.000 0.7578 0.5466 1 332 448 -49.439 0.000 0.7073 0.4297 1 332 452 137.084 0.000 0.8067 0.7534 1 332 453 -52.442 0.000 0.7170 0.4281 1 332 458 149.048 0.000 0.7985 0.6693 1 332 463 135.069 0.000 0.8150 0.7600 1 332 467 -11.963 0.000 0.8459 0.7518 1 332 503 151.064 0.000 0.7834 0.7188 1 332 505 -225.100 0.000 0.7508 0.5411 1 332 511 137.084 0.000 0.8127 0.7364 1 332 534 137.084 0.000 0.8064 0.6657 1 332 561 -180.042 0.000 0.7690 0.4409 1 333 334 -17.027 0.000 0.8846 0.7411 1 333 549 -70.006 0.000 0.7472 0.5382 1 333 573 -70.006 0.000 0.7475 0.5196 1 333 605 -59.001 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344 458 195.090 0.000 0.7454 0.5315 1 344 463 181.110 0.000 0.7057 0.5553 1 344 467 34.078 0.000 0.7810 0.4716 1 344 503 197.105 0.000 0.7014 0.5960 1 344 505 -179.058 0.000 0.7902 0.4950 1 344 561 -134.001 0.000 0.7964 0.4076 1 346 347 18.010 0.000 0.7891 0.5471 1 346 603 15.995 0.000 0.7174 0.6767 1 348 414 -2.016 0.000 0.8583 0.6637 1 348 520 -16.031 0.000 0.7778 0.7026 1 348 546 -388.152 0.000 0.7715 0.7307 1 348 550 0.000 0.000 0.8768 0.6648 1 348 552 -18.010 0.000 0.7647 0.6352 1 348 558 -30.011 0.000 0.7890 0.5970 1 348 574 0.000 0.000 0.8792 0.6517 1 348 575 -388.152 0.000 0.7756 0.7210 1 351 386 0.000 0.000 0.9648 0.8272 1 351 388 -2.005 0.000 0.8043 0.6418 1 351 399 0.000 0.000 0.9642 0.7923 1 351 437 15.024 0.000 0.7406 0.6364 1 351 445 0.000 0.000 0.9630 0.8166 1 351 451 -2.005 0.000 0.8432 0.6461 1 351 462 0.000 0.000 0.9645 0.8210 1 351 508 0.000 0.000 0.9644 0.8194 1 351 515 -1.003 0.000 0.7035 0.5202 1 351 535 0.000 0.000 0.9431 0.7795 1 351 544 -10.021 0.000 0.7578 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398 60.859 0.000 0.9458 0.7138 1 382 400 105.917 0.000 0.8988 0.5313 1 382 423 -0.000 0.000 0.9537 0.7598 1 382 424 80.973 0.000 0.9193 0.6071 1 382 427 79.973 0.000 0.9063 0.5316 1 382 428 -32.995 0.000 0.7296 0.3314 1 382 430 -77.092 0.000 0.8133 0.4314 1 382 433 8.008 0.000 0.8522 0.4127 1 382 434 108.940 0.000 0.7785 0.3554 1 382 438 -264.120 0.000 0.7489 0.3680 1 382 439 -309.118 0.000 0.7871 0.3403 1 382 442 -317.126 0.000 0.8519 0.5081 1 382 444 -279.157 0.000 0.8735 0.4600 1 382 448 -78.590 0.000 0.8085 0.3392 1 382 452 107.933 0.000 0.8777 0.4695 1 382 453 -81.593 0.000 0.8479 0.5299 1 382 458 119.896 0.000 0.8912 0.4682 1 382 463 105.917 0.000 0.8899 0.4846 1 382 467 -41.115 0.000 0.9344 0.5730 1 382 503 121.912 0.000 0.8603 0.4427 1 382 505 -254.252 0.000 0.8440 0.4361 1 382 511 107.933 0.000 0.8856 0.5037 1 382 516 79.973 0.000 0.7513 0.4888 1 382 534 107.933 0.000 0.8973 0.5052 1 382 561 -209.194 0.000 0.8899 0.5884 1 383 385 117.935 0.000 0.7949 0.6576 1 383 393 -27.995 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196.988 0.000 0.7579 0.4551 1 430 463 183.009 0.000 0.7492 0.5350 1 430 467 35.977 0.000 0.8284 0.4816 1 430 503 199.004 0.000 0.7185 0.4898 1 430 505 -177.160 0.000 0.8089 0.4468 1 430 511 185.025 0.000 0.7353 0.4669 1 430 534 185.025 0.000 0.7402 0.4669 1 430 561 -132.102 0.000 0.8288 0.4121 1 432 446 159.065 0.000 0.9057 0.7206 1 432 449 0.502 0.000 0.8497 0.7396 1 433 434 100.932 0.000 0.7379 0.4691 1 433 439 -317.126 0.000 0.8777 0.6568 1 433 442 -325.134 0.000 0.7438 0.4239 1 433 444 -287.165 0.000 0.8026 0.4999 1 433 448 -86.598 0.000 0.7203 0.3517 1 433 452 99.925 0.000 0.8313 0.5123 1 433 453 -89.601 0.000 0.7435 0.3898 1 433 458 111.888 0.000 0.8428 0.5165 1 433 463 97.909 0.000 0.8366 0.4937 1 433 467 -49.123 0.000 0.8608 0.5088 1 433 503 113.904 0.000 0.8143 0.5235 1 433 505 -262.260 0.000 0.7593 0.4555 1 433 511 99.925 0.000 0.8365 0.4829 1 433 534 99.925 0.000 0.8481 0.5141 1 433 561 -217.202 0.000 0.8026 0.4307 1 434 444 -388.097 0.000 0.7819 0.5511 1 434 448 -187.530 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497 30.010 0.000 0.8276 0.6632 1 492 529 -0.000 0.000 0.8879 0.7901 1 492 536 0.000 0.000 0.8365 0.5723 1 492 545 60.021 0.000 0.7404 0.5269 1 494 495 -330.147 0.000 0.7407 0.3791 1 494 498 -375.205 0.000 0.7462 0.5198 1 494 531 -0.000 0.000 0.8187 0.3290 1 495 496 97.053 0.000 0.7788 0.7609 1 495 498 -45.058 0.000 0.9287 0.6157 1 495 530 -75.069 0.000 0.7606 0.4599 1 495 531 330.147 0.000 0.7365 0.4110 1 495 532 -30.011 0.000 0.9217 0.7450 1 496 533 -30.011 0.000 0.7230 0.6775 1 497 529 -30.011 0.000 0.8027 0.6281 1 497 545 30.010 0.000 0.8903 0.6244 1 498 530 -30.011 0.000 0.8649 0.5099 1 498 532 15.047 0.000 0.7204 0.3045 1 501 511 -30.011 0.000 0.8495 0.6213 1 501 534 -30.011 0.000 0.8577 0.6148 1 502 507 -30.010 0.000 0.7907 0.5863 1 502 536 -30.010 0.000 0.7157 0.5492 1 503 505 -376.164 0.000 0.7272 0.5474 1 503 511 -13.979 0.000 0.9519 0.7559 1 503 534 -13.979 0.000 0.9487 0.7528 1 503 561 -331.106 0.000 0.7513 0.4349 1 505 510 45.058 0.000 0.7917 0.6738 1 505 511 362.184 0.000 0.7521 0.5499 1 505 534 362.184 0.000 0.7554 0.5419 1 505 561 45.058 0.000 0.9113 0.4520 1 507 536 0.000 0.000 0.9118 0.7638 1 507 670 181.001 0.000 0.7098 0.3366 1 507 684 181.001 0.000 0.7502 0.4227 1 508 535 0.000 0.000 0.9475 0.8105 1 508 544 -10.021 0.000 0.7545 0.5307 1 508 572 -10.021 0.000 0.7491 0.5368 1 509 511 1.003 0.000 0.7810 0.5625 1 509 534 1.003 0.000 0.7901 0.5592 1 510 512 97.053 0.000 0.8629 0.6660 1 511 534 0.000 0.000 0.9859 0.8070 1 511 561 -317.127 0.000 0.7762 0.5060 1 516 534 27.960 0.000 0.7118 0.4441 1 516 561 -289.167 0.000 0.7008 0.5062 1 517 522 4.979 0.000 0.7449 0.5245 1 517 523 -30.011 0.000 0.8495 0.4856 1 517 563 -75.008 0.000 0.7727 0.4083 1 517 597 -14.016 0.000 0.9720 0.7511 1 517 598 -30.011 0.000 0.9026 0.4910 1 517 766 -306.184 0.000 0.7626 0.4276 1 517 767 -304.169 0.000 0.7047 0.3434 1 517 776 -308.200 0.000 0.7146 0.3850 1 517 781 -310.206 0.000 0.7142 0.4309 1 517 795 -372.193 0.000 0.8283 0.3166 1 517 821 -250.194 0.000 0.7790 0.3834 1 517 869 -302.473 0.000 0.8418 0.3032 1 520 550 16.031 0.000 0.8545 0.7360 1 520 574 16.031 0.000 0.8566 0.7231 1 521 648 -84.094 0.000 0.9191 0.6975 1 522 537 -42.011 0.000 0.7093 0.5815 1 522 538 -63.992 0.000 0.7115 0.4574 1 522 562 -58.005 0.000 0.7123 0.6285 1 522 597 -18.995 0.000 0.8101 0.5747 1 522 598 -34.990 0.000 0.7489 0.4194 1 523 597 15.995 0.000 0.9129 0.5902 1 523 598 -0.000 0.000 0.8369 0.3823 1 524 559 43.990 0.000 0.7321 0.5759 1 524 562 15.995 0.000 0.7469 0.6106 1 524 605 29.974 0.000 0.8627 0.7127 1 527 551 -14.016 0.000 0.7037 0.6210 1 527 584 2.016 0.000 0.7567 0.6204 1 528 855 -2.016 0.000 0.7787 0.7791 1 528 865 -2.016 0.000 0.7821 0.7670 1 528 876 -2.016 0.000 0.7750 0.7580 1 529 545 60.021 0.000 0.7256 0.4921 1 530 532 45.058 0.000 0.9467 0.7903 1 530 533 142.111 0.000 0.7189 0.7339 1 532 533 97.053 0.000 0.7699 0.7063 1 534 561 -317.127 0.000 0.7867 0.5066 1 535 544 -10.021 0.000 0.7374 0.5200 1 535 572 -10.021 0.000 0.7363 0.5306 1 536 670 181.001 0.000 0.7639 0.2875 1 536 675 181.001 0.000 0.7712 0.4245 1 536 684 181.001 0.000 0.7994 0.4358 1 537 562 -15.994 0.000 0.8193 0.6856 1 538 563 -15.995 0.000 0.8731 0.4741 1 538 598 29.003 0.000 0.7038 0.3492 1 543 567 -0.000 0.000 0.8877 0.6293 1 544 572 0.000 0.000 0.9144 0.7283 1 546 550 388.152 0.000 0.7999 0.7466 1 546 552 370.142 0.000 0.7711 0.7188 1 546 574 388.152 0.000 0.7987 0.7315 1 546 575 -0.000 0.000 0.9887 0.9088 1 547 565 0.000 0.000 0.9635 0.7381 1 548 568 -0.000 0.000 0.9326 0.7670 1 549 573 -0.000 0.000 0.9822 0.8764 1 550 552 -18.010 0.000 0.8222 0.8785 1 550 558 -30.011 0.000 0.7445 0.4120 1 550 574 -0.000 0.000 0.9946 0.9434 1 550 575 -388.152 0.000 0.8055 0.7775 1 550 585 16.031 0.000 0.7139 0.6452 1 551 564 0.000 0.000 0.8408 0.7430 1 552 554 -17.027 0.000 0.9005 0.6639 1 552 574 18.010 0.000 0.8198 0.8817 1 552 575 -370.142 0.000 0.7783 0.7663 1 552 581 16.031 0.000 0.7576 0.5297 1 552 587 18.047 0.000 0.7573 0.3875 1 558 574 30.011 0.000 0.7530 0.4116 1 559 562 -27.995 0.000 0.8201 0.7854 1 559 605 -14.016 0.000 0.7876 0.6732 1 562 563 -21.982 0.000 0.7152 0.4030 1 562 605 13.979 0.000 0.7872 0.6858 1 564 576 -117.935 0.000 0.8283 0.5771 1 574 575 -388.152 0.000 0.8052 0.7657 1 574 585 16.031 0.000 0.7114 0.6277 1 577 583 -18.010 0.000 0.7449 0.6747 1 577 590 -134.094 0.000 0.7287 0.6915 1 577 608 -134.094 0.000 0.7461 0.7015 1 577 609 -108.058 0.000 0.7349 0.6511 1 577 617 -134.094 0.000 0.7183 0.5916 1 577 618 15.995 0.000 0.7682 0.6268 1 577 631 13.979 0.000 0.7395 0.6204 1 577 637 13.979 0.000 0.7600 0.6494 1 577 640 13.979 0.000 0.7139 0.5281 1 577 646 13.979 0.000 0.7402 0.6339 1 577 649 13.979 0.000 0.7359 0.5824 1 577 660 13.979 0.000 0.7318 0.6146 1 577 663 -130.078 0.000 0.7259 0.6412 1 577 667 13.979 0.000 0.7435 0.6395 1 577 679 -156.094 0.000 0.7156 0.5048 1 577 680 13.979 0.000 0.7401 0.6263 1 577 706 -156.094 0.000 0.7137 0.5664 1 577 868 13.979 0.000 0.7535 0.6618 1 578 592 -12.000 0.000 0.7205 0.6344 1 581 582 18.010 0.000 0.7900 0.5703 1 581 584 1.008 0.000 0.7987 0.5938 1 581 585 18.010 0.000 0.7133 0.6210 1 581 854 13.979 0.000 0.7936 0.5999 1 581 855 31.989 0.000 0.7484 0.6446 1 581 864 13.979 0.000 0.8076 0.6886 1 581 865 31.989 0.000 0.7510 0.7103 1 581 876 31.989 0.000 0.7402 0.5804 1 584 855 30.982 0.000 0.7008 0.6106 1 590 591 -341.132 0.000 0.8154 0.7102 1 590 608 0.000 0.000 0.9660 0.8615 1 590 609 26.037 0.000 0.7046 0.5814 1 590 610 -144.043 0.000 0.7265 0.5943 1 590 612 -179.080 0.000 0.8836 0.7420 1 590 616 -179.080 0.000 0.8845 0.7133 1 590 617 -0.000 0.000 0.9481 0.7822 1 590 618 150.089 0.000 0.7504 0.5772 1 590 624 148.073 0.000 0.7103 0.5558 1 590 631 148.073 0.000 0.7541 0.5613 1 590 637 148.073 0.000 0.7824 0.5919 1 590 640 148.073 0.000 0.7309 0.5164 1 590 646 148.073 0.000 0.7619 0.5910 1 590 649 148.073 0.000 0.7407 0.5471 1 590 660 148.073 0.000 0.7574 0.5803 1 590 667 148.073 0.000 0.7661 0.5988 1 590 680 148.073 0.000 0.7571 0.5807 1 590 692 -441.309 0.000 0.7560 0.5830 1 590 696 -441.309 0.000 0.7725 0.6070 1 590 762 -633.336 0.000 0.7297 0.5980 1 590 768 -471.283 0.000 0.7402 0.5608 1 590 817 -471.283 0.000 0.7541 0.5939 1 590 826 -258.199 0.000 0.7900 0.5976 1 590 829 -455.288 0.000 0.7270 0.5530 1 590 868 148.073 0.000 0.7560 0.6133 1 590 886 -72.037 0.000 0.7142 0.4855 1 591 602 -2.016 0.000 0.8817 0.7717 1 591 608 341.132 0.000 0.8481 0.7937 1 591 610 197.090 0.000 0.7851 0.7328 1 591 612 162.053 0.000 0.9557 0.8840 1 591 616 162.053 0.000 0.9204 0.7460 1 591 617 341.132 0.000 0.8025 0.6095 1 591 688 -148.161 0.000 0.7323 0.6192 1 591 692 -100.177 0.000 0.8181 0.6882 1 591 696 -100.177 0.000 0.8073 0.6819 1 591 732 -238.229 0.000 0.8159 0.7581 1 591 740 -44.078 0.000 0.7201 0.7168 1 591 762 -292.204 0.000 0.7442 0.6658 1 591 768 -130.151 0.000 0.7896 0.6772 1 591 817 -130.151 0.000 0.7664 0.6725 1 591 826 82.934 0.000 0.7133 0.5964 1 591 829 -114.156 0.000 0.7747 0.6443 1 593 599 191.144 0.000 0.7368 0.5893 1 593 601 208.147 0.000 0.7003 0.6574 1 593 611 -19.018 0.000 0.8604 0.7919 1 593 613 0.000 0.000 0.8360 0.8333 1 593 622 -19.018 0.000 0.8659 0.8327 1 593 623 0.000 0.000 0.8185 0.6757 1 593 630 15.995 0.000 0.8871 0.8427 1 593 634 0.000 0.000 0.8056 0.7132 1 593 645 -19.018 0.000 0.8153 0.6546 1 593 655 190.136 0.000 0.8286 0.8058 1 593 658 190.136 0.000 0.8388 0.8218 1 593 662 -1.007 0.000 0.7662 0.5768 1 593 664 232.147 0.000 0.7175 0.5213 1 593 665 -19.017 0.000 0.8573 0.8231 1 593 674 190.136 0.000 0.7886 0.6305 1 593 679 224.142 0.000 0.7099 0.6218 1 593 681 -19.017 0.000 0.8159 0.7442 1 593 682 207.139 0.000 0.7265 0.6021 1 593 683 206.132 0.000 0.7481 0.7042 1 593 689 -19.017 0.000 0.8241 0.8071 1 593 694 -3.023 0.000 0.8026 0.7449 1 593 703 -19.017 0.000 0.8288 0.7712 1 593 708 15.995 0.000 0.7686 0.7430 1 593 709 -1.007 0.000 0.8775 0.7346 1 593 719 15.995 0.000 0.7977 0.7952 1 593 720 -1.007 0.000 0.8826 0.7339 1 593 725 -1.007 0.000 0.8932 0.8013 1 593 727 -1.007 0.000 0.8994 0.8057 1 593 729 14.988 0.000 0.8277 0.7709 1 593 730 184.111 0.000 0.7221 0.5694 1 593 734 -1.007 0.000 0.8895 0.7538 1 593 735 0.000 0.000 0.9308 0.8049 1 593 750 -1.007 0.000 0.8941 0.7779 1 593 751 15.995 0.000 0.7007 0.6122 1 593 803 -1.007 0.000 0.7941 0.6592 1 593 804 0.000 0.000 0.8256 0.7174 1 593 805 165.129 0.000 0.8128 0.7212 1 593 815 -1.007 0.000 0.8586 0.7423 1 593 819 0.000 0.000 0.8976 0.8097 1 593 824 14.988 0.000 0.8515 0.7542 1 593 828 -1.007 0.000 0.7753 0.6615 1 593 830 0.000 0.000 0.8556 0.6514 1 593 831 165.129 0.000 0.7899 0.6129 1 593 832 164.122 0.000 0.7197 0.5049 1 593 833 15.995 0.000 0.8612 0.7366 1 593 841 30.984 0.000 0.7983 0.7437 1 593 843 15.995 0.000 0.8461 0.8069 1 593 844 31.990 0.000 0.8184 0.7380 1 593 845 14.989 0.000 0.8433 0.7861 1 593 846 -14.013 0.000 0.7514 0.6478 1 593 847 -30.009 0.000 0.7108 0.4754 1 593 849 32.999 0.000 0.8085 0.6495 1 593 850 -13.007 0.000 0.7520 0.6229 1 593 851 -1.006 0.000 0.7981 0.7446 1 593 852 0.001 0.000 0.8589 0.8306 1 593 874 14.989 0.000 0.8368 0.7734 1 593 894 31.991 0.000 0.8167 0.7805 1 593 895 32.999 0.000 0.7072 0.4927 1 593 896 14.989 0.000 0.8373 0.8032 1 593 898 -13.007 0.000 0.7416 0.5691 1 594 606 -2.016 0.000 0.9818 0.7106 1 594 615 -2.016 0.000 0.8364 0.6842 1 594 639 21.984 0.000 0.8206 0.5952 1 594 731 -265.248 0.000 0.9157 0.5866 1 594 757 -262.229 0.000 0.9667 0.5564 1 594 788 -241.248 0.000 0.9172 0.6775 1 594 789 -240.245 0.000 0.9699 0.5098 1 594 820 -262.229 0.000 0.9378 0.5928 1 597 598 -15.995 0.000 0.9041 0.5030 1 597 766 -292.169 0.000 0.7142 0.3571 1 598 766 -276.174 0.000 0.7128 0.3817 1 598 795 -342.182 0.000 0.7901 0.2623 1 599 601 17.003 0.000 0.7033 0.6358 1 599 609 81.034 0.000 0.7299 0.5605 1 599 611 -210.162 0.000 0.7581 0.5550 1 599 622 -210.162 0.000 0.7617 0.5957 1 599 645 -210.162 0.000 0.7667 0.6984 1 599 655 -1.008 0.000 0.7839 0.6853 1 599 658 -1.008 0.000 0.7879 0.6591 1 599 662 -192.151 0.000 0.7234 0.6252 1 599 663 59.014 0.000 0.7375 0.5792 1 599 664 41.003 0.000 0.7828 0.6754 1 599 674 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0.000 0.7536 0.6822 1 828 830 1.007 0.000 0.7419 0.4560 1 828 831 166.136 0.000 0.7255 0.4634 1 828 843 17.002 0.000 0.7160 0.6909 1 828 845 15.996 0.000 0.7168 0.6875 1 828 851 0.001 0.000 0.9115 0.6951 1 828 852 1.007 0.000 0.8268 0.6279 1 828 874 15.996 0.000 0.7413 0.6322 1 829 838 2.016 0.000 0.7764 0.7395 1 829 840 19.042 0.000 0.7407 0.5519 1 829 841 240.131 0.000 0.7185 0.6006 1 829 844 241.137 0.000 0.7496 0.6429 1 829 846 195.134 0.000 0.7376 0.6503 1 829 847 179.137 0.000 0.7153 0.5627 1 829 848 178.131 0.000 0.7089 0.5309 1 829 870 241.137 0.000 0.7029 0.5521 1 829 891 11.963 0.000 0.7117 0.7834 1 829 894 241.137 0.000 0.7479 0.5990 1 830 831 165.128 0.000 0.7776 0.7097 1 830 832 164.122 0.000 0.7045 0.6290 1 830 833 15.995 0.000 0.8389 0.7266 1 830 841 30.984 0.000 0.7102 0.5956 1 830 843 15.995 0.000 0.7899 0.5996 1 830 844 31.990 0.000 0.7522 0.6564 1 830 845 14.988 0.000 0.7722 0.5848 1 830 847 -30.010 0.000 0.7034 0.5903 1 830 849 32.999 0.000 0.7586 0.7295 1 830 851 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0.8055 0.6224 1 843 851 -17.001 0.000 0.7408 0.6840 1 843 852 -15.995 0.000 0.7776 0.7631 1 843 870 15.995 0.000 0.7704 0.4978 1 843 874 -1.006 0.000 0.8534 0.7640 1 843 894 15.995 0.000 0.8979 0.8072 1 843 895 17.003 0.000 0.7961 0.5273 1 843 896 -1.006 0.000 0.9042 0.8370 1 843 897 -30.008 0.000 0.7892 0.4916 1 843 898 -29.002 0.000 0.7991 0.5753 1 844 845 -17.002 0.000 0.8837 0.7273 1 844 846 -46.003 0.000 0.9483 0.8618 1 844 847 -62.000 0.000 0.8577 0.6119 1 844 848 -63.006 0.000 0.8275 0.5523 1 844 849 1.009 0.000 0.8806 0.7359 1 844 850 -44.997 0.000 0.8673 0.7658 1 844 852 -31.990 0.000 0.7364 0.7297 1 844 870 0.000 0.000 0.8436 0.6236 1 844 874 -17.001 0.000 0.8193 0.7153 1 844 894 0.000 0.000 0.9776 0.8650 1 844 895 1.008 0.000 0.8063 0.5930 1 844 896 -17.001 0.000 0.8938 0.7562 1 844 897 -46.003 0.000 0.8814 0.6436 1 844 898 -44.997 0.000 0.8652 0.7229 1 845 846 -29.002 0.000 0.8968 0.7255 1 845 847 -44.998 0.000 0.8095 0.4949 1 845 848 -46.005 0.000 0.7880 0.4520 1 845 849 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nf_output/GNPS-SAM-SIK-KANG-LEGACY-LIBRARY.mgf.tsv0000644000000000000000000000000114664572140017500 0ustar rootroot nf_output/MASSBANKEU.mgf.tsv0000644000000000000000000000000114664572140014536 0ustar rootroot nf_output/HMDB.mgf.tsv0000644000000000000000000000000114664572140013617 0ustar rootroot nf_output/MSNLIB-POSITIVE.mgf.tsv0000644000000000000000000000000114664572142015333 0ustar rootroot nf_output/GNPS-COLLECTIONS-PESTICIDES-NEGATIVE.mgf.tsv0000644000000000000000000000000114664572140020262 0ustar rootroot nf_output/GNPS-NUTRI-METAB-FEM-NEG.mgf.tsv0000644000000000000000000000000114664572140016415 0ustar rootroot nf_output/ELIXDB-LICHEN-DATABASE.mgf.tsv0000644000000000000000000000000114664572140016156 0ustar rootroot nf_output/GNPS-PRESTWICKPHYTOCHEM.mgf.tsv0000644000000000000000000000000114664572140016506 0ustar rootroot nf_output/GNPS-MSMLS.mgf.tsv0000644000000000000000000000000114664572140014545 0ustar rootroot nf_output/MIADB.mgf.tsv0000644000000000000000000000000114664572140013721 0ustar rootroot nf_output/GNPS-SELLECKCHEM-FDA-PART1.mgf.tsv0000644000000000000000000000000114664572140016606 0ustar rootroot nf_output/GNPS-EMBL-MCF.mgf.tsv0000644000000000000000000000000114664572140014774 0ustar rootroot nf_output/filesummary/0000755000000000000000000000000014664572140014145 5ustar rootrootnf_output/filesummary/summaryresult.tsv0000644000000000000000000000000114664572140017626 0ustar rootroot nf_output/GNPS-NIH-CLINICALCOLLECTION1.mgf.tsv0000644000000000000000000000000114664572140017101 0ustar rootroot nf_output/library/0000755000000000000000000000000014664574437013267 5ustar rootrootnf_output/library/merged_results_with_gnps.tsv0000644000000000000000000077607214664574437021156 0ustar rootrootSpectrumID #Scan# SpectrumFile LibraryName MQScore TIC_Query RT_Query MZErrorPPM SharedPeaks MassDiff SpecMZ SpecCharge FileScanUniqueID NumberHits Compound_Name Ion_Source Instrument Compound_Source PI Data_Collector Adduct Precursor_MZ ExactMass Charge CAS_Number Pubmed_ID Smiles INCHI INCHI_AUX Library_Class IonMode Organism LibMZ UpdateWorkflowName LibraryQualityString tags molecular_formula InChIKey InChIKey-Planar superclass class subclass npclassifier_superclass npclassifier_class npclassifier_pathway library_usi CCMSLIB00004720842 462 spectra_filtered.mgf MONA.mgf 0.998567 35860000.0 0 305069.0 9 97.0528 221.081 1 temp/spectra_filtered.mgf462 1 Piplartine N/A ESI-QFT isolated MoNA MoNA:VF-NPL-QEHF027261 [M+H]+ 318.134 0.0 1 N/A N/A COc1cc(/C=C/C(=O)N2CCC=CC2=O)cc(OC)c1OC InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+ N/A 3 positive MONA 318.134 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C17H19NO5 VABYUUZNAVQNPG-BQYQJAHWSA-N VABYUUZNAVQNPG N/A N/A N/A Lysine alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00004720842 CCMSLIB00004720842 508 spectra_filtered.mgf MONA.mgf 0.998483 19350000.0 0 305069.0 9 97.0528 221.081 1 temp/spectra_filtered.mgf508 1 Piplartine N/A ESI-QFT isolated MoNA MoNA:VF-NPL-QEHF027261 [M+H]+ 318.134 0.0 1 N/A N/A COc1cc(/C=C/C(=O)N2CCC=CC2=O)cc(OC)c1OC InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+ N/A 3 positive MONA 318.134 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C17H19NO5 VABYUUZNAVQNPG-BQYQJAHWSA-N VABYUUZNAVQNPG N/A N/A N/A Lysine alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00004720842 CCMSLIB00004720842 351 spectra_filtered.mgf MONA.mgf 0.997876 3540600.0 0 305069.0 9 97.0528 221.081 1 temp/spectra_filtered.mgf351 1 Piplartine N/A ESI-QFT isolated MoNA MoNA:VF-NPL-QEHF027261 [M+H]+ 318.134 0.0 1 N/A N/A COc1cc(/C=C/C(=O)N2CCC=CC2=O)cc(OC)c1OC InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+ N/A 3 positive MONA 318.134 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C17H19NO5 VABYUUZNAVQNPG-BQYQJAHWSA-N VABYUUZNAVQNPG N/A N/A N/A Lysine alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00004720842 CCMSLIB00005768453 334 spectra_filtered.mgf MASSBANK.mgf 0.99588 22788900.0 0 47320.4 6 14.0146 282.149 1 temp/spectra_filtered.mgf334 1 Massbank:NA002903 (-)-Nuciferine|Nuciferine|(6aR)-1,2-dimethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline ESI Hybrid FT Isolated Massbank Massbank M+H 296.164 0.0 1 475-83-2 N/A CN1CCc2cc(c(c-3c2[C@H]1Cc4c3cccc4)OC)OC 1S/C19H21NO2/c1-20-9-8-13-11-16(21-2)19(22-3)18-14-7-5-4-6-12(14)10-15(20)17(13)18/h4-7,11,15H,8-10H2,1-3H3/t15-/m1/s1 N/A 3 Positive MASSBANK 296.164 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C19H21NO2 ORJVQPIHKOARKV-OAHLLOKOSA-N ORJVQPIHKOARKV N/A N/A N/A Tyrosine alkaloids Aporphine alkaloids|Isoquinoline alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00005768453 CCMSLIB00005761602 555 spectra_filtered.mgf MASSBANK.mgf 0.995327 11481000.0 0 0.639907 12 0.000183105 286.144 1 temp/spectra_filtered.mgf555 1 Massbank:LU109603 Piperine|(2E,4E)-5-(1,3-benzodioxol-5-yl)-1-piperidin-1-ylpenta-2,4-dien-1-one ESI Hybrid FT Isolated Massbank Massbank M+H 286.144 0.0 1 94-62-2 N/A O=C(\C=C\C=C\C1=CC=C2OCOC2=C1)N1CCCCC1 1S/C17H19NO3/c19-17(18-10-4-1-5-11-18)7-3-2-6-14-8-9-15-16(12-14)21-13-20-15/h2-3,6-9,12H,1,4-5,10-11,13H2/b6-2+,7-3+ N/A 3 Positive MASSBANK 286.144 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C17H19NO3 MXXWOMGUGJBKIW-YPCIICBESA-N MXXWOMGUGJBKIW N/A N/A N/A Lysine alkaloids Piperidine alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00005761602 CCMSLIB00010106258 378 spectra_filtered.mgf BERKELEY-LAB.mgf 0.993382 58349200.0 0 141631.0 7 45.0577 363.192 1 temp/spectra_filtered.mgf378 1 Piperlongumine CollisionEnergy:102040 LC-ESI Orbitrap Commercial Trent Northen JGI M+H 318.134 0.0 1 N/A N/A COc1cc(C=CC(=O)N2CCC=CC2=O)cc(OC)c1OC """InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+""" N/A 3 Positive BERKELEY-LAB 318.134 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C17H19NO5 VABYUUZNAVQNPG-UHFFFAOYSA-N VABYUUZNAVQNPG N/A N/A N/A Lysine alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00010106258 CCMSLIB00004706102 59 spectra_filtered.mgf MONA.mgf 0.991533 29635900.0 0 310325.0 8 162.053 360.15 1 temp/spectra_filtered.mgf59 1 Melezitose N/A ESI-QFT isolated MoNA MoNA:VF-NPL-QEHF015039 [M+NH4]+ 522.203 0.0 1 N/A N/A OC[C@H]1O[C@H](O[C@H]2[C@H](O)[C@@H](CO)O[C@@]2(CO)O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@@H]1O InChI=1S/C18H32O16/c19-1-5-8(23)11(26)13(28)16(30-5)32-15-10(25)7(3-21)33-18(15,4-22)34-17-14(29)12(27)9(24)6(2-20)31-17/h5-17,19-29H,1-4H2/t5-,6-,7-,8-,9-,10-,11+,12+,13-,14-,15+,16-,17-,18+/m1/s1 N/A 3 positive MONA 522.203 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C18H32O16 QWIZNVHXZXRPDR-WSCXOGSTSA-N QWIZNVHXZXRPDR Organic oxygen compounds Organooxygen compounds Carbohydrates and carbohydrate conjugates Saccharides Disaccharides|Polysaccharides Carbohydrates mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00004706102 CCMSLIB00004719836 206 spectra_filtered.mgf MONA.mgf 0.991504 39385000.0 0 2.72585 14 0.000793457 291.087 1 temp/spectra_filtered.mgf206 1 Catechin N/A ESI-QTOF isolated MoNA MoNA:VF-NPL-QTOF002052 [M+H]+ 291.086 0.0 1 N/A N/A Oc1cc(O)c2c(c1)O[C@H](c1ccc(O)c(O)c1)[C@H](O)C2 InChI=1S/C15H14O6/c16-8-4-11(18)9-6-13(20)15(21-14(9)5-8)7-1-2-10(17)12(19)3-7/h1-5,13,15-20H,6H2/t13-,15-/m1/s1 N/A 3 positive MONA 291.086 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C15H14O6 PFTAWBLQPZVEMU-UKRRQHHQSA-N PFTAWBLQPZVEMU Phenylpropanoids and polyketides Flavonoids Flavans Flavonoids Flavan-3-ols Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00004719836 CCMSLIB00004684185 156 spectra_filtered.mgf GNPS-LIBRARY.mgf 0.988831 5859300.0 0 1.11722 9 0.000396729 355.102 1 temp/spectra_filtered.mgf156 1 Chlorogenic acid LC-ESI Orbitrap Isolated Gleixner Carsten Simon M+H 355.102 354.095 1 327-97-9 1794427 C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)/b4-2+/t11-,12-,14-,16+/m1/s1 3 Positive GNPS-LIBRARY 355.102 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C16H18O9 CWVRJTMFETXNAD-UHFFFAOYSA-N CWVRJTMFETXNAD Organic oxygen compounds Organooxygen compounds Alcohols and polyols Phenylpropanoids (C6-C3) Cinnamic acids and derivatives Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00004684185 CCMSLIB00010106258 398 spectra_filtered.mgf BERKELEY-LAB.mgf 0.98733 2492300.0 0 147967.0 6 47.0733 365.207 1 temp/spectra_filtered.mgf398 1 Piperlongumine CollisionEnergy:102040 LC-ESI Orbitrap Commercial Trent Northen JGI M+H 318.134 0.0 1 N/A N/A COc1cc(C=CC(=O)N2CCC=CC2=O)cc(OC)c1OC """InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+""" N/A 3 Positive BERKELEY-LAB 318.134 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C17H19NO5 VABYUUZNAVQNPG-UHFFFAOYSA-N VABYUUZNAVQNPG N/A N/A N/A Lysine alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00010106258 CCMSLIB00012447737 360 spectra_filtered.mgf MSNLIB-POSITIVE.mgf 0.987162 77450500.0 0 462886.0 7 262.09 304.118 1 temp/spectra_filtered.mgf360 1 Sibiricose A6 ESI Orbitrap Crude Tomas Pluskal Corinna Brungs [M+NH4]+ 566.208 548.174 1 N/A N/A COc1cc(/C=C/C(=O)O[C@H]2[C@H](O)[C@@H](CO)O[C@@]2(CO)O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O InChI=1S/C23H32O15/c1-33-11-5-10(6-12(34-2)16(11)28)3-4-15(27)36-21-18(30)14(8-25)37-23(21,9-26)38-22-20(32)19(31)17(29)13(7-24)35-22/h3-6,13-14,17-22,24-26,28-32H,7-9H2,1-2H3/b4-3+/t13-,14-,17-,18-,19+,20-,21+,22-,23+/m1/s1 WTCVROXOIQEIRC-IBVGEFGBSA-N 1 Positive MSNLIB-POSITIVE 566.208 UPDATE-SINGLE-ANNOTATED-GOLD Gold C23H32O15 WTCVROXOIQEIRC-IBVGEFGBSA-N WTCVROXOIQEIRC Phenylpropanoids and polyketides Cinnamic acids and derivatives Hydroxycinnamic acids and derivatives Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012447737 CCMSLIB00010106793 372 spectra_filtered.mgf BERKELEY-LAB.mgf 0.986752 7562800.0 0 21593.2 6 7.04239 333.181 1 temp/spectra_filtered.mgf372 1 """(2E)-N-(3-acetylphenyl)-3-(3,4-dimethoxyphenyl)prop-2-enamide CollisionEnergy:102040""" LC-ESI Orbitrap Commercial Trent Northen JGI M+H 326.139 0.0 1 N/A N/A COc1ccc(C=CC(O)=Nc2cccc(C(C)=O)c2)cc1OC """InChI=1S/C19H19NO4/c1-13(21)15-5-4-6-16(12-15)20-19(22)10-8-14-7-9-17(23-2)18(11-14)24-3/h4-12H,1-3H3,(H,20,22)/b10-8+""" N/A 3 Positive BERKELEY-LAB 326.139 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C19H19NO4 GCBFLLRSFHXBHN-UHFFFAOYSA-N GCBFLLRSFHXBHN Organic oxygen compounds Organooxygen compounds Carbonyl compounds Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00010106793 CCMSLIB00003138466 49 spectra_filtered.mgf GNPS-NIST14-MATCHES.mgf 0.985903 12909300.0 0 521913.0 11 179.08 522.203 1 temp/spectra_filtered.mgf49 1 Spectral Match to 4-O-.beta.-Galactopyranosyl-D-mannopyranose from NIST14 ESI qTof Isolated Data from Christopher A. Lowry Data deposited by fevargas M+H 343.123 342.116 1 20869276 N/A C(C1[C@@H](C([C@@H]([C@@H](O1)O[C@@H]2C(O[C@@H]([C@@H](C2O)O)O)CO)O)O)O)O InChI=1S/C12H22O11/c13-1-3-5(15)6(16)9(19)12(22-3)23-10-4(2-14)21-11(20)8(18)7(10)17/h3-20H,1-2H2/t3?,4?,5-,6?,7?,8+,9-,10+,11-,12-/m0/s1 N/A 3 Positive GNPS-NIST14-MATCHES 343.123 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C12H22O11 GUBGYTABKSRVRQ-TUTXPGRXSA-N GUBGYTABKSRVRQ Organic oxygen compounds Organooxygen compounds Carbohydrates and carbohydrate conjugates Saccharides Disaccharides|Polysaccharides Carbohydrates mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00003138466 CCMSLIB00010106258 467 spectra_filtered.mgf BERKELEY-LAB.mgf 0.984531 19702100.0 0 468506.0 6 149.048 467.182 1 temp/spectra_filtered.mgf467 1 Piperlongumine CollisionEnergy:102040 LC-ESI Orbitrap Commercial Trent Northen JGI M+H 318.134 0.0 1 N/A N/A COc1cc(C=CC(=O)N2CCC=CC2=O)cc(OC)c1OC """InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+""" N/A 3 Positive BERKELEY-LAB 318.134 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C17H19NO5 VABYUUZNAVQNPG-UHFFFAOYSA-N VABYUUZNAVQNPG N/A N/A N/A Lysine alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00010106258 CCMSLIB00012335082 41 spectra_filtered.mgf MSNLIB-POSITIVE.mgf 0.984293 27165000.0 0 2.47866 8 0.00050354 203.15 1 temp/spectra_filtered.mgf41 1 N,N-dimethylarginine ESI Orbitrap Crude Tomas Pluskal Corinna Brungs [M+H]+ 203.15 202.143 1 N/A N/A CN(C)C(N)=NCCC[C@H](N)C(=O)O InChI=1S/C8H18N4O2/c1-12(2)8(10)11-5-3-4-6(9)7(13)14/h6H,3-5,9H2,1-2H3,(H2,10,11)(H,13,14)/t6-/m0/s1 YDGMGEXADBMOMJ-LURJTMIESA-N 1 Positive MSNLIB-POSITIVE 203.15 UPDATE-SINGLE-ANNOTATED-GOLD Gold C8H18N4O2 YDGMGEXADBMOMJ-LURJTMIESA-N YDGMGEXADBMOMJ Organic acids and derivatives Carboxylic acids and derivatives Amino acids, peptides, and analogues Small peptides Aminoacids Amino acids and Peptides mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012335082 CCMSLIB00012060262 233 spectra_filtered.mgf GNPS-LIBRARY.mgf 0.983845 6193600.0 0 2.03346 16 0.000671387 330.171 1 temp/spectra_filtered.mgf233 1 Reticuline LC-ESI Orbitrap Isolated Wolfender Olivier Kirchhoffer M+H 330.17 0.0 0 485-19-8 439653 CN1CCC2=CC(=C(C=C2C1CC3=CC(=C(C=C3)OC)O)O)OC InChI=1S/C19H23NO4/c1-20-7-6-13-10-19(24-3)17(22)11-14(13)15(20)8-12-4-5-18(23-2)16(21)9-12/h4-5,9-11,15,21-22H,6-8H2,1-3H3/t15-/m0/s1 3 Positive GNPS-LIBRARY 330.17 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C19H23NO4 BHLYRWXGMIUIHG-UHFFFAOYSA-N BHLYRWXGMIUIHG Organoheterocyclic compounds Isoquinolines and derivatives Benzylisoquinolines Tyrosine alkaloids Isoquinoline alkaloids|Tetrahydroisoquinoline alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012060262 CCMSLIB00010110932 416 spectra_filtered.mgf BERKELEY-LAB.mgf 0.983003 12404900.0 0 387688.0 8 81.0582 290.139 1 temp/spectra_filtered.mgf416 1 """3,4-DIMETHOXYCINNAMIC ACID CollisionEnergy:102040""" LC-ESI Orbitrap Commercial Trent Northen JGI M+H 209.081 0.0 1 N/A N/A COc1ccc(C=CC(=O)O)cc1OC """InChI=1S/C11H12O4/c1-14-9-5-3-8(4-6-11(12)13)7-10(9)15-2/h3-7H,1-2H3,(H,12,13)/b6-4+""" N/A 3 Positive BERKELEY-LAB 209.081 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C11H12O4 HJBWJAPEBGSQPR-UHFFFAOYSA-N HJBWJAPEBGSQPR Phenylpropanoids and polyketides Cinnamic acids and derivatives Hydroxycinnamic acids and derivatives Phenylpropanoids (C6-C3) Cinnamic acids and derivatives Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00010110932 CCMSLIB00003137628 132 spectra_filtered.mgf GNPS-NIST14-MATCHES.mgf 0.982914 43531000.0 0 2.45513 7 0.00050354 205.098 1 temp/spectra_filtered.mgf132 1 Spectral Match to L-Tryptophan from NIST14 ESI qTof Isolated Data from Jeffrey McLean, Xuesong He Data deposited by aedlund M+H 205.097 204.09 1 73223 N/A C1=CC=C2C(=C1)C(=CN2)C[C@@H](C(=O)O)N InChI=1S/C11H12N2O2/c12-9(11(14)15)5-7-6-13-10-4-2-1-3-8(7)10/h1-4,6,9,13H,5,12H2,(H,14,15)/t9-/m0/s1 N/A 3 Positive GNPS-NIST14-MATCHES 205.097 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C11H12N2O2 QIVBCDIJIAJPQS-VIFPVBQESA-N QIVBCDIJIAJPQS Organoheterocyclic compounds Indoles and derivatives Indolyl carboxylic acids and derivatives Small peptides Aminoacids Amino acids and Peptides|Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00003137628 CCMSLIB00012445959 222 spectra_filtered.mgf MSNLIB-POSITIVE.mgf 0.982606 3860000.0 0 465037.0 9 180.063 207.138 1 temp/spectra_filtered.mgf222 1 3,5,5-Trimethyl-4beta-hydroxy-4-[3-(beta-D-glucopyranosyloxy)-1-butenyl]-2-cyclohexene-1-one ESI Orbitrap Crude Tomas Pluskal Corinna Brungs [M+H]+ 387.201 386.194 1 N/A N/A CC1=CC(=O)CC(C)(C)[C@@]1(O)/C=C/C(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O InChI=1S/C19H30O8/c1-10-7-12(21)8-18(3,4)19(10,25)6-5-11(2)26-17-16(24)15(23)14(22)13(9-20)27-17/h5-7,11,13-17,20,22-25H,8-9H2,1-4H3/b6-5+/t11?,13-,14-,15+,16-,17-,19-/m1/s1 SWYRVCGNMNAFEK-CLCVOTHJSA-N 1 Positive MSNLIB-POSITIVE 387.201 UPDATE-SINGLE-ANNOTATED-GOLD Gold C19H30O8 SWYRVCGNMNAFEK-CLCVOTHJSA-N SWYRVCGNMNAFEK Lipids and lipid-like molecules Fatty Acyls Fatty acyl glycosides Apocarotenoids Megastigmanes Terpenoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012445959 CCMSLIB00010103189 606 spectra_filtered.mgf BERKELEY-LAB.mgf 0.981796 23024500.0 0 288770.0 8 211.266 520.34 1 temp/spectra_filtered.mgf606 1 Sphingomyelin (d18:1/18:0) CollisionEnergy:102040 LC-ESI Orbitrap Commercial Trent Northen JGI M 731.606 0.0 1 N/A N/A CCCCCCCCCCCCC/C=C/[C@@H](O)[C@H](COP(=O)(O)OCC[N+](C)(C)C)N=C(O)CCCCCCCCCCCCCCCCC """InChI=1S/C41H83N2O6P/c1-6-8-10-12-14-16-18-20-21-23-25-27-29-31-33-35-41(45)42-39(38-49-50(46,47)48-37-36-43(3,4)5)40(44)34-32-30-28-26-24-22-19-17-15-13-11-9-7-2/h32,34,39-40,44H,6-31,33,35-38H2,1-5H3,(H-,42,45,46,47)/p+1/b34-32+/t39-,40+/m0/s1""" N/A 3 Positive BERKELEY-LAB 731.606 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze N/A LKQLRGMMMAHREN-YJFXYUILSA-O LKQLRGMMMAHREN Lipids and lipid-like molecules Sphingolipids Phosphosphingolipids N/A N/A N/A mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00010103189 CCMSLIB00010110932 371 spectra_filtered.mgf BERKELEY-LAB.mgf 0.981794 37269400.0 0 378048.0 9 79.0426 288.124 1 temp/spectra_filtered.mgf371 1 """3,4-DIMETHOXYCINNAMIC ACID CollisionEnergy:102040""" LC-ESI Orbitrap Commercial Trent Northen JGI M+H 209.081 0.0 1 N/A N/A COc1ccc(C=CC(=O)O)cc1OC """InChI=1S/C11H12O4/c1-14-9-5-3-8(4-6-11(12)13)7-10(9)15-2/h3-7H,1-2H3,(H,12,13)/b6-4+""" N/A 3 Positive BERKELEY-LAB 209.081 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C11H12O4 HJBWJAPEBGSQPR-UHFFFAOYSA-N HJBWJAPEBGSQPR Phenylpropanoids and polyketides Cinnamic acids and derivatives Hydroxycinnamic acids and derivatives Phenylpropanoids (C6-C3) Cinnamic acids and derivatives Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00010110932 CCMSLIB00012445747 406 spectra_filtered.mgf MSNLIB-POSITIVE.mgf 0.980689 196507000.0 0 597748.0 8 428.152 288.124 1 temp/spectra_filtered.mgf406 1 NCGC00384692-01 ESI Orbitrap Crude Tomas Pluskal Corinna Brungs [M+NH4]+ 716.276 698.242 1 N/A N/A COc1c(OC)cc(/C=C/C(=O)O[C@@H]2[C@@H](O)[C@H](C)O[C@@H](OC3C4C=COC(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)C4C4(CO)OC34)[C@@H]2O)cc1 InChI=1S/C32H42O17/c1-13-21(36)27(46-19(35)7-5-14-4-6-16(41-2)17(10-14)42-3)25(40)31(44-13)47-26-15-8-9-43-29(20(15)32(12-34)28(26)49-32)48-30-24(39)23(38)22(37)18(11-33)45-30/h4-10,13,15,18,20-31,33-34,36-40H,11-12H2,1-3H3/b7-5+/t13-,15?,18+,20?,21-,22+,23-,24+,25+,26?,27+,28?,29?,30-,31-,32?/m0/s1 ATVXWIBQUWJBAT-USTGJSRQSA-N 1 Positive MSNLIB-POSITIVE 716.276 UPDATE-SINGLE-ANNOTATED-GOLD Gold C32H42O17 ATVXWIBQUWJBAT-USTGJSRQSA-N ATVXWIBQUWJBAT Phenylpropanoids and polyketides Cinnamic acids and derivatives Hydroxycinnamic acids and derivatives Monoterpenoids Iridoids monoterpenoids Terpenoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012445747 CCMSLIB00010110932 501 spectra_filtered.mgf BERKELEY-LAB.mgf 0.979989 5372000.0 0 378047.0 9 79.0425 288.124 1 temp/spectra_filtered.mgf501 1 """3,4-DIMETHOXYCINNAMIC ACID CollisionEnergy:102040""" LC-ESI Orbitrap Commercial Trent Northen JGI M+H 209.081 0.0 1 N/A N/A COc1ccc(C=CC(=O)O)cc1OC """InChI=1S/C11H12O4/c1-14-9-5-3-8(4-6-11(12)13)7-10(9)15-2/h3-7H,1-2H3,(H,12,13)/b6-4+""" N/A 3 Positive BERKELEY-LAB 209.081 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C11H12O4 HJBWJAPEBGSQPR-UHFFFAOYSA-N HJBWJAPEBGSQPR Phenylpropanoids and polyketides Cinnamic acids and derivatives Hydroxycinnamic acids and derivatives Phenylpropanoids (C6-C3) Cinnamic acids and derivatives Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00010110932 CCMSLIB00006121557 46 spectra_filtered.mgf BIRMINGHAM-UHPLC-MS-POS.mgf 0.977899 26381100.0 0 0.827643 10 0.000213623 258.11 1 temp/spectra_filtered.mgf46 1 L-alpha-Glycerylphosphorylcholine - 40.0 eV ESI Orbitrap Isolated PI Data Collector M+H 258.11 0.0 1 N/A C[N+](C)(C)CCOP(=O)([O-])OC[C@@H](CO)O InChI=1S/C8H20NO6P/c1-9(2,3)4-5-14-16(12,13)15-7-8(11)6-10/h8,10-11H,4-7H2,1-3H3/t8-/m1/s1 N/A 1 Positive BIRMINGHAM-UHPLC-MS-POS 258.11 UPDATE-SINGLE-ANNOTATED-GOLD Gold N/A SUHOQUVVVLNYQR-MRVPVSSYSA-N SUHOQUVVVLNYQR Lipids and lipid-like molecules Glycerophospholipids Glycerophosphocholines N/A N/A N/A mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00006121557 CCMSLIB00003136543 789 spectra_filtered.mgf GNPS-NIST14-MATCHES.mgf 0.977086 49208700.0 0 35633.8 6 28.0295 758.57 1 temp/spectra_filtered.mgf789 1 Spectral Match to 1-Stearoyl-2-linoleoyl-sn-glycero-3-phosphocholine from NIST14 ESI qTof Isolated Data from Pieter Dorrestein Data deposited by daniel M+H 786.599 785.594 1 27098244 N/A CCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCC/C=C\C/C=C\CCCCC InChI=1S/C44H84NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-43(46)50-40-42(41-52-54(48,49)51-39-38-45(3,4)5)53-44(47)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h15,17,21,23,42H,6-14,16,18-20,22,24-41H2,1-5H3/b17-15-,23-21-/t42-/m1/s1 N/A 3 Positive GNPS-NIST14-MATCHES 786.599 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze N/A FORFDCPQKJHEBF-VPUSDGANSA-N FORFDCPQKJHEBF Lipids and lipid-like molecules Glycerophospholipids Glycerophosphocholines N/A N/A N/A mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00003136543 CCMSLIB00010103189 594 spectra_filtered.mgf BERKELEY-LAB.mgf 0.976975 4683300.0 0 291525.0 8 213.281 518.325 1 temp/spectra_filtered.mgf594 1 Sphingomyelin (d18:1/18:0) CollisionEnergy:102040 LC-ESI Orbitrap Commercial Trent Northen JGI M 731.606 0.0 1 N/A N/A CCCCCCCCCCCCC/C=C/[C@@H](O)[C@H](COP(=O)(O)OCC[N+](C)(C)C)N=C(O)CCCCCCCCCCCCCCCCC """InChI=1S/C41H83N2O6P/c1-6-8-10-12-14-16-18-20-21-23-25-27-29-31-33-35-41(45)42-39(38-49-50(46,47)48-37-36-43(3,4)5)40(44)34-32-30-28-26-24-22-19-17-15-13-11-9-7-2/h32,34,39-40,44H,6-31,33,35-38H2,1-5H3,(H-,42,45,46,47)/p+1/b34-32+/t39-,40+/m0/s1""" N/A 3 Positive BERKELEY-LAB 731.606 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze N/A LKQLRGMMMAHREN-YJFXYUILSA-O LKQLRGMMMAHREN Lipids and lipid-like molecules Sphingolipids Phosphosphingolipids N/A N/A N/A mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00010103189 CCMSLIB00004720842 535 spectra_filtered.mgf MONA.mgf 0.975429 2729000.0 0 305069.0 8 97.0529 221.081 1 temp/spectra_filtered.mgf535 1 Piplartine N/A ESI-QFT isolated MoNA MoNA:VF-NPL-QEHF027261 [M+H]+ 318.134 0.0 1 N/A N/A COc1cc(/C=C/C(=O)N2CCC=CC2=O)cc(OC)c1OC InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+ N/A 3 positive MONA 318.134 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C17H19NO5 VABYUUZNAVQNPG-BQYQJAHWSA-N VABYUUZNAVQNPG N/A N/A N/A Lysine alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00004720842 CCMSLIB00003137017 757 spectra_filtered.mgf GNPS-NIST14-MATCHES.mgf 0.975046 96810900.0 0 69852.6 6 50.9637 780.554 1 temp/spectra_filtered.mgf757 1 Spectral Match to N-Oleoyl-D-erythro-sphingosylphosphorylcholine from NIST14 ESI qTof Isolated Data from Pieter Dorrestein Data deposited by daniel M+H 729.59 728.583 1 108392105 N/A CCCCCCCCCCCCC/C=C/[C@H]([C@H](COP(=O)([O-])OCC[N+](C)(C)C)NC(=O)CCCCCCC/C=C\CCCCCCCC)O InChI=1S/C41H81N2O6P/c1-6-8-10-12-14-16-18-20-21-23-25-27-29-31-33-35-41(45)42-39(38-49-50(46,47)48-37-36-43(3,4)5)40(44)34-32-30-28-26-24-22-19-17-15-13-11-9-7-2/h20-21,32,34,39-40,44H,6-19,22-31,33,35-38H2,1-5H3,(H-,42,45,46,47)/b21-20-,34-32+/t39-,40+/m0/s1 N/A 3 Positive GNPS-NIST14-MATCHES 729.59 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze N/A NBEADXWAAWCCDG-QDDWGVBQSA-N NBEADXWAAWCCDG Lipids and lipid-like molecules Sphingolipids Phosphosphingolipids N/A N/A N/A mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00003137017 CCMSLIB00005722482 337 spectra_filtered.mgf GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE.mgf 0.974384 34412400.0 0 0.58288 9 0.000183105 314.139 1 temp/spectra_filtered.mgf337 1 NCGC00169550-02!(E)-3-(4-hydroxy-3-methoxyphenyl)-N-[2-(4-hydroxyphenyl)ethyl]prop-2-enamide [IIN-based: Match] LC-ESI Orbitrap Commercial Pieter Dorrestein lfnothias/robinschmid [M+H]+ 314.139 313.132 1 N/A N/A COC1=C(O)C=CC(\\C=C\\C(=O)NCCC2=CC=C(O)C=C2)=C1 InChI=1S/C18H19NO4/c1-23-17-12-14(4-8-16(17)21)5-9-18(22)19-11-10-13-2-6-15(20)7-3-13/h2-9,12,20-21H,10-11H2,1H3,(H,19,22)/b9-5+ N/A 3 Positive GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE 314.139 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C18H19NO4 NPNNKDMSXVRADT-WEVVVXLNSA-N NPNNKDMSXVRADT Benzenoids Phenols Methoxyphenols Phenylpropanoids (C6-C3) Cinnamic acid amides Amino acids and Peptides|Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00005722482 CCMSLIB00003137788 788 spectra_filtered.mgf GNPS-NIST14-MATCHES.mgf 0.974338 2801600.0 0 1330.59 7 1.01202 759.573 1 temp/spectra_filtered.mgf788 1 Spectral Match to 1-Oleoyl-2-palmitoyl-sn-glycero-3-phosphocholine from NIST14 ESI qTof Isolated Data from James McKerrow Data deposited by daniel M+H 760.585 759.578 1 59491622 N/A CCCCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCC/C=C\CCCCCCCC)COP(=O)([O-])OCC[N+](C)(C)C InChI=1S/C42H82NO8P/c1-6-8-10-12-14-16-18-20-21-23-24-26-28-30-32-34-41(44)48-38-40(39-50-52(46,47)49-37-36-43(3,4)5)51-42(45)35-33-31-29-27-25-22-19-17-15-13-11-9-7-2/h20-21,40H,6-19,22-39H2,1-5H3/b21-20-/t40-/m1/s1 N/A 3 Positive GNPS-NIST14-MATCHES 760.585 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze N/A RRVPPYNAZJRZFR-VYOBOKEXSA-N RRVPPYNAZJRZFR Lipids and lipid-like molecules Glycerophospholipids Glycerophosphocholines N/A N/A N/A mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00003137788 CCMSLIB00004720842 386 spectra_filtered.mgf MONA.mgf 0.973917 84800000.0 0 305069.0 8 97.0529 221.081 1 temp/spectra_filtered.mgf386 1 Piplartine N/A ESI-QFT isolated MoNA MoNA:VF-NPL-QEHF027261 [M+H]+ 318.134 0.0 1 N/A N/A COc1cc(/C=C/C(=O)N2CCC=CC2=O)cc(OC)c1OC InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+ N/A 3 positive MONA 318.134 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C17H19NO5 VABYUUZNAVQNPG-BQYQJAHWSA-N VABYUUZNAVQNPG N/A N/A N/A Lysine alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00004720842 CCMSLIB00003140032 615 spectra_filtered.mgf GNPS-NIST14-MATCHES.mgf 0.973817 5124400.0 0 48357.1 11 24.0015 520.341 1 temp/spectra_filtered.mgf615 1 Spectral Match to Lyso-PC(16:0) from NIST14 ESI qTof Isolated Data from Julia Gauglitz Data deposited by fevargas M+H 496.339 495.332 1 17364168 N/A CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)O InChI=1S/C24H50NO7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-24(27)30-21-23(26)22-32-33(28,29)31-20-19-25(2,3)4/h23,26H,5-22H2,1-4H3/t23-/m1/s1 N/A 3 Positive GNPS-NIST14-MATCHES 496.339 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze N/A ASWBNKHCZGQVJV-HSZRJFAPSA-N ASWBNKHCZGQVJV Lipids and lipid-like molecules Glycerophospholipids Glycerophosphocholines N/A N/A N/A mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00003140032 CCMSLIB00004720842 445 spectra_filtered.mgf MONA.mgf 0.973791 1249000000.0 0 305070.0 8 97.053 221.081 1 temp/spectra_filtered.mgf445 1 Piplartine N/A ESI-QFT isolated MoNA MoNA:VF-NPL-QEHF027261 [M+H]+ 318.134 0.0 1 N/A N/A COc1cc(/C=C/C(=O)N2CCC=CC2=O)cc(OC)c1OC InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+ N/A 3 positive MONA 318.134 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C17H19NO5 VABYUUZNAVQNPG-BQYQJAHWSA-N VABYUUZNAVQNPG N/A N/A N/A Lysine alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00004720842 CCMSLIB00005766805 519 spectra_filtered.mgf MASSBANK.mgf 0.973185 4372400.0 0 92722.8 9 28.0306 274.274 1 temp/spectra_filtered.mgf519 1 Massbank:LU100203 2,2'-(Tetradecylimino)diethanol|Tetradecyldiethanolamine ESI Hybrid FT Isolated Massbank Massbank M+H 302.305 0.0 1 18924-66-8 N/A CCCCCCCCCCCCCCN(CCO)CCO 1S/C18H39NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-19(15-17-20)16-18-21/h20-21H,2-18H2,1H3 N/A 3 Positive MASSBANK 302.305 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C18H39NO2 CPHJEACXPATRSU-UHFFFAOYSA-N CPHJEACXPATRSU Organic nitrogen compounds Organonitrogen compounds Amines Fatty acyls|Fatty amides Fatty alcohols|N-acyl ethanolamines (endocannabinoids) Fatty acids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00005766805 CCMSLIB00010110411 356 spectra_filtered.mgf BERKELEY-LAB.mgf 0.971912 6809300.0 0 158881.0 7 64.0499 467.182 1 temp/spectra_filtered.mgf356 1 """(2E)-N-{[(4-methoxyphenyl)amino]thioxomethyl}-3-(3,4,5-trimethoxyphenyl)prop-2 -enamide CollisionEnergy:102040""" LC-ESI Orbitrap Commercial Trent Northen JGI M+H 403.132 0.0 1 N/A N/A COc1ccc(NC(=S)N=C(O)C=Cc2cc(OC)c(OC)c(OC)c2)cc1 """InChI=1S/C20H22N2O5S/c1-24-15-8-6-14(7-9-15)21-20(28)22-18(23)10-5-13-11-16(25-2)19(27-4)17(12-13)26-3/h5-12H,1-4H3,(H2,21,22,23,28)/b10-5+""" N/A 3 Positive BERKELEY-LAB 403.132 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C20H22N2O5S VUGRMQHRMVCMQQ-UHFFFAOYSA-N VUGRMQHRMVCMQQ Benzenoids Benzene and substituted derivatives N-phenylthioureas Phenylpropanoids (C6-C3) Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00010110411 CCMSLIB00004720841 387 spectra_filtered.mgf MONA.mgf 0.971754 457519000.0 0 0.575561 7 0.000183105 318.134 1 temp/spectra_filtered.mgf387 1 Piplartine N/A ESI-QFT isolated MoNA MoNA:VF-NPL-QEHF027260 [M+H]+ 318.134 0.0 1 N/A N/A COc1cc(/C=C/C(=O)N2CCC=CC2=O)cc(OC)c1OC InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+ N/A 3 positive MONA 318.134 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C17H19NO5 VABYUUZNAVQNPG-BQYQJAHWSA-N VABYUUZNAVQNPG N/A N/A N/A Lysine alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00004720841 CCMSLIB00004720840 427 spectra_filtered.mgf MONA.mgf 0.971734 2992800.0 0 87886.9 8 27.9598 346.094 1 temp/spectra_filtered.mgf427 1 Piplartine N/A ESI-QFT isolated MoNA MoNA:VF-NPL-QEHF027259 [M+H]+ 318.134 0.0 1 N/A N/A COc1cc(/C=C/C(=O)N2CCC=CC2=O)cc(OC)c1OC InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+ N/A 3 positive MONA 318.134 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C17H19NO5 VABYUUZNAVQNPG-BQYQJAHWSA-N VABYUUZNAVQNPG N/A N/A N/A Lysine alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00004720840 CCMSLIB00004720841 452 spectra_filtered.mgf MONA.mgf 0.971726 7631750000.0 0 0.575561 7 0.000183105 318.134 1 temp/spectra_filtered.mgf452 1 Piplartine N/A ESI-QFT isolated MoNA MoNA:VF-NPL-QEHF027260 [M+H]+ 318.134 0.0 1 N/A N/A COc1cc(/C=C/C(=O)N2CCC=CC2=O)cc(OC)c1OC InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+ N/A 3 positive MONA 318.134 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C17H19NO5 VABYUUZNAVQNPG-BQYQJAHWSA-N VABYUUZNAVQNPG N/A N/A N/A Lysine alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00004720841 CCMSLIB00004720841 534 spectra_filtered.mgf MONA.mgf 0.97046 18116600.0 0 0.28778 7 9.15527e-05 318.134 1 temp/spectra_filtered.mgf534 1 Piplartine N/A ESI-QFT isolated MoNA MoNA:VF-NPL-QEHF027260 [M+H]+ 318.134 0.0 1 N/A N/A COc1cc(/C=C/C(=O)N2CCC=CC2=O)cc(OC)c1OC InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+ N/A 3 positive MONA 318.134 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C17H19NO5 VABYUUZNAVQNPG-BQYQJAHWSA-N VABYUUZNAVQNPG N/A N/A N/A Lysine alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00004720841 CCMSLIB00012448585 146 spectra_filtered.mgf MSNLIB-POSITIVE.mgf 0.970287 3295900.0 0 495617.0 6 333.179 339.071 1 temp/spectra_filtered.mgf146 1 Saccatoside ESI Orbitrap Crude Tomas Pluskal Corinna Brungs [M+NH4]+ 672.25 654.216 1 N/A N/A C[C@@H]1O[C@@H](O[C@H]2[C@@H]3C=CO[C@@H](O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H]3[C@@]3(CO)O[C@@H]23)[C@H](OC(=O)/C=C/c2ccc(O)cc2)[C@H](O)[C@H]1O InChI=1S/C30H38O16/c1-12-19(35)22(38)25(43-17(34)7-4-13-2-5-14(33)6-3-13)29(41-12)44-24-15-8-9-40-27(18(15)30(11-32)26(24)46-30)45-28-23(39)21(37)20(36)16(10-31)42-28/h2-9,12,15-16,18-29,31-33,35-39H,10-11H2,1H3/b7-4+/t12-,15+,16+,18+,19-,20+,21-,22+,23+,24-,25+,26-,27-,28-,29-,30+/m0/s1 XIPQZLUSSJDAIC-UYESFEPRSA-N 1 Positive MSNLIB-POSITIVE 672.25 UPDATE-SINGLE-ANNOTATED-GOLD Gold C30H38O16 XIPQZLUSSJDAIC-UYESFEPRSA-N XIPQZLUSSJDAIC Phenylpropanoids and polyketides Cinnamic acids and derivatives Hydroxycinnamic acids and derivatives Monoterpenoids Iridoids monoterpenoids Terpenoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012448585 CCMSLIB00004700079 300 spectra_filtered.mgf MONA.mgf 0.970123 1501000.0 0 101866.0 10 44.0251 388.161 1 temp/spectra_filtered.mgf300 1 3-oxo-3-[[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(4-hydroxy-5-methyl-2-propan-2-ylphenoxy)oxan-2-yl]methoxy]propanoic acid N/A ESI-QFT isolated MoNA MoNA:VF-NPL-QEHF009016 [M+NH4]+ 432.186 0.0 1 N/A N/A Cc1cc(O[C@@H]2O[C@H](COC(=O)CC(=O)O)[C@@H](O)[C@H](O)[C@H]2O)c(C(C)C)cc1O InChI=1S/C19H26O10/c1-8(2)10-5-11(20)9(3)4-12(10)28-19-18(26)17(25)16(24)13(29-19)7-27-15(23)6-14(21)22/h4-5,8,13,16-20,24-26H,6-7H2,1-3H3,(H,21,22)/t13-,16-,17+,18-,19-/m1/s1 N/A 3 positive MONA 432.186 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C19H26O10 VJVGTGQETNCOEX-LQDZTQBFSA-N VJVGTGQETNCOEX Lipids and lipid-like molecules Prenol lipids Terpene glycosides Monoterpenoids Menthane monoterpenoids Terpenoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00004700079 CCMSLIB00012447737 408 spectra_filtered.mgf MSNLIB-POSITIVE.mgf 0.969968 4728400.0 0 462886.0 7 262.09 304.118 1 temp/spectra_filtered.mgf408 1 Sibiricose A6 ESI Orbitrap Crude Tomas Pluskal Corinna Brungs [M+NH4]+ 566.208 548.174 1 N/A N/A COc1cc(/C=C/C(=O)O[C@H]2[C@H](O)[C@@H](CO)O[C@@]2(CO)O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O InChI=1S/C23H32O15/c1-33-11-5-10(6-12(34-2)16(11)28)3-4-15(27)36-21-18(30)14(8-25)37-23(21,9-26)38-22-20(32)19(31)17(29)13(7-24)35-22/h3-6,13-14,17-22,24-26,28-32H,7-9H2,1-2H3/b4-3+/t13-,14-,17-,18-,19+,20-,21+,22-,23+/m1/s1 WTCVROXOIQEIRC-IBVGEFGBSA-N 1 Positive MSNLIB-POSITIVE 566.208 UPDATE-SINGLE-ANNOTATED-GOLD Gold C23H32O15 WTCVROXOIQEIRC-IBVGEFGBSA-N WTCVROXOIQEIRC Phenylpropanoids and polyketides Cinnamic acids and derivatives Hydroxycinnamic acids and derivatives Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012447737 CCMSLIB00004720841 511 spectra_filtered.mgf MONA.mgf 0.969703 101423000.0 0 0.28778 7 9.15527e-05 318.134 1 temp/spectra_filtered.mgf511 1 Piplartine N/A ESI-QFT isolated MoNA MoNA:VF-NPL-QEHF027260 [M+H]+ 318.134 0.0 1 N/A N/A COc1cc(/C=C/C(=O)N2CCC=CC2=O)cc(OC)c1OC InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+ N/A 3 positive MONA 318.134 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C17H19NO5 VABYUUZNAVQNPG-BQYQJAHWSA-N VABYUUZNAVQNPG N/A N/A N/A Lysine alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00004720841 CCMSLIB00004720841 400 spectra_filtered.mgf MONA.mgf 0.968293 10167500.0 0 6336.64 7 2.0159 320.15 1 temp/spectra_filtered.mgf400 1 Piplartine N/A ESI-QFT isolated MoNA MoNA:VF-NPL-QEHF027260 [M+H]+ 318.134 0.0 1 N/A N/A COc1cc(/C=C/C(=O)N2CCC=CC2=O)cc(OC)c1OC InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+ N/A 3 positive MONA 318.134 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C17H19NO5 VABYUUZNAVQNPG-BQYQJAHWSA-N VABYUUZNAVQNPG N/A N/A N/A Lysine alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00004720841 CCMSLIB00004720841 463 spectra_filtered.mgf MONA.mgf 0.96828 177915000.0 0 6335.97 7 2.01569 320.15 1 temp/spectra_filtered.mgf463 1 Piplartine N/A ESI-QFT isolated MoNA MoNA:VF-NPL-QEHF027260 [M+H]+ 318.134 0.0 1 N/A N/A COc1cc(/C=C/C(=O)N2CCC=CC2=O)cc(OC)c1OC InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+ N/A 3 positive MONA 318.134 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C17H19NO5 VABYUUZNAVQNPG-BQYQJAHWSA-N VABYUUZNAVQNPG N/A N/A N/A Lysine alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00004720841 CCMSLIB00012294315 154 spectra_filtered.mgf MSNLIB-POSITIVE.mgf 0.967859 2381700.0 0 150917.0 6 52.9926 298.144 1 temp/spectra_filtered.mgf154 1 PF-9366 ESI Orbitrap Crude Tomas Pluskal Corinna Brungs [M+H]+ 351.137 350.13 1 N/A N/A CN(C)CCc1nnc2cc(-c3ccccc3)c3c(ccc(Cl)c3)n12 InChI=1S/C20H19ClN4/c1-24(2)11-10-19-22-23-20-13-16(14-6-4-3-5-7-14)17-12-15(21)8-9-18(17)25(19)20/h3-9,12-13H,10-11H2,1-2H3 LYLASWLQCMKZAT-UHFFFAOYSA-N 1 Positive MSNLIB-POSITIVE 351.137 UPDATE-SINGLE-ANNOTATED-GOLD Gold C20H19ClN4 LYLASWLQCMKZAT-UHFFFAOYSA-N LYLASWLQCMKZAT Organoheterocyclic compounds Quinolines and derivatives Phenylquinolines Tyrosine alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012294315 CCMSLIB00012359145 42 spectra_filtered.mgf MSNLIB-POSITIVE.mgf 0.966504 12684300.0 0 404565.0 6 197.09 684.256 1 temp/spectra_filtered.mgf42 1 Manninotriose ESI Orbitrap Crude Tomas Pluskal Corinna Brungs [M+H-H2O]+ 487.166 504.169 1 N/A N/A O=C[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO[C@H]1O[C@H](CO[C@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O InChI=1S/C18H32O16/c19-1-5(21)9(23)10(24)6(22)3-31-17-16(30)14(28)12(26)8(34-17)4-32-18-15(29)13(27)11(25)7(2-20)33-18/h1,5-18,20-30H,2-4H2/t5-,6+,7+,8+,9+,10+,11-,12-,13-,14-,15+,16+,17-,18-/m0/s1 FZWBNHMXJMCXLU-YRBKNLIBSA-N 1 Positive MSNLIB-POSITIVE 487.166 UPDATE-SINGLE-ANNOTATED-GOLD Gold C18H32O16 FZWBNHMXJMCXLU-YRBKNLIBSA-N FZWBNHMXJMCXLU Lipids and lipid-like molecules Fatty Acyls Fatty acyl glycosides Saccharides Disaccharides|Polysaccharides Carbohydrates mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012359145 CCMSLIB00004720841 352 spectra_filtered.mgf MONA.mgf 0.966173 20161900.0 0 50277.8 6 15.9951 334.129 1 temp/spectra_filtered.mgf352 1 Piplartine N/A ESI-QFT isolated MoNA MoNA:VF-NPL-QEHF027260 [M+H]+ 318.134 0.0 1 N/A N/A COc1cc(/C=C/C(=O)N2CCC=CC2=O)cc(OC)c1OC InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+ N/A 3 positive MONA 318.134 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C17H19NO5 VABYUUZNAVQNPG-BQYQJAHWSA-N VABYUUZNAVQNPG N/A N/A N/A Lysine alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00004720841 CCMSLIB00012448585 128 spectra_filtered.mgf MSNLIB-POSITIVE.mgf 0.965577 4904600.0 0 443498.0 6 298.141 374.109 1 temp/spectra_filtered.mgf128 1 Saccatoside ESI Orbitrap Crude Tomas Pluskal Corinna Brungs [M+NH4]+ 672.25 654.216 1 N/A N/A C[C@@H]1O[C@@H](O[C@H]2[C@@H]3C=CO[C@@H](O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H]3[C@@]3(CO)O[C@@H]23)[C@H](OC(=O)/C=C/c2ccc(O)cc2)[C@H](O)[C@H]1O InChI=1S/C30H38O16/c1-12-19(35)22(38)25(43-17(34)7-4-13-2-5-14(33)6-3-13)29(41-12)44-24-15-8-9-40-27(18(15)30(11-32)26(24)46-30)45-28-23(39)21(37)20(36)16(10-31)42-28/h2-9,12,15-16,18-29,31-33,35-39H,10-11H2,1H3/b7-4+/t12-,15+,16+,18+,19-,20+,21-,22+,23+,24-,25+,26-,27-,28-,29-,30+/m0/s1 XIPQZLUSSJDAIC-UYESFEPRSA-N 1 Positive MSNLIB-POSITIVE 672.25 UPDATE-SINGLE-ANNOTATED-GOLD Gold C30H38O16 XIPQZLUSSJDAIC-UYESFEPRSA-N XIPQZLUSSJDAIC Phenylpropanoids and polyketides Cinnamic acids and derivatives Hydroxycinnamic acids and derivatives Monoterpenoids Iridoids monoterpenoids Terpenoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012448585 CCMSLIB00003139970 608 spectra_filtered.mgf GNPS-NIST14-MATCHES.mgf 0.964801 6509700.0 0 149732.0 12 46.0069 353.269 1 temp/spectra_filtered.mgf608 1 Spectral Match to cis-5,8,11-Eicosatrienoic acid from NIST14 ESI qTof Isolated Data from Wolfender/Litaudon Data deposited by pmallard M+H 307.262 306.256 1 20590323 N/A CCCCCCCC/C=C\C/C=C\C/C=C\CCCC(=O)O InChI=1S/C20H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h9-10,12-13,15-16H,2-8,11,14,17-19H2,1H3,(H,21,22)/b10-9-,13-12-,16-15- N/A 3 Positive GNPS-NIST14-MATCHES 307.262 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C20H34O2 UNSRRHDPHVZAHH-YOILPLPUSA-N UNSRRHDPHVZAHH Lipids and lipid-like molecules Fatty Acyls Fatty acids and conjugates Fatty Acids and Conjugates Unsaturated fatty acids Fatty acids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00003139970 CCMSLIB00003137788 731 spectra_filtered.mgf GNPS-NIST14-MATCHES.mgf 0.96232 4009400.0 0 30223.9 7 22.9879 783.573 1 temp/spectra_filtered.mgf731 1 Spectral Match to 1-Oleoyl-2-palmitoyl-sn-glycero-3-phosphocholine from NIST14 ESI qTof Isolated Data from James McKerrow Data deposited by daniel M+H 760.585 759.578 1 59491622 N/A CCCCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCC/C=C\CCCCCCCC)COP(=O)([O-])OCC[N+](C)(C)C InChI=1S/C42H82NO8P/c1-6-8-10-12-14-16-18-20-21-23-24-26-28-30-32-34-41(44)48-38-40(39-50-52(46,47)49-37-36-43(3,4)5)51-42(45)35-33-31-29-27-25-22-19-17-15-13-11-9-7-2/h20-21,40H,6-19,22-39H2,1-5H3/b21-20-/t40-/m1/s1 N/A 3 Positive GNPS-NIST14-MATCHES 760.585 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze N/A RRVPPYNAZJRZFR-VYOBOKEXSA-N RRVPPYNAZJRZFR Lipids and lipid-like molecules Glycerophospholipids Glycerophosphocholines N/A N/A N/A mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00003137788 CCMSLIB00010122956 631 spectra_filtered.mgf BERKELEY-LAB.mgf 0.96212 24254000.0 0 1.93342 7 0.000396729 205.195 1 temp/spectra_filtered.mgf631 1 Bisabolol CollisionEnergy:205060 LC-ESI Orbitrap Commercial Trent Northen JGI M+H-H2O 205.195 0.0 1 N/A N/A CC(C)=CCCC(C)(O)C1CC=C(C)CC1 """InChI=1S/C15H26O/c1-12(2)6-5-11-15(4,16)14-9-7-13(3)8-10-14/h6-7,14,16H,5,8-11H2,1-4H3""" N/A 3 Positive BERKELEY-LAB 205.195 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C15H26O RGZSQWQPBWRIAQ-UHFFFAOYSA-N RGZSQWQPBWRIAQ Lipids and lipid-like molecules Prenol lipids Sesquiterpenoids Sesquiterpenoids Bisabolane sesquiterpenoids Terpenoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00010122956 CCMSLIB00012344200 53 spectra_filtered.mgf MSNLIB-POSITIVE.mgf 0.961768 4427700.0 0 524866.0 8 359.142 325.113 1 temp/spectra_filtered.mgf53 1 Stachyose ESI Orbitrap Crude Tomas Pluskal Corinna Brungs [M+NH4]+ 684.256 666.222 1 N/A N/A OC[C@H]1O[C@H](OC[C@H]2O[C@H](OC[C@H]3O[C@H](O[C@]4(CO)O[C@H](CO)[C@@H](O)[C@@H]4O)[C@H](O)[C@@H](O)[C@@H]3O)[C@H](O)[C@@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@H]1O InChI=1S/C24H42O21/c25-1-6-10(28)14(32)17(35)21(41-6)39-3-8-11(29)15(33)18(36)22(42-8)40-4-9-12(30)16(34)19(37)23(43-9)45-24(5-27)20(38)13(31)7(2-26)44-24/h6-23,25-38H,1-5H2/t6-,7-,8-,9-,10+,11+,12-,13-,14+,15+,16+,17-,18-,19-,20+,21+,22+,23-,24+/m1/s1 UQZIYBXSHAGNOE-XNSRJBNMSA-N 1 Positive MSNLIB-POSITIVE 684.256 UPDATE-SINGLE-ANNOTATED-GOLD Gold C24H42O21 UQZIYBXSHAGNOE-XNSRJBNMSA-N UQZIYBXSHAGNOE Organic oxygen compounds Organooxygen compounds Carbohydrates and carbohydrate conjugates Saccharides Polysaccharides Carbohydrates mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012344200 CCMSLIB00010122956 660 spectra_filtered.mgf BERKELEY-LAB.mgf 0.96168 153400000.0 0 1.93342 7 0.000396729 205.195 1 temp/spectra_filtered.mgf660 1 Bisabolol CollisionEnergy:205060 LC-ESI Orbitrap Commercial Trent Northen JGI M+H-H2O 205.195 0.0 1 N/A N/A CC(C)=CCCC(C)(O)C1CC=C(C)CC1 """InChI=1S/C15H26O/c1-12(2)6-5-11-15(4,16)14-9-7-13(3)8-10-14/h6-7,14,16H,5,8-11H2,1-4H3""" N/A 3 Positive BERKELEY-LAB 205.195 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C15H26O RGZSQWQPBWRIAQ-UHFFFAOYSA-N RGZSQWQPBWRIAQ Lipids and lipid-like molecules Prenol lipids Sesquiterpenoids Sesquiterpenoids Bisabolane sesquiterpenoids Terpenoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00010122956 CCMSLIB00010122956 680 spectra_filtered.mgf BERKELEY-LAB.mgf 0.961633 52170000.0 0 1.93342 7 0.000396729 205.195 1 temp/spectra_filtered.mgf680 1 Bisabolol CollisionEnergy:205060 LC-ESI Orbitrap Commercial Trent Northen JGI M+H-H2O 205.195 0.0 1 N/A N/A CC(C)=CCCC(C)(O)C1CC=C(C)CC1 """InChI=1S/C15H26O/c1-12(2)6-5-11-15(4,16)14-9-7-13(3)8-10-14/h6-7,14,16H,5,8-11H2,1-4H3""" N/A 3 Positive BERKELEY-LAB 205.195 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C15H26O RGZSQWQPBWRIAQ-UHFFFAOYSA-N RGZSQWQPBWRIAQ Lipids and lipid-like molecules Prenol lipids Sesquiterpenoids Sesquiterpenoids Bisabolane sesquiterpenoids Terpenoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00010122956 CCMSLIB00003139970 590 spectra_filtered.mgf GNPS-NIST14-MATCHES.mgf 0.960558 2659400.0 0 149732.0 12 46.0069 353.269 1 temp/spectra_filtered.mgf590 1 Spectral Match to cis-5,8,11-Eicosatrienoic acid from NIST14 ESI qTof Isolated Data from Wolfender/Litaudon Data deposited by pmallard M+H 307.262 306.256 1 20590323 N/A CCCCCCCC/C=C\C/C=C\C/C=C\CCCC(=O)O InChI=1S/C20H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h9-10,12-13,15-16H,2-8,11,14,17-19H2,1H3,(H,21,22)/b10-9-,13-12-,16-15- N/A 3 Positive GNPS-NIST14-MATCHES 307.262 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C20H34O2 UNSRRHDPHVZAHH-YOILPLPUSA-N UNSRRHDPHVZAHH Lipids and lipid-like molecules Fatty Acyls Fatty acids and conjugates Fatty Acids and Conjugates Unsaturated fatty acids Fatty acids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00003139970 CCMSLIB00010122956 667 spectra_filtered.mgf BERKELEY-LAB.mgf 0.959926 116670000.0 0 1.93342 7 0.000396729 205.195 1 temp/spectra_filtered.mgf667 1 Bisabolol CollisionEnergy:205060 LC-ESI Orbitrap Commercial Trent Northen JGI M+H-H2O 205.195 0.0 1 N/A N/A CC(C)=CCCC(C)(O)C1CC=C(C)CC1 """InChI=1S/C15H26O/c1-12(2)6-5-11-15(4,16)14-9-7-13(3)8-10-14/h6-7,14,16H,5,8-11H2,1-4H3""" N/A 3 Positive BERKELEY-LAB 205.195 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C15H26O RGZSQWQPBWRIAQ-UHFFFAOYSA-N RGZSQWQPBWRIAQ Lipids and lipid-like molecules Prenol lipids Sesquiterpenoids Sesquiterpenoids Bisabolane sesquiterpenoids Terpenoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00010122956 CCMSLIB00003137839 639 spectra_filtered.mgf GNPS-NIST14-MATCHES.mgf 0.958658 2612300.0 0 53453.6 10 28.0295 496.341 1 temp/spectra_filtered.mgf639 1 Spectral Match to 1-Stearoyl-2-hydroxy-sn-glycero-3-phosphocholine from NIST14 ESI HCD Isolated Data from Joshua Wollam Data deposited by fevargas M+H 524.37 0.0 1 19420576 N/A N/A N/A N/A 3 Positive GNPS-NIST14-MATCHES 524.37 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze N/A N/A N/A N/A N/A N/A N/A N/A N/A mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00003137839 CCMSLIB00006113011 51 spectra_filtered.mgf BIRMINGHAM-UHPLC-MS-POS.mgf 0.956976 1644500.0 0 0.467636 7 0.00012207 261.037 1 temp/spectra_filtered.mgf51 1 Cori ester (alpha-anomer) - 40.0 eV ESI Orbitrap Isolated PI Data Collector M+H 261.037 0.0 1 N/A C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)OP(=O)(O)O)O)O)O)O InChI=1S/C6H13O9P/c7-1-2-3(8)4(9)5(10)6(14-2)15-16(11,12)13/h2-10H,1H2,(H2,11,12,13)/t2-,3-,4+,5-,6-/m1/s1 N/A 1 Positive BIRMINGHAM-UHPLC-MS-POS 261.037 UPDATE-SINGLE-ANNOTATED-GOLD Gold C6H13O9P HXXFSFRBOHSIMQ-VFUOTHLCSA-N HXXFSFRBOHSIMQ Organic oxygen compounds Organooxygen compounds Carbohydrates and carbohydrate conjugates Saccharides Monosaccharides Carbohydrates mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00006113011 CCMSLIB00010102268 347 spectra_filtered.mgf BERKELEY-LAB.mgf 0.956791 1449000.0 0 3.06345 10 0.000701904 229.123 1 temp/spectra_filtered.mgf347 1 abscisic acid CollisionEnergy:205060 LC-ESI Orbitrap Commercial Trent Northen JGI M-2H2O+H 229.122 264.136 1 N/A N/A CC1=CC(=O)CC([C@]1(/C=C/C(=C\C(=O)O)/C)O)(C)C """InChI=1S/C15H20O4/c1-10(7-13(17)18)5-6-15(19)11(2)8-12(16)9-14(15,3)4/h5-8,19H,9H2,1-4H3,(H,17,18)/b6-5+,10-7-/t15-/m1/s1""" N/A 3 Positive BERKELEY-LAB 229.122 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C15H20O4 JLIDBLDQVAYHNE-YKALOCIXSA-N JLIDBLDQVAYHNE Lipids and lipid-like molecules Prenol lipids Sesquiterpenoids Apocarotenoids Apocarotenoids(ε-) Terpenoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00010102268 CCMSLIB00005436078 279 spectra_filtered.mgf GNPS-LIBRARY.mgf 0.956613 14264900.0 0 16.8449 6 0.0045166 268.134 1 temp/spectra_filtered.mgf279 1 Asimilobine LC-ESI qTof Crude KOOLEN/ANGOLINI ANGOLINI M+H 268.129 0.0 1 3 Positive GNPS-LIBRARY 268.129 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze N/A N/A N/A N/A N/A N/A N/A N/A N/A mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00005436078 CCMSLIB00003136237 188 spectra_filtered.mgf GNPS-NIST14-MATCHES.mgf 0.956027 26402500.0 0 0.632325 13 0.000366211 579.15 1 temp/spectra_filtered.mgf188 1 Spectral Match to Procyanidin B2 from NIST14 ESI qTof Isolated Data from System Wide MS course Data deposited by daniel M+H 579.15 578.142 1 15514064 N/A C1[C@H]([C@H](OC2=C1C(=CC(=C2[C@@H]3[C@H]([C@H](OC4=CC(=CC(=C34)O)O)C5=CC(=C(C=C5)O)O)O)O)O)C6=CC(=C(C=C6)O)O)O InChI=1S/C30H26O12/c31-13-7-20(37)24-23(8-13)41-29(12-2-4-16(33)19(36)6-12)27(40)26(24)25-21(38)10-17(34)14-9-22(39)28(42-30(14)25)11-1-3-15(32)18(35)5-11/h1-8,10,22,26-29,31-40H,9H2/t22-,26-,27-,28-,29-/m1/s1 N/A 3 Positive GNPS-NIST14-MATCHES 579.15 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C30H26O12 XFZJEEAOWLFHDH-NFJBMHMQSA-N XFZJEEAOWLFHDH Phenylpropanoids and polyketides Flavonoids Biflavonoids and polyflavonoids Flavonoids Proanthocyanins Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00003136237 CCMSLIB00010122956 868 spectra_filtered.mgf BERKELEY-LAB.mgf 0.955838 12755000.0 0 1.93342 7 0.000396729 205.195 1 temp/spectra_filtered.mgf868 1 Bisabolol CollisionEnergy:205060 LC-ESI Orbitrap Commercial Trent Northen JGI M+H-H2O 205.195 0.0 1 N/A N/A CC(C)=CCCC(C)(O)C1CC=C(C)CC1 """InChI=1S/C15H26O/c1-12(2)6-5-11-15(4,16)14-9-7-13(3)8-10-14/h6-7,14,16H,5,8-11H2,1-4H3""" N/A 3 Positive BERKELEY-LAB 205.195 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C15H26O RGZSQWQPBWRIAQ-UHFFFAOYSA-N RGZSQWQPBWRIAQ Lipids and lipid-like molecules Prenol lipids Sesquiterpenoids Sesquiterpenoids Bisabolane sesquiterpenoids Terpenoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00010122956 CCMSLIB00005724962 202 spectra_filtered.mgf GNPS-LIBRARY.mgf 0.955722 102200000.0 0 0.95986 11 0.000274658 286.144 1 temp/spectra_filtered.mgf202 1 1-[(4-hydroxyphenyl)methyl]-6-methoxy-1,2,3,4-tetrahydroisoquinolin-7-ol ESI Orbitrap Isolated Wolfender Luis Quiros-Guerrero M+H 286.144 285.137 1 N/A N/A COc(cc(CCNC1Cc(cc2)ccc2O)c1c1)c1O InChI=1S/C17H19NO3/c1-21-17-9-12-6-7-18-15(14(12)10-16(17)20)8-11-2-4-13(19)5-3-11/h2-5,9-10,15,18-20H,6-8H2,1H3/t15-/m0/s1 N/A 1 Positive GNPS-LIBRARY 286.144 UPDATE-SINGLE-ANNOTATED-GOLD Gold C17H19NO3 LVVKXRQZSRUVPY-UHFFFAOYSA-N LVVKXRQZSRUVPY Organoheterocyclic compounds Isoquinolines and derivatives Benzylisoquinolines Tyrosine alkaloids Isoquinoline alkaloids|Tetrahydroisoquinoline alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00005724962 CCMSLIB00005436045 190 spectra_filtered.mgf GNPS-LIBRARY.mgf 0.954755 5582400.0 0 48981.3 12 14.0157 272.128 1 temp/spectra_filtered.mgf190 1 Coclaurine LC-ESI qTof Crude KOOLEN/ANGOLINI ANGOLINI M+H 286.144 285.137 1 OC1=C(OC)C=C2C([C@@](CC3=CC=C(O)C=C3)([H])NCC2)=C1 InChI=1S/C17H19NO3/c1-21-17-9-12-6-7-18-15(14(12)10-16(17)20)8-11-2-4-13(19)5-3-11/h2-5,9-10,15,18-20H,6-8H2,1H3/t15-/m0/s1 3 Positive GNPS-LIBRARY 286.144 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C17H19NO3 LVVKXRQZSRUVPY-HNNXBMFYSA-N LVVKXRQZSRUVPY Organoheterocyclic compounds Isoquinolines and derivatives Benzylisoquinolines Tyrosine alkaloids Isoquinoline alkaloids|Tetrahydroisoquinoline alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00005436045 CCMSLIB00006112954 45 spectra_filtered.mgf BIRMINGHAM-UHPLC-MS-POS.mgf 0.954748 1369300.0 0 472286.0 10 162.053 505.177 1 temp/spectra_filtered.mgf45 1 beta-Lactose - 40.0 eV ESI Orbitrap Isolated PI Data Collector M+H 343.124 0.0 1 N/A C([C@@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)O[C@@H]2[C@H](O[C@H]([C@@H]([C@H]2O)O)O)CO)O)O)O)O InChI=1S/C12H22O11/c13-1-3-5(15)6(16)9(19)12(22-3)23-10-4(2-14)21-11(20)8(18)7(10)17/h3-20H,1-2H2/t3-,4-,5+,6+,7-,8-,9-,10-,11-,12+/m1/s1 N/A 1 Positive BIRMINGHAM-UHPLC-MS-POS 343.124 UPDATE-SINGLE-ANNOTATED-GOLD Gold C12H22O11 GUBGYTABKSRVRQ-DCSYEGIMSA-N GUBGYTABKSRVRQ Organic oxygen compounds Organooxygen compounds Carbohydrates and carbohydrate conjugates Saccharides Disaccharides|Polysaccharides Carbohydrates mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00006112954 CCMSLIB00010122956 640 spectra_filtered.mgf BERKELEY-LAB.mgf 0.95438 1819000.0 0 1.93342 7 0.000396729 205.195 1 temp/spectra_filtered.mgf640 1 Bisabolol CollisionEnergy:205060 LC-ESI Orbitrap Commercial Trent Northen JGI M+H-H2O 205.195 0.0 1 N/A N/A CC(C)=CCCC(C)(O)C1CC=C(C)CC1 """InChI=1S/C15H26O/c1-12(2)6-5-11-15(4,16)14-9-7-13(3)8-10-14/h6-7,14,16H,5,8-11H2,1-4H3""" N/A 3 Positive BERKELEY-LAB 205.195 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C15H26O RGZSQWQPBWRIAQ-UHFFFAOYSA-N RGZSQWQPBWRIAQ Lipids and lipid-like molecules Prenol lipids Sesquiterpenoids Sesquiterpenoids Bisabolane sesquiterpenoids Terpenoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00010122956 CCMSLIB00005436045 270 spectra_filtered.mgf GNPS-LIBRARY.mgf 0.953892 67868000.0 0 0.639907 12 0.000183105 286.144 1 temp/spectra_filtered.mgf270 1 Coclaurine LC-ESI qTof Crude KOOLEN/ANGOLINI ANGOLINI M+H 286.144 285.137 1 OC1=C(OC)C=C2C([C@@](CC3=CC=C(O)C=C3)([H])NCC2)=C1 InChI=1S/C17H19NO3/c1-21-17-9-12-6-7-18-15(14(12)10-16(17)20)8-11-2-4-13(19)5-3-11/h2-5,9-10,15,18-20H,6-8H2,1H3/t15-/m0/s1 3 Positive GNPS-LIBRARY 286.144 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C17H19NO3 LVVKXRQZSRUVPY-HNNXBMFYSA-N LVVKXRQZSRUVPY Organoheterocyclic compounds Isoquinolines and derivatives Benzylisoquinolines Tyrosine alkaloids Isoquinoline alkaloids|Tetrahydroisoquinoline alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00005436045 CCMSLIB00012448942 40 spectra_filtered.mgf MSNLIB-POSITIVE.mgf 0.950988 5610600.0 0 162541.0 6 46.9894 242.103 1 temp/spectra_filtered.mgf40 1 Dianthoside ESI Orbitrap Crude Tomas Pluskal Corinna Brungs [M+H]+ 289.092 288.085 1 N/A N/A Cc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(=O)cco1 InChI=1S/C12H16O8/c1-5-11(6(14)2-3-18-5)20-12-10(17)9(16)8(15)7(4-13)19-12/h2-3,7-10,12-13,15-17H,4H2,1H3/t7-,8-,9+,10-,12+/m1/s1 YGSIRXHFAUFUEJ-GPTQDWHKSA-N 1 Positive MSNLIB-POSITIVE 289.092 UPDATE-SINGLE-ANNOTATED-GOLD Gold C12H16O8 YGSIRXHFAUFUEJ-GPTQDWHKSA-N YGSIRXHFAUFUEJ Organic oxygen compounds Organooxygen compounds Carbohydrates and carbohydrate conjugates Cyclic polyketides 4-pyrone derivatives Polyketides mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012448942 CCMSLIB00004697065 654 spectra_filtered.mgf MONA.mgf 0.950973 13220000.0 0 1.63337 9 0.000411987 252.232 1 temp/spectra_filtered.mgf654 1 (2E,4E)-N-(2-methylpropyl)dodeca-2,4-dienamide N/A ESI-QFT isolated MoNA MoNA:VF-NPL-QEHF006002 [M+H]+ 252.232 0.0 1 N/A N/A CCCCCCC/C=C/C=C/C(O)=NCC(C)C InChI=1S/C16H29NO/c1-4-5-6-7-8-9-10-11-12-13-16(18)17-14-15(2)3/h10-13,15H,4-9,14H2,1-3H3,(H,17,18)/b11-10+,13-12+ N/A 3 positive MONA 252.232 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C16H29NO BBRMJCAPNGJKEM-AQASXUMVSA-N BBRMJCAPNGJKEM Lipids and lipid-like molecules Fatty Acyls Fatty amides Fatty acyls Fatty alcohols|Hydrocarbons Fatty acids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00004697065 CCMSLIB00005436047 243 spectra_filtered.mgf GNPS-LIBRARY.mgf 0.948365 440000000.0 0 42707.9 12 14.0164 314.176 1 temp/spectra_filtered.mgf243 1 O-methylarmepavine LC-ESI qTof Crude KOOLEN/ANGOLINI ANGOLINI M+H 328.192 327.183 1 [H][C@@]1(CC2=CC=C(OC)C=C2)C3=CC(OC)=C(OC)C=C3CCN1C InChI=1S/C20H25NO3/c1-21-10-9-15-12-19(23-3)20(24-4)13-17(15)18(21)11-14-5-7-16(22-2)8-6-14/h5-8,12-13,18H,9-11H2,1-4H3/t18-/m1/s1 3 Positive GNPS-LIBRARY 328.192 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C20H25NO3 LZJWNVLTWYMMDJ-GOSISDBHSA-N LZJWNVLTWYMMDJ Organoheterocyclic compounds Isoquinolines and derivatives Benzylisoquinolines Tyrosine alkaloids Isoquinoline alkaloids|Tetrahydroisoquinoline alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00005436047 CCMSLIB00006439446 130 spectra_filtered.mgf BMDMS-NP.mgf 0.948173 8217000.0 0 31.2892 9 0.0085144 272.129 1 temp/spectra_filtered.mgf130 1 Higenamine ESI Orbitrap Commercial standard BMDMS-NP BMDMS-NP [M+H]+ 272.12 271.121 1 N/A N/A OC1=CC=C(C=C1)CC2NCCC3=CC(O)=C(O)C=C32 InChI=1S/C16H17NO3/c18-12-3-1-10(2-4-12)7-14-13-9-16(20)15(19)8-11(13)5-6-17-14/h1-4,8-9,14,17-20H,5-7H2 N/A 1 Positive BMDMS-NP 272.12 UPDATE-SINGLE-ANNOTATED-GOLD Gold C16H17NO3 WZRCQWQRFZITDX-UHFFFAOYSA-N WZRCQWQRFZITDX Organoheterocyclic compounds Isoquinolines and derivatives Benzylisoquinolines Tyrosine alkaloids Isoquinoline alkaloids|Tetrahydroisoquinoline alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00006439446 CCMSLIB00006409894 517 spectra_filtered.mgf BMDMS-NP.mgf 0.948111 14212000.0 0 13.2741 10 0.00378418 285.076 1 temp/spectra_filtered.mgf517 1 5-hydroxy-2-(4-hydroxyphenyl)-7-methoxy-4H-chromen-4-one ESI Orbitrap Commercial standard BMDMS-NP BMDMS-NP [M+H]+ 285.08 284.068 1 N/A N/A O=C1C=C(OC=2C=C(OC)C=C(O)C12)C=3C=CC(O)=CC3 InChI=1S/C16H12O5/c1-20-11-6-12(18)16-13(19)8-14(21-15(16)7-11)9-2-4-10(17)5-3-9/h2-8,17-18H,1H3 N/A 1 Positive BMDMS-NP 285.08 UPDATE-SINGLE-ANNOTATED-GOLD Gold C16H12O5 JPMYFOBNRRGFNO-UHFFFAOYSA-N JPMYFOBNRRGFNO Phenylpropanoids and polyketides Flavonoids O-methylated flavonoids Flavonoids Flavones Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00006409894 CCMSLIB00004720840 424 spectra_filtered.mgf MONA.mgf 0.947025 2112200.0 0 84742.6 7 26.9595 345.094 1 temp/spectra_filtered.mgf424 1 Piplartine N/A ESI-QFT isolated MoNA MoNA:VF-NPL-QEHF027259 [M+H]+ 318.134 0.0 1 N/A N/A COc1cc(/C=C/C(=O)N2CCC=CC2=O)cc(OC)c1OC InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+ N/A 3 positive MONA 318.134 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C17H19NO5 VABYUUZNAVQNPG-BQYQJAHWSA-N VABYUUZNAVQNPG N/A N/A N/A Lysine alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00004720840 CCMSLIB00010119044 597 spectra_filtered.mgf BERKELEY-LAB.mgf 0.946771 11333000.0 0 49165.9 8 14.016 299.092 1 temp/spectra_filtered.mgf597 1 acacetin CollisionEnergy:205060 LC-ESI Orbitrap Commercial Trent Northen JGI M+H 285.076 0.0 1 N/A N/A COc1ccc(-c2cc(=O)c3c(O)cc(O)cc3o2)cc1 """InChI=1S/C16H12O5/c1-20-11-4-2-9(3-5-11)14-8-13(19)16-12(18)6-10(17)7-15(16)21-14/h2-8,17-18H,1H3""" N/A 3 Positive BERKELEY-LAB 285.076 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C16H12O5 DANYIYRPLHHOCZ-UHFFFAOYSA-N DANYIYRPLHHOCZ Phenylpropanoids and polyketides Flavonoids O-methylated flavonoids Flavonoids Flavones Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00010119044 CCMSLIB00005722482 239 spectra_filtered.mgf GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE.mgf 0.946482 39927000.0 0 146334.0 6 45.9691 360.108 1 temp/spectra_filtered.mgf239 1 NCGC00169550-02!(E)-3-(4-hydroxy-3-methoxyphenyl)-N-[2-(4-hydroxyphenyl)ethyl]prop-2-enamide [IIN-based: Match] LC-ESI Orbitrap Commercial Pieter Dorrestein lfnothias/robinschmid [M+H]+ 314.139 313.132 1 N/A N/A COC1=C(O)C=CC(\\C=C\\C(=O)NCCC2=CC=C(O)C=C2)=C1 InChI=1S/C18H19NO4/c1-23-17-12-14(4-8-16(17)21)5-9-18(22)19-11-10-13-2-6-15(20)7-3-13/h2-9,12,20-21H,10-11H2,1H3,(H,19,22)/b9-5+ N/A 3 Positive GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE 314.139 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C18H19NO4 NPNNKDMSXVRADT-WEVVVXLNSA-N NPNNKDMSXVRADT Benzenoids Phenols Methoxyphenols Phenylpropanoids (C6-C3) Cinnamic acid amides Amino acids and Peptides|Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00005722482 CCMSLIB00006439439 201 spectra_filtered.mgf BMDMS-NP.mgf 0.946062 1543500.0 0 158.28 9 0.0426025 269.117 1 temp/spectra_filtered.mgf201 1 sophocarpine ESI Orbitrap Commercial standard BMDMS-NP BMDMS-NP [M+Na]+ 269.16 246.173 1 N/A N/A O=C1C=CCC2N1CC3CCCN4CCCC2C43 InChI=1S/C15H22N2O/c18-14-7-1-6-13-12-5-3-9-16-8-2-4-11(15(12)16)10-17(13)14/h1,7,11-13,15H,2-6,8-10H2 N/A 1 Positive BMDMS-NP 269.16 UPDATE-SINGLE-ANNOTATED-GOLD Gold C15H22N2O AAGFPTSOPGCENQ-UHFFFAOYSA-N AAGFPTSOPGCENQ Alkaloids and derivatives Lupin alkaloids Matrine alkaloids Lysine alkaloids Quinolizidine alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00006439439 CCMSLIB00012296728 158 spectra_filtered.mgf MSNLIB-POSITIVE.mgf 0.94381 13218200.0 0 101306.0 6 30.0006 326.14 1 temp/spectra_filtered.mgf158 1 PJ34 ESI Orbitrap Crude Tomas Pluskal Corinna Brungs [M+H]+ 296.139 295.132 1 N/A N/A CN(C)CC(=O)Nc1cc2c(cc1)[nH]c(=O)c1ccccc12 InChI=1S/C17H17N3O2/c1-20(2)10-16(21)18-11-7-8-15-14(9-11)12-5-3-4-6-13(12)17(22)19-15/h3-9H,10H2,1-2H3,(H,18,21)(H,19,22) UYJZZVDLGDDTCL-UHFFFAOYSA-N 1 Positive MSNLIB-POSITIVE 296.139 UPDATE-SINGLE-ANNOTATED-GOLD Gold C17H17N3O2 UYJZZVDLGDDTCL-UHFFFAOYSA-N UYJZZVDLGDDTCL Organoheterocyclic compounds Quinolines and derivatives Benzoquinolines Tryptophan alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012296728 CCMSLIB00000577949 82 spectra_filtered.mgf GNPS-EMBL-MCF.mgf 0.943155 34635000.0 0 1324050.0 6 204.023 358.113 1 temp/spectra_filtered.mgf82 1 DOPAMINE LC-ESI Q-Exactive Plus Commercial standard Alexandrov Theodore Prasad M+H 154.09 153.079 0 62-31-7 681 C1=CC(=C(C=C1CCN)O)O InChI=1S/C8H11NO2/c9-4-3-6-1-2-7(10)8(11)5-6/h1-2,5,10-11H,3-4,9H2 N/A 1 Positive GNPS-EMBL-MCF 154.09 UPDATE-SINGLE-ANNOTATED-GOLD Gold C8H11NO2 VYFYYTLLBUKUHU-UHFFFAOYSA-N VYFYYTLLBUKUHU Benzenoids Phenols Benzenediols Tyrosine alkaloids Phenylethylamines Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00000577949 CCMSLIB00012344200 52 spectra_filtered.mgf MSNLIB-POSITIVE.mgf 0.942893 1528600.0 0 498545.0 8 341.132 343.124 1 temp/spectra_filtered.mgf52 1 Stachyose ESI Orbitrap Crude Tomas Pluskal Corinna Brungs [M+NH4]+ 684.256 666.222 1 N/A N/A OC[C@H]1O[C@H](OC[C@H]2O[C@H](OC[C@H]3O[C@H](O[C@]4(CO)O[C@H](CO)[C@@H](O)[C@@H]4O)[C@H](O)[C@@H](O)[C@@H]3O)[C@H](O)[C@@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@H]1O InChI=1S/C24H42O21/c25-1-6-10(28)14(32)17(35)21(41-6)39-3-8-11(29)15(33)18(36)22(42-8)40-4-9-12(30)16(34)19(37)23(43-9)45-24(5-27)20(38)13(31)7(2-26)44-24/h6-23,25-38H,1-5H2/t6-,7-,8-,9-,10+,11+,12-,13-,14+,15+,16+,17-,18-,19-,20+,21+,22+,23-,24+/m1/s1 UQZIYBXSHAGNOE-XNSRJBNMSA-N 1 Positive MSNLIB-POSITIVE 684.256 UPDATE-SINGLE-ANNOTATED-GOLD Gold C24H42O21 UQZIYBXSHAGNOE-XNSRJBNMSA-N UQZIYBXSHAGNOE Organic oxygen compounds Organooxygen compounds Carbohydrates and carbohydrate conjugates Saccharides Polysaccharides Carbohydrates mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012344200 CCMSLIB00003136253 753 spectra_filtered.mgf GNPS-NIST14-MATCHES.mgf 0.942362 3818000.0 0 796152.0 6 125.122 282.28 1 temp/spectra_filtered.mgf753 1 Spectral Match to .beta.-Citronellol from NIST14 ESI qTof Isolated Data from Piel Data deposited by eriche M+H 157.158 156.151 1 106229 N/A CC(CCC=C(C)C)CCO InChI=1S/C10H20O/c1-9(2)5-4-6-10(3)7-8-11/h5,10-11H,4,6-8H2,1-3H3 N/A 3 Positive GNPS-NIST14-MATCHES 157.158 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C10H20O QMVPMAAFGQKVCJ-UHFFFAOYSA-N QMVPMAAFGQKVCJ Lipids and lipid-like molecules Prenol lipids Monoterpenoids Monoterpenoids Acyclic monoterpenoids Terpenoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00003136253 CCMSLIB00005723046 365 spectra_filtered.mgf GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE.mgf 0.941574 2378700.0 0 146569.0 7 45.0209 262.144 1 temp/spectra_filtered.mgf365 1 NCGC00170014-03!(E)-N-(4-acetamidobutyl)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enamide [IIN-based: Match] LC-ESI Orbitrap Commercial Pieter Dorrestein lfnothias/robinschmid [M+H]+ 307.165 306.158 1 N/A N/A COC1=C(O)C=CC(\\C=C\\C(=O)NCCCCNC(C)=O)=C1 InChI=1S/C16H22N2O4/c1-12(19)17-9-3-4-10-18-16(21)8-6-13-5-7-14(20)15(11-13)22-2/h5-8,11,20H,3-4,9-10H2,1-2H3,(H,17,19)(H,18,21)/b8-6+ N/A 3 Positive GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE 307.165 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C16H22N2O4 ZVMGKOAHBAIHLO-SOFGYWHQSA-N ZVMGKOAHBAIHLO Phenylpropanoids and polyketides Cinnamic acids and derivatives Hydroxycinnamic acids and derivatives Ornithine alkaloids Polyamines Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00005723046 CCMSLIB00010122956 646 spectra_filtered.mgf BERKELEY-LAB.mgf 0.941517 57300000.0 0 1.93342 7 0.000396729 205.195 1 temp/spectra_filtered.mgf646 1 Bisabolol CollisionEnergy:205060 LC-ESI Orbitrap Commercial Trent Northen JGI M+H-H2O 205.195 0.0 1 N/A N/A CC(C)=CCCC(C)(O)C1CC=C(C)CC1 """InChI=1S/C15H26O/c1-12(2)6-5-11-15(4,16)14-9-7-13(3)8-10-14/h6-7,14,16H,5,8-11H2,1-4H3""" N/A 3 Positive BERKELEY-LAB 205.195 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C15H26O RGZSQWQPBWRIAQ-UHFFFAOYSA-N RGZSQWQPBWRIAQ Lipids and lipid-like molecules Prenol lipids Sesquiterpenoids Sesquiterpenoids Bisabolane sesquiterpenoids Terpenoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00010122956 CCMSLIB00010012048 231 spectra_filtered.mgf GNPS-LIBRARY.mgf 0.939945 1789700.0 0 216052.0 8 132.042 743.203 1 temp/spectra_filtered.mgf231 1 Rutin LC-ESI qTof Commercial Stephane GREFF Stephane GREFF M+H 611.161 610.153 1 153-18-4 5280805 C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)OC[C@@H]2[C@H]([C@@H]([C@H]([C@@H](O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC(=C(C=C5)O)O)O)O)O)O)O)O 1S/C27H30O16/c1-8-17(32)20(35)22(37)26(40-8)39-7-15-18(33)21(36)23(38)27(42-15)43-25-19(34)16-13(31)5-10(28)6-14(16)41-24(25)9-2-3-11(29)12(30)4-9/h2-6,8,15,17-18,20-23,26-33,35-38H,7H2,1H3/t8-,15+,17-,18+,20+,21-,22+,23+,26+,27-/m0/s1 IKGXIBQEEMLURG-NVPNHPEKSA-N 3 Positive GNPS-LIBRARY 611.161 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C27H30O16 IKGXIBQEEMLURG-NVPNHPEKSA-N IKGXIBQEEMLURG Phenylpropanoids and polyketides Flavonoids Flavonoid glycosides Flavonoids Flavonols Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00010012048 CCMSLIB00004700154 151 spectra_filtered.mgf MONA.mgf 0.93989 3060000.0 0 1.83025 13 0.000823975 450.198 1 temp/spectra_filtered.mgf151 1 (2R,3S,4S,5R,6R)-5-[(2S,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy-2-(hydroxymethyl)-6-[2-(4-hydroxyphenyl)ethoxy]oxane-3,4-diol N/A ESI-QFT isolated MoNA MoNA:VF-NPL-QEHF009091 [M+NH4]+ 450.197 0.0 1 N/A N/A OC[C@H]1O[C@@H](OCCc2ccc(O)cc2)[C@H](O[C@@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@@H]1O InChI=1S/C19H28O11/c20-7-12-13(23)14(24)15(30-18-16(25)19(26,8-21)9-28-18)17(29-12)27-6-5-10-1-3-11(22)4-2-10/h1-4,12-18,20-26H,5-9H2/t12-,13-,14+,15-,16+,17-,18+,19-/m1/s1 N/A 3 positive MONA 450.197 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C19H28O11 WWVATHTYIDDAQF-DERWZFJFSA-N WWVATHTYIDDAQF Organic oxygen compounds Organooxygen compounds Carbohydrates and carbohydrate conjugates Phenylethanoids (C6-C2) Phenylethanoids Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00004700154 CCMSLIB00012439423 249 spectra_filtered.mgf MSNLIB-POSITIVE.mgf 0.93977 4273100.0 0 221857.0 8 132.042 727.208 1 temp/spectra_filtered.mgf249 1 17353-03-6 ESI Orbitrap Crude Tomas Pluskal Corinna Brungs [M+H]+ 595.166 594.158 1 N/A N/A C[C@@H]1O[C@@H](O[C@H]2[C@H](Oc3cc(O)c4c(=O)c(O)c(-c5ccc(O)cc5)oc4c3)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O InChI=1S/C27H30O15/c1-9-17(31)20(34)23(37)26(38-9)42-25-21(35)18(32)15(8-28)41-27(25)39-12-6-13(30)16-14(7-12)40-24(22(36)19(16)33)10-2-4-11(29)5-3-10/h2-7,9,15,17-18,20-21,23,25-32,34-37H,8H2,1H3/t9-,15+,17-,18+,20+,21-,23+,25+,26-,27+/m0/s1 ZEJXENDZTYVXDP-CSJHBIPPSA-N 1 Positive MSNLIB-POSITIVE 595.166 UPDATE-SINGLE-ANNOTATED-GOLD Gold C27H30O15 ZEJXENDZTYVXDP-CSJHBIPPSA-N ZEJXENDZTYVXDP Phenylpropanoids and polyketides Flavonoids Flavonoid glycosides Flavonoids Flavonols Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012439423 CCMSLIB00011428096 505 spectra_filtered.mgf LEAFBOT.mgf 0.939493 25922000.0 0 1138460.0 6 362.184 680.318 1 temp/spectra_filtered.mgf505 1 PIPERLONGUMINE ESI Orbitrap Commercial Cech Vicky Anderson M+H 318.134 317.126 1 20069-09-04 N/A COC1=CC(=CC(=C1OC)OC)C=CC(=O)N2CCC=CC2=O """InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3""" N/A 1 Positive LEAFBOT 318.134 UPDATE-SINGLE-ANNOTATED-GOLD Gold C17H19NO5 VABYUUZNAVQNPG-UHFFFAOYSA-N VABYUUZNAVQNPG N/A N/A N/A Lysine alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00011428096 CCMSLIB00003137017 820 spectra_filtered.mgf GNPS-NIST14-MATCHES.mgf 0.937547 3109100.0 0 69852.5 6 50.9637 780.554 1 temp/spectra_filtered.mgf820 1 Spectral Match to N-Oleoyl-D-erythro-sphingosylphosphorylcholine from NIST14 ESI qTof Isolated Data from Pieter Dorrestein Data deposited by daniel M+H 729.59 728.583 1 108392105 N/A CCCCCCCCCCCCC/C=C/[C@H]([C@H](COP(=O)([O-])OCC[N+](C)(C)C)NC(=O)CCCCCCC/C=C\CCCCCCCC)O InChI=1S/C41H81N2O6P/c1-6-8-10-12-14-16-18-20-21-23-25-27-29-31-33-35-41(45)42-39(38-49-50(46,47)48-37-36-43(3,4)5)40(44)34-32-30-28-26-24-22-19-17-15-13-11-9-7-2/h20-21,32,34,39-40,44H,6-19,22-31,33,35-38H2,1-5H3,(H-,42,45,46,47)/b21-20-,34-32+/t39-,40+/m0/s1 N/A 3 Positive GNPS-NIST14-MATCHES 729.59 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze N/A NBEADXWAAWCCDG-QDDWGVBQSA-N NBEADXWAAWCCDG Lipids and lipid-like molecules Sphingolipids Phosphosphingolipids N/A N/A N/A mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00003137017 CCMSLIB00010105222 140 spectra_filtered.mgf BERKELEY-LAB.mgf 0.937538 13405900.0 0 95268.7 8 26.0156 247.06 1 temp/spectra_filtered.mgf140 1 naringenin CollisionEnergy:102040 LC-ESI Orbitrap Commercial Trent Northen JGI M+H 273.076 0.0 1 N/A N/A O=C1CC(c2ccc(O)cc2)Oc2cc(O)cc(O)c21 """InChI=1S/C15H12O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-6,13,16-18H,7H2""" N/A 3 Positive BERKELEY-LAB 273.076 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C15H12O5 FTVWIRXFELQLPI-UHFFFAOYSA-N FTVWIRXFELQLPI Phenylpropanoids and polyketides Flavonoids Flavans Flavonoids Flavanones Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00010105222 CCMSLIB00011906145 152 spectra_filtered.mgf TUEBINGEN-NATURAL-PRODUCT-COLLECTION.mgf 0.937481 49399000.0 0 359316.0 6 70.0899 265.155 1 temp/spectra_filtered.mgf152 1 Ferulic acid ESI Orbitrap Isolated Daniel Petras """Christian Geibel, Giovanni Andrea Vitale""" M+H 195.065 194.058 1 N/A N/A COC1=C(C=CC(=C1)C=CC(=O)O)O InChI=1S/C10H10O4/c1-14-9-6-7(2-4-8(9)11)3-5-10(12)13/h2-6,11H,1H3,(H,12,13) N/A 1 Positive TUEBINGEN-NATURAL-PRODUCT-COLLECTION 195.065 UPDATE-SINGLE-ANNOTATED-GOLD Gold C10H10O4 KSEBMYQBYZTDHS-UHFFFAOYSA-N KSEBMYQBYZTDHS Phenylpropanoids and polyketides Cinnamic acids and derivatives Hydroxycinnamic acids and derivatives Phenylpropanoids (C6-C3) Cinnamic acids and derivatives Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00011906145 CCMSLIB00010110861 99 spectra_filtered.mgf BERKELEY-LAB.mgf 0.936357 14576300.0 0 156736.0 6 31.9901 236.092 1 temp/spectra_filtered.mgf99 1 Indole-3-butyric acid CollisionEnergy:102040 LC-ESI Orbitrap Commercial Trent Northen JGI M+H 204.102 0.0 1 N/A N/A O=C(O)CCCc1c[nH]c2ccccc12 """InChI=1S/C12H13NO2/c14-12(15)7-3-4-9-8-13-11-6-2-1-5-10(9)11/h1-2,5-6,8,13H,3-4,7H2,(H,14,15)""" N/A 3 Positive BERKELEY-LAB 204.102 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C12H13NO2 JTEDVYBZBROSJT-UHFFFAOYSA-N JTEDVYBZBROSJT Organoheterocyclic compounds Indoles and derivatives Indoles Tryptophan alkaloids Simple indole alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00010110861 CCMSLIB00004702150 131 spectra_filtered.mgf MONA.mgf 0.936346 2341700.0 0 0.959205 9 0.000305176 318.155 1 temp/spectra_filtered.mgf131 1 Salidroside N/A ESI-QFT isolated MoNA MoNA:VF-NPL-QEHF011087 [M+NH4]+ 318.155 0.0 1 N/A N/A OC[C@H]1O[C@@H](OCCc2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O InChI=1S/C14H20O7/c15-7-10-11(17)12(18)13(19)14(21-10)20-6-5-8-1-3-9(16)4-2-8/h1-4,10-19H,5-7H2/t10-,11-,12+,13-,14-/m1/s1 N/A 3 positive MONA 318.155 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C14H20O7 ILRCGYURZSFMEG-RKQHYHRCSA-N ILRCGYURZSFMEG Organic oxygen compounds Organooxygen compounds Carbohydrates and carbohydrate conjugates Phenylethanoids (C6-C2) Phenylethanoids Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00004702150 CCMSLIB00005436045 266 spectra_filtered.mgf GNPS-LIBRARY.mgf 0.935882 21220000.0 0 48982.0 11 14.0159 300.16 1 temp/spectra_filtered.mgf266 1 Coclaurine LC-ESI qTof Crude KOOLEN/ANGOLINI ANGOLINI M+H 286.144 285.137 1 OC1=C(OC)C=C2C([C@@](CC3=CC=C(O)C=C3)([H])NCC2)=C1 InChI=1S/C17H19NO3/c1-21-17-9-12-6-7-18-15(14(12)10-16(17)20)8-11-2-4-13(19)5-3-11/h2-5,9-10,15,18-20H,6-8H2,1H3/t15-/m0/s1 3 Positive GNPS-LIBRARY 286.144 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C17H19NO3 LVVKXRQZSRUVPY-HNNXBMFYSA-N LVVKXRQZSRUVPY Organoheterocyclic compounds Isoquinolines and derivatives Benzylisoquinolines Tyrosine alkaloids Isoquinoline alkaloids|Tetrahydroisoquinoline alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00005436045 CCMSLIB00012447737 396 spectra_filtered.mgf MSNLIB-POSITIVE.mgf 0.935855 102639000.0 0 487575.0 7 276.069 290.139 1 temp/spectra_filtered.mgf396 1 Sibiricose A6 ESI Orbitrap Crude Tomas Pluskal Corinna Brungs [M+NH4]+ 566.208 548.174 1 N/A N/A COc1cc(/C=C/C(=O)O[C@H]2[C@H](O)[C@@H](CO)O[C@@]2(CO)O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O InChI=1S/C23H32O15/c1-33-11-5-10(6-12(34-2)16(11)28)3-4-15(27)36-21-18(30)14(8-25)37-23(21,9-26)38-22-20(32)19(31)17(29)13(7-24)35-22/h3-6,13-14,17-22,24-26,28-32H,7-9H2,1-2H3/b4-3+/t13-,14-,17-,18-,19+,20-,21+,22-,23+/m1/s1 WTCVROXOIQEIRC-IBVGEFGBSA-N 1 Positive MSNLIB-POSITIVE 566.208 UPDATE-SINGLE-ANNOTATED-GOLD Gold C23H32O15 WTCVROXOIQEIRC-IBVGEFGBSA-N WTCVROXOIQEIRC Phenylpropanoids and polyketides Cinnamic acids and derivatives Hydroxycinnamic acids and derivatives Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012447737 CCMSLIB00005724962 200 spectra_filtered.mgf GNPS-LIBRARY.mgf 0.93475 2909300.0 0 279428.0 10 79.9567 366.101 1 temp/spectra_filtered.mgf200 1 1-[(4-hydroxyphenyl)methyl]-6-methoxy-1,2,3,4-tetrahydroisoquinolin-7-ol ESI Orbitrap Isolated Wolfender Luis Quiros-Guerrero M+H 286.144 285.137 1 N/A N/A COc(cc(CCNC1Cc(cc2)ccc2O)c1c1)c1O InChI=1S/C17H19NO3/c1-21-17-9-12-6-7-18-15(14(12)10-16(17)20)8-11-2-4-13(19)5-3-11/h2-5,9-10,15,18-20H,6-8H2,1H3/t15-/m0/s1 N/A 1 Positive GNPS-LIBRARY 286.144 UPDATE-SINGLE-ANNOTATED-GOLD Gold C17H19NO3 LVVKXRQZSRUVPY-UHFFFAOYSA-N LVVKXRQZSRUVPY Organoheterocyclic compounds Isoquinolines and derivatives Benzylisoquinolines Tyrosine alkaloids Isoquinoline alkaloids|Tetrahydroisoquinoline alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00005724962 CCMSLIB00010106258 458 spectra_filtered.mgf BERKELEY-LAB.mgf 0.934674 20382300.0 0 37605.2 7 11.9635 306.171 1 temp/spectra_filtered.mgf458 1 Piperlongumine CollisionEnergy:102040 LC-ESI Orbitrap Commercial Trent Northen JGI M+H 318.134 0.0 1 N/A N/A COc1cc(C=CC(=O)N2CCC=CC2=O)cc(OC)c1OC """InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+""" N/A 3 Positive BERKELEY-LAB 318.134 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C17H19NO5 VABYUUZNAVQNPG-UHFFFAOYSA-N VABYUUZNAVQNPG N/A N/A N/A Lysine alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00010106258 CCMSLIB00006683629 115 spectra_filtered.mgf MONA.mgf 0.933371 5360000.0 0 1.80234 9 0.000396729 220.118 1 temp/spectra_filtered.mgf115 1 PANTOTHENIC ACID ESI qTof isolated MoNA MoNA:MoNA033114 M+H 220.118 0.0 1 N/A N/A CC(C)(CO)C(/C(=N/CCC(=O)O)/O)O """InChI=1S/C9H17NO5/c1-9(2,5-11)7(14)8(15)10-4-3-6(12)13/h7,11,14H,3-5H2,1-2H3,(H,10,15)(H,12,13)""" N/A 3 positive MONA 220.118 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C9H17NO5 GHOKWGTUZJEAQD-UHFFFAOYSA-N GHOKWGTUZJEAQD Organic acids and derivatives Carboxylic acids and derivatives Amino acids, peptides, and analogues Fatty Acids and Conjugates Branched fatty acids Fatty acids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00006683629 CCMSLIB00005722482 339 spectra_filtered.mgf GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE.mgf 0.93323 14593000.0 0 95533.1 7 30.0107 344.15 1 temp/spectra_filtered.mgf339 1 NCGC00169550-02!(E)-3-(4-hydroxy-3-methoxyphenyl)-N-[2-(4-hydroxyphenyl)ethyl]prop-2-enamide [IIN-based: Match] LC-ESI Orbitrap Commercial Pieter Dorrestein lfnothias/robinschmid [M+H]+ 314.139 313.132 1 N/A N/A COC1=C(O)C=CC(\\C=C\\C(=O)NCCC2=CC=C(O)C=C2)=C1 InChI=1S/C18H19NO4/c1-23-17-12-14(4-8-16(17)21)5-9-18(22)19-11-10-13-2-6-15(20)7-3-13/h2-9,12,20-21H,10-11H2,1H3,(H,19,22)/b9-5+ N/A 3 Positive GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE 314.139 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C18H19NO4 NPNNKDMSXVRADT-WEVVVXLNSA-N NPNNKDMSXVRADT Benzenoids Phenols Methoxyphenols Phenylpropanoids (C6-C3) Cinnamic acid amides Amino acids and Peptides|Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00005722482 CCMSLIB00006124013 649 spectra_filtered.mgf BIRMINGHAM-UHPLC-MS-POS.mgf 0.933158 5760000.0 0 1.93342 9 0.000396729 205.195 1 temp/spectra_filtered.mgf649 1 (.+/-.)-trans-Nerolidol - 40.0 eV ESI Orbitrap Isolated PI Data Collector Unknown 205.195 0.0 1 N/A CC(=CCC/C(=C/CCC(C)(C=C)O)/C)C InChI=1S/C15H26O/c1-6-15(5,16)12-8-11-14(4)10-7-9-13(2)3/h6,9,11,16H,1,7-8,10,12H2,2-5H3/b14-11+ N/A 1 Positive BIRMINGHAM-UHPLC-MS-POS 205.195 UPDATE-SINGLE-ANNOTATED-GOLD Gold C15H26O FQTLCLSUCSAZDY-SDNWHVSQSA-N FQTLCLSUCSAZDY Lipids and lipid-like molecules Prenol lipids Sesquiterpenoids Sesquiterpenoids|Monoterpenoids Acyclic monoterpenoids|Farnesane sesquiterpenoids Terpenoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00006124013 CCMSLIB00012447737 369 spectra_filtered.mgf MSNLIB-POSITIVE.mgf 0.932911 11245500.0 0 462885.0 6 262.089 304.119 1 temp/spectra_filtered.mgf369 1 Sibiricose A6 ESI Orbitrap Crude Tomas Pluskal Corinna Brungs [M+NH4]+ 566.208 548.174 1 N/A N/A COc1cc(/C=C/C(=O)O[C@H]2[C@H](O)[C@@H](CO)O[C@@]2(CO)O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O InChI=1S/C23H32O15/c1-33-11-5-10(6-12(34-2)16(11)28)3-4-15(27)36-21-18(30)14(8-25)37-23(21,9-26)38-22-20(32)19(31)17(29)13(7-24)35-22/h3-6,13-14,17-22,24-26,28-32H,7-9H2,1-2H3/b4-3+/t13-,14-,17-,18-,19+,20-,21+,22-,23+/m1/s1 WTCVROXOIQEIRC-IBVGEFGBSA-N 1 Positive MSNLIB-POSITIVE 566.208 UPDATE-SINGLE-ANNOTATED-GOLD Gold C23H32O15 WTCVROXOIQEIRC-IBVGEFGBSA-N WTCVROXOIQEIRC Phenylpropanoids and polyketides Cinnamic acids and derivatives Hydroxycinnamic acids and derivatives Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012447737 CCMSLIB00012320438 133 spectra_filtered.mgf MSNLIB-POSITIVE.mgf 0.932097 1695200.0 0 51506.7 9 14.0164 286.144 1 temp/spectra_filtered.mgf133 1 Higenamine ESI Orbitrap Crude Tomas Pluskal Corinna Brungs [M+H]+ 272.128 271.121 1 N/A N/A Oc1ccc(CC2NCCc3cc(O)c(O)cc32)cc1 InChI=1S/C16H17NO3/c18-12-3-1-10(2-4-12)7-14-13-9-16(20)15(19)8-11(13)5-6-17-14/h1-4,8-9,14,17-20H,5-7H2 WZRCQWQRFZITDX-UHFFFAOYSA-N 1 Positive MSNLIB-POSITIVE 272.128 UPDATE-SINGLE-ANNOTATED-GOLD Gold C16H17NO3 WZRCQWQRFZITDX-UHFFFAOYSA-N WZRCQWQRFZITDX Organoheterocyclic compounds Isoquinolines and derivatives Benzylisoquinolines Tyrosine alkaloids Isoquinoline alkaloids|Tetrahydroisoquinoline alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012320438 CCMSLIB00004708348 150 spectra_filtered.mgf MONA.mgf 0.931531 2178400.0 0 88272.8 6 28.9639 357.082 1 temp/spectra_filtered.mgf150 1 (2S)-3-(4-hydroxyphenyl)-2-[[(Z)-3-(4-hydroxyphenyl)prop-2-enoyl]amino]propanoic acid N/A ESI-QFT isolated MoNA MoNA:VF-NPL-QEHF017285 [M+H]+ 328.118 0.0 1 N/A N/A O=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)/C=C\c1ccc(O)cc1 InChI=1S/C18H17NO5/c20-14-6-1-12(2-7-14)5-10-17(22)19-16(18(23)24)11-13-3-8-15(21)9-4-13/h1-10,16,20-21H,11H2,(H,19,22)(H,23,24)/b10-5-/t16-/m0/s1 N/A 3 positive MONA 328.118 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C18H17NO5 LEEDEKWKJVUWGA-AVFOEOQDSA-N LEEDEKWKJVUWGA Organic acids and derivatives Carboxylic acids and derivatives Amino acids, peptides, and analogues Diarylheptanoids Linear diarylheptanoids Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00004708348 CCMSLIB00003139684 618 spectra_filtered.mgf GNPS-NIST14-MATCHES.mgf 0.931461 1628000.0 0 73128.1 7 16.0304 203.18 1 temp/spectra_filtered.mgf618 1 Spectral Match to Methyl hexadecanoate from NIST14 ESI IT/ion trap Isolated Data from Rob Knight Data deposited by amelnik 219.2 219.21 0.0 1 112390 N/A N/A N/A N/A 3 Positive GNPS-NIST14-MATCHES 219.21 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze N/A N/A N/A N/A N/A N/A N/A N/A N/A mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00003139684 CCMSLIB00004702150 116 spectra_filtered.mgf MONA.mgf 0.931135 4873200.0 0 0.959205 8 0.000305176 318.155 1 temp/spectra_filtered.mgf116 1 Salidroside N/A ESI-QFT isolated MoNA MoNA:VF-NPL-QEHF011087 [M+NH4]+ 318.155 0.0 1 N/A N/A OC[C@H]1O[C@@H](OCCc2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O InChI=1S/C14H20O7/c15-7-10-11(17)12(18)13(19)14(21-10)20-6-5-8-1-3-9(16)4-2-8/h1-4,10-19H,5-7H2/t10-,11-,12+,13-,14-/m1/s1 N/A 3 positive MONA 318.155 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C14H20O7 ILRCGYURZSFMEG-RKQHYHRCSA-N ILRCGYURZSFMEG Organic oxygen compounds Organooxygen compounds Carbohydrates and carbohydrate conjugates Phenylethanoids (C6-C2) Phenylethanoids Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00004702150 CCMSLIB00004720841 503 spectra_filtered.mgf MONA.mgf 0.930858 31664000.0 0 43941.3 7 13.9792 304.155 1 temp/spectra_filtered.mgf503 1 Piplartine N/A ESI-QFT isolated MoNA MoNA:VF-NPL-QEHF027260 [M+H]+ 318.134 0.0 1 N/A N/A COc1cc(/C=C/C(=O)N2CCC=CC2=O)cc(OC)c1OC InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+ N/A 3 positive MONA 318.134 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C17H19NO5 VABYUUZNAVQNPG-BQYQJAHWSA-N VABYUUZNAVQNPG N/A N/A N/A Lysine alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00004720841 CCMSLIB00005720085 13 spectra_filtered.mgf LDB_POSITIVE.mgf 0.930464 594600.0 0 374043.0 7 132.048 220.982 1 temp/spectra_filtered.mgf13 1 Thelephoric acid LC-ESI Orbitrap Isolated Jean-Luc WOLFENDER Pierre-Marie ALLARD Damien OLIVIER [M+H] 353.03 352.022 1 N/A N/A O=C1c2c(c3c(cc(O)c(O)c3)o2)C(=O)c2c1c1c(o2)cc(c(c1)O)O """InChI=1S/C18H8O8/c19-7-1-5-11(3-9(7)21)25-17-13(5)15(23)18-14(16(17)24)6-2-8(20)10(22)4-12(6)26-18/h1-4,19-22H""" N/A 3 Positive LDB_POSITIVE 353.03 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C18H8O8 PDICCECAPKBDBB-UHFFFAOYSA-N PDICCECAPKBDBB N/A N/A N/A Terphenyls p-Terphenyls Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00005720085 CCMSLIB00004720478 226 spectra_filtered.mgf MONA.mgf 0.928291 628200.0 0 269463.0 6 128.047 347.145 1 temp/spectra_filtered.mgf226 1 Amygdalin N/A ESI-QFT isolated MoNA MoNA:VF-NPL-QEHF026897 [M+NH4]+ 475.192 0.0 1 N/A N/A N#C[C@H](OC1O[C@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O)c1ccccc1 InChI=1S/C20H27NO11/c21-6-10(9-4-2-1-3-5-9)30-20-18(28)16(26)14(24)12(32-20)8-29-19-17(27)15(25)13(23)11(7-22)31-19/h1-5,10-20,22-28H,7-8H2/t10-,11+,12+,13+,14+,15-,16-,17+,18+,19+,20?/m0/s1 N/A 3 positive MONA 475.192 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze H3N XUCIJNAGGSZNQT-KDDLJKRCSA-N XUCIJNAGGSZNQT Organic oxygen compounds Organooxygen compounds Carbohydrates and carbohydrate conjugates Small peptides Aminoacids Amino acids and Peptides|Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00004720478 CCMSLIB00006405612 198 spectra_filtered.mgf BMDMS-NP.mgf 0.928231 2876300.0 0 35273.3 6 10.0222 274.108 1 temp/spectra_filtered.mgf198 1 Paprazine ESI Orbitrap Commercial standard BMDMS-NP BMDMS-NP [M+H]+ 284.13 283.121 1 N/A N/A O=C(C=CC1=CC=C(O)C=C1)NCCC2=CC=C(O)C=C2 InChI=1S/C17H17NO3/c19-15-6-1-13(2-7-15)5-10-17(21)18-12-11-14-3-8-16(20)9-4-14/h1-10,19-20H,11-12H2,(H,18,21) N/A 1 Positive BMDMS-NP 284.13 UPDATE-SINGLE-ANNOTATED-GOLD Gold C17H17NO3 RXGUTQNKCXHALN-UHFFFAOYSA-N RXGUTQNKCXHALN Phenylpropanoids and polyketides Cinnamic acids and derivatives Hydroxycinnamic acids and derivatives Phenylpropanoids (C6-C3) Cinnamic acid amides Amino acids and Peptides|Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00006405612 CCMSLIB00003138839 652 spectra_filtered.mgf GNPS-NIST14-MATCHES.mgf 0.927748 2329600.0 0 217965.0 7 56.0631 313.274 1 temp/spectra_filtered.mgf652 1 Spectral Match to Monolaurin from NIST14 ESI qTof Isolated Data from Wolfender/Litaudon Data deposited by pmallard M+H-H2O 257.211 274.214 1 142187 N/A CCCCCCCCCCCC(=O)OCC(CO)O InChI=1S/C15H30O4/c1-2-3-4-5-6-7-8-9-10-11-15(18)19-13-14(17)12-16/h14,16-17H,2-13H2,1H3 N/A 3 Positive GNPS-NIST14-MATCHES 257.211 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C15H30O4 ARIWANIATODDMH-UHFFFAOYSA-N ARIWANIATODDMH Lipids and lipid-like molecules Glycerolipids Monoradylglycerols Glycerolipids Monoacylglycerols Fatty acids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00003138839 CCMSLIB00005720085 177 spectra_filtered.mgf LDB_POSITIVE.mgf 0.924457 4706700.0 0 164173.0 7 57.9581 295.072 1 temp/spectra_filtered.mgf177 1 Thelephoric acid LC-ESI Orbitrap Isolated Jean-Luc WOLFENDER Pierre-Marie ALLARD Damien OLIVIER [M+H] 353.03 352.022 1 N/A N/A O=C1c2c(c3c(cc(O)c(O)c3)o2)C(=O)c2c1c1c(o2)cc(c(c1)O)O """InChI=1S/C18H8O8/c19-7-1-5-11(3-9(7)21)25-17-13(5)15(23)18-14(16(17)24)6-2-8(20)10(22)4-12(6)26-18/h1-4,19-22H""" N/A 3 Positive LDB_POSITIVE 353.03 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C18H8O8 PDICCECAPKBDBB-UHFFFAOYSA-N PDICCECAPKBDBB N/A N/A N/A Terphenyls p-Terphenyls Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00005720085 CCMSLIB00012270173 394 spectra_filtered.mgf CMMC-REFRAME-POSITIVE-LIBRARY.mgf 0.924126 10551200.0 0 315253.0 6 82.006 342.134 1 temp/spectra_filtered.mgf394 1 ILEPCIMIDE LC-ESI Orbitrap Commercial Pieter C. Dorrestein Nina Haoqi Zhao [M+H]+ 260.128 259.121 1 N/A N/A O=C(C=Cc1cc2c(cc1)OCO2)N1CCCCC1 """InChI=1S/C15H17NO3/c17-15(16-8-2-1-3-9-16)7-5-12-4-6-13-14(10-12)19-11-18-13/h4-7,10H,1-3,8-9,11H2/b7-5+""" BLPUOQGPBJPXRL-FNORWQNLSA-N 1 Positive PRIVATE-LIB 260.128 UPDATE-SINGLE-ANNOTATED-GOLD Gold C15H17NO3 BLPUOQGPBJPXRL-UHFFFAOYSA-N BLPUOQGPBJPXRL N/A N/A N/A Lysine alkaloids Piperidine alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012270173 CCMSLIB00005884009 172 spectra_filtered.mgf GNPS-LIBRARY.mgf 0.923386 6870500.0 0 614080.0 8 113.027 297.087 1 temp/spectra_filtered.mgf172 1 4-PYRIDOXATE - 60.0 eV ESI Orbitrap Isolated Madeleine Ernst Anna Abrahamsson M+H 184.06 0.0 1 82-82-6 N/A CC1=NC=C(CO)C(C(O)=O)=C1O InChI=1S/C8H9NO4/c1-4-7(11)6(8(12)13)5(3-10)2-9-4/h2,10-11H,3H2,1H3,(H,12,13) N/A 1 Positive GNPS-LIBRARY 184.06 UPDATE-SINGLE-ANNOTATED-GOLD Gold C8H9NO4 HXACOUQIXZGNBF-UHFFFAOYSA-N HXACOUQIXZGNBF Organoheterocyclic compounds Pyridines and derivatives Pyridinecarboxylic acids and derivatives Nicotinic acid alkaloids Pyridine alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00005884009 CCMSLIB00004720840 453 spectra_filtered.mgf MONA.mgf 0.923274 930300.0 0 595743.0 7 189.526 507.66 1 temp/spectra_filtered.mgf453 1 Piplartine N/A ESI-QFT isolated MoNA MoNA:VF-NPL-QEHF027259 [M+H]+ 318.134 0.0 1 N/A N/A COc1cc(/C=C/C(=O)N2CCC=CC2=O)cc(OC)c1OC InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+ N/A 3 positive MONA 318.134 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C17H19NO5 VABYUUZNAVQNPG-BQYQJAHWSA-N VABYUUZNAVQNPG N/A N/A N/A Lysine alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00004720840 CCMSLIB00010124668 359 spectra_filtered.mgf BERKELEY-LAB.mgf 0.923115 17480000.0 0 2.4318 8 0.00050354 207.066 1 temp/spectra_filtered.mgf359 1 SINAPIC ACID CollisionEnergy:205060 LC-ESI Orbitrap Commercial Trent Northen JGI M+H-H2O 207.065 0.0 1 N/A N/A COc1cc(C=CC(=O)O)cc(OC)c1O """InChI=1S/C11H12O5/c1-15-8-5-7(3-4-10(12)13)6-9(16-2)11(8)14/h3-6,14H,1-2H3,(H,12,13)/b4-3+""" N/A 3 Positive BERKELEY-LAB 207.065 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C11H12O5 PCMORTLOPMLEFB-UHFFFAOYSA-N PCMORTLOPMLEFB Phenylpropanoids and polyketides Cinnamic acids and derivatives Hydroxycinnamic acids and derivatives Phenylpropanoids (C6-C3) Cinnamic acids and derivatives Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00010124668 CCMSLIB00012444244 637 spectra_filtered.mgf MSNLIB-POSITIVE.mgf 0.922607 21156000.0 0 442828.0 8 163.085 205.195 1 temp/spectra_filtered.mgf637 1 5-(5-methoxycarbonyl-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl)-3-methylpentanoic acid ESI Orbitrap Crude Tomas Pluskal Corinna Brungs [M+NH4]+ 368.28 350.246 1 N/A N/A C=C1CCC2C(C)(C(=O)OC)CCCC2(C)C1CCC(C)CC(=O)O InChI=1S/C21H34O4/c1-14(13-18(22)23)7-9-16-15(2)8-10-17-20(16,3)11-6-12-21(17,4)19(24)25-5/h14,16-17H,2,6-13H2,1,3-5H3,(H,22,23) WTDIRAZPDUAJEB-UHFFFAOYSA-N 1 Positive MSNLIB-POSITIVE 368.28 UPDATE-SINGLE-ANNOTATED-GOLD Gold C21H34O4 WTDIRAZPDUAJEB-UHFFFAOYSA-N WTDIRAZPDUAJEB Lipids and lipid-like molecules Prenol lipids Diterpenoids Diterpenoids Labdane diterpenoids|Norlabdane diterpenoids Terpenoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012444244 CCMSLIB00005436046 185 spectra_filtered.mgf GNPS-LIBRARY.mgf 0.922056 2818600.0 0 46694.5 10 14.0158 286.144 1 temp/spectra_filtered.mgf185 1 N-methylcoclaurine LC-ESI qTof Crude KOOLEN/ANGOLINI ANGOLINI M+H 300.16 299.152 1 OC1=C(OC)C=C2C([C@@](CC3=CC=C(O)C=C3)([H])N(C)CC2)=C1 InChI=1S/C18H21NO3/c1-19-8-7-13-10-18(22-2)17(21)11-15(13)16(19)9-12-3-5-14(20)6-4-12/h3-6,10-11,16,20-21H,7-9H2,1-2H3/t16-/m0/s1 3 Positive GNPS-LIBRARY 300.16 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C18H21NO3 BOKVLBSSPUTWLV-INIZCTEOSA-N BOKVLBSSPUTWLV Organoheterocyclic compounds Isoquinolines and derivatives Benzylisoquinolines Tyrosine alkaloids Isoquinoline alkaloids|Tetrahydroisoquinoline alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00005436046 CCMSLIB00006445616 214 spectra_filtered.mgf BMDMS-NP.mgf 0.920742 7320000.0 0 519722.0 8 355.105 328.155 1 temp/spectra_filtered.mgf214 1 Matairesinol 4'-O-beta-gentiobioside ESI Orbitrap Commercial standard BMDMS-NP BMDMS-NP [M+H]+ 683.26 682.247 1 N/A N/A O=C1OCC(CC2=CC=C(O)C(OC)=C2)C1CC3=CC=C(OC4OC(COC5OC(CO)C(O)C(O)C5O)C(O)C(O)C4O)C(OC)=C3 InChI=1S/C32H42O16/c1-42-20-9-14(3-5-18(20)34)7-16-12-44-30(41)17(16)8-15-4-6-19(21(10-15)43-2)46-32-29(40)27(38)25(36)23(48-32)13-45-31-28(39)26(37)24(35)22(11-33)47-31/h3-6,9-10,16-17,22-29,31-40H,7-8,11-13H2,1-2H3 N/A 1 Positive BMDMS-NP 683.26 UPDATE-SINGLE-ANNOTATED-GOLD Gold C32H42O16 SSZQYOJANKKXOX-UHFFFAOYSA-N SSZQYOJANKKXOX N/A N/A N/A Lignans Dibenzylbutyrolactone lignans Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00006445616 CCMSLIB00010105172 411 spectra_filtered.mgf BERKELEY-LAB.mgf 0.919127 2904700.0 0 104202.0 6 26.0609 276.16 1 temp/spectra_filtered.mgf411 1 (2E)-3-(4-chlorophenyl)-1-piperidylprop-2-en-1-one CollisionEnergy:102040 LC-ESI Orbitrap Commercial Trent Northen JGI M+H 250.099 0.0 1 N/A N/A O=C(C=Cc1ccc(Cl)cc1)N1CCCCC1 """InChI=1S/C14H16ClNO/c15-13-7-4-12(5-8-13)6-9-14(17)16-10-2-1-3-11-16/h4-9H,1-3,10-11H2/b9-6+""" N/A 3 Positive BERKELEY-LAB 250.099 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C14H16ClNO UCBCOMZMXLGOSD-UHFFFAOYSA-N UCBCOMZMXLGOSD N/A N/A N/A Lysine alkaloids Piperidine alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00010105172 CCMSLIB00003135392 127 spectra_filtered.mgf GNPS-NIST14-MATCHES.mgf 0.916755 1688000.0 0 26.2085 6 0.0078125 298.098 1 temp/spectra_filtered.mgf127 1 Spectral Match to Adenosine, 5'-S-methyl-5'-thio- from NIST14 ESI qTof Isolated Data from Pieter Dorrestein Data deposited by lfnothias M+H 298.09 297.09 1 2457809 N/A CSC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)O InChI=1S/C11H15N5O3S/c1-20-2-5-7(17)8(18)11(19-5)16-4-15-6-9(12)13-3-14-10(6)16/h3-5,7-8,11,17-18H,2H2,1H3,(H2,12,13,14)/t5-,7-,8-,11-/m1/s1 N/A 3 Positive GNPS-NIST14-MATCHES 298.09 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C11H15N5O3S WUUGFSXJNOTRMR-IOSLPCCCSA-N WUUGFSXJNOTRMR Nucleosides, nucleotides, and analogues 5'-deoxyribonucleosides 5'-deoxy-5'-thionucleosides Nucleosides Purine nucleos(t)ides Carbohydrates mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00003135392 CCMSLIB00006678134 859 spectra_filtered.mgf GNPS-LIBRARY.mgf 0.915403 32600700.0 0 24583.6 9 21.9664 871.573 1 temp/spectra_filtered.mgf859 1 Chlorophyll a LC-ESI Orbitrap Other S Ding Su Ding M+H 893.539 893.539 1 N/A N/A N/A N/A N/A 3 Positive GNPS-LIBRARY 893.539 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze N/A N/A N/A N/A N/A N/A N/A N/A N/A mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00006678134 CCMSLIB00006678134 837 spectra_filtered.mgf GNPS-LIBRARY.mgf 0.915281 18936600.0 0 24583.3 8 21.9661 871.573 1 temp/spectra_filtered.mgf837 1 Chlorophyll a LC-ESI Orbitrap Other S Ding Su Ding M+H 893.539 893.539 1 N/A N/A N/A N/A N/A 3 Positive GNPS-LIBRARY 893.539 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze N/A N/A N/A N/A N/A N/A N/A N/A N/A mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00006678134 CCMSLIB00012447737 364 spectra_filtered.mgf MSNLIB-POSITIVE.mgf 0.914882 8533400.0 0 484015.0 6 274.053 292.155 1 temp/spectra_filtered.mgf364 1 Sibiricose A6 ESI Orbitrap Crude Tomas Pluskal Corinna Brungs [M+NH4]+ 566.208 548.174 1 N/A N/A COc1cc(/C=C/C(=O)O[C@H]2[C@H](O)[C@@H](CO)O[C@@]2(CO)O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O InChI=1S/C23H32O15/c1-33-11-5-10(6-12(34-2)16(11)28)3-4-15(27)36-21-18(30)14(8-25)37-23(21,9-26)38-22-20(32)19(31)17(29)13(7-24)35-22/h3-6,13-14,17-22,24-26,28-32H,7-9H2,1-2H3/b4-3+/t13-,14-,17-,18-,19+,20-,21+,22-,23+/m1/s1 WTCVROXOIQEIRC-IBVGEFGBSA-N 1 Positive MSNLIB-POSITIVE 566.208 UPDATE-SINGLE-ANNOTATED-GOLD Gold C23H32O15 WTCVROXOIQEIRC-IBVGEFGBSA-N WTCVROXOIQEIRC Phenylpropanoids and polyketides Cinnamic acids and derivatives Hydroxycinnamic acids and derivatives Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012447737 CCMSLIB00004696002 199 spectra_filtered.mgf MONA.mgf 0.914225 5502200.0 0 0.307654 19 0.000183105 595.166 1 temp/spectra_filtered.mgf199 1 apigenin 6,8-digalactoside N/A ESI-QFT isolated MoNA MoNA:VF-NPL-QEHF004939 [M+H]+ 595.166 0.0 1 N/A N/A O=c1cc(-c2ccc(O)cc2)oc2c(C3OC(CO)C(O)C(O)C3O)c(O)c(C3OC(CO)C(O)C(O)C3O)c(O)c12 InChI=1S/C27H30O15/c28-6-12-17(32)21(36)23(38)26(41-12)15-19(34)14-10(31)5-11(8-1-3-9(30)4-2-8)40-25(14)16(20(15)35)27-24(39)22(37)18(33)13(7-29)42-27/h1-5,12-13,17-18,21-24,26-30,32-39H,6-7H2 N/A 3 positive MONA 595.166 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C27H30O15 FIAAVMJLAGNUKW-UHFFFAOYSA-N FIAAVMJLAGNUKW Phenylpropanoids and polyketides Flavonoids Flavonoid glycosides Flavonoids Flavones Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00004696002 CCMSLIB00011429077 524 spectra_filtered.mgf XANTHONES-DB.mgf 0.913163 1592500.0 0 168292.0 8 51.0075 354.098 1 temp/spectra_filtered.mgf524 1 5-hydroxy-1,2,3-trimethoxyxanthone ESI qTof Isolated Severine Derbre Manon Meunier M-H 303.09 302.079 1 N/A N/A O=C1C2=C(OC)C(OC)=C(OC)C=C2OC3=C(O)C=CC=C31 InChI=1S/C16H14O6/c1-19-11-7-10-12(16(21-3)15(11)20-2)13(18)8-5-4-6-9(17)14(8)22-10/h4-7,17H,1-3H3 N/A 1 Positive XANTHONES-DB 303.09 UPDATE-SINGLE-ANNOTATED-GOLD Gold C16H14O6 BQFIZOHBSDOURY-UHFFFAOYSA-N BQFIZOHBSDOURY Organoheterocyclic compounds Benzopyrans 1-benzopyrans Xanthones Plant xanthones Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00011429077 CCMSLIB00011428145 258 spectra_filtered.mgf LEAFBOT.mgf 0.911914 2043600.0 0 18172.0 7 14.0149 757.219 1 temp/spectra_filtered.mgf258 1 TYPHANEOSIDE ESI Orbitrap Commercial Cech Vicky Anderson M+H 771.234 770.227 1 104472-68-6 N/A CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC(=C(C=C5)O)OC)OC6C(C(C(C(O6)C)O)O)O)O)O)O)O)O """InChI=1S/C34H42O20/c1-10-20(38)24(42)27(45)32(49-10)48-9-18-22(40)26(44)31(54-33-28(46)25(43)21(39)11(2)50-33)34(52-18)53-30-23(41)19-15(37)7-13(35)8-17(19)51-29(30)12-4-5-14(36)16(6-12)47-3/h4-8,10-11,18,20-22,24-28,31-40,42-46H,9H2,1-3H3""" N/A 1 Positive LEAFBOT 771.234 UPDATE-SINGLE-ANNOTATED-GOLD Gold C34H42O20 POMAQDQEVHXLGT-UHFFFAOYSA-N POMAQDQEVHXLGT Phenylpropanoids and polyketides Flavonoids Flavonoid glycosides Flavonoids Flavonols Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00011428145 CCMSLIB00012432214 706 spectra_filtered.mgf MSNLIB-POSITIVE.mgf 0.909653 3112600.0 0 465766.0 8 327.173 375.269 1 temp/spectra_filtered.mgf706 1 CHEBI:181245 ESI Orbitrap Crude Tomas Pluskal Corinna Brungs [M+NH4]+ 702.442 684.408 1 N/A N/A CC(CC(O)C(O)C(C)(C)O)C1CCC2(C)C3CCC4C(C)(C(=O)OC5OC(CO)C(O)C(O)C5O)C(O)CC(O)C45CC35CCC12C InChI=1S/C36H60O12/c1-17(13-19(38)28(44)31(2,3)46)18-9-10-33(5)21-7-8-22-34(6,30(45)48-29-27(43)26(42)25(41)20(15-37)47-29)23(39)14-24(40)36(22)16-35(21,36)12-11-32(18,33)4/h17-29,37-44,46H,7-16H2,1-6H3 RCCBGOMNZWYBTJ-UHFFFAOYSA-N 1 Positive MSNLIB-POSITIVE 702.442 UPDATE-SINGLE-ANNOTATED-GOLD Gold C36H60O12 RCCBGOMNZWYBTJ-UHFFFAOYSA-N RCCBGOMNZWYBTJ Lipids and lipid-like molecules Prenol lipids Terpene glycosides Triterpenoids Cycloartane triterpenoids Terpenoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012432214 CCMSLIB00006415484 9 spectra_filtered.mgf BMDMS-NP.mgf 0.909027 11543000.0 0 277304.0 7 84.026 218.984 1 temp/spectra_filtered.mgf9 1 2,3,7,8-tetrahydroxychromeno[5,4,3-cde]chromene-5,10-dione ESI Orbitrap Commercial standard BMDMS-NP BMDMS-NP [M+H]+ 303.01 302.006 1 N/A N/A O=C1OC2=C(O)C(O)=CC=3C(=O)OC=4C(O)=C(O)C=C1C4C23 InChI=1S/C14H6O8/c15-5-1-3-7-8-4(14(20)22-11(7)9(5)17)2-6(16)10(18)12(8)21-13(3)19/h1-2,15-18H N/A 1 Positive BMDMS-NP 303.01 UPDATE-SINGLE-ANNOTATED-GOLD Gold C14H6O8 AFSDNFLWKVMVRB-UHFFFAOYSA-N AFSDNFLWKVMVRB Phenylpropanoids and polyketides Tannins Hydrolyzable tannins Phenolic acids (C6-C1) Gallotannins Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00006415484 CCMSLIB00012438307 350 spectra_filtered.mgf MSNLIB-POSITIVE.mgf 0.90844 3114100.0 0 1.15786 14 0.000793457 685.277 1 temp/spectra_filtered.mgf350 1 C38H40N2O10 ESI Orbitrap Crude Tomas Pluskal Corinna Brungs [M+H]+ 685.276 684.268 1 N/A N/A COc1cc([C@@H]2c3c(OC)c(O)c(OC)cc3C=C(C(=O)NCCc3ccc(O)cc3)[C@H]2C(=O)NCCc2ccc(O)cc2)cc(OC)c1O InChI=1S/C38H40N2O10/c1-47-28-19-24(20-29(48-2)34(28)43)31-32-23(18-30(49-3)35(44)36(32)50-4)17-27(37(45)39-15-13-21-5-9-25(41)10-6-21)33(31)38(46)40-16-14-22-7-11-26(42)12-8-22/h5-12,17-20,31,33,41-44H,13-16H2,1-4H3,(H,39,45)(H,40,46)/t31-,33-/m1/s1 IFNFMIMLJKQPGW-ZQWAWDFXSA-N 1 Positive MSNLIB-POSITIVE 685.276 UPDATE-SINGLE-ANNOTATED-GOLD Gold C38H40N2O10 IFNFMIMLJKQPGW-ZQWAWDFXSA-N IFNFMIMLJKQPGW N/A N/A N/A Lignans Arylnaphthalene and aryltetralin lignans Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012438307 CCMSLIB00012339100 254 spectra_filtered.mgf MSNLIB-POSITIVE.mgf 0.906803 26810000.0 0 44609.1 12 14.0151 300.16 1 temp/spectra_filtered.mgf254 1 Armepavine ESI Orbitrap Crude Tomas Pluskal Corinna Brungs [M+H]+ 314.175 313.168 1 N/A N/A COc1c(OC)cc2c(c1)CCN(C)[C@@H]2Cc1ccc(O)cc1 InChI=1S/C19H23NO3/c1-20-9-8-14-11-18(22-2)19(23-3)12-16(14)17(20)10-13-4-6-15(21)7-5-13/h4-7,11-12,17,21H,8-10H2,1-3H3/t17-/m1/s1 ZBKFZIUKXTWQTP-QGZVFWFLSA-N 1 Positive MSNLIB-POSITIVE 314.175 UPDATE-SINGLE-ANNOTATED-GOLD Gold C19H23NO3 ZBKFZIUKXTWQTP-QGZVFWFLSA-N ZBKFZIUKXTWQTP Organoheterocyclic compounds Isoquinolines and derivatives Benzylisoquinolines Tyrosine alkaloids Isoquinoline alkaloids|Tetrahydroisoquinoline alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012339100 CCMSLIB00005436049 204 spectra_filtered.mgf GNPS-LIBRARY.mgf 0.904785 4395300.0 0 44608.8 11 14.015 300.16 1 temp/spectra_filtered.mgf204 1 N,O-dimethylcoclaurine LC-ESI qTof Lysate KOOLEN/ANGOLINI ANGOLINI M+H 314.175 313.168 1 OC1=C(OC)C=C2C([C@@](CC3=CC=C(OC)C=C3)([H])N(C)CC2)=C1 InChI=1S/C19H23NO3/c1-20-9-8-14-11-19(23-3)18(21)12-16(14)17(20)10-13-4-6-15(22-2)7-5-13/h4-7,11-12,17,21H,8-10H2,1-3H3/t17-/m0/s1 3 Positive GNPS-LIBRARY 314.175 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C19H23NO3 DLDZDBDYUZLISX-KRWDZBQOSA-N DLDZDBDYUZLISX Organoheterocyclic compounds Isoquinolines and derivatives Benzylisoquinolines Tyrosine alkaloids Isoquinoline alkaloids|Tetrahydroisoquinoline alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00005436049 CCMSLIB00012443499 683 spectra_filtered.mgf MSNLIB-POSITIVE.mgf 0.904573 4300000.0 0 425394.0 8 291.153 393.279 1 temp/spectra_filtered.mgf683 1 NCGC00380456-01 ESI Orbitrap Crude Tomas Pluskal Corinna Brungs [M+NH4]+ 684.432 666.398 1 N/A N/A CC(C)(O)C1CCC(C)(C2CCC3(C)C4CCC5C(C)(C(=O)OC6OC(CO)C(O)C(O)C6O)C(O)CC(O)C56CC46CCC23C)O1 InChI=1S/C36H58O11/c1-30(2,44)24-10-12-33(5,47-24)19-9-11-31(3)20-7-8-21-34(6,29(43)46-28-27(42)26(41)25(40)18(16-37)45-28)22(38)15-23(39)36(21)17-35(20,36)14-13-32(19,31)4/h18-28,37-42,44H,7-17H2,1-6H3 YAJZEISZRAKFLZ-UHFFFAOYSA-N 1 Positive MSNLIB-POSITIVE 684.432 UPDATE-SINGLE-ANNOTATED-GOLD Gold C36H58O11 YAJZEISZRAKFLZ-UHFFFAOYSA-N YAJZEISZRAKFLZ Lipids and lipid-like molecules Prenol lipids Terpene glycosides Triterpenoids Cycloartane triterpenoids Terpenoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012443499 CCMSLIB00004720842 399 spectra_filtered.mgf MONA.mgf 0.904561 2276300.0 0 305069.0 9 97.0529 221.081 1 temp/spectra_filtered.mgf399 1 Piplartine N/A ESI-QFT isolated MoNA MoNA:VF-NPL-QEHF027261 [M+H]+ 318.134 0.0 1 N/A N/A COc1cc(/C=C/C(=O)N2CCC=CC2=O)cc(OC)c1OC InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+ N/A 3 positive MONA 318.134 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C17H19NO5 VABYUUZNAVQNPG-BQYQJAHWSA-N VABYUUZNAVQNPG N/A N/A N/A Lysine alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00004720842 CCMSLIB00003138418 616 spectra_filtered.mgf GNPS-NIST14-MATCHES.mgf 0.904184 1028400.0 0 506921.0 11 179.08 532.349 1 temp/spectra_filtered.mgf616 1 Spectral Match to Monolinolenin (9c,12c,15c) from NIST14 ESI HCD Isolated Data from Wolfender/Litaudon Data deposited by pmallard M+H 353.269 0.0 1 18465991 N/A N/A N/A N/A 3 Positive GNPS-NIST14-MATCHES 353.269 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze N/A N/A N/A N/A N/A N/A N/A N/A N/A mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00003138418 CCMSLIB00005436049 196 spectra_filtered.mgf GNPS-LIBRARY.mgf 0.903156 46690000.0 0 44609.1 11 14.0151 300.16 1 temp/spectra_filtered.mgf196 1 N,O-dimethylcoclaurine LC-ESI qTof Lysate KOOLEN/ANGOLINI ANGOLINI M+H 314.175 313.168 1 OC1=C(OC)C=C2C([C@@](CC3=CC=C(OC)C=C3)([H])N(C)CC2)=C1 InChI=1S/C19H23NO3/c1-20-9-8-14-11-19(23-3)18(21)12-16(14)17(20)10-13-4-6-15(22-2)7-5-13/h4-7,11-12,17,21H,8-10H2,1-3H3/t17-/m0/s1 3 Positive GNPS-LIBRARY 314.175 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C19H23NO3 DLDZDBDYUZLISX-KRWDZBQOSA-N DLDZDBDYUZLISX Organoheterocyclic compounds Isoquinolines and derivatives Benzylisoquinolines Tyrosine alkaloids Isoquinoline alkaloids|Tetrahydroisoquinoline alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00005436049 CCMSLIB00004713749 716 spectra_filtered.mgf MONA.mgf 0.903106 1767300.0 0 645231.0 10 715.271 393.279 1 temp/spectra_filtered.mgf716 1 (2S,3S,4S,5R,6R)-6-[[(3S,4S,6aR,6bS,8R,8aR,9R,10R,12aS,14bR)-10-acetyloxy-8a-(acetyloxymethyl)-8,9-dihydroxy-4-(hydroxymethyl)-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-4-hydroxy-3,5-bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]oxane-2-carboxylic acid N/A ESI-QFT isolated MoNA MoNA:VF-NPL-QEHF022686 [M+NH4]+ 1108.55 0.0 1 N/A N/A CC(=O)OC[C@@]12[C@@H](CC(C)(C)[C@@H](OC(C)=O)[C@@H]1O)C1=CCC3[C@@]4(C)CC[C@H](O[C@@H]5O[C@H](C(=O)O)[C@@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@H](O)[C@H]5O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@](C)(CO)C4CC[C@@]3(C)[C@]1(C)C[C@H]2O InChI=1S/C52H82O24/c1-21(56)69-20-52-24(15-47(3,4)42(41(52)66)70-22(2)57)23-9-10-28-48(5)13-12-30(49(6,19-55)27(48)11-14-50(28,7)51(23,8)16-29(52)58)73-46-39(75-45-36(64)34(62)32(60)26(18-54)72-45)37(65)38(40(76-46)43(67)68)74-44-35(63)33(61)31(59)25(17-53)71-44/h9,24-42,44-46,53-55,58-66H,10-20H2,1-8H3,(H,67,68)/t24-,25+,26+,27?,28?,29+,30-,31+,32+,33-,34-,35+,36+,37-,38-,39+,40-,41-,42-,44-,45-,46+,48-,49+,50+,51+,52-/m0/s1 N/A 3 positive MONA 1108.55 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C52H82O24 CJFSVYYGNWQUMQ-DBWNCVFDSA-N CJFSVYYGNWQUMQ Lipids and lipid-like molecules Prenol lipids Terpene glycosides Triterpenoids Oleanane triterpenoids Terpenoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00004713749 CCMSLIB00012356682 50 spectra_filtered.mgf MSNLIB-POSITIVE.mgf 0.900615 8075100.0 0 1831.25 6 0.895996 490.177 1 temp/spectra_filtered.mgf50 1 DUPA(OtBu)-OH ESI Orbitrap Crude Tomas Pluskal Corinna Brungs [M+H]+ 489.281 488.273 1 N/A N/A CC(C)(C)OC(=O)CC[C@H](NC(=O)N[C@@H](CCC(=O)O)C(=O)OC(C)(C)C)C(=O)OC(C)(C)C InChI=1S/C23H40N2O9/c1-21(2,3)32-17(28)13-11-15(19(30)34-23(7,8)9)25-20(31)24-14(10-12-16(26)27)18(29)33-22(4,5)6/h14-15H,10-13H2,1-9H3,(H,26,27)(H2,24,25,31)/t14-,15-/m0/s1 KBDDHSXZOLZZGF-GJZGRUSLSA-N 1 Positive MSNLIB-POSITIVE 489.281 UPDATE-SINGLE-ANNOTATED-GOLD Gold C23H40N2O9 KBDDHSXZOLZZGF-GJZGRUSLSA-N KBDDHSXZOLZZGF Organic acids and derivatives Carboxylic acids and derivatives Amino acids, peptides, and analogues mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012356682 CCMSLIB00005884757 65 spectra_filtered.mgf GNPS-LIBRARY.mgf 0.899804 8404000.0 0 257563.0 6 42.0106 205.119 1 temp/spectra_filtered.mgf65 1 DL-5-HYDROXYLYSINE - 60.0 eV ESI Orbitrap Isolated Madeleine Ernst Anna Abrahamsson M+H 163.108 0.0 1 13204-98-3 N/A NC[C@H](O)CC[C@H](N)C(O)=O InChI=1S/C6H14N2O3/c7-3-4(9)1-2-5(8)6(10)11/h4-5,9H,1-3,7-8H2,(H,10,11)/t4-,5+/m1/s1 N/A 1 Positive GNPS-LIBRARY 163.108 UPDATE-SINGLE-ANNOTATED-GOLD Gold C6H14N2O3 YSMODUONRAFBET-UHNVWZDZSA-N YSMODUONRAFBET Organic acids and derivatives Carboxylic acids and derivatives Amino acids, peptides, and analogues Small peptides Aminoacids Amino acids and Peptides mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00005884757 CCMSLIB00005716555 559 spectra_filtered.mgf GNPS-LIBRARY.mgf 0.898518 12016900.0 0 15798.9 6 4.978 310.108 1 temp/spectra_filtered.mgf559 1 KU036-6-1 LC-ESI qTof Isolated Birger L. Moller Oliver Gericke M+H 315.086 314.079 1 N/A N/A O=C1C2=C(O)C(OC)=C(OC)C=C2OC(C3=CC=C(O)C=C3)=C1 InChI=1S/C17H14O6/c1-21-14-8-13-15(16(20)17(14)22-2)11(19)7-12(23-13)9-3-5-10(18)6-4-9/h3-8,18,20H,1-2H3 N/A 3 Positive GNPS-LIBRARY 315.086 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C17H14O6 ZIIAJIWLQUVGHB-UHFFFAOYSA-N ZIIAJIWLQUVGHB Phenylpropanoids and polyketides Flavonoids O-methylated flavonoids Flavonoids Flavones Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00005716555 CCMSLIB00006406691 336 spectra_filtered.mgf BMDMS-NP.mgf 0.898444 9885600.0 0 95529.6 8 30.0097 344.15 1 temp/spectra_filtered.mgf336 1 Moupinamide ESI Orbitrap Commercial standard BMDMS-NP BMDMS-NP [M+H]+ 314.14 313.131 1 N/A N/A O=C(C=CC1=CC=C(O)C(OC)=C1)NCCC2=CC=C(O)C=C2 InChI=1S/C18H19NO4/c1-23-17-12-14(4-8-16(17)21)5-9-18(22)19-11-10-13-2-6-15(20)7-3-13/h2-9,12,20-21H,10-11H2,1H3,(H,19,22) N/A 1 Positive BMDMS-NP 314.14 UPDATE-SINGLE-ANNOTATED-GOLD Gold C18H19NO4 NPNNKDMSXVRADT-UHFFFAOYSA-N NPNNKDMSXVRADT Phenylpropanoids and polyketides Cinnamic acids and derivatives Hydroxycinnamic acids and derivatives Phenylpropanoids (C6-C3) Cinnamic acid amides Amino acids and Peptides|Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00006406691 CCMSLIB00006678134 866 spectra_filtered.mgf GNPS-LIBRARY.mgf 0.898189 20895200.0 0 24583.8 9 21.9666 871.572 1 temp/spectra_filtered.mgf866 1 Chlorophyll a LC-ESI Orbitrap Other S Ding Su Ding M+H 893.539 893.539 1 N/A N/A N/A N/A N/A 3 Positive GNPS-LIBRARY 893.539 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze N/A N/A N/A N/A N/A N/A N/A N/A N/A mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00006678134 CCMSLIB00010069471 732 spectra_filtered.mgf PNNL-LIPIDS-POSITIVE.mgf 0.8964 43989200.0 0 117539.0 16 98.0907 932.631 1 temp/spectra_filtered.mgf732 1 SQDG(16:0/18:3); [M+NH4]+ C43H80N1O12S1 LC-ESI HCD; Velos Commercial Thomas Metz Thomas Metz M+NH4 834.54 0.0 1 N/A N/A N/A N/A N/A 1 Positive PNNL-LIPIDS-POSITIVE 834.54 UPDATE-SINGLE-ANNOTATED-GOLD Gold N/A N/A N/A N/A N/A N/A N/A N/A N/A mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00010069471 CCMSLIB00003138475 642 spectra_filtered.mgf GNPS-NIST14-MATCHES.mgf 0.896089 2014500.0 0 504048.0 12 179.08 534.364 1 temp/spectra_filtered.mgf642 1 Spectral Match to 1-Linoleoylglycerol from NIST14 ESI qTof Isolated Data from P.Dorrestein Data deposited by amelnik M+H 355.284 354.277 1 2258926 N/A CCCCC/C=C\C/C=C\CCCCCCCC(=O)OCC(CO)O InChI=1S/C21H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-19-20(23)18-22/h6-7,9-10,20,22-23H,2-5,8,11-19H2,1H3/b7-6-,10-9- N/A 3 Positive GNPS-NIST14-MATCHES 355.284 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C21H38O4 WECGLUPZRHILCT-HZJYTTRNSA-N WECGLUPZRHILCT Lipids and lipid-like molecules Fatty Acyls Lineolic acids and derivatives Glycerolipids Monoacylglycerols Fatty acids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00003138475 CCMSLIB00003134936 602 spectra_filtered.mgf GNPS-NIST14-MATCHES.mgf 0.893951 1379900.0 0 960170.0 12 341.133 696.417 1 temp/spectra_filtered.mgf602 1 Spectral Match to 1-Linoleoylglycerol from NIST14 ESI HCD Isolated Data from Rob Knight Data deposited by amelnik M+H 355.284 0.0 1 2258926 N/A N/A N/A N/A 3 Positive GNPS-NIST14-MATCHES 355.284 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze N/A N/A N/A N/A N/A N/A N/A N/A N/A mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00003134936 CCMSLIB00004697065 721 spectra_filtered.mgf MONA.mgf 0.892912 2751000.0 0 111136.0 9 28.0321 280.264 1 temp/spectra_filtered.mgf721 1 (2E,4E)-N-(2-methylpropyl)dodeca-2,4-dienamide N/A ESI-QFT isolated MoNA MoNA:VF-NPL-QEHF006002 [M+H]+ 252.232 0.0 1 N/A N/A CCCCCCC/C=C/C=C/C(O)=NCC(C)C InChI=1S/C16H29NO/c1-4-5-6-7-8-9-10-11-12-13-16(18)17-14-15(2)3/h10-13,15H,4-9,14H2,1-3H3,(H,17,18)/b11-10+,13-12+ N/A 3 positive MONA 252.232 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C16H29NO BBRMJCAPNGJKEM-AQASXUMVSA-N BBRMJCAPNGJKEM Lipids and lipid-like molecules Fatty Acyls Fatty amides Fatty acyls Fatty alcohols|Hydrocarbons Fatty acids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00004697065 CCMSLIB00003136412 787 spectra_filtered.mgf GNPS-NIST14-MATCHES.mgf 0.892869 392900.0 0 91868.2 8 38.1483 453.398 1 temp/spectra_filtered.mgf787 1 Spectral Match to Nonaethylene glycol from NIST14 ESI QqQ Isolated Data from Piel Data deposited by eriche M+H 415.25 0.0 1 3386183 N/A N/A N/A N/A 3 Positive GNPS-NIST14-MATCHES 415.25 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze N/A N/A N/A N/A N/A N/A N/A N/A N/A mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00003136412 CCMSLIB00003138727 647 spectra_filtered.mgf GNPS-NIST14-MATCHES.mgf 0.891581 3864200.0 0 6.12193 6 0.00170898 279.16 1 temp/spectra_filtered.mgf647 1 Spectral Match to Dibutyl phthalate from NIST14 ESI QqQ Isolated Data from Pieter Dorrestein Data deposited by lfnothias M+H 279.158 0.0 1 84742 N/A N/A N/A N/A 3 Positive GNPS-NIST14-MATCHES 279.158 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze N/A N/A N/A N/A N/A N/A N/A N/A N/A mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00003138727 CCMSLIB00010121750 444 spectra_filtered.mgf BERKELEY-LAB.mgf 0.890942 7068200.0 0 124069.0 6 302.092 353.116 2 temp/spectra_filtered.mgf444 1 """(2E)-N-{[(4-methoxyphenyl)amino]thioxomethyl}-3-(3,4,5-trimethoxyphenyl)prop-2 -enamide CollisionEnergy:205060""" LC-ESI Orbitrap Commercial Trent Northen JGI M+H 403.132 0.0 1 N/A N/A COc1ccc(NC(=S)N=C(O)C=Cc2cc(OC)c(OC)c(OC)c2)cc1 """InChI=1S/C20H22N2O5S/c1-24-15-8-6-14(7-9-15)21-20(28)22-18(23)10-5-13-11-16(25-2)19(27-4)17(12-13)26-3/h5-12H,1-4H3,(H2,21,22,23,28)/b10-5+""" N/A 3 Positive BERKELEY-LAB 403.132 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C20H22N2O5S VUGRMQHRMVCMQQ-UHFFFAOYSA-N VUGRMQHRMVCMQQ Benzenoids Benzene and substituted derivatives N-phenylthioureas Phenylpropanoids (C6-C3) Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00010121750 CCMSLIB00010128701 759 spectra_filtered.mgf GNPS-LIBRARY.mgf 0.88828 51338400.0 0 0.901595 15 0.000549316 609.271 1 temp/spectra_filtered.mgf759 1 3.10S-Hydroxypheophorbide a LC-ESI Orbitrap Isolated Wolfender R. Huber M+H 609.272 0.0 1 OC(CC[C@H]1[C@@H](C2=N/C1=C([C@](C(OC)=O)(O)C3=O)\C4=C3C(C)=C(N4)/C=C5N=C(C(C)=C\5CC)/C=C(N/6)/C(C=C)=C(C6=C\2)C)C)=O InChI=1S/C35H36N4O6/c1-8-19-15(3)22-12-24-17(5)21(10-11-28(40)41)31(38-24)30-32-29(33(42)35(30,44)34(43)45-7)18(6)25(39-32)14-27-20(9-2)16(4)23(37-27)13-26(19)36-22/h8,12-14,17,21,36,39,44H,1,9-11H2,2-7H3,(H,40,41)/t17-,21-,35-/m0/s1 3 Positive GNPS-LIBRARY 609.272 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C35H36N4O6 TXOKSKCKTYISQV-FHCXDJKBSA-N TXOKSKCKTYISQV Organoheterocyclic compounds Tetrapyrroles and derivatives Chlorins Tryptophan alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00010128701 CCMSLIB00004716190 225 spectra_filtered.mgf MONA.mgf 0.887698 103725000.0 0 3072.07 9 1.05441 342.171 1 temp/spectra_filtered.mgf225 1 Spegatrine N/A ESI-QFT isolated MoNA MoNA:VF-NPL-QEHF025127 [M+NH4]+ 343.225 0.0 1 N/A N/A C/C=C1/C[N+]2(C)C3Cc4c([nH]c5ccc(O)cc45)[C@@H]2C[C@H]1[C@H]3CO InChI=1S/C20H24N2O2/c1-3-11-9-22(2)18-8-15-14-6-12(24)4-5-17(14)21-20(15)19(22)7-13(11)16(18)10-23/h3-6,13,16,18-19,21,23H,7-10H2,1-2H3/p+1/b11-3-/t13-,16-,18?,19+,22?/m1/s1 N/A 3 positive MONA 343.225 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze N/A DOTYYDUNWITJSJ-SYMHJQAPSA-O DOTYYDUNWITJSJ N/A N/A N/A N/A N/A N/A mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00004716190 CCMSLIB00004720840 448 spectra_filtered.mgf MONA.mgf 0.88767 73663900.0 0 586304.0 8 186.523 504.657 1 temp/spectra_filtered.mgf448 1 Piplartine N/A ESI-QFT isolated MoNA MoNA:VF-NPL-QEHF027259 [M+H]+ 318.134 0.0 1 N/A N/A COc1cc(/C=C/C(=O)N2CCC=CC2=O)cc(OC)c1OC InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+ N/A 3 positive MONA 318.134 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C17H19NO5 VABYUUZNAVQNPG-BQYQJAHWSA-N VABYUUZNAVQNPG N/A N/A N/A Lysine alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00004720840 CCMSLIB00012444262 197 spectra_filtered.mgf MSNLIB-POSITIVE.mgf 0.886724 28328700.0 0 286160.0 12 174.053 434.181 1 temp/spectra_filtered.mgf197 1 NCGC00347814-02 ESI Orbitrap Crude Tomas Pluskal Corinna Brungs [M+H]+ 608.234 607.227 1 N/A N/A CC(=O)N1CCc2c(c(OC3OC(COC4OCC(O)(CO)C4O)C(O)C(O)C3O)c(O)cc2)C1Cc1ccc(O)cc1 InChI=1S/C29H37NO13/c1-14(32)30-9-8-16-4-7-19(34)25(21(16)18(30)10-15-2-5-17(33)6-3-15)43-27-24(37)23(36)22(35)20(42-27)11-40-28-26(38)29(39,12-31)13-41-28/h2-7,18,20,22-24,26-28,31,33-39H,8-13H2,1H3 CZSDLEOHLKBTSI-UHFFFAOYSA-N 1 Positive MSNLIB-POSITIVE 608.234 UPDATE-SINGLE-ANNOTATED-GOLD Gold C29H37NO13 CZSDLEOHLKBTSI-UHFFFAOYSA-N CZSDLEOHLKBTSI Organoheterocyclic compounds Isoquinolines and derivatives Benzylisoquinolines mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012444262 CCMSLIB00005716555 461 spectra_filtered.mgf GNPS-LIBRARY.mgf 0.886504 2782300.0 0 60281.0 6 18.9937 296.092 1 temp/spectra_filtered.mgf461 1 KU036-6-1 LC-ESI qTof Isolated Birger L. Moller Oliver Gericke M+H 315.086 314.079 1 N/A N/A O=C1C2=C(O)C(OC)=C(OC)C=C2OC(C3=CC=C(O)C=C3)=C1 InChI=1S/C17H14O6/c1-21-14-8-13-15(16(20)17(14)22-2)11(19)7-12(23-13)9-3-5-10(18)6-4-9/h3-8,18,20H,1-2H3 N/A 3 Positive GNPS-LIBRARY 315.086 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C17H14O6 ZIIAJIWLQUVGHB-UHFFFAOYSA-N ZIIAJIWLQUVGHB Phenylpropanoids and polyketides Flavonoids O-methylated flavonoids Flavonoids Flavones Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00005716555 CCMSLIB00003137008 276 spectra_filtered.mgf GNPS-NIST14-MATCHES.mgf 0.886413 4864100.0 0 1.79785 14 0.0010376 577.135 1 temp/spectra_filtered.mgf276 1 Spectral Match to Procyanidin A1 from NIST14 ESI qTof Isolated Data from P.Dorrestein Data deposited by amelnik M+H 577.134 576.127 1 12798560 N/A C1[C@@H]([C@H](OC2=C1C(=CC3=C2[C@@H]4[C@H]([C@](O3)(OC5=CC(=CC(=C45)O)O)C6=CC(=C(C=C6)O)O)O)O)C7=CC(=C(C=C7)O)O)O InChI=1S/C30H24O12/c31-13-7-20(37)24-22(8-13)41-30(12-2-4-16(33)19(36)6-12)29(39)26(24)25-23(42-30)10-17(34)14-9-21(38)27(40-28(14)25)11-1-3-15(32)18(35)5-11/h1-8,10,21,26-27,29,31-39H,9H2/t21-,26+,27+,29+,30-/m0/s1 N/A 3 Positive GNPS-NIST14-MATCHES 577.134 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C30H24O12 NSEWTSAADLNHNH-TXZJYACMSA-N NSEWTSAADLNHNH Phenylpropanoids and polyketides Flavonoids Biflavonoids and polyflavonoids Flavonoids Proanthocyanins Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00003137008 CCMSLIB00003138418 612 spectra_filtered.mgf GNPS-NIST14-MATCHES.mgf 0.885971 9931300.0 0 506921.0 11 179.08 532.349 1 temp/spectra_filtered.mgf612 1 Spectral Match to Monolinolenin (9c,12c,15c) from NIST14 ESI HCD Isolated Data from Wolfender/Litaudon Data deposited by pmallard M+H 353.269 0.0 1 18465991 N/A N/A N/A N/A 3 Positive GNPS-NIST14-MATCHES 353.269 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze N/A N/A N/A N/A N/A N/A N/A N/A N/A mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00003138418 CCMSLIB00012447763 609 spectra_filtered.mgf MSNLIB-POSITIVE.mgf 0.885693 1203300.0 0 308708.0 9 146.131 327.232 1 temp/spectra_filtered.mgf609 1 NCGC00385237-01 ESI Orbitrap Crude Tomas Pluskal Corinna Brungs [M+H]+ 473.363 472.355 1 N/A N/A CC(C(O)/C=C/C(C)(C)O)C1CCC2(C)C3C(=O)C=C4C(CCC(O)C4(C)C)C3(C)CCC12C InChI=1S/C30H48O4/c1-18(22(31)12-13-26(2,3)34)19-11-14-30(8)25-23(32)17-21-20(9-10-24(33)27(21,4)5)28(25,6)15-16-29(19,30)7/h12-13,17-20,22,24-25,31,33-34H,9-11,14-16H2,1-8H3/b13-12+ MMQUESDXUKYFEN-OUKQBFOZSA-N 1 Positive MSNLIB-POSITIVE 473.363 UPDATE-SINGLE-ANNOTATED-GOLD Gold C30H48O4 MMQUESDXUKYFEN-OUKQBFOZSA-N MMQUESDXUKYFEN Lipids and lipid-like molecules Steroids and steroid derivatives Cucurbitacins Triterpenoids Cucurbitane triterpenoids Terpenoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012447763 CCMSLIB00010108678 227 spectra_filtered.mgf BERKELEY-LAB.mgf 0.885209 209750000.0 0 118280.0 9 44.0257 328.191 1 temp/spectra_filtered.mgf227 1 AC1L9EVY CollisionEnergy:102040 LC-ESI Orbitrap Commercial Trent Northen JGI M 372.217 0.0 1 N/A N/A COc1ccc(CC2c3cc(OC)c(OC)cc3CC[N+]2(C)C)cc1OC """InChI=1S/C22H30NO4/c1-23(2)10-9-16-13-21(26-5)22(27-6)14-17(16)18(23)11-15-7-8-19(24-3)20(12-15)25-4/h7-8,12-14,18H,9-11H2,1-6H3/q+1""" N/A 3 Positive BERKELEY-LAB 372.217 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze N/A RVBHVIRGZXRPRX-UHFFFAOYSA-N RVBHVIRGZXRPRX Organoheterocyclic compounds Isoquinolines and derivatives Benzylisoquinolines N/A N/A N/A mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00010108678 CCMSLIB00012254917 713 spectra_filtered.mgf CMMC-REFRAME-POSITIVE-LIBRARY.mgf 0.883006 3818100.0 0 293278.0 7 176.104 424.364 1 temp/spectra_filtered.mgf713 1 Polidocanol LC-ESI Orbitrap Commercial Pieter C. Dorrestein Nina Haoqi Zhao [M+NH4]+ 600.468 582.434 1 N/A N/A CCCCCCCCCCCCOCCOCCOCCOCCOCCOCCOCCOCCOCCO """InChI=1S/C30H62O10/c1-2-3-4-5-6-7-8-9-10-11-13-32-15-17-34-19-21-36-23-25-38-27-29-40-30-28-39-26-24-37-22-20-35-18-16-33-14-12-31/h31H,2-30H2,1H3""" ONJQDTZCDSESIW-UHFFFAOYSA-N 1 Positive PRIVATE-LIB 600.468 UPDATE-SINGLE-ANNOTATED-GOLD Gold C30H62O10 ONJQDTZCDSESIW-UHFFFAOYSA-N ONJQDTZCDSESIW Organic oxygen compounds Organooxygen compounds Ethers Glycerolipids Triacylglycerols Fatty acids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012254917 CCMSLIB00005724651 635 spectra_filtered.mgf GNPS-LIBRARY.mgf 0.881647 1217500.0 0 2937.13 6 0.91153 311.259 1 temp/spectra_filtered.mgf635 1 (2R,6R)-2-methyl-6-pentadecylpiperidine ESI Orbitrap Isolated Wolfender Luis Quiros-Guerrero M+H 310.347 309.34 1 N/A N/A CCCCCCCCCCCCCCC[C@@H]1N[C@@H](C)CCC1 InChI=1S/C21H43N/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-18-21-19-16-17-20(2)22-21/h20-22H,3-19H2,1-2H3/t20-,21-/m0/s1 N/A 1 Positive GNPS-LIBRARY 310.347 UPDATE-SINGLE-ANNOTATED-GOLD Gold C21H43N UZFYSJNBWVQZQB-SFTDATJTSA-N UZFYSJNBWVQZQB N/A N/A N/A Lysine alkaloids Piperidine alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00005724651 CCMSLIB00003139970 617 spectra_filtered.mgf GNPS-NIST14-MATCHES.mgf 0.880219 811100.0 0 149732.0 11 46.007 353.269 1 temp/spectra_filtered.mgf617 1 Spectral Match to cis-5,8,11-Eicosatrienoic acid from NIST14 ESI qTof Isolated Data from Wolfender/Litaudon Data deposited by pmallard M+H 307.262 306.256 1 20590323 N/A CCCCCCCC/C=C\C/C=C\C/C=C\CCCC(=O)O InChI=1S/C20H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h9-10,12-13,15-16H,2-8,11,14,17-19H2,1H3,(H,21,22)/b10-9-,13-12-,16-15- N/A 3 Positive GNPS-NIST14-MATCHES 307.262 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C20H34O2 UNSRRHDPHVZAHH-YOILPLPUSA-N UNSRRHDPHVZAHH Lipids and lipid-like molecules Fatty Acyls Fatty acids and conjugates Fatty Acids and Conjugates Unsaturated fatty acids Fatty acids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00003139970 CCMSLIB00006370342 175 spectra_filtered.mgf BMDMS-NP.mgf 0.87888 1844300.0 0 26589.5 6 8.05688 311.067 1 temp/spectra_filtered.mgf175 1 Ellagic acid ESI Orbitrap Commercial standard BMDMS-NP BMDMS-NP [M+H]+ 303.01 302.006 1 N/A N/A O=C1OC2=C(O)C(O)=CC=3C(=O)OC=4C(O)=C(O)C=C1C4C23 InChI=1S/C14H6O8/c15-5-1-3-7-8-4(14(20)22-11(7)9(5)17)2-6(16)10(18)12(8)21-13(3)19/h1-2,15-18H N/A 1 Positive BMDMS-NP 303.01 UPDATE-SINGLE-ANNOTATED-GOLD Gold C14H6O8 AFSDNFLWKVMVRB-UHFFFAOYSA-N AFSDNFLWKVMVRB Phenylpropanoids and polyketides Tannins Hydrolyzable tannins Phenolic acids (C6-C1) Gallotannins Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00006370342 CCMSLIB00004713749 679 spectra_filtered.mgf MONA.mgf 0.878807 12386000.0 0 661478.0 9 733.282 375.268 1 temp/spectra_filtered.mgf679 1 (2S,3S,4S,5R,6R)-6-[[(3S,4S,6aR,6bS,8R,8aR,9R,10R,12aS,14bR)-10-acetyloxy-8a-(acetyloxymethyl)-8,9-dihydroxy-4-(hydroxymethyl)-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-4-hydroxy-3,5-bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]oxane-2-carboxylic acid N/A ESI-QFT isolated MoNA MoNA:VF-NPL-QEHF022686 [M+NH4]+ 1108.55 0.0 1 N/A N/A CC(=O)OC[C@@]12[C@@H](CC(C)(C)[C@@H](OC(C)=O)[C@@H]1O)C1=CCC3[C@@]4(C)CC[C@H](O[C@@H]5O[C@H](C(=O)O)[C@@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@H](O)[C@H]5O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@](C)(CO)C4CC[C@@]3(C)[C@]1(C)C[C@H]2O InChI=1S/C52H82O24/c1-21(56)69-20-52-24(15-47(3,4)42(41(52)66)70-22(2)57)23-9-10-28-48(5)13-12-30(49(6,19-55)27(48)11-14-50(28,7)51(23,8)16-29(52)58)73-46-39(75-45-36(64)34(62)32(60)26(18-54)72-45)37(65)38(40(76-46)43(67)68)74-44-35(63)33(61)31(59)25(17-53)71-44/h9,24-42,44-46,53-55,58-66H,10-20H2,1-8H3,(H,67,68)/t24-,25+,26+,27?,28?,29+,30-,31+,32+,33-,34-,35+,36+,37-,38-,39+,40-,41-,42-,44-,45-,46+,48-,49+,50+,51+,52-/m0/s1 N/A 3 positive MONA 1108.55 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C52H82O24 CJFSVYYGNWQUMQ-DBWNCVFDSA-N CJFSVYYGNWQUMQ Lipids and lipid-like molecules Prenol lipids Terpene glycosides Triterpenoids Oleanane triterpenoids Terpenoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00004713749 CCMSLIB00005884276 100 spectra_filtered.mgf GNPS-LIBRARY.mgf 0.875217 1608200.0 0 76868.7 6 19.0659 267.098 1 temp/spectra_filtered.mgf100 1 PYRIDOXAL 5'-PHOSPHATE - 30.0 eV ESI Orbitrap Isolated Madeleine Ernst Anna Abrahamsson M+H 248.032 0.0 1 853645-22-4 N/A CC1=NC=C(COP(O)(O)=O)C(C=O)=C1O InChI=1S/C8H10NO6P/c1-5-8(11)7(3-10)6(2-9-5)4-15-16(12,13)14/h2-3,11H,4H2,1H3,(H2,12,13,14) N/A 1 Positive GNPS-LIBRARY 248.032 UPDATE-SINGLE-ANNOTATED-GOLD Gold C8H10NO6P NGVDGCNFYWLIFO-UHFFFAOYSA-N NGVDGCNFYWLIFO Organoheterocyclic compounds Pyridines and derivatives Pyridine carboxaldehydes Nicotinic acid alkaloids Pyridine alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00005884276 CCMSLIB00010125850 166 spectra_filtered.mgf BERKELEY-LAB.mgf 0.874911 6976000.0 0 354800.0 6 55.0061 210.04 1 temp/spectra_filtered.mgf166 1 patulin CollisionEnergy:205060 LC-ESI Orbitrap Commercial Trent Northen JGI M+H 155.034 0.0 1 N/A N/A O=C1C=C2C(=CCOC2O)O1 """InChI=1S/C7H6O4/c8-6-3-4-5(11-6)1-2-10-7(4)9/h1,3,7,9H,2H2""" N/A 3 Positive BERKELEY-LAB 155.034 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C7H6O4 ZRWPUFFVAOMMNM-UHFFFAOYSA-N ZRWPUFFVAOMMNM N/A N/A N/A Miscellaneous polyketides Miscellaneous polyketides Polyketides mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00010125850 CCMSLIB00010128701 741 spectra_filtered.mgf GNPS-LIBRARY.mgf 0.874499 17000700.0 0 1.3023 14 0.000793457 609.271 1 temp/spectra_filtered.mgf741 1 3.10S-Hydroxypheophorbide a LC-ESI Orbitrap Isolated Wolfender R. Huber M+H 609.272 0.0 1 OC(CC[C@H]1[C@@H](C2=N/C1=C([C@](C(OC)=O)(O)C3=O)\C4=C3C(C)=C(N4)/C=C5N=C(C(C)=C\5CC)/C=C(N/6)/C(C=C)=C(C6=C\2)C)C)=O InChI=1S/C35H36N4O6/c1-8-19-15(3)22-12-24-17(5)21(10-11-28(40)41)31(38-24)30-32-29(33(42)35(30,44)34(43)45-7)18(6)25(39-32)14-27-20(9-2)16(4)23(37-27)13-26(19)36-22/h8,12-14,17,21,36,39,44H,1,9-11H2,2-7H3,(H,40,41)/t17-,21-,35-/m0/s1 3 Positive GNPS-LIBRARY 609.272 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C35H36N4O6 TXOKSKCKTYISQV-FHCXDJKBSA-N TXOKSKCKTYISQV Organoheterocyclic compounds Tetrapyrroles and derivatives Chlorins Tryptophan alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00010128701 CCMSLIB00003139689 638 spectra_filtered.mgf GNPS-NIST14-MATCHES.mgf 0.872298 560300.0 0 1.07482 9 0.000488281 454.293 1 temp/spectra_filtered.mgf638 1 Spectral Match to 1-Palmitoyl-2-hydroxy-sn-glycero-3-phosphoethanolamine from NIST14 ESI HCD Isolated Data from Pieter Dorrestein Data deposited by lfnothias M+H 454.293 0.0 1 53862354 N/A N/A N/A N/A 3 Positive GNPS-NIST14-MATCHES 454.293 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze N/A N/A N/A N/A N/A N/A N/A N/A N/A mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00003139689 CCMSLIB00010108678 191 spectra_filtered.mgf BERKELEY-LAB.mgf 0.871727 2029200.0 0 75308.0 10 28.0309 344.186 1 temp/spectra_filtered.mgf191 1 AC1L9EVY CollisionEnergy:102040 LC-ESI Orbitrap Commercial Trent Northen JGI M 372.217 0.0 1 N/A N/A COc1ccc(CC2c3cc(OC)c(OC)cc3CC[N+]2(C)C)cc1OC """InChI=1S/C22H30NO4/c1-23(2)10-9-16-13-21(26-5)22(27-6)14-17(16)18(23)11-15-7-8-19(24-3)20(12-15)25-4/h7-8,12-14,18H,9-11H2,1-6H3/q+1""" N/A 3 Positive BERKELEY-LAB 372.217 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze N/A RVBHVIRGZXRPRX-UHFFFAOYSA-N RVBHVIRGZXRPRX Organoheterocyclic compounds Isoquinolines and derivatives Benzylisoquinolines N/A N/A N/A mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00010108678 CCMSLIB00006112954 44 spectra_filtered.mgf BIRMINGHAM-UHPLC-MS-POS.mgf 0.867827 760300.0 0 419797.0 10 144.042 487.166 1 temp/spectra_filtered.mgf44 1 beta-Lactose - 40.0 eV ESI Orbitrap Isolated PI Data Collector M+H 343.124 0.0 1 N/A C([C@@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)O[C@@H]2[C@H](O[C@H]([C@@H]([C@H]2O)O)O)CO)O)O)O)O InChI=1S/C12H22O11/c13-1-3-5(15)6(16)9(19)12(22-3)23-10-4(2-14)21-11(20)8(18)7(10)17/h3-20H,1-2H2/t3-,4-,5+,6+,7-,8-,9-,10-,11-,12+/m1/s1 N/A 1 Positive BIRMINGHAM-UHPLC-MS-POS 343.124 UPDATE-SINGLE-ANNOTATED-GOLD Gold C12H22O11 GUBGYTABKSRVRQ-DCSYEGIMSA-N GUBGYTABKSRVRQ Organic oxygen compounds Organooxygen compounds Carbohydrates and carbohydrate conjugates Saccharides Disaccharides|Polysaccharides Carbohydrates mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00006112954 CCMSLIB00003136629 73 spectra_filtered.mgf GNPS-NIST14-MATCHES.mgf 0.866322 3232000.0 0 97729.9 10 30.0112 337.094 1 temp/spectra_filtered.mgf73 1 Spectral Match to Glutathione, oxidized from NIST14 ESI qTof Isolated Data from Piel, Dittmann Data deposited by eriche M+2H 307.083 612.152 1 27025418 N/A C(CC(=O)N[C@@H](CSSC[C@@H](C(=O)NCC(=O)O)NC(=O)CC[C@@H](C(=O)O)N)C(=O)NCC(=O)O)[C@@H](C(=O)O)N InChI=1S/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/t9-,10-,11-,12-/m0/s1 N/A 3 Positive GNPS-NIST14-MATCHES 307.083 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C20H32N6O12S2 YPZRWBKMTBYPTK-BJDJZHNGSA-N YPZRWBKMTBYPTK Organic acids and derivatives Carboxylic acids and derivatives Amino acids, peptides, and analogues Small peptides Tripeptides Amino acids and Peptides mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00003136629 CCMSLIB00003136412 783 spectra_filtered.mgf GNPS-NIST14-MATCHES.mgf 0.866101 288800.0 0 197891.0 8 82.1744 497.424 1 temp/spectra_filtered.mgf783 1 Spectral Match to Nonaethylene glycol from NIST14 ESI QqQ Isolated Data from Piel Data deposited by eriche M+H 415.25 0.0 1 3386183 N/A N/A N/A N/A 3 Positive GNPS-NIST14-MATCHES 415.25 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze N/A N/A N/A N/A N/A N/A N/A N/A N/A mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00003136412 CCMSLIB00010107835 485 spectra_filtered.mgf BERKELEY-LAB.mgf 0.865381 7353000.0 0 162046.0 6 53.0148 274.144 1 temp/spectra_filtered.mgf485 1 """4-(methylethyl)phenyl (2E)-3-(2,4-dimethoxyphenyl)prop-2-enoate CollisionEnergy:102040""" LC-ESI Orbitrap Commercial Trent Northen JGI M+H 327.159 0.0 1 N/A N/A COc1ccc(C=CC(=O)Oc2ccc(C(C)C)cc2)c(OC)c1 """InChI=1S/C20H22O4/c1-14(2)15-5-9-17(10-6-15)24-20(21)12-8-16-7-11-18(22-3)13-19(16)23-4/h5-14H,1-4H3/b12-8+""" N/A 3 Positive BERKELEY-LAB 327.159 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C20H22O4 IJEFZWYCCMROKK-UHFFFAOYSA-N IJEFZWYCCMROKK Phenylpropanoids and polyketides Cinnamic acids and derivatives Cinnamic acid esters Flavonoids Chalcones Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00010107835 CCMSLIB00004720478 117 spectra_filtered.mgf MONA.mgf 0.865268 1087900.0 0 301052.0 6 143.057 332.135 1 temp/spectra_filtered.mgf117 1 Amygdalin N/A ESI-QFT isolated MoNA MoNA:VF-NPL-QEHF026897 [M+NH4]+ 475.192 0.0 1 N/A N/A N#C[C@H](OC1O[C@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O)c1ccccc1 InChI=1S/C20H27NO11/c21-6-10(9-4-2-1-3-5-9)30-20-18(28)16(26)14(24)12(32-20)8-29-19-17(27)15(25)13(23)11(7-22)31-19/h1-5,10-20,22-28H,7-8H2/t10-,11+,12+,13+,14+,15-,16-,17+,18+,19+,20?/m0/s1 N/A 3 positive MONA 475.192 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze H3N XUCIJNAGGSZNQT-KDDLJKRCSA-N XUCIJNAGGSZNQT Organic oxygen compounds Organooxygen compounds Carbohydrates and carbohydrate conjugates Small peptides Aminoacids Amino acids and Peptides|Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00004720478 CCMSLIB00012444244 624 spectra_filtered.mgf MSNLIB-POSITIVE.mgf 0.864559 9857000.0 0 442828.0 8 163.085 205.195 1 temp/spectra_filtered.mgf624 1 5-(5-methoxycarbonyl-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl)-3-methylpentanoic acid ESI Orbitrap Crude Tomas Pluskal Corinna Brungs [M+NH4]+ 368.28 350.246 1 N/A N/A C=C1CCC2C(C)(C(=O)OC)CCCC2(C)C1CCC(C)CC(=O)O InChI=1S/C21H34O4/c1-14(13-18(22)23)7-9-16-15(2)8-10-17-20(16,3)11-6-12-21(17,4)19(24)25-5/h14,16-17H,2,6-13H2,1,3-5H3,(H,22,23) WTDIRAZPDUAJEB-UHFFFAOYSA-N 1 Positive MSNLIB-POSITIVE 368.28 UPDATE-SINGLE-ANNOTATED-GOLD Gold C21H34O4 WTDIRAZPDUAJEB-UHFFFAOYSA-N WTDIRAZPDUAJEB Lipids and lipid-like molecules Prenol lipids Diterpenoids Diterpenoids Labdane diterpenoids|Norlabdane diterpenoids Terpenoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012444244 CCMSLIB00000076748 781 spectra_filtered.mgf GNPS-LIBRARY.mgf 0.864235 12194000.0 0 3393.48 9 2.01324 595.282 1 temp/spectra_filtered.mgf781 1 Pheophorbide A LC-ESI qTof Commercial Pieter Dorrestein Jimmy Yi Zeng M+H 593.269 592.268 1 15664-29-6 5323510 CCC1=C2C=C3C(=C4C(=O)C(C(=C5C(C(C(=N5)C=C6C(=C(C(=CC(=C1C)N2)N6)C=C)C)C)CCC(=O)O)C4=N3)C(=O)OC)C InChI=1S/C35H36N4O5/c1-8-19-15(3)22-12-24-17(5)21(10-11-28(40)41)32(38-24)30-31(35(43)44-7)34(42)29-18(6)25(39-33(29)30)14-27-20(9-2)16(4)23(37-27)13-26(19)36-22/h8,12-14,17,21,31,36-37H,1,9-11H2,2-7H3,(H,40,41) 3 Positive GNPS-LIBRARY 593.269 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C35H36N4O5 OINDWIFDMFYGDX-UHFFFAOYSA-N OINDWIFDMFYGDX Organoheterocyclic compounds Tetrapyrroles and derivatives Chlorins Tryptophan alkaloids Carbazole alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00000076748 CCMSLIB00000848212 192 spectra_filtered.mgf GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE.mgf 0.864109 2041900.0 0 487915.0 6 265.994 279.171 1 temp/spectra_filtered.mgf192 1 NCGC00385009-01!(1S,3R,4R,5R)-1,3-dihydroxy-4,5-bis[[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxy]cyclohexane-1-carboxylic acid LC-ESI Maxis II HD Q-TOF Bruker isolated Jadhav/Dorrestein lfnothias M+H 545.165 544.158 1 n/a n/a COC1=CC(\C=C\C(=O)O[C@@H]2C[C@@](O)(C[C@@H](O)[C@H]2OC(=O)\C=C\C3=CC=C(O)C(OC)=C3)C(O)=O)=CC=C1O InChI=1S/C27H28O12/c1-36-20-11-15(3-7-17(20)28)5-9-23(31)38-22-14-27(35,26(33)34)13-19(30)25(22)39-24(32)10-6-16-4-8-18(29)21(12-16)37-2/h3-12,19,22,25,28-30,35H,13-14H2,1-2H3,(H,33,34)/b9-5+,10-6+/t19-,22-,25-,27+/m1/s1 N/A 1 positive GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE 545.165 UPDATE-SINGLE-ANNOTATED-GOLD Gold C27H28O12 WCIDSNIXNCYSPH-AYCJRBPQSA-N WCIDSNIXNCYSPH Organic oxygen compounds Organooxygen compounds Alcohols and polyols Phenylpropanoids (C6-C3) Cinnamic acids and derivatives Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00000848212 CCMSLIB00010116559 136 spectra_filtered.mgf BERKELEY-LAB.mgf 0.864072 1369500.0 0 95268.7 6 26.0156 247.06 1 temp/spectra_filtered.mgf136 1 naringenin CollisionEnergy:205060 LC-ESI Orbitrap Commercial Trent Northen JGI M+H 273.076 0.0 1 N/A N/A O=C1CC(c2ccc(O)cc2)Oc2cc(O)cc(O)c21 """InChI=1S/C15H12O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-6,13,16-18H,7H2""" N/A 3 Positive BERKELEY-LAB 273.076 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C15H12O5 FTVWIRXFELQLPI-UHFFFAOYSA-N FTVWIRXFELQLPI Phenylpropanoids and polyketides Flavonoids Flavans Flavonoids Flavanones Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00010116559 CCMSLIB00003135449 554 spectra_filtered.mgf GNPS-NIST14-MATCHES.mgf 0.862796 16411200.0 0 5163.94 11 2.01492 388.176 1 temp/spectra_filtered.mgf554 1 Spectral Match to Arctigenin from NIST14 ESI HCD Isolated Data from Wolfender/Litaudon Data deposited by pmallard M+NH4 390.191 0.0 1 7770787 N/A N/A N/A N/A 3 Positive GNPS-NIST14-MATCHES 390.191 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze N/A N/A N/A N/A N/A N/A N/A N/A N/A mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00003135449 CCMSLIB00010071406 692 spectra_filtered.mgf PNNL-LIPIDS-POSITIVE.mgf 0.86262 29996600.0 0 256201.0 18 162.053 794.578 1 temp/spectra_filtered.mgf692 1 DG(18:2/18:3/0:0); [M+NH4]+ C39H70N1O5 LC-ESI HCD; Velos Commercial Thomas Metz Thomas Metz M+NH4 632.525 0.0 1 N/A N/A N/A N/A N/A 1 Positive PNNL-LIPIDS-POSITIVE 632.525 UPDATE-SINGLE-ANNOTATED-GOLD Gold N/A N/A N/A N/A N/A N/A N/A N/A N/A mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00010071406 CCMSLIB00010106258 293 spectra_filtered.mgf BERKELEY-LAB.mgf 0.862468 5392500.0 0 537791.0 6 171.09 489.224 1 temp/spectra_filtered.mgf293 1 Piperlongumine CollisionEnergy:102040 LC-ESI Orbitrap Commercial Trent Northen JGI M+H 318.134 0.0 1 N/A N/A COc1cc(C=CC(=O)N2CCC=CC2=O)cc(OC)c1OC """InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+""" N/A 3 Positive BERKELEY-LAB 318.134 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C17H19NO5 VABYUUZNAVQNPG-UHFFFAOYSA-N VABYUUZNAVQNPG N/A N/A N/A Lysine alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00010106258 CCMSLIB00004720840 430 spectra_filtered.mgf MONA.mgf 0.862463 1600000.0 0 581594.0 6 185.025 503.159 1 temp/spectra_filtered.mgf430 1 Piplartine N/A ESI-QFT isolated MoNA MoNA:VF-NPL-QEHF027259 [M+H]+ 318.134 0.0 1 N/A N/A COc1cc(/C=C/C(=O)N2CCC=CC2=O)cc(OC)c1OC InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+ N/A 3 positive MONA 318.134 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C17H19NO5 VABYUUZNAVQNPG-BQYQJAHWSA-N VABYUUZNAVQNPG N/A N/A N/A Lysine alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00004720840 CCMSLIB00005740864 552 spectra_filtered.mgf MASSBANK.mgf 0.861834 18904000.0 0 5402.74 9 2.01611 371.149 1 temp/spectra_filtered.mgf552 1 Massbank:PR303923 Arctigenin ESI qTof Isolated Massbank Massbank M+H 373.165 0.0 1 N/A N/A COC1=C(OC)C=C(C[C@H]2COC(=O)[C@@H]2CC2=CC(OC)=C(O)C=C2)C=C1 1S/C21H24O6/c1-24-18-7-5-13(11-20(18)26-3)8-15-12-27-21(23)16(15)9-14-4-6-17(22)19(10-14)25-2/h4-7,10-11,15-16,22H,8-9,12H2,1-3H3/t15-,16+/m0/s1 N/A 3 Positive MASSBANK 373.165 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C21H24O6 NQWVSMVXKMHKTF-JKSUJKDBSA-N NQWVSMVXKMHKTF Lignans, neolignans and related compounds Furanoid lignans Tetrahydrofuran lignans Lignans Dibenzylbutyrolactone lignans Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00005740864 CCMSLIB00010104323 598 spectra_filtered.mgf BERKELEY-LAB.mgf 0.861048 1002300.0 0 53481.8 10 15.9959 315.087 1 temp/spectra_filtered.mgf598 1 """4',7-Dimethoxy-3-hydroxyflavone CollisionEnergy:102040""" LC-ESI Orbitrap Commercial Trent Northen JGI M+H 299.091 0.0 1 N/A N/A COc1ccc(-c2oc3cc(OC)ccc3c(=O)c2O)cc1 """InChI=1S/C17H14O5/c1-20-11-5-3-10(4-6-11)17-16(19)15(18)13-8-7-12(21-2)9-14(13)22-17/h3-9,19H,1-2H3""" N/A 3 Positive BERKELEY-LAB 299.091 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C17H14O5 IFHXSMSQHPVVSF-UHFFFAOYSA-N IFHXSMSQHPVVSF Phenylpropanoids and polyketides Flavonoids Flavones Flavonoids Flavonols Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00010104323 CCMSLIB00003136412 707 spectra_filtered.mgf GNPS-NIST14-MATCHES.mgf 0.860977 2802000.0 0 340018.0 6 141.193 556.443 1 temp/spectra_filtered.mgf707 1 Spectral Match to Nonaethylene glycol from NIST14 ESI QqQ Isolated Data from Piel Data deposited by eriche M+H 415.25 0.0 1 3386183 N/A N/A N/A N/A 3 Positive GNPS-NIST14-MATCHES 415.25 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze N/A N/A N/A N/A N/A N/A N/A N/A N/A mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00003136412 CCMSLIB00012323684 865 spectra_filtered.mgf MSNLIB-POSITIVE.mgf 0.860732 29487000.0 0 200698.0 6 54.0112 323.128 1 temp/spectra_filtered.mgf865 1 4,4'-Dimethoxychalcone ESI Orbitrap Crude Tomas Pluskal Corinna Brungs [M+H]+ 269.117 268.11 1 N/A N/A COc1ccc(/C=C/C(=O)c2ccc(OC)cc2)cc1 InChI=1S/C17H16O3/c1-19-15-8-3-13(4-9-15)5-12-17(18)14-6-10-16(20-2)11-7-14/h3-12H,1-2H3/b12-5+ HDXVSZWKIHQDES-LFYBBSHMSA-N 1 Positive MSNLIB-POSITIVE 269.117 UPDATE-SINGLE-ANNOTATED-GOLD Gold C17H16O3 HDXVSZWKIHQDES-LFYBBSHMSA-N HDXVSZWKIHQDES Phenylpropanoids and polyketides Linear 1,3-diarylpropanoids Chalcones and dihydrochalcones Flavonoids Chalcones Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012323684 CCMSLIB00006678135 806 spectra_filtered.mgf GNPS-LIBRARY.mgf 0.858291 4758500.0 0 126647.0 6 110.382 761.189 1 temp/spectra_filtered.mgf806 1 Pheophytin a LC-ESI Orbitrap Other S Ding Su Ding M+H 871.571 871.573 1 N/A N/A N/A N/A N/A 3 Positive GNPS-LIBRARY 871.571 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze N/A N/A N/A N/A N/A N/A N/A N/A N/A mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00006678135 CCMSLIB00012472792 877 spectra_filtered.mgf CMMC-LIBRARY.mgf 0.857926 8969300.0 0 6.80775 7 0.0045166 663.455 1 temp/spectra_filtered.mgf877 1 L-phenylalanine_dodecanoic acid LC-ESI Orbitrap Commercial Pieter C. Dorrestein Victoria Deleray [2M-3H2O+Na]+ 663.45 347.246 1 N/A N/A CCCCCCCCCCCC(=O)N[C@@H](Cc1ccccc1)C(=O)O InChI=1S/C21H33NO3/c1-2-3-4-5-6-7-8-9-13-16-20(23)22-19(21(24)25)17-18-14-11-10-12-15-18/h10-12,14-15,19H,2-9,13,16-17H2,1H3,(H,22,23)(H,24,25)/t19-/m0/s1 N/A 1 Positive CMMC-LIBRARY 663.45 UPDATE-SINGLE-ANNOTATED-GOLD Gold C21H33NO3 RKQUHHNIJVGMIG-IBGZPJMESA-N RKQUHHNIJVGMIG Organic acids and derivatives Carboxylic acids and derivatives Amino acids, peptides, and analogues Fatty amides N-acyl amines Fatty acids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012472792 CCMSLIB00005436047 186 spectra_filtered.mgf GNPS-LIBRARY.mgf 0.85789 149600000.0 0 42708.2 12 14.0165 314.176 1 temp/spectra_filtered.mgf186 1 O-methylarmepavine LC-ESI qTof Crude KOOLEN/ANGOLINI ANGOLINI M+H 328.192 327.183 1 [H][C@@]1(CC2=CC=C(OC)C=C2)C3=CC(OC)=C(OC)C=C3CCN1C InChI=1S/C20H25NO3/c1-21-10-9-15-12-19(23-3)20(24-4)13-17(15)18(21)11-14-5-7-16(22-2)8-6-14/h5-8,12-13,18H,9-11H2,1-4H3/t18-/m1/s1 3 Positive GNPS-LIBRARY 328.192 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C20H25NO3 LZJWNVLTWYMMDJ-GOSISDBHSA-N LZJWNVLTWYMMDJ Organoheterocyclic compounds Isoquinolines and derivatives Benzylisoquinolines Tyrosine alkaloids Isoquinoline alkaloids|Tetrahydroisoquinoline alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00005436047 CCMSLIB00004700079 335 spectra_filtered.mgf MONA.mgf 0.857759 3719200.0 0 231422.0 9 100.017 532.203 1 temp/spectra_filtered.mgf335 1 3-oxo-3-[[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(4-hydroxy-5-methyl-2-propan-2-ylphenoxy)oxan-2-yl]methoxy]propanoic acid N/A ESI-QFT isolated MoNA MoNA:VF-NPL-QEHF009016 [M+NH4]+ 432.186 0.0 1 N/A N/A Cc1cc(O[C@@H]2O[C@H](COC(=O)CC(=O)O)[C@@H](O)[C@H](O)[C@H]2O)c(C(C)C)cc1O InChI=1S/C19H26O10/c1-8(2)10-5-11(20)9(3)4-12(10)28-19-18(26)17(25)16(24)13(29-19)7-27-15(23)6-14(21)22/h4-5,8,13,16-20,24-26H,6-7H2,1-3H3,(H,21,22)/t13-,16-,17+,18-,19-/m1/s1 N/A 3 positive MONA 432.186 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C19H26O10 VJVGTGQETNCOEX-LQDZTQBFSA-N VJVGTGQETNCOEX Lipids and lipid-like molecules Prenol lipids Terpene glycosides Monoterpenoids Menthane monoterpenoids Terpenoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00004700079 CCMSLIB00010108678 235 spectra_filtered.mgf BERKELEY-LAB.mgf 0.8573 6607600.0 0 75308.2 12 28.031 344.186 1 temp/spectra_filtered.mgf235 1 AC1L9EVY CollisionEnergy:102040 LC-ESI Orbitrap Commercial Trent Northen JGI M 372.217 0.0 1 N/A N/A COc1ccc(CC2c3cc(OC)c(OC)cc3CC[N+]2(C)C)cc1OC """InChI=1S/C22H30NO4/c1-23(2)10-9-16-13-21(26-5)22(27-6)14-17(16)18(23)11-15-7-8-19(24-3)20(12-15)25-4/h7-8,12-14,18H,9-11H2,1-6H3/q+1""" N/A 3 Positive BERKELEY-LAB 372.217 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze N/A RVBHVIRGZXRPRX-UHFFFAOYSA-N RVBHVIRGZXRPRX Organoheterocyclic compounds Isoquinolines and derivatives Benzylisoquinolines N/A N/A N/A mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00010108678 CCMSLIB00000076748 776 spectra_filtered.mgf GNPS-LIBRARY.mgf 0.855708 544340000.0 0 12.0369 9 0.00714111 593.276 1 temp/spectra_filtered.mgf776 1 Pheophorbide A LC-ESI qTof Commercial Pieter Dorrestein Jimmy Yi Zeng M+H 593.269 592.268 1 15664-29-6 5323510 CCC1=C2C=C3C(=C4C(=O)C(C(=C5C(C(C(=N5)C=C6C(=C(C(=CC(=C1C)N2)N6)C=C)C)C)CCC(=O)O)C4=N3)C(=O)OC)C InChI=1S/C35H36N4O5/c1-8-19-15(3)22-12-24-17(5)21(10-11-28(40)41)32(38-24)30-31(35(43)44-7)34(42)29-18(6)25(39-33(29)30)14-27-20(9-2)16(4)23(37-27)13-26(19)36-22/h8,12-14,17,21,31,36-37H,1,9-11H2,2-7H3,(H,40,41) 3 Positive GNPS-LIBRARY 593.269 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C35H36N4O5 OINDWIFDMFYGDX-UHFFFAOYSA-N OINDWIFDMFYGDX Organoheterocyclic compounds Tetrapyrroles and derivatives Chlorins Tryptophan alkaloids Carbazole alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00000076748 CCMSLIB00012408499 217 spectra_filtered.mgf MSNLIB-POSITIVE.mgf 0.855699 4596700.0 0 336003.0 6 116.991 465.174 1 temp/spectra_filtered.mgf217 1 2034287-08-4 ESI Orbitrap Crude Tomas Pluskal Corinna Brungs [M+H]+ 348.183 347.176 1 N/A N/A CCNC(=O)N1CCC(Cc2n[nH]c(=O)n2-c2ccccc2F)CC1 InChI=1S/C17H22FN5O2/c1-2-19-16(24)22-9-7-12(8-10-22)11-15-20-21-17(25)23(15)14-6-4-3-5-13(14)18/h3-6,12H,2,7-11H2,1H3,(H,19,24)(H,21,25) VUPWNXNXFLOHEE-UHFFFAOYSA-N 1 Positive MSNLIB-POSITIVE 348.183 UPDATE-SINGLE-ANNOTATED-GOLD Gold C17H22FN5O2 VUPWNXNXFLOHEE-UHFFFAOYSA-N VUPWNXNXFLOHEE N/A N/A N/A Tryptophan alkaloids Carboline alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012408499 CCMSLIB00004691806 581 spectra_filtered.mgf MONA.mgf 0.854787 25344000.0 0 281518.0 6 78.0106 355.118 1 temp/spectra_filtered.mgf581 1 7,8-dihydromethysticin N/A ESI-QFT isolated MoNA MoNA:VF-NPL-QEHF000743 [M+H]+ 277.107 0.0 1 N/A N/A COC1=CC(=O)O[C@@H](CCc2ccc3c(c2)OCO3)C1 InChI=1S/C15H16O5/c1-17-12-7-11(20-15(16)8-12)4-2-10-3-5-13-14(6-10)19-9-18-13/h3,5-6,8,11H,2,4,7,9H2,1H3/t11-/m0/s1 N/A 3 positive MONA 277.107 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C15H16O5 RSIWXFIBHXYNFM-NSHDSACASA-N RSIWXFIBHXYNFM N/A N/A N/A Styrylpyrones Kavalactones and derivatives Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00004691806 CCMSLIB00012323684 876 spectra_filtered.mgf MSNLIB-POSITIVE.mgf 0.851563 4722000.0 0 200698.0 6 54.0113 323.128 1 temp/spectra_filtered.mgf876 1 4,4'-Dimethoxychalcone ESI Orbitrap Crude Tomas Pluskal Corinna Brungs [M+H]+ 269.117 268.11 1 N/A N/A COc1ccc(/C=C/C(=O)c2ccc(OC)cc2)cc1 InChI=1S/C17H16O3/c1-19-15-8-3-13(4-9-15)5-12-17(18)14-6-10-16(20-2)11-7-14/h3-12H,1-2H3/b12-5+ HDXVSZWKIHQDES-LFYBBSHMSA-N 1 Positive MSNLIB-POSITIVE 269.117 UPDATE-SINGLE-ANNOTATED-GOLD Gold C17H16O3 HDXVSZWKIHQDES-LFYBBSHMSA-N HDXVSZWKIHQDES Phenylpropanoids and polyketides Linear 1,3-diarylpropanoids Chalcones and dihydrochalcones Flavonoids Chalcones Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012323684 CCMSLIB00012398710 531 spectra_filtered.mgf MSNLIB-POSITIVE.mgf 0.851435 7514200.0 0 209604.0 6 72.954 275.103 1 temp/spectra_filtered.mgf531 1 1040655-37-5 ESI Orbitrap Crude Tomas Pluskal Corinna Brungs [M+H]+ 348.057 347.05 1 N/A N/A O=C(Cc1csc(Nc2cc(Cl)ccc2)n1)NCc1ccco1 InChI=1S/C16H14ClN3O2S/c17-11-3-1-4-12(7-11)19-16-20-13(10-23-16)8-15(21)18-9-14-5-2-6-22-14/h1-7,10H,8-9H2,(H,18,21)(H,19,20) LSGHXPKFYFWGLP-UHFFFAOYSA-N 1 Positive MSNLIB-POSITIVE 348.057 UPDATE-SINGLE-ANNOTATED-GOLD Gold C16H14ClN3O2S LSGHXPKFYFWGLP-UHFFFAOYSA-N LSGHXPKFYFWGLP N/A N/A N/A mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012398710 CCMSLIB00006425064 263 spectra_filtered.mgf BMDMS-NP.mgf 0.850282 1080300.0 0 6529.37 15 4.0296 621.18 1 temp/spectra_filtered.mgf263 1 Vicenin II ESI Orbitrap Commercial standard BMDMS-NP BMDMS-NP [M+Na]+ 617.15 594.158 1 N/A N/A O=C1C=C(OC2=C1C(O)=C(C(O)=C2C3OC(CO)C(O)C(O)C3O)C4OC(CO)C(O)C(O)C4O)C=5C=CC(O)=CC5 InChI=1S/C27H30O15/c28-6-12-17(32)21(36)23(38)26(41-12)15-19(34)14-10(31)5-11(8-1-3-9(30)4-2-8)40-25(14)16(20(15)35)27-24(39)22(37)18(33)13(7-29)42-27/h1-5,12-13,17-18,21-24,26-30,32-39H,6-7H2 N/A 1 Positive BMDMS-NP 617.15 UPDATE-SINGLE-ANNOTATED-GOLD Gold C27H30O15 FIAAVMJLAGNUKW-UHFFFAOYSA-N FIAAVMJLAGNUKW Phenylpropanoids and polyketides Flavonoids Flavonoid glycosides Flavonoids Flavones Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00006425064 CCMSLIB00012254917 710 spectra_filtered.mgf CMMC-REFRAME-POSITIVE-LIBRARY.mgf 0.850232 4616100.0 0 219958.0 7 132.078 468.39 1 temp/spectra_filtered.mgf710 1 Polidocanol LC-ESI Orbitrap Commercial Pieter C. Dorrestein Nina Haoqi Zhao [M+NH4]+ 600.468 582.434 1 N/A N/A CCCCCCCCCCCCOCCOCCOCCOCCOCCOCCOCCOCCOCCO """InChI=1S/C30H62O10/c1-2-3-4-5-6-7-8-9-10-11-13-32-15-17-34-19-21-36-23-25-38-27-29-40-30-28-39-26-24-37-22-20-35-18-16-33-14-12-31/h31H,2-30H2,1H3""" ONJQDTZCDSESIW-UHFFFAOYSA-N 1 Positive PRIVATE-LIB 600.468 UPDATE-SINGLE-ANNOTATED-GOLD Gold C30H62O10 ONJQDTZCDSESIW-UHFFFAOYSA-N ONJQDTZCDSESIW Organic oxygen compounds Organooxygen compounds Ethers Glycerolipids Triacylglycerols Fatty acids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012254917 CCMSLIB00006684563 119 spectra_filtered.mgf MONA.mgf 0.850112 3948100.0 0 137798.0 7 47.0012 388.088 1 temp/spectra_filtered.mgf119 1 ESCULIN ESI qTof isolated MoNA MoNA:MoNA033014 M+H 341.087 0.0 1 N/A N/A C1=CC(=O)OC2=C1C=C(C(=C2)O)O[C@H]3[C@@H]([C@H]([C@@H]([C@@H](CO)O3)O)O)O """InChI=1S/C15H16O9/c16-5-10-12(19)13(20)14(21)15(24-10)23-9-3-6-1-2-11(18)22-8(6)4-7(9)17/h1-4,10,12-17,19-21H,5H2/t10-,12-,13+,14-,15-/m1/s1""" N/A 3 positive MONA 341.087 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C15H16O9 XHCADAYNFIFUHF-TVKJYDDYSA-N XHCADAYNFIFUHF Phenylpropanoids and polyketides Coumarins and derivatives Coumarin glycosides Coumarins Simple coumarins Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00006684563 CCMSLIB00012323684 480 spectra_filtered.mgf MSNLIB-POSITIVE.mgf 0.849013 275530000.0 0 200699.0 6 54.0114 323.128 1 temp/spectra_filtered.mgf480 1 4,4'-Dimethoxychalcone ESI Orbitrap Crude Tomas Pluskal Corinna Brungs [M+H]+ 269.117 268.11 1 N/A N/A COc1ccc(/C=C/C(=O)c2ccc(OC)cc2)cc1 InChI=1S/C17H16O3/c1-19-15-8-3-13(4-9-15)5-12-17(18)14-6-10-16(20-2)11-7-14/h3-12H,1-2H3/b12-5+ HDXVSZWKIHQDES-LFYBBSHMSA-N 1 Positive MSNLIB-POSITIVE 269.117 UPDATE-SINGLE-ANNOTATED-GOLD Gold C17H16O3 HDXVSZWKIHQDES-LFYBBSHMSA-N HDXVSZWKIHQDES Phenylpropanoids and polyketides Linear 1,3-diarylpropanoids Chalcones and dihydrochalcones Flavonoids Chalcones Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012323684 CCMSLIB00012323684 855 spectra_filtered.mgf MSNLIB-POSITIVE.mgf 0.848167 9361000.0 0 200698.0 6 54.0112 323.128 1 temp/spectra_filtered.mgf855 1 4,4'-Dimethoxychalcone ESI Orbitrap Crude Tomas Pluskal Corinna Brungs [M+H]+ 269.117 268.11 1 N/A N/A COc1ccc(/C=C/C(=O)c2ccc(OC)cc2)cc1 InChI=1S/C17H16O3/c1-19-15-8-3-13(4-9-15)5-12-17(18)14-6-10-16(20-2)11-7-14/h3-12H,1-2H3/b12-5+ HDXVSZWKIHQDES-LFYBBSHMSA-N 1 Positive MSNLIB-POSITIVE 269.117 UPDATE-SINGLE-ANNOTATED-GOLD Gold C17H16O3 HDXVSZWKIHQDES-LFYBBSHMSA-N HDXVSZWKIHQDES Phenylpropanoids and polyketides Linear 1,3-diarylpropanoids Chalcones and dihydrochalcones Flavonoids Chalcones Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012323684 CCMSLIB00012472793 883 spectra_filtered.mgf CMMC-LIBRARY.mgf 0.847993 5124700.0 0 20187.3 7 14.0199 708.512 1 temp/spectra_filtered.mgf883 1 L-phenylalanine_dodecanoic acid LC-ESI Orbitrap Commercial Pieter C. Dorrestein Victoria Deleray [2M]+ 694.492 347.246 1 N/A N/A CCCCCCCCCCCC(=O)N[C@@H](Cc1ccccc1)C(=O)O InChI=1S/C21H33NO3/c1-2-3-4-5-6-7-8-9-13-16-20(23)22-19(21(24)25)17-18-14-11-10-12-15-18/h10-12,14-15,19H,2-9,13,16-17H2,1H3,(H,22,23)(H,24,25)/t19-/m0/s1 N/A 1 Positive CMMC-LIBRARY 694.492 UPDATE-SINGLE-ANNOTATED-GOLD Gold C21H33NO3 RKQUHHNIJVGMIG-IBGZPJMESA-N RKQUHHNIJVGMIG Organic acids and derivatives Carboxylic acids and derivatives Amino acids, peptides, and analogues Fatty amides N-acyl amines Fatty acids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012472793 CCMSLIB00004713752 663 spectra_filtered.mgf MONA.mgf 0.847782 945900.0 0 680034.0 7 742.277 349.253 1 temp/spectra_filtered.mgf663 1 (2S,3S,4S,5R,6R)-6-[[(3S,4S,6aR,6bS,8R,8aR,9R,10R,12aS,14bR)-10-acetyloxy-8a-(acetyloxymethyl)-8,9-dihydroxy-4-(hydroxymethyl)-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-4-hydroxy-3,5-bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]oxane-2-carboxylic acid N/A ESI-QFT isolated MoNA MoNA:VF-NPL-QEHF022689 [M+H]+ 1091.53 0.0 1 N/A N/A CC(=O)OC[C@@]12[C@@H](CC(C)(C)[C@@H](OC(C)=O)[C@@H]1O)C1=CCC3[C@@]4(C)CC[C@H](O[C@@H]5O[C@H](C(=O)O)[C@@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@H](O)[C@H]5O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@](C)(CO)C4CC[C@@]3(C)[C@]1(C)C[C@H]2O InChI=1S/C52H82O24/c1-21(56)69-20-52-24(15-47(3,4)42(41(52)66)70-22(2)57)23-9-10-28-48(5)13-12-30(49(6,19-55)27(48)11-14-50(28,7)51(23,8)16-29(52)58)73-46-39(75-45-36(64)34(62)32(60)26(18-54)72-45)37(65)38(40(76-46)43(67)68)74-44-35(63)33(61)31(59)25(17-53)71-44/h9,24-42,44-46,53-55,58-66H,10-20H2,1-8H3,(H,67,68)/t24-,25+,26+,27?,28?,29+,30-,31+,32+,33-,34-,35+,36+,37-,38-,39+,40-,41-,42-,44-,45-,46+,48-,49+,50+,51+,52-/m0/s1 N/A 3 positive MONA 1091.53 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C52H82O24 CJFSVYYGNWQUMQ-DBWNCVFDSA-N CJFSVYYGNWQUMQ Lipids and lipid-like molecules Prenol lipids Terpene glycosides Triterpenoids Oleanane triterpenoids Terpenoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00004713752 CCMSLIB00012079701 212 spectra_filtered.mgf PHENOLICSDB.mgf 0.847113 4149600.0 0 0.0703808 19 6.10352e-05 867.213 1 temp/spectra_filtered.mgf212 1 Procyanidin C1 40eV LC-ESI qTof Commercial Jessica Cooperstone DOI:10.5281/zenodo.8409038 M+H 867.213 866.206 1 N/A N/A C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=C(C(=CC(=C34)O)O)C5C(C(OC6=CC(=CC(=C56)O)O)C7=CC(=C(C=C7)O)O)O)C8=CC(=C(C=C8)O)O)O)O)O)C9=CC(=C(C=C9)O)O)O MOJZMWJRUKIQGL-XILRTYJMSA-N N/A 1 Positive PHENOLICSDB 867.213 UPDATE-SINGLE-ANNOTATED-GOLD Gold C45H38O18 MOJZMWJRUKIQGL-UHFFFAOYSA-N MOJZMWJRUKIQGL Phenylpropanoids and polyketides Flavonoids Biflavonoids and polyflavonoids Flavonoids Proanthocyanins Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012079701 CCMSLIB00006123930 641 spectra_filtered.mgf BIRMINGHAM-UHPLC-MS-POS.mgf 0.84587 15577300.0 0 287714.0 6 59.0374 264.232 1 temp/spectra_filtered.mgf641 1 (�)-alpha-Bisabolol - 40.0 eV ESI Orbitrap Isolated PI Data Collector Unknown 205.195 0.0 1 N/A N/A N/A 1 Positive BIRMINGHAM-UHPLC-MS-POS 205.195 UPDATE-SINGLE-ANNOTATED-GOLD Gold N/A N/A N/A N/A N/A N/A N/A N/A N/A mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00006123930 CCMSLIB00004712627 355 spectra_filtered.mgf MONA.mgf 0.844567 4152400.0 0 581241.0 7 304.115 219.102 1 temp/spectra_filtered.mgf355 1 (2R,3R,4S,5S,6R)-2-[[7-hydroxy-1-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-6-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol N/A ESI-QFT isolated MoNA MoNA:VF-NPL-QEHF021564 [M+H]+ 523.217 0.0 1 N/A N/A COc1cc(C2c3cc(O)c(OC)cc3CC(CO)C2CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)ccc1O InChI=1S/C26H34O11/c1-34-19-6-12(3-4-17(19)29)22-15-8-18(30)20(35-2)7-13(15)5-14(9-27)16(22)11-36-26-25(33)24(32)23(31)21(10-28)37-26/h3-4,6-8,14,16,21-33H,5,9-11H2,1-2H3/t14?,16?,21-,22?,23-,24+,25-,26-/m1/s1 N/A 3 positive MONA 523.217 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C26H34O11 AHYOMNWKYGMYMB-CIEFDVMPSA-N AHYOMNWKYGMYMB N/A N/A N/A Lignans Arylnaphthalene and aryltetralin lignans Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00004712627 CCMSLIB00004712627 282 spectra_filtered.mgf MONA.mgf 0.84364 2633000.0 0 581241.0 7 304.115 219.102 1 temp/spectra_filtered.mgf282 1 (2R,3R,4S,5S,6R)-2-[[7-hydroxy-1-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-6-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol N/A ESI-QFT isolated MoNA MoNA:VF-NPL-QEHF021564 [M+H]+ 523.217 0.0 1 N/A N/A COc1cc(C2c3cc(O)c(OC)cc3CC(CO)C2CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)ccc1O InChI=1S/C26H34O11/c1-34-19-6-12(3-4-17(19)29)22-15-8-18(30)20(35-2)7-13(15)5-14(9-27)16(22)11-36-26-25(33)24(32)23(31)21(10-28)37-26/h3-4,6-8,14,16,21-33H,5,9-11H2,1-2H3/t14?,16?,21-,22?,23-,24+,25-,26-/m1/s1 N/A 3 positive MONA 523.217 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C26H34O11 AHYOMNWKYGMYMB-CIEFDVMPSA-N AHYOMNWKYGMYMB N/A N/A N/A Lignans Arylnaphthalene and aryltetralin lignans Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00004712627 CCMSLIB00010111124 209 spectra_filtered.mgf BERKELEY-LAB.mgf 0.843138 5371000.0 0 6921.67 9 2.0148 289.071 1 temp/spectra_filtered.mgf209 1 Cianidanol CollisionEnergy:102040 LC-ESI Orbitrap Commercial Trent Northen JGI M+H 291.086 0.0 1 N/A N/A Oc1cc(O)c2c(c1)OC(c1ccc(O)c(O)c1)C(O)C2 """InChI=1S/C15H14O6/c16-8-4-11(18)9-6-13(20)15(21-14(9)5-8)7-1-2-10(17)12(19)3-7/h1-5,13,15-20H,6H2/t13-,15+/m0/s1""" N/A 3 Positive BERKELEY-LAB 291.086 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C15H14O6 PFTAWBLQPZVEMU-UHFFFAOYSA-N PFTAWBLQPZVEMU Phenylpropanoids and polyketides Flavonoids Flavans Flavonoids Flavan-3-ols Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00010111124 CCMSLIB00012380008 135 spectra_filtered.mgf MSNLIB-NEGATIVE.mgf 0.843077 2010700.0 0 59732.6 6 20.8468 328.155 1 temp/spectra_filtered.mgf135 1 5-bromo-N-(1-(thiophen-2-yl)cyclopentyl)nicotinamide ESI Orbitrap Crude Tomas Pluskal Corinna Brungs [M-H]- 349.002 350.009 1 N/A N/A O=C(NC1(c2cccs2)CCCC1)c1cc(Br)cnc1 InChI=1S/C15H15BrN2OS/c16-12-8-11(9-17-10-12)14(19)18-15(5-1-2-6-15)13-4-3-7-20-13/h3-4,7-10H,1-2,5-6H2,(H,18,19) LVFGGXGYTIDQEY-UHFFFAOYSA-N 1 Negative MSNLIB-NEGATIVE 349.002 UPDATE-SINGLE-ANNOTATED-GOLD Gold C15H15BrN2OS LVFGGXGYTIDQEY-UHFFFAOYSA-N LVFGGXGYTIDQEY N/A N/A N/A Nicotinic acid alkaloids Pyridine alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012380008 CCMSLIB00004712627 377 spectra_filtered.mgf MONA.mgf 0.843025 5357400.0 0 581241.0 7 304.115 219.102 1 temp/spectra_filtered.mgf377 1 (2R,3R,4S,5S,6R)-2-[[7-hydroxy-1-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-6-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol N/A ESI-QFT isolated MoNA MoNA:VF-NPL-QEHF021564 [M+H]+ 523.217 0.0 1 N/A N/A COc1cc(C2c3cc(O)c(OC)cc3CC(CO)C2CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)ccc1O InChI=1S/C26H34O11/c1-34-19-6-12(3-4-17(19)29)22-15-8-18(30)20(35-2)7-13(15)5-14(9-27)16(22)11-36-26-25(33)24(32)23(31)21(10-28)37-26/h3-4,6-8,14,16,21-33H,5,9-11H2,1-2H3/t14?,16?,21-,22?,23-,24+,25-,26-/m1/s1 N/A 3 positive MONA 523.217 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C26H34O11 AHYOMNWKYGMYMB-CIEFDVMPSA-N AHYOMNWKYGMYMB N/A N/A N/A Lignans Arylnaphthalene and aryltetralin lignans Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00004712627 CCMSLIB00012079699 259 spectra_filtered.mgf PHENOLICSDB.mgf 0.842399 3623900.0 0 1.37004 13 0.000793457 579.151 1 temp/spectra_filtered.mgf259 1 Procyanidin B3 40eV LC-ESI qTof Commercial Jessica Cooperstone DOI:10.5281/zenodo.8409038 M+H 579.15 578.142 1 N/A N/A C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=CC(=CC(=C34)O)O)C5=CC(=C(C=C5)O)O)O)O)O)C6=CC(=C(C=C6)O)O)O XFZJEEAOWLFHDH-AVFWISQGSA-N N/A 1 Positive PHENOLICSDB 579.15 UPDATE-SINGLE-ANNOTATED-GOLD Gold C30H26O12 XFZJEEAOWLFHDH-UHFFFAOYSA-N XFZJEEAOWLFHDH Phenylpropanoids and polyketides Flavonoids Biflavonoids and polyflavonoids Flavonoids Proanthocyanins Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012079699 CCMSLIB00012374786 171 spectra_filtered.mgf MSNLIB-POSITIVE.mgf 0.84028 3730000.0 0 79233.9 7 38.044 442.104 1 temp/spectra_filtered.mgf171 1 STL464062 ESI Orbitrap Crude Tomas Pluskal Corinna Brungs [M+H]+ 480.148 479.14 1 N/A N/A CSCC[C@@H](NC(=O)Cc1c(C)c2cc3c(cc2oc1=O)occ3-c1ccc(C)cc1)C(=O)O InChI=1S/C26H25NO6S/c1-14-4-6-16(7-5-14)20-13-32-22-12-23-17(10-19(20)22)15(2)18(26(31)33-23)11-24(28)27-21(25(29)30)8-9-34-3/h4-7,10,12-13,21H,8-9,11H2,1-3H3,(H,27,28)(H,29,30)/t21-/m1/s1 SWMBSQOIQMEUOU-OAQYLSRUSA-N 1 Positive MSNLIB-POSITIVE 480.148 UPDATE-SINGLE-ANNOTATED-GOLD Gold C26H25NO6S SWMBSQOIQMEUOU-OAQYLSRUSA-N SWMBSQOIQMEUOU N/A N/A N/A Coumarins Furocoumarins|Simple coumarins Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012374786 CCMSLIB00005436047 161 spectra_filtered.mgf GNPS-LIBRARY.mgf 0.840246 883500000.0 0 42707.6 12 14.0163 314.176 1 temp/spectra_filtered.mgf161 1 O-methylarmepavine LC-ESI qTof Crude KOOLEN/ANGOLINI ANGOLINI M+H 328.192 327.183 1 [H][C@@]1(CC2=CC=C(OC)C=C2)C3=CC(OC)=C(OC)C=C3CCN1C InChI=1S/C20H25NO3/c1-21-10-9-15-12-19(23-3)20(24-4)13-17(15)18(21)11-14-5-7-16(22-2)8-6-14/h5-8,12-13,18H,9-11H2,1-4H3/t18-/m1/s1 3 Positive GNPS-LIBRARY 328.192 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C20H25NO3 LZJWNVLTWYMMDJ-GOSISDBHSA-N LZJWNVLTWYMMDJ Organoheterocyclic compounds Isoquinolines and derivatives Benzylisoquinolines Tyrosine alkaloids Isoquinoline alkaloids|Tetrahydroisoquinoline alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00005436047 CCMSLIB00012472793 878 spectra_filtered.mgf CMMC-LIBRARY.mgf 0.838769 4814700.0 0 20174.4 7 14.011 680.481 1 temp/spectra_filtered.mgf878 1 L-phenylalanine_dodecanoic acid LC-ESI Orbitrap Commercial Pieter C. Dorrestein Victoria Deleray [2M]+ 694.492 347.246 1 N/A N/A CCCCCCCCCCCC(=O)N[C@@H](Cc1ccccc1)C(=O)O InChI=1S/C21H33NO3/c1-2-3-4-5-6-7-8-9-13-16-20(23)22-19(21(24)25)17-18-14-11-10-12-15-18/h10-12,14-15,19H,2-9,13,16-17H2,1H3,(H,22,23)(H,24,25)/t19-/m0/s1 N/A 1 Positive CMMC-LIBRARY 694.492 UPDATE-SINGLE-ANNOTATED-GOLD Gold C21H33NO3 RKQUHHNIJVGMIG-IBGZPJMESA-N RKQUHHNIJVGMIG Organic acids and derivatives Carboxylic acids and derivatives Amino acids, peptides, and analogues Fatty amides N-acyl amines Fatty acids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012472793 CCMSLIB00003138418 591 spectra_filtered.mgf GNPS-NIST14-MATCHES.mgf 0.837865 5135200.0 0 965644.0 11 341.132 694.401 1 temp/spectra_filtered.mgf591 1 Spectral Match to Monolinolenin (9c,12c,15c) from NIST14 ESI HCD Isolated Data from Wolfender/Litaudon Data deposited by pmallard M+H 353.269 0.0 1 18465991 N/A N/A N/A N/A 3 Positive GNPS-NIST14-MATCHES 353.269 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze N/A N/A N/A N/A N/A N/A N/A N/A N/A mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00003138418 CCMSLIB00006118163 363 spectra_filtered.mgf BIRMINGHAM-UHPLC-MS-POS.mgf 0.837841 225300.0 0 55719.6 8 15.9946 271.06 1 temp/spectra_filtered.mgf363 1 Luteolin - 40.0 eV ESI Orbitrap Isolated PI Data Collector M+H 287.055 0.0 1 N/A c1cc(c(cc1c2cc(=O)c3c(cc(cc3o2)O)O)O)O InChI=1S/C15H10O6/c16-8-4-11(19)15-12(20)6-13(21-14(15)5-8)7-1-2-9(17)10(18)3-7/h1-6,16-19H N/A 1 Positive BIRMINGHAM-UHPLC-MS-POS 287.055 UPDATE-SINGLE-ANNOTATED-GOLD Gold C15H10O6 IQPNAANSBPBGFQ-UHFFFAOYSA-N IQPNAANSBPBGFQ Phenylpropanoids and polyketides Flavonoids Flavones Flavonoids Flavones Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00006118163 CCMSLIB00012443642 682 spectra_filtered.mgf MSNLIB-POSITIVE.mgf 0.836019 1433700.0 0 267230.0 9 143.056 392.272 1 temp/spectra_filtered.mgf682 1 CHEBI:181879 ESI Orbitrap Crude Tomas Pluskal Corinna Brungs [M+H]+ 535.327 534.319 1 N/A N/A CC1(CO)CC(O)[C@]2(C(=O)O)CCC34CC3(C=CC3[C@]5(C)C(CC[C@]34C)C(C)(CO)[C@@H](O)[C@H](O)[C@@H]5O)C2C1 InChI=1S/C30H46O8/c1-24(14-31)11-18-28-8-6-17-26(3,29(28,13-28)9-10-30(18,23(37)38)19(33)12-24)7-5-16-25(2,15-32)21(35)20(34)22(36)27(16,17)4/h6,8,16-22,31-36H,5,7,9-15H2,1-4H3,(H,37,38)/t16?,17?,18?,19?,20-,21-,22-,24?,25?,26+,27-,28?,29?,30-/m0/s1 IXIMDUAPYHOVHL-QQQCTMDWSA-N 1 Positive MSNLIB-POSITIVE 535.327 UPDATE-SINGLE-ANNOTATED-GOLD Gold C30H46O8 IXIMDUAPYHOVHL-QQQCTMDWSA-N IXIMDUAPYHOVHL Lipids and lipid-like molecules Prenol lipids Sesterterpenoids Triterpenoids Oleanane triterpenoids Terpenoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012443642 CCMSLIB00012333962 123 spectra_filtered.mgf MSNLIB-POSITIVE.mgf 0.834053 209750000.0 0 136126.0 6 35.964 300.16 1 temp/spectra_filtered.mgf123 1 Desvenlafaxine ESI Orbitrap Crude Tomas Pluskal Corinna Brungs [M+H]+ 264.196 263.189 1 N/A N/A CN(C)CC(c1ccc(O)cc1)C1(O)CCCCC1 InChI=1S/C16H25NO2/c1-17(2)12-15(13-6-8-14(18)9-7-13)16(19)10-4-3-5-11-16/h6-9,15,18-19H,3-5,10-12H2,1-2H3 KYYIDSXMWOZKMP-UHFFFAOYSA-N 1 Positive MSNLIB-POSITIVE 264.196 UPDATE-SINGLE-ANNOTATED-GOLD Gold C16H25NO2 KYYIDSXMWOZKMP-UHFFFAOYSA-N KYYIDSXMWOZKMP Organic oxygen compounds Organooxygen compounds Alcohols and polyols Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012333962 CCMSLIB00012443642 841 spectra_filtered.mgf MSNLIB-POSITIVE.mgf 0.833241 6395900.0 0 61830.4 9 33.0995 568.427 1 temp/spectra_filtered.mgf841 1 CHEBI:181879 ESI Orbitrap Crude Tomas Pluskal Corinna Brungs [M+H]+ 535.327 534.319 1 N/A N/A CC1(CO)CC(O)[C@]2(C(=O)O)CCC34CC3(C=CC3[C@]5(C)C(CC[C@]34C)C(C)(CO)[C@@H](O)[C@H](O)[C@@H]5O)C2C1 InChI=1S/C30H46O8/c1-24(14-31)11-18-28-8-6-17-26(3,29(28,13-28)9-10-30(18,23(37)38)19(33)12-24)7-5-16-25(2,15-32)21(35)20(34)22(36)27(16,17)4/h6,8,16-22,31-36H,5,7,9-15H2,1-4H3,(H,37,38)/t16?,17?,18?,19?,20-,21-,22-,24?,25?,26+,27-,28?,29?,30-/m0/s1 IXIMDUAPYHOVHL-QQQCTMDWSA-N 1 Positive MSNLIB-POSITIVE 535.327 UPDATE-SINGLE-ANNOTATED-GOLD Gold C30H46O8 IXIMDUAPYHOVHL-QQQCTMDWSA-N IXIMDUAPYHOVHL Lipids and lipid-like molecules Prenol lipids Sesterterpenoids Triterpenoids Oleanane triterpenoids Terpenoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012443642 CCMSLIB00012443642 845 spectra_filtered.mgf MSNLIB-POSITIVE.mgf 0.83293 4361400.0 0 91709.9 10 49.0948 584.422 1 temp/spectra_filtered.mgf845 1 CHEBI:181879 ESI Orbitrap Crude Tomas Pluskal Corinna Brungs [M+H]+ 535.327 534.319 1 N/A N/A CC1(CO)CC(O)[C@]2(C(=O)O)CCC34CC3(C=CC3[C@]5(C)C(CC[C@]34C)C(C)(CO)[C@@H](O)[C@H](O)[C@@H]5O)C2C1 InChI=1S/C30H46O8/c1-24(14-31)11-18-28-8-6-17-26(3,29(28,13-28)9-10-30(18,23(37)38)19(33)12-24)7-5-16-25(2,15-32)21(35)20(34)22(36)27(16,17)4/h6,8,16-22,31-36H,5,7,9-15H2,1-4H3,(H,37,38)/t16?,17?,18?,19?,20-,21-,22-,24?,25?,26+,27-,28?,29?,30-/m0/s1 IXIMDUAPYHOVHL-QQQCTMDWSA-N 1 Positive MSNLIB-POSITIVE 535.327 UPDATE-SINGLE-ANNOTATED-GOLD Gold C30H46O8 IXIMDUAPYHOVHL-QQQCTMDWSA-N IXIMDUAPYHOVHL Lipids and lipid-like molecules Prenol lipids Sesterterpenoids Triterpenoids Oleanane triterpenoids Terpenoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012443642 CCMSLIB00005745114 537 spectra_filtered.mgf MASSBANK.mgf 0.832842 1642000.0 0 85319.7 6 30.0457 322.108 1 temp/spectra_filtered.mgf537 1 Massbank:PR300611 Palmatine ESI qTof Isolated Massbank Massbank M 352.154 0.0 1 N/A N/A COC1=C(OC)C=C2C(CC[N+]3=C2C=C2C=CC(OC)=C(OC)C2=C3)=C1 1S/C21H22NO4/c1-23-18-6-5-13-9-17-15-11-20(25-3)19(24-2)10-14(15)7-8-22(17)12-16(13)21(18)26-4/h5-6,9-12H,7-8H2,1-4H3/q+1 N/A 3 Positive MASSBANK 352.154 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze N/A QUCQEUCGKKTEBI-UHFFFAOYSA-N QUCQEUCGKKTEBI N/A N/A N/A N/A N/A N/A mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00005745114 CCMSLIB00005723134 619 spectra_filtered.mgf GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE.mgf 0.832692 4212100.0 0 87261.2 12 33.961 355.227 1 temp/spectra_filtered.mgf619 1 NCGC00380882-01!5-chloro-2,4-dihydroxy-6-methyl-3-[(E)-3-methyl-5-[(1S,2R,6R)-1,2,6-trimethyl-3-oxocyclohexyl]pent-2-enyl]benzaldehyde [IIN-based on: CCMSLIB00000845779] LC-ESI Orbitrap Commercial Pieter Dorrestein lfnothias/robinschmid [M-H2O+H]+ 389.188 406.192 1 N/A N/A C[C@@H]1CCC(=O)[C@H](C)[C@@]1(C)CC\\C(C)=C\\CC2=C(O)C(C=O)=C(C)C(Cl)=C2O InChI=1S/C23H31ClO4/c1-13(10-11-23(5)14(2)7-9-19(26)16(23)4)6-8-17-21(27)18(12-25)15(3)20(24)22(17)28/h6,12,14,16,27-28H,7-11H2,1-5H3/b13-6+/t14-,16+,23+/m1/s1 N/A 3 Positive GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE 389.188 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C23H31ClO4 IJEHYEVNWOYGMS-WGUBEYSISA-N IJEHYEVNWOYGMS Organic oxygen compounds Organooxygen compounds Carbonyl compounds Meroterpenoids Tetraketide meroterpenoids Polyketides|Terpenoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00005723134 CCMSLIB00004699248 280 spectra_filtered.mgf MONA.mgf 0.832076 3002300.0 0 42853.6 16 30.0096 670.271 1 temp/spectra_filtered.mgf280 1 2-[4-[(3S,3aR,6S,6aR)-6-[3-methoxy-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-3-yl]-2-methoxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol N/A ESI-QFT isolated MoNA MoNA:VF-NPL-QEHF008185 [M+NH4]+ 700.281 0.0 1 N/A N/A COc1cc([C@H]2OC[C@@H]3[C@@H](c4ccc(OC5OC(CO)C(O)C(O)C5O)c(OC)c4)OC[C@H]23)ccc1OC1OC(CO)C(O)C(O)C1O InChI=1S/C32H42O16/c1-41-19-7-13(3-5-17(19)45-31-27(39)25(37)23(35)21(9-33)47-31)29-15-11-44-30(16(15)12-43-29)14-4-6-18(20(8-14)42-2)46-32-28(40)26(38)24(36)22(10-34)48-32/h3-8,15-16,21-40H,9-12H2,1-2H3/t15-,16-,21?,22?,23?,24?,25?,26?,27?,28?,29+,30+,31?,32?/m0/s1 N/A 3 positive MONA 700.281 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C32H42O16 ZJSJQWDXAYNLNS-XJUVHSKASA-N ZJSJQWDXAYNLNS N/A N/A N/A Lignans Furofuranoid lignans Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00004699248 CCMSLIB00005436047 219 spectra_filtered.mgf GNPS-LIBRARY.mgf 0.830746 31600000.0 0 48733.4 12 15.9939 344.186 1 temp/spectra_filtered.mgf219 1 O-methylarmepavine LC-ESI qTof Crude KOOLEN/ANGOLINI ANGOLINI M+H 328.192 327.183 1 [H][C@@]1(CC2=CC=C(OC)C=C2)C3=CC(OC)=C(OC)C=C3CCN1C InChI=1S/C20H25NO3/c1-21-10-9-15-12-19(23-3)20(24-4)13-17(15)18(21)11-14-5-7-16(22-2)8-6-14/h5-8,12-13,18H,9-11H2,1-4H3/t18-/m1/s1 3 Positive GNPS-LIBRARY 328.192 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C20H25NO3 LZJWNVLTWYMMDJ-GOSISDBHSA-N LZJWNVLTWYMMDJ Organoheterocyclic compounds Isoquinolines and derivatives Benzylisoquinolines Tyrosine alkaloids Isoquinoline alkaloids|Tetrahydroisoquinoline alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00005436047 CCMSLIB00000847896 141 spectra_filtered.mgf GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE.mgf 0.830027 920400.0 0 59785.6 11 26.0144 409.114 1 temp/spectra_filtered.mgf141 1 NCGC00180273-02!7-hydroxy-2-(4-hydroxyphenyl)-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3-dihydrochromen-4-one LC-ESI Maxis II HD Q-TOF Bruker isolated Jadhav/Dorrestein lfnothias M+H 435.128 434.121 1 n/a n/a OC[C@H]1O[C@@H](OC2=C3C(=O)CC(OC3=CC(O)=C2)C4=CC=C(O)C=C4)[C@H](O)[C@@H](O)[C@@H]1O InChI=1S/C21H22O10/c22-8-16-18(26)19(27)20(28)21(31-16)30-15-6-11(24)5-14-17(15)12(25)7-13(29-14)9-1-3-10(23)4-2-9/h1-6,13,16,18-24,26-28H,7-8H2/t13?,16-,18-,19+,20-,21-/m1/s1 N/A 1 positive GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE 435.128 UPDATE-SINGLE-ANNOTATED-GOLD Gold C21H22O10 MFQIWHVVFBCURA-LKBAIHPRSA-N MFQIWHVVFBCURA Phenylpropanoids and polyketides Flavonoids Flavonoid glycosides Flavonoids Flavanones Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00000847896 CCMSLIB00000076748 889 spectra_filtered.mgf GNPS-LIBRARY.mgf 0.829846 40740000.0 0 47259.9 7 28.0378 621.307 1 temp/spectra_filtered.mgf889 1 Pheophorbide A LC-ESI qTof Commercial Pieter Dorrestein Jimmy Yi Zeng M+H 593.269 592.268 1 15664-29-6 5323510 CCC1=C2C=C3C(=C4C(=O)C(C(=C5C(C(C(=N5)C=C6C(=C(C(=CC(=C1C)N2)N6)C=C)C)C)CCC(=O)O)C4=N3)C(=O)OC)C InChI=1S/C35H36N4O5/c1-8-19-15(3)22-12-24-17(5)21(10-11-28(40)41)32(38-24)30-31(35(43)44-7)34(42)29-18(6)25(39-33(29)30)14-27-20(9-2)16(4)23(37-27)13-26(19)36-22/h8,12-14,17,21,31,36-37H,1,9-11H2,2-7H3,(H,40,41) 3 Positive GNPS-LIBRARY 593.269 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C35H36N4O5 OINDWIFDMFYGDX-UHFFFAOYSA-N OINDWIFDMFYGDX Organoheterocyclic compounds Tetrapyrroles and derivatives Chlorins Tryptophan alkaloids Carbazole alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00000076748 CCMSLIB00010113148 90 spectra_filtered.mgf BERKELEY-LAB.mgf 0.828692 2247000.0 0 328948.0 6 152.995 312.108 1 temp/spectra_filtered.mgf90 1 CCG-208508 CollisionEnergy:102040 LC-ESI Orbitrap Commercial Trent Northen JGI M+H 465.103 0.0 1 N/A N/A O=c1c(OC2OC(C(O)CO)C(O)C2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12 """InChI=1S/C21H20O12/c22-6-12(27)19-16(29)17(30)21(32-19)33-20-15(28)14-11(26)4-8(23)5-13(14)31-18(20)7-1-2-9(24)10(25)3-7/h1-5,12,16-17,19,21-27,29-30H,6H2/t12-,16-,17-,19?,21+/m1/s1""" N/A 3 Positive BERKELEY-LAB 465.103 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C21H20O12 OPJZLUXFQFQYAI-UHFFFAOYSA-N OPJZLUXFQFQYAI Phenylpropanoids and polyketides Flavonoids Flavonoid glycosides Flavonoids Flavonols Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00010113148 CCMSLIB00005723134 627 spectra_filtered.mgf GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE.mgf 0.826118 3149000.0 0 87261.2 8 33.961 355.227 1 temp/spectra_filtered.mgf627 1 NCGC00380882-01!5-chloro-2,4-dihydroxy-6-methyl-3-[(E)-3-methyl-5-[(1S,2R,6R)-1,2,6-trimethyl-3-oxocyclohexyl]pent-2-enyl]benzaldehyde [IIN-based on: CCMSLIB00000845779] LC-ESI Orbitrap Commercial Pieter Dorrestein lfnothias/robinschmid [M-H2O+H]+ 389.188 406.192 1 N/A N/A C[C@@H]1CCC(=O)[C@H](C)[C@@]1(C)CC\\C(C)=C\\CC2=C(O)C(C=O)=C(C)C(Cl)=C2O InChI=1S/C23H31ClO4/c1-13(10-11-23(5)14(2)7-9-19(26)16(23)4)6-8-17-21(27)18(12-25)15(3)20(24)22(17)28/h6,12,14,16,27-28H,7-11H2,1-5H3/b13-6+/t14-,16+,23+/m1/s1 N/A 3 Positive GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE 389.188 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C23H31ClO4 IJEHYEVNWOYGMS-WGUBEYSISA-N IJEHYEVNWOYGMS Organic oxygen compounds Organooxygen compounds Carbonyl compounds Meroterpenoids Tetraketide meroterpenoids Polyketides|Terpenoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00005723134 CCMSLIB00000078864 385 spectra_filtered.mgf GNPS-LIBRARY.mgf 0.824802 6642200.0 0 3185.09 6 1.01331 317.127 1 temp/spectra_filtered.mgf385 1 Piplartine DI-ESI qTof Commercial Norberto Lopes Denise Silva M+H 318.14 317.126 1 20069-09-4 O=C(N1CCC=CC1=O)/C=C/C2=CC(OC)=C(OC)C(OC)=C2 InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+ 3 Positive GNPS-LIBRARY 318.14 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C17H19NO5 VABYUUZNAVQNPG-BQYQJAHWSA-N VABYUUZNAVQNPG N/A N/A N/A Lysine alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00000078864 CCMSLIB00010124181 585 spectra_filtered.mgf BERKELEY-LAB.mgf 0.824363 27332000.0 0 1.53897 12 0.000518799 337.108 1 temp/spectra_filtered.mgf585 1 CCG-208458 CollisionEnergy:205060 LC-ESI Orbitrap Commercial Trent Northen JGI M+H-H2O 337.107 0.0 1 N/A N/A c1cc2c(cc1C1OCC3C(c4ccc5c(c4)OCO5)OCC13)OCO2 """InChI=1S/C20H18O6/c1-3-15-17(25-9-23-15)5-11(1)19-13-7-22-20(14(13)8-21-19)12-2-4-16-18(6-12)26-10-24-16/h1-6,13-14,19-20H,7-10H2/t13-,14-,19?,20?/m0/s1""" N/A 3 Positive BERKELEY-LAB 337.107 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C20H18O6 PEYUIKBAABKQKQ-UHFFFAOYSA-N PEYUIKBAABKQKQ N/A N/A N/A Lignans Furofuranoid lignans Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00010124181 CCMSLIB00005436047 134 spectra_filtered.mgf GNPS-LIBRARY.mgf 0.822387 51593000.0 0 6028.81 12 1.97861 330.171 1 temp/spectra_filtered.mgf134 1 O-methylarmepavine LC-ESI qTof Crude KOOLEN/ANGOLINI ANGOLINI M+H 328.192 327.183 1 [H][C@@]1(CC2=CC=C(OC)C=C2)C3=CC(OC)=C(OC)C=C3CCN1C InChI=1S/C20H25NO3/c1-21-10-9-15-12-19(23-3)20(24-4)13-17(15)18(21)11-14-5-7-16(22-2)8-6-14/h5-8,12-13,18H,9-11H2,1-4H3/t18-/m1/s1 3 Positive GNPS-LIBRARY 328.192 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C20H25NO3 LZJWNVLTWYMMDJ-GOSISDBHSA-N LZJWNVLTWYMMDJ Organoheterocyclic compounds Isoquinolines and derivatives Benzylisoquinolines Tyrosine alkaloids Isoquinoline alkaloids|Tetrahydroisoquinoline alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00005436047 CCMSLIB00000076748 802 spectra_filtered.mgf GNPS-LIBRARY.mgf 0.821116 74963600.0 0 12.9628 9 0.00769043 593.277 1 temp/spectra_filtered.mgf802 1 Pheophorbide A LC-ESI qTof Commercial Pieter Dorrestein Jimmy Yi Zeng M+H 593.269 592.268 1 15664-29-6 5323510 CCC1=C2C=C3C(=C4C(=O)C(C(=C5C(C(C(=N5)C=C6C(=C(C(=CC(=C1C)N2)N6)C=C)C)C)CCC(=O)O)C4=N3)C(=O)OC)C InChI=1S/C35H36N4O5/c1-8-19-15(3)22-12-24-17(5)21(10-11-28(40)41)32(38-24)30-31(35(43)44-7)34(42)29-18(6)25(39-33(29)30)14-27-20(9-2)16(4)23(37-27)13-26(19)36-22/h8,12-14,17,21,31,36-37H,1,9-11H2,2-7H3,(H,40,41) 3 Positive GNPS-LIBRARY 593.269 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C35H36N4O5 OINDWIFDMFYGDX-UHFFFAOYSA-N OINDWIFDMFYGDX Organoheterocyclic compounds Tetrapyrroles and derivatives Chlorins Tryptophan alkaloids Carbazole alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00000076748 CCMSLIB00006123930 632 spectra_filtered.mgf BIRMINGHAM-UHPLC-MS-POS.mgf 0.819984 52326000.0 0 287714.0 6 59.0375 264.233 1 temp/spectra_filtered.mgf632 1 (�)-alpha-Bisabolol - 40.0 eV ESI Orbitrap Isolated PI Data Collector Unknown 205.195 0.0 1 N/A N/A N/A 1 Positive BIRMINGHAM-UHPLC-MS-POS 205.195 UPDATE-SINGLE-ANNOTATED-GOLD Gold N/A N/A N/A N/A N/A N/A N/A N/A N/A mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00006123930 CCMSLIB00006114467 88 spectra_filtered.mgf BIRMINGHAM-UHPLC-MS-POS.mgf 0.81979 9033100.0 0 740528.0 6 120.022 282.098 1 temp/spectra_filtered.mgf88 1 N-Methylglutamate - 40.0 eV ESI Orbitrap Isolated PI Data Collector M+H 162.076 0.0 1 N/A CN[C@@H](CCC(=O)O)C(=O)O InChI=1S/C6H11NO4/c1-7-4(6(10)11)2-3-5(8)9/h4,7H,2-3H2,1H3,(H,8,9)(H,10,11)/t4-/m0/s1 N/A 1 Positive BIRMINGHAM-UHPLC-MS-POS 162.076 UPDATE-SINGLE-ANNOTATED-GOLD Gold C6H11NO4 XLBVNMSMFQMKEY-BYPYZUCNSA-N XLBVNMSMFQMKEY Organic acids and derivatives Carboxylic acids and derivatives Amino acids, peptides, and analogues Small peptides Aminoacids Amino acids and Peptides mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00006114467 CCMSLIB00003139689 614 spectra_filtered.mgf GNPS-NIST14-MATCHES.mgf 0.819639 936000.0 0 52830.4 8 24.0005 478.293 1 temp/spectra_filtered.mgf614 1 Spectral Match to 1-Palmitoyl-2-hydroxy-sn-glycero-3-phosphoethanolamine from NIST14 ESI HCD Isolated Data from Pieter Dorrestein Data deposited by lfnothias M+H 454.293 0.0 1 53862354 N/A N/A N/A N/A 3 Positive GNPS-NIST14-MATCHES 454.293 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze N/A N/A N/A N/A N/A N/A N/A N/A N/A mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00003139689 CCMSLIB00000076748 810 spectra_filtered.mgf GNPS-LIBRARY.mgf 0.819538 8122400.0 0 23637.1 9 14.0231 607.292 1 temp/spectra_filtered.mgf810 1 Pheophorbide A LC-ESI qTof Commercial Pieter Dorrestein Jimmy Yi Zeng M+H 593.269 592.268 1 15664-29-6 5323510 CCC1=C2C=C3C(=C4C(=O)C(C(=C5C(C(C(=N5)C=C6C(=C(C(=CC(=C1C)N2)N6)C=C)C)C)CCC(=O)O)C4=N3)C(=O)OC)C InChI=1S/C35H36N4O5/c1-8-19-15(3)22-12-24-17(5)21(10-11-28(40)41)32(38-24)30-31(35(43)44-7)34(42)29-18(6)25(39-33(29)30)14-27-20(9-2)16(4)23(37-27)13-26(19)36-22/h8,12-14,17,21,31,36-37H,1,9-11H2,2-7H3,(H,40,41) 3 Positive GNPS-LIBRARY 593.269 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C35H36N4O5 OINDWIFDMFYGDX-UHFFFAOYSA-N OINDWIFDMFYGDX Organoheterocyclic compounds Tetrapyrroles and derivatives Chlorins Tryptophan alkaloids Carbazole alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00000076748 CCMSLIB00006439034 240 spectra_filtered.mgf BMDMS-NP.mgf 0.819266 3050600.0 0 44613.8 6 14.015 328.155 1 temp/spectra_filtered.mgf240 1 Laetanine ESI Orbitrap Commercial standard BMDMS-NP BMDMS-NP [M+H]+ 314.14 313.131 1 N/A N/A OC=1C=C2C=3C(OC)=C(O)C=C4C3C(NCC4)CC2=CC1OC InChI=1S/C18H19NO4/c1-22-15-7-10-5-12-16-9(3-4-19-12)6-14(21)18(23-2)17(16)11(10)8-13(15)20/h6-8,12,19-21H,3-5H2,1-2H3 N/A 1 Positive BMDMS-NP 314.14 UPDATE-SINGLE-ANNOTATED-GOLD Gold C18H19NO4 URQAEFLEDPPPFX-UHFFFAOYSA-N URQAEFLEDPPPFX N/A N/A N/A Tyrosine alkaloids Aporphine alkaloids|Isoquinoline alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00006439034 CCMSLIB00005745707 595 spectra_filtered.mgf MASSBANK.mgf 0.818024 10035000.0 0 904273.0 6 189.08 398.176 1 temp/spectra_filtered.mgf595 1 Massbank:PR310506 Chalcone ESI qTof Isolated Massbank Massbank M+H 209.096 0.0 1 N/A N/A O=C(C=CC1=CC=CC=C1)C1=CC=CC=C1 1S/C15H12O/c16-15(14-9-5-2-6-10-14)12-11-13-7-3-1-4-8-13/h1-12H N/A 3 Positive MASSBANK 209.096 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C15H12O DQFBYFPFKXHELB-UHFFFAOYSA-N DQFBYFPFKXHELB Phenylpropanoids and polyketides Linear 1,3-diarylpropanoids Chalcones and dihydrochalcones Flavonoids Chalcones Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00005745707 CCMSLIB00006684563 122 spectra_filtered.mgf MONA.mgf 0.81654 2353300.0 0 87879.0 7 29.9744 371.061 1 temp/spectra_filtered.mgf122 1 ESCULIN ESI qTof isolated MoNA MoNA:MoNA033014 M+H 341.087 0.0 1 N/A N/A C1=CC(=O)OC2=C1C=C(C(=C2)O)O[C@H]3[C@@H]([C@H]([C@@H]([C@@H](CO)O3)O)O)O """InChI=1S/C15H16O9/c16-5-10-12(19)13(20)14(21)15(24-10)23-9-3-6-1-2-11(18)22-8(6)4-7(9)17/h1-4,10,12-17,19-21H,5H2/t10-,12-,13+,14-,15-/m1/s1""" N/A 3 positive MONA 341.087 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C15H16O9 XHCADAYNFIFUHF-TVKJYDDYSA-N XHCADAYNFIFUHF Phenylpropanoids and polyketides Coumarins and derivatives Coumarin glycosides Coumarins Simple coumarins Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00006684563 CCMSLIB00010106258 344 spectra_filtered.mgf BERKELEY-LAB.mgf 0.816524 9105800.0 0 575625.0 6 183.126 501.26 1 temp/spectra_filtered.mgf344 1 Piperlongumine CollisionEnergy:102040 LC-ESI Orbitrap Commercial Trent Northen JGI M+H 318.134 0.0 1 N/A N/A COc1cc(C=CC(=O)N2CCC=CC2=O)cc(OC)c1OC """InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+""" N/A 3 Positive BERKELEY-LAB 318.134 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C17H19NO5 VABYUUZNAVQNPG-UHFFFAOYSA-N VABYUUZNAVQNPG N/A N/A N/A Lysine alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00010106258 CCMSLIB00012432214 842 spectra_filtered.mgf MSNLIB-POSITIVE.mgf 0.816251 253400.0 0 166582.0 8 117.015 585.427 1 temp/spectra_filtered.mgf842 1 CHEBI:181245 ESI Orbitrap Crude Tomas Pluskal Corinna Brungs [M+NH4]+ 702.442 684.408 1 N/A N/A CC(CC(O)C(O)C(C)(C)O)C1CCC2(C)C3CCC4C(C)(C(=O)OC5OC(CO)C(O)C(O)C5O)C(O)CC(O)C45CC35CCC12C InChI=1S/C36H60O12/c1-17(13-19(38)28(44)31(2,3)46)18-9-10-33(5)21-7-8-22-34(6,30(45)48-29-27(43)26(42)25(41)20(15-37)47-29)23(39)14-24(40)36(22)16-35(21,36)12-11-32(18,33)4/h17-29,37-44,46H,7-16H2,1-6H3 RCCBGOMNZWYBTJ-UHFFFAOYSA-N 1 Positive MSNLIB-POSITIVE 702.442 UPDATE-SINGLE-ANNOTATED-GOLD Gold C36H60O12 RCCBGOMNZWYBTJ-UHFFFAOYSA-N RCCBGOMNZWYBTJ Lipids and lipid-like molecules Prenol lipids Terpene glycosides Triterpenoids Cycloartane triterpenoids Terpenoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012432214 CCMSLIB00010058733 696 spectra_filtered.mgf PNNL-LIPIDS-POSITIVE.mgf 0.815696 17426100.0 0 256200.0 16 162.053 794.578 1 temp/spectra_filtered.mgf696 1 DG(18:2/18:3/0:0); [M+NH4]+ C39H70N1O5 LC-ESI HCD; Velos Commercial Thomas Metz Thomas Metz M+NH4 632.525 0.0 1 N/A N/A N/A N/A N/A 1 Positive PNNL-LIPIDS-POSITIVE 632.525 UPDATE-SINGLE-ANNOTATED-GOLD Gold N/A N/A N/A N/A N/A N/A N/A N/A N/A mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00010058733 CCMSLIB00012283573 664 spectra_filtered.mgf MSNLIB-POSITIVE.mgf 0.814749 1914100.0 0 287384.0 8 148.11 367.263 1 temp/spectra_filtered.mgf664 1 alisol A 24-acetate ESI Orbitrap Crude Tomas Pluskal Corinna Brungs [M+H-H2O]+ 515.373 532.376 1 N/A N/A CC(=O)O[C@H]([C@@H](O)C[C@@H](C)C1=C2C[C@H](O)[C@H]3[C@@]4(C)CCC(=O)C(C)(C)[C@@H]4CC[C@]3(C)[C@@]2(C)CC1)C(C)(C)O InChI=1S/C32H52O6/c1-18(16-23(35)27(29(5,6)37)38-19(2)33)20-10-14-31(8)21(20)17-22(34)26-30(7)13-12-25(36)28(3,4)24(30)11-15-32(26,31)9/h18,22-24,26-27,34-35,37H,10-17H2,1-9H3/t18-,22+,23+,24+,26+,27-,30+,31+,32+/m1/s1 WXHUQVMHWUQNTG-JSWHPQHOSA-N 1 Positive MSNLIB-POSITIVE 515.373 UPDATE-SINGLE-ANNOTATED-GOLD Gold C32H52O6 WXHUQVMHWUQNTG-JSWHPQHOSA-N WXHUQVMHWUQNTG Lipids and lipid-like molecules Prenol lipids Triterpenoids Triterpenoids Dammarane and Protostane triterpenoids|Fusidane triterpenoids Terpenoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012283573 CCMSLIB00005722288 582 spectra_filtered.mgf GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE.mgf 0.813404 1270200.0 0 45396.9 9 16.0314 337.108 1 temp/spectra_filtered.mgf582 1 NCGC00180457-02!4-(1,3-benzodioxol-5-ylmethyl)-3-[(3,4-dimethoxyphenyl)methyl]oxolan-2-one [IIN-based on: CCMSLIB00000847667] LC-ESI Orbitrap Commercial Pieter Dorrestein lfnothias/robinschmid [M-H2O+H]+ 353.139 370.142 1 N/A N/A COC1=C(OC)C=C(CC2C(CC3=CC4=C(OCO4)C=C3)COC2=O)C=C1 InChI=1S/C21H22O6/c1-23-17-5-3-14(9-19(17)24-2)8-16-15(11-25-21(16)22)7-13-4-6-18-20(10-13)27-12-26-18/h3-6,9-10,15-16H,7-8,11-12H2,1-2H3 N/A 3 Positive GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE 353.139 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C21H22O6 IYBDDRJHJMFFBB-UHFFFAOYSA-N IYBDDRJHJMFFBB Lignans, neolignans and related compounds Furanoid lignans Tetrahydrofuran lignans Lignans Dibenzylbutyrolactone lignans Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00005722288 CCMSLIB00000076748 879 spectra_filtered.mgf GNPS-LIBRARY.mgf 0.813153 77607700.0 0 47260.0 7 28.0379 621.307 1 temp/spectra_filtered.mgf879 1 Pheophorbide A LC-ESI qTof Commercial Pieter Dorrestein Jimmy Yi Zeng M+H 593.269 592.268 1 15664-29-6 5323510 CCC1=C2C=C3C(=C4C(=O)C(C(=C5C(C(C(=N5)C=C6C(=C(C(=CC(=C1C)N2)N6)C=C)C)C)CCC(=O)O)C4=N3)C(=O)OC)C InChI=1S/C35H36N4O5/c1-8-19-15(3)22-12-24-17(5)21(10-11-28(40)41)32(38-24)30-31(35(43)44-7)34(42)29-18(6)25(39-33(29)30)14-27-20(9-2)16(4)23(37-27)13-26(19)36-22/h8,12-14,17,21,31,36-37H,1,9-11H2,2-7H3,(H,40,41) 3 Positive GNPS-LIBRARY 593.269 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C35H36N4O5 OINDWIFDMFYGDX-UHFFFAOYSA-N OINDWIFDMFYGDX Organoheterocyclic compounds Tetrapyrroles and derivatives Chlorins Tryptophan alkaloids Carbazole alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00000076748 CCMSLIB00000849000 330 spectra_filtered.mgf GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE.mgf 0.812684 2476800.0 0 113907.0 11 46.0422 450.249 1 temp/spectra_filtered.mgf330 1 NCGC00380478-01!(3S,3aR,6S,6aR)-3,6-bis(3,4-dimethoxyphenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan LC-ESI Maxis II HD Q-TOF Bruker isolated Jadhav/Dorrestein lfnothias M+NH4 404.207 386.173 1 n/a n/a COC1=C(OC)C=C(C=C1)[C@H]2OC[C@H]3[C@@H]2CO[C@@H]3C4=CC(OC)=C(OC)C=C4 InChI=1S/C22H26O6/c1-23-17-7-5-13(9-19(17)25-3)21-15-11-28-22(16(15)12-27-21)14-6-8-18(24-2)20(10-14)26-4/h5-10,15-16,21-22H,11-12H2,1-4H3/t15-,16-,21+,22+/m0/s1 N/A 1 positive GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE 404.207 UPDATE-SINGLE-ANNOTATED-GOLD Gold C22H26O6 PEUUVVGQIVMSAW-RZTYQLBFSA-N PEUUVVGQIVMSAW N/A N/A N/A Lignans Furofuranoid lignans Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00000849000 CCMSLIB00010122956 643 spectra_filtered.mgf BERKELEY-LAB.mgf 0.812032 3912000.0 0 1.93342 6 0.000396729 205.195 1 temp/spectra_filtered.mgf643 1 Bisabolol CollisionEnergy:205060 LC-ESI Orbitrap Commercial Trent Northen JGI M+H-H2O 205.195 0.0 1 N/A N/A CC(C)=CCCC(C)(O)C1CC=C(C)CC1 """InChI=1S/C15H26O/c1-12(2)6-5-11-15(4,16)14-9-7-13(3)8-10-14/h6-7,14,16H,5,8-11H2,1-4H3""" N/A 3 Positive BERKELEY-LAB 205.195 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C15H26O RGZSQWQPBWRIAQ-UHFFFAOYSA-N RGZSQWQPBWRIAQ Lipids and lipid-like molecules Prenol lipids Sesquiterpenoids Sesquiterpenoids Bisabolane sesquiterpenoids Terpenoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00010122956 CCMSLIB00008851205 74 spectra_filtered.mgf IQAMDB.mgf 0.810591 3884700.0 0 90941.3 6 30.0262 300.145 1 temp/spectra_filtered.mgf74 1 Anomuricine LC-ESI qTof Isolated Beniddir/Le Pogam Le Pogam M+H 330.171 329.163 1 N/A N/A COC1=CC=C(C[C@]2([H])NCCC3=C2C=C(OC)C(OC)=C3O)C=C1 InChI=1S/C19H23NO4/c1-22-13-6-4-12(5-7-13)10-16-15-11-17(23-2)19(24-3)18(21)14(15)8-9-20-16/h4-7,11,16,20-21H,8-10H2,1-3H3/t16-/m0/s1 N/A 3 Positive IQAMDB 330.171 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C19H23NO4 SQMUQBYKHDACDD-INIZCTEOSA-N SQMUQBYKHDACDD Organoheterocyclic compounds Isoquinolines and derivatives Benzylisoquinolines Tyrosine alkaloids Isoquinoline alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00008851205 CCMSLIB00012475058 854 spectra_filtered.mgf GNPS-LIBRARY.mgf 0.809906 2079300.0 0 49195.2 6 15.9955 341.138 1 temp/spectra_filtered.mgf854 1 Knemolic acid B LC-ESI Orbitrap Isolated Wolfender Olivier Kirchhoffer M+H-H2O 325.143 0.0 1 OC1=C(C(O)=O)C(CCCCCCC2=CC(OCO3)=C3C=C2)=CC=C1 InChI=1S/C20H22O5/c21-16-9-5-8-15(19(16)20(22)23)7-4-2-1-3-6-14-10-11-17-18(12-14)25-13-24-17/h5,8-12,21H,1-4,6-7,13H2,(H,22,23) DVFSVQXMSUTLSZ-UHFFFAOYSA-N 3 Positive GNPS-LIBRARY 325.143 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C20H22O5 DVFSVQXMSUTLSZ-UHFFFAOYSA-N DVFSVQXMSUTLSZ N/A N/A N/A Lignans Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012475058 CCMSLIB00010106258 434 spectra_filtered.mgf BERKELEY-LAB.mgf 0.808241 54036000.0 0 3165.68 6 1.00711 317.127 1 temp/spectra_filtered.mgf434 1 Piperlongumine CollisionEnergy:102040 LC-ESI Orbitrap Commercial Trent Northen JGI M+H 318.134 0.0 1 N/A N/A COc1cc(C=CC(=O)N2CCC=CC2=O)cc(OC)c1OC """InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+""" N/A 3 Positive BERKELEY-LAB 318.134 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C17H19NO5 VABYUUZNAVQNPG-UHFFFAOYSA-N VABYUUZNAVQNPG N/A N/A N/A Lysine alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00010106258 CCMSLIB00005722714 659 spectra_filtered.mgf GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE.mgf 0.806981 6087900.0 0 5908.97 13 2.0162 343.227 1 temp/spectra_filtered.mgf659 1 NCGC00169961-02!4-hydroxy-3-[(2E,6E)-4-hydroxy-3,7,11-trimethyldodeca-2,6,10-trienyl]benzoic acid [IIN-based: Match] LC-ESI Orbitrap Commercial Pieter Dorrestein lfnothias/robinschmid [M-H2O+H]+ 341.211 358.215 1 N/A N/A CC(C)=CCC\\C(C)=C\\CC(O)C(\\C)=C\\CC1=C(O)C=CC(=C1)C(O)=O InChI=1S/C22H30O4/c1-15(2)6-5-7-16(3)8-12-20(23)17(4)9-10-18-14-19(22(25)26)11-13-21(18)24/h6,8-9,11,13-14,20,23-24H,5,7,10,12H2,1-4H3,(H,25,26)/b16-8+,17-9+ N/A 3 Positive GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE 341.211 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C22H30O4 LSQRGMPMJOCLHX-GONBZBRSSA-N LSQRGMPMJOCLHX Lipids and lipid-like molecules Prenol lipids Sesquiterpenoids Meroterpenoids Merosesquiterpenoids Terpenoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00005722714 CCMSLIB00010076562 891 spectra_filtered.mgf PNNL-LIPIDS-POSITIVE.mgf 0.805669 26149600.0 0 255386.0 16 162.053 796.594 1 temp/spectra_filtered.mgf891 1 DG(18:2/0:0/18:2); [M+NH4]+ C39H72N1O5 LC-ESI HCD; Velos Commercial Thomas Metz Thomas Metz M+NH4 634.541 0.0 1 N/A N/A N/A N/A N/A 1 Positive PNNL-LIPIDS-POSITIVE 634.541 UPDATE-SINGLE-ANNOTATED-GOLD Gold N/A N/A N/A N/A N/A N/A N/A N/A N/A mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00010076562 CCMSLIB00012445334 695 spectra_filtered.mgf MSNLIB-POSITIVE.mgf 0.80512 1460700.0 0 458033.0 8 339.138 401.284 1 temp/spectra_filtered.mgf695 1 NCGC00380920-01 ESI Orbitrap Crude Tomas Pluskal Corinna Brungs [M+NH4]+ 740.422 722.388 1 N/A N/A CC(=O)OC1C(O)CC2(C)C(CCC3(C)C2CC=C2C4C5(CCC(CO[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)(OC5=O)C4(C)O)C(O)CC23C)C1(C)C InChI=1S/C38H58O13/c1-18(40)49-29-20(41)14-33(4)22(32(29,2)3)10-11-34(5)23(33)9-8-19-28-36(7,47)37(17-48-30-27(45)26(44)25(43)21(16-39)50-30)12-13-38(28,31(46)51-37)24(42)15-35(19,34)6/h8,20-30,39,41-45,47H,9-17H2,1-7H3/t20?,21-,22?,23?,24?,25-,26+,27-,28?,29?,30-,33?,34?,35?,36?,37?,38?/m1/s1 LEQXEFGUWIFCPS-UHSOLSLDSA-N 1 Positive MSNLIB-POSITIVE 740.422 UPDATE-SINGLE-ANNOTATED-GOLD Gold C38H58O13 LEQXEFGUWIFCPS-UHSOLSLDSA-N LEQXEFGUWIFCPS Lipids and lipid-like molecules Prenol lipids Triterpenoids Triterpenoids Oleanane triterpenoids Terpenoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012445334 CCMSLIB00010104123 382 spectra_filtered.mgf BERKELEY-LAB.mgf 0.804974 1014100.0 0 343423.0 6 108.917 426.067 1 temp/spectra_filtered.mgf382 1 """(2E)-1-(1,3-dimethylpyrazol-4-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one CollisionEnergy:102040""" LC-ESI Orbitrap Commercial Trent Northen JGI M+H 317.15 0.0 1 N/A N/A COc1cc(C=CC(=O)c2cn(C)nc2C)cc(OC)c1OC """InChI=1S/C17H20N2O4/c1-11-13(10-19(2)18-11)14(20)7-6-12-8-15(21-3)17(23-5)16(9-12)22-4/h6-10H,1-5H3/b7-6+""" N/A 3 Positive BERKELEY-LAB 317.15 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C17H20N2O4 SRWKSZVFPVIAGB-UHFFFAOYSA-N SRWKSZVFPVIAGB N/A N/A N/A Flavonoids Chalcones Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00010104123 CCMSLIB00012447608 730 spectra_filtered.mgf MSNLIB-POSITIVE.mgf 0.804583 3003800.0 0 174748.0 6 87.94 415.3 1 temp/spectra_filtered.mgf730 1 CHEBI:181076 ESI Orbitrap Crude Tomas Pluskal Corinna Brungs [M+Na]+ 503.24 480.251 1 N/A N/A CC(=O)O[C@@H]1CC2C(/C=C(\C)C(=O)[C@@]3(O)C[C@@H](C)[C@H](OC(=O)c4ccccc4)C3/C=C/1C)C2(C)C InChI=1S/C29H36O6/c1-16-12-23-25(35-27(32)20-10-8-7-9-11-20)18(3)15-29(23,33)26(31)17(2)13-21-22(28(21,5)6)14-24(16)34-19(4)30/h7-13,18,21-25,33H,14-15H2,1-6H3/b16-12+,17-13+/t18-,21?,22?,23?,24-,25+,29-/m1/s1 WTURHHSEHGCTBS-OMKDOCLMSA-N 1 Positive MSNLIB-POSITIVE 503.24 UPDATE-SINGLE-ANNOTATED-GOLD Gold C29H36O6 WTURHHSEHGCTBS-OMKDOCLMSA-N WTURHHSEHGCTBS Lipids and lipid-like molecules Prenol lipids Diterpenoids Diterpenoids Lathyrane diterpenoids Terpenoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012447608 CCMSLIB00006114078 504 spectra_filtered.mgf BIRMINGHAM-UHPLC-MS-POS.mgf 0.804205 54254000.0 0 53402.3 6 11.0052 217.086 1 temp/spectra_filtered.mgf504 1 dl-3-Indolelactic acid - 40.0 eV ESI Orbitrap Isolated PI Data Collector M+H 206.081 0.0 1 N/A c1ccc2c(c1)c(c[nH]2)CC(C(=O)O)O InChI=1S/C11H11NO3/c13-10(11(14)15)5-7-6-12-9-4-2-1-3-8(7)9/h1-4,6,10,12-13H,5H2,(H,14,15) N/A 1 Positive BIRMINGHAM-UHPLC-MS-POS 206.081 UPDATE-SINGLE-ANNOTATED-GOLD Gold C11H11NO3 XGILAAMKEQUXLS-UHFFFAOYSA-N XGILAAMKEQUXLS Organoheterocyclic compounds Indoles and derivatives Indolyl carboxylic acids and derivatives Tryptophan alkaloids Simple indole alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00006114078 CCMSLIB00010122925 661 spectra_filtered.mgf BERKELEY-LAB.mgf 0.802362 4036700.0 0 2195090.0 6 428.186 623.251 1 temp/spectra_filtered.mgf661 1 ferulic acid CollisionEnergy:205060 LC-ESI Orbitrap Commercial Trent Northen JGI M+H 195.065 0.0 1 N/A N/A COc1cc(C=CC(=O)O)ccc1O """InChI=1S/C10H10O4/c1-14-9-6-7(2-4-8(9)11)3-5-10(12)13/h2-6,11H,1H3,(H,12,13)/b5-3+""" N/A 3 Positive BERKELEY-LAB 195.065 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C10H10O4 KSEBMYQBYZTDHS-UHFFFAOYSA-N KSEBMYQBYZTDHS Phenylpropanoids and polyketides Cinnamic acids and derivatives Hydroxycinnamic acids and derivatives Phenylpropanoids (C6-C3) Cinnamic acids and derivatives Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00010122925 CCMSLIB00006114078 459 spectra_filtered.mgf BIRMINGHAM-UHPLC-MS-POS.mgf 0.801655 24511000.0 0 53402.8 6 11.0053 217.086 1 temp/spectra_filtered.mgf459 1 dl-3-Indolelactic acid - 40.0 eV ESI Orbitrap Isolated PI Data Collector M+H 206.081 0.0 1 N/A c1ccc2c(c1)c(c[nH]2)CC(C(=O)O)O InChI=1S/C11H11NO3/c13-10(11(14)15)5-7-6-12-9-4-2-1-3-8(7)9/h1-4,6,10,12-13H,5H2,(H,14,15) N/A 1 Positive BIRMINGHAM-UHPLC-MS-POS 206.081 UPDATE-SINGLE-ANNOTATED-GOLD Gold C11H11NO3 XGILAAMKEQUXLS-UHFFFAOYSA-N XGILAAMKEQUXLS Organoheterocyclic compounds Indoles and derivatives Indolyl carboxylic acids and derivatives Tryptophan alkaloids Simple indole alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00006114078 CCMSLIB00012342517 392 spectra_filtered.mgf MSNLIB-POSITIVE.mgf 0.801569 776500.0 0 250920.0 6 83.8578 418.059 1 temp/spectra_filtered.mgf392 1 Cinoctramide ESI Orbitrap Crude Tomas Pluskal Corinna Brungs [M+H]+ 334.201 333.194 1 N/A N/A COc1cc(/C=C/C(=O)N2CCCCCCC2)cc(OC)c1OC InChI=1S/C19H27NO4/c1-22-16-13-15(14-17(23-2)19(16)24-3)9-10-18(21)20-11-7-5-4-6-8-12-20/h9-10,13-14H,4-8,11-12H2,1-3H3/b10-9+ MDGVCMGGLSOVIQ-MDZDMXLPSA-N 1 Positive MSNLIB-POSITIVE 334.201 UPDATE-SINGLE-ANNOTATED-GOLD Gold C19H27NO4 MDGVCMGGLSOVIQ-MDZDMXLPSA-N MDGVCMGGLSOVIQ N/A N/A N/A Lysine alkaloids Piperidine alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012342517 CCMSLIB00012446314 164 spectra_filtered.mgf MSNLIB-POSITIVE.mgf 0.800345 1461200.0 0 249974.0 6 133.036 399.166 1 temp/spectra_filtered.mgf164 1 NCGC00380580-01 ESI Orbitrap Crude Tomas Pluskal Corinna Brungs [M+NH4]+ 532.202 514.169 1 N/A N/A CC(=O)O[C@@H]1[C@@H](CO)O[C@@](CO)(O[C@H]2O[C@H](COC(=O)/C=C/c3ccccc3)[C@@H](O)[C@H](O)[C@H]2O)[C@H]1O InChI=1S/C23H30O13/c1-12(26)33-20-14(9-24)35-23(11-25,21(20)31)36-22-19(30)18(29)17(28)15(34-22)10-32-16(27)8-7-13-5-3-2-4-6-13/h2-8,14-15,17-22,24-25,28-31H,9-11H2,1H3/b8-7+/t14-,15-,17-,18+,19-,20-,21+,22-,23+/m1/s1 JNKDXWGGWNLKOD-BLFJEXFJSA-N 1 Positive MSNLIB-POSITIVE 532.202 UPDATE-SINGLE-ANNOTATED-GOLD Gold C23H30O13 JNKDXWGGWNLKOD-BLFJEXFJSA-N JNKDXWGGWNLKOD Phenylpropanoids and polyketides Cinnamic acids and derivatives Cinnamic acid esters Phenylpropanoids (C6-C3) Cinnamic acids and derivatives Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012446314 CCMSLIB00006678080 604 spectra_filtered.mgf GNPS-LIBRARY.mgf 0.79999 10341300.0 0 330596.0 12 236.212 478.293 1 temp/spectra_filtered.mgf604 1 PE-DAG (16:1/18:2) LC-ESI Orbitrap Other S Ding Su Ding M+H 714.506 714.506 1 N/A N/A N/A N/A N/A 3 Positive GNPS-LIBRARY 714.506 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze N/A N/A N/A N/A N/A N/A N/A N/A N/A mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00006678080 CCMSLIB00012432703 578 spectra_filtered.mgf MSNLIB-POSITIVE.mgf 0.799726 21792500.0 0 94208.8 6 26.0166 302.176 1 temp/spectra_filtered.mgf578 1 (4E)-N-Isobutyl-5-(1,3-benzodioxol-5-yl)-4-pentenamide ESI Orbitrap Crude Tomas Pluskal Corinna Brungs [M+H]+ 276.159 275.152 1 N/A N/A CC(C)CNC(=O)CC/C=C/c1cc2c(cc1)OCO2 InChI=1S/C16H21NO3/c1-12(2)10-17-16(18)6-4-3-5-13-7-8-14-15(9-13)20-11-19-14/h3,5,7-9,12H,4,6,10-11H2,1-2H3,(H,17,18)/b5-3+ ZECKKAHILSTZLB-HWKANZROSA-N 1 Positive MSNLIB-POSITIVE 276.159 UPDATE-SINGLE-ANNOTATED-GOLD Gold C16H21NO3 ZECKKAHILSTZLB-HWKANZROSA-N ZECKKAHILSTZLB N/A N/A N/A Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012432703 CCMSLIB00012475058 864 spectra_filtered.mgf GNPS-LIBRARY.mgf 0.798835 6175000.0 0 49195.6 6 15.9956 341.139 1 temp/spectra_filtered.mgf864 1 Knemolic acid B LC-ESI Orbitrap Isolated Wolfender Olivier Kirchhoffer M+H-H2O 325.143 0.0 1 OC1=C(C(O)=O)C(CCCCCCC2=CC(OCO3)=C3C=C2)=CC=C1 InChI=1S/C20H22O5/c21-16-9-5-8-15(19(16)20(22)23)7-4-2-1-3-6-14-10-11-17-18(12-14)25-13-24-17/h5,8-12,21H,1-4,6-7,13H2,(H,22,23) DVFSVQXMSUTLSZ-UHFFFAOYSA-N 3 Positive GNPS-LIBRARY 325.143 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C20H22O5 DVFSVQXMSUTLSZ-UHFFFAOYSA-N DVFSVQXMSUTLSZ N/A N/A N/A Lignans Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012475058 CCMSLIB00012432214 844 spectra_filtered.mgf MSNLIB-POSITIVE.mgf 0.797576 11265000.0 0 192218.0 8 135.022 567.42 1 temp/spectra_filtered.mgf844 1 CHEBI:181245 ESI Orbitrap Crude Tomas Pluskal Corinna Brungs [M+NH4]+ 702.442 684.408 1 N/A N/A CC(CC(O)C(O)C(C)(C)O)C1CCC2(C)C3CCC4C(C)(C(=O)OC5OC(CO)C(O)C(O)C5O)C(O)CC(O)C45CC35CCC12C InChI=1S/C36H60O12/c1-17(13-19(38)28(44)31(2,3)46)18-9-10-33(5)21-7-8-22-34(6,30(45)48-29-27(43)26(42)25(41)20(15-37)47-29)23(39)14-24(40)36(22)16-35(21,36)12-11-32(18,33)4/h17-29,37-44,46H,7-16H2,1-6H3 RCCBGOMNZWYBTJ-UHFFFAOYSA-N 1 Positive MSNLIB-POSITIVE 702.442 UPDATE-SINGLE-ANNOTATED-GOLD Gold C36H60O12 RCCBGOMNZWYBTJ-UHFFFAOYSA-N RCCBGOMNZWYBTJ Lipids and lipid-like molecules Prenol lipids Terpene glycosides Triterpenoids Cycloartane triterpenoids Terpenoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012432214 CCMSLIB00000849957 147 spectra_filtered.mgf GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE.mgf 0.794795 2217200.0 0 49780.0 6 17.975 379.064 1 temp/spectra_filtered.mgf147 1 NCGC00384821-01_C16H18O8_Cyclohexanecarboxylic acid, 1,3,4-trihydroxy-5-[[(2E)-3-(4-hydroxyphenyl)-1-oxo-2-propen-1-yl]oxy]-, (1R,3R,4S,5R)- LC-ESI Maxis II HD Q-TOF Bruker isolated Jadhav/Dorrestein lfnothias M+Na 361.089 338.1 1 n/a n/a O[C@@H]1C[C@@](O)(C[C@@H](OC(=O)\C=C\C2=CC=C(O)C=C2)[C@H]1O)C(O)=O InChI=1S/C16H18O8/c17-10-4-1-9(2-5-10)3-6-13(19)24-12-8-16(23,15(21)22)7-11(18)14(12)20/h1-6,11-12,14,17-18,20,23H,7-8H2,(H,21,22)/b6-3+/t11-,12-,14+,16-/m1/s1 N/A 1 positive GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE 361.089 UPDATE-SINGLE-ANNOTATED-GOLD Gold C16H18O8 BMRSEYFENKXDIS-QHAYPTCMSA-N BMRSEYFENKXDIS Organic oxygen compounds Organooxygen compounds Alcohols and polyols Phenylpropanoids (C6-C3) Cinnamic acids and derivatives Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00000849957 CCMSLIB00012269489 323 spectra_filtered.mgf CMMC-REFRAME-POSITIVE-LIBRARY.mgf 0.793159 6297400.0 0 978998.0 6 233.106 471.213 1 temp/spectra_filtered.mgf323 1 Cintriamide LC-ESI Orbitrap Commercial Pieter C. Dorrestein Nina Haoqi Zhao [M+H]+ 238.107 237.1 1 N/A N/A COc1cc(C=CC(N)=O)cc(OC)c1OC """InChI=1S/C12H15NO4/c1-15-9-6-8(4-5-11(13)14)7-10(16-2)12(9)17-3/h4-7H,1-3H3,(H2,13,14)/b5-4+""" LRLKZVMLJBNNPE-SNAWJCMRSA-N 1 Positive PRIVATE-LIB 238.107 UPDATE-SINGLE-ANNOTATED-GOLD Gold C12H15NO4 LRLKZVMLJBNNPE-UHFFFAOYSA-N LRLKZVMLJBNNPE Phenylpropanoids and polyketides Cinnamic acids and derivatives Cinnamic acid amides Phenylpropanoids (C6-C3) Cinnamic acid amides Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012269489 CCMSLIB00004715484 245 spectra_filtered.mgf MONA.mgf 0.791507 2152700.0 0 25197.2 13 14.0157 570.255 1 temp/spectra_filtered.mgf245 1 2-[4-[4-[hydroxy-(4-hydroxy-3-methoxyphenyl)methyl]-3-(hydroxymethyl)oxolan-2-yl]-2-methoxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol N/A ESI-QFT isolated MoNA MoNA:VF-NPL-QEHF024421 [M+NH4]+ 556.239 0.0 1 N/A N/A COc1cc(C(O)C2COC(c3ccc(OC4OC(CO)C(O)C(O)C4O)c(OC)c3)C2CO)ccc1O InChI=1S/C26H34O12/c1-34-18-7-12(3-5-16(18)29)21(30)15-11-36-25(14(15)9-27)13-4-6-17(19(8-13)35-2)37-26-24(33)23(32)22(31)20(10-28)38-26/h3-8,14-15,20-33H,9-11H2,1-2H3 N/A 3 positive MONA 556.239 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C26H34O12 AWTYKUNFPBFFHC-UHFFFAOYSA-N AWTYKUNFPBFFHC N/A N/A N/A Lignans Furanoid lignans Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00004715484 CCMSLIB00012475058 477 spectra_filtered.mgf GNPS-LIBRARY.mgf 0.789999 44430000.0 0 49195.9 6 15.9957 341.139 1 temp/spectra_filtered.mgf477 1 Knemolic acid B LC-ESI Orbitrap Isolated Wolfender Olivier Kirchhoffer M+H-H2O 325.143 0.0 1 OC1=C(C(O)=O)C(CCCCCCC2=CC(OCO3)=C3C=C2)=CC=C1 InChI=1S/C20H22O5/c21-16-9-5-8-15(19(16)20(22)23)7-4-2-1-3-6-14-10-11-17-18(12-14)25-13-24-17/h5,8-12,21H,1-4,6-7,13H2,(H,22,23) DVFSVQXMSUTLSZ-UHFFFAOYSA-N 3 Positive GNPS-LIBRARY 325.143 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C20H22O5 DVFSVQXMSUTLSZ-UHFFFAOYSA-N DVFSVQXMSUTLSZ N/A N/A N/A Lignans Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012475058 CCMSLIB00010114577 303 spectra_filtered.mgf BERKELEY-LAB.mgf 0.787037 7098200.0 0 938743.0 6 139.997 289.129 1 temp/spectra_filtered.mgf303 1 (1R)-(-)-Nopol CollisionEnergy:102040 LC-ESI Orbitrap Commercial Trent Northen JGI M+H-H2O 149.132 0.0 1 N/A N/A CC1(C)C2CC=C(CCO)C1C2 """InChI=1S/C11H18O/c1-11(2)9-4-3-8(5-6-12)10(11)7-9/h3,9-10,12H,4-7H2,1-2H3/t9-,10?/m0/s1""" N/A 3 Positive BERKELEY-LAB 149.132 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C11H18O ROKSAUSPJGWCSM-UHFFFAOYSA-N ROKSAUSPJGWCSM Lipids and lipid-like molecules Prenol lipids Monoterpenoids Monoterpenoids Pinane monoterpenoids Terpenoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00010114577 CCMSLIB00012432214 894 spectra_filtered.mgf MSNLIB-POSITIVE.mgf 0.786603 19248100.0 0 192218.0 8 135.022 567.42 1 temp/spectra_filtered.mgf894 1 CHEBI:181245 ESI Orbitrap Crude Tomas Pluskal Corinna Brungs [M+NH4]+ 702.442 684.408 1 N/A N/A CC(CC(O)C(O)C(C)(C)O)C1CCC2(C)C3CCC4C(C)(C(=O)OC5OC(CO)C(O)C(O)C5O)C(O)CC(O)C45CC35CCC12C InChI=1S/C36H60O12/c1-17(13-19(38)28(44)31(2,3)46)18-9-10-33(5)21-7-8-22-34(6,30(45)48-29-27(43)26(42)25(41)20(15-37)47-29)23(39)14-24(40)36(22)16-35(21,36)12-11-32(18,33)4/h17-29,37-44,46H,7-16H2,1-6H3 RCCBGOMNZWYBTJ-UHFFFAOYSA-N 1 Positive MSNLIB-POSITIVE 702.442 UPDATE-SINGLE-ANNOTATED-GOLD Gold C36H60O12 RCCBGOMNZWYBTJ-UHFFFAOYSA-N RCCBGOMNZWYBTJ Lipids and lipid-like molecules Prenol lipids Terpene glycosides Triterpenoids Cycloartane triterpenoids Terpenoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012432214 CCMSLIB00006560703 603 spectra_filtered.mgf BMDMS-NP.mgf 0.786243 8240000.0 0 8985.09 7 2.0583 231.138 1 temp/spectra_filtered.mgf603 1 p-methoxycinnamic acid ethyl ester ESI Orbitrap Commercial standard BMDMS-NP BMDMS-NP [M+Na]+ 229.08 206.094 1 N/A N/A O=C(OCC)C=CC1=CC=C(OC)C=C1 InChI=1S/C12H14O3/c1-3-15-12(13)9-6-10-4-7-11(14-2)8-5-10/h4-9H,3H2,1-2H3 N/A 1 Positive BMDMS-NP 229.08 UPDATE-SINGLE-ANNOTATED-GOLD Gold C12H14O3 DHNGCHLFKUPGPX-UHFFFAOYSA-N DHNGCHLFKUPGPX Phenylpropanoids and polyketides Cinnamic acids and derivatives Cinnamic acid esters Phenylpropanoids (C6-C3) Cinnamic acids and derivatives Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00006560703 CCMSLIB00006439374 153 spectra_filtered.mgf BMDMS-NP.mgf 0.785688 27970000.0 0 103042.0 8 28.0399 300.16 1 temp/spectra_filtered.mgf153 1 Higenamine ESI Orbitrap Commercial standard BMDMS-NP BMDMS-NP [M+H]+ 272.12 271.121 1 N/A N/A OC1=CC=C(C=C1)CC2NCCC3=CC(O)=C(O)C=C32 InChI=1S/C16H17NO3/c18-12-3-1-10(2-4-12)7-14-13-9-16(20)15(19)8-11(13)5-6-17-14/h1-4,8-9,14,17-20H,5-7H2 N/A 1 Positive BMDMS-NP 272.12 UPDATE-SINGLE-ANNOTATED-GOLD Gold C16H17NO3 WZRCQWQRFZITDX-UHFFFAOYSA-N WZRCQWQRFZITDX Organoheterocyclic compounds Isoquinolines and derivatives Benzylisoquinolines Tyrosine alkaloids Isoquinoline alkaloids|Tetrahydroisoquinoline alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00006439374 CCMSLIB00012443642 694 spectra_filtered.mgf MSNLIB-POSITIVE.mgf 0.784711 1899100.0 0 125356.0 9 67.1062 602.433 1 temp/spectra_filtered.mgf694 1 CHEBI:181879 ESI Orbitrap Crude Tomas Pluskal Corinna Brungs [M+H]+ 535.327 534.319 1 N/A N/A CC1(CO)CC(O)[C@]2(C(=O)O)CCC34CC3(C=CC3[C@]5(C)C(CC[C@]34C)C(C)(CO)[C@@H](O)[C@H](O)[C@@H]5O)C2C1 InChI=1S/C30H46O8/c1-24(14-31)11-18-28-8-6-17-26(3,29(28,13-28)9-10-30(18,23(37)38)19(33)12-24)7-5-16-25(2,15-32)21(35)20(34)22(36)27(16,17)4/h6,8,16-22,31-36H,5,7,9-15H2,1-4H3,(H,37,38)/t16?,17?,18?,19?,20-,21-,22-,24?,25?,26+,27-,28?,29?,30-/m0/s1 IXIMDUAPYHOVHL-QQQCTMDWSA-N 1 Positive MSNLIB-POSITIVE 535.327 UPDATE-SINGLE-ANNOTATED-GOLD Gold C30H46O8 IXIMDUAPYHOVHL-QQQCTMDWSA-N IXIMDUAPYHOVHL Lipids and lipid-like molecules Prenol lipids Sesterterpenoids Triterpenoids Oleanane triterpenoids Terpenoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012443642 CCMSLIB00004698754 143 spectra_filtered.mgf MONA.mgf 0.78279 2948000.0 0 26028.2 6 11.1975 419.009 1 temp/spectra_filtered.mgf143 1 4-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypentan-2-yl (E)-3-(4-hydroxyphenyl)prop-2-enoate N/A ESI-QFT isolated MoNA MoNA:VF-NPL-QEHF007691 [M+NH4]+ 430.207 0.0 1 N/A N/A CC(CC(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)OC(=O)/C=C/c1ccc(O)cc1 InChI=1S/C20H28O9/c1-11(27-16(23)8-5-13-3-6-14(22)7-4-13)9-12(2)28-20-19(26)18(25)17(24)15(10-21)29-20/h3-8,11-12,15,17-22,24-26H,9-10H2,1-2H3/b8-5+/t11?,12?,15-,17-,18+,19-,20-/m1/s1 N/A 3 positive MONA 430.207 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C20H28O9 RMFDCHYDPYVNFA-AKVWERCLSA-N RMFDCHYDPYVNFA Lipids and lipid-like molecules Fatty Acyls Fatty acyl glycosides Phenylpropanoids (C6-C3) Cinnamic acids and derivatives Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00004698754 CCMSLIB00012280371 163 spectra_filtered.mgf MSNLIB-POSITIVE.mgf 0.781514 8087800.0 0 341148.0 6 83.9854 330.17 1 temp/spectra_filtered.mgf163 1 Desvenlafaxine ESI Orbitrap Crude Tomas Pluskal Corinna Brungs [M+H-H2O]+ 246.185 263.189 1 N/A N/A CN(C)CC(c1ccc(O)cc1)C1(O)CCCCC1 InChI=1S/C16H25NO2/c1-17(2)12-15(13-6-8-14(18)9-7-13)16(19)10-4-3-5-11-16/h6-9,15,18-19H,3-5,10-12H2,1-2H3 KYYIDSXMWOZKMP-UHFFFAOYSA-N 1 Positive MSNLIB-POSITIVE 246.185 UPDATE-SINGLE-ANNOTATED-GOLD Gold C16H25NO2 KYYIDSXMWOZKMP-UHFFFAOYSA-N KYYIDSXMWOZKMP Organic oxygen compounds Organooxygen compounds Alcohols and polyols Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012280371 CCMSLIB00000849000 328 spectra_filtered.mgf GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE.mgf 0.780915 7627700.0 0 44558.8 11 18.011 422.218 1 temp/spectra_filtered.mgf328 1 NCGC00380478-01!(3S,3aR,6S,6aR)-3,6-bis(3,4-dimethoxyphenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan LC-ESI Maxis II HD Q-TOF Bruker isolated Jadhav/Dorrestein lfnothias M+NH4 404.207 386.173 1 n/a n/a COC1=C(OC)C=C(C=C1)[C@H]2OC[C@H]3[C@@H]2CO[C@@H]3C4=CC(OC)=C(OC)C=C4 InChI=1S/C22H26O6/c1-23-17-7-5-13(9-19(17)25-3)21-15-11-28-22(16(15)12-27-21)14-6-8-18(24-2)20(10-14)26-4/h5-10,15-16,21-22H,11-12H2,1-4H3/t15-,16-,21+,22+/m0/s1 N/A 1 positive GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE 404.207 UPDATE-SINGLE-ANNOTATED-GOLD Gold C22H26O6 PEUUVVGQIVMSAW-RZTYQLBFSA-N PEUUVVGQIVMSAW N/A N/A N/A Lignans Furofuranoid lignans Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00000849000 CCMSLIB00005777275 896 spectra_filtered.mgf MASSBANK.mgf 0.779682 4338600.0 0 22697.3 12 12.9704 584.421 1 temp/spectra_filtered.mgf896 1 Massbank:MSJ00113 Lycopene-5,6-diol ESI qTof Isolated Massbank Massbank M+H 571.451 0.0 1 N/A N/A CC(=CCC/C(=C/C=C/C(=C/C=C/C(=C/C=C/C=C(\C)/C=C/C=C(\C)/C=C/C(C(C)(CCC=C(C)C)O)O)/C)/C)/C)C 1S/C40H58O2/c1-32(2)18-13-22-36(7)25-15-27-37(8)26-14-23-34(5)20-11-12-21-35(6)24-16-28-38(9)29-30-39(41)40(10,42)31-17-19-33(3)4/h11-12,14-16,18-21,23-30,39,41-42H,13,17,22,31H2,1-10H3/b12-11+,23-14+,24-16+,27-15+,30-29+,34-20+,35-21+,36-25+,37-26+,38-28+ N/A 3 Positive MASSBANK 571.451 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C40H58O2 BMVRDJXDSMPZGO-RGZXCSNFSA-N BMVRDJXDSMPZGO Lipids and lipid-like molecules Prenol lipids Tetraterpenoids Carotenoids (C40) Carotenoids (C40, Ψ-Ψ) Terpenoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00005777275 CCMSLIB00006114729 433 spectra_filtered.mgf BIRMINGHAM-UHPLC-MS-POS.mgf 0.777717 3568300.0 0 748535.0 6 178.968 418.059 1 temp/spectra_filtered.mgf433 1 (E)-3,4,5-Trimethoxycinnamic acid - 40.0 eV ESI Orbitrap Isolated PI Data Collector M+H 239.091 0.0 1 N/A COc1cc(cc(c1OC)OC)/C=C/C(=O)O InChI=1S/C12H14O5/c1-15-9-6-8(4-5-11(13)14)7-10(16-2)12(9)17-3/h4-7H,1-3H3,(H,13,14)/b5-4+ N/A 1 Positive BIRMINGHAM-UHPLC-MS-POS 239.091 UPDATE-SINGLE-ANNOTATED-GOLD Gold C12H14O5 YTFVRYKNXDADBI-SNAWJCMRSA-N YTFVRYKNXDADBI Phenylpropanoids and polyketides Cinnamic acids and derivatives Hydroxycinnamic acids and derivatives Phenylpropanoids (C6-C3) Cinnamic acids and derivatives Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00006114729 CCMSLIB00006417315 437 spectra_filtered.mgf BMDMS-NP.mgf 0.777121 2583000.0 0 50644.1 6 10.9923 206.058 1 temp/spectra_filtered.mgf437 1 9-methoxy-7H-furo[3,2-g]chromen-7-one ESI Orbitrap Commercial standard BMDMS-NP BMDMS-NP [M+H]+ 217.05 216.042 1 N/A N/A O=C1OC2=C(OC)C=3OC=CC3C=C2C=C1 InChI=1S/C12H8O4/c1-14-12-10-8(4-5-15-10)6-7-2-3-9(13)16-11(7)12/h2-6H,1H3 N/A 1 Positive BMDMS-NP 217.05 UPDATE-SINGLE-ANNOTATED-GOLD Gold C12H8O4 QXKHYNVANLEOEG-UHFFFAOYSA-N QXKHYNVANLEOEG Phenylpropanoids and polyketides Coumarins and derivatives Furanocoumarins Coumarins Furocoumarins|Simple coumarins Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00006417315 CCMSLIB00010113342 358 spectra_filtered.mgf BERKELEY-LAB.mgf 0.777066 4504000.0 0 463844.0 6 96.0458 303.111 1 temp/spectra_filtered.mgf358 1 SINAPIC ACID CollisionEnergy:102040 LC-ESI Orbitrap Commercial Trent Northen JGI M+H-H2O 207.065 0.0 1 N/A N/A COc1cc(C=CC(=O)O)cc(OC)c1O """InChI=1S/C11H12O5/c1-15-8-5-7(3-4-10(12)13)6-9(16-2)11(8)14/h3-6,14H,1-2H3,(H,12,13)/b4-3+""" N/A 3 Positive BERKELEY-LAB 207.065 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C11H12O5 PCMORTLOPMLEFB-UHFFFAOYSA-N PCMORTLOPMLEFB Phenylpropanoids and polyketides Cinnamic acids and derivatives Hydroxycinnamic acids and derivatives Phenylpropanoids (C6-C3) Cinnamic acids and derivatives Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00010113342 CCMSLIB00005777287 897 spectra_filtered.mgf MASSBANK.mgf 0.776634 397900.0 0 19949.8 10 11.9983 613.423 1 temp/spectra_filtered.mgf897 1 Massbank:MSJ00114 Nostoxanthin ESI qTof Isolated Massbank Massbank M+H 601.425 0.0 1 N/A N/A CC1=C(C([C@H]([C@@H](C1)O)O)(C)C)/C=C/C(=C/C=C/C(=C/C=C/C=C(/C=C/C=C(/C=C/C2=C(C[C@H]([C@@H](C2(C)C)O)O)C)\C)\C)/C)/C 1S/C40H56O4/c1-27(17-13-19-29(3)21-23-33-31(5)25-35(41)37(43)39(33,7)8)15-11-12-16-28(2)18-14-20-30(4)22-24-34-32(6)26-36(42)38(44)40(34,9)10/h11-24,35-38,41-44H,25-26H2,1-10H3/b12-11+,17-13+,18-14+,23-21+,24-22+,27-15+,28-16+,29-19+,30-20+/t35-,36-,37+,38+/m1/s1 N/A 3 Positive MASSBANK 601.425 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C40H56O4 JVPASJUYZJKFHY-HWFHZMFDSA-N JVPASJUYZJKFHY Lipids and lipid-like molecules Prenol lipids Tetraterpenoids Carotenoids (C40) Carotenoids (C40, β-β) Terpenoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00005777287 CCMSLIB00000853579 848 spectra_filtered.mgf GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE.mgf 0.774954 285100.0 0 636311.0 8 245.154 630.427 1 temp/spectra_filtered.mgf848 1 NCGC00381199-01_C25H38O4_(3aR,5E,7S,10E,14E,16aS)-2,7-Dihydroxy-3-[(2S)-1-hydroxy-2-propanyl]-6,10,14,16a-tetramethyl-4,7,8,9,12,13,16,16a-octahydrocyclopenta[15]annulen-1(3aH)-one LC-ESI Maxis II HD Q-TOF Bruker isolated Jadhav/Dorrestein lfnothias M-H2O+H 385.273 402.277 1 n/a n/a C[C@H](CO)C/1=C(O)/C(=O)[C@@]2(C)C/C=C(C)/CC/C=C(C)/CC[C@H](O)/C(=C/C[C@H]12)C InChI=1S/C25H38O4/c1-16-7-6-8-17(2)13-14-25(5)20(11-10-18(3)21(27)12-9-16)22(19(4)15-26)23(28)24(25)29/h7,10,13,19-21,26-28H,6,8-9,11-12,14-15H2,1-5H3/b16-7+,17-13+,18-10+/t19-,20-,21+,25+/m1/s1 N/A 1 positive GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE 385.273 UPDATE-SINGLE-ANNOTATED-GOLD Gold C25H38O4 UTGBBPSEQPITLF-IXRUDUFRSA-N UTGBBPSEQPITLF Organic oxygen compounds Organooxygen compounds Alcohols and polyols Diterpenoids Cembrane diterpenoids|Dolabellane diterpenoids Terpenoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00000853579 CCMSLIB00003135590 645 spectra_filtered.mgf GNPS-NIST14-MATCHES.mgf 0.772892 1774300.0 0 119469.0 10 65.9983 618.428 1 temp/spectra_filtered.mgf645 1 Spectral Match to .beta.-Cryptoxanthin from NIST14 ESI QqQ Isolated Data from Wolfender/Litaudon Data deposited by pmallard M] 552.43 0.0 1 472708 N/A N/A N/A N/A 3 Positive GNPS-NIST14-MATCHES 552.43 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze N/A N/A N/A N/A N/A N/A N/A N/A N/A mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00003135590 CCMSLIB00005777272 898 spectra_filtered.mgf MASSBANK.mgf 0.77234 1056900.0 0 46098.5 9 26.9874 612.417 1 temp/spectra_filtered.mgf898 1 Massbank:MSJ00121 Antheraxanthin ESI qTof Isolated Massbank Massbank M+H 585.43 0.0 1 N/A N/A CC1=C(C(C[C@@H](C1)O)(C)C)/C=C/C(=C/C=C/C(=C/C=C/C=C(\C)/C=C/C=C(\C)/C=C/[C@]23[C@](O2)(C[C@H](CC3(C)C)O)C)/C)/C 1S/C40H56O3/c1-29(17-13-19-31(3)21-22-36-33(5)25-34(41)26-37(36,6)7)15-11-12-16-30(2)18-14-20-32(4)23-24-40-38(8,9)27-35(42)28-39(40,10)43-40/h11-24,34-35,41-42H,25-28H2,1-10H3/b12-11+,17-13+,18-14+,22-21+,24-23+,29-15+,30-16+,31-19+,32-20+/t34-,35+,39-,40+/m1/s1 N/A 3 Positive MASSBANK 585.43 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C40H56O3 OFNSUWBAQRCHAV-OYQUVCAXSA-N OFNSUWBAQRCHAV Lipids and lipid-like molecules Prenol lipids Tetraterpenoids Carotenoids (C40) Carotenoids (C40, β-β) Terpenoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00005777272 CCMSLIB00010102114 290 spectra_filtered.mgf BERKELEY-LAB.mgf 0.771373 13572000.0 0 614973.0 6 107.038 281.092 1 temp/spectra_filtered.mgf290 1 2-oxindole-3-acetic acid CollisionEnergy:205060 LC-ESI Orbitrap Commercial Trent Northen JGI M-H2O+H 174.054 191.058 1 N/A N/A C1=CC=C2C(=C1)C(C(=O)N2)CC(=O)O """InChI=1S/C10H9NO3/c12-9(13)5-7-6-3-1-2-4-8(6)11-10(7)14/h1-4,7H,5H2,(H,11,14)(H,12,13)""" N/A 3 Positive BERKELEY-LAB 174.054 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C10H9NO3 ILGMGHZPXRDCCS-UHFFFAOYSA-N ILGMGHZPXRDCCS Organoheterocyclic compounds Indoles and derivatives Indolyl carboxylic acids and derivatives Tryptophan alkaloids Simple oxindole alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00010102114 CCMSLIB00012449886 184 spectra_filtered.mgf MSNLIB-POSITIVE.mgf 0.76985 1227000.0 0 510764.0 6 237.084 227.092 1 temp/spectra_filtered.mgf184 1 NCGC00385424-01 ESI Orbitrap Crude Tomas Pluskal Corinna Brungs [M+NH4]+ 464.176 446.142 1 N/A N/A COc1cc(C(=O)OC[C@H]2O[C@@H](OC(C)(C)C(=O)O)[C@H](O)[C@@H](O)[C@@H]2O)cc(OC)c1O InChI=1S/C19H26O12/c1-19(2,18(25)26)31-17-15(23)14(22)13(21)11(30-17)7-29-16(24)8-5-9(27-3)12(20)10(6-8)28-4/h5-6,11,13-15,17,20-23H,7H2,1-4H3,(H,25,26)/t11-,13-,14+,15-,17+/m1/s1 JARGQHMSRBODMU-AQFIFQLPSA-N 1 Positive MSNLIB-POSITIVE 464.176 UPDATE-SINGLE-ANNOTATED-GOLD Gold C19H26O12 JARGQHMSRBODMU-AQFIFQLPSA-N JARGQHMSRBODMU Phenylpropanoids and polyketides Tannins Hydrolyzable tannins Phenolic acids (C6-C1) Simple phenolic acids Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012449886 CCMSLIB00010128701 678 spectra_filtered.mgf GNPS-LIBRARY.mgf 0.769148 7214300.0 0 22943.0 7 13.9785 623.25 1 temp/spectra_filtered.mgf678 1 3.10S-Hydroxypheophorbide a LC-ESI Orbitrap Isolated Wolfender R. Huber M+H 609.272 0.0 1 OC(CC[C@H]1[C@@H](C2=N/C1=C([C@](C(OC)=O)(O)C3=O)\C4=C3C(C)=C(N4)/C=C5N=C(C(C)=C\5CC)/C=C(N/6)/C(C=C)=C(C6=C\2)C)C)=O InChI=1S/C35H36N4O6/c1-8-19-15(3)22-12-24-17(5)21(10-11-28(40)41)31(38-24)30-32-29(33(42)35(30,44)34(43)45-7)18(6)25(39-32)14-27-20(9-2)16(4)23(37-27)13-26(19)36-22/h8,12-14,17,21,36,39,44H,1,9-11H2,2-7H3,(H,40,41)/t17-,21-,35-/m0/s1 3 Positive GNPS-LIBRARY 609.272 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C35H36N4O6 TXOKSKCKTYISQV-FHCXDJKBSA-N TXOKSKCKTYISQV Organoheterocyclic compounds Tetrapyrroles and derivatives Chlorins Tryptophan alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00010128701 CCMSLIB00010119597 346 spectra_filtered.mgf BERKELEY-LAB.mgf 0.768615 11100000.0 0 0.432203 10 0.000106812 247.133 1 temp/spectra_filtered.mgf346 1 ABSCISIC ACID CollisionEnergy:205060 LC-ESI Orbitrap Commercial Trent Northen JGI M+H-H2O 247.133 0.0 1 N/A N/A CC(C=CC1(O)C(C)=CC(=O)CC1(C)C)=CC(=O)O """InChI=1S/C15H20O4/c1-10(7-13(17)18)5-6-15(19)11(2)8-12(16)9-14(15,3)4/h5-8,19H,9H2,1-4H3,(H,17,18)/b6-5+,10-7-""" N/A 3 Positive BERKELEY-LAB 247.133 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C15H20O4 JLIDBLDQVAYHNE-UHFFFAOYSA-N JLIDBLDQVAYHNE Lipids and lipid-like molecules Prenol lipids Sesquiterpenoids Apocarotenoids Apocarotenoids(ε-) Terpenoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00010119597 CCMSLIB00012443882 304 spectra_filtered.mgf MSNLIB-POSITIVE.mgf 0.766618 1413300.0 0 83639.4 6 39.9957 518.188 1 temp/spectra_filtered.mgf304 1 CHEBI:181517 ESI Orbitrap Crude Tomas Pluskal Corinna Brungs [M+NH4]+ 478.192 460.158 1 N/A N/A O=C(Cc1ccccc1)OC[C@H]1O[C@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@@H]1O InChI=1S/C20H28O12/c21-7-10-13(23)15(25)17(27)19(30-10)32-20-18(28)16(26)14(24)11(31-20)8-29-12(22)6-9-4-2-1-3-5-9/h1-5,10-11,13-21,23-28H,6-8H2/t10-,11-,13-,14-,15+,16+,17-,18-,19-,20-/m1/s1 STSLPRRNSYCFTQ-JFRFVCMESA-N 1 Positive MSNLIB-POSITIVE 478.192 UPDATE-SINGLE-ANNOTATED-GOLD Gold C20H28O12 STSLPRRNSYCFTQ-JFRFVCMESA-N STSLPRRNSYCFTQ Organic oxygen compounds Organooxygen compounds Carbohydrates and carbohydrate conjugates mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012443882 CCMSLIB00012475056 648 spectra_filtered.mgf GNPS-LIBRARY.mgf 0.766049 8549400.0 0 448281.0 7 125.158 404.353 1 temp/spectra_filtered.mgf648 1 Knemolone D LC-ESI Orbitrap Isolated Wolfender Olivier Kirchhoffer M+H 279.195 0.0 1 OC1=C(C(C)=O)C(CCCCCCCCC)=CC(O)=C1 InChI=1S/C17H26O3/c1-3-4-5-6-7-8-9-10-14-11-15(19)12-16(20)17(14)13(2)18/h11-12,19-20H,3-10H2,1-2H3 JVLHSQZBYIOVOG-UHFFFAOYSA-N 3 Positive GNPS-LIBRARY 279.195 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C17H26O3 JVLHSQZBYIOVOG-UHFFFAOYSA-N JVLHSQZBYIOVOG N/A N/A N/A Aromatic polyketides Catechols with side chains Polyketides mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012475056 CCMSLIB00010127350 160 spectra_filtered.mgf GNPS-LIBRARY.mgf 0.765154 74672000.0 0 40959.5 7 14.0151 328.155 1 temp/spectra_filtered.mgf160 1 Magnoflorine LC-ESI Orbitrap Commercial Kellogg Kellogg M+ 342.17 342.171 1 2141-09-5 73337 C[N+]1(CCC2=CC(=C(C3=C2C1CC4=C3C(=C(C=C4)OC)O)O)OC)C 1S/C20H23NO4/c1-21(2)8-7-12-10-15(25-4)20(23)18-16(12)13(21)9-11-5-6-14(24-3)19(22)17(11)18/h5-6,10,13H,7-9H2,1-4H3,(H-,22,23)/p+1/t13-/m0/s1 3 Positive GNPS-LIBRARY 342.17 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze N/A YLRXAIKMLINXQY-UHFFFAOYSA-O YLRXAIKMLINXQY N/A N/A N/A N/A N/A N/A mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00010127350 CCMSLIB00010121500 329 spectra_filtered.mgf BERKELEY-LAB.mgf 0.764921 13134200.0 0 2.04932 11 0.000793457 387.181 1 temp/spectra_filtered.mgf329 1 """4-[(1R,5R)-6-(3,4-dimethoxyphenyl)-3,7-dioxabicyclo[3.3.0]oct-2-yl]-1,2-dimeth oxybenzene CollisionEnergy:205060""" LC-ESI Orbitrap Commercial Trent Northen JGI M+H 387.18 0.0 1 N/A N/A COc1ccc(C2OCC3C(c4ccc(OC)c(OC)c4)OCC23)cc1OC """InChI=1S/C22H26O6/c1-23-17-7-5-13(9-19(17)25-3)21-15-11-28-22(16(15)12-27-21)14-6-8-18(24-2)20(10-14)26-4/h5-10,15-16,21-22H,11-12H2,1-4H3/t15-,16-,21?,22?/m0/s1""" N/A 3 Positive BERKELEY-LAB 387.18 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C22H26O6 PEUUVVGQIVMSAW-UHFFFAOYSA-N PEUUVVGQIVMSAW N/A N/A N/A Lignans Furofuranoid lignans Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00010121500 CCMSLIB00003136309 724 spectra_filtered.mgf GNPS-NIST14-MATCHES.mgf 0.764476 4493900.0 0 4652.06 10 2.00681 429.373 1 temp/spectra_filtered.mgf724 1 Spectral Match to (+)-.alpha.-Tocopherol from NIST14 ESI Q-TOF Isolated Data from Wolfender/Litaudon Data deposited by pmallard M+H 431.38 0.0 1 59029 N/A N/A N/A N/A 3 Positive GNPS-NIST14-MATCHES 431.38 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze N/A N/A N/A N/A N/A N/A N/A N/A N/A mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00003136309 CCMSLIB00012475056 521 spectra_filtered.mgf GNPS-LIBRARY.mgf 0.763389 4205400.0 0 147080.0 6 41.0639 320.259 1 temp/spectra_filtered.mgf521 1 Knemolone D LC-ESI Orbitrap Isolated Wolfender Olivier Kirchhoffer M+H 279.195 0.0 1 OC1=C(C(C)=O)C(CCCCCCCCC)=CC(O)=C1 InChI=1S/C17H26O3/c1-3-4-5-6-7-8-9-10-14-11-15(19)12-16(20)17(14)13(2)18/h11-12,19-20H,3-10H2,1-2H3 JVLHSQZBYIOVOG-UHFFFAOYSA-N 3 Positive GNPS-LIBRARY 279.195 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C17H26O3 JVLHSQZBYIOVOG-UHFFFAOYSA-N JVLHSQZBYIOVOG N/A N/A N/A Aromatic polyketides Catechols with side chains Polyketides mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012475056 CCMSLIB00004699751 55 spectra_filtered.mgf MONA.mgf 0.762762 847000.0 0 815073.0 6 899.523 204.087 1 temp/spectra_filtered.mgf55 1 [3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 10-[3-acetamido-6-[[4,5-dihydroxy-3-(3,4,5-trihydroxyoxan-2-yl)oxyoxan-2-yl]oxymethyl]-4,5-dihydroxyoxan-2-yl]oxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate N/A ESI-QFT isolated MoNA MoNA:VF-NPL-QEHF008688 [M+NH4]+ 1103.61 0.0 1 N/A N/A CC(O)=NC1C(OC2CCC3(C)C(CCC4(C)C3CC=C3C5CC(C)(C)CCC5(C(=O)OC5OC(CO)C(O)C(O)C5O)CCC34C)C2(C)C)OC(COC2OCC(O)C(O)C2OC2OCC(O)C(O)C2O)C(O)C1O InChI=1S/C54H87NO21/c1-24(57)55-34-39(64)38(63)30(23-71-47-43(36(61)28(59)22-70-47)75-45-41(66)35(60)27(58)21-69-45)73-44(34)74-33-12-13-51(6)31(50(33,4)5)11-14-53(8)32(51)10-9-25-26-19-49(2,3)15-17-54(26,18-16-52(25,53)7)48(68)76-46-42(67)40(65)37(62)29(20-56)72-46/h9,26-47,56,58-67H,10-23H2,1-8H3,(H,55,57) N/A 3 positive MONA 1103.61 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C54H87NO21 NFMZRMNYRASNPY-UHFFFAOYSA-N NFMZRMNYRASNPY Lipids and lipid-like molecules Prenol lipids Terpene glycosides Triterpenoids Oleanane triterpenoids Terpenoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00004699751 CCMSLIB00003135029 790 spectra_filtered.mgf GNPS-NIST14-MATCHES.mgf 0.762038 7806400.0 0 2803.74 13 2.01459 716.522 1 temp/spectra_filtered.mgf790 1 Spectral Match to 1-Hexadecanoyl-2-(9Z-octadecenoyl)-sn-glycero-3-phosphoethanolamine from NIST14 ESI qTof Isolated Data from Piel, Dittmann Data deposited by eriche M+H 718.537 717.531 1 26662942 N/A CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)(O)OCCN)OC(=O)CCCCCCC/C=C\CCCCCCCC InChI=1S/C39H76NO8P/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-30-32-39(42)48-37(36-47-49(43,44)46-34-33-40)35-45-38(41)31-29-27-25-23-21-19-16-14-12-10-8-6-4-2/h17-18,37H,3-16,19-36,40H2,1-2H3,(H,43,44)/b18-17-/t37-/m1/s1 N/A 3 Positive GNPS-NIST14-MATCHES 718.537 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C39H76NO8P FHQVHHIBKUMWTI-OTMQOFQLSA-N FHQVHHIBKUMWTI Lipids and lipid-like molecules Glycerophospholipids Glycerophosphoethanolamines Glycerophospholipids Glycerophosphoethanolamines Fatty acids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00003135029 CCMSLIB00012311675 229 spectra_filtered.mgf MSNLIB-POSITIVE.mgf 0.758132 3224700.0 0 899490.0 6 162.032 342.17 1 temp/spectra_filtered.mgf229 1 Mexiletine ESI Orbitrap Crude Tomas Pluskal Corinna Brungs [M+H]+ 180.138 179.131 1 N/A N/A Cc1c(OCC(C)N)c(C)ccc1 InChI=1S/C11H17NO/c1-8-5-4-6-9(2)11(8)13-7-10(3)12/h4-6,10H,7,12H2,1-3H3 VLPIATFUUWWMKC-UHFFFAOYSA-N 1 Positive MSNLIB-POSITIVE 180.138 UPDATE-SINGLE-ANNOTATED-GOLD Gold C11H17NO VLPIATFUUWWMKC-UHFFFAOYSA-N VLPIATFUUWWMKC N/A N/A N/A Pseudoalkaloids Phenylalanine-derived alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012311675 CCMSLIB00004700245 414 spectra_filtered.mgf MONA.mgf 0.757374 9946000.0 0 356889.0 13 197.09 355.154 1 temp/spectra_filtered.mgf414 1 2-[4-[(3R,3aR,6S,6aR)-3-(3,4-dimethoxyphenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-6-yl]-2-methoxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol N/A ESI-QFT isolated MoNA MoNA:VF-NPL-QEHF009182 [M+NH4]+ 552.244 0.0 1 N/A N/A COc1ccc([C@@H]2OC[C@@H]3[C@@H](c4ccc(OC5OC(CO)C(O)C(O)C5O)c(OC)c4)OC[C@H]23)cc1OC InChI=1S/C27H34O11/c1-32-17-6-4-13(8-19(17)33-2)25-15-11-36-26(16(15)12-35-25)14-5-7-18(20(9-14)34-3)37-27-24(31)23(30)22(29)21(10-28)38-27/h4-9,15-16,21-31H,10-12H2,1-3H3/t15-,16-,21?,22?,23?,24?,25-,26+,27?/m0/s1 N/A 3 positive MONA 552.244 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C27H34O11 KFFCKOBAHMGTMW-NXTKOJRFSA-N KFFCKOBAHMGTMW N/A N/A N/A Lignans Furofuranoid lignans Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00004700245 CCMSLIB00005777275 850 spectra_filtered.mgf MASSBANK.mgf 0.756156 1976800.0 0 71688.5 11 40.9665 612.417 1 temp/spectra_filtered.mgf850 1 Massbank:MSJ00113 Lycopene-5,6-diol ESI qTof Isolated Massbank Massbank M+H 571.451 0.0 1 N/A N/A CC(=CCC/C(=C/C=C/C(=C/C=C/C(=C/C=C/C=C(\C)/C=C/C=C(\C)/C=C/C(C(C)(CCC=C(C)C)O)O)/C)/C)/C)C 1S/C40H58O2/c1-32(2)18-13-22-36(7)25-15-27-37(8)26-14-23-34(5)20-11-12-21-35(6)24-16-28-38(9)29-30-39(41)40(10,42)31-17-19-33(3)4/h11-12,14-16,18-21,23-30,39,41-42H,13,17,22,31H2,1-10H3/b12-11+,23-14+,24-16+,27-15+,30-29+,34-20+,35-21+,36-25+,37-26+,38-28+ N/A 3 Positive MASSBANK 571.451 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C40H58O2 BMVRDJXDSMPZGO-RGZXCSNFSA-N BMVRDJXDSMPZGO Lipids and lipid-like molecules Prenol lipids Tetraterpenoids Carotenoids (C40) Carotenoids (C40, Ψ-Ψ) Terpenoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00005777275 CCMSLIB00000849957 113 spectra_filtered.mgf GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE.mgf 0.755286 1841500.0 0 49780.6 6 17.9752 379.064 1 temp/spectra_filtered.mgf113 1 NCGC00384821-01_C16H18O8_Cyclohexanecarboxylic acid, 1,3,4-trihydroxy-5-[[(2E)-3-(4-hydroxyphenyl)-1-oxo-2-propen-1-yl]oxy]-, (1R,3R,4S,5R)- LC-ESI Maxis II HD Q-TOF Bruker isolated Jadhav/Dorrestein lfnothias M+Na 361.089 338.1 1 n/a n/a O[C@@H]1C[C@@](O)(C[C@@H](OC(=O)\C=C\C2=CC=C(O)C=C2)[C@H]1O)C(O)=O InChI=1S/C16H18O8/c17-10-4-1-9(2-5-10)3-6-13(19)24-12-8-16(23,15(21)22)7-11(18)14(12)20/h1-6,11-12,14,17-18,20,23H,7-8H2,(H,21,22)/b6-3+/t11-,12-,14+,16-/m1/s1 N/A 1 positive GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE 361.089 UPDATE-SINGLE-ANNOTATED-GOLD Gold C16H18O8 BMRSEYFENKXDIS-QHAYPTCMSA-N BMRSEYFENKXDIS Organic oxygen compounds Organooxygen compounds Alcohols and polyols Phenylpropanoids (C6-C3) Cinnamic acids and derivatives Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00000849957 CCMSLIB00010121499 520 spectra_filtered.mgf BERKELEY-LAB.mgf 0.751886 11623200.0 0 0.0 12 0.0 369.17 1 temp/spectra_filtered.mgf520 1 """4-[(1R,5R)-6-(3,4-dimethoxyphenyl)-3,7-dioxabicyclo[3.3.0]oct-2-yl]-1,2-dimeth oxybenzene CollisionEnergy:205060""" LC-ESI Orbitrap Commercial Trent Northen JGI M+H-H2O 369.17 0.0 1 N/A N/A COc1ccc(C2OCC3C(c4ccc(OC)c(OC)c4)OCC23)cc1OC """InChI=1S/C22H26O6/c1-23-17-7-5-13(9-19(17)25-3)21-15-11-28-22(16(15)12-27-21)14-6-8-18(24-2)20(10-14)26-4/h5-10,15-16,21-22H,11-12H2,1-4H3/t15-,16-,21?,22?/m0/s1""" N/A 3 Positive BERKELEY-LAB 369.17 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C22H26O6 PEUUVVGQIVMSAW-UHFFFAOYSA-N PEUUVVGQIVMSAW N/A N/A N/A Lignans Furofuranoid lignans Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00010121499 CCMSLIB00012443642 846 spectra_filtered.mgf MSNLIB-POSITIVE.mgf 0.751057 2824300.0 0 145886.0 9 78.0966 613.424 1 temp/spectra_filtered.mgf846 1 CHEBI:181879 ESI Orbitrap Crude Tomas Pluskal Corinna Brungs [M+H]+ 535.327 534.319 1 N/A N/A CC1(CO)CC(O)[C@]2(C(=O)O)CCC34CC3(C=CC3[C@]5(C)C(CC[C@]34C)C(C)(CO)[C@@H](O)[C@H](O)[C@@H]5O)C2C1 InChI=1S/C30H46O8/c1-24(14-31)11-18-28-8-6-17-26(3,29(28,13-28)9-10-30(18,23(37)38)19(33)12-24)7-5-16-25(2,15-32)21(35)20(34)22(36)27(16,17)4/h6,8,16-22,31-36H,5,7,9-15H2,1-4H3,(H,37,38)/t16?,17?,18?,19?,20-,21-,22-,24?,25?,26+,27-,28?,29?,30-/m0/s1 IXIMDUAPYHOVHL-QQQCTMDWSA-N 1 Positive MSNLIB-POSITIVE 535.327 UPDATE-SINGLE-ANNOTATED-GOLD Gold C30H46O8 IXIMDUAPYHOVHL-QQQCTMDWSA-N IXIMDUAPYHOVHL Lipids and lipid-like molecules Prenol lipids Sesterterpenoids Triterpenoids Oleanane triterpenoids Terpenoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012443642 CCMSLIB00000853579 847 spectra_filtered.mgf GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE.mgf 0.746441 662400.0 0 633698.0 8 244.147 629.42 1 temp/spectra_filtered.mgf847 1 NCGC00381199-01_C25H38O4_(3aR,5E,7S,10E,14E,16aS)-2,7-Dihydroxy-3-[(2S)-1-hydroxy-2-propanyl]-6,10,14,16a-tetramethyl-4,7,8,9,12,13,16,16a-octahydrocyclopenta[15]annulen-1(3aH)-one LC-ESI Maxis II HD Q-TOF Bruker isolated Jadhav/Dorrestein lfnothias M-H2O+H 385.273 402.277 1 n/a n/a C[C@H](CO)C/1=C(O)/C(=O)[C@@]2(C)C/C=C(C)/CC/C=C(C)/CC[C@H](O)/C(=C/C[C@H]12)C InChI=1S/C25H38O4/c1-16-7-6-8-17(2)13-14-25(5)20(11-10-18(3)21(27)12-9-16)22(19(4)15-26)23(28)24(25)29/h7,10,13,19-21,26-28H,6,8-9,11-12,14-15H2,1-5H3/b16-7+,17-13+,18-10+/t19-,20-,21+,25+/m1/s1 N/A 1 positive GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE 385.273 UPDATE-SINGLE-ANNOTATED-GOLD Gold C25H38O4 UTGBBPSEQPITLF-IXRUDUFRSA-N UTGBBPSEQPITLF Organic oxygen compounds Organooxygen compounds Alcohols and polyols Diterpenoids Cembrane diterpenoids|Dolabellane diterpenoids Terpenoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00000853579 CCMSLIB00000851023 248 spectra_filtered.mgf GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE.mgf 0.745846 7142400.0 0 326742.0 6 133.035 540.19 1 temp/spectra_filtered.mgf248 1 NCGC00169057-02_C17H26O11_Methyl (1S,4aS,5R,7S,7aS)-1-(beta-D-glucopyranosyloxy)-5,7-dihydroxy-7-methyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylate LC-ESI Maxis II HD Q-TOF Bruker isolated Jadhav/Dorrestein lfnothias M+H 407.155 406.148 1 n/a n/a COC(=O)\C1=C\O[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]3[C@@H]1[C@H](O)C[C@]3(C)O InChI=1S/C17H26O11/c1-17(24)3-7(19)9-6(14(23)25-2)5-26-15(10(9)17)28-16-13(22)12(21)11(20)8(4-18)27-16/h5,7-13,15-16,18-22,24H,3-4H2,1-2H3/t7-,8-,9+,10-,11-,12+,13-,15+,16+,17+/m1/s1 N/A 1 positive GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE 407.155 UPDATE-SINGLE-ANNOTATED-GOLD Gold C17H26O11 KKSYAZCUYVRKML-IRDZEPHTSA-N KKSYAZCUYVRKML Lipids and lipid-like molecules Prenol lipids Terpene glycosides Monoterpenoids Iridoids monoterpenoids Terpenoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00000851023 CCMSLIB00005777311 729 spectra_filtered.mgf MASSBANK.mgf 0.742282 6661000.0 0 26319.9 7 14.9875 584.422 1 temp/spectra_filtered.mgf729 1 Massbank:MSJ00118 Zeaxanthin ESI qTof Isolated Massbank Massbank M+H 569.435 0.0 1 N/A N/A CC1=C(C(C[C@@H](C1)O)(C)C)/C=C/C(=C/C=C/C(=C/C=C/C=C(/C=C/C=C(/C=C/C2=C(C[C@H](CC2(C)C)O)C)\C)\C)/C)/C 1S/C40H56O2/c1-29(17-13-19-31(3)21-23-37-33(5)25-35(41)27-39(37,7)8)15-11-12-16-30(2)18-14-20-32(4)22-24-38-34(6)26-36(42)28-40(38,9)10/h11-24,35-36,41-42H,25-28H2,1-10H3/b12-11+,17-13+,18-14+,23-21+,24-22+,29-15+,30-16+,31-19+,32-20+/t35-,36-/m1/s1 N/A 3 Positive MASSBANK 569.435 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C40H56O2 JKQXZKUSFCKOGQ-QAYBQHTQSA-N JKQXZKUSFCKOGQ Lipids and lipid-like molecules Prenol lipids Tetraterpenoids Carotenoids (C40) Carotenoids (C40, β-β) Terpenoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00005777311 CCMSLIB00012355195 817 spectra_filtered.mgf MSNLIB-POSITIVE.mgf 0.740895 6436500.0 0 885674.0 7 387.28 824.552 1 temp/spectra_filtered.mgf817 1 INT-767 ESI Orbitrap Crude Tomas Pluskal Corinna Brungs [M+H-2H2O]+ 437.272 472.286 1 N/A N/A CC[C@H]1[C@@H](O)[C@@H]2[C@H](CC[C@]3(C)[C@@H]([C@H](C)CCOS(=O)(=O)O)CC[C@@H]23)[C@@]2(C)CC[C@@H](O)C[C@@H]12 InChI=1S/C25H44O6S/c1-5-17-21-14-16(26)8-11-25(21,4)20-9-12-24(3)18(6-7-19(24)22(20)23(17)27)15(2)10-13-31-32(28,29)30/h15-23,26-27H,5-14H2,1-4H3,(H,28,29,30)/t15-,16-,17-,18-,19+,20+,21+,22+,23-,24-,25-/m1/s1 XGIYOABXZNJOHV-APIYUPOTSA-N 1 Positive MSNLIB-POSITIVE 437.272 UPDATE-SINGLE-ANNOTATED-GOLD Gold C25H44O6S XGIYOABXZNJOHV-APIYUPOTSA-N XGIYOABXZNJOHV Lipids and lipid-like molecules Steroids and steroid derivatives Bile acids, alcohols and derivatives Steroids Cholestane steroids Terpenoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012355195 CCMSLIB00000080140 473 spectra_filtered.mgf GNPS-NIH-NATURALPRODUCTSLIBRARY.mgf 0.737758 2076900.0 0 169.342 6 0.0371094 219.102 1 temp/spectra_filtered.mgf473 1 """MLS002473104-01!(2R)-6-(2-hydroxyethyl)-2,5,7-trimethyl-2,3-dihydroinden-1-one""" LC-ESI qTof NIH Natural Product Library Dorrestein VVP/LMS M+H 219.139 218.131 1 N/A N/A C[C@@H]1Cc2cc(C)c(CCO)c(C)c2C1=O InChI=1S/C14H18O2/c1-8-6-11-7-9(2)14(16)13(11)10(3)12(8)4-5-15/h6,9,15H,4-5,7H2,1-3H3/t9-/m1/s1 N/A 1 Positive GNPS-NIH-NATURALPRODUCTSLIBRARY 219.139 UPDATE-SINGLE-ANNOTATED-GOLD Gold C14H18O2 SJNCSXMTBXDZQA-SECBINFHSA-N SJNCSXMTBXDZQA Benzenoids Indanes Indanones Sesquiterpenoids Illudalane sesquiterpenoids Terpenoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00000080140 CCMSLIB00012417104 587 spectra_filtered.mgf MSNLIB-POSITIVE.mgf 0.736191 1330000.0 0 120611.0 6 38.0043 353.102 1 temp/spectra_filtered.mgf587 1 N-(3,5-dioxo-10-oxa-4-azatricyclo[5.2.1.0~2,6~]dec-8-en-4-yl)-2-methoxybenzamide ESI Orbitrap Crude Tomas Pluskal Corinna Brungs [M+H]+ 315.098 314.09 1 N/A N/A COc1ccccc1C(=O)NN1C(=O)C2C3C=CC(O3)C2C1=O InChI=1S/C16H14N2O5/c1-22-9-5-3-2-4-8(9)14(19)17-18-15(20)12-10-6-7-11(23-10)13(12)16(18)21/h2-7,10-13H,1H3,(H,17,19) DUDMCOLAOVMIEZ-UHFFFAOYSA-N 1 Positive MSNLIB-POSITIVE 315.098 UPDATE-SINGLE-ANNOTATED-GOLD Gold C16H14N2O5 DUDMCOLAOVMIEZ-UHFFFAOYSA-N DUDMCOLAOVMIEZ Organoheterocyclic compounds Isoindoles and derivatives Isoindolines mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012417104 CCMSLIB00003135917 768 spectra_filtered.mgf GNPS-NIST14-MATCHES.mgf 0.735811 7001900.0 0 1701260.0 8 519.305 824.552 1 temp/spectra_filtered.mgf768 1 Spectral Match to Stearidonic acid ethyl ester from NIST14 ESI qTof Isolated Data from Wolfender/Litaudon Data deposited by pmallard M+H 305.247 304.24 1 119798446 N/A CCC=CCC=CCC=CCC=CCCCCC(=O)OCC InChI=1S/C20H32O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22-4-2/h5-6,8-9,11-12,14-15H,3-4,7,10,13,16-19H2,1-2H3 N/A 3 Positive GNPS-NIST14-MATCHES 305.247 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C20H32O2 RIDOSNBWMUADGT-UHFFFAOYSA-N RIDOSNBWMUADGT Lipids and lipid-like molecules Fatty Acyls Lineolic acids and derivatives Fatty esters Wax monoesters Fatty acids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00003135917 CCMSLIB00012717563 892 spectra_filtered.mgf GNPS-N-ACYL-LIPIDS-MASSQL.mgf 0.734632 8330600.0 0 1188230.0 6 435.248 801.549 1 temp/spectra_filtered.mgf892 1 Candidate GABA-C18:2 (delta mass:262.2306) LC-ESI Orbitrap Crude Pieter Dorrestein helenamrusso M+H 366.301 366.301 0 N/A N/A N/A N/A N/A 4 Positive GNPS-N-ACYL-LIPIDS-MASSQL 366.301 UPDATE-SINGLE-ANNOTATED-BRONZE Insilico N/A N/A N/A N/A N/A N/A N/A N/A N/A mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012717563 CCMSLIB00004698741 375 spectra_filtered.mgf MONA.mgf 0.734495 10979000.0 0 5027.7 10 2.01691 403.176 1 temp/spectra_filtered.mgf375 1 6-[3-(3,4-dimethoxyphenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-6-yl]-4-methoxy-1,3-benzodioxole N/A ESI-QFT isolated MoNA MoNA:VF-NPL-QEHF007678 [M+H]+ 401.159 0.0 1 N/A N/A COc1ccc(C2OCC3C(c4cc(OC)c5c(c4)OCO5)OCC23)cc1OC InChI=1S/C22H24O7/c1-23-16-5-4-12(6-17(16)24-2)20-14-9-27-21(15(14)10-26-20)13-7-18(25-3)22-19(8-13)28-11-29-22/h4-8,14-15,20-21H,9-11H2,1-3H3 N/A 3 positive MONA 401.159 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C22H24O7 UTPBMRNHPNUBLT-UHFFFAOYSA-N UTPBMRNHPNUBLT N/A N/A N/A Lignans Furofuranoid lignans Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00004698741 CCMSLIB00005436047 126 spectra_filtered.mgf GNPS-LIBRARY.mgf 0.732991 2379600.0 0 6028.53 9 1.97852 330.171 1 temp/spectra_filtered.mgf126 1 O-methylarmepavine LC-ESI qTof Crude KOOLEN/ANGOLINI ANGOLINI M+H 328.192 327.183 1 [H][C@@]1(CC2=CC=C(OC)C=C2)C3=CC(OC)=C(OC)C=C3CCN1C InChI=1S/C20H25NO3/c1-21-10-9-15-12-19(23-3)20(24-4)13-17(15)18(21)11-14-5-7-16(22-2)8-6-14/h5-8,12-13,18H,9-11H2,1-4H3/t18-/m1/s1 3 Positive GNPS-LIBRARY 328.192 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C20H25NO3 LZJWNVLTWYMMDJ-GOSISDBHSA-N LZJWNVLTWYMMDJ Organoheterocyclic compounds Isoquinolines and derivatives Benzylisoquinolines Tyrosine alkaloids Isoquinoline alkaloids|Tetrahydroisoquinoline alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00005436047 CCMSLIB00000851023 241 spectra_filtered.mgf GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE.mgf 0.732409 8384600.0 0 361077.0 7 147.014 554.169 1 temp/spectra_filtered.mgf241 1 NCGC00169057-02_C17H26O11_Methyl (1S,4aS,5R,7S,7aS)-1-(beta-D-glucopyranosyloxy)-5,7-dihydroxy-7-methyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylate LC-ESI Maxis II HD Q-TOF Bruker isolated Jadhav/Dorrestein lfnothias M+H 407.155 406.148 1 n/a n/a COC(=O)\C1=C\O[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]3[C@@H]1[C@H](O)C[C@]3(C)O InChI=1S/C17H26O11/c1-17(24)3-7(19)9-6(14(23)25-2)5-26-15(10(9)17)28-16-13(22)12(21)11(20)8(4-18)27-16/h5,7-13,15-16,18-22,24H,3-4H2,1-2H3/t7-,8-,9+,10-,11-,12+,13-,15+,16+,17+/m1/s1 N/A 1 positive GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE 407.155 UPDATE-SINGLE-ANNOTATED-GOLD Gold C17H26O11 KKSYAZCUYVRKML-IRDZEPHTSA-N KKSYAZCUYVRKML Lipids and lipid-like molecules Prenol lipids Terpene glycosides Monoterpenoids Iridoids monoterpenoids Terpenoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00000851023 CCMSLIB00000847762 366 spectra_filtered.mgf GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE.mgf 0.731117 3160100.0 0 2.59429 8 0.00088501 341.139 1 temp/spectra_filtered.mgf366 1 NCGC00347864-02!5-[6-(3-hydroxy-4-methoxyphenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-3-yl]-2-methoxyphenol LC-ESI Maxis II HD Q-TOF Bruker isolated Jadhav/Dorrestein lfnothias M-H2O+H 341.138 358.142 1 n/a n/a COC1=CC=C(C=C1O)C2OCC3C2COC3C4=CC=C(OC)C(O)=C4 InChI=1S/C20H22O6/c1-23-17-5-3-11(7-15(17)21)19-13-9-26-20(14(13)10-25-19)12-4-6-18(24-2)16(22)8-12/h3-8,13-14,19-22H,9-10H2,1-2H3 N/A 1 positive GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE 341.138 UPDATE-SINGLE-ANNOTATED-GOLD Gold C20H22O6 VRHZMFGDDGFRLP-UHFFFAOYSA-N VRHZMFGDDGFRLP N/A N/A N/A Lignans Furofuranoid lignans Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00000847762 CCMSLIB00000848177 296 spectra_filtered.mgf GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE.mgf 0.729431 596500.0 0 198500.0 6 75.068 303.108 1 temp/spectra_filtered.mgf296 1 NCGC00169586-02!7-methyl-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylic acid LC-ESI Maxis II HD Q-TOF Bruker isolated Jadhav/Dorrestein lfnothias M+NH4 378.176 360.142 1 n/a n/a CC1CCC2C1C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)OC=C2C(O)=O InChI=1S/C16H24O9/c1-6-2-3-7-8(14(21)22)5-23-15(10(6)7)25-16-13(20)12(19)11(18)9(4-17)24-16/h5-7,9-13,15-20H,2-4H2,1H3,(H,21,22)/t6?,7?,9-,10?,11-,12+,13-,15?,16+/m1/s1 N/A 1 positive GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE 378.176 UPDATE-SINGLE-ANNOTATED-GOLD Gold C16H24O9 DSXFHNSGLYXPNG-WUBGXZNDSA-N DSXFHNSGLYXPNG Lipids and lipid-like molecules Prenol lipids Terpene glycosides Monoterpenoids Iridoids monoterpenoids Terpenoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00000848177 CCMSLIB00004713749 849 spectra_filtered.mgf MONA.mgf 0.728236 872400.0 0 489052.0 8 542.138 566.412 1 temp/spectra_filtered.mgf849 1 (2S,3S,4S,5R,6R)-6-[[(3S,4S,6aR,6bS,8R,8aR,9R,10R,12aS,14bR)-10-acetyloxy-8a-(acetyloxymethyl)-8,9-dihydroxy-4-(hydroxymethyl)-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-4-hydroxy-3,5-bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]oxane-2-carboxylic acid N/A ESI-QFT isolated MoNA MoNA:VF-NPL-QEHF022686 [M+NH4]+ 1108.55 0.0 1 N/A N/A CC(=O)OC[C@@]12[C@@H](CC(C)(C)[C@@H](OC(C)=O)[C@@H]1O)C1=CCC3[C@@]4(C)CC[C@H](O[C@@H]5O[C@H](C(=O)O)[C@@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@H](O)[C@H]5O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@](C)(CO)C4CC[C@@]3(C)[C@]1(C)C[C@H]2O InChI=1S/C52H82O24/c1-21(56)69-20-52-24(15-47(3,4)42(41(52)66)70-22(2)57)23-9-10-28-48(5)13-12-30(49(6,19-55)27(48)11-14-50(28,7)51(23,8)16-29(52)58)73-46-39(75-45-36(64)34(62)32(60)26(18-54)72-45)37(65)38(40(76-46)43(67)68)74-44-35(63)33(61)31(59)25(17-53)71-44/h9,24-42,44-46,53-55,58-66H,10-20H2,1-8H3,(H,67,68)/t24-,25+,26+,27?,28?,29+,30-,31+,32+,33-,34-,35+,36+,37-,38-,39+,40-,41-,42-,44-,45-,46+,48-,49+,50+,51+,52-/m0/s1 N/A 3 positive MONA 1108.55 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C52H82O24 CJFSVYYGNWQUMQ-DBWNCVFDSA-N CJFSVYYGNWQUMQ Lipids and lipid-like molecules Prenol lipids Terpene glycosides Triterpenoids Oleanane triterpenoids Terpenoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00004713749 CCMSLIB00000853579 870 spectra_filtered.mgf GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE.mgf 0.726392 821100.0 0 472774.0 8 182.147 567.42 1 temp/spectra_filtered.mgf870 1 NCGC00381199-01_C25H38O4_(3aR,5E,7S,10E,14E,16aS)-2,7-Dihydroxy-3-[(2S)-1-hydroxy-2-propanyl]-6,10,14,16a-tetramethyl-4,7,8,9,12,13,16,16a-octahydrocyclopenta[15]annulen-1(3aH)-one LC-ESI Maxis II HD Q-TOF Bruker isolated Jadhav/Dorrestein lfnothias M-H2O+H 385.273 402.277 1 n/a n/a C[C@H](CO)C/1=C(O)/C(=O)[C@@]2(C)C/C=C(C)/CC/C=C(C)/CC[C@H](O)/C(=C/C[C@H]12)C InChI=1S/C25H38O4/c1-16-7-6-8-17(2)13-14-25(5)20(11-10-18(3)21(27)12-9-16)22(19(4)15-26)23(28)24(25)29/h7,10,13,19-21,26-28H,6,8-9,11-12,14-15H2,1-5H3/b16-7+,17-13+,18-10+/t19-,20-,21+,25+/m1/s1 N/A 1 positive GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE 385.273 UPDATE-SINGLE-ANNOTATED-GOLD Gold C25H38O4 UTGBBPSEQPITLF-IXRUDUFRSA-N UTGBBPSEQPITLF Organic oxygen compounds Organooxygen compounds Alcohols and polyols Diterpenoids Cembrane diterpenoids|Dolabellane diterpenoids Terpenoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00000853579 CCMSLIB00012261903 528 spectra_filtered.mgf CMMC-REFRAME-POSITIVE-LIBRARY.mgf 0.725608 120276000.0 0 689302.0 7 131.027 321.113 1 temp/spectra_filtered.mgf528 1 hydrastinine LC-ESI Orbitrap Commercial Pieter C. Dorrestein Nina Haoqi Zhao [M-H2O+H]+ 190.086 207.09 1 N/A N/A CN1CCc2cc3c(cc2C1O)OCO3 """InChI=1S/C11H13NO3/c1-12-3-2-7-4-9-10(15-6-14-9)5-8(7)11(12)13/h4-5,11,13H,2-3,6H2,1H3""" YOJQZPVUNUQTDF-UHFFFAOYSA-N 1 Positive PRIVATE-LIB 190.086 UPDATE-SINGLE-ANNOTATED-GOLD Gold C11H13NO3 YOJQZPVUNUQTDF-UHFFFAOYSA-N YOJQZPVUNUQTDF N/A N/A N/A Tyrosine alkaloids Isoquinoline alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012261903 CCMSLIB00012435189 886 spectra_filtered.mgf MSNLIB-POSITIVE.mgf 0.725386 19645900.0 0 530841.0 6 481.221 425.306 1 temp/spectra_filtered.mgf886 1 NCGC00380368-01!methyl 3,15,21-tris[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]docosanoate ESI Orbitrap Crude Tomas Pluskal Corinna Brungs [M+NH4]+ 906.527 888.493 1 N/A N/A COC(=O)CC(CCCCCCCCCCCC(CCCCCC(C)OC1OC(CO)C(O)C(O)C1O)OC1OC(CO)C(O)C(O)C1O)OC1OC(CO)C(O)C(O)C1O InChI=1S/C41H76O20/c1-23(56-39-36(52)33(49)30(46)26(20-42)59-39)15-11-10-14-17-24(57-40-37(53)34(50)31(47)27(21-43)60-40)16-12-8-6-4-3-5-7-9-13-18-25(19-29(45)55-2)58-41-38(54)35(51)32(48)28(22-44)61-41/h23-28,30-44,46-54H,3-22H2,1-2H3 BKEFKSNTAPNAHR-UHFFFAOYSA-N 1 Positive MSNLIB-POSITIVE 906.527 UPDATE-SINGLE-ANNOTATED-GOLD Gold C41H76O20 BKEFKSNTAPNAHR-UHFFFAOYSA-N BKEFKSNTAPNAHR Lipids and lipid-like molecules Fatty Acyls Fatty acyl glycosides Fatty acyl glycosides Sophorolipids Fatty acids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012435189 CCMSLIB00004700244 246 spectra_filtered.mgf MONA.mgf 0.725204 1199200.0 0 324276.0 10 179.079 373.165 1 temp/spectra_filtered.mgf246 1 2-[4-[(3R,3aR,6S,6aR)-3-(3,4-dimethoxyphenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-6-yl]-2-methoxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol N/A ESI-QFT isolated MoNA MoNA:VF-NPL-QEHF009181 [M+NH4]+ 552.244 0.0 1 N/A N/A COc1ccc([C@@H]2OC[C@@H]3[C@@H](c4ccc(OC5OC(CO)C(O)C(O)C5O)c(OC)c4)OC[C@H]23)cc1OC InChI=1S/C27H34O11/c1-32-17-6-4-13(8-19(17)33-2)25-15-11-36-26(16(15)12-35-25)14-5-7-18(20(9-14)34-3)37-27-24(31)23(30)22(29)21(10-28)38-27/h4-9,15-16,21-31H,10-12H2,1-3H3/t15-,16-,21?,22?,23?,24?,25-,26+,27?/m0/s1 N/A 3 positive MONA 552.244 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C27H34O11 KFFCKOBAHMGTMW-NXTKOJRFSA-N KFFCKOBAHMGTMW N/A N/A N/A Lignans Furofuranoid lignans Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00004700244 CCMSLIB00012310125 79 spectra_filtered.mgf MSNLIB-POSITIVE.mgf 0.724086 7209000.0 0 409515.0 7 154.005 222.061 1 temp/spectra_filtered.mgf79 1 2479-49-4 ESI Orbitrap Crude Tomas Pluskal Corinna Brungs [M+NH4]+ 376.066 358.032 1 N/A N/A O=C(c1cc(C(=O)O)c(C(=O)O)cc1)c1cc(C(=O)O)c(C(=O)O)cc1 InChI=1S/C17H10O9/c18-13(7-1-3-9(14(19)20)11(5-7)16(23)24)8-2-4-10(15(21)22)12(6-8)17(25)26/h1-6H,(H,19,20)(H,21,22)(H,23,24)(H,25,26) UITKHKNFVCYWNG-UHFFFAOYSA-N 1 Positive MSNLIB-POSITIVE 376.066 UPDATE-SINGLE-ANNOTATED-GOLD Gold C17H10O9 UITKHKNFVCYWNG-UHFFFAOYSA-N UITKHKNFVCYWNG Benzenoids Benzene and substituted derivatives Benzophenones Phenolic acids (C6-C1) Simple phenolic acids Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012310125 CCMSLIB00004713752 658 spectra_filtered.mgf MONA.mgf 0.723653 10257900.0 0 625046.0 7 682.256 409.274 1 temp/spectra_filtered.mgf658 1 (2S,3S,4S,5R,6R)-6-[[(3S,4S,6aR,6bS,8R,8aR,9R,10R,12aS,14bR)-10-acetyloxy-8a-(acetyloxymethyl)-8,9-dihydroxy-4-(hydroxymethyl)-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-4-hydroxy-3,5-bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]oxane-2-carboxylic acid N/A ESI-QFT isolated MoNA MoNA:VF-NPL-QEHF022689 [M+H]+ 1091.53 0.0 1 N/A N/A CC(=O)OC[C@@]12[C@@H](CC(C)(C)[C@@H](OC(C)=O)[C@@H]1O)C1=CCC3[C@@]4(C)CC[C@H](O[C@@H]5O[C@H](C(=O)O)[C@@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@H](O)[C@H]5O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@](C)(CO)C4CC[C@@]3(C)[C@]1(C)C[C@H]2O InChI=1S/C52H82O24/c1-21(56)69-20-52-24(15-47(3,4)42(41(52)66)70-22(2)57)23-9-10-28-48(5)13-12-30(49(6,19-55)27(48)11-14-50(28,7)51(23,8)16-29(52)58)73-46-39(75-45-36(64)34(62)32(60)26(18-54)72-45)37(65)38(40(76-46)43(67)68)74-44-35(63)33(61)31(59)25(17-53)71-44/h9,24-42,44-46,53-55,58-66H,10-20H2,1-8H3,(H,67,68)/t24-,25+,26+,27?,28?,29+,30-,31+,32+,33-,34-,35+,36+,37-,38-,39+,40-,41-,42-,44-,45-,46+,48-,49+,50+,51+,52-/m0/s1 N/A 3 positive MONA 1091.53 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C52H82O24 CJFSVYYGNWQUMQ-DBWNCVFDSA-N CJFSVYYGNWQUMQ Lipids and lipid-like molecules Prenol lipids Terpene glycosides Triterpenoids Oleanane triterpenoids Terpenoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00004713752 CCMSLIB00012443642 469 spectra_filtered.mgf MSNLIB-POSITIVE.mgf 0.722963 1227000.0 0 239234.0 8 128.068 407.259 1 temp/spectra_filtered.mgf469 1 CHEBI:181879 ESI Orbitrap Crude Tomas Pluskal Corinna Brungs [M+H]+ 535.327 534.319 1 N/A N/A CC1(CO)CC(O)[C@]2(C(=O)O)CCC34CC3(C=CC3[C@]5(C)C(CC[C@]34C)C(C)(CO)[C@@H](O)[C@H](O)[C@@H]5O)C2C1 InChI=1S/C30H46O8/c1-24(14-31)11-18-28-8-6-17-26(3,29(28,13-28)9-10-30(18,23(37)38)19(33)12-24)7-5-16-25(2,15-32)21(35)20(34)22(36)27(16,17)4/h6,8,16-22,31-36H,5,7,9-15H2,1-4H3,(H,37,38)/t16?,17?,18?,19?,20-,21-,22-,24?,25?,26+,27-,28?,29?,30-/m0/s1 IXIMDUAPYHOVHL-QQQCTMDWSA-N 1 Positive MSNLIB-POSITIVE 535.327 UPDATE-SINGLE-ANNOTATED-GOLD Gold C30H46O8 IXIMDUAPYHOVHL-QQQCTMDWSA-N IXIMDUAPYHOVHL Lipids and lipid-like molecules Prenol lipids Sesterterpenoids Triterpenoids Oleanane triterpenoids Terpenoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012443642 CCMSLIB00005743823 383 spectra_filtered.mgf MASSBANK.mgf 0.722706 3162700.0 0 367542.0 6 116.927 435.061 1 temp/spectra_filtered.mgf383 1 Massbank:PR310505 Piperlongumine ESI qTof Isolated Massbank Massbank M+H 318.134 0.0 1 N/A N/A COC1=CC(C=CC(=O)N2CCC=CC2=O)=CC(OC)=C1OC 1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3 N/A 3 Positive MASSBANK 318.134 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C17H19NO5 VABYUUZNAVQNPG-UHFFFAOYSA-N VABYUUZNAVQNPG N/A N/A N/A Lysine alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00005743823 CCMSLIB00005743823 426 spectra_filtered.mgf MASSBANK.mgf 0.722303 13474300.0 0 367542.0 7 116.927 435.061 1 temp/spectra_filtered.mgf426 1 Massbank:PR310505 Piperlongumine ESI qTof Isolated Massbank Massbank M+H 318.134 0.0 1 N/A N/A COC1=CC(C=CC(=O)N2CCC=CC2=O)=CC(OC)=C1OC 1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3 N/A 3 Positive MASSBANK 318.134 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C17H19NO5 VABYUUZNAVQNPG-UHFFFAOYSA-N VABYUUZNAVQNPG N/A N/A N/A Lysine alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00005743823 CCMSLIB00004713749 895 spectra_filtered.mgf MONA.mgf 0.722061 581300.0 0 489052.0 9 542.138 566.412 1 temp/spectra_filtered.mgf895 1 (2S,3S,4S,5R,6R)-6-[[(3S,4S,6aR,6bS,8R,8aR,9R,10R,12aS,14bR)-10-acetyloxy-8a-(acetyloxymethyl)-8,9-dihydroxy-4-(hydroxymethyl)-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-4-hydroxy-3,5-bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]oxane-2-carboxylic acid N/A ESI-QFT isolated MoNA MoNA:VF-NPL-QEHF022686 [M+NH4]+ 1108.55 0.0 1 N/A N/A CC(=O)OC[C@@]12[C@@H](CC(C)(C)[C@@H](OC(C)=O)[C@@H]1O)C1=CCC3[C@@]4(C)CC[C@H](O[C@@H]5O[C@H](C(=O)O)[C@@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@H](O)[C@H]5O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@](C)(CO)C4CC[C@@]3(C)[C@]1(C)C[C@H]2O InChI=1S/C52H82O24/c1-21(56)69-20-52-24(15-47(3,4)42(41(52)66)70-22(2)57)23-9-10-28-48(5)13-12-30(49(6,19-55)27(48)11-14-50(28,7)51(23,8)16-29(52)58)73-46-39(75-45-36(64)34(62)32(60)26(18-54)72-45)37(65)38(40(76-46)43(67)68)74-44-35(63)33(61)31(59)25(17-53)71-44/h9,24-42,44-46,53-55,58-66H,10-20H2,1-8H3,(H,67,68)/t24-,25+,26+,27?,28?,29+,30-,31+,32+,33-,34-,35+,36+,37-,38-,39+,40-,41-,42-,44-,45-,46+,48-,49+,50+,51+,52-/m0/s1 N/A 3 positive MONA 1108.55 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C52H82O24 CJFSVYYGNWQUMQ-DBWNCVFDSA-N CJFSVYYGNWQUMQ Lipids and lipid-like molecules Prenol lipids Terpene glycosides Triterpenoids Oleanane triterpenoids Terpenoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00004713749 CCMSLIB00003138718 826 spectra_filtered.mgf GNPS-NIST14-MATCHES.mgf 0.717752 3050400.0 0 845867.0 9 280.205 611.468 1 temp/spectra_filtered.mgf826 1 Spectral Match to Eicosapentaenoic acid ethyl ester from NIST14 ESI qTof Isolated Data from Piel, Dittmann Data deposited by eriche M+H 331.263 330.256 1 86227476 N/A CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)OCC InChI=1S/C22H34O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24-4-2/h5-6,8-9,11-12,14-15,17-18H,3-4,7,10,13,16,19-21H2,1-2H3/b6-5-,9-8-,12-11-,15-14-,18-17- N/A 3 Positive GNPS-NIST14-MATCHES 331.263 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C22H34O2 SSQPWTVBQMWLSZ-AAQCHOMXSA-N SSQPWTVBQMWLSZ Lipids and lipid-like molecules Fatty Acyls Fatty acid esters Fatty esters Wax monoesters Fatty acids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00003138718 CCMSLIB00012432214 843 spectra_filtered.mgf MSNLIB-POSITIVE.mgf 0.717043 5878500.0 0 169447.0 7 119.027 583.415 1 temp/spectra_filtered.mgf843 1 CHEBI:181245 ESI Orbitrap Crude Tomas Pluskal Corinna Brungs [M+NH4]+ 702.442 684.408 1 N/A N/A CC(CC(O)C(O)C(C)(C)O)C1CCC2(C)C3CCC4C(C)(C(=O)OC5OC(CO)C(O)C(O)C5O)C(O)CC(O)C45CC35CCC12C InChI=1S/C36H60O12/c1-17(13-19(38)28(44)31(2,3)46)18-9-10-33(5)21-7-8-22-34(6,30(45)48-29-27(43)26(42)25(41)20(15-37)47-29)23(39)14-24(40)36(22)16-35(21,36)12-11-32(18,33)4/h17-29,37-44,46H,7-16H2,1-6H3 RCCBGOMNZWYBTJ-UHFFFAOYSA-N 1 Positive MSNLIB-POSITIVE 702.442 UPDATE-SINGLE-ANNOTATED-GOLD Gold C36H60O12 RCCBGOMNZWYBTJ-UHFFFAOYSA-N RCCBGOMNZWYBTJ Lipids and lipid-like molecules Prenol lipids Terpene glycosides Triterpenoids Cycloartane triterpenoids Terpenoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012432214 CCMSLIB00010121500 327 spectra_filtered.mgf BERKELEY-LAB.mgf 0.717027 14889000.0 0 46515.8 10 18.01 369.17 1 temp/spectra_filtered.mgf327 1 """4-[(1R,5R)-6-(3,4-dimethoxyphenyl)-3,7-dioxabicyclo[3.3.0]oct-2-yl]-1,2-dimeth oxybenzene CollisionEnergy:205060""" LC-ESI Orbitrap Commercial Trent Northen JGI M+H 387.18 0.0 1 N/A N/A COc1ccc(C2OCC3C(c4ccc(OC)c(OC)c4)OCC23)cc1OC """InChI=1S/C22H26O6/c1-23-17-7-5-13(9-19(17)25-3)21-15-11-28-22(16(15)12-27-21)14-6-8-18(24-2)20(10-14)26-4/h5-10,15-16,21-22H,11-12H2,1-4H3/t15-,16-,21?,22?/m0/s1""" N/A 3 Positive BERKELEY-LAB 387.18 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C22H26O6 PEUUVVGQIVMSAW-UHFFFAOYSA-N PEUUVVGQIVMSAW N/A N/A N/A Lignans Furofuranoid lignans Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00010121500 CCMSLIB00004692249 312 spectra_filtered.mgf MONA.mgf 0.715948 318200.0 0 98956.5 6 31.0861 345.225 1 temp/spectra_filtered.mgf312 1 feruloyltyramine N/A ESI-QFT isolated MoNA MoNA:VF-NPL-QEHF001186 [M+H]+ 314.139 0.0 1 N/A N/A COc1cc(/C=C/C(O)=NCCc2ccc(O)cc2)ccc1O InChI=1S/C18H19NO4/c1-23-17-12-14(4-8-16(17)21)5-9-18(22)19-11-10-13-2-6-15(20)7-3-13/h2-9,12,20-21H,10-11H2,1H3,(H,19,22)/b9-5+ N/A 3 positive MONA 314.139 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C18H19NO4 NPNNKDMSXVRADT-WEVVVXLNSA-N NPNNKDMSXVRADT Benzenoids Phenols Methoxyphenols Diarylheptanoids Linear diarylheptanoids Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00004692249 CCMSLIB00004695446 468 spectra_filtered.mgf MONA.mgf 0.715166 923900.0 0 266938.0 6 72.1091 342.243 1 temp/spectra_filtered.mgf468 1 Methyl 3,4,5-trimethoxycinnamate N/A ESI-QFT isolated MoNA MoNA:VF-NPL-QEHF004383 [M+NH4]+ 270.134 0.0 1 N/A N/A COC(=O)/C=C/c1cc(OC)c(OC)c(OC)c1 InChI=1S/C13H16O5/c1-15-10-7-9(5-6-12(14)17-3)8-11(16-2)13(10)18-4/h5-8H,1-4H3/b6-5+ N/A 3 positive MONA 270.134 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C13H16O5 KLXHCGFNNUQTEY-AATRIKPKSA-N KLXHCGFNNUQTEY Phenylpropanoids and polyketides Cinnamic acids and derivatives Hydroxycinnamic acids and derivatives Phenylpropanoids (C6-C3) Cinnamic acids and derivatives Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00004695446 CCMSLIB00006411177 321 spectra_filtered.mgf BMDMS-NP.mgf 0.713989 4210000.0 0 274805.0 7 79.9931 211.097 1 temp/spectra_filtered.mgf321 1 (2R,3R)-2-(3,4-dihydroxyphenyl)-3,4-dihydro-2H-chromene-3,5,7-triol ESI Orbitrap Commercial standard BMDMS-NP BMDMS-NP [M+H]+ 291.09 290.079 1 N/A N/A OC=1C=C(O)C2=C(OC(C3=CC=C(O)C(O)=C3)C(O)C2)C1 InChI=1S/C15H14O6/c16-8-4-11(18)9-6-13(20)15(21-14(9)5-8)7-1-2-10(17)12(19)3-7/h1-5,13,15-20H,6H2 N/A 1 Positive BMDMS-NP 291.09 UPDATE-SINGLE-ANNOTATED-GOLD Gold C15H14O6 PFTAWBLQPZVEMU-UHFFFAOYSA-N PFTAWBLQPZVEMU Phenylpropanoids and polyketides Flavonoids Flavans Flavonoids Flavan-3-ols Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00006411177 CCMSLIB00006678135 867 spectra_filtered.mgf GNPS-LIBRARY.mgf 0.713855 5533900.0 0 1153.1 9 1.005 870.566 1 temp/spectra_filtered.mgf867 1 Pheophytin a LC-ESI Orbitrap Other S Ding Su Ding M+H 871.571 871.573 1 N/A N/A N/A N/A N/A 3 Positive GNPS-LIBRARY 871.571 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze N/A N/A N/A N/A N/A N/A N/A N/A N/A mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00006678135 CCMSLIB00004720840 455 spectra_filtered.mgf MONA.mgf 0.713116 11041700.0 0 532944.0 6 169.548 487.682 1 temp/spectra_filtered.mgf455 1 Piplartine N/A ESI-QFT isolated MoNA MoNA:VF-NPL-QEHF027259 [M+H]+ 318.134 0.0 1 N/A N/A COc1cc(/C=C/C(=O)N2CCC=CC2=O)cc(OC)c1OC InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+ N/A 3 positive MONA 318.134 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C17H19NO5 VABYUUZNAVQNPG-BQYQJAHWSA-N VABYUUZNAVQNPG N/A N/A N/A Lysine alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00004720840 CCMSLIB00010110764 224 spectra_filtered.mgf BERKELEY-LAB.mgf 0.71311 4102800.0 0 178561.0 6 61.9791 285.124 1 temp/spectra_filtered.mgf224 1 """2-amino-6-(hydroxymethyl)-4-naphthyl-8-oxo-4H-pyrano[3,2-b]pyran-3-carbonitril e CollisionEnergy:102040""" LC-ESI Orbitrap Commercial Trent Northen JGI M+H 347.103 0.0 1 N/A N/A N#CC1=C(N)Oc2c(oc(CO)cc2=O)C1c1cccc2ccccc12 """InChI=1S/C20H14N2O4/c21-9-15-17(14-7-3-5-11-4-1-2-6-13(11)14)19-18(26-20(15)22)16(24)8-12(10-23)25-19/h1-8,17,23H,10,22H2""" N/A 3 Positive BERKELEY-LAB 347.103 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze H3N DCECXXVEKNNRNY-UHFFFAOYSA-N DCECXXVEKNNRNY N/A N/A N/A Small peptides Aminoacids Amino acids and Peptides|Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00010110764 CCMSLIB00003136165 403 spectra_filtered.mgf GNPS-NIST14-MATCHES.mgf 0.712911 3407800.0 0 502818.0 6 89.0264 266.081 1 temp/spectra_filtered.mgf403 1 Spectral Match to trans-Ferulic acid from NIST14 ESI qTof Isolated Data from Suryasarathi Dasgupta Data deposited by fevargas M+H-H2O 177.055 194.058 1 537984 N/A COC1=C(C=CC(=C1)/C=C/C(=O)O)O InChI=1S/C10H10O4/c1-14-9-6-7(2-4-8(9)11)3-5-10(12)13/h2-6,11H,1H3,(H,12,13)/b5-3+ N/A 3 Positive GNPS-NIST14-MATCHES 177.055 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C10H10O4 KSEBMYQBYZTDHS-HWKANZROSA-N KSEBMYQBYZTDHS Phenylpropanoids and polyketides Cinnamic acids and derivatives Hydroxycinnamic acids and derivatives Phenylpropanoids (C6-C3) Cinnamic acids and derivatives Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00003136165 CCMSLIB00004713752 655 spectra_filtered.mgf MONA.mgf 0.712279 5308200.0 0 625045.0 7 682.256 409.274 1 temp/spectra_filtered.mgf655 1 (2S,3S,4S,5R,6R)-6-[[(3S,4S,6aR,6bS,8R,8aR,9R,10R,12aS,14bR)-10-acetyloxy-8a-(acetyloxymethyl)-8,9-dihydroxy-4-(hydroxymethyl)-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-4-hydroxy-3,5-bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]oxane-2-carboxylic acid N/A ESI-QFT isolated MoNA MoNA:VF-NPL-QEHF022689 [M+H]+ 1091.53 0.0 1 N/A N/A CC(=O)OC[C@@]12[C@@H](CC(C)(C)[C@@H](OC(C)=O)[C@@H]1O)C1=CCC3[C@@]4(C)CC[C@H](O[C@@H]5O[C@H](C(=O)O)[C@@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@H](O)[C@H]5O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@](C)(CO)C4CC[C@@]3(C)[C@]1(C)C[C@H]2O InChI=1S/C52H82O24/c1-21(56)69-20-52-24(15-47(3,4)42(41(52)66)70-22(2)57)23-9-10-28-48(5)13-12-30(49(6,19-55)27(48)11-14-50(28,7)51(23,8)16-29(52)58)73-46-39(75-45-36(64)34(62)32(60)26(18-54)72-45)37(65)38(40(76-46)43(67)68)74-44-35(63)33(61)31(59)25(17-53)71-44/h9,24-42,44-46,53-55,58-66H,10-20H2,1-8H3,(H,67,68)/t24-,25+,26+,27?,28?,29+,30-,31+,32+,33-,34-,35+,36+,37-,38-,39+,40-,41-,42-,44-,45-,46+,48-,49+,50+,51+,52-/m0/s1 N/A 3 positive MONA 1091.53 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C52H82O24 CJFSVYYGNWQUMQ-DBWNCVFDSA-N CJFSVYYGNWQUMQ Lipids and lipid-like molecules Prenol lipids Terpene glycosides Triterpenoids Oleanane triterpenoids Terpenoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00004713752 CCMSLIB00000847665 527 spectra_filtered.mgf GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE.mgf 0.707626 6900200.0 0 40477.8 6 15.0233 356.126 1 temp/spectra_filtered.mgf527 1 NCGC00180457-02!4-(1,3-benzodioxol-5-ylmethyl)-3-[(3,4-dimethoxyphenyl)methyl]oxolan-2-one LC-ESI Maxis II HD Q-TOF Bruker isolated Jadhav/Dorrestein lfnothias M+H 371.149 370.142 1 n/a n/a COC1=C(OC)C=C(CC2C(CC3=CC4=C(OCO4)C=C3)COC2=O)C=C1 InChI=1S/C21H22O6/c1-23-17-5-3-14(9-19(17)24-2)8-16-15(11-25-21(16)22)7-13-4-6-18-20(10-13)27-12-26-18/h3-6,9-10,15-16H,7-8,11-12H2,1-2H3 N/A 1 positive GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE 371.149 UPDATE-SINGLE-ANNOTATED-GOLD Gold C21H22O6 IYBDDRJHJMFFBB-UHFFFAOYSA-N IYBDDRJHJMFFBB Lignans, neolignans and related compounds Furanoid lignans Tetrahydrofuran lignans Lignans Dibenzylbutyrolactone lignans Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00000847665 CCMSLIB00006678135 836 spectra_filtered.mgf GNPS-LIBRARY.mgf 0.707449 1884600.0 0 1153.31 9 1.00519 870.566 1 temp/spectra_filtered.mgf836 1 Pheophytin a LC-ESI Orbitrap Other S Ding Su Ding M+H 871.571 871.573 1 N/A N/A N/A N/A N/A 3 Positive GNPS-LIBRARY 871.571 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze N/A N/A N/A N/A N/A N/A N/A N/A N/A mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00006678135 CCMSLIB00000848041 745 spectra_filtered.mgf GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE.mgf 0.706958 115910000.0 0 86809.9 7 33.9603 357.243 1 temp/spectra_filtered.mgf745 1 NCGC00380640-01!5-chloro-2,4-dihydroxy-6-methyl-3-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl]benzaldehyde LC-ESI Maxis II HD Q-TOF Bruker isolated Jadhav/Dorrestein lfnothias M+H 391.203 390.196 1 n/a n/a CC(C)=CCC\C(C)=C\CC\C(C)=C\CC1=C(O)C(C=O)=C(C)C(Cl)=C1O InChI=1S/C23H31ClO3/c1-15(2)8-6-9-16(3)10-7-11-17(4)12-13-19-22(26)20(14-25)18(5)21(24)23(19)27/h8,10,12,14,26-27H,6-7,9,11,13H2,1-5H3/b16-10+,17-12+ N/A 1 positive GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE 391.203 UPDATE-SINGLE-ANNOTATED-GOLD Gold C23H31ClO3 MHWOMRMBQGSTFS-JTCWOHKRSA-N MHWOMRMBQGSTFS Lipids and lipid-like molecules Prenol lipids Sesquiterpenoids Meroterpenoids Tetraketide meroterpenoids Polyketides|Terpenoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00000848041 CCMSLIB00003135029 736 spectra_filtered.mgf GNPS-NIST14-MATCHES.mgf 0.705197 3254200.0 0 111473.0 14 80.0973 638.44 1 temp/spectra_filtered.mgf736 1 Spectral Match to 1-Hexadecanoyl-2-(9Z-octadecenoyl)-sn-glycero-3-phosphoethanolamine from NIST14 ESI qTof Isolated Data from Piel, Dittmann Data deposited by eriche M+H 718.537 717.531 1 26662942 N/A CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)(O)OCCN)OC(=O)CCCCCCC/C=C\CCCCCCCC InChI=1S/C39H76NO8P/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-30-32-39(42)48-37(36-47-49(43,44)46-34-33-40)35-45-38(41)31-29-27-25-23-21-19-16-14-12-10-8-6-4-2/h17-18,37H,3-16,19-36,40H2,1-2H3,(H,43,44)/b18-17-/t37-/m1/s1 N/A 3 Positive GNPS-NIST14-MATCHES 718.537 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C39H76NO8P FHQVHHIBKUMWTI-OTMQOFQLSA-N FHQVHHIBKUMWTI Lipids and lipid-like molecules Glycerophospholipids Glycerophosphoethanolamines Glycerophospholipids Glycerophosphoethanolamines Fatty acids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00003135029 CCMSLIB00012443642 611 spectra_filtered.mgf MSNLIB-POSITIVE.mgf 0.704725 3877100.0 0 155235.0 10 83.1015 618.429 1 temp/spectra_filtered.mgf611 1 CHEBI:181879 ESI Orbitrap Crude Tomas Pluskal Corinna Brungs [M+H]+ 535.327 534.319 1 N/A N/A CC1(CO)CC(O)[C@]2(C(=O)O)CCC34CC3(C=CC3[C@]5(C)C(CC[C@]34C)C(C)(CO)[C@@H](O)[C@H](O)[C@@H]5O)C2C1 InChI=1S/C30H46O8/c1-24(14-31)11-18-28-8-6-17-26(3,29(28,13-28)9-10-30(18,23(37)38)19(33)12-24)7-5-16-25(2,15-32)21(35)20(34)22(36)27(16,17)4/h6,8,16-22,31-36H,5,7,9-15H2,1-4H3,(H,37,38)/t16?,17?,18?,19?,20-,21-,22-,24?,25?,26+,27-,28?,29?,30-/m0/s1 IXIMDUAPYHOVHL-QQQCTMDWSA-N 1 Positive MSNLIB-POSITIVE 535.327 UPDATE-SINGLE-ANNOTATED-GOLD Gold C30H46O8 IXIMDUAPYHOVHL-QQQCTMDWSA-N IXIMDUAPYHOVHL Lipids and lipid-like molecules Prenol lipids Sesterterpenoids Triterpenoids Oleanane triterpenoids Terpenoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012443642 CCMSLIB00012311677 242 spectra_filtered.mgf MSNLIB-POSITIVE.mgf 0.703721 1429800.0 0 910680.0 6 164.048 344.186 1 temp/spectra_filtered.mgf242 1 Mexiletine ESI Orbitrap Crude Tomas Pluskal Corinna Brungs [M+H]+ 180.138 179.131 1 N/A N/A Cc1c(OCC(C)N)c(C)ccc1 InChI=1S/C11H17NO/c1-8-5-4-6-9(2)11(8)13-7-10(3)12/h4-6,10H,7,12H2,1-3H3 VLPIATFUUWWMKC-UHFFFAOYSA-N 1 Positive MSNLIB-POSITIVE 180.138 UPDATE-SINGLE-ANNOTATED-GOLD Gold C11H17NO VLPIATFUUWWMKC-UHFFFAOYSA-N VLPIATFUUWWMKC N/A N/A N/A Pseudoalkaloids Phenylalanine-derived alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00012311677 CCMSLIB00010128701 862 spectra_filtered.mgf GNPS-LIBRARY.mgf 0.703174 49040300.0 0 46004.8 9 28.0294 637.301 1 temp/spectra_filtered.mgf862 1 3.10S-Hydroxypheophorbide a LC-ESI Orbitrap Isolated Wolfender R. Huber M+H 609.272 0.0 1 OC(CC[C@H]1[C@@H](C2=N/C1=C([C@](C(OC)=O)(O)C3=O)\C4=C3C(C)=C(N4)/C=C5N=C(C(C)=C\5CC)/C=C(N/6)/C(C=C)=C(C6=C\2)C)C)=O InChI=1S/C35H36N4O6/c1-8-19-15(3)22-12-24-17(5)21(10-11-28(40)41)31(38-24)30-32-29(33(42)35(30,44)34(43)45-7)18(6)25(39-32)14-27-20(9-2)16(4)23(37-27)13-26(19)36-22/h8,12-14,17,21,36,39,44H,1,9-11H2,2-7H3,(H,40,41)/t17-,21-,35-/m0/s1 3 Positive GNPS-LIBRARY 609.272 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C35H36N4O6 TXOKSKCKTYISQV-FHCXDJKBSA-N TXOKSKCKTYISQV Organoheterocyclic compounds Tetrapyrroles and derivatives Chlorins Tryptophan alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00010128701 CCMSLIB00005724964 187 spectra_filtered.mgf GNPS-LIBRARY.mgf 0.70281 3319600.0 0 189392.0 8 108.196 463.084 1 temp/spectra_filtered.mgf187 1 1-[(4-hydroxyphenyl)methyl]-6-methoxy-1,2,3,4-tetrahydroisoquinolin-7-ol ESI Orbitrap Isolated Wolfender Luis Quiros-Guerrero 2M+H 571.28 285.137 1 N/A N/A COc(cc(CCNC1Cc(cc2)ccc2O)c1c1)c1O InChI=1S/C17H19NO3/c1-21-17-9-12-6-7-18-15(14(12)10-16(17)20)8-11-2-4-13(19)5-3-11/h2-5,9-10,15,18-20H,6-8H2,1H3/t15-/m0/s1 N/A 1 Positive GNPS-LIBRARY 571.28 UPDATE-SINGLE-ANNOTATED-GOLD Gold C17H19NO3 LVVKXRQZSRUVPY-UHFFFAOYSA-N LVVKXRQZSRUVPY Organoheterocyclic compounds Isoquinolines and derivatives Benzylisoquinolines Tyrosine alkaloids Isoquinoline alkaloids|Tetrahydroisoquinoline alkaloids Alkaloids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00005724964 CCMSLIB00003136313 762 spectra_filtered.mgf GNPS-NIST14-MATCHES.mgf 0.702769 1775800.0 0 608203.0 10 373.122 986.605 1 temp/spectra_filtered.mgf762 1 Spectral Match to Dilinolenin (9c,12c,15c) from NIST14 ESI HCD Isolated Data from Wolfender/Litaudon Data deposited by pmallard M+H 613.483 0.0 1 35098841 N/A N/A N/A N/A 3 Positive GNPS-NIST14-MATCHES 613.483 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze N/A N/A N/A N/A N/A N/A N/A N/A N/A mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00003136313 CCMSLIB00004693357 260 spectra_filtered.mgf MONA.mgf 0.701534 8543700.0 0 359175.0 8 194.042 346.202 1 temp/spectra_filtered.mgf260 1 2-(hydroxymethyl)-6-[5-[3-(hydroxymethyl)-5-(3-hydroxypropyl)-7-methoxy-2,3-dihydro-1-benzofuran-2-yl]-2-methoxyphenoxy]oxane-3,4,5-triol N/A ESI-QFT isolated MoNA MoNA:VF-NPL-QEHF002294 [M+NH4]+ 540.244 0.0 1 N/A N/A COc1ccc(C2Oc3c(OC)cc(CCCO)cc3C2CO)cc1OC1OC(CO)C(O)C(O)C1O InChI=1S/C26H34O11/c1-33-17-6-5-14(10-18(17)35-26-23(32)22(31)21(30)20(12-29)36-26)24-16(11-28)15-8-13(4-3-7-27)9-19(34-2)25(15)37-24/h5-6,8-10,16,20-24,26-32H,3-4,7,11-12H2,1-2H3 N/A 3 positive MONA 540.244 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze C26H34O11 RWEVZSYWIIZZFV-UHFFFAOYSA-N RWEVZSYWIIZZFV N/A N/A N/A Lignans Neolignans Shikimates and Phenylpropanoids mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00004693357 CCMSLIB00006678135 858 spectra_filtered.mgf GNPS-LIBRARY.mgf 0.700774 2561200.0 0 1153.45 9 1.00531 870.566 1 temp/spectra_filtered.mgf858 1 Pheophytin a LC-ESI Orbitrap Other S Ding Su Ding M+H 871.571 871.573 1 N/A N/A N/A N/A N/A 3 Positive GNPS-LIBRARY 871.571 UPDATE-SINGLE-ANNOTATED-BRONZE Bronze N/A N/A N/A N/A N/A N/A N/A N/A N/A mzspec:GNPS:GNPS-LIBRARY:CCMSLIB00006678135 nf_output/GNPS-LIBRARY.mgf.tsv0000644000000000000000000000000114664572142014760 0ustar rootroot nf_output/MMV_NEGATIVE.mgf.tsv0000644000000000000000000000000114664572140015026 0ustar rootroot nf_output/GNPS-D2-AMINO-LIPID-LIBRARY.mgf.tsv0000644000000000000000000000000114664572137016727 0ustar rootroot nf_output/CASMI.mgf.tsv0000644000000000000000000000000114664572140013741 0ustar rootroot nf_output/GNPS-FAULKNERLEGACY.mgf.tsv0000644000000000000000000000000114664572140015746 0ustar rootroot nf_output/BIRMINGHAM-UHPLC-MS-NEG.mgf.tsv0000644000000000000000000000000114664572140016317 0ustar rootroot nf_output/CMMC-LIBRARY.mgf.tsv0000644000000000000000000000000114664572140014726 0ustar rootroot nf_output/GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE.mgf.tsv0000644000000000000000000000000114664572141022161 0ustar rootroot nf_output/LDB_NEGATIVE.mgf.tsv0000644000000000000000000000000114664572140014770 0ustar rootroot nf_output/MASSBANK.mgf.tsv0000644000000000000000000000000114664572141014305 0ustar rootroot nf_output/TUEBINGEN-NATURAL-PRODUCT-COLLECTION.mgf.tsv0000644000000000000000000000000114664572140020300 0ustar rootroot nf_output/networking/0000755000000000000000000000000014664574442014006 5ustar rootrootnf_output/networking/filtered_pairs.tsv0000644000000000000000000011705514664572156017551 0ustar rootrootCLUSTERID1 CLUSTERID2 ComponentIndex Cosine DeltaMZ 3 6 1 0.8118 -23.016 4 6 1 0.7195 -27.995 4 5 1 0.7623 23.016 439 442 2 0.8424 -8.008 442 453 2 0.8247 235.533 442 505 2 0.8343 62.874 442 561 2 0.8821 107.932 352 534 2 0.9897 15.995 378 534 2 0.9298 45.058 387 534 2 0.984 0.000 400 534 2 0.9884 2.016 452 534 2 0.9843 0.000 458 534 2 0.9485 -11.964 463 534 2 0.984 2.016 467 534 2 0.9509 149.048 503 534 2 0.9487 -13.979 511 534 2 0.9859 0.000 428 439 2 0.8059 -276.123 352 452 2 0.984 15.995 387 452 2 0.9954 0.000 400 452 2 0.9816 2.016 452 458 2 0.9442 11.964 452 463 2 0.9951 -2.016 452 467 2 0.9474 -149.048 452 503 2 0.9514 13.979 452 511 2 0.9954 0.000 293 561 2 0.8402 -146.037 356 561 2 0.899 -168.079 398 561 2 0.9281 -270.053 505 561 2 0.9113 45.058 382 427 2 0.9063 79.973 423 427 2 0.9004 79.973 424 427 2 0.9245 -1.000 352 378 2 0.9356 -29.063 352 387 2 0.9857 15.995 352 400 2 0.987 13.979 352 458 2 0.9433 27.959 352 463 2 0.98 13.979 352 467 2 0.9603 -133.053 352 503 2 0.9475 29.974 352 511 2 0.9869 15.995 378 511 2 0.9283 45.058 387 511 2 0.9955 0.000 400 511 2 0.9817 2.016 458 511 2 0.9459 -11.964 463 511 2 0.9945 2.016 467 511 2 0.9525 149.048 503 511 2 0.9519 -13.979 378 458 2 0.929 57.021 387 458 2 0.9434 11.964 400 458 2 0.9522 13.979 458 463 2 0.9497 -13.979 458 467 2 0.9424 -161.011 458 503 2 0.952 2.016 356 382 2 0.8961 41.115 378 382 2 0.9339 -62.875 382 398 2 0.9458 60.859 382 423 2 0.9537 -0.000 382 424 2 0.9193 80.973 332 344 2 0.877 -46.042 392 433 2 0.9162 -0.000 433 439 2 0.8777 -317.126 293 323 2 0.8997 18.010 293 505 2 0.8161 -191.095 356 398 2 0.9328 101.975 378 398 2 0.9674 -2.016 398 423 2 0.9366 -60.860 398 424 2 0.9081 20.114 398 467 2 0.9521 -101.974 392 439 2 0.8466 -317.126 423 424 2 0.9098 80.973 356 378 2 0.9447 103.990 387 503 2 0.9509 13.979 400 503 2 0.9397 15.995 463 503 2 0.9497 15.995 378 400 2 0.933 43.042 387 400 2 0.9793 -2.016 400 463 2 0.9817 0.000 400 467 2 0.954 -147.032 378 463 2 0.9291 43.042 387 463 2 0.9949 -2.016 463 467 2 0.9576 -147.032 323 332 2 0.9724 15.995 378 467 2 0.9809 -103.990 387 467 2 0.9485 -149.048 841 850 3 0.8838 -43.991 846 850 3 0.9116 1.006 849 850 3 0.8798 -46.006 850 897 3 0.8856 -1.006 850 898 3 0.9496 0.000 611 896 3 0.8929 34.007 622 896 3 0.9027 34.007 694 896 3 0.9265 18.012 841 896 3 0.9244 -15.995 843 896 3 0.9042 -1.006 844 896 3 0.8938 -17.001 845 896 3 0.9733 0.000 846 896 3 0.9042 29.002 874 896 3 0.927 0.000 894 896 3 0.8991 -17.001 683 846 3 0.9057 -220.145 694 846 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0.9609 0.000 167 174 105 0.7169 -15.995 nf_output/networking/params/0000755000000000000000000000000014664572144015266 5ustar rootrootnf_output/networking/params/0.params0000644000000000000000000000026114664572144016631 0ustar rootrootALIGNS_FORMAT=tsv MIN_MATCHED_PEAKS=6 TOLERANCE_PEAK=0.01 TOLERANCE_PM=0.01 PAIRS_MIN_COSINE=0.7 MAX_SHIFT=1999.0 INPUT_SPECTRA_MS2=spectra_filtered.mgf IDX_START=0 IDX_END=898 nf_output/networking/merged_pairs.tsv0000644000000000000000000046626614664572154017227 0ustar rootrootCLUSTERID1 CLUSTERID2 DeltaMZ MinRatio Cosine AlignScore2 AlignScore3 1 2 -27.995 0.000 0.8386 0.5727 1 2 28 8.008 0.000 0.8116 0.4964 1 3 6 -23.016 0.000 0.8118 0.6268 1 4 5 23.016 0.000 0.7623 0.6359 1 4 6 -27.995 0.000 0.7195 0.5851 1 8 9 41.026 0.000 0.7406 0.6252 1 8 15 -5.005 0.000 0.8295 0.5616 1 8 19 18.011 0.000 0.8251 0.5813 1 8 26 -77.960 0.000 0.7414 0.4546 1 9 13 -1.998 0.000 0.9057 0.6814 1 9 15 -46.032 0.000 0.8941 0.7262 1 9 17 -5.005 0.000 0.8215 0.5606 1 9 19 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14.016 0.000 0.8883 0.8495 1 243 270 28.031 0.000 0.8049 0.7178 1 243 283 -2.016 0.000 0.7101 0.7008 1 244 245 -215.101 0.000 0.7950 0.6754 1 244 246 -18.011 0.000 0.8840 0.7284 1 244 327 -14.016 0.000 0.8441 0.7196 1 244 348 2.015 0.000 0.9000 0.7690 1 244 366 14.015 0.000 0.8225 0.7359 1 244 414 -0.000 0.000 0.9114 0.7742 1 244 520 -14.016 0.000 0.8114 0.7601 1 244 550 2.015 0.000 0.8674 0.6644 1 244 574 2.015 0.000 0.8703 0.6558 1 245 246 197.090 0.000 0.8641 0.7630 1 245 328 148.037 0.000 0.7004 0.5743 1 245 414 215.100 0.000 0.7115 0.5559 1 246 329 -14.016 0.000 0.8749 0.6640 1 246 414 18.010 0.000 0.8169 0.6235 1 246 552 2.016 0.000 0.7574 0.5259 1 249 250 132.042 0.000 0.8594 0.4345 1 249 258 -30.011 0.000 0.9375 0.6584 1 249 276 150.073 0.000 0.7850 0.3228 1 251 310 -28.031 0.000 0.7379 0.5894 1 253 273 0.000 0.000 0.9609 0.8502 1 254 270 14.016 0.000 0.8316 0.8065 1 256 257 -14.016 0.000 0.9530 0.8616 1 256 294 1.979 0.000 0.7919 0.6257 1 256 301 176.069 0.000 0.7363 0.6787 1 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0.000 0.7006 0.4001 1 293 392 71.165 0.000 0.7364 0.4602 1 293 398 124.016 0.000 0.8444 0.4363 1 293 400 169.074 0.000 0.7609 0.6138 1 293 423 63.157 0.000 0.7944 0.4353 1 293 424 144.130 0.000 0.7757 0.4766 1 293 427 143.130 0.000 0.7633 0.4782 1 293 430 -13.935 0.000 0.7555 0.4588 1 293 433 71.165 0.000 0.7359 0.4584 1 293 438 -200.964 0.000 0.7240 0.3987 1 293 439 -245.961 0.000 0.7352 0.3987 1 293 442 -253.969 0.000 0.7718 0.4541 1 293 444 -216.000 0.000 0.7406 0.4794 1 293 448 -15.434 0.000 0.7383 0.4120 1 293 452 171.090 0.000 0.7292 0.5469 1 293 453 -18.436 0.000 0.7703 0.4471 1 293 458 183.053 0.000 0.7912 0.5839 1 293 463 169.074 0.000 0.7567 0.6112 1 293 467 22.042 0.000 0.8307 0.5430 1 293 503 185.069 0.000 0.7328 0.5638 1 293 505 -191.095 0.000 0.8161 0.5019 1 293 511 171.090 0.000 0.7391 0.5244 1 293 534 171.090 0.000 0.7442 0.5318 1 293 561 -146.037 0.000 0.8402 0.4577 1 294 314 -197.156 0.000 0.7623 0.6331 1 294 315 146.058 0.000 0.7090 0.6193 1 294 317 28.979 0.000 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323 332 15.995 0.000 0.9724 0.7477 1 323 352 137.084 0.000 0.7969 0.5979 1 323 356 4.031 0.000 0.8159 0.5578 1 323 378 108.021 0.000 0.8420 0.6009 1 323 382 45.146 0.000 0.8200 0.4750 1 323 387 153.079 0.000 0.7772 0.5805 1 323 391 125.120 0.000 0.7025 0.4053 1 323 392 53.154 0.000 0.7506 0.4911 1 323 398 106.006 0.000 0.8397 0.4869 1 323 400 151.063 0.000 0.7957 0.5951 1 323 423 45.146 0.000 0.8096 0.4615 1 323 424 126.120 0.000 0.7907 0.5265 1 323 427 125.119 0.000 0.7731 0.5218 1 323 430 -31.945 0.000 0.7276 0.4523 1 323 433 53.154 0.000 0.7513 0.4859 1 323 439 -263.972 0.000 0.7073 0.3817 1 323 442 -271.980 0.000 0.7414 0.4815 1 323 444 -234.011 0.000 0.7615 0.5375 1 323 448 -33.444 0.000 0.7151 0.3838 1 323 452 153.079 0.000 0.7764 0.5898 1 323 453 -36.447 0.000 0.7310 0.4421 1 323 458 165.043 0.000 0.7943 0.5969 1 323 463 151.064 0.000 0.7864 0.5895 1 323 467 4.031 0.000 0.8391 0.6601 1 323 503 167.058 0.000 0.7623 0.5971 1 323 505 -209.105 0.000 0.7768 0.5331 1 323 511 153.079 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137.084 0.000 0.8073 0.7314 1 332 392 37.159 0.000 0.7342 0.4657 1 332 398 90.011 0.000 0.8197 0.4626 1 332 400 135.068 0.000 0.8076 0.6449 1 332 423 29.151 0.000 0.7924 0.4363 1 332 424 110.125 0.000 0.7855 0.5268 1 332 427 109.124 0.000 0.7780 0.6023 1 332 430 -47.940 0.000 0.7073 0.4523 1 332 433 37.159 0.000 0.7387 0.4984 1 332 434 138.091 0.000 0.7026 0.5499 1 332 442 -287.975 0.000 0.7088 0.4368 1 332 444 -250.006 0.000 0.7578 0.5466 1 332 448 -49.439 0.000 0.7073 0.4297 1 332 452 137.084 0.000 0.8067 0.7534 1 332 453 -52.442 0.000 0.7170 0.4281 1 332 458 149.048 0.000 0.7985 0.6693 1 332 463 135.069 0.000 0.8150 0.7600 1 332 467 -11.963 0.000 0.8459 0.7518 1 332 503 151.064 0.000 0.7834 0.7188 1 332 505 -225.100 0.000 0.7508 0.5411 1 332 511 137.084 0.000 0.8127 0.7364 1 332 534 137.084 0.000 0.8064 0.6657 1 332 561 -180.042 0.000 0.7690 0.4409 1 333 334 -17.027 0.000 0.8846 0.7411 1 333 549 -70.006 0.000 0.7472 0.5382 1 333 573 -70.006 0.000 0.7475 0.5196 1 333 605 -59.001 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398 60.859 0.000 0.9458 0.7138 1 382 400 105.917 0.000 0.8988 0.5313 1 382 423 -0.000 0.000 0.9537 0.7598 1 382 424 80.973 0.000 0.9193 0.6071 1 382 427 79.973 0.000 0.9063 0.5316 1 382 428 -32.995 0.000 0.7296 0.3314 1 382 430 -77.092 0.000 0.8133 0.4314 1 382 433 8.008 0.000 0.8522 0.4127 1 382 434 108.940 0.000 0.7785 0.3554 1 382 438 -264.120 0.000 0.7489 0.3680 1 382 439 -309.118 0.000 0.7871 0.3403 1 382 442 -317.126 0.000 0.8519 0.5081 1 382 444 -279.157 0.000 0.8735 0.4600 1 382 448 -78.590 0.000 0.8085 0.3392 1 382 452 107.933 0.000 0.8777 0.4695 1 382 453 -81.593 0.000 0.8479 0.5299 1 382 458 119.896 0.000 0.8912 0.4682 1 382 463 105.917 0.000 0.8899 0.4846 1 382 467 -41.115 0.000 0.9344 0.5730 1 382 503 121.912 0.000 0.8603 0.4427 1 382 505 -254.252 0.000 0.8440 0.4361 1 382 511 107.933 0.000 0.8856 0.5037 1 382 516 79.973 0.000 0.7513 0.4888 1 382 534 107.933 0.000 0.8973 0.5052 1 382 561 -209.194 0.000 0.8899 0.5884 1 383 385 117.935 0.000 0.7949 0.6576 1 383 393 -27.995 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196.988 0.000 0.7579 0.4551 1 430 463 183.009 0.000 0.7492 0.5350 1 430 467 35.977 0.000 0.8284 0.4816 1 430 503 199.004 0.000 0.7185 0.4898 1 430 505 -177.160 0.000 0.8089 0.4468 1 430 511 185.025 0.000 0.7353 0.4669 1 430 534 185.025 0.000 0.7402 0.4669 1 430 561 -132.102 0.000 0.8288 0.4121 1 432 446 159.065 0.000 0.9057 0.7206 1 432 449 0.502 0.000 0.8497 0.7396 1 433 434 100.932 0.000 0.7379 0.4691 1 433 439 -317.126 0.000 0.8777 0.6568 1 433 442 -325.134 0.000 0.7438 0.4239 1 433 444 -287.165 0.000 0.8026 0.4999 1 433 448 -86.598 0.000 0.7203 0.3517 1 433 452 99.925 0.000 0.8313 0.5123 1 433 453 -89.601 0.000 0.7435 0.3898 1 433 458 111.888 0.000 0.8428 0.5165 1 433 463 97.909 0.000 0.8366 0.4937 1 433 467 -49.123 0.000 0.8608 0.5088 1 433 503 113.904 0.000 0.8143 0.5235 1 433 505 -262.260 0.000 0.7593 0.4555 1 433 511 99.925 0.000 0.8365 0.4829 1 433 534 99.925 0.000 0.8481 0.5141 1 433 561 -217.202 0.000 0.8026 0.4307 1 434 444 -388.097 0.000 0.7819 0.5511 1 434 448 -187.530 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497 30.010 0.000 0.8276 0.6632 1 492 529 -0.000 0.000 0.8879 0.7901 1 492 536 0.000 0.000 0.8365 0.5723 1 492 545 60.021 0.000 0.7404 0.5269 1 494 495 -330.147 0.000 0.7407 0.3791 1 494 498 -375.205 0.000 0.7462 0.5198 1 494 531 -0.000 0.000 0.8187 0.3290 1 495 496 97.053 0.000 0.7788 0.7609 1 495 498 -45.058 0.000 0.9287 0.6157 1 495 530 -75.069 0.000 0.7606 0.4599 1 495 531 330.147 0.000 0.7365 0.4110 1 495 532 -30.011 0.000 0.9217 0.7450 1 496 533 -30.011 0.000 0.7230 0.6775 1 497 529 -30.011 0.000 0.8027 0.6281 1 497 545 30.010 0.000 0.8903 0.6244 1 498 530 -30.011 0.000 0.8649 0.5099 1 498 532 15.047 0.000 0.7204 0.3045 1 501 511 -30.011 0.000 0.8495 0.6213 1 501 534 -30.011 0.000 0.8577 0.6148 1 502 507 -30.010 0.000 0.7907 0.5863 1 502 536 -30.010 0.000 0.7157 0.5492 1 503 505 -376.164 0.000 0.7272 0.5474 1 503 511 -13.979 0.000 0.9519 0.7559 1 503 534 -13.979 0.000 0.9487 0.7528 1 503 561 -331.106 0.000 0.7513 0.4349 1 505 510 45.058 0.000 0.7917 0.6738 1 505 511 362.184 0.000 0.7521 0.5499 1 505 534 362.184 0.000 0.7554 0.5419 1 505 561 45.058 0.000 0.9113 0.4520 1 507 536 0.000 0.000 0.9118 0.7638 1 507 670 181.001 0.000 0.7098 0.3366 1 507 684 181.001 0.000 0.7502 0.4227 1 508 535 0.000 0.000 0.9475 0.8105 1 508 544 -10.021 0.000 0.7545 0.5307 1 508 572 -10.021 0.000 0.7491 0.5368 1 509 511 1.003 0.000 0.7810 0.5625 1 509 534 1.003 0.000 0.7901 0.5592 1 510 512 97.053 0.000 0.8629 0.6660 1 511 534 0.000 0.000 0.9859 0.8070 1 511 561 -317.127 0.000 0.7762 0.5060 1 516 534 27.960 0.000 0.7118 0.4441 1 516 561 -289.167 0.000 0.7008 0.5062 1 517 522 4.979 0.000 0.7449 0.5245 1 517 523 -30.011 0.000 0.8495 0.4856 1 517 563 -75.008 0.000 0.7727 0.4083 1 517 597 -14.016 0.000 0.9720 0.7511 1 517 598 -30.011 0.000 0.9026 0.4910 1 517 766 -306.184 0.000 0.7626 0.4276 1 517 767 -304.169 0.000 0.7047 0.3434 1 517 776 -308.200 0.000 0.7146 0.3850 1 517 781 -310.206 0.000 0.7142 0.4309 1 517 795 -372.193 0.000 0.8283 0.3166 1 517 821 -250.194 0.000 0.7790 0.3834 1 517 869 -302.473 0.000 0.8418 0.3032 1 520 550 16.031 0.000 0.8545 0.7360 1 520 574 16.031 0.000 0.8566 0.7231 1 521 648 -84.094 0.000 0.9191 0.6975 1 522 537 -42.011 0.000 0.7093 0.5815 1 522 538 -63.992 0.000 0.7115 0.4574 1 522 562 -58.005 0.000 0.7123 0.6285 1 522 597 -18.995 0.000 0.8101 0.5747 1 522 598 -34.990 0.000 0.7489 0.4194 1 523 597 15.995 0.000 0.9129 0.5902 1 523 598 -0.000 0.000 0.8369 0.3823 1 524 559 43.990 0.000 0.7321 0.5759 1 524 562 15.995 0.000 0.7469 0.6106 1 524 605 29.974 0.000 0.8627 0.7127 1 527 551 -14.016 0.000 0.7037 0.6210 1 527 584 2.016 0.000 0.7567 0.6204 1 528 855 -2.016 0.000 0.7787 0.7791 1 528 865 -2.016 0.000 0.7821 0.7670 1 528 876 -2.016 0.000 0.7750 0.7580 1 529 545 60.021 0.000 0.7256 0.4921 1 530 532 45.058 0.000 0.9467 0.7903 1 530 533 142.111 0.000 0.7189 0.7339 1 532 533 97.053 0.000 0.7699 0.7063 1 534 561 -317.127 0.000 0.7867 0.5066 1 535 544 -10.021 0.000 0.7374 0.5200 1 535 572 -10.021 0.000 0.7363 0.5306 1 536 670 181.001 0.000 0.7639 0.2875 1 536 675 181.001 0.000 0.7712 0.4245 1 536 684 181.001 0.000 0.7994 0.4358 1 537 562 -15.994 0.000 0.8193 0.6856 1 538 563 -15.995 0.000 0.8731 0.4741 1 538 598 29.003 0.000 0.7038 0.3492 1 543 567 -0.000 0.000 0.8877 0.6293 1 544 572 0.000 0.000 0.9144 0.7283 1 546 550 388.152 0.000 0.7999 0.7466 1 546 552 370.142 0.000 0.7711 0.7188 1 546 574 388.152 0.000 0.7987 0.7315 1 546 575 -0.000 0.000 0.9887 0.9088 1 547 565 0.000 0.000 0.9635 0.7381 1 548 568 -0.000 0.000 0.9326 0.7670 1 549 573 -0.000 0.000 0.9822 0.8764 1 550 552 -18.010 0.000 0.8222 0.8785 1 550 558 -30.011 0.000 0.7445 0.4120 1 550 574 -0.000 0.000 0.9946 0.9434 1 550 575 -388.152 0.000 0.8055 0.7775 1 550 585 16.031 0.000 0.7139 0.6452 1 551 564 0.000 0.000 0.8408 0.7430 1 552 554 -17.027 0.000 0.9005 0.6639 1 552 574 18.010 0.000 0.8198 0.8817 1 552 575 -370.142 0.000 0.7783 0.7663 1 552 581 16.031 0.000 0.7576 0.5297 1 552 587 18.047 0.000 0.7573 0.3875 1 558 574 30.011 0.000 0.7530 0.4116 1 559 562 -27.995 0.000 0.8201 0.7854 1 559 605 -14.016 0.000 0.7876 0.6732 1 562 563 -21.982 0.000 0.7152 0.4030 1 562 605 13.979 0.000 0.7872 0.6858 1 564 576 -117.935 0.000 0.8283 0.5771 1 574 575 -388.152 0.000 0.8052 0.7657 1 574 585 16.031 0.000 0.7114 0.6277 1 577 583 -18.010 0.000 0.7449 0.6747 1 577 590 -134.094 0.000 0.7287 0.6915 1 577 608 -134.094 0.000 0.7461 0.7015 1 577 609 -108.058 0.000 0.7349 0.6511 1 577 617 -134.094 0.000 0.7183 0.5916 1 577 618 15.995 0.000 0.7682 0.6268 1 577 631 13.979 0.000 0.7395 0.6204 1 577 637 13.979 0.000 0.7600 0.6494 1 577 640 13.979 0.000 0.7139 0.5281 1 577 646 13.979 0.000 0.7402 0.6339 1 577 649 13.979 0.000 0.7359 0.5824 1 577 660 13.979 0.000 0.7318 0.6146 1 577 663 -130.078 0.000 0.7259 0.6412 1 577 667 13.979 0.000 0.7435 0.6395 1 577 679 -156.094 0.000 0.7156 0.5048 1 577 680 13.979 0.000 0.7401 0.6263 1 577 706 -156.094 0.000 0.7137 0.5664 1 577 868 13.979 0.000 0.7535 0.6618 1 578 592 -12.000 0.000 0.7205 0.6344 1 581 582 18.010 0.000 0.7900 0.5703 1 581 584 1.008 0.000 0.7987 0.5938 1 581 585 18.010 0.000 0.7133 0.6210 1 581 854 13.979 0.000 0.7936 0.5999 1 581 855 31.989 0.000 0.7484 0.6446 1 581 864 13.979 0.000 0.8076 0.6886 1 581 865 31.989 0.000 0.7510 0.7103 1 581 876 31.989 0.000 0.7402 0.5804 1 584 855 30.982 0.000 0.7008 0.6106 1 590 591 -341.132 0.000 0.8154 0.7102 1 590 608 0.000 0.000 0.9660 0.8615 1 590 609 26.037 0.000 0.7046 0.5814 1 590 610 -144.043 0.000 0.7265 0.5943 1 590 612 -179.080 0.000 0.8836 0.7420 1 590 616 -179.080 0.000 0.8845 0.7133 1 590 617 -0.000 0.000 0.9481 0.7822 1 590 618 150.089 0.000 0.7504 0.5772 1 590 624 148.073 0.000 0.7103 0.5558 1 590 631 148.073 0.000 0.7541 0.5613 1 590 637 148.073 0.000 0.7824 0.5919 1 590 640 148.073 0.000 0.7309 0.5164 1 590 646 148.073 0.000 0.7619 0.5910 1 590 649 148.073 0.000 0.7407 0.5471 1 590 660 148.073 0.000 0.7574 0.5803 1 590 667 148.073 0.000 0.7661 0.5988 1 590 680 148.073 0.000 0.7571 0.5807 1 590 692 -441.309 0.000 0.7560 0.5830 1 590 696 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InChI=1S/C17H17NO3/c19-15-6-1-13(2-7-15)5-10-17(21)18-12-11-14-3-8-16(20)9-4-14/h1-10,19-20H,11-12H2,(H,18,21) 275228.03 0.0 0.0 261371.2 189994.61 374318.28 0.0 0.0 0.0 0.0 0.0 0.0 657.2691 16.17 16.17 0 8 2816469.833333333 558860.4999999999 2517725.333333333 2394441.8 2809667.2 3245300.5 611261.7 421775.2 643544.6 2180122.2 2701326.0 2671727.8 221.0812 9.07 9.07 0 34 Piplartine COc1cc(/C=C/C(=O)N2CCC=CC2=O)cc(OC)c1OC InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+ 221791.35 0.0 0.0 176658.31 234620.08 254095.66 0.0 0.0 0.0 0.0 0.0 0.0 318.1553 2.73 2.73 0 39 Salidroside OC[C@H]1O[C@@H](OCCc2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O InChI=1S/C14H20O7/c15-7-10-11(17)12(18)13(19)14(21-10)20-6-5-8-1-3-9(16)4-2-8/h1-4,10-19H,5-7H2/t10-,11-,12+,13-,14-/m1/s1 0.0 52860.58933333333 0.0 0.0 0.0 0.0 41872.816 91858.53 24850.422 0.0 0.0 0.0 337.1076 10.72 10.72 0 24 NCGC00180457-02!4-(1,3-benzodioxol-5-ylmethyl)-3-[(3,4-dimethoxyphenyl)methyl]oxolan-2-one [IIN-based on: CCMSLIB00000847667] COC1=C(OC)C=C(CC2C(CC3=CC4=C(OCO4)C=C3)COC2=O)C=C1 InChI=1S/C21H22O6/c1-23-17-5-3-14(9-19(17)24-2)8-16-15(11-25-21(16)22)7-13-4-6-18-20(10-13)27-12-26-18/h3-6,9-10,15-16H,7-8,11-12H2,1-2H3 26444.971666666668 0.0 0.0 25955.508 22812.979 30566.428 0.0 0.0 0.0 0.0 0.0 0.0 383.1495 10.26 10.26 0 24 36934.29166666666 0.0 0.0 25389.275 31115.264 54298.336 0.0 0.0 0.0 0.0 0.0 0.0 829.5075 15.34 15.34 0 26 804883.6 196144.298 59383.791000000005 685526.75 815109.25 914014.8 75437.234 159658.0 353337.66 43693.613 70475.96 63981.8 657.2424 8.02 8.02 0 4 66571.31999999999 69867.519 168822.34 85084.81 114629.15 0.0 68246.69 82128.07 59227.797 174289.83 171734.19 160443.0 265.0159 0.88 0.88 0 5 0.0 0.0 133119.37666666668 0.0 0.0 0.0 0.0 0.0 0.0 76045.69 148648.19 174664.25 205.0862 9.2 9.2 0 34 22311.65566666667 96724.72766666666 465856.08 33853.527 0.0 33081.44 83889.12 152183.86 54101.203 274340.44 465632.7 657595.1 205.1954 12.92 12.92 0 10 5-(5-methoxycarbonyl-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl)-3-methylpentanoic acid C=C1CCC2C(C)(C(=O)OC)CCCC2(C)C1CCC(C)CC(=O)O InChI=1S/C21H34O4/c1-14(13-18(22)23)7-9-16-15(2)8-10-17-20(16,3)11-6-12-21(17,4)19(24)25-5/h14,16-17H,2,6-13H2,1,3-5H3,(H,22,23) 96941.86 62649.37333333333 0.0 113712.71 72617.22 104495.65 52317.99 80189.28 55440.85 0.0 0.0 0.0 330.2069 5.18 5.18 0 15 0.0 8459.698666666667 85480.01833333333 0.0 0.0 0.0 0.0 25379.096 0.0 85283.09 71631.195 99525.77 341.1389 7.66 7.66 0 24 NCGC00347864-02!5-[6-(3-hydroxy-4-methoxyphenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-3-yl]-2-methoxyphenol COC1=CC=C(C=C1O)C2OCC3C2COC3C4=CC=C(OC)C(O)=C4 InChI=1S/C20H22O6/c1-23-17-5-3-11(7-15(17)21)19-13-9-26-20(14(13)10-25-19)12-4-6-18(24-2)16(22)8-12/h3-8,13-14,19-22H,9-10H2,1-2H3 1129719.1 1098249.9200000002 1077519.6 1095342.8 1178336.4 1115478.1 850709.06 1560996.1 883044.6 632805.3 1058922.6 1540830.9 357.2427 15.35 15.35 0 14 NCGC00380640-01!5-chloro-2,4-dihydroxy-6-methyl-3-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl]benzaldehyde CC(C)=CCC\\C(C)=C\\CC\\C(C)=C\\CC1=C(O)C(C=O)=C(C)C(Cl)=C1O InChI=1S/C23H31ClO3/c1-15(2)8-6-9-16(3)10-7-11-17(4)12-13-19-22(26)20(14-25)18(5)21(24)23(19)27/h8,10,12,14,26-27H,6-7,9,11,13H2,1-5H3/b16-10+,17-12+ 0.0 702158.4400000001 543226.86 0.0 0.0 0.0 271501.97 1605146.6 229826.75 433847.8 495496.22 700336.56 264.2325 12.76 12.76 0 100 ( )-alpha-Bisabolol - 40.0 eV nan nan 124967.39033333331 0.0 0.0 113017.586 109555.055 152329.53 0.0 0.0 0.0 0.0 0.0 0.0 637.2655 15.86 15.86 0 8 162986.05333333332 0.0 0.0 164884.28 138539.05 185534.83 0.0 0.0 0.0 0.0 0.0 0.0 618.428 13.74 13.74 0 3 265225.54333333333 0.0 0.0 263347.25 215806.6 316522.78 0.0 0.0 0.0 0.0 0.0 0.0 382.7086 4.9 4.9 0 102 431652.45333333337 8662.164666666666 0.0 418721.5 390011.8 486224.06 25986.494 0.0 0.0 0.0 0.0 0.0 585.4275 16.6 16.6 0 3 CHEBI:181245 CC(CC(O)C(O)C(C)(C)O)C1CCC2(C)C3CCC4C(C)(C(=O)OC5OC(CO)C(O)C(O)C5O)C(O)CC(O)C45CC35CCC12C InChI=1S/C36H60O12/c1-17(13-19(38)28(44)31(2,3)46)18-9-10-33(5)21-7-8-22-34(6,30(45)48-29-27(43)26(42)25(41)20(15-37)47-29)23(39)14-24(40)36(22)16-35(21,36)12-11-32(18,33)4/h17-29,37-44,46H,7-16H2,1-6H3 99371.713 0.0 0.0 104659.984 75141.195 118313.96 0.0 0.0 0.0 0.0 0.0 0.0 618.4283 12.54 12.54 0 3 702344.9533333333 91707.508 0.0 729179.7 673726.06 704129.1 22491.748 99794.336 152836.44 0.0 0.0 0.0 600.4174 16.43 16.43 0 3 55485.392 0.0 0.0 67716.88 29975.416 68763.88 0.0 0.0 0.0 0.0 0.0 0.0 320.2589 9.74 9.74 0 83 Knemolone D OC1=C(C(C)=O)C(CCCCCCCCC)=CC(O)=C1 InChI=1S/C17H26O3/c1-3-4-5-6-7-8-9-10-14-11-15(19)12-16(20)17(14)13(2)18/h11-12,19-20H,3-10H2,1-2H3 73807.28666666667 0.0 0.0 71811.125 55651.895 93958.84 0.0 0.0 0.0 0.0 0.0 0.0 269.1174 4.1 4.1 0 40 sophocarpine O=C1C=CCC2N1CC3CCCN4CCCC2C43 InChI=1S/C15H22N2O/c18-14-7-1-6-13-12-5-3-9-16-8-2-4-11(15(12)16)10-17(13)14/h1,7,11-13,15H,2-6,8-10H2 327851.2066666667 0.0 0.0 378298.84 234840.44 370414.34 0.0 0.0 0.0 0.0 0.0 0.0 600.4171 15.27 15.27 0 3 131894.92333333334 11505.894 0.0 119659.07 121484.92 154540.78 0.0 15737.02 18780.662 0.0 0.0 0.0 300.1447 1.27 1.27 0 6 36063.097 0.0 74263.74633333333 35292.766 29784.662 43111.863 0.0 0.0 0.0 34803.88 86404.445 101582.914 355.1545 7.42 7.42 0 24 0.0 119609.49 73272.97466666666 0.0 0.0 0.0 0.0 358828.47 0.0 59632.754 83596.04 76590.13 312.1083 1.26 1.26 0 72 CCG-208508 CollisionEnergy:102040 O=c1c(OC2OC(C(O)CO)C(O)C2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12 "InChI=1S/C21H20O12/c22-6-12(27)19-16(29)17(30)21(32-19)33-20-15(28)14-11(26)4-8(23)5-13(14)31-18(20)7-1-2-9(24)10(25)3-7/h1-5,12,16-17,19,21-27,29-30H,6H2/t12-,16-,17-,19?,21+/m1/s1" 122965.05166666668 0.0 0.0 122075.63 92100.695 154718.83 0.0 0.0 0.0 0.0 0.0 0.0 328.1548 4.02 4.02 0 16 13614866.333333334 3281078.633333333 1324452.9666666666 11712899.0 13696620.0 15435080.0 1916528.6 2483266.8 5443440.5 1335800.5 1380016.0 1257542.4 318.1342 8.02 8.02 0 2 Piplartine COc1cc(/C=C/C(=O)N2CCC=CC2=O)cc(OC)c1OC InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+ 95368.54133333334 0.0 33856.64233333333 98908.484 71310.4 115886.74 0.0 0.0 0.0 24866.23 35315.9 41387.797 274.1442 9.24 9.24 0 6 "4-(methylethyl)phenyl (2E)-3-(2,4-dimethoxyphenyl)prop-2-enoate CollisionEnergy:102040" COc1ccc(C=CC(=O)Oc2ccc(C(C)C)cc2)c(OC)c1 "InChI=1S/C20H22O4/c1-14(2)15-5-9-17(10-6-15)24-20(21)12-8-16-7-11-18(22-3)13-19(16)23-4/h5-14H,1-4H3/b12-8+" 853303.8166666668 0.0 0.0 950204.75 486842.1 1122864.6 0.0 0.0 0.0 0.0 0.0 0.0 300.1599 4.91 4.91 0 40 Armepavine COc1c(OC)cc2c(c1)CCN(C)[C@@H]2Cc1ccc(O)cc1 InChI=1S/C19H23NO3/c1-20-9-8-14-11-18(22-2)19(23-3)12-16(14)17(20)10-13-4-6-15(21)7-5-13/h4-7,11-12,17,21H,8-10H2,1-3H3/t17-/m1/s1 93100.46 0.0 0.0 97726.89 98594.14 82980.35 0.0 0.0 0.0 0.0 0.0 0.0 583.4151 15.47 15.47 0 3 906583.6533333332 280037.2833333333 0.0 920570.5 865163.06 934017.4 204302.83 290215.9 345593.12 0.0 0.0 0.0 298.1442 3.92 3.92 0 16 598248.4866666667 224300.02 686081.1166666666 528394.56 604438.9 661912.0 231970.44 203557.2 237372.42 662694.9 710768.2 684780.25 223.0863 8.83 8.83 0 34 832502.6666666666 0.0 0.0 434392.8 975610.3 1087504.9 0.0 0.0 0.0 0.0 0.0 0.0 871.5724 16.85 16.85 0 8 Chlorophyll a nan nan 61682.479 0.0 0.0 51573.727 66746.11 66727.6 0.0 0.0 0.0 0.0 0.0 0.0 282.0891 10.08 10.08 0 47 151890.6733333333 0.0 0.0 152043.55 127185.61 176442.86 0.0 0.0 0.0 0.0 0.0 0.0 811.4971 16.52 16.52 0 26 139041.03666666665 0.0 0.0 142407.11 139852.94 134863.06 0.0 0.0 0.0 0.0 0.0 0.0 613.4236 16.61 16.61 0 3 CHEBI:181879 CC1(CO)CC(O)[C@]2(C(=O)O)CCC34CC3(C=CC3[C@]5(C)C(CC[C@]34C)C(C)(CO)[C@@H](O)[C@H](O)[C@@H]5O)C2C1 InChI=1S/C30H46O8/c1-24(14-31)11-18-28-8-6-17-26(3,29(28,13-28)9-10-30(18,23(37)38)19(33)12-24)7-5-16-25(2,15-32)21(35)20(34)22(36)27(16,17)4/h6,8,16-22,31-36H,5,7,9-15H2,1-4H3,(H,37,38)/t16?,17?,18?,19?,20-,21-,22-,24?,25?,26+,27-,28?,29?,30-/m0/s1 33528.85533333333 0.0 0.0 32597.994 27888.422 40100.15 0.0 0.0 0.0 0.0 0.0 0.0 600.4175 14.18 14.18 0 89 0.0 37684.74733333333 5410.912 0.0 0.0 0.0 46429.746 31285.762 35338.734 16232.736 0.0 0.0 426.0669 8.81 8.81 0 2 84403.71966666666 24254.101666666666 0.0 77267.055 81480.62 94463.484 72762.305 0.0 0.0 0.0 0.0 0.0 300.1449 1.79 1.79 0 6 363056.6566666667 70624.94066666666 0.0 390148.16 288266.06 410755.75 108233.695 72425.92 31215.207 0.0 0.0 0.0 636.2951 16.78 16.78 0 8 106862.393 18516.080666666665 165590.04166666666 124763.21 79578.805 116245.164 0.0 55548.242 0.0 98673.375 202768.17 195328.58 684.2564 1.0 1.0 0 39 Manninotriose O=C[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO[C@H]1O[C@H](CO[C@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O InChI=1S/C18H32O16/c19-1-5(21)9(23)10(24)6(22)3-31-17-16(30)14(28)12(26)8(34-17)4-32-18-15(29)13(27)11(25)7(2-20)33-18/h1,5-18,20-30H,2-4H2/t5-,6+,7+,8+,9+,10+,11-,12-,13-,14-,15+,16+,17-,18-/m0/s1 126085.59 0.0 0.0 100134.09 118468.37 159654.31 0.0 0.0 0.0 0.0 0.0 0.0 272.1283 3.92 3.92 0 40 Coclaurine OC1=C(OC)C=C2C([C@@](CC3=CC=C(O)C=C3)([H])NCC2)=C1 InChI=1S/C17H19NO3/c1-21-17-9-12-6-7-18-15(14(12)10-16(17)20)8-11-2-4-13(19)5-3-11/h2-5,9-10,15,18-20H,6-8H2,1H3/t15-/m0/s1 84946.74333333333 80312.65466666665 89191.73666666665 95774.84 96472.29 62593.1 92545.734 76273.94 72118.29 99304.71 81280.4 86990.1 244.9471 0.87 0.87 0 1 39145.335666666666 0.0 0.0 38381.203 35326.754 43728.05 0.0 0.0 0.0 0.0 0.0 0.0 476.2283 3.83 3.83 0 44 100353.90333333332 25586.726666666666 0.0 92793.67 85656.98 122611.06 31454.15 0.0 45306.03 0.0 0.0 0.0 772.4765 14.88 14.88 0 66 0.0 9650.465 82829.009 0.0 0.0 0.0 0.0 28951.395 0.0 36146.207 94042.37 118298.45 233.1175 9.21 9.21 0 34 0.0 92094.07466666668 0.0 0.0 0.0 0.0 83404.164 119846.15 73031.91 0.0 0.0 0.0 532.2033 6.58 6.58 0 39 3-oxo-3-[[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(4-hydroxy-5-methyl-2-propan-2-ylphenoxy)oxan-2-yl]methoxy]propanoic acid Cc1cc(O[C@@H]2O[C@H](COC(=O)CC(=O)O)[C@@H](O)[C@H](O)[C@H]2O)c(C(C)C)cc1O InChI=1S/C19H26O10/c1-8(2)10-5-11(20)9(3)4-12(10)28-19-18(26)17(25)16(24)13(29-19)7-27-15(23)6-14(21)22/h4-5,8,13,16-20,24-26H,6-7H2,1-3H3,(H,21,22)/t13-,16-,17+,18-,19-/m1/s1 53036.492 0.0 65315.08866666667 49842.113 43390.293 65877.07 0.0 0.0 0.0 76082.9 56886.94 62975.426 289.0712 4.23 4.23 0 93 Cianidanol CollisionEnergy:102040 Oc1cc(O)c2c(c1)OC(c1ccc(O)c(O)c1)C(O)C2 "InChI=1S/C15H14O6/c16-8-4-11(18)9-6-13(20)15(21-14(9)5-8)7-1-2-10(17)12(19)3-7/h1-5,13,15-20H,6H2/t13-,15+/m0/s1" 3215133.5666666664 536181.7433333333 382610.2466666666 2370707.2 3300639.0 3974054.5 216410.25 366317.38 1025817.6 365496.9 350163.56 432170.28 318.1341 9.59 9.59 0 2 Piplartine COc1cc(/C=C/C(=O)N2CCC=CC2=O)cc(OC)c1OC InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+ 0.0 17882.679 14017.944 0.0 0.0 0.0 22924.176 0.0 30723.861 42053.832 0.0 0.0 518.1877 5.98 5.98 0 39 CHEBI:181517 O=C(Cc1ccccc1)OC[C@H]1O[C@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@@H]1O InChI=1S/C20H28O12/c21-7-10-13(23)15(25)17(27)19(30-10)32-20-18(28)16(26)14(24)11(31-20)8-29-12(22)6-9-4-2-1-3-5-9/h1-5,10-11,13-21,23-28H,6-8H2/t10-,11-,13-,14-,15+,16+,17-,18-,19-,20-/m1/s1 77881.11700000001 0.0 0.0 61047.98 113924.266 58671.105 0.0 0.0 0.0 0.0 0.0 0.0 342.1703 4.51 4.51 0 40 Mexiletine Cc1c(OCC(C)N)c(C)ccc1 InChI=1S/C11H17NO/c1-8-5-4-6-9(2)11(8)13-7-10(3)12/h4-6,10H,7,12H2,1-3H3 140666.7933333333 0.0 0.0 128958.945 124001.875 169039.56 0.0 0.0 0.0 0.0 0.0 0.0 625.2653 15.86 15.86 0 8 311571.0466666667 0.0 24015.666666666668 270933.16 323554.88 340225.1 0.0 0.0 0.0 0.0 28011.44 44035.56 335.1281 10.09 10.09 0 8 216987.52666666664 0.0 0.0 253082.52 198572.03 199308.03 0.0 0.0 0.0 0.0 0.0 0.0 599.4101 15.27 15.27 0 3 145026.28333333333 0.0 0.0 114052.44 152083.64 168942.77 0.0 0.0 0.0 0.0 0.0 0.0 462.2128 1.26 1.26 0 44 312785.99 0.0 138056.09333333335 228692.12 432698.38 276967.47 0.0 0.0 0.0 0.0 414168.28 0.0 236.1678 15.34 15.34 0 95 2099210.4333333336 348526.64 450492.58 1649422.1 2111082.2 2537127.0 157440.86 264584.62 623554.44 350854.56 507605.78 493017.4 221.0812 9.58 9.58 0 34 Piplartine COc1cc(/C=C/C(=O)N2CCC=CC2=O)cc(OC)c1OC InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+ 373315.2166666666 0.0 0.0 322206.75 189953.5 607785.4 0.0 0.0 0.0 0.0 0.0 0.0 607.2559 14.63 14.63 0 8 42942.59733333333 0.0 0.0 43388.78 44667.77 40771.242 0.0 0.0 0.0 0.0 0.0 0.0 353.952 1.04 1.04 0 59 676092.1533333333 357299.93999999994 1279404.8333333333 493571.4 854476.06 680229.0 720198.94 177442.5 174258.38 1108471.9 1252084.0 1477658.6 290.1392 8.19 8.19 0 6 Sibiricose A6 COc1cc(/C=C/C(=O)O[C@H]2[C@H](O)[C@@H](CO)O[C@@]2(CO)O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O InChI=1S/C23H32O15/c1-33-11-5-10(6-12(34-2)16(11)28)3-4-15(27)36-21-18(30)14(8-25)37-23(21,9-26)38-22-20(32)19(31)17(29)13(7-24)35-22/h3-6,13-14,17-22,24-26,28-32H,7-9H2,1-2H3/b4-3+/t13-,14-,17-,18-,19+,20-,21+,22-,23+/m1/s1 45382.10266666667 43728.121666666666 102897.27533333334 38596.59 45829.812 51719.906 28132.832 74467.51 28584.023 73627.266 88058.67 147005.89 343.2272 13.6 13.6 0 14 NCGC00169961-02!4-hydroxy-3-[(2E,6E)-4-hydroxy-3,7,11-trimethyldodeca-2,6,10-trienyl]benzoic acid [IIN-based: Match] CC(C)=CCC\\\\C(C)=C\\\\CC(O)C(\\\\C)=C\\\\CC1=C(O)C=CC(=C1)C(O)=O InChI=1S/C22H30O4/c1-15(2)6-5-7-16(3)8-12-20(23)17(4)9-10-18-14-19(22(25)26)11-13-21(18)24/h6,8-9,11,13-14,20,23-24H,5,7,10,12H2,1-4H3,(H,25,26)/b16-8+,17-9+ 0.0 0.0 203644.03333333333 0.0 0.0 0.0 0.0 0.0 0.0 315854.4 226089.56 68988.14 322.1083 10.06 10.06 0 8 Massbank:PR300611 Palmatine COC1=C(OC)C=C2C(CC[N+]3=C2C=C2C=CC(OC)=C(OC)C2=C3)=C1 1S/C21H22NO4/c1-23-18-6-5-13-9-17-15-11-20(25-3)19(24-2)10-14(15)7-8-22(17)12-16(13)21(18)26-4/h5-6,9-12H,7-8H2,1-4H3/q+1 173638.38 0.0 0.0 196083.92 145898.11 178933.11 0.0 0.0 0.0 0.0 0.0 0.0 618.4278 14.38 14.38 0 3 82664.93333333333 0.0 0.0 106073.39 42650.38 99271.03 0.0 0.0 0.0 0.0 0.0 0.0 342.2431 9.19 9.19 0 65 Methyl 3,4,5-trimethoxycinnamate COC(=O)/C=C/c1cc(OC)c(OC)c(OC)c1 InChI=1S/C13H16O5/c1-15-10-7-9(5-6-12(14)17-3)8-11(16-2)13(10)18-4/h5-8H,1-4H3/b6-5+ 0.0 47903.58266666666 0.0 0.0 0.0 0.0 28876.994 51744.16 63089.594 0.0 0.0 0.0 439.1581 3.76 3.76 0 29 85573.29166666667 79424.40333333334 89502.99866666667 95264.555 99530.46 61924.86 89143.15 76867.51 72262.55 95548.12 84927.766 88033.11 272.9423 0.87 0.87 0 1 0.0 0.0 204979.1 0.0 0.0 0.0 0.0 0.0 0.0 195702.8 249871.3 169363.2 328.1549 4.32 4.32 0 9 Matairesinol 4'-O-beta-gentiobioside O=C1OCC(CC2=CC=C(O)C(OC)=C2)C1CC3=CC=C(OC4OC(COC5OC(CO)C(O)C(O)C5O)C(O)C(O)C4O)C(OC)=C3 InChI=1S/C32H42O16/c1-42-20-9-14(3-5-18(20)34)7-16-12-44-30(41)17(16)8-15-4-6-19(21(10-15)43-2)46-32-29(40)27(38)25(36)23(48-32)13-45-31-28(39)26(37)24(35)22(11-33)47-31/h3-6,9-10,16-17,22-29,31-40H,7-8,11-13H2,1-2H3 0.0 0.0 838231.96 0.0 0.0 0.0 0.0 0.0 0.0 846978.06 1480250.9 187466.92 338.1027 10.46 10.46 0 8 42112957.333333336 956371.0 0.0 38257744.0 35211344.0 52869784.0 508414.6 1219918.9 1140779.5 0.0 0.0 0.0 593.2761 15.86 15.86 0 8 Pheophorbide A CCC1=C2C=C3C(=C4C(=O)C(C(=C5C(C(C(=N5)C=C6C(=C(C(=CC(=C1C)N2)N6)C=C)C)C)CCC(=O)O)C4=N3)C(=O)OC)C InChI=1S/C35H36N4O5/c1-8-19-15(3)22-12-24-17(5)21(10-11-28(40)41)32(38-24)30-31(35(43)44-7)34(42)29-18(6)25(39-33(29)30)14-27-20(9-2)16(4)23(37-27)13-26(19)36-22/h8,12-14,17,21,31,36-37H,1,9-11H2,2-7H3,(H,40,41) 76305.11333333333 0.0 0.0 68050.17 75337.89 85527.28 0.0 0.0 0.0 0.0 0.0 0.0 435.0615 8.02 8.02 0 20 Massbank:PR310505 Piperlongumine COC1=CC(C=CC(=O)N2CCC=CC2=O)=CC(OC)=C1OC 1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3 154029.39 23185.77133333333 0.0 155455.52 137206.62 169426.03 0.0 35315.984 34241.33 0.0 0.0 0.0 612.4175 16.61 16.61 0 3 Massbank:MSJ00113 Lycopene-5,6-diol CC(=CCC/C(=C/C=C/C(=C/C=C/C(=C/C=C/C=C(\\C)/C=C/C=C(\\C)/C=C/C(C(C)(CCC=C(C)C)O)O)/C)/C)/C)C 1S/C40H58O2/c1-32(2)18-13-22-36(7)25-15-27-37(8)26-14-23-34(5)20-11-12-21-35(6)24-16-28-38(9)29-30-39(41)40(10,42)31-17-19-33(3)4/h11-12,14-16,18-21,23-30,39,41-42H,13,17,22,31H2,1-10H3/b12-11+,23-14+,24-16+,27-15+,30-29+,34-20+,35-21+,36-25+,37-26+,38-28+ 117323.72866666668 119002.65666666668 262751.89666666667 145384.47 172040.45 34546.266 131642.14 124490.33 100875.5 303219.6 249149.78 235886.31 218.984 0.87 0.87 0 5 2,3,7,8-tetrahydroxychromeno[5,4,3-cde]chromene-5,10-dione O=C1OC2=C(O)C(O)=CC=3C(=O)OC=4C(O)=C(O)C=C1C4C23 InChI=1S/C14H6O8/c15-5-1-3-7-8-4(14(20)22-11(7)9(5)17)2-6(16)10(18)12(8)21-13(3)19/h1-2,15-18H 200841.05666666664 578221.0966666667 384812.9166666667 268075.7 0.0 334447.47 559826.6 786314.44 388522.25 489896.34 352193.88 312348.53 358.1135 1.23 1.23 0 6 DOPAMINE C1=CC(=C(C=C1CCN)O)O InChI=1S/C8H11NO2/c9-4-3-6-1-2-7(10)8(11)5-6/h1-2,5,10-11H,3-4,9H2 12077738.333333334 5892661.833333333 346421.5333333333 10982472.0 12602882.0 12647861.0 4946851.5 6344556.0 6386578.0 403845.53 410659.1 224759.97 300.16 3.11 3.11 0 40 Desvenlafaxine CN(C)CC(c1ccc(O)cc1)C1(O)CCCCC1 InChI=1S/C16H25NO2/c1-17(2)12-15(13-6-8-14(18)9-7-13)16(19)10-4-3-5-11-16/h6-9,15,18-19H,3-5,10-12H2,1-2H3 108844.325 0.0 0.0 97542.96 122748.96 106241.055 0.0 0.0 0.0 0.0 0.0 0.0 567.4201 16.88 16.88 0 3 NCGC00381199-01_C25H38O4_(3aR,5E,7S,10E,14E,16aS)-2,7-Dihydroxy-3-[(2S)-1-hydroxy-2-propanyl]-6,10,14,16a-tetramethyl-4,7,8,9,12,13,16,16a-octahydrocyclopenta[15]annulen-1(3aH)-one C[C@H](CO)C/1=C(O)/C(=O)[C@@]2(C)C/C=C(C)/CC/C=C(C)/CC[C@H](O)/C(=C/C[C@H]12)C InChI=1S/C25H38O4/c1-16-7-6-8-17(2)13-14-25(5)20(11-10-18(3)21(27)12-9-16)22(19(4)15-26)23(28)24(25)29/h7,10,13,19-21,26-28H,6,8-9,11-12,14-15H2,1-5H3/b16-7+,17-13+,18-10+/t19-,20-,21+,25+/m1/s1 0.0 39420.39766666666 534655.14 0.0 0.0 0.0 34913.543 83347.65 0.0 245448.62 536764.2 821752.6 233.1176 8.62 8.62 0 34 1505366.933333333 306836.0966666667 1100452.6333333333 1390511.2 1514129.1 1611460.5 301002.62 272343.47 347162.2 978093.0 1152374.4 1170890.5 310.1055 8.5 8.5 0 45 27340.142666666667 0.0 0.0 25897.883 26847.697 29274.848 0.0 0.0 0.0 0.0 0.0 0.0 566.4119 17.29 17.29 0 3 (2S,3S,4S,5R,6R)-6-[[(3S,4S,6aR,6bS,8R,8aR,9R,10R,12aS,14bR)-10-acetyloxy-8a-(acetyloxymethyl)-8,9-dihydroxy-4-(hydroxymethyl)-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-4-hydroxy-3,5-bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]oxane-2-carboxylic acid CC(=O)OC[C@@]12[C@@H](CC(C)(C)[C@@H](OC(C)=O)[C@@H]1O)C1=CCC3[C@@]4(C)CC[C@H](O[C@@H]5O[C@H](C(=O)O)[C@@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@H](O)[C@H]5O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@](C)(CO)C4CC[C@@]3(C)[C@]1(C)C[C@H]2O InChI=1S/C52H82O24/c1-21(56)69-20-52-24(15-47(3,4)42(41(52)66)70-22(2)57)23-9-10-28-48(5)13-12-30(49(6,19-55)27(48)11-14-50(28,7)51(23,8)16-29(52)58)73-46-39(75-45-36(64)34(62)32(60)26(18-54)72-45)37(65)38(40(76-46)43(67)68)74-44-35(63)33(61)31(59)25(17-53)71-44/h9,24-42,44-46,53-55,58-66H,10-20H2,1-8H3,(H,67,68)/t24-,25+,26+,27?,28?,29+,30-,31+,32+,33-,34-,35+,36+,37-,38-,39+,40-,41-,42-,44-,45-,46+,48-,49+,50+,51+,52-/m0/s1 0.0 0.0 67424.85666666667 0.0 0.0 0.0 0.0 0.0 0.0 76232.16 84202.91 41839.5 328.155 4.77 4.77 0 9 Laetanine OC=1C=C2C=3C(OC)=C(O)C=C4C3C(NCC4)CC2=CC1OC InChI=1S/C18H19NO4/c1-22-15-7-10-5-12-16-9(3-4-19-12)6-14(21)18(23-2)17(16)11(10)8-13(15)20/h6-8,12,19-21H,3-5H2,1-2H3 70560.56333333334 0.0 134815.88999999998 211681.69 0.0 0.0 0.0 0.0 0.0 0.0 202693.05 201754.62 236.1679 6.49 6.49 0 95 1854549.9666666668 299231.5733333333 75251.13666666667 1476633.0 1799511.4 2287505.5 99241.51 171530.11 626923.1 59722.26 93331.52 72699.63 635.2606 9.34 9.34 0 28 161953.92333333334 0.0 0.0 150366.55 85156.19 250339.03 0.0 0.0 0.0 0.0 0.0 0.0 689.2459 12.73 12.73 0 7 3247465.9 29244.563666666665 0.0 2740867.2 1880342.0 5121188.5 21040.105 66693.586 0.0 0.0 0.0 0.0 593.2767 16.09 16.09 0 8 Pheophorbide A CCC1=C2C=C3C(=C4C(=O)C(C(=C5C(C(C(=N5)C=C6C(=C(C(=CC(=C1C)N2)N6)C=C)C)C)CCC(=O)O)C4=N3)C(=O)OC)C InChI=1S/C35H36N4O5/c1-8-19-15(3)22-12-24-17(5)21(10-11-28(40)41)32(38-24)30-31(35(43)44-7)34(42)29-18(6)25(39-33(29)30)14-27-20(9-2)16(4)23(37-27)13-26(19)36-22/h8,12-14,17,21,31,36-37H,1,9-11H2,2-7H3,(H,40,41) 0.0 40408.638 273287.74333333335 0.0 0.0 0.0 0.0 121225.914 0.0 160991.28 272162.75 386709.2 356.1257 9.93 9.93 0 24 NCGC00180457-02!4-(1,3-benzodioxol-5-ylmethyl)-3-[(3,4-dimethoxyphenyl)methyl]oxolan-2-one COC1=C(OC)C=C(CC2C(CC3=CC4=C(OCO4)C=C3)COC2=O)C=C1 InChI=1S/C21H22O6/c1-23-17-5-3-14(9-19(17)24-2)8-16-15(11-25-21(16)22)7-13-4-6-18-20(10-13)27-12-26-18/h3-6,9-10,15-16H,7-8,11-12H2,1-2H3 68019.63466666666 0.0 0.0 95463.77 59768.574 48826.56 0.0 0.0 0.0 0.0 0.0 0.0 583.415 15.19 15.19 0 3 21193177.33333333 8559107.666666666 24802043.33333333 20239336.0 21203882.0 22136314.0 8422756.0 8399657.0 8854910.0 22257942.0 25650084.0 26498104.0 340.1158 8.83 8.83 0 45 33726.27066666667 313568.98666666663 228224.21333333332 33348.746 42792.996 25037.07 291931.3 351320.72 297454.94 183593.42 273341.06 227738.16 281.0925 5.57 5.57 0 5 2-oxindole-3-acetic acid CollisionEnergy:205060 C1=CC=C2C(=C1)C(C(=O)N2)CC(=O)O "InChI=1S/C10H9NO3/c12-9(13)5-7-6-3-1-2-4-8(6)11-10(7)14/h1-4,7H,5H2,(H,11,14)(H,12,13)" 266827.99666666664 122149.98533333332 250643.55666666667 270095.03 259860.08 270528.88 131850.42 100671.586 133927.95 255792.23 248115.66 248022.78 435.0615 8.81 8.81 0 20 Massbank:PR310505 Piperlongumine COC1=CC(C=CC(=O)N2CCC=CC2=O)=CC(OC)=C1OC 1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3 67041.302 0.0 0.0 70686.75 68141.59 62295.566 0.0 0.0 0.0 0.0 0.0 0.0 986.6051 15.63 15.63 0 18 Spectral Match to Dilinolenin (9c,12c,15c) from NIST14 nan nan 52167.94033333333 0.0 0.0 47755.387 45601.516 63146.918 0.0 0.0 0.0 0.0 0.0 0.0 650.3076 9.37 9.37 0 28 70895.58333333333 607687.9333333333 656989.5833333334 212686.75 0.0 0.0 0.0 667507.2 1155556.6 0.0 1192548.0 778420.75 565.5673 16.89 16.89 0 50 17884.443333333333 87290.645 18450.676666666663 0.0 53653.33 0.0 78788.65 79377.16 103706.125 55352.03 0.0 0.0 274.9364 1.05 1.05 0 84 145101.62 0.0 0.0 144949.86 116104.39 174250.61 0.0 0.0 0.0 0.0 0.0 0.0 360.2172 4.59 4.59 0 38 250006.1 27898.898666666664 574126.2666666667 222296.36 230677.1 297044.84 34732.598 0.0 48964.098 353842.0 704732.3 663804.5 599.1978 5.08 5.08 0 54 1824254.9 128726.13333333336 0.0 0.0 3255783.5 2216981.2 0.0 0.0 386178.4 0.0 0.0 0.0 799.5333 14.31 14.31 0 26 54243.87 0.0 0.0 48034.07 48831.6 65865.94 0.0 0.0 0.0 0.0 0.0 0.0 315.0868 9.82 9.82 0 8 1088104.7966666666 96370.50433333336 0.0 1244586.2 1036351.75 983376.44 42212.133 133332.2 113567.18 0.0 0.0 0.0 600.4178 14.83 14.83 0 3 77469.06333333334 72952.918 65985.97666666667 79567.52 74849.96 77989.71 54955.336 111575.91 52327.508 68290.19 63318.22 66349.52 231.1383 11.92 11.92 0 30 p-methoxycinnamic acid ethyl ester O=C(OCC)C=CC1=CC=C(OC)C=C1 InChI=1S/C12H14O3/c1-3-15-12(13)9-6-10-4-7-11(14-2)8-5-10/h4-9H,3H2,1-2H3 103827.27166666668 105993.94133333332 132579.13 96015.83 105440.18 110025.805 86858.93 125389.414 105733.48 106530.87 146190.94 145015.58 345.0935 8.81 8.81 0 2 Piplartine COc1cc(/C=C/C(=O)N2CCC=CC2=O)cc(OC)c1OC InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+ 101155.49333333332 10019.057333333332 0.0 97303.23 83807.0 122356.25 30057.172 0.0 0.0 0.0 0.0 0.0 419.201 6.85 6.85 0 57 270668.5533333333 0.0 0.0 255402.61 252879.45 303723.6 0.0 0.0 0.0 0.0 0.0 0.0 540.1898 4.84 4.84 0 60 NCGC00169057-02_C17H26O11_Methyl (1S,4aS,5R,7S,7aS)-1-(beta-D-glucopyranosyloxy)-5,7-dihydroxy-7-methyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylate COC(=O)\\C1=C\\O[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]3[C@@H]1[C@H](O)C[C@]3(C)O InChI=1S/C17H26O11/c1-17(24)3-7(19)9-6(14(23)25-2)5-26-15(10(9)17)28-16-13(22)12(21)11(20)8(4-18)27-16/h5,7-13,15-16,18-22,24H,3-4H2,1-2H3/t7-,8-,9+,10-,11-,12+,13-,15+,16+,17+/m1/s1 27368.869999999995 0.0 15883.429666666669 26848.44 22267.873 32990.297 0.0 0.0 0.0 0.0 23298.514 24351.775 276.1599 8.58 8.58 0 6 (2E)-3-(4-chlorophenyl)-1-piperidylprop-2-en-1-one CollisionEnergy:102040 O=C(C=Cc1ccc(Cl)cc1)N1CCCCC1 "InChI=1S/C14H16ClNO/c15-13-7-4-12(5-8-13)6-9-14(17)16-10-2-1-3-11-16/h4-9H,1-3,10-11H2/b9-6+" 28464.890666666663 33786.57033333334 0.0 39860.418 45534.254 0.0 0.0 36376.008 64983.703 0.0 0.0 0.0 402.1398 6.11 6.11 0 75 338223.8333333333 0.0 33871.166666666664 478944.5 535727.0 0.0 0.0 0.0 0.0 0.0 0.0 101613.5 319.1373 9.58 9.58 0 81 57568.91333333333 0.0 0.0 56849.06 58954.176 56903.504 0.0 0.0 0.0 0.0 0.0 0.0 359.2057 5.54 5.54 0 38 201764.25666666668 0.0 0.0 107174.18 84732.15 413386.44 0.0 0.0 0.0 0.0 0.0 0.0 535.2705 16.35 16.35 0 8 1928953.566666667 2529718.8666666667 0.0 2069788.1 1606132.4 2110940.2 1898568.6 2986029.5 2704558.5 0.0 0.0 0.0 330.2068 5.52 5.52 0 15 227844.9233333333 0.0 0.0 213533.53 130623.86 339377.38 0.0 0.0 0.0 0.0 0.0 0.0 623.2505 14.05 14.05 0 8 3.10S-Hydroxypheophorbide a OC(CC[C@H]1[C@@H](C2=N/C1=C([C@](C(OC)=O)(O)C3=O)\\C4=C3C(C)=C(N4)/C=C5N=C(C(C)=C\\5CC)/C=C(N/6)/C(C=C)=C(C6=C\\2)C)C)=O InChI=1S/C35H36N4O6/c1-8-19-15(3)22-12-24-17(5)21(10-11-28(40)41)31(38-24)30-32-29(33(42)35(30,44)34(43)45-7)18(6)25(39-32)14-27-20(9-2)16(4)23(37-27)13-26(19)36-22/h8,12-14,17,21,36,39,44H,1,9-11H2,2-7H3,(H,40,41)/t17-,21-,35-/m0/s1 255730.6366666667 0.0 0.0 230749.38 208404.69 328037.84 0.0 0.0 0.0 0.0 0.0 0.0 808.5572 16.43 16.43 0 18 0.0 0.0 1639421.2933333332 0.0 0.0 0.0 0.0 0.0 0.0 2090844.4 2407958.2 419461.28 266.0814 8.39 8.39 0 8 Spectral Match to trans-Ferulic acid from NIST14 COC1=C(C=CC(=C1)/C=C/C(=O)O)O InChI=1S/C10H10O4/c1-14-9-6-7(2-4-8(9)11)3-5-10(12)13/h2-6,11H,1H3,(H,12,13)/b5-3+ 647353.6466666666 142275.24666666667 0.0 675282.4 608800.6 657977.94 112134.54 220161.39 94529.81 0.0 0.0 0.0 620.3004 17.22 17.22 0 8 42219.623666666674 300877.66 1010321.2333333334 41298.027 34759.906 50600.938 159068.2 613110.25 130454.53 529130.56 978788.94 1523044.2 205.1954 13.2 13.2 0 10 Bisabolol CollisionEnergy:205060 CC(C)=CCCC(C)(O)C1CC=C(C)CC1 "InChI=1S/C15H26O/c1-12(2)6-5-11-15(4,16)14-9-7-13(3)8-10-14/h6-7,14,16H,5,8-11H2,1-4H3" 206500.4233333333 57979.95066666667 222233.67666666667 199884.69 194573.72 225042.86 57209.49 58732.03 57998.332 214362.84 222920.5 229417.69 735.1849 8.83 8.83 0 2 202608.3953333333 0.0 0.0 138504.9 38907.316 430412.97 0.0 0.0 0.0 0.0 0.0 0.0 501.26 6.87 6.87 0 2 Piperlongumine CollisionEnergy:102040 COc1cc(C=CC(=O)N2CCC=CC2=O)cc(OC)c1OC "InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+" 13148969.0 3433567.833333333 4565558.5 12938732.0 12658942.0 13849233.0 2558223.5 3752168.5 3990311.5 6027316.0 5456652.0 2212707.5 314.1756 4.83 4.83 0 40 O-methylarmepavine [H][C@@]1(CC2=CC=C(OC)C=C2)C3=CC(OC)=C(OC)C=C3CCN1C InChI=1S/C20H25NO3/c1-21-10-9-15-12-19(23-3)20(24-4)13-17(15)18(21)11-14-5-7-16(22-2)8-6-14/h5-8,12-13,18H,9-11H2,1-4H3/t18-/m1/s1 51397.756 0.0 0.0 54415.656 43082.312 56695.3 0.0 0.0 0.0 0.0 0.0 0.0 460.2335 3.54 3.54 0 44 271685.7 99059.27033333332 326633.2066666667 246474.88 265090.34 303491.88 105031.24 90311.055 101835.516 309112.53 336924.03 333863.06 206.0577 8.83 8.83 0 34 9-methoxy-7H-furo[3,2-g]chromen-7-one O=C1OC2=C(OC)C=3OC=CC3C=C2C=C1 InChI=1S/C12H8O4/c1-14-12-10-8(4-5-15-10)6-7-2-3-9(13)16-11(7)12/h2-6H,1H3 8879.985 7996.701333333333 16006.041666666666 26639.955 0.0 0.0 23990.104 0.0 0.0 0.0 0.0 48018.125 388.2548 4.22 4.22 0 36 68518.92866666666 0.0 0.0 58047.65 70956.766 76552.37 0.0 0.0 0.0 0.0 0.0 0.0 566.4117 16.61 16.61 0 3 (2S,3S,4S,5R,6R)-6-[[(3S,4S,6aR,6bS,8R,8aR,9R,10R,12aS,14bR)-10-acetyloxy-8a-(acetyloxymethyl)-8,9-dihydroxy-4-(hydroxymethyl)-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-4-hydroxy-3,5-bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]oxane-2-carboxylic acid CC(=O)OC[C@@]12[C@@H](CC(C)(C)[C@@H](OC(C)=O)[C@@H]1O)C1=CCC3[C@@]4(C)CC[C@H](O[C@@H]5O[C@H](C(=O)O)[C@@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@H](O)[C@H]5O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@](C)(CO)C4CC[C@@]3(C)[C@]1(C)C[C@H]2O InChI=1S/C52H82O24/c1-21(56)69-20-52-24(15-47(3,4)42(41(52)66)70-22(2)57)23-9-10-28-48(5)13-12-30(49(6,19-55)27(48)11-14-50(28,7)51(23,8)16-29(52)58)73-46-39(75-45-36(64)34(62)32(60)26(18-54)72-45)37(65)38(40(76-46)43(67)68)74-44-35(63)33(61)31(59)25(17-53)71-44/h9,24-42,44-46,53-55,58-66H,10-20H2,1-8H3,(H,67,68)/t24-,25+,26+,27?,28?,29+,30-,31+,32+,33-,34-,35+,36+,37-,38-,39+,40-,41-,42-,44-,45-,46+,48-,49+,50+,51+,52-/m0/s1 0.0 43649.513 0.0 0.0 0.0 0.0 50021.406 41757.11 39170.023 0.0 0.0 0.0 311.0669 4.84 4.84 0 5 871643.5833333334 145855.892 37217.99333333334 692433.9 849416.75 1073080.1 51917.496 82953.15 302697.03 31743.922 44608.562 35301.496 538.2076 9.33 9.33 0 28 57544.024333333335 8203.115333333333 0.0 37637.348 64985.105 70009.62 0.0 24609.346 0.0 0.0 0.0 0.0 518.3245 11.25 11.25 0 23 Sphingomyelin (d18:1/18:0) CollisionEnergy:102040 CCCCCCCCCCCCC/C=C/[C@@H](O)[C@H](COP(=O)(O)OCC[N+](C)(C)C)N=C(O)CCCCCCCCCCCCCCCCC "InChI=1S/C41H83N2O6P/c1-6-8-10-12-14-16-18-20-21-23-25-27-29-31-33-35-41(45)42-39(38-49-50(46,47)48-37-36-43(3,4)5)40(44)34-32-30-28-26-24-22-19-17-15-13-11-9-7-2/h32,34,39-40,44H,6-31,33,35-38H2,1-5H3,(H-,42,45,46,47)/p+1/b34-32+/t39-,40+/m0/s1" 44954.87533333333 40970.831 0.0 40952.742 49153.254 44758.63 31247.996 49926.97 41737.527 0.0 0.0 0.0 316.1913 4.54 4.54 0 15 0.0 0.0 209397.1533333333 0.0 0.0 0.0 0.0 0.0 0.0 257821.77 256640.92 113728.77 344.0897 10.06 10.06 0 8 111608.27666666669 0.0 0.0 110738.74 90263.17 133822.92 0.0 0.0 0.0 0.0 0.0 0.0 583.4153 14.6 14.6 0 3 377506.0 7061.672 44393.96433333334 315170.03 390879.47 426468.5 0.0 0.0 21185.016 37233.3 46396.82 49551.773 247.0604 3.54 3.54 0 19 naringenin CollisionEnergy:102040 O=C1CC(c2ccc(O)cc2)Oc2cc(O)cc(O)c21 "InChI=1S/C15H12O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-6,13,16-18H,7H2" 39043.55 0.0 0.0 38637.453 38996.957 39496.24 0.0 0.0 0.0 0.0 0.0 0.0 353.1023 10.79 10.79 0 24 N-(3,5-dioxo-10-oxa-4-azatricyclo[5.2.1.0~2,6~]dec-8-en-4-yl)-2-methoxybenzamide COc1ccccc1C(=O)NN1C(=O)C2C3C=CC(O3)C2C1=O InChI=1S/C16H14N2O5/c1-22-9-5-3-2-4-8(9)14(19)17-18-15(20)12-10-6-7-11(23-10)13(12)16(18)21/h2-7,10-13H,1H3,(H,17,19) 59169.37833333333 361881.4 0.0 94066.945 0.0 83441.19 0.0 0.0 1085644.2 0.0 0.0 0.0 234.0973 16.69 16.69 0 85 0.0 0.0 367320.3533333333 0.0 0.0 0.0 0.0 0.0 0.0 403680.12 509921.1 188359.84 314.1393 3.79 3.79 0 8 0.0 0.0 78599.52799999999 0.0 0.0 0.0 0.0 0.0 0.0 115389.14 81766.664 38642.78 327.1434 3.67 3.67 0 40 106974.828 83953.87666666666 113046.305 105158.91 105678.66 110086.914 77934.3 85682.04 88245.29 101923.125 120823.76 116392.03 420.0594 8.82 8.82 0 12 23986758.0 693757.53 0.0 23902842.0 20021526.0 28035906.0 504555.28 689156.56 887560.75 0.0 0.0 0.0 330.2068 6.02 6.02 0 15 211957.28000000003 0.0 0.0 198444.06 162756.38 274671.4 0.0 0.0 0.0 0.0 0.0 0.0 631.2532 15.63 15.63 0 67 19254.126666666667 33548.32 24544.25533333333 0.0 0.0 57762.38 0.0 100644.96 0.0 0.0 73632.766 0.0 780.5537 16.35 16.35 0 23 Spectral Match to N-Oleoyl-D-erythro-sphingosylphosphorylcholine from NIST14 CCCCCCCCCCCCC/C=C/[C@H]([C@H](COP(=O)([O-])OCC[N+](C)(C)C)NC(=O)CCCCCCC/C=C\\CCCCCCCC)O InChI=1S/C41H81N2O6P/c1-6-8-10-12-14-16-18-20-21-23-25-27-29-31-33-35-41(45)42-39(38-49-50(46,47)48-37-36-43(3,4)5)40(44)34-32-30-28-26-24-22-19-17-15-13-11-9-7-2/h20-21,32,34,39-40,44H,6-19,22-31,33,35-38H2,1-5H3,(H-,42,45,46,47)/b21-20-,34-32+/t39-,40+/m0/s1 271740.0633333333 86026.00666666667 0.0 268036.75 273702.44 273481.0 89311.234 55893.176 112873.61 0.0 0.0 0.0 358.2018 5.54 5.54 0 38 714062.2200000001 106701.662 0.0 612714.56 733586.4 795885.7 66870.586 113740.3 139494.1 0.0 0.0 0.0 434.1815 4.07 4.07 0 35 NCGC00347814-02 CC(=O)N1CCc2c(c(OC3OC(COC4OCC(O)(CO)C4O)C(O)C(O)C3O)c(O)cc2)C1Cc1ccc(O)cc1 InChI=1S/C29H37NO13/c1-14(32)30-9-8-16-4-7-19(34)25(21(16)18(30)10-15-2-5-17(33)6-3-15)43-27-24(37)23(36)22(35)20(42-27)11-40-28-26(38)29(39,12-31)13-41-28/h2-7,18,20,22-24,26-28,31,33-39H,8-13H2,1H3 99485.21 29599.903666666665 0.0 88982.4 105159.06 104314.17 43298.598 0.0 45501.113 0.0 0.0 0.0 298.1446 3.12 3.12 0 40 29264.81466666666 0.0 0.0 23697.787 30628.602 33468.055 0.0 0.0 0.0 0.0 0.0 0.0 321.142 8.02 8.02 0 81 0.0 0.0 102731.413 0.0 0.0 0.0 0.0 0.0 0.0 79599.945 192036.2 36558.094 296.0923 9.02 9.02 0 8 KU036-6-1 O=C1C2=C(O)C(OC)=C(OC)C=C2OC(C3=CC=C(O)C=C3)=C1 InChI=1S/C17H14O6/c1-21-14-8-13-15(16(20)17(14)22-2)11(19)7-12(23-13)9-3-5-10(18)6-4-9/h3-8,18,20H,1-2H3 14583.843666666668 0.0 31655.139333333336 22201.873 0.0 21549.658 0.0 0.0 0.0 0.0 35188.504 59776.914 448.2337 7.89 7.89 0 86 134471.02 0.0 0.0 119309.87 111484.07 172619.12 0.0 0.0 0.0 0.0 0.0 0.0 609.2704 15.87 15.87 0 8 45399.757666666665 0.0 0.0 28846.504 47869.902 59482.867 0.0 0.0 0.0 0.0 0.0 0.0 476.2411 13.99 13.99 0 4 0.0 453751.2933333334 307794.58 0.0 0.0 0.0 173333.48 1035177.56 152742.84 262315.72 267972.3 393095.72 205.1954 12.76 12.76 0 10 Bisabolol CollisionEnergy:205060 CC(C)=CCCC(C)(O)C1CC=C(C)CC1 "InChI=1S/C15H26O/c1-12(2)6-5-11-15(4,16)14-9-7-13(3)8-10-14/h6-7,14,16H,5,8-11H2,1-4H3" 1461739.6 0.0 0.0 1461512.6 1029826.0 1893880.2 0.0 0.0 0.0 0.0 0.0 0.0 673.2638 15.58 15.58 0 63 45767.42333333334 44944.742666666665 132585.87000000002 59018.504 78283.766 0.0 40740.895 55550.293 38543.04 136306.72 135368.2 126082.69 382.9291 0.88 0.88 0 5 42837.04033333333 0.0 0.0 45018.977 33272.742 50219.402 0.0 0.0 0.0 0.0 0.0 0.0 367.2632 13.7 13.7 0 3 alisol A 24-acetate CC(=O)O[C@H]([C@@H](O)C[C@@H](C)C1=C2C[C@H](O)[C@H]3[C@@]4(C)CCC(=O)C(C)(C)[C@@H]4CC[C@]3(C)[C@@]2(C)CC1)C(C)(C)O InChI=1S/C32H52O6/c1-18(16-23(35)27(29(5,6)37)38-19(2)33)20-10-14-31(8)21(20)17-22(34)26-30(7)13-12-25(36)28(3,4)24(30)11-15-32(26,31)9/h18,22-24,26-27,34-35,37H,10-17H2,1-9H3/t18-,22+,23+,24+,26+,27-,30+,31+,32+/m1/s1 709199.1033333334 132948.62166666667 0.0 702276.56 637060.25 788260.5 104546.305 140956.5 153343.06 0.0 0.0 0.0 285.1488 6.06 6.06 0 15 359019.2133333334 24041.286666666667 0.0 250272.52 489992.72 336792.4 0.0 0.0 72123.86 0.0 0.0 0.0 221.0811 10.04 10.04 0 34 Piplartine COc1cc(/C=C/C(=O)N2CCC=CC2=O)cc(OC)c1OC InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+ 87698.33133333332 0.0 0.0 79118.234 50836.43 133140.33 0.0 0.0 0.0 0.0 0.0 0.0 639.2455 13.85 13.85 0 7 50654.566 0.0 0.0 38699.91 50087.53 63176.258 0.0 0.0 0.0 0.0 0.0 0.0 635.2606 10.41 10.41 0 2 42413.43666666667 0.0 0.0 36767.992 45897.4 44574.918 0.0 0.0 0.0 0.0 0.0 0.0 299.1646 12.53 12.53 0 14 217301.67666666667 26067.226666666666 0.0 170534.75 210539.94 270830.34 0.0 0.0 78201.68 0.0 0.0 0.0 538.2075 9.59 9.59 0 17 33431.375 0.0 0.0 25543.879 27970.504 46779.742 0.0 0.0 0.0 0.0 0.0 0.0 597.2213 10.08 10.08 0 4 59795.451 0.0 0.0 52959.543 73741.19 52685.62 0.0 0.0 0.0 0.0 0.0 0.0 870.5657 16.37 16.37 0 8 0.0 24810.786666666667 990691.2866666669 0.0 0.0 0.0 0.0 74432.36 0.0 340989.56 1108597.5 1522486.8 323.1282 16.85 16.85 0 24 4,4'-Dimethoxychalcone COc1ccc(/C=C/C(=O)c2ccc(OC)cc2)cc1 InChI=1S/C17H16O3/c1-19-15-8-3-13(4-9-15)5-12-17(18)14-6-10-16(20-2)11-7-14/h3-12H,1-2H3/b12-5+ 107636.05366666667 27970.773666666664 127714.18133333333 92748.625 120790.336 109369.2 26537.266 25728.303 31646.752 126910.164 126287.07 129945.31 221.0812 7.29 7.29 0 34 Piplartine COc1cc(/C=C/C(=O)N2CCC=CC2=O)cc(OC)c1OC InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+ 467941.4266666667 198893.78666666665 549015.2466666667 456339.5 470675.9 476808.88 197039.73 195060.83 204580.8 515420.34 565085.4 566540.0 356.0897 8.83 8.83 0 6 9368202.666666666 2099740.933333333 813360.5833333334 8045773.0 9231600.0 10827235.0 1185974.8 1579623.5 3533624.5 820527.25 844201.7 775352.8 221.0811 8.02 8.02 0 34 Piplartine COc1cc(/C=C/C(=O)N2CCC=CC2=O)cc(OC)c1OC InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+ 3469276.1666666665 242966.09666666668 0.0 3323755.5 2862829.0 4221244.0 294518.6 227011.02 207368.67 0.0 0.0 0.0 382.7086 5.13 5.13 0 102 252135.6833333333 0.0 0.0 144684.55 230390.78 381331.72 0.0 0.0 0.0 0.0 0.0 0.0 743.4345 15.31 15.31 0 26 0.0 0.0 141062.9 0.0 0.0 0.0 0.0 0.0 0.0 145025.31 139742.36 138421.03 344.1497 6.58 6.58 0 6 Moupinamide O=C(C=CC1=CC=C(O)C(OC)=C1)NCCC2=CC=C(O)C=C2 InChI=1S/C18H19NO4/c1-23-17-12-14(4-8-16(17)21)5-9-18(22)19-11-10-13-2-6-15(20)7-3-13/h2-9,12,20-21H,10-11H2,1H3,(H,19,22) 221608.77333333332 0.0 15479.052333333331 230531.23 150892.19 283402.9 0.0 0.0 0.0 0.0 23822.027 22615.13 727.2078 4.84 4.84 0 37 17353-03-6 C[C@@H]1O[C@@H](O[C@H]2[C@H](Oc3cc(O)c4c(=O)c(O)c(-c5ccc(O)cc5)oc4c3)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O InChI=1S/C27H30O15/c1-9-17(31)20(34)23(37)26(38-9)42-25-21(35)18(32)15(8-28)41-27(25)39-12-6-13(30)16-14(7-12)40-24(22(36)19(16)33)10-2-4-11(29)5-3-10/h2-7,9,15,17-18,20-21,23,25-32,34-37H,8H2,1H3/t9-,15+,17-,18+,20+,21-,23+,25+,26-,27+/m0/s1 22205.164666666667 18221.888666666666 45963.17966666666 30661.984 35953.51 0.0 0.0 30792.254 23873.412 33893.625 55402.07 48593.844 260.0104 0.87 0.87 0 5 249403.56 86198.15666666666 289897.78 237552.64 244925.44 265732.6 65327.67 124702.24 68564.56 182261.75 275230.06 412201.53 370.1413 10.49 10.49 0 24 49733.83433333333 0.0 0.0 47010.863 47769.37 54421.27 0.0 0.0 0.0 0.0 0.0 0.0 342.0824 4.39 4.39 0 31 92756.45166666666 0.0 0.0 104431.06 81787.24 92051.055 0.0 0.0 0.0 0.0 0.0 0.0 415.3 15.19 15.19 0 3 CHEBI:181076 CC(=O)O[C@@H]1CC2C(/C=C(\\C)C(=O)[C@@]3(O)C[C@@H](C)[C@H](OC(=O)c4ccccc4)C3/C=C/1C)C2(C)C InChI=1S/C29H36O6/c1-16-12-23-25(35-27(32)20-10-8-7-9-11-20)18(3)15-29(23,33)26(31)17(2)13-21-22(28(21,5)6)14-24(16)34-19(4)30/h7-13,18,21-25,33H,14-15H2,1-6H3/b16-12+,17-13+/t18-,21?,22?,23?,24-,25+,29-/m1/s1 111026.86 83691.95166666666 0.0 85912.46 113133.82 134034.3 57871.145 99182.27 94022.44 0.0 0.0 0.0 643.2895 17.06 17.06 0 8 48572.51233333334 44929.85666666667 49910.793 54626.785 54707.94 36382.812 53545.68 41897.48 39346.41 56053.367 45887.348 47791.664 249.926 0.87 0.87 0 1 166266.12 0.0 0.0 113183.9 205369.44 180245.02 0.0 0.0 0.0 0.0 0.0 0.0 272.1285 3.31 3.31 0 40 Higenamine OC1=CC=C(C=C1)CC2NCCC3=CC(O)=C(O)C=C32 InChI=1S/C16H17NO3/c18-12-3-1-10(2-4-12)7-14-13-9-16(20)15(19)8-11(13)5-6-17-14/h1-4,8-9,14,17-20H,5-7H2 31271.600333333336 9543.895333333334 57505.493333333325 45247.156 48567.645 0.0 28631.686 0.0 0.0 66567.06 49736.72 56212.7 743.1928 8.83 8.83 0 2 0.0 0.0 590687.2533333333 0.0 0.0 0.0 0.0 0.0 0.0 713830.25 912262.06 145969.45 310.108 10.26 10.26 0 8 KU036-6-1 O=C1C2=C(O)C(OC)=C(OC)C=C2OC(C3=CC=C(O)C=C3)=C1 InChI=1S/C17H14O6/c1-21-14-8-13-15(16(20)17(14)22-2)11(19)7-12(23-13)9-3-5-10(18)6-4-9/h3-8,18,20H,1-2H3 242919.5433333333 0.0 0.0 233125.08 196033.45 299600.1 0.0 0.0 0.0 0.0 0.0 0.0 723.3506 6.79 6.79 0 57 0.0 0.0 41252.375 0.0 0.0 0.0 0.0 0.0 0.0 41388.895 48596.664 33771.566 251.107 5.32 5.32 0 9 824088.6699999999 226499.30333333332 85508.45666666667 686529.2 811898.75 973838.06 153243.8 132153.67 394100.44 101039.41 84394.02 71091.94 680.3183 9.33 9.33 0 28 130891.28666666668 30051.099666666665 0.0 113830.74 131632.5 147210.62 0.0 28278.014 61875.285 0.0 0.0 0.0 317.1267 8.02 8.02 0 20 Piplartine O=C(N1CCC=CC1=O)/C=C/C2=CC(OC)=C(OC)C(OC)=C2 InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+ 73951.31166666666 13913.116 124521.08 0.0 106812.375 115041.56 41739.348 0.0 0.0 150030.92 110065.4 113466.92 507.66 8.83 8.83 0 2 Piplartine COc1cc(/C=C/C(=O)N2CCC=CC2=O)cc(OC)c1OC InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+ 86154.93466666667 0.0 0.0 102639.734 70658.51 85166.56 0.0 0.0 0.0 0.0 0.0 0.0 613.2663 14.93 14.93 0 46 687792.4700000001 33747.456666666665 133067.14666666667 719386.25 483421.06 860570.1 35893.805 32325.105 33023.46 104411.45 202025.38 92764.61 300.1599 5.1 5.1 0 40 Coclaurine OC1=C(OC)C=C2C([C@@](CC3=CC=C(O)C=C3)([H])NCC2)=C1 InChI=1S/C17H19NO3/c1-21-17-9-12-6-7-18-15(14(12)10-16(17)20)8-11-2-4-13(19)5-3-11/h2-5,9-10,15,18-20H,6-8H2,1H3/t15-/m0/s1 81680.28666666667 0.0 0.0 71642.96 84807.64 88590.26 0.0 0.0 0.0 0.0 0.0 0.0 355.227 12.69 12.69 0 14 NCGC00380882-01!5-chloro-2,4-dihydroxy-6-methyl-3-[(E)-3-methyl-5-[(1S,2R,6R)-1,2,6-trimethyl-3-oxocyclohexyl]pent-2-enyl]benzaldehyde [IIN-based on: CCMSLIB00000845779] C[C@@H]1CCC(=O)[C@H](C)[C@@]1(C)CC\\\\C(C)=C\\\\CC2=C(O)C(C=O)=C(C)C(Cl)=C2O InChI=1S/C23H31ClO4/c1-13(10-11-23(5)14(2)7-9-19(26)16(23)4)6-8-17-21(27)18(12-25)15(3)20(24)22(17)28/h6,12,14,16,27-28H,7-11H2,1-5H3/b13-6+/t14-,16+,23+/m1/s1 34970.09133333334 0.0 0.0 28347.031 33411.227 43152.016 0.0 0.0 0.0 0.0 0.0 0.0 418.0588 8.02 8.02 0 2 Cinoctramide COc1cc(/C=C/C(=O)N2CCCCCCC2)cc(OC)c1OC InChI=1S/C19H27NO4/c1-22-16-13-15(14-17(23-2)19(16)24-3)9-10-18(21)20-11-7-5-4-6-8-12-20/h9-10,13-14H,4-8,11-12H2,1-3H3/b10-9+ 188190.2633333333 36172.88333333333 118082.38333333332 245633.9 56663.23 262273.66 0.0 48521.69 59996.96 59482.2 143236.55 151528.4 522.2034 1.02 1.02 0 39 Spectral Match to 4-O-.beta.-Galactopyranosyl-D-mannopyranose from NIST14 C(C1[C@@H](C([C@@H]([C@@H](O1)O[C@@H]2C(O[C@@H]([C@@H](C2O)O)O)CO)O)O)O)O InChI=1S/C12H22O11/c13-1-3-5(15)6(16)9(19)12(22-3)23-10-4(2-14)21-11(20)8(18)7(10)17/h3-20H,1-2H2/t3?,4?,5-,6?,7?,8+,9-,10+,11-,12-/m0/s1 22741.06233333333 0.0 89429.85666666667 33999.445 0.0 34223.742 0.0 0.0 0.0 150127.88 0.0 118161.69 680.481 17.01 17.01 0 32 L-phenylalanine_dodecanoic acid CCCCCCCCCCCC(=O)N[C@@H](Cc1ccccc1)C(=O)O InChI=1S/C21H33NO3/c1-2-3-4-5-6-7-8-9-13-16-20(23)22-19(21(24)25)17-18-14-11-10-12-15-18/h10-12,14-15,19H,2-9,13,16-17H2,1H3,(H,22,23)(H,24,25)/t19-/m0/s1 490673.9733333333 6673.035666666667 0.0 473603.66 413609.16 584809.1 0.0 0.0 20019.107 0.0 0.0 0.0 567.42 17.29 17.29 0 3 CHEBI:181245 CC(CC(O)C(O)C(C)(C)O)C1CCC2(C)C3CCC4C(C)(C(=O)OC5OC(CO)C(O)C(O)C5O)C(O)CC(O)C45CC35CCC12C InChI=1S/C36H60O12/c1-17(13-19(38)28(44)31(2,3)46)18-9-10-33(5)21-7-8-22-34(6,30(45)48-29-27(43)26(42)25(41)20(15-37)47-29)23(39)14-24(40)36(22)16-35(21,36)12-11-32(18,33)4/h17-29,37-44,46H,7-16H2,1-6H3 357379.34 8856.430333333334 0.0 353048.84 302155.62 416933.56 26569.291 0.0 0.0 0.0 0.0 0.0 254.1614 1.26 1.26 0 87 38887.54866666667 0.0 0.0 29347.365 38110.676 49204.605 0.0 0.0 0.0 0.0 0.0 0.0 371.222 13.11 13.11 0 14 1726224.7333333334 149595.19333333333 0.0 0.0 2725352.2 2453322.0 0.0 222109.69 226675.89 0.0 0.0 0.0 932.6307 15.22 15.22 0 18 SQDG(16:0/18:3); [M+NH4]+ C43H80N1O12S1 nan nan 346858.4733333333 0.0 0.0 364467.22 295223.7 380884.5 0.0 0.0 0.0 0.0 0.0 0.0 375.2685 14.06 14.06 0 3 (2S,3S,4S,5R,6R)-6-[[(3S,4S,6aR,6bS,8R,8aR,9R,10R,12aS,14bR)-10-acetyloxy-8a-(acetyloxymethyl)-8,9-dihydroxy-4-(hydroxymethyl)-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-4-hydroxy-3,5-bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]oxane-2-carboxylic acid CC(=O)OC[C@@]12[C@@H](CC(C)(C)[C@@H](OC(C)=O)[C@@H]1O)C1=CCC3[C@@]4(C)CC[C@H](O[C@@H]5O[C@H](C(=O)O)[C@@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@H](O)[C@H]5O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@](C)(CO)C4CC[C@@]3(C)[C@]1(C)C[C@H]2O InChI=1S/C52H82O24/c1-21(56)69-20-52-24(15-47(3,4)42(41(52)66)70-22(2)57)23-9-10-28-48(5)13-12-30(49(6,19-55)27(48)11-14-50(28,7)51(23,8)16-29(52)58)73-46-39(75-45-36(64)34(62)32(60)26(18-54)72-45)37(65)38(40(76-46)43(67)68)74-44-35(63)33(61)31(59)25(17-53)71-44/h9,24-42,44-46,53-55,58-66H,10-20H2,1-8H3,(H,67,68)/t24-,25+,26+,27?,28?,29+,30-,31+,32+,33-,34-,35+,36+,37-,38-,39+,40-,41-,42-,44-,45-,46+,48-,49+,50+,51+,52-/m0/s1 0.0 7587.31 977541.8533333332 0.0 0.0 0.0 0.0 0.0 22761.93 1737066.2 784125.3 411434.06 344.1859 4.37 4.37 0 40 O-methylarmepavine [H][C@@]1(CC2=CC=C(OC)C=C2)C3=CC(OC)=C(OC)C=C3CCN1C InChI=1S/C20H25NO3/c1-21-10-9-15-12-19(23-3)20(24-4)13-17(15)18(21)11-14-5-7-16(22-2)8-6-14/h5-8,12-13,18H,9-11H2,1-4H3/t18-/m1/s1 198791.71333333332 137110.13499999998 199946.76666666663 182938.28 195632.25 217804.61 141683.94 131019.695 138626.77 206455.53 198047.33 195337.44 346.0938 8.82 8.82 0 2 Piplartine COc1cc(/C=C/C(=O)N2CCC=CC2=O)cc(OC)c1OC InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+ 62216.80233333333 0.0 0.0 40454.977 57237.7 88957.73 0.0 0.0 0.0 0.0 0.0 0.0 499.3169 13.99 13.99 0 11 261618.6133333333 562177.4866666667 727632.4633333333 262199.62 215506.25 307149.97 431683.06 696643.2 558206.2 368579.75 705670.44 1108647.2 217.0862 9.57 9.57 0 34 dl-3-Indolelactic acid - 40.0 eV c1ccc2c(c1)c(c[nH]2)CC(C(=O)O)O InChI=1S/C11H11NO3/c13-10(11(14)15)5-7-6-12-9-4-2-1-3-8(7)9/h1-4,6,10,12-13H,5H2,(H,14,15) 27836.70233333333 0.0 63696.097 20387.494 32709.17 30413.443 0.0 0.0 0.0 33798.996 68189.92 89099.375 353.1388 7.04 7.04 0 24 10982.356666666668 18378.96833333333 23769.179 0.0 32947.07 0.0 32570.69 0.0 22566.215 0.0 36660.977 34646.56 205.9512 1.15 1.15 0 73 91017.02133333334 0.0 87330.19666666667 79242.08 91650.57 102158.414 0.0 0.0 0.0 70391.28 92300.26 99299.05 290.1392 8.75 8.75 0 6 "3,4-DIMETHOXYCINNAMIC ACID CollisionEnergy:102040" COc1ccc(C=CC(=O)O)cc1OC "InChI=1S/C11H12O4/c1-14-9-5-3-8(4-6-11(12)13)7-10(9)15-2/h3-7H,1-2H3,(H,12,13)/b6-4+" 75868.22033333335 0.0 0.0 64357.508 59947.523 103299.63 0.0 0.0 0.0 0.0 0.0 0.0 434.2819 16.09 16.09 0 3 35798.587 0.0 0.0 30140.031 35114.17 42141.56 0.0 0.0 0.0 0.0 0.0 0.0 206.0577 8.02 8.02 0 34 35363.45766666666 0.0 10947.898333333333 33206.414 32301.744 40582.215 0.0 0.0 0.0 32843.695 0.0 0.0 496.3405 13.0 13.0 0 23 Spectral Match to 1-Stearoyl-2-hydroxy-sn-glycero-3-phosphocholine from NIST14 nan nan 0.0 16247.781333333332 321726.33666666667 0.0 0.0 0.0 0.0 48743.344 0.0 187272.27 352946.4 424960.34 201.0912 9.2 9.2 0 34 74018.28833333333 0.0 0.0 79439.43 69001.445 73613.99 0.0 0.0 0.0 0.0 0.0 0.0 461.3008 6.07 6.07 0 15 2891142.1 317935.01666666666 0.0 2532610.8 2718080.5 3422735.0 202706.75 343166.9 407931.4 0.0 0.0 0.0 299.092 11.65 11.65 0 8 acacetin CollisionEnergy:205060 COc1ccc(-c2cc(=O)c3c(O)cc(O)cc3o2)cc1 "InChI=1S/C16H12O5/c1-20-11-4-2-9(3-5-11)14-8-13(19)16-12(18)6-10(17)7-15(16)21-14/h2-8,17-18H,1H3" 80465.428 0.0 0.0 77210.55 63202.754 100982.98 0.0 0.0 0.0 0.0 0.0 0.0 362.179 6.79 6.79 0 57 0.0 0.0 75351.481 0.0 0.0 0.0 0.0 0.0 0.0 42342.438 81674.805 102037.2 770.2024 9.2 9.2 0 25 18367.964 0.0 60535.589 0.0 30249.494 24854.398 0.0 0.0 0.0 37960.14 56662.887 86983.74 201.0913 6.48 6.48 0 52 39441.399 959065.55 57829.12233333333 40622.39 26931.477 50770.33 895426.25 914476.0 1067294.4 73334.32 51351.145 48801.902 265.1549 3.59 3.59 0 6 Ferulic acid COC1=C(C=CC(=C1)C=CC(=O)O)O InChI=1S/C10H10O4/c1-14-9-6-7(2-4-8(9)11)3-5-10(12)13/h2-6,11H,1H3,(H,12,13) 96200.75666666668 54646.00366666666 54474.41666666666 122349.94 56273.74 109978.59 60159.074 51232.867 52546.07 73930.18 0.0 89493.07 558.0887 1.01 1.01 0 13 155876.12 0.0 0.0 179004.69 147859.69 140763.98 0.0 0.0 0.0 0.0 0.0 0.0 584.4217 16.91 16.91 0 3 65320.295000000006 0.0 0.0 58851.22 47120.215 89989.45 0.0 0.0 0.0 0.0 0.0 0.0 822.5365 16.02 16.02 0 18 55795.65633333334 0.0 0.0 55987.34 46166.953 65232.676 0.0 0.0 0.0 0.0 0.0 0.0 663.175 14.34 14.34 0 8 0.0 34461.39333333333 0.0 0.0 0.0 0.0 26241.963 22568.604 54573.613 0.0 0.0 0.0 279.1708 3.95 3.95 0 6 NCGC00385009-01!(1S,3R,4R,5R)-1,3-dihydroxy-4,5-bis[[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxy]cyclohexane-1-carboxylic acid COC1=CC(\\C=C\\C(=O)O[C@@H]2C[C@@](O)(C[C@@H](O)[C@H]2OC(=O)\\C=C\\C3=CC=C(O)C(OC)=C3)C(O)=O)=CC=C1O InChI=1S/C27H28O12/c1-36-20-11-15(3-7-17(20)28)5-9-23(31)38-22-14-27(35,26(33)34)13-19(30)25(22)39-24(32)10-6-16-4-8-18(29)21(12-16)37-2/h3-12,19,22,25,28-30,35H,13-14H2,1-2H3,(H,33,34)/b9-5+,10-6+/t19-,22-,25-,27+/m1/s1 132137.26333333334 0.0 0.0 136561.81 117910.21 141939.77 0.0 0.0 0.0 0.0 0.0 0.0 827.4916 15.96 15.96 0 26 16977.024999999998 7040.343666666667 0.0 0.0 22954.275 27976.8 0.0 0.0 21121.031 0.0 0.0 0.0 347.1127 5.1 5.1 0 53 31686.863666666668 0.0 0.0 33924.484 28180.525 32955.582 0.0 0.0 0.0 0.0 0.0 0.0 401.2842 14.28 14.28 0 3 NCGC00380920-01 CC(=O)OC1C(O)CC2(C)C(CCC3(C)C2CC=C2C4C5(CCC(CO[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)(OC5=O)C4(C)O)C(O)CC23C)C1(C)C InChI=1S/C38H58O13/c1-18(40)49-29-20(41)14-33(4)22(32(29,2)3)10-11-34(5)23(33)9-8-19-28-36(7,47)37(17-48-30-27(45)26(44)25(43)21(16-39)50-30)12-13-38(28,31(46)51-37)24(42)15-35(19,34)6/h8,20-30,39,41-45,47H,9-17H2,1-7H3/t20?,21-,22?,23?,24?,25-,26+,27-,28?,29?,30-,33?,34?,35?,36?,37?,38?/m1/s1 68361.70533333333 0.0 0.0 71744.47 51088.176 82252.47 0.0 0.0 0.0 0.0 0.0 0.0 455.9992 2.6 2.6 0 41 44033.949 0.0 0.0 40794.96 35145.832 56161.055 0.0 0.0 0.0 0.0 0.0 0.0 743.2035 4.53 4.53 0 37 Rutin C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)OC[C@@H]2[C@H]([C@@H]([C@H]([C@@H](O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC(=C(C=C5)O)O)O)O)O)O)O)O 1S/C27H30O16/c1-8-17(32)20(35)22(37)26(40-8)39-7-15-18(33)21(36)23(38)27(42-15)43-25-19(34)16-13(31)5-10(28)6-14(16)41-24(25)9-2-3-11(29)12(30)4-9/h2-6,8,15,17-18,20-23,26-33,35-38H,7H2,1H3/t8-,15+,17-,18+,20+,21-,22+,23+,26+,27-/m0/s1 56229.67633333334 18474.121 282670.8066666667 43658.074 62997.67 62033.285 0.0 55422.363 0.0 196001.66 244684.73 407326.03 355.1544 8.73 8.73 0 24 2-[4-[(3R,3aR,6S,6aR)-3-(3,4-dimethoxyphenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-6-yl]-2-methoxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol COc1ccc([C@@H]2OC[C@@H]3[C@@H](c4ccc(OC5OC(CO)C(O)C(O)C5O)c(OC)c4)OC[C@H]23)cc1OC InChI=1S/C27H34O11/c1-32-17-6-4-13(8-19(17)33-2)25-15-11-36-26(16(15)12-35-25)14-5-7-18(20(9-14)34-3)37-27-24(31)23(30)22(29)21(10-28)38-27/h4-9,15-16,21-31H,10-12H2,1-3H3/t15-,16-,21?,22?,23?,24?,25-,26+,27?/m0/s1 44364.389 0.0 0.0 43348.574 41119.543 48625.05 0.0 0.0 0.0 0.0 0.0 0.0 203.1796 12.42 12.42 0 61 Spectral Match to Methyl hexadecanoate from NIST14 nan nan 205823.41 0.0 0.0 171223.47 188948.12 257298.64 0.0 0.0 0.0 0.0 0.0 0.0 741.2907 10.08 10.08 0 24 609340.1133333334 164179.56833333333 739251.16 429531.34 761185.06 637303.94 241710.11 123599.125 127229.47 1308746.4 387479.2 521527.88 304.1184 7.38 7.38 0 6 Sibiricose A6 COc1cc(/C=C/C(=O)O[C@H]2[C@H](O)[C@@H](CO)O[C@@]2(CO)O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O InChI=1S/C23H32O15/c1-33-11-5-10(6-12(34-2)16(11)28)3-4-15(27)36-21-18(30)14(8-25)37-23(21,9-26)38-22-20(32)19(31)17(29)13(7-24)35-22/h3-6,13-14,17-22,24-26,28-32H,7-9H2,1-2H3/b4-3+/t13-,14-,17-,18-,19+,20-,21+,22-,23+/m1/s1 33563.795333333335 0.0 28440.824666666667 33001.188 32747.898 34942.3 0.0 0.0 0.0 0.0 34602.54 50719.934 488.0767 10.49 10.49 0 24 19646.424 0.0 44297.652 32169.139 26770.133 0.0 0.0 0.0 0.0 86074.086 46818.87 0.0 328.1552 3.42 3.42 0 40 5-bromo-N-(1-(thiophen-2-yl)cyclopentyl)nicotinamide O=C(NC1(c2cccs2)CCCC1)c1cc(Br)cnc1 InChI=1S/C15H15BrN2OS/c16-12-8-11(9-17-10-12)14(19)18-15(5-1-2-6-15)13-4-3-7-20-13/h3-4,7-10H,1-2,5-6H2,(H,18,19) 2228214.8000000003 411116.53333333327 1452937.6 1995230.2 2260195.0 2429219.2 455633.72 337263.16 440452.72 1394050.4 1458297.8 1506464.6 288.1235 8.5 8.5 0 6 NCGC00384692-01 COc1c(OC)cc(/C=C/C(=O)O[C@@H]2[C@@H](O)[C@H](C)O[C@@H](OC3C4C=COC(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)C4C4(CO)OC34)[C@@H]2O)cc1 InChI=1S/C32H42O17/c1-13-21(36)27(46-19(35)7-5-14-4-6-16(41-2)17(10-14)42-3)25(40)31(44-13)47-26-15-8-9-43-29(20(15)32(12-34)28(26)49-32)48-30-24(39)23(38)22(37)18(11-33)45-30/h4-10,13,15,18,20-31,33-34,36-40H,11-12H2,1-3H3/b7-5+/t13-,15?,18+,20?,21-,22+,23-,24+,25+,26?,27+,28?,29?,30-,31-,32?/m0/s1 83351.51666666666 0.0 0.0 73433.12 66084.74 110536.69 0.0 0.0 0.0 0.0 0.0 0.0 288.1235 9.54 9.54 0 6 "3,4-DIMETHOXYCINNAMIC ACID CollisionEnergy:102040" COc1ccc(C=CC(=O)O)cc1OC "InChI=1S/C11H12O4/c1-14-9-5-3-8(4-6-11(12)13)7-10(9)15-2/h3-7H,1-2H3,(H,12,13)/b6-4+" 39707.05333333334 0.0 0.0 31456.012 46384.824 41280.324 0.0 0.0 0.0 0.0 0.0 0.0 446.218 3.24 3.24 0 44 0.0 45804.920000000006 108923.04166666669 0.0 0.0 0.0 70107.72 0.0 67307.04 200874.5 125894.625 0.0 335.9418 1.27 1.27 0 51 53504.52066666667 0.0 0.0 48018.047 49872.535 62622.98 0.0 0.0 0.0 0.0 0.0 0.0 766.068 3.55 3.55 0 41 92674.31166666666 8075.699333333334 0.0 94381.34 77409.195 106232.4 24227.098 0.0 0.0 0.0 0.0 0.0 316.1397 1.15 1.15 0 6 50629.43066666666 0.0 70109.93966666667 45730.367 47736.305 58421.62 0.0 0.0 0.0 32078.904 67898.29 110352.625 231.1018 10.49 10.49 0 34 952124.6333333332 1113151.1666666667 737772.18 0.0 1415434.5 1440939.4 0.0 1239746.0 2099707.5 0.0 1255890.1 957426.44 780.5538 15.61 15.61 0 23 Spectral Match to N-Oleoyl-D-erythro-sphingosylphosphorylcholine from NIST14 CCCCCCCCCCCCC/C=C/[C@H]([C@H](COP(=O)([O-])OCC[N+](C)(C)C)NC(=O)CCCCCCC/C=C\\CCCCCCCC)O InChI=1S/C41H81N2O6P/c1-6-8-10-12-14-16-18-20-21-23-25-27-29-31-33-35-41(45)42-39(38-49-50(46,47)48-37-36-43(3,4)5)40(44)34-32-30-28-26-24-22-19-17-15-13-11-9-7-2/h20-21,32,34,39-40,44H,6-19,22-31,33,35-38H2,1-5H3,(H-,42,45,46,47)/b21-20-,34-32+/t39-,40+/m0/s1 40349.834 0.0 0.0 26194.78 47359.16 47495.562 0.0 0.0 0.0 0.0 0.0 0.0 271.0604 7.56 7.56 0 8 Luteolin - 40.0 eV c1cc(c(cc1c2cc(=O)c3c(cc(cc3o2)O)O)O)O InChI=1S/C15H10O6/c16-8-4-11(19)15-12(20)6-13(21-14(15)5-8)7-1-2-9(17)10(18)3-7/h1-6,16-19H 194488.6533333333 0.0 0.0 166741.28 182099.08 234625.6 0.0 0.0 0.0 0.0 0.0 0.0 463.0843 3.9 3.9 0 40 1-[(4-hydroxyphenyl)methyl]-6-methoxy-1,2,3,4-tetrahydroisoquinolin-7-ol COc(cc(CCNC1Cc(cc2)ccc2O)c1c1)c1O InChI=1S/C17H19NO3/c1-21-17-9-12-6-7-18-15(14(12)10-16(17)20)8-11-2-4-13(19)5-3-11/h2-5,9-10,15,18-20H,6-8H2,1H3/t15-/m0/s1 31493.554666666663 0.0 43160.37466666666 30555.191 36123.785 27801.688 0.0 0.0 0.0 29232.65 51278.49 48969.984 577.135 5.2 5.2 0 37 Spectral Match to Procyanidin A1 from NIST14 C1[C@@H]([C@H](OC2=C1C(=CC3=C2[C@@H]4[C@H]([C@](O3)(OC5=CC(=CC(=C45)O)O)C6=CC(=C(C=C6)O)O)O)O)C7=CC(=C(C=C7)O)O)O InChI=1S/C30H24O12/c31-13-7-20(37)24-22(8-13)41-30(12-2-4-16(33)19(36)6-12)29(39)26(24)25-23(42-30)10-17(34)14-9-21(38)27(40-28(14)25)11-1-3-15(32)18(35)5-11/h1-8,10,21,26-27,29,31-39H,9H2/t21-,26+,27+,29+,30-/m0/s1 196931.77 111265.38333333336 198227.48 189816.69 180126.22 220852.4 102784.49 118173.05 112838.61 184972.92 201406.6 208302.92 418.0589 8.82 8.82 0 2 (E)-3,4,5-Trimethoxycinnamic acid - 40.0 eV COc1cc(cc(c1OC)OC)/C=C/C(=O)O InChI=1S/C12H14O5/c1-15-9-6-8(4-5-11(13)14)7-10(16-2)12(9)17-3/h4-7H,1-3H3,(H,13,14)/b5-4+ 7727.373666666666 0.0 30971.160333333333 0.0 23182.121 0.0 0.0 0.0 0.0 31622.719 31939.645 29351.117 287.9601 0.88 0.88 0 5 0.0 562850.13 553354.8766666666 0.0 0.0 0.0 125251.29 1341821.2 221477.9 369411.53 504695.16 785957.94 205.1954 14.06 14.06 0 10 Bisabolol CollisionEnergy:205060 CC(C)=CCCC(C)(O)C1CC=C(C)CC1 "InChI=1S/C15H26O/c1-12(2)6-5-11-15(4,16)14-9-7-13(3)8-10-14/h6-7,14,16H,5,8-11H2,1-4H3" 43380.63033333333 0.0 50687.47066666666 32531.602 55190.555 42419.734 0.0 0.0 0.0 89113.59 27001.832 35946.99 303.1108 7.38 7.38 0 6 SINAPIC ACID CollisionEnergy:102040 COc1cc(C=CC(=O)O)cc(OC)c1O "InChI=1S/C11H12O5/c1-15-8-5-7(3-4-10(12)13)6-9(16-2)11(8)14/h3-6,14H,1-2H3,(H,12,13)/b4-3+" 892001.52 138489.40866666668 912770.9133333334 782628.06 943665.25 949711.25 119489.016 136645.27 159333.94 680304.0 1058955.8 999052.94 342.1316 9.07 9.07 0 45 55547.00133333334 0.0 0.0 36059.062 33163.992 97417.95 0.0 0.0 0.0 0.0 0.0 0.0 353.269 12.4 12.4 0 18 Spectral Match to cis-5,8,11-Eicosatrienoic acid from NIST14 CCCCCCCC/C=C\\C/C=C\\C/C=C\\CCCC(=O)O InChI=1S/C20H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h9-10,12-13,15-16H,2-8,11,14,17-19H2,1H3,(H,21,22)/b10-9-,13-12-,16-15- 94288.70466666669 0.0 0.0 87220.8 73172.484 122472.83 0.0 0.0 0.0 0.0 0.0 0.0 662.4396 14.45 14.45 0 18 36143.498 0.0 0.0 31579.088 38822.332 38029.074 0.0 0.0 0.0 0.0 0.0 0.0 313.1802 12.52 12.52 0 14 1704871.4 19680.779666666665 0.0 1585712.1 1258050.6 2270851.5 36775.13 22267.209 0.0 0.0 0.0 0.0 609.2714 15.63 15.63 0 8 3.10S-Hydroxypheophorbide a OC(CC[C@H]1[C@@H](C2=N/C1=C([C@](C(OC)=O)(O)C3=O)\\C4=C3C(C)=C(N4)/C=C5N=C(C(C)=C\\5CC)/C=C(N/6)/C(C=C)=C(C6=C\\2)C)C)=O InChI=1S/C35H36N4O6/c1-8-19-15(3)22-12-24-17(5)21(10-11-28(40)41)31(38-24)30-32-29(33(42)35(30,44)34(43)45-7)18(6)25(39-32)14-27-20(9-2)16(4)23(37-27)13-26(19)36-22/h8,12-14,17,21,36,39,44H,1,9-11H2,2-7H3,(H,40,41)/t17-,21-,35-/m0/s1 72644.63666666666 0.0 89503.65866666667 74040.41 73726.95 70166.55 0.0 0.0 0.0 84923.32 78960.016 104627.64 654.2336 8.83 8.83 0 79 0.0 0.0 3069773.4666666663 0.0 0.0 0.0 0.0 0.0 0.0 3902455.0 3653004.8 1653860.6 328.1549 3.67 3.67 0 9 Magnoflorine C[N+]1(CCC2=CC(=C(C3=C2C1CC4=C3C(=C(C=C4)OC)O)O)OC)C 1S/C20H23NO4/c1-21(2)8-7-12-10-15(25-4)20(23)18-16(12)13(21)9-11-5-6-14(24-3)19(22)17(11)18/h5-6,10,13H,7-9H2,1-4H3,(H-,22,23)/p+1/t13-/m0/s1 36911.51 42408.771 82048.40333333334 50072.21 60662.32 0.0 39659.273 47405.65 40161.39 82697.08 88426.63 75021.5 286.9591 0.88 0.88 0 5 99380.21666666666 0.0 0.0 88445.77 97004.9 112689.98 0.0 0.0 0.0 0.0 0.0 0.0 339.0714 3.55 3.55 0 41 Saccatoside C[C@@H]1O[C@@H](O[C@H]2[C@@H]3C=CO[C@@H](O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H]3[C@@]3(CO)O[C@@H]23)[C@H](OC(=O)/C=C/c2ccc(O)cc2)[C@H](O)[C@H]1O InChI=1S/C30H38O16/c1-12-19(35)22(38)25(43-17(34)7-4-13-2-5-14(33)6-3-13)29(41-12)44-24-15-8-9-40-27(18(15)30(11-32)26(24)46-30)45-28-23(39)21(37)20(36)16(10-31)42-28/h2-9,12,15-16,18-29,31-33,35-39H,10-11H2,1H3/b7-4+/t12-,15+,16+,18+,19-,20+,21-,22+,23+,24-,25+,26-,27-,28-,29-,30+/m0/s1 166739.62 0.0 0.0 178031.6 162707.38 159479.88 0.0 0.0 0.0 0.0 0.0 0.0 655.3124 14.35 14.35 0 68 219005.63 8297.591666666667 8575.137333333334 152801.22 213477.97 290737.7 0.0 24892.775 0.0 0.0 0.0 25725.412 353.2689 12.14 12.14 0 18 Spectral Match to cis-5,8,11-Eicosatrienoic acid from NIST14 CCCCCCCC/C=C\\C/C=C\\C/C=C\\CCCC(=O)O InChI=1S/C20H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h9-10,12-13,15-16H,2-8,11,14,17-19H2,1H3,(H,21,22)/b10-9-,13-12-,16-15- 185898.9833333333 0.0 0.0 173200.55 214248.4 170248.0 0.0 0.0 0.0 0.0 0.0 0.0 282.2796 15.52 15.52 0 58 Spectral Match to .beta.-Citronellol from NIST14 CC(CCC=C(C)C)CCO InChI=1S/C10H20O/c1-9(2)5-4-6-10(3)7-8-11/h5,10-11H,4,6-8H2,1-3H3 172693.75 0.0 0.0 188893.1 138482.62 190705.53 0.0 0.0 0.0 0.0 0.0 0.0 409.2742 13.44 13.44 0 3 (2S,3S,4S,5R,6R)-6-[[(3S,4S,6aR,6bS,8R,8aR,9R,10R,12aS,14bR)-10-acetyloxy-8a-(acetyloxymethyl)-8,9-dihydroxy-4-(hydroxymethyl)-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-4-hydroxy-3,5-bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]oxane-2-carboxylic acid CC(=O)OC[C@@]12[C@@H](CC(C)(C)[C@@H](OC(C)=O)[C@@H]1O)C1=CCC3[C@@]4(C)CC[C@H](O[C@@H]5O[C@H](C(=O)O)[C@@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@H](O)[C@H]5O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@](C)(CO)C4CC[C@@]3(C)[C@]1(C)C[C@H]2O InChI=1S/C52H82O24/c1-21(56)69-20-52-24(15-47(3,4)42(41(52)66)70-22(2)57)23-9-10-28-48(5)13-12-30(49(6,19-55)27(48)11-14-50(28,7)51(23,8)16-29(52)58)73-46-39(75-45-36(64)34(62)32(60)26(18-54)72-45)37(65)38(40(76-46)43(67)68)74-44-35(63)33(61)31(59)25(17-53)71-44/h9,24-42,44-46,53-55,58-66H,10-20H2,1-8H3,(H,67,68)/t24-,25+,26+,27?,28?,29+,30-,31+,32+,33-,34-,35+,36+,37-,38-,39+,40-,41-,42-,44-,45-,46+,48-,49+,50+,51+,52-/m0/s1 0.0 5023.333333333333 266511.30666666664 0.0 0.0 0.0 0.0 15070.0 0.0 91764.2 316030.1 391739.62 323.1282 16.69 16.69 0 24 4,4'-Dimethoxychalcone COc1ccc(/C=C/C(=O)c2ccc(OC)cc2)cc1 InChI=1S/C17H16O3/c1-19-15-8-3-13(4-9-15)5-12-17(18)14-6-10-16(20-2)11-7-14/h3-12H,1-2H3/b12-5+ 67628.34499999999 0.0 0.0 62343.395 71813.84 68727.8 0.0 0.0 0.0 0.0 0.0 0.0 409.9937 3.55 3.55 0 41 8310027.5 348215.2233333333 0.0 7308770.0 7361081.5 10260231.0 137293.27 404255.9 503096.5 0.0 0.0 0.0 635.287 15.97 15.97 0 8 0.0 35480.44533333334 7897.719333333333 0.0 0.0 0.0 55290.316 24379.07 26771.95 0.0 23693.158 0.0 313.0824 5.58 5.58 0 42 0.0 27176.921666666665 547238.5299999999 0.0 0.0 0.0 55844.023 0.0 25686.742 1304839.2 158037.64 178838.75 314.1757 11.12 11.12 0 70 508479.6866666667 0.0 0.0 482623.78 402810.03 640005.25 0.0 0.0 0.0 0.0 0.0 0.0 641.2969 16.11 16.11 0 46 2882008.966666667 1021455.5666666668 3315363.8666666667 3166796.2 2297052.5 3182178.2 1056524.5 993092.0 1014750.2 4888362.5 3287564.5 1770164.6 314.1755 3.89 3.89 0 40 O-methylarmepavine [H][C@@]1(CC2=CC=C(OC)C=C2)C3=CC(OC)=C(OC)C=C3CCN1C InChI=1S/C20H25NO3/c1-21-10-9-15-12-19(23-3)20(24-4)13-17(15)18(21)11-14-5-7-16(22-2)8-6-14/h5-8,12-13,18H,9-11H2,1-4H3/t18-/m1/s1 351309.32 560493.86 1528265.8333333333 405795.28 246961.52 401171.16 678806.94 494838.3 507836.34 762478.3 1542996.4 2279322.8 205.1954 13.79 13.79 0 10 Bisabolol CollisionEnergy:205060 CC(C)=CCCC(C)(O)C1CC=C(C)CC1 "InChI=1S/C15H26O/c1-12(2)6-5-11-15(4,16)14-9-7-13(3)8-10-14/h6-7,14,16H,5,8-11H2,1-4H3" 208637.86333333337 118174.39666666668 169886.17 261670.05 69533.34 294710.2 115201.21 108965.43 130356.55 110186.94 203672.84 195798.73 325.1135 1.03 1.03 0 39 Stachyose OC[C@H]1O[C@H](OC[C@H]2O[C@H](OC[C@H]3O[C@H](O[C@]4(CO)O[C@H](CO)[C@@H](O)[C@@H]4O)[C@H](O)[C@@H](O)[C@@H]3O)[C@H](O)[C@@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@H]1O InChI=1S/C24H42O21/c25-1-6-10(28)14(32)17(35)21(41-6)39-3-8-11(29)15(33)18(36)22(42-8)40-4-9-12(30)16(34)19(37)23(43-9)45-24(5-27)20(38)13(31)7(2-26)44-24/h6-23,25-38H,1-5H2/t6-,7-,8-,9-,10+,11+,12-,13-,14+,15+,16+,17-,18-,19-,20+,21+,22+,23-,24+/m1/s1 139769.89566666665 139187.32 318540.62666666665 167709.08 209993.88 41606.727 140684.88 156172.64 120704.44 343091.47 319064.97 293465.44 243.9975 0.88 0.88 0 5 452778.86 0.0 0.0 435057.25 403159.8 520119.53 0.0 0.0 0.0 0.0 0.0 0.0 591.2609 15.86 15.86 0 8 5718073.333333333 1620444.5333333332 643613.5366666667 5114477.0 5720229.0 6319514.0 773922.6 1349907.2 2737503.8 536587.56 727100.75 667152.3 340.1159 8.02 8.02 0 45 0.0 0.0 157072.6366666667 0.0 0.0 0.0 0.0 0.0 0.0 80390.67 159637.66 231189.58 205.1954 13.33 13.33 0 10 (.+/-.)-trans-Nerolidol - 40.0 eV CC(=CCC/C(=C/CCC(C)(C=C)O)/C)C InChI=1S/C15H26O/c1-6-15(5,16)12-8-11-14(4)10-7-9-13(2)3/h6,9,11,16H,1,7-8,10,12H2,2-5H3/b14-11+ 56157.143 95041.38333333336 85446.928 102312.695 0.0 66158.734 66653.84 80770.36 137699.95 87662.69 80347.484 88330.61 468.3901 14.61 14.61 0 36 Polidocanol CCCCCCCCCCCCOCCOCCOCCOCCOCCOCCOCCOCCOCCO "InChI=1S/C30H62O10/c1-2-3-4-5-6-7-8-9-10-11-13-32-15-17-34-19-21-36-23-25-38-27-29-40-30-28-39-26-24-37-22-20-35-18-16-33-14-12-31/h31H,2-30H2,1H3" 807688.0800000001 104424.86766666669 0.0 804531.94 720789.5 897742.8 57139.113 142483.38 113652.11 0.0 0.0 0.0 600.4179 14.6 14.6 0 3 0.0 0.0 155677.75333333333 0.0 0.0 0.0 0.0 0.0 0.0 133201.61 277516.84 56314.81 326.1393 4.28 4.28 0 8 42289.06766666667 0.0 132578.24666666667 48446.69 29877.473 48543.04 0.0 0.0 0.0 224526.05 0.0 173208.69 663.4545 17.01 17.01 0 32 L-phenylalanine_dodecanoic acid CCCCCCCCCCCC(=O)N[C@@H](Cc1ccccc1)C(=O)O InChI=1S/C21H33NO3/c1-2-3-4-5-6-7-8-9-13-16-20(23)22-19(21(24)25)17-18-14-11-10-12-15-18/h10-12,14-15,19H,2-9,13,16-17H2,1H3,(H,22,23)(H,24,25)/t19-/m0/s1 95580.04333333332 0.0 0.0 98520.19 71582.18 116637.76 0.0 0.0 0.0 0.0 0.0 0.0 379.0642 2.59 2.59 0 78 NCGC00384821-01_C16H18O8_Cyclohexanecarboxylic acid, 1,3,4-trihydroxy-5-[[(2E)-3-(4-hydroxyphenyl)-1-oxo-2-propen-1-yl]oxy]-, (1R,3R,4S,5R)- O[C@@H]1C[C@@](O)(C[C@@H](OC(=O)\\C=C\\C2=CC=C(O)C=C2)[C@H]1O)C(O)=O InChI=1S/C16H18O8/c17-10-4-1-9(2-5-10)3-6-13(19)24-12-8-16(23,15(21)22)7-11(18)14(12)20/h1-6,11-12,14,17-18,20,23H,7-8H2,(H,21,22)/b6-3+/t11-,12-,14+,16-/m1/s1 220949.86333333337 618476.7866666667 0.0 310047.25 0.0 352802.34 1175971.9 329606.34 349852.12 0.0 0.0 0.0 258.1102 1.0 1.0 0 23 L-alpha-Glycerylphosphorylcholine - 40.0 eV C[N+](C)(C)CCOP(=O)([O-])OC[C@@H](CO)O InChI=1S/C8H20NO6P/c1-9(2,3)4-5-14-16(12,13)15-7-8(11)6-10/h8,10-11H,4-7H2,1-3H3/t8-/m1/s1 0.0 305476.4366666667 290272.9366666667 0.0 0.0 0.0 115379.74 684049.4 117000.17 202335.19 256950.28 411533.34 264.2324 13.0 13.0 0 100 ( )-alpha-Bisabolol - 40.0 eV nan nan 32037.43133333333 0.0 0.0 33080.562 20971.232 42060.5 0.0 0.0 0.0 0.0 0.0 0.0 595.1658 4.84 4.84 0 37 45260.14233333333 0.0 0.0 43576.055 45999.434 46204.938 0.0 0.0 0.0 0.0 0.0 0.0 612.4174 17.29 17.29 0 3 Massbank:MSJ00121 Antheraxanthin CC1=C(C(C[C@@H](C1)O)(C)C)/C=C/C(=C/C=C/C(=C/C=C/C=C(\\C)/C=C/C=C(\\C)/C=C/[C@]23[C@](O2)(C[C@H](CC3(C)C)O)C)/C)/C 1S/C40H56O3/c1-29(17-13-19-31(3)21-22-36-33(5)25-34(41)26-37(36,6)7)15-11-12-16-30(2)18-14-20-32(4)23-24-40-38(8,9)27-35(42)28-39(40,10)43-40/h11-24,34-35,41-42H,25-28H2,1-10H3/b12-11+,17-13+,18-14+,22-21+,24-23+,29-15+,30-16+,31-19+,32-20+/t34-,35+,39-,40+/m1/s1 144931.31666666665 21861.588666666667 0.0 104734.67 143279.62 186779.66 0.0 0.0 65584.766 0.0 0.0 0.0 454.2592 13.99 13.99 0 11 125257.09666666668 0.0 0.0 155134.2 71182.69 149454.4 0.0 0.0 0.0 0.0 0.0 0.0 342.2431 8.99 8.99 0 65 92932.01166666669 0.0 19776.336 123868.26 73745.08 81182.695 0.0 0.0 0.0 0.0 0.0 59329.008 404.3529 13.32 13.32 0 83 Knemolone D OC1=C(C(C)=O)C(CCCCCCCCC)=CC(O)=C1 InChI=1S/C17H26O3/c1-3-4-5-6-7-8-9-10-14-11-15(19)12-16(20)17(14)13(2)18/h11-12,19-20H,3-10H2,1-2H3 8630.812666666667 0.0 850613.8433333334 25892.438 0.0 0.0 0.0 0.0 0.0 1129760.5 1112715.0 309366.03 280.0973 9.78 9.78 0 8 131523.35666666666 0.0 0.0 126476.99 102819.13 165273.95 0.0 0.0 0.0 0.0 0.0 0.0 583.4151 14.82 14.82 0 3 93820.75666666668 88720.34333333334 56249.205 127219.086 40806.484 113436.7 87004.87 75491.71 103664.45 53660.242 63216.383 51870.99 396.0357 1.04 1.04 0 13 65519.283 0.0 0.0 67420.305 57823.164 71314.38 0.0 0.0 0.0 0.0 0.0 0.0 629.4198 16.61 16.61 0 3 NCGC00381199-01_C25H38O4_(3aR,5E,7S,10E,14E,16aS)-2,7-Dihydroxy-3-[(2S)-1-hydroxy-2-propanyl]-6,10,14,16a-tetramethyl-4,7,8,9,12,13,16,16a-octahydrocyclopenta[15]annulen-1(3aH)-one C[C@H](CO)C/1=C(O)/C(=O)[C@@]2(C)C/C=C(C)/CC/C=C(C)/CC[C@H](O)/C(=C/C[C@H]12)C InChI=1S/C25H38O4/c1-16-7-6-8-17(2)13-14-25(5)20(11-10-18(3)21(27)12-9-16)22(19(4)15-26)23(28)24(25)29/h7,10,13,19-21,26-28H,6,8-9,11-12,14-15H2,1-5H3/b16-7+,17-13+,18-10+/t19-,20-,21+,25+/m1/s1 0.0 0.0 70164.62966666667 0.0 0.0 0.0 0.0 0.0 0.0 111239.63 68473.05 30781.209 324.1237 12.05 12.05 0 8 51768.76433333333 0.0 0.0 47583.133 49386.83 58336.33 0.0 0.0 0.0 0.0 0.0 0.0 318.1553 3.31 3.31 0 39 Salidroside OC[C@H]1O[C@@H](OCCc2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O InChI=1S/C14H20O7/c15-7-10-11(17)12(18)13(19)14(21-10)20-6-5-8-1-3-9(16)4-2-8/h1-4,10-19H,5-7H2/t10-,11-,12+,13-,14-/m1/s1 66558.62133333333 0.0 0.0 61902.18 57448.754 80324.93 0.0 0.0 0.0 0.0 0.0 0.0 599.4102 12.83 12.83 0 3 54265.348333333335 0.0 0.0 31043.78 50736.695 81015.57 0.0 0.0 0.0 0.0 0.0 0.0 476.2411 14.09 14.09 0 4 138159.90466666667 0.0 0.0 46848.324 245305.39 122326.0 0.0 0.0 0.0 0.0 0.0 0.0 347.1451 4.46 4.46 0 39 Amygdalin N#C[C@H](OC1O[C@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O)c1ccccc1 InChI=1S/C20H27NO11/c21-6-10(9-4-2-1-3-5-9)30-20-18(28)16(26)14(24)12(32-20)8-29-19-17(27)15(25)13(23)11(7-22)31-19/h1-5,10-20,22-28H,7-8H2/t10-,11+,12+,13+,14+,15-,16-,17+,18+,19+,20?/m0/s1 0.0 678242.6 204359.46666666667 0.0 0.0 0.0 0.0 838208.9 1196518.9 0.0 0.0 613078.4 794.5782 14.3 14.3 0 18 DG(18:2/18:3/0:0); [M+NH4]+ C39H70N1O5 nan nan 146723.82333333333 0.0 0.0 129275.24 82812.95 228083.28 0.0 0.0 0.0 0.0 0.0 0.0 592.2685 16.09 16.09 0 8 373358.7766666667 13977.146666666667 0.0 438010.03 361814.1 320252.2 0.0 0.0 41931.44 0.0 0.0 0.0 600.4177 16.28 16.28 0 3 0.0 25768.759 9214.674333333334 0.0 0.0 0.0 25857.104 24768.355 26680.818 0.0 0.0 27644.023 279.1597 13.25 13.25 0 82 Spectral Match to Dibutyl phthalate from NIST14 nan nan 1459167.066666667 230852.448 58172.525 1162177.9 1414011.5 1801311.8 70691.664 134351.06 487514.62 43083.92 72855.875 58577.78 652.2871 9.34 9.34 0 28 80462.088 0.0 0.0 93922.25 61189.85 86274.164 0.0 0.0 0.0 0.0 0.0 0.0 375.2686 14.51 14.51 0 3 CHEBI:181245 CC(CC(O)C(O)C(C)(C)O)C1CCC2(C)C3CCC4C(C)(C(=O)OC5OC(CO)C(O)C(O)C5O)C(O)CC(O)C45CC35CCC12C InChI=1S/C36H60O12/c1-17(13-19(38)28(44)31(2,3)46)18-9-10-33(5)21-7-8-22-34(6,30(45)48-29-27(43)26(42)25(41)20(15-37)47-29)23(39)14-24(40)36(22)16-35(21,36)12-11-32(18,33)4/h17-29,37-44,46H,7-16H2,1-6H3 46298.43033333333 0.0 0.0 33719.33 54452.844 50723.117 0.0 0.0 0.0 0.0 0.0 0.0 286.1444 3.38 3.38 0 40 Higenamine Oc1ccc(CC2NCCc3cc(O)c(O)cc32)cc1 InChI=1S/C16H17NO3/c18-12-3-1-10(2-4-12)7-14-13-9-16(20)15(19)8-11(13)5-6-17-14/h1-4,8-9,14,17-20H,5-7H2 64110.46 16005.943333333336 151711.51833333334 41551.01 81754.15 69026.22 0.0 48017.83 0.0 82370.695 147623.75 225140.11 422.218 6.48 6.48 0 24 NCGC00380478-01!(3S,3aR,6S,6aR)-3,6-bis(3,4-dimethoxyphenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan COC1=C(OC)C=C(C=C1)[C@H]2OC[C@H]3[C@@H]2CO[C@@H]3C4=CC(OC)=C(OC)C=C4 InChI=1S/C22H26O6/c1-23-17-7-5-13(9-19(17)25-3)21-15-11-28-22(16(15)12-27-21)14-6-8-18(24-2)20(10-14)26-4/h5-10,15-16,21-22H,11-12H2,1-4H3/t15-,16-,21+,22+/m0/s1 0.0 5261.491333333333 23562.656 0.0 0.0 0.0 0.0 0.0 15784.474 17650.61 25549.014 27488.344 470.3635 17.09 17.09 0 64 322630.16333333333 79075.719 23266.04233333333 253570.61 310670.16 403649.72 21587.793 70838.664 144800.7 0.0 40122.875 29675.252 275.103 9.99 9.99 0 28 1040655-37-5 O=C(Cc1csc(Nc2cc(Cl)ccc2)n1)NCc1ccco1 InChI=1S/C16H14ClN3O2S/c17-11-3-1-4-12(7-11)19-16-20-13(10-23-16)8-15(21)18-9-14-5-2-6-22-14/h1-7,10H,8-9H2,(H,18,21)(H,19,20) 182481.61666666667 247648.06333333327 325125.16333333333 172631.27 167646.31 207167.27 141637.17 375191.62 226115.4 179490.52 400773.94 395111.03 425.3056 17.09 17.09 0 64 NCGC00380368-01!methyl 3,15,21-tris[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]docosanoate COC(=O)CC(CCCCCCCCCCCC(CCCCCC(C)OC1OC(CO)C(O)C(O)C1O)OC1OC(CO)C(O)C(O)C1O)OC1OC(CO)C(O)C(O)C1O InChI=1S/C41H76O20/c1-23(56-39-36(52)33(49)30(46)26(20-42)59-39)15-11-10-14-17-24(57-40-37(53)34(50)31(47)27(21-43)60-40)16-12-8-6-4-3-5-7-9-13-18-25(19-29(45)55-2)58-41-38(54)35(51)32(48)28(22-44)61-41/h23-28,30-44,46-54H,3-22H2,1-2H3 29564.839000000004 0.0 0.0 25380.898 32121.508 31192.111 0.0 0.0 0.0 0.0 0.0 0.0 299.1647 12.64 12.64 0 14 681472.6533333333 0.0 0.0 404304.06 851239.3 788874.6 0.0 0.0 0.0 0.0 0.0 0.0 871.5726 16.71 16.71 0 8 Chlorophyll a nan nan 0.0 61080.54 19477.796666666665 0.0 0.0 0.0 65707.53 79931.625 37602.465 28761.525 29671.865 0.0 339.0979 6.02 6.02 0 5 47912.24166666667 0.0 0.0 44102.72 36437.36 63196.645 0.0 0.0 0.0 0.0 0.0 0.0 657.2566 13.52 13.52 0 8 709799.6 298184.8566666667 747345.9333333332 679741.4 680478.4 769179.0 326360.7 258864.17 309329.7 771600.94 717091.8 753345.06 317.1269 8.82 8.82 0 20 Piperlongumine CollisionEnergy:102040 COc1cc(C=CC(=O)N2CCC=CC2=O)cc(OC)c1OC "InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+" 155206.92 0.0 0.0 92739.7 187912.75 184968.31 0.0 0.0 0.0 0.0 0.0 0.0 476.2412 13.81 13.81 0 4 291478.0533333333 0.0 0.0 279585.5 210183.44 384665.22 0.0 0.0 0.0 0.0 0.0 0.0 824.5519 15.79 15.79 0 18 Spectral Match to Stearidonic acid ethyl ester from NIST14 CCC=CCC=CCC=CCC=CCCCCC(=O)OCC InChI=1S/C20H32O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22-4-2/h5-6,8-9,11-12,14-15H,3-4,7,10,13,16-19H2,1-2H3 0.0 0.0 259545.84333333332 0.0 0.0 0.0 0.0 0.0 0.0 269626.78 245223.47 263787.28 286.1442 10.12 10.12 0 6 Massbank:LU109603 Piperine|(2E,4E)-5-(1,3-benzodioxol-5-yl)-1-piperidin-1-ylpenta-2,4-dien-1-one O=C(\\C=C\\C=C\\C1=CC=C2OCOC2=C1)N1CCCCC1 1S/C17H19NO3/c19-17(18-10-4-1-5-11-18)7-3-2-6-14-8-9-15-16(12-14)21-13-20-15/h2-3,6-9,12H,1,4-5,10-11,13H2/b6-2+,7-3+ 27121.35 233672.68666666668 153719.62666666668 81364.05 0.0 0.0 0.0 255509.28 445508.78 0.0 461158.88 0.0 566.5706 16.89 16.89 0 50 53572.27 28568.985666666664 71485.381 45390.81 54876.027 60449.973 33351.01 23031.58 29324.367 88217.15 65989.61 60249.383 690.1872 8.83 8.83 0 56 679042.4633333333 125441.05333333334 0.0 535877.25 731850.44 769399.7 0.0 178206.64 198116.52 0.0 0.0 0.0 318.1341 10.04 10.04 0 2 Piplartine COc1cc(/C=C/C(=O)N2CCC=CC2=O)cc(OC)c1OC InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+ 155356.44333333333 0.0 0.0 119043.76 185881.23 161144.34 0.0 0.0 0.0 0.0 0.0 0.0 583.4152 16.45 16.45 0 3 139362.62333333332 0.0 0.0 98606.23 140908.64 178573.0 0.0 0.0 0.0 0.0 0.0 0.0 694.4012 11.08 11.08 0 18 Spectral Match to Monolinolenin (9c,12c,15c) from NIST14 nan nan 368825.98 200630.96666666667 107395.988 376260.25 311740.75 418476.94 200608.86 191039.23 210244.81 92670.41 101291.14 128226.414 360.1081 4.77 4.77 0 6 NCGC00169550-02!(E)-3-(4-hydroxy-3-methoxyphenyl)-N-[2-(4-hydroxyphenyl)ethyl]prop-2-enamide [IIN-based: Match] COC1=C(O)C=CC(\\\\C=C\\\\C(=O)NCCC2=CC=C(O)C=C2)=C1 InChI=1S/C18H19NO4/c1-23-17-12-14(4-8-16(17)21)5-9-18(22)19-11-10-13-2-6-15(20)7-3-13/h2-9,12,20-21H,10-11H2,1H3,(H,19,22)/b9-5+ 145799.69 0.0 0.0 141859.2 101925.18 193614.69 0.0 0.0 0.0 0.0 0.0 0.0 659.2843 16.77 16.77 0 63 77139.74433333334 9384.901 0.0 64133.633 77129.61 90155.99 0.0 0.0 28154.703 0.0 0.0 0.0 223.0863 8.02 8.02 0 34 22723.037333333337 20304.494666666666 105683.62466666668 0.0 38044.55 30124.562 60913.484 0.0 0.0 107111.38 89674.26 120265.234 292.155 7.57 7.57 0 6 Sibiricose A6 COc1cc(/C=C/C(=O)O[C@H]2[C@H](O)[C@@H](CO)O[C@@]2(CO)O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O InChI=1S/C23H32O15/c1-33-11-5-10(6-12(34-2)16(11)28)3-4-15(27)36-21-18(30)14(8-25)37-23(21,9-26)38-22-20(32)19(31)17(29)13(7-24)35-22/h3-6,13-14,17-22,24-26,28-32H,7-9H2,1-2H3/b4-3+/t13-,14-,17-,18-,19+,20-,21+,22-,23+/m1/s1 119790.44333333334 0.0 0.0 109883.85 110552.98 138934.5 0.0 0.0 0.0 0.0 0.0 0.0 357.0819 3.56 3.56 0 41 (2S)-3-(4-hydroxyphenyl)-2-[[(Z)-3-(4-hydroxyphenyl)prop-2-enoyl]amino]propanoic acid O=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)/C=C\\c1ccc(O)cc1 InChI=1S/C18H17NO5/c20-14-6-1-12(2-7-14)5-10-17(22)19-16(18(23)24)11-13-3-8-15(21)9-4-13/h1-10,16,20-21H,11H2,(H,19,22)(H,23,24)/b10-5-/t16-/m0/s1 937986.4 104092.01833333333 0.0 882091.1 923312.8 1008555.3 27193.635 128602.26 156480.16 0.0 0.0 0.0 600.4175 16.09 16.09 0 3 87336.56933333333 0.0 0.0 83139.875 65385.703 113484.13 0.0 0.0 0.0 0.0 0.0 0.0 634.2796 16.18 16.18 0 8 101877.72000000002 53262.9 0.0 104035.93 81625.1 119972.13 61983.61 57097.77 40707.32 0.0 0.0 0.0 465.1736 4.34 4.34 0 88 2034287-08-4 CCNC(=O)N1CCC(Cc2n[nH]c(=O)n2-c2ccccc2F)CC1 InChI=1S/C17H22FN5O2/c1-2-19-16(24)22-9-7-12(8-10-22)11-15-20-21-17(25)23(15)14-6-4-3-5-13(14)18/h3-6,12H,2,7-11H2,1H3,(H,19,24)(H,21,25) 48785.73533333334 17307.04566666667 124887.46666666667 46105.82 43761.48 56489.906 51921.137 0.0 0.0 0.0 0.0 374662.4 354.1099 10.76 10.76 0 24 40848.61666666667 0.0 0.0 40968.25 33296.58 48281.02 0.0 0.0 0.0 0.0 0.0 0.0 373.2531 11.81 11.81 0 94 107190.408 0.0 0.0 118813.21 72579.03 130178.984 0.0 0.0 0.0 0.0 0.0 0.0 316.1911 5.16 5.16 0 15 329863.6533333333 0.0 0.0 304922.5 324172.16 360496.3 0.0 0.0 0.0 0.0 0.0 0.0 379.064 3.55 3.55 0 78 NCGC00384821-01_C16H18O8_Cyclohexanecarboxylic acid, 1,3,4-trihydroxy-5-[[(2E)-3-(4-hydroxyphenyl)-1-oxo-2-propen-1-yl]oxy]-, (1R,3R,4S,5R)- O[C@@H]1C[C@@](O)(C[C@@H](OC(=O)\\C=C\\C2=CC=C(O)C=C2)[C@H]1O)C(O)=O InChI=1S/C16H18O8/c17-10-4-1-9(2-5-10)3-6-13(19)24-12-8-16(23,15(21)22)7-11(18)14(12)20/h1-6,11-12,14,17-18,20,23H,7-8H2,(H,21,22)/b6-3+/t11-,12-,14+,16-/m1/s1 49638.958333333336 0.0 0.0 44472.445 48028.637 56415.793 0.0 0.0 0.0 0.0 0.0 0.0 219.1746 10.51 10.51 0 61 52597.954 0.0 0.0 47013.9 52257.992 58521.97 0.0 0.0 0.0 0.0 0.0 0.0 463.0563 8.02 8.02 0 20 88053.928 0.0 10827.626333333334 81729.39 23939.334 158493.06 0.0 0.0 0.0 32482.879 0.0 0.0 489.2237 5.67 5.67 0 2 Piperlongumine CollisionEnergy:102040 COc1cc(C=CC(=O)N2CCC=CC2=O)cc(OC)c1OC "InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+" 0.0 104295.22666666668 56899.282666666666 0.0 0.0 0.0 0.0 124690.04 188195.64 0.0 117757.93 52939.918 610.6251 16.88 16.88 0 50 54116.38533333333 0.0 0.0 45651.71 57004.38 59693.066 0.0 0.0 0.0 0.0 0.0 0.0 332.1347 2.86 2.86 0 39 Amygdalin N#C[C@H](OC1O[C@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O)c1ccccc1 InChI=1S/C20H27NO11/c21-6-10(9-4-2-1-3-5-9)30-20-18(28)16(26)14(24)12(32-20)8-29-19-17(27)15(25)13(23)11(7-22)31-19/h1-5,10-20,22-28H,7-8H2/t10-,11+,12+,13+,14+,15-,16-,17+,18+,19+,20?/m0/s1 0.0 118082.27333333332 0.0 0.0 0.0 0.0 61391.535 262022.66 30832.625 0.0 0.0 0.0 285.1239 4.4 4.4 0 90 "2-amino-6-(hydroxymethyl)-4-naphthyl-8-oxo-4H-pyrano[3,2-b]pyran-3-carbonitril e CollisionEnergy:102040" N#CC1=C(N)Oc2c(oc(CO)cc2=O)C1c1cccc2ccccc12 "InChI=1S/C20H14N2O4/c21-9-15-17(14-7-3-5-11-4-1-2-6-13(11)14)19-18(26-20(15)22)16(24)8-12(10-23)25-19/h1-8,17,23H,10,22H2" 0.0 0.0 5694274.566666666 0.0 0.0 0.0 0.0 0.0 0.0 7618878.5 6258310.0 3205635.2 342.1706 4.41 4.41 0 9 Spegatrine C/C=C1/C[N+]2(C)C3Cc4c([nH]c5ccc(O)cc45)[C@@H]2C[C@H]1[C@H]3CO InChI=1S/C20H24N2O2/c1-3-11-9-22(2)18-8-15-14-6-12(24)4-5-17(14)21-20(15)19(22)7-13(11)16(18)10-23/h3-6,13,16,18-19,21,23H,7-10H2,1-2H3/p+1/b11-3-/t13-,16-,18?,19+,22?/m1/s1 101219.38333333336 30970.36666666667 436466.3666666667 85949.77 102684.0 115024.38 32986.6 31321.555 28602.945 358439.38 421629.62 529330.1 306.1705 8.9 8.9 0 2 Piperlongumine CollisionEnergy:102040 COc1cc(C=CC(=O)N2CCC=CC2=O)cc(OC)c1OC "InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+" 65586.64566666666 0.0 0.0 50487.617 67310.82 78961.5 0.0 0.0 0.0 0.0 0.0 0.0 371.222 13.36 13.36 0 14 38651.87733333334 0.0 0.0 30609.992 36733.26 48612.38 0.0 0.0 0.0 0.0 0.0 0.0 275.1028 9.34 9.34 0 28 152164.15666666665 94142.43 572100.75 133907.84 150980.16 171604.47 67258.26 172008.53 43160.5 250781.27 513008.38 952512.6 371.1489 10.1 10.1 0 24 Massbank:PR303923 Arctigenin COC1=C(OC)C=C(C[C@H]2COC(=O)[C@@H]2CC2=CC(OC)=C(O)C=C2)C=C1 1S/C21H24O6/c1-24-18-7-5-13(11-20(18)26-3)8-15-12-27-21(23)16(15)9-14-4-6-17(22)19(10-14)25-2/h4-7,10-11,15-16,22H,8-9,12H2,1-3H3/t15-,16+/m0/s1 342618.44 25124.736666666668 508134.53 299859.25 326351.6 401644.47 0.0 75374.21 0.0 172594.97 459971.12 891837.5 741.2908 10.49 10.49 0 24 113282.34133333332 10800.675 0.0 111435.914 84067.88 144343.23 0.0 0.0 32402.025 0.0 0.0 0.0 600.4161 16.66 16.66 0 3 80159.057 0.0 0.0 86621.055 66342.766 87513.35 0.0 0.0 0.0 0.0 0.0 0.0 618.4278 14.06 14.06 0 3 36479.60866666667 0.0 50125.10566666666 35424.91 30923.572 43090.344 0.0 0.0 0.0 49301.504 72808.055 28265.758 300.1448 1.12 1.12 0 6 Anomuricine COC1=CC=C(C[C@]2([H])NCCC3=C2C=C(OC)C(OC)=C3O)C=C1 InChI=1S/C19H23NO4/c1-22-13-6-4-12(5-7-13)10-16-15-11-17(23-2)19(24-3)18(21)14(15)8-9-20-16/h4-7,11,16,20-21H,8-10H2,1-3H3/t16-/m0/s1 0.0 0.0 65194.606 0.0 0.0 0.0 0.0 0.0 0.0 81298.625 76974.4 37310.793 290.1028 3.65 3.65 0 6 214381.16666666663 88462.40666666666 100197.669 270739.97 0.0 372403.53 265387.22 0.0 0.0 228490.58 40186.047 31916.38 303.1345 1.24 1.24 0 6 102640.19333333331 0.0 0.0 97974.95 98211.91 111733.72 0.0 0.0 0.0 0.0 0.0 0.0 419.0095 3.55 3.55 0 41 4-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypentan-2-yl (E)-3-(4-hydroxyphenyl)prop-2-enoate CC(CC(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)OC(=O)/C=C/c1ccc(O)cc1 InChI=1S/C20H28O9/c1-11(27-16(23)8-5-13-3-6-14(22)7-4-13)9-12(2)28-20-19(26)18(25)17(24)15(10-21)29-20/h3-8,11-12,15,17-22,24-26H,9-10H2,1-2H3/b8-5+/t11?,12?,15-,17-,18+,19-,20-/m1/s1 38037.573 14374.039 0.0 36480.867 38684.676 38947.176 0.0 43122.117 0.0 0.0 0.0 0.0 237.1851 10.74 10.74 0 61 103207.465 0.0 0.0 80815.44 104571.08 124235.875 0.0 0.0 0.0 0.0 0.0 0.0 388.0882 2.97 2.97 0 43 ESCULIN C1=CC(=O)OC2=C1C=C(C(=C2)O)O[C@H]3[C@@H]([C@H]([C@@H]([C@@H](CO)O3)O)O)O "InChI=1S/C15H16O9/c16-5-10-12(19)13(20)14(21)15(24-10)23-9-3-6-1-2-11(18)22-8(6)4-7(9)17/h1-4,10,12-17,19-21H,5H2/t10-,12-,13+,14-,15-/m1/s1" 58277.117666666665 0.0 0.0 48327.56 61373.527 65130.266 0.0 0.0 0.0 0.0 0.0 0.0 323.1281 10.08 10.08 0 71 45927.136666666665 65819.52 77301.98666666668 68913.56 0.0 68867.85 66779.555 70703.56 59975.445 73425.39 92911.125 65569.445 424.364 14.64 14.64 0 36 Polidocanol CCCCCCCCCCCCOCCOCCOCCOCCOCCOCCOCCOCCOCCO "InChI=1S/C30H62O10/c1-2-3-4-5-6-7-8-9-10-11-13-32-15-17-34-19-21-36-23-25-38-27-29-40-30-28-39-26-24-37-22-20-35-18-16-33-14-12-31/h31H,2-30H2,1H3" 57772.44066666666 0.0 0.0 60253.812 46184.78 66878.73 0.0 0.0 0.0 0.0 0.0 0.0 618.4283 13.13 13.13 0 3 Spectral Match to .beta.-Cryptoxanthin from NIST14 nan nan 20631.782666666662 15012.527333333332 20565.54566666667 0.0 31575.332 30320.016 45037.582 0.0 0.0 61696.637 0.0 0.0 262.1441 7.64 7.64 0 6 NCGC00170014-03!(E)-N-(4-acetamidobutyl)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enamide [IIN-based: Match] COC1=C(O)C=CC(\\\\C=C\\\\C(=O)NCCCCNC(C)=O)=C1 InChI=1S/C16H22N2O4/c1-12(19)17-9-3-4-10-18-16(21)8-6-13-5-7-14(20)15(11-13)22-2/h5-8,11,20H,3-4,9-10H2,1-2H3,(H,17,19)(H,18,21)/b8-6+ 292603.13 0.0 0.0 301332.94 255582.73 320893.72 0.0 0.0 0.0 0.0 0.0 0.0 393.2789 14.07 14.07 0 3 NCGC00380456-01 CC(C)(O)C1CCC(C)(C2CCC3(C)C4CCC5C(C)(C(=O)OC6OC(CO)C(O)C(O)C6O)C(O)CC(O)C56CC46CCC23C)O1 InChI=1S/C36H58O11/c1-30(2,44)24-10-12-33(5,47-24)19-9-11-31(3)20-7-8-21-34(6,29(43)46-28-27(42)26(41)25(40)18(16-37)45-28)22(38)15-23(39)36(21)17-35(20,36)14-13-32(19,31)4/h18-28,37-42,44H,7-17H2,1-6H3 56185.174666666666 0.0 50993.87033333333 54141.52 53307.188 61106.816 0.0 0.0 0.0 46972.734 50568.4 55440.477 752.1874 8.83 8.83 0 20 33130.737 0.0 0.0 27834.379 38240.234 33317.598 0.0 0.0 0.0 0.0 0.0 0.0 462.213 1.67 1.67 0 44 0.0 79929.37666666666 130289.81333333334 0.0 0.0 0.0 48537.91 191250.22 0.0 75498.13 130298.01 185073.3 264.2325 12.65 12.65 0 100 0.0 100881.17666666664 53535.105 0.0 0.0 0.0 91055.73 127517.49 84070.31 42420.227 62196.348 55988.74 259.988 3.78 3.78 0 105 795481.0666666668 15635.786333333332 0.0 587346.1 371521.0 1427576.1 29001.105 17906.254 0.0 0.0 0.0 0.0 653.297 16.69 16.69 0 7 83888.66666666667 0.0 0.0 89551.74 71657.17 90457.09 0.0 0.0 0.0 0.0 0.0 0.0 409.2741 13.93 13.93 0 3 35559.130333333334 0.0 0.0 37375.863 27321.434 41980.094 0.0 0.0 0.0 0.0 0.0 0.0 327.2323 12.14 12.14 0 3 NCGC00385237-01 CC(C(O)/C=C/C(C)(C)O)C1CCC2(C)C3C(=O)C=C4C(CCC(O)C4(C)C)C3(C)CCC12C InChI=1S/C30H48O4/c1-18(22(31)12-13-26(2,3)34)19-11-14-30(8)25-23(32)17-21-20(9-10-24(33)27(21,4)5)28(25,6)15-16-29(19,30)7/h12-13,17-20,22,24-25,31,33-34H,9-11,14-16H2,1-8H3/b13-12+ 165674.56999999998 0.0 80435.026 158324.97 158811.72 179887.02 0.0 0.0 0.0 45602.664 70920.914 124781.5 370.1413 10.1 10.1 0 24 46433.639 0.0 0.0 37443.605 48279.785 53577.527 0.0 0.0 0.0 0.0 0.0 0.0 303.1959 13.81 13.81 0 27 0.0 13168.747333333333 25383.52733333333 0.0 0.0 0.0 0.0 39506.242 0.0 0.0 32064.59 44085.992 264.2323 6.21 6.21 0 76 116101.995 0.0 0.0 113302.55 83827.375 151176.06 0.0 0.0 0.0 0.0 0.0 0.0 638.4397 15.27 15.27 0 18 Spectral Match to 1-Hexadecanoyl-2-(9Z-octadecenoyl)-sn-glycero-3-phosphoethanolamine from NIST14 CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)(O)OCCN)OC(=O)CCCCCCC/C=C\\CCCCCCCC InChI=1S/C39H76NO8P/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-30-32-39(42)48-37(36-47-49(43,44)46-34-33-40)35-45-38(41)31-29-27-25-23-21-19-16-14-12-10-8-6-4-2/h17-18,37H,3-16,19-36,40H2,1-2H3,(H,43,44)/b18-17-/t37-/m1/s1 100675.95333333332 0.0 0.0 104255.04 80945.74 116827.08 0.0 0.0 0.0 0.0 0.0 0.0 344.2587 9.64 9.64 0 65 14586.644 0.0 12017.18 23957.979 0.0 19801.953 0.0 0.0 0.0 0.0 0.0 36051.54 476.3069 4.69 4.69 0 36 94890743.33333331 35549855.333333336 104197993.33333331 84792664.0 96475496.0 103404070.0 35200060.0 33031146.0 38418360.0 96387730.0 109298060.0 106908190.0 318.1342 8.83 8.83 0 2 Piplartine COc1cc(/C=C/C(=O)N2CCC=CC2=O)cc(OC)c1OC InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+ 33506.58933333333 0.0 0.0 27081.213 28276.43 45162.125 0.0 0.0 0.0 0.0 0.0 0.0 696.4172 11.88 11.88 0 18 Spectral Match to 1-Linoleoylglycerol from NIST14 nan nan 109365.72333333331 0.0 89876.62 98259.14 84283.48 145554.55 0.0 0.0 0.0 62379.38 96061.06 111189.42 867.2131 4.29 4.29 0 69 Procyanidin C1 40eV C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=C(C(=CC(=C34)O)O)C5C(C(OC6=CC(=CC(=C56)O)O)C7=CC(=C(C=C7)O)O)O)C8=CC(=C(C=C8)O)O)O)O)O)C9=CC(=C(C=C9)O)O)O MOJZMWJRUKIQGL-XILRTYJMSA-N 105333.31166666666 0.0 11411.78 112514.375 63716.66 139768.9 0.0 0.0 0.0 0.0 34235.34 0.0 300.16 4.2 4.2 0 40 N,O-dimethylcoclaurine OC1=C(OC)C=C2C([C@@](CC3=CC=C(OC)C=C3)([H])N(C)CC2)=C1 InChI=1S/C19H23NO3/c1-20-9-8-14-11-19(23-3)18(21)12-16(14)17(20)10-13-4-6-15(22-2)7-5-13/h4-7,11-12,17,21H,8-10H2,1-3H3/t17-/m0/s1 733114.8866666667 0.0 0.0 634525.9 564434.7 1000384.06 0.0 0.0 0.0 0.0 0.0 0.0 609.2712 15.32 15.32 0 8 3.10S-Hydroxypheophorbide a OC(CC[C@H]1[C@@H](C2=N/C1=C([C@](C(OC)=O)(O)C3=O)\\C4=C3C(C)=C(N4)/C=C5N=C(C(C)=C\\5CC)/C=C(N/6)/C(C=C)=C(C6=C\\2)C)C)=O InChI=1S/C35H36N4O6/c1-8-19-15(3)22-12-24-17(5)21(10-11-28(40)41)31(38-24)30-32-29(33(42)35(30,44)34(43)45-7)18(6)25(39-32)14-27-20(9-2)16(4)23(37-27)13-26(19)36-22/h8,12-14,17,21,36,39,44H,1,9-11H2,2-7H3,(H,40,41)/t17-,21-,35-/m0/s1 71012.77500000001 0.0 0.0 48711.715 73342.73 90983.88 0.0 0.0 0.0 0.0 0.0 0.0 304.1185 8.54 8.54 0 6 Sibiricose A6 COc1cc(/C=C/C(=O)O[C@H]2[C@H](O)[C@@H](CO)O[C@@]2(CO)O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O InChI=1S/C23H32O15/c1-33-11-5-10(6-12(34-2)16(11)28)3-4-15(27)36-21-18(30)14(8-25)37-23(21,9-26)38-22-20(32)19(31)17(29)13(7-24)35-22/h3-6,13-14,17-22,24-26,28-32H,7-9H2,1-2H3/b4-3+/t13-,14-,17-,18-,19+,20-,21+,22-,23+/m1/s1 359164.1333333333 0.0 0.0 347529.7 283920.7 446042.0 0.0 0.0 0.0 0.0 0.0 0.0 829.5073 15.79 15.79 0 26 191110.8033333333 53321.03533333334 211441.66 173296.52 204402.2 195633.69 65595.74 43633.656 50733.71 207708.45 208573.45 218043.08 495.6707 8.83 8.83 0 79 0.0 17328.118 28636.267666666667 0.0 0.0 0.0 27302.012 24682.342 0.0 32227.652 27636.137 26045.014 232.9234 0.88 0.88 0 62 87580175.33333333 21098932.33333333 0.0 87415910.0 79349120.0 95975496.0 16171185.0 22535002.0 24590610.0 0.0 0.0 0.0 344.2226 6.06 6.06 0 15 0.0 0.0 43105.14633333334 0.0 0.0 0.0 0.0 0.0 0.0 69774.24 34467.402 25073.797 344.186 4.82 4.82 0 40 Mexiletine Cc1c(OCC(C)N)c(C)ccc1 InChI=1S/C11H17NO/c1-8-5-4-6-9(2)11(8)13-7-10(3)12/h4-6,10H,7,12H2,1-3H3 97264.69333333334 0.0 0.0 90827.18 72226.51 128740.39 0.0 0.0 0.0 0.0 0.0 0.0 761.1888 16.09 16.09 0 8 Pheophytin a nan nan 62973.12899999999 0.0 0.0 58628.918 46622.555 83667.914 0.0 0.0 0.0 0.0 0.0 0.0 608.2634 15.63 15.63 0 8 35034.308 0.0 0.0 31340.771 37671.703 36090.45 0.0 0.0 0.0 0.0 0.0 0.0 371.222 12.82 12.82 0 14 225076.07333333333 89380.23999999999 93336.15666666668 154403.14 243400.3 277424.78 81743.92 97937.81 88458.99 97407.94 91800.64 90799.89 520.3404 12.06 12.06 0 23 Sphingomyelin (d18:1/18:0) CollisionEnergy:102040 CCCCCCCCCCCCC/C=C/[C@@H](O)[C@H](COP(=O)(O)OCC[N+](C)(C)C)N=C(O)CCCCCCCCCCCCCCCCC "InChI=1S/C41H83N2O6P/c1-6-8-10-12-14-16-18-20-21-23-25-27-29-31-33-35-41(45)42-39(38-49-50(46,47)48-37-36-43(3,4)5)40(44)34-32-30-28-26-24-22-19-17-15-13-11-9-7-2/h32,34,39-40,44H,6-31,33,35-38H2,1-5H3,(H-,42,45,46,47)/p+1/b34-32+/t39-,40+/m0/s1" 48622.265666666666 0.0 0.0 41311.496 49535.418 55019.883 0.0 0.0 0.0 0.0 0.0 0.0 231.1018 10.08 10.08 0 34 7891.564333333333 0.0 226422.08 23674.693 0.0 0.0 0.0 0.0 0.0 221742.36 229235.1 228288.78 342.134 8.07 8.07 0 6 ILEPCIMIDE O=C(C=Cc1cc2c(cc1)OCO2)N1CCCCC1 "InChI=1S/C15H17NO3/c17-15(16-8-2-1-3-9-16)7-5-12-4-6-13-14(10-12)19-11-18-13/h4-7,10H,1-3,8-9,11H2/b7-5+" 0.0 0.0 93035.16133333334 0.0 0.0 0.0 0.0 0.0 0.0 55828.934 102134.93 121141.62 339.1595 8.54 8.54 0 24 47109.98533333334 0.0 0.0 49886.13 45619.01 45824.816 0.0 0.0 0.0 0.0 0.0 0.0 827.4919 16.35 16.35 0 26 73384.66666666667 0.0 0.0 59992.88 69193.69 90967.43 0.0 0.0 0.0 0.0 0.0 0.0 342.1315 8.26 8.26 0 45 63833.691 8345.936333333333 84589.52233333334 57475.81 58210.543 75814.72 0.0 25037.809 0.0 41078.777 78818.62 133871.17 282.0891 10.49 10.49 0 47 0.0 58015.81666666667 46788.72 0.0 0.0 0.0 0.0 84651.83 89395.62 0.0 81758.086 58608.074 610.6251 16.75 16.75 0 50 122715.01866666666 16387.199333333334 0.0 114174.086 103739.2 150231.77 49161.598 0.0 0.0 0.0 0.0 0.0 599.4105 11.15 11.15 0 3 46262.411 0.0 0.0 49713.13 39371.273 49702.83 0.0 0.0 0.0 0.0 0.0 0.0 789.5152 16.53 16.53 0 18 147890.92 81741.478 95343.268 100414.92 173452.5 169805.34 73903.164 84933.61 86387.66 96005.14 97703.0 92321.664 478.2935 12.0 12.0 0 18 PE-DAG (16:1/18:2) nan nan 27367.78933333333 0.0 68782.85933333333 23933.092 24673.076 33497.2 0.0 0.0 0.0 43000.918 84023.52 79324.14 581.1872 5.08 5.08 0 54 60053.42833333334 7458.894 86387.11899999999 54201.664 55625.637 70332.984 0.0 22376.682 0.0 40979.707 80245.85 137935.8 323.1282 10.49 10.49 0 71 30439.25633333333 0.0 0.0 30761.992 24309.465 36246.312 0.0 0.0 0.0 0.0 0.0 0.0 600.4176 13.67 13.67 0 3 32732.320333333333 15818.468 9407.17 52042.348 0.0 46154.613 23568.434 23886.97 0.0 28221.51 0.0 0.0 344.1861 3.94 3.94 0 40 AC1L9EVY CollisionEnergy:102040 COc1ccc(CC2c3cc(OC)c(OC)cc3CC[N+]2(C)C)cc1OC "InChI=1S/C22H30NO4/c1-23(2)10-9-16-13-21(26-5)22(27-6)14-17(16)18(23)11-15-7-8-19(24-3)20(12-15)25-4/h7-8,12-14,18H,9-11H2,1-6H3/q+1" 8121.208333333333 6226.266666666666 36406.315 0.0 24363.625 0.0 0.0 18678.8 0.0 36157.195 36801.406 36260.344 337.9701 0.88 0.88 0 5 163863.16666666666 0.0 0.0 151422.14 115675.25 224492.11 0.0 0.0 0.0 0.0 0.0 0.0 842.5624 14.12 14.12 0 18 0.0 55326.36333333334 19542.768333333333 0.0 0.0 0.0 96371.38 69607.71 0.0 58628.305 0.0 0.0 323.9782 1.04 1.04 0 59 40258.633 0.0 0.0 41306.938 34195.766 45273.195 0.0 0.0 0.0 0.0 0.0 0.0 407.2587 9.19 9.19 0 3 CHEBI:181879 CC1(CO)CC(O)[C@]2(C(=O)O)CCC34CC3(C=CC3[C@]5(C)C(CC[C@]34C)C(C)(CO)[C@@H](O)[C@H](O)[C@@H]5O)C2C1 InChI=1S/C30H46O8/c1-24(14-31)11-18-28-8-6-17-26(3,29(28,13-28)9-10-30(18,23(37)38)19(33)12-24)7-5-16-25(2,15-32)21(35)20(34)22(36)27(16,17)4/h6,8,16-22,31-36H,5,7,9-15H2,1-4H3,(H,37,38)/t16?,17?,18?,19?,20-,21-,22-,24?,25?,26+,27-,28?,29?,30-/m0/s1 48365.55666666666 0.0 0.0 39691.36 46074.23 59331.08 0.0 0.0 0.0 0.0 0.0 0.0 619.2919 17.1 17.1 0 8 33729.535 0.0 0.0 38858.355 24565.67 37764.58 0.0 0.0 0.0 0.0 0.0 0.0 619.2921 16.92 16.92 0 8 109677.35166666668 0.0 0.0 132385.67 80903.33 115743.055 0.0 0.0 0.0 0.0 0.0 0.0 602.4332 14.27 14.27 0 3 CHEBI:181879 CC1(CO)CC(O)[C@]2(C(=O)O)CCC34CC3(C=CC3[C@]5(C)C(CC[C@]34C)C(C)(CO)[C@@H](O)[C@H](O)[C@@H]5O)C2C1 InChI=1S/C30H46O8/c1-24(14-31)11-18-28-8-6-17-26(3,29(28,13-28)9-10-30(18,23(37)38)19(33)12-24)7-5-16-25(2,15-32)21(35)20(34)22(36)27(16,17)4/h6,8,16-22,31-36H,5,7,9-15H2,1-4H3,(H,37,38)/t16?,17?,18?,19?,20-,21-,22-,24?,25?,26+,27-,28?,29?,30-/m0/s1 197297.14 0.0 0.0 171367.08 123455.18 297069.16 0.0 0.0 0.0 0.0 0.0 0.0 653.2975 16.43 16.43 0 8 842866.0133333333 223266.74666666667 0.0 874469.44 616036.4 1038092.2 153772.9 250343.28 265684.06 0.0 0.0 0.0 316.1912 5.48 5.48 0 15 50932.51966666666 0.0 0.0 57125.074 35400.465 60272.02 0.0 0.0 0.0 0.0 0.0 0.0 298.1444 3.62 3.62 0 40 PF-9366 CN(C)CCc1nnc2cc(-c3ccccc3)c3c(ccc(Cl)c3)n12 InChI=1S/C20H19ClN4/c1-24(2)11-10-19-22-23-20-13-16(14-6-4-3-5-7-14)17-12-15(21)8-9-18(17)25(19)20/h3-9,12-13H,10-11H2,1-2H3 36860.87233333333 0.0 0.0 39143.98 33732.11 37706.527 0.0 0.0 0.0 0.0 0.0 0.0 435.2887 16.44 16.44 0 3 222226.41666666663 0.0 0.0 194320.64 218518.95 253839.66 0.0 0.0 0.0 0.0 0.0 0.0 554.1695 4.78 4.78 0 60 NCGC00169057-02_C17H26O11_Methyl (1S,4aS,5R,7S,7aS)-1-(beta-D-glucopyranosyloxy)-5,7-dihydroxy-7-methyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylate COC(=O)\\C1=C\\O[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]3[C@@H]1[C@H](O)C[C@]3(C)O InChI=1S/C17H26O11/c1-17(24)3-7(19)9-6(14(23)25-2)5-26-15(10(9)17)28-16-13(22)12(21)11(20)8(4-18)27-16/h5,7-13,15-16,18-22,24H,3-4H2,1-2H3/t7-,8-,9+,10-,11-,12+,13-,15+,16+,17+/m1/s1 323868.67 79655.591 429785.44333333336 289605.66 304201.97 377798.38 60105.535 130104.484 48756.754 218010.53 403449.7 667896.1 335.1282 10.49 10.49 0 8 289913.39 28653.907 20668.803333333333 203218.8 288467.34 378054.03 26826.117 32230.604 26905.0 0.0 29231.9 32774.51 532.3486 12.14 12.14 0 18 Spectral Match to Monolinolenin (9c,12c,15c) from NIST14 nan nan 111068.94666666666 0.0 0.0 139467.88 84991.62 108747.34 0.0 0.0 0.0 0.0 0.0 0.0 643.2893 17.2 17.2 0 8 93243.14 35040.28366666666 94223.9 100391.86 92762.11 86575.45 34903.984 33117.312 37099.555 92597.1 89882.11 100192.49 737.1861 8.82 8.82 0 12 2738093.4 218721.6533333333 0.0 2521977.5 2417314.2 3274988.5 136114.72 371920.44 148129.8 0.0 0.0 0.0 621.3068 17.22 17.22 0 8 Pheophorbide A CCC1=C2C=C3C(=C4C(=O)C(C(=C5C(C(C(=N5)C=C6C(=C(C(=CC(=C1C)N2)N6)C=C)C)C)CCC(=O)O)C4=N3)C(=O)OC)C InChI=1S/C35H36N4O5/c1-8-19-15(3)22-12-24-17(5)21(10-11-28(40)41)32(38-24)30-31(35(43)44-7)34(42)29-18(6)25(39-33(29)30)14-27-20(9-2)16(4)23(37-27)13-26(19)36-22/h8,12-14,17,21,31,36-37H,1,9-11H2,2-7H3,(H,40,41) 1437212.9799999995 66119.46233333334 0.0 1347724.5 945081.44 2018833.0 106758.52 63586.867 28013.0 0.0 0.0 0.0 637.3014 16.77 16.77 0 8 3.10S-Hydroxypheophorbide a OC(CC[C@H]1[C@@H](C2=N/C1=C([C@](C(OC)=O)(O)C3=O)\\C4=C3C(C)=C(N4)/C=C5N=C(C(C)=C\\5CC)/C=C(N/6)/C(C=C)=C(C6=C\\2)C)C)=O InChI=1S/C35H36N4O6/c1-8-19-15(3)22-12-24-17(5)21(10-11-28(40)41)31(38-24)30-32-29(33(42)35(30,44)34(43)45-7)18(6)25(39-32)14-27-20(9-2)16(4)23(37-27)13-26(19)36-22/h8,12-14,17,21,36,39,44H,1,9-11H2,2-7H3,(H,40,41)/t17-,21-,35-/m0/s1 99287.62666666666 0.0 0.0 81650.28 81671.24 134541.36 0.0 0.0 0.0 0.0 0.0 0.0 822.5362 15.96 15.96 0 18 118948.23 0.0 0.0 79506.81 108944.19 168393.69 0.0 0.0 0.0 0.0 0.0 0.0 313.2741 13.38 13.38 0 58 Spectral Match to Monolaurin from NIST14 CCCCCCCCCCCC(=O)OCC(CO)O InChI=1S/C15H30O4/c1-2-3-4-5-6-7-8-9-10-11-15(18)19-13-14(17)12-16/h14,16-17H,2-13H2,1H3 70100.76666666666 925677.5066666668 10080570.0 56575.02 67896.59 85830.69 756216.5 1610783.9 410032.12 5876521.0 11172225.0 13192964.0 323.1284 9.2 9.2 0 24 4,4'-Dimethoxychalcone COc1ccc(/C=C/C(=O)c2ccc(OC)cc2)cc1 InChI=1S/C17H16O3/c1-19-15-8-3-13(4-9-15)5-12-17(18)14-6-10-16(20-2)11-7-14/h3-12H,1-2H3/b12-5+ 52645.25 0.0 0.0 42879.05 57479.766 57576.934 0.0 0.0 0.0 0.0 0.0 0.0 366.1007 4.09 4.09 0 40 1-[(4-hydroxyphenyl)methyl]-6-methoxy-1,2,3,4-tetrahydroisoquinolin-7-ol COc(cc(CCNC1Cc(cc2)ccc2O)c1c1)c1O InChI=1S/C17H19NO3/c1-21-17-9-12-6-7-18-15(14(12)10-16(17)20)8-11-2-4-13(19)5-3-11/h2-5,9-10,15,18-20H,6-8H2,1H3/t15-/m0/s1 423404.4966666668 0.0 0.0 408222.34 339982.03 522009.12 0.0 0.0 0.0 0.0 0.0 0.0 629.2374 14.34 14.34 0 21 86834.578 14383.699333333332 0.0 82995.164 69508.586 107999.984 0.0 0.0 43151.098 0.0 0.0 0.0 748.4763 15.63 15.63 0 66 258559.31 368437.7233333333 831481.4166666666 254901.27 204026.56 316750.1 270949.97 537425.9 296937.3 510708.25 761559.6 1222176.4 233.1175 8.89 8.89 0 34 44977.24133333333 0.0 0.0 37296.01 45550.562 52085.152 0.0 0.0 0.0 0.0 0.0 0.0 374.1087 3.22 3.22 0 41 Saccatoside C[C@@H]1O[C@@H](O[C@H]2[C@@H]3C=CO[C@@H](O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H]3[C@@]3(CO)O[C@@H]23)[C@H](OC(=O)/C=C/c2ccc(O)cc2)[C@H](O)[C@H]1O InChI=1S/C30H38O16/c1-12-19(35)22(38)25(43-17(34)7-4-13-2-5-14(33)6-3-13)29(41-12)44-24-15-8-9-40-27(18(15)30(11-32)26(24)46-30)45-28-23(39)21(37)20(36)16(10-31)42-28/h2-9,12,15-16,18-29,31-33,35-39H,10-11H2,1H3/b7-4+/t12-,15+,16+,18+,19-,20+,21-,22+,23+,24-,25+,26-,27-,28-,29-,30+/m0/s1 63215.744666666666 0.0 0.0 44078.027 60747.797 84821.41 0.0 0.0 0.0 0.0 0.0 0.0 454.2591 14.09 14.09 0 11 32763.04 0.0 10106.545666666669 24993.46 29680.34 43615.32 0.0 0.0 0.0 0.0 0.0 30319.637 534.3642 13.03 13.03 0 18 Spectral Match to 1-Linoleoylglycerol from NIST14 CCCCC/C=C\\C/C=C\\CCCCCCCC(=O)OCC(CO)O InChI=1S/C21H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-19-20(23)18-22/h6-7,9-10,20,22-23H,2-5,8,11-19H2,1H3/b7-6-,10-9- 95411.85 0.0 0.0 82360.66 79397.52 124477.37 0.0 0.0 0.0 0.0 0.0 0.0 508.1968 9.37 9.37 0 28 56141.94666666668 0.0 0.0 38589.758 43671.168 86164.914 0.0 0.0 0.0 0.0 0.0 0.0 311.2585 12.88 12.88 0 58 (2R,6R)-2-methyl-6-pentadecylpiperidine CCCCCCCCCCCCCCC[C@@H]1N[C@@H](C)CCC1 InChI=1S/C21H43N/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-18-21-19-16-17-20(2)22-21/h20-22H,3-19H2,1-2H3/t20-,21-/m0/s1 120672.558 17066.911333333333 0.0 99283.984 115252.92 147480.77 0.0 0.0 51200.734 0.0 0.0 0.0 221.0811 8.26 8.26 0 34 Piplartine COc1cc(/C=C/C(=O)N2CCC=CC2=O)cc(OC)c1OC InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+ 0.0 188320.6233333333 90578.79333333332 0.0 0.0 0.0 0.0 300404.25 264557.62 0.0 0.0 271736.38 587.5493 16.88 16.88 0 8 39979.545666666665 12001.198 0.0 33915.004 38896.863 47126.77 0.0 0.0 36003.594 0.0 0.0 0.0 526.1921 5.1 5.1 0 53 0.0 176348.08333333334 42381.992 0.0 0.0 0.0 133296.45 254030.03 141717.77 0.0 74619.836 52526.14 313.0825 3.77 3.77 0 42 374460.1866666667 90802.35 438044.3033333334 347523.66 310899.34 464957.56 114430.78 59274.54 98701.73 404749.0 435681.88 473702.03 291.0868 4.22 4.22 0 93 Catechin Oc1cc(O)c2c(c1)O[C@H](c1ccc(O)c(O)c1)[C@H](O)C2 InChI=1S/C15H14O6/c16-8-4-11(18)9-6-13(20)15(21-14(9)5-8)7-1-2-10(17)12(19)3-7/h1-5,13,15-20H,6H2/t13-,15-/m1/s1 49654.795666666665 0.0 0.0 29215.412 53572.145 66176.83 0.0 0.0 0.0 0.0 0.0 0.0 621.2449 8.47 8.47 0 28 1021129.2 22863.454 0.0 903421.5 624550.0 1535416.1 0.0 41254.266 27336.096 0.0 0.0 0.0 635.287 16.17 16.17 0 8 213157.62666666665 52289.286 0.0 218287.75 187721.83 233463.3 39132.55 55752.55 61982.758 0.0 0.0 0.0 347.231 6.06 6.06 0 22 353833.28 0.0 0.0 359955.7 290448.2 411095.94 0.0 0.0 0.0 0.0 0.0 0.0 583.4154 12.74 12.74 0 3 137754.34 29326.866 153599.95 117889.44 150964.72 144408.86 28745.035 25746.887 33488.676 142621.69 159073.06 159105.1 334.1291 7.29 7.29 0 2 Piplartine COc1cc(/C=C/C(=O)N2CCC=CC2=O)cc(OC)c1OC InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+ 112006.19333333331 0.0 0.0 108748.21 69472.53 157797.84 0.0 0.0 0.0 0.0 0.0 0.0 623.2508 13.64 13.64 0 8 ferulic acid CollisionEnergy:205060 COc1cc(C=CC(=O)O)ccc1O "InChI=1S/C10H10O4/c1-14-9-6-7(2-4-8(9)11)3-5-10(12)13/h2-6,11H,1H3,(H,12,13)/b5-3+" 70590.93833333334 0.0 0.0 71513.945 62297.03 77961.84 0.0 0.0 0.0 0.0 0.0 0.0 665.2969 17.06 17.06 0 8 45714.29433333333 0.0 0.0 49855.004 37552.324 49735.555 0.0 0.0 0.0 0.0 0.0 0.0 391.2638 13.57 13.57 0 94 61278.51499999999 0.0 0.0 62350.562 45630.863 75854.12 0.0 0.0 0.0 0.0 0.0 0.0 583.415 15.27 15.27 0 3 0.0 0.0 108639.52 0.0 0.0 0.0 0.0 0.0 0.0 92571.34 111893.55 121453.67 242.1026 1.0 1.0 0 72 Dianthoside Cc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(=O)cco1 InChI=1S/C12H16O8/c1-5-11(6(14)2-3-18-5)20-12-10(17)9(16)8(15)7(4-13)19-12/h2-3,7-10,12-13,15-17H,4H2,1H3/t7-,8-,9+,10-,12+/m1/s1 78649.85666666667 0.0 0.0 72721.63 76831.85 86396.09 0.0 0.0 0.0 0.0 0.0 0.0 455.999 3.55 3.55 0 41 29725.114 30115.744666666666 83343.746 26019.71 27837.932 35317.7 0.0 90347.234 0.0 47903.734 84039.02 118088.484 205.1954 12.62 12.62 0 10 5-(5-methoxycarbonyl-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl)-3-methylpentanoic acid C=C1CCC2C(C)(C(=O)OC)CCCC2(C)C1CCC(C)CC(=O)O InChI=1S/C21H34O4/c1-14(13-18(22)23)7-9-16-15(2)8-10-17-20(16,3)11-6-12-21(17,4)19(24)25-5/h14,16-17H,2,6-13H2,1,3-5H3,(H,22,23) 172891.79133333333 0.0 0.0 171792.78 127917.734 218964.86 0.0 0.0 0.0 0.0 0.0 0.0 618.4285 12.14 12.14 0 3 CHEBI:181879 CC1(CO)CC(O)[C@]2(C(=O)O)CCC34CC3(C=CC3[C@]5(C)C(CC[C@]34C)C(C)(CO)[C@@H](O)[C@H](O)[C@@H]5O)C2C1 InChI=1S/C30H46O8/c1-24(14-31)11-18-28-8-6-17-26(3,29(28,13-28)9-10-30(18,23(37)38)19(33)12-24)7-5-16-25(2,15-32)21(35)20(34)22(36)27(16,17)4/h6,8,16-22,31-36H,5,7,9-15H2,1-4H3,(H,37,38)/t16?,17?,18?,19?,20-,21-,22-,24?,25?,26+,27-,28?,29?,30-/m0/s1 0.0 0.0 211205.96566666663 0.0 0.0 0.0 0.0 0.0 0.0 59783.867 246227.5 327606.53 205.1954 16.88 16.88 0 10 Bisabolol CollisionEnergy:205060 CC(C)=CCCC(C)(O)C1CC=C(C)CC1 "InChI=1S/C15H26O/c1-12(2)6-5-11-15(4,16)14-9-7-13(3)8-10-14/h6-7,14,16H,5,8-11H2,1-4H3" 731843.7333333334 64015.35533333333 0.0 0.0 1450275.5 745255.7 0.0 84729.266 107316.8 0.0 0.0 0.0 431.3525 16.01 16.01 0 64 26623.449000000004 29242.335000000003 65698.33466666668 35692.773 44177.574 0.0 32940.055 31667.725 23119.225 74547.97 62320.94 60226.094 220.9816 0.88 0.88 0 5 Thelephoric acid O=C1c2c(c3c(cc(O)c(O)c3)o2)C(=O)c2c1c1c(o2)cc(c(c1)O)O "InChI=1S/C18H8O8/c19-7-1-5-11(3-9(7)21)25-17-13(5)15(23)18-14(16(17)24)6-2-8(20)10(22)4-12(6)26-18/h1-4,19-22H" 231251.90666666665 38197.600333333336 127925.735 193051.03 238931.42 261773.27 33252.086 33087.973 48252.742 103735.625 134220.7 145820.88 304.1186 7.7 7.7 0 6 Sibiricose A6 COc1cc(/C=C/C(=O)O[C@H]2[C@H](O)[C@@H](CO)O[C@@]2(CO)O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O InChI=1S/C23H32O15/c1-33-11-5-10(6-12(34-2)16(11)28)3-4-15(27)36-21-18(30)14(8-25)37-23(21,9-26)38-22-20(32)19(31)17(29)13(7-24)35-22/h3-6,13-14,17-22,24-26,28-32H,7-9H2,1-2H3/b4-3+/t13-,14-,17-,18-,19+,20-,21+,22-,23+/m1/s1 37416.46 45429.853 221759.02 61860.38 0.0 50389.0 51115.004 36697.188 48477.367 211725.64 266588.22 186963.2 268.1335 5.32 5.32 0 9 Asimilobine 215096.75333333333 81018.84733333334 158894.91333333333 294683.34 83759.7 266847.22 85547.766 73979.586 83529.19 174370.39 155450.27 146864.08 282.1494 6.52 6.52 0 8 Massbank:NA002903 (-)-Nuciferine|Nuciferine|(6aR)-1,2-dimethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline CN1CCc2cc(c(c-3c2[C@H]1Cc4c3cccc4)OC)OC 1S/C19H21NO2/c1-20-9-8-13-11-16(21-2)19(22-3)18-14-7-5-4-6-12(14)10-15(20)17(13)18/h4-7,11,15H,8-10H2,1-3H3/t15-/m1/s1 73162.39833333333 0.0 0.0 70732.59 103663.96 45090.645 0.0 0.0 0.0 0.0 0.0 0.0 870.5658 16.49 16.49 0 8 Pheophytin a nan nan 21933.612 20652.443333333333 78186.85566666667 26452.871 39347.965 0.0 0.0 61957.33 0.0 143572.39 53396.29 37591.887 471.2132 6.22 6.22 0 2 Cintriamide COc1cc(C=CC(N)=O)cc(OC)c1OC "InChI=1S/C12H15NO4/c1-15-9-6-8(4-5-11(13)14)7-10(16-2)12(9)17-3/h4-7H,1-3H3,(H2,13,14)/b5-4+" 179414.29666666666 64491.46333333334 520018.68333333335 158375.92 173413.25 206453.72 65253.0 74074.77 54146.62 459309.9 548656.9 552089.25 314.1392 6.61 6.61 0 6 NCGC00169550-02!(E)-3-(4-hydroxy-3-methoxyphenyl)-N-[2-(4-hydroxyphenyl)ethyl]prop-2-enamide [IIN-based: Match] COC1=C(O)C=CC(\\\\C=C\\\\C(=O)NCCC2=CC=C(O)C=C2)=C1 InChI=1S/C18H19NO4/c1-23-17-12-14(4-8-16(17)21)5-9-18(22)19-11-10-13-2-6-15(20)7-3-13/h2-9,12,20-21H,10-11H2,1H3,(H,19,22)/b9-5+ 45898.087666666666 0.0 29070.685 47271.156 44093.22 46329.887 0.0 0.0 0.0 41815.688 45396.367 0.0 459.0617 8.82 8.82 0 2 700200.6866666666 136214.0006666667 26327.589666666667 578670.06 679134.6 842797.4 31910.152 96221.82 280510.03 0.0 39843.023 39139.746 657.2425 9.58 9.58 0 4 45312.21666666667 0.0 72844.40999999999 67404.9 0.0 68531.75 0.0 0.0 0.0 0.0 110094.0 108439.23 505.1767 1.0 1.0 0 39 beta-Lactose - 40.0 eV C([C@@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)O[C@@H]2[C@H](O[C@H]([C@@H]([C@H]2O)O)O)CO)O)O)O)O InChI=1S/C12H22O11/c13-1-3-5(15)6(16)9(19)12(22-3)23-10-4(2-14)21-11(20)8(18)7(10)17/h3-20H,1-2H2/t3-,4-,5+,6+,7-,8-,9-,10-,11-,12+/m1/s1 106737.31866666667 0.0 0.0 149732.14 76758.23 93721.586 0.0 0.0 0.0 0.0 0.0 0.0 467.1819 7.32 7.32 0 2 "(2E)-N-{[(4-methoxyphenyl)amino]thioxomethyl}-3-(3,4,5-trimethoxyphenyl)prop-2 -enamide CollisionEnergy:102040" COc1ccc(NC(=S)N=C(O)C=Cc2cc(OC)c(OC)c(OC)c2)cc1 "InChI=1S/C20H22N2O5S/c1-24-15-8-6-14(7-9-15)21-20(28)22-18(23)10-5-13-11-16(25-2)19(27-4)17(12-13)26-3/h5-12H,1-4H3,(H2,21,22,23,28)/b10-5+" 217637.44333333336 128420.97766666666 66237.61333333334 161002.34 198583.05 293326.94 33930.633 152480.03 198852.27 44496.14 79573.46 74643.24 657.2426 9.99 9.99 0 4 67429.59366666667 0.0 0.0 69396.086 59278.14 73614.555 0.0 0.0 0.0 0.0 0.0 0.0 317.1841 3.68 3.68 0 40 0.0 203100.1433333333 2286931.9 0.0 0.0 0.0 159422.05 361114.3 88764.08 1282363.5 2541196.0 3037236.2 341.1387 9.2 9.2 0 24 Knemolic acid B OC1=C(C(O)=O)C(CCCCCCC2=CC(OCO3)=C3C=C2)=CC=C1 InChI=1S/C20H22O5/c21-16-9-5-8-15(19(16)20(22)23)7-4-2-1-3-6-14-10-11-17-18(12-14)25-13-24-17/h5,8-12,21H,1-4,6-7,13H2,(H,22,23) 191020.42 0.0 0.0 188506.84 166553.19 218001.23 0.0 0.0 0.0 0.0 0.0 0.0 476.2286 2.46 2.46 0 44 1564795.9666666668 262994.9733333333 0.0 1367630.4 1578213.4 1748544.1 156891.88 332381.16 299711.88 0.0 0.0 0.0 568.4265 16.6 16.6 0 3 CHEBI:181879 CC1(CO)CC(O)[C@]2(C(=O)O)CCC34CC3(C=CC3[C@]5(C)C(CC[C@]34C)C(C)(CO)[C@@H](O)[C@H](O)[C@@H]5O)C2C1 InChI=1S/C30H46O8/c1-24(14-31)11-18-28-8-6-17-26(3,29(28,13-28)9-10-30(18,23(37)38)19(33)12-24)7-5-16-25(2,15-32)21(35)20(34)22(36)27(16,17)4/h6,8,16-22,31-36H,5,7,9-15H2,1-4H3,(H,37,38)/t16?,17?,18?,19?,20-,21-,22-,24?,25?,26+,27-,28?,29?,30-/m0/s1 62580.62100000001 0.0 0.0 56706.848 50354.965 80680.05 0.0 0.0 0.0 0.0 0.0 0.0 655.3128 13.77 13.77 0 68 39878.31266666667 0.0 0.0 33818.29 38317.992 47498.656 0.0 0.0 0.0 0.0 0.0 0.0 757.0732 3.55 3.55 0 41 96139.95333333332 0.0 0.0 65528.93 92380.63 130510.3 0.0 0.0 0.0 0.0 0.0 0.0 537.3039 12.14 12.14 0 29 65940.21666666666 0.0 0.0 69874.89 48510.04 79435.72 0.0 0.0 0.0 0.0 0.0 0.0 330.1705 3.15 3.15 0 40 O-methylarmepavine [H][C@@]1(CC2=CC=C(OC)C=C2)C3=CC(OC)=C(OC)C=C3CCN1C InChI=1S/C20H25NO3/c1-21-10-9-15-12-19(23-3)20(24-4)13-17(15)18(21)11-14-5-7-16(22-2)8-6-14/h5-8,12-13,18H,9-11H2,1-4H3/t18-/m1/s1 505828.6 272512.0266666667 224485.50833333333 0.0 909564.9 607920.9 126743.89 266831.66 423960.53 107290.445 259083.52 307082.56 796.5939 17.25 17.25 0 18 DG(18:2/0:0/18:2); [M+NH4]+ C39H72N1O5 nan nan 4135696.233333333 47379.70133333333 0.0 3857592.2 3150999.5 5398497.0 0.0 72459.62 69679.484 0.0 0.0 0.0 592.2685 15.86 15.86 0 8 1021482.6166666666 12755.523333333333 0.0 1143623.4 667518.25 1253306.2 0.0 0.0 38266.57 0.0 0.0 0.0 300.1599 3.62 3.62 0 40 Higenamine OC1=CC=C(C=C1)CC2NCCC3=CC(O)=C(O)C=C32 InChI=1S/C16H17NO3/c18-12-3-1-10(2-4-12)7-14-13-9-16(20)15(19)8-11(13)5-6-17-14/h1-4,8-9,14,17-20H,5-7H2 38375.47233333333 0.0 0.0 39954.793 30422.664 44748.96 0.0 0.0 0.0 0.0 0.0 0.0 434.2819 16.44 16.44 0 3 71478.48366666667 0.0 0.0 61967.996 58466.445 94001.01 0.0 0.0 0.0 0.0 0.0 0.0 627.2318 9.37 9.37 0 4 0.0 0.0 231572.78666666665 0.0 0.0 0.0 0.0 0.0 0.0 313168.75 176053.67 205495.94 344.1497 6.77 6.77 0 6 NCGC00169550-02!(E)-3-(4-hydroxy-3-methoxyphenyl)-N-[2-(4-hydroxyphenyl)ethyl]prop-2-enamide [IIN-based: Match] COC1=C(O)C=CC(\\\\C=C\\\\C(=O)NCCC2=CC=C(O)C=C2)=C1 InChI=1S/C18H19NO4/c1-23-17-12-14(4-8-16(17)21)5-9-18(22)19-11-10-13-2-6-15(20)7-3-13/h2-9,12,20-21H,10-11H2,1H3,(H,19,22)/b9-5+ 32605.78133333333 0.0 0.0 30048.531 30035.043 37733.77 0.0 0.0 0.0 0.0 0.0 0.0 284.1498 1.71 1.71 0 6 1839060.1666666667 0.0 335958.60000000003 0.0 0.0 5517180.5 0.0 0.0 0.0 541310.0 466565.8 0.0 794.5783 14.21 14.21 0 18 DG(18:2/18:3/0:0); [M+NH4]+ C39H70N1O5 nan nan 128289.94333333331 62103.12100000001 318911.48666666663 88448.76 163679.67 132741.4 54723.85 100861.54 30723.973 235545.06 297401.5 423787.9 450.2492 6.48 6.48 0 24 NCGC00380478-01!(3S,3aR,6S,6aR)-3,6-bis(3,4-dimethoxyphenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan COC1=C(OC)C=C(C=C1)[C@H]2OC[C@H]3[C@@H]2CO[C@@H]3C4=CC(OC)=C(OC)C=C4 InChI=1S/C22H26O6/c1-23-17-7-5-13(9-19(17)25-3)21-15-11-28-22(16(15)12-27-21)14-6-8-18(24-2)20(10-14)26-4/h5-10,15-16,21-22H,11-12H2,1-4H3/t15-,16-,21+,22+/m0/s1 45571.435 0.0 0.0 36896.547 42605.453 57212.305 0.0 0.0 0.0 0.0 0.0 0.0 735.1381 3.55 3.55 0 78 8168710.5 1651761.5 31915.491 8306882.0 7380685.5 8818564.0 1049467.6 1915139.1 1990677.8 21237.053 35196.21 39313.21 621.3069 17.04 17.04 0 8 Pheophorbide A CCC1=C2C=C3C(=C4C(=O)C(C(=C5C(C(C(=N5)C=C6C(=C(C(=CC(=C1C)N2)N6)C=C)C)C)CCC(=O)O)C4=N3)C(=O)OC)C InChI=1S/C35H36N4O5/c1-8-19-15(3)22-12-24-17(5)21(10-11-28(40)41)32(38-24)30-31(35(43)44-7)34(42)29-18(6)25(39-33(29)30)14-27-20(9-2)16(4)23(37-27)13-26(19)36-22/h8,12-14,17,21,31,36-37H,1,9-11H2,2-7H3,(H,40,41) 214232.04666666663 20323.411333333333 0.0 184768.27 209720.6 248207.27 0.0 0.0 60970.234 0.0 0.0 0.0 499.317 13.84 13.84 0 11 26326.535666666663 17480.375666666667 71512.68766666666 34677.617 44301.99 0.0 0.0 30900.148 21540.979 74515.414 75195.055 64827.594 400.9397 0.88 0.88 0 5 66534.77666666667 42015.677 0.0 62638.777 65023.363 71942.19 42884.242 40786.227 42376.562 0.0 0.0 0.0 229.1227 6.9 6.9 0 30 abscisic acid CollisionEnergy:205060 CC1=CC(=O)CC([C@]1(/C=C/C(=C\\C(=O)O)/C)O)(C)C "InChI=1S/C15H20O4/c1-10(7-13(17)18)5-6-15(19)11(2)8-12(16)9-14(15,3)4/h5-8,19H,9H2,1-4H3,(H,17,18)/b6-5+,10-7-/t15-/m1/s1" 46498.76833333333 0.0 0.0 44157.742 36308.137 59030.426 0.0 0.0 0.0 0.0 0.0 0.0 607.2552 15.87 15.87 0 8 424548.39333333337 62946.35 0.0 323139.34 407456.28 543049.56 0.0 0.0 188839.05 0.0 0.0 0.0 454.2592 13.81 13.81 0 11 454365.8233333334 127259.84466666666 577057.1666666667 317765.53 571402.06 473929.88 192176.86 93599.51 96003.164 1046772.56 291479.84 392919.1 207.0655 7.38 7.38 0 48 SINAPIC ACID CollisionEnergy:205060 COc1cc(C=CC(=O)O)cc(OC)c1O "InChI=1S/C11H12O5/c1-15-8-5-7(3-4-10(12)13)6-9(16-2)11(8)14/h3-6,14H,1-2H3,(H,12,13)/b4-3+" 156809.6066666667 0.0 0.0 118539.32 193014.73 158874.77 0.0 0.0 0.0 0.0 0.0 0.0 870.5657 16.71 16.71 0 8 Pheophytin a nan nan 22473.50533333333 0.0 125312.72166666666 0.0 0.0 67420.516 0.0 0.0 0.0 77565.195 152991.36 145381.61 453.3983 15.89 15.89 0 36 Spectral Match to Nonaethylene glycol from NIST14 nan nan 0.0 15326.312666666669 597518.9333333333 0.0 0.0 0.0 0.0 45978.938 0.0 247266.9 608566.5 936723.4 717.2909 9.2 9.2 0 24 34414.57666666667 0.0 15763.25 53537.74 49705.99 0.0 0.0 0.0 0.0 0.0 0.0 47289.75 436.0645 8.8 8.8 0 20 264952.11 399928.9033333333 279813.7966666667 254604.27 338716.44 201535.62 409816.38 360696.8 429273.53 345560.7 266792.0 227088.69 202.9515 1.05 1.05 0 84 0.0 168332.03133333335 724929.5666666668 0.0 0.0 0.0 128262.734 293461.78 83271.58 303017.1 678593.2 1193178.4 355.1176 10.71 10.71 0 24 7,8-dihydromethysticin COC1=CC(=O)O[C@@H](CCc2ccc3c(c2)OCO3)C1 InChI=1S/C15H16O5/c1-17-12-7-11(20-15(16)8-12)4-2-10-3-5-13-14(6-10)19-9-18-13/h3,5-6,8,11H,2,4,7,9H2,1H3/t11-/m0/s1 60289.116 0.0 0.0 51102.188 62505.24 67259.92 0.0 0.0 0.0 0.0 0.0 0.0 201.0912 10.08 10.08 0 52 0.0 0.0 409686.9666666666 0.0 0.0 0.0 0.0 0.0 0.0 595463.25 422123.38 211474.27 326.1396 3.67 3.67 0 40 PJ34 CN(C)CC(=O)Nc1cc2c(cc1)[nH]c(=O)c1ccccc12 InChI=1S/C17H17N3O2/c1-20(2)10-16(21)18-11-7-8-15-14(9-11)12-5-3-4-6-13(12)17(22)19-15/h3-9H,10H2,1-2H3,(H,18,21)(H,19,22) 160130.84333333335 67876.78033333334 385043.20333333337 113342.65 198767.28 168282.6 52148.15 119146.33 32335.861 242594.95 365952.06 546582.6 369.17 6.48 6.48 0 24 "4-[(1R,5R)-6-(3,4-dimethoxyphenyl)-3,7-dioxabicyclo[3.3.0]oct-2-yl]-1,2-dimeth oxybenzene CollisionEnergy:205060" COc1ccc(C2OCC3C(c4ccc(OC)c(OC)c4)OCC23)cc1OC "InChI=1S/C22H26O6/c1-23-17-7-5-13(9-19(17)25-3)21-15-11-28-22(16(15)12-27-21)14-6-8-18(24-2)20(10-14)26-4/h5-10,15-16,21-22H,11-12H2,1-4H3/t15-,16-,21?,22?/m0/s1" 0.0 84556.98666666668 27772.656666666662 0.0 0.0 0.0 147732.14 105938.82 0.0 83317.97 0.0 0.0 305.9676 1.04 1.04 0 59 0.0 262885.10000000003 38594.27833333333 0.0 0.0 0.0 60817.5 535420.6 192417.2 0.0 73162.03 42620.805 297.0875 3.77 3.77 0 42 4-PYRIDOXATE - 60.0 eV CC1=NC=C(CO)C(C(O)=O)=C1O InChI=1S/C8H9NO4/c1-4-7(11)6(8(12)13)5(3-10)2-9-4/h2,10-11H,3H2,1H3,(H,12,13) 0.0 87870.32433333334 0.0 0.0 0.0 0.0 33844.953 199584.61 30181.41 0.0 0.0 0.0 205.1954 13.0 13.0 0 10 Bisabolol CollisionEnergy:205060 CC(C)=CCCC(C)(O)C1CC=C(C)CC1 "InChI=1S/C15H26O/c1-12(2)6-5-11-15(4,16)14-9-7-13(3)8-10-14/h6-7,14,16H,5,8-11H2,1-4H3" 0.0 103183.58333333331 17541.652333333335 0.0 0.0 0.0 101909.68 126904.03 80737.04 0.0 52624.957 0.0 311.0669 3.78 3.78 0 5 Ellagic acid O=C1OC2=C(O)C(O)=CC=3C(=O)OC=4C(O)=C(O)C=C1C4C23 InChI=1S/C14H6O8/c15-5-1-3-7-8-4(14(20)22-11(7)9(5)17)2-6(16)10(18)12(8)21-13(3)19/h1-2,15-18H 34457.020333333334 0.0 0.0 36003.008 26452.203 40915.85 0.0 0.0 0.0 0.0 0.0 0.0 349.2528 13.7 13.7 0 3 (2S,3S,4S,5R,6R)-6-[[(3S,4S,6aR,6bS,8R,8aR,9R,10R,12aS,14bR)-10-acetyloxy-8a-(acetyloxymethyl)-8,9-dihydroxy-4-(hydroxymethyl)-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-4-hydroxy-3,5-bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]oxane-2-carboxylic acid CC(=O)OC[C@@]12[C@@H](CC(C)(C)[C@@H](OC(C)=O)[C@@H]1O)C1=CCC3[C@@]4(C)CC[C@H](O[C@@H]5O[C@H](C(=O)O)[C@@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@H](O)[C@H]5O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@](C)(CO)C4CC[C@@]3(C)[C@]1(C)C[C@H]2O InChI=1S/C52H82O24/c1-21(56)69-20-52-24(15-47(3,4)42(41(52)66)70-22(2)57)23-9-10-28-48(5)13-12-30(49(6,19-55)27(48)11-14-50(28,7)51(23,8)16-29(52)58)73-46-39(75-45-36(64)34(62)32(60)26(18-54)72-45)37(65)38(40(76-46)43(67)68)74-44-35(63)33(61)31(59)25(17-53)71-44/h9,24-42,44-46,53-55,58-66H,10-20H2,1-8H3,(H,67,68)/t24-,25+,26+,27?,28?,29+,30-,31+,32+,33-,34-,35+,36+,37-,38-,39+,40-,41-,42-,44-,45-,46+,48-,49+,50+,51+,52-/m0/s1 3411344.0 876478.4 4408088.833333333 3097429.8 3199034.2 3937568.0 660207.8 1417721.1 551506.3 2292830.2 4178445.8 6752990.5 353.1388 10.49 10.49 0 24 143150.14133333333 7849.884666666666 0.0 126639.164 115653.64 187157.62 0.0 0.0 23549.654 0.0 0.0 0.0 605.2498 9.37 9.37 0 28 350235.0633333333 0.0 0.0 351329.0 307065.16 392311.03 0.0 0.0 0.0 0.0 0.0 0.0 687.4365 6.06 6.06 0 15 100410.95666666668 0.0 0.0 132095.14 75344.57 93793.16 0.0 0.0 0.0 0.0 0.0 0.0 584.4224 15.77 15.77 0 89 114535.87833333334 18928.693333333333 28838.04 116766.805 130149.74 96691.09 0.0 56786.08 0.0 0.0 0.0 86514.12 457.3502 15.88 15.88 0 8 199889.96333333332 25983.944666666663 0.0 209680.11 152253.45 237736.33 0.0 27289.24 50662.594 0.0 0.0 0.0 584.4223 16.45 16.45 0 89 0.0 36405.45 0.0 0.0 0.0 0.0 35085.844 45691.1 28439.406 0.0 0.0 0.0 267.0767 3.77 3.77 0 5 164810.88333333333 0.0 0.0 172029.22 138683.1 183720.33 0.0 0.0 0.0 0.0 0.0 0.0 589.2453 15.79 15.79 0 8 1084207.2333333334 107948.28166666666 0.0 1049998.9 1035530.0 1167092.8 30126.125 122225.56 171493.16 0.0 0.0 0.0 657.269 15.97 15.97 0 8 28931.98066666667 0.0 1562610.35 37482.402 0.0 49313.54 0.0 0.0 0.0 2275870.5 1610570.8 801389.75 330.1706 3.41 3.41 0 40 O-methylarmepavine [H][C@@]1(CC2=CC=C(OC)C=C2)C3=CC(OC)=C(OC)C=C3CCN1C InChI=1S/C20H25NO3/c1-21-10-9-15-12-19(23-3)20(24-4)13-17(15)18(21)11-14-5-7-16(22-2)8-6-14/h5-8,12-13,18H,9-11H2,1-4H3/t18-/m1/s1 270470.4 10114.366 0.0 265905.06 237650.61 307855.53 30343.098 0.0 0.0 0.0 0.0 0.0 254.1615 1.61 1.61 0 87 64870.898 0.0 0.0 66664.484 76417.78 51530.43 0.0 0.0 0.0 0.0 0.0 0.0 840.5465 15.62 15.62 0 18 352214.9266666667 0.0 0.0 342227.88 293117.34 421299.56 0.0 0.0 0.0 0.0 0.0 0.0 813.5126 16.42 16.42 0 26 0.0 30057.869666666666 0.0 0.0 0.0 0.0 21804.05 42831.895 25537.664 0.0 0.0 0.0 388.1609 5.86 5.86 0 39 3-oxo-3-[[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(4-hydroxy-5-methyl-2-propan-2-ylphenoxy)oxan-2-yl]methoxy]propanoic acid Cc1cc(O[C@@H]2O[C@H](COC(=O)CC(=O)O)[C@@H](O)[C@H](O)[C@H]2O)c(C(C)C)cc1O InChI=1S/C19H26O10/c1-8(2)10-5-11(20)9(3)4-12(10)28-19-18(26)17(25)16(24)13(29-19)7-27-15(23)6-14(21)22/h4-5,8,13,16-20,24-26H,6-7H2,1-3H3,(H,21,22)/t13-,16-,17+,18-,19-/m1/s1 89294.35333333333 0.0 0.0 73649.2 99338.08 94895.78 0.0 0.0 0.0 0.0 0.0 0.0 492.2597 4.94 4.94 0 15 0.0 21188.694666666663 7398.427666666666 0.0 0.0 0.0 38188.586 25377.498 0.0 22195.283 0.0 0.0 202.0503 4.38 4.38 0 5 114961.15466666664 0.0 0.0 118000.38 107373.17 119509.914 0.0 0.0 0.0 0.0 0.0 0.0 490.2803 5.67 5.67 0 15 142125.19666666666 0.0 0.0 138300.83 132314.92 155759.84 0.0 0.0 0.0 0.0 0.0 0.0 584.4214 17.29 17.29 0 3 Massbank:MSJ00113 Lycopene-5,6-diol CC(=CCC/C(=C/C=C/C(=C/C=C/C(=C/C=C/C=C(\\C)/C=C/C=C(\\C)/C=C/C(C(C)(CCC=C(C)C)O)O)/C)/C)/C)C 1S/C40H58O2/c1-32(2)18-13-22-36(7)25-15-27-37(8)26-14-23-34(5)20-11-12-21-35(6)24-16-28-38(9)29-30-39(41)40(10,42)31-17-19-33(3)4/h11-12,14-16,18-21,23-30,39,41-42H,13,17,22,31H2,1-10H3/b12-11+,23-14+,24-16+,27-15+,30-29+,34-20+,35-21+,36-25+,37-26+,38-28+ 36536.49733333333 10785.381666666666 31964.673333333336 54035.176 0.0 55574.316 0.0 0.0 32356.145 51725.332 0.0 44168.688 464.0596 8.81 8.81 0 20 3529462.733333333 174065.02666666667 498556.7766666667 3064553.2 3652355.0 3871480.0 142352.8 221183.95 158658.33 295926.6 456861.53 742882.2 353.1387 10.09 10.09 0 24 95077.95233333332 0.0 0.0 80003.79 47018.617 158211.45 0.0 0.0 0.0 0.0 0.0 0.0 653.2973 16.29 16.29 0 8 15553.898333333333 484462.45333333337 0.0 46661.695 0.0 0.0 0.0 524649.8 928737.56 0.0 0.0 0.0 716.5224 15.91 15.91 0 18 Spectral Match to 1-Hexadecanoyl-2-(9Z-octadecenoyl)-sn-glycero-3-phosphoethanolamine from NIST14 CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)(O)OCCN)OC(=O)CCCCCCC/C=C\\CCCCCCCC InChI=1S/C39H76NO8P/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-30-32-39(42)48-37(36-47-49(43,44)46-34-33-40)35-45-38(41)31-29-27-25-23-21-19-16-14-12-10-8-6-4-2/h17-18,37H,3-16,19-36,40H2,1-2H3,(H,43,44)/b18-17-/t37-/m1/s1 55832.96133333333 61651.73766666666 61658.44666666666 57624.188 60954.348 48920.348 75217.81 55883.473 53853.93 72569.14 53694.32 58711.88 263.9472 0.86 0.86 0 62 156932.275 92205.69433333332 10078.852333333334 123267.945 152335.05 195193.83 69206.63 51465.473 155944.98 30236.557 0.0 0.0 680.3185 9.99 9.99 0 28 33238.73166666667 0.0 0.0 28057.412 32349.459 39309.324 0.0 0.0 0.0 0.0 0.0 0.0 365.2073 8.26 8.26 0 2 Piperlongumine CollisionEnergy:102040 COc1cc(C=CC(=O)N2CCC=CC2=O)cc(OC)c1OC "InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+" 0.0 0.0 556052.4633333334 0.0 0.0 0.0 0.0 0.0 0.0 377717.75 1109654.5 180785.14 360.0845 10.48 10.48 0 8 55113.58033333334 0.0 0.0 48518.453 51403.6 65418.688 0.0 0.0 0.0 0.0 0.0 0.0 515.7342 6.1 6.1 0 55 31224.119 74834.57900000001 0.0 28080.562 29865.342 35726.453 46074.543 76199.414 102229.78 0.0 0.0 0.0 315.0869 11.78 11.78 0 8 "4',7-Dimethoxy-3-hydroxyflavone CollisionEnergy:102040" COc1ccc(-c2oc3cc(OC)ccc3c(=O)c2O)cc1 "InChI=1S/C17H14O5/c1-20-11-5-3-10(4-6-11)17-16(19)15(18)13-8-7-12(21-2)9-14(13)22-17/h3-9,19H,1-2H3" 445358.34 152734.16 34099.92566666667 364064.94 423682.28 548327.8 98675.05 98198.83 261328.6 36160.707 36951.242 29187.828 680.3184 9.58 9.58 0 2 PIPERLONGUMINE COC1=CC(=CC(=C1OC)OC)C=CC(=O)N2CCC=CC2=O "InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3" 231061.8533333333 0.0 0.0 167904.0 397711.97 127569.59 0.0 0.0 0.0 0.0 0.0 0.0 344.186 4.63 4.63 0 40 AC1L9EVY CollisionEnergy:102040 COc1ccc(CC2c3cc(OC)c(OC)cc3CC[N+]2(C)C)cc1OC "InChI=1S/C22H30NO4/c1-23(2)10-9-16-13-21(26-5)22(27-6)14-17(16)18(23)11-15-7-8-19(24-3)20(12-15)25-4/h7-8,12-14,18H,9-11H2,1-6H3/q+1" 0.0 258150.88666666663 184657.1783333333 0.0 0.0 0.0 85665.81 358683.75 330103.1 114087.875 212814.06 227069.6 236.0921 1.27 1.27 0 5 Indole-3-butyric acid CollisionEnergy:102040 O=C(O)CCCc1c[nH]c2ccccc12 "InChI=1S/C12H13NO2/c14-12(15)7-3-4-9-8-13-11-6-2-1-5-10(9)11/h1-2,5-6,8,13H,3-4,7H2,(H,14,15)" 0.0 16731.813333333335 35870.355 0.0 0.0 0.0 0.0 50195.44 0.0 0.0 45008.125 62602.94 246.2218 8.07 8.07 0 76 210576.68 0.0 0.0 168913.48 188887.62 273928.94 0.0 0.0 0.0 0.0 0.0 0.0 657.2422 10.06 10.06 0 4 71947.42466666667 13520.49 112899.47000000002 74920.83 57735.734 83185.71 0.0 40561.47 0.0 43100.605 106505.805 189092.0 403.1759 7.89 7.89 0 86 6-[3-(3,4-dimethoxyphenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-6-yl]-4-methoxy-1,3-benzodioxole COc1ccc(C2OCC3C(c4cc(OC)c5c(c4)OCO5)OCC23)cc1OC InChI=1S/C22H24O7/c1-23-16-5-4-12(6-17(16)24-2)20-14-9-27-21(15(14)10-26-20)13-7-18(25-3)22-19(8-13)28-11-29-22/h4-8,14-15,20-21H,9-11H2,1-3H3 62713.27133333334 0.0 0.0 60030.37 59691.934 68417.51 0.0 0.0 0.0 0.0 0.0 0.0 333.1814 7.83 7.83 0 6 "(2E)-N-(3-acetylphenyl)-3-(3,4-dimethoxyphenyl)prop-2-enamide CollisionEnergy:102040" COc1ccc(C=CC(O)=Nc2cccc(C(C)=O)c2)cc1OC "InChI=1S/C19H19NO4/c1-13(21)15-5-4-6-16(12-15)20-19(22)10-8-14-7-9-17(23-2)18(11-14)24-3/h4-12H,1-3H3,(H,20,22)/b10-8+" 13577.983333333332 0.0 33380.72 0.0 0.0 40733.95 0.0 0.0 0.0 0.0 53059.336 47082.824 261.0371 1.03 1.03 0 72 Cori ester (alpha-anomer) - 40.0 eV C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)OP(=O)(O)O)O)O)O)O InChI=1S/C6H13O9P/c7-1-2-3(8)4(9)5(10)6(14-2)15-16(11,12)13/h2-10H,1H2,(H2,11,12,13)/t2-,3-,4+,5-,6-/m1/s1 64392.81333333333 0.0 0.0 55533.99 58456.38 79188.07 0.0 0.0 0.0 0.0 0.0 0.0 371.0614 2.97 2.97 0 43 ESCULIN C1=CC(=O)OC2=C1C=C(C(=C2)O)O[C@H]3[C@@H]([C@H]([C@@H]([C@@H](CO)O3)O)O)O "InChI=1S/C15H16O9/c16-5-10-12(19)13(20)14(21)15(24-10)23-9-3-6-1-2-11(18)22-8(6)4-7(9)17/h1-4,10,12-17,19-21H,5H2/t10-,12-,13+,14-,15-/m1/s1" 161330.179 155364.39333333334 414323.3366666666 192929.92 252893.75 38166.867 158928.97 179774.56 127389.65 446993.47 412218.38 383758.16 224.9906 0.88 0.88 0 5 27301.053666666663 37327.856 217780.382 38582.266 0.0 43320.895 29408.768 36477.97 46096.83 114774.086 294560.25 244006.81 207.1383 4.39 4.39 0 61 3,5,5-Trimethyl-4beta-hydroxy-4-[3-(beta-D-glucopyranosyloxy)-1-butenyl]-2-cyclohexene-1-one CC1=CC(=O)CC(C)(C)[C@@]1(O)/C=C/C(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O InChI=1S/C19H30O8/c1-10-7-12(21)8-18(3,4)19(10,25)6-5-11(2)26-17-16(24)15(23)14(22)13(9-20)27-17/h5-7,11,13-17,20,22-25H,8-9H2,1-4H3/b6-5+/t11?,13-,14-,15+,16-,17-,19-/m1/s1 64371.380000000005 139354.17 0.0 62436.99 61111.05 69566.1 108287.15 156216.02 153559.34 0.0 0.0 0.0 346.2017 4.99 4.99 0 15 2-(hydroxymethyl)-6-[5-[3-(hydroxymethyl)-5-(3-hydroxypropyl)-7-methoxy-2,3-dihydro-1-benzofuran-2-yl]-2-methoxyphenoxy]oxane-3,4,5-triol COc1ccc(C2Oc3c(OC)cc(CCCO)cc3C2CO)cc1OC1OC(CO)C(O)C(O)C1O InChI=1S/C26H34O11/c1-33-17-6-5-14(10-18(17)35-26-23(32)22(31)21(30)20(12-29)36-26)24-16(11-28)15-8-13(4-3-7-27)9-19(34-2)25(15)37-24/h5-6,8-10,16,20-24,26-32H,3-4,7,11-12H2,1-2H3 127742.76 0.0 0.0 113373.59 93314.36 176540.33 0.0 0.0 0.0 0.0 0.0 0.0 606.248 14.34 14.34 0 8 56936.214 0.0 0.0 40844.832 57514.0 72449.81 0.0 0.0 0.0 0.0 0.0 0.0 353.2689 11.08 11.08 0 18 Spectral Match to cis-5,8,11-Eicosatrienoic acid from NIST14 CCCCCCCC/C=C\\C/C=C\\C/C=C\\CCCC(=O)O InChI=1S/C20H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h9-10,12-13,15-16H,2-8,11,14,17-19H2,1H3,(H,21,22)/b10-9-,13-12-,16-15- 0.0 0.0 142819.60466666668 0.0 0.0 0.0 0.0 0.0 0.0 172527.48 108691.164 147240.17 393.9837 1.26 1.26 0 51 24560.259 23014.102666666666 24446.834666666666 36778.492 36902.285 0.0 38795.734 30246.574 0.0 39821.734 0.0 33518.77 221.9313 0.87 0.87 0 1 463295.87000000005 109782.74366666668 40546.374 366751.06 442819.75 580316.8 30245.691 95654.12 203448.42 25278.809 53775.918 42584.395 635.2606 9.99 9.99 0 28 339330.87999999995 0.0 0.0 247364.2 401808.5 368819.94 0.0 0.0 0.0 0.0 0.0 0.0 870.566 16.86 16.86 0 8 Pheophytin a nan nan 0.0 148400.56666666668 67195.989 0.0 0.0 0.0 92274.1 207981.16 144946.44 22179.287 97884.39 81524.29 243.9932 3.77 3.77 0 105 133776.30466666666 17105.244666666666 87391.60166666668 107691.164 141488.02 152149.73 24917.857 0.0 26397.877 94373.195 78738.59 89063.02 207.0656 7.7 7.7 0 48 362747.24 0.0 0.0 393086.75 303486.44 391668.53 0.0 0.0 0.0 0.0 0.0 0.0 600.4173 15.47 15.47 0 3 455138.32666666666 0.0 0.0 423044.5 236804.58 705565.9 0.0 0.0 0.0 0.0 0.0 0.0 667.2765 15.44 15.44 0 7 0.0 191596.49 14987.789 0.0 0.0 0.0 64177.95 377261.97 133349.55 0.0 44963.367 0.0 442.104 3.77 3.77 0 42 STL464062 CSCC[C@@H](NC(=O)Cc1c(C)c2cc3c(cc2oc1=O)occ3-c1ccc(C)cc1)C(=O)O InChI=1S/C26H25NO6S/c1-14-4-6-16(7-5-14)20-13-32-22-12-23-17(10-19(20)22)15(2)18(26(31)33-23)11-24(28)27-21(25(29)30)8-9-34-3/h4-7,10,12-13,21H,8-9,11H2,1-3H3,(H,27,28)(H,29,30)/t21-/m1/s1 93906.42533333332 0.0 0.0 79558.81 85855.016 116305.45 0.0 0.0 0.0 0.0 0.0 0.0 515.2327 6.09 6.09 0 55 313393.75 49324.405 0.0 241149.03 299092.66 399939.56 0.0 31191.275 116781.94 0.0 0.0 0.0 635.2604 9.59 9.59 0 17 72260.64 7843.082666666666 0.0 66918.25 68688.48 81175.19 0.0 23529.248 0.0 0.0 0.0 0.0 373.1647 4.83 4.83 0 24 2-[4-[(3R,3aR,6S,6aR)-3-(3,4-dimethoxyphenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-6-yl]-2-methoxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol COc1ccc([C@@H]2OC[C@@H]3[C@@H](c4ccc(OC5OC(CO)C(O)C(O)C5O)c(OC)c4)OC[C@H]23)cc1OC InChI=1S/C27H34O11/c1-32-17-6-4-13(8-19(17)33-2)25-15-11-36-26(16(15)12-35-25)14-5-7-18(20(9-14)34-3)37-27-24(31)23(30)22(29)21(10-28)38-27/h4-9,15-16,21-31H,10-12H2,1-3H3/t15-,16-,21?,22?,23?,24?,25-,26+,27?/m0/s1 456945.3 81530.83333333333 0.0 432639.62 397334.72 540861.56 0.0 142228.73 102363.77 0.0 0.0 0.0 599.4103 12.24 12.24 0 3 125315.19433333332 86009.93666666666 86884.14 152803.53 42949.223 180192.83 82617.71 74480.62 100931.48 75774.59 99273.59 85604.24 365.1057 1.04 1.04 0 88 0.0 31074.69133333333 83603.21333333333 0.0 0.0 0.0 59407.824 0.0 33816.25 250809.64 0.0 0.0 280.2641 14.86 14.86 0 58 (2E,4E)-N-(2-methylpropyl)dodeca-2,4-dienamide CCCCCCC/C=C/C=C/C(O)=NCC(C)C InChI=1S/C16H29NO/c1-4-5-6-7-8-9-10-11-12-13-16(18)17-14-15(2)3/h10-13,15H,4-9,14H2,1-3H3,(H,17,18)/b11-10+,13-12+ 195231.03000000003 0.0 0.0 182775.0 156675.92 246242.17 0.0 0.0 0.0 0.0 0.0 0.0 611.4676 16.42 16.42 0 18 Spectral Match to Eicosapentaenoic acid ethyl ester from NIST14 CC/C=C\\C/C=C\\C/C=C\\C/C=C\\C/C=C\\CCCC(=O)OCC InChI=1S/C22H34O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24-4-2/h5-6,8-9,11-12,14-15,17-18H,3-4,7,10,13,16,19-21H2,1-2H3/b6-5-,9-8-,12-11-,15-14-,18-17- 137660.67866666664 0.0 0.0 142009.94 88811.266 182160.83 0.0 0.0 0.0 0.0 0.0 0.0 625.2662 15.33 15.33 0 8 31775.233333333337 46166.555666666674 69215.67833333333 37823.54 57502.16 0.0 52209.44 46557.387 39732.84 84561.1 65221.465 57864.47 277.9362 1.15 1.15 0 73 56394.494333333336 40078.87666666666 0.0 37187.15 83482.38 48513.953 27762.25 40925.61 51548.77 0.0 0.0 0.0 298.1444 3.51 3.51 0 16 81724.67333333334 0.0 0.0 72191.0 79198.58 93784.44 0.0 0.0 0.0 0.0 0.0 0.0 346.2015 5.48 5.48 0 15 481715.5 20910.466333333334 421973.2166666666 462485.5 355499.75 627161.25 25228.852 0.0 37502.547 282017.47 473477.56 510424.62 579.1504 3.91 3.91 0 69 Spectral Match to Procyanidin B2 from NIST14 C1[C@H]([C@H](OC2=C1C(=CC(=C2[C@@H]3[C@H]([C@H](OC4=CC(=CC(=C34)O)O)C5=CC(=C(C=C5)O)O)O)O)O)C6=CC(=C(C=C6)O)O)O InChI=1S/C30H26O12/c31-13-7-20(37)24-23(8-13)41-29(12-2-4-16(33)19(36)6-12)27(40)26(24)25-21(38)10-17(34)14-9-22(39)28(42-30(14)25)11-1-3-15(32)18(35)5-11/h1-8,10,22,26-29,31-40H,9H2/t22-,26-,27-,28-,29-/m1/s1 351893.30666666664 71706.81266666666 465299.11 313862.5 341542.2 400275.22 85107.97 63156.234 66856.234 299617.47 507749.06 588530.8 304.1548 9.56 9.56 0 2 Piplartine COc1cc(/C=C/C(=O)N2CCC=CC2=O)cc(OC)c1OC InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+ 4744020.100000001 64606.291 40946.81133333334 4665752.5 3692460.8 5873847.0 67329.08 63853.047 62636.746 42736.914 53300.19 26803.33 286.1443 4.11 4.11 0 40 1-[(4-hydroxyphenyl)methyl]-6-methoxy-1,2,3,4-tetrahydroisoquinolin-7-ol COc(cc(CCNC1Cc(cc2)ccc2O)c1c1)c1O InChI=1S/C17H19NO3/c1-21-17-9-12-6-7-18-15(14(12)10-16(17)20)8-11-2-4-13(19)5-3-11/h2-5,9-10,15,18-20H,6-8H2,1H3/t15-/m0/s1 123666.80666666666 20624.248000000003 0.0 115796.15 121370.16 133834.11 0.0 38257.707 23615.037 0.0 0.0 0.0 570.2547 4.83 4.83 0 24 2-[4-[4-[hydroxy-(4-hydroxy-3-methoxyphenyl)methyl]-3-(hydroxymethyl)oxolan-2-yl]-2-methoxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol COc1cc(C(O)C2COC(c3ccc(OC4OC(CO)C(O)C(O)C4O)c(OC)c3)C2CO)ccc1O InChI=1S/C26H34O12/c1-34-18-7-12(3-5-16(18)29)21(30)15-11-36-25(14(15)9-27)13-4-6-17(19(8-13)35-2)37-26-24(33)23(32)22(31)20(10-28)38-26/h3-8,14-15,20-33H,9-11H2,1-2H3 36289382.66666666 6887175.666666667 0.0 36821620.0 33144712.0 38901816.0 5536475.5 7459311.0 7665740.5 0.0 0.0 0.0 314.1757 3.68 3.68 0 40 O-methylarmepavine [H][C@@]1(CC2=CC=C(OC)C=C2)C3=CC(OC)=C(OC)C=C3CCN1C InChI=1S/C20H25NO3/c1-21-10-9-15-12-19(23-3)20(24-4)13-17(15)18(21)11-14-5-7-16(22-2)8-6-14/h5-8,12-13,18H,9-11H2,1-4H3/t18-/m1/s1 217863.11666666667 135828.7666666667 35977.34566666667 202248.45 215828.0 235512.9 135621.7 133314.48 138550.12 21990.764 40516.066 45425.207 247.1331 6.9 6.9 0 30 ABSCISIC ACID CollisionEnergy:205060 CC(C=CC1(O)C(C)=CC(=O)CC1(C)C)=CC(=O)O "InChI=1S/C15H20O4/c1-10(7-13(17)18)5-6-15(19)11(2)8-12(16)9-14(15,3)4/h5-8,19H,9H2,1-4H3,(H,17,18)/b6-5+,10-7-" 0.0 0.0 457098.7333333333 0.0 0.0 0.0 0.0 0.0 0.0 551191.2 354953.0 465152.0 437.9734 1.26 1.26 0 51 0.0 0.0 49603.818 0.0 0.0 0.0 0.0 0.0 0.0 41578.49 51552.754 55680.21 453.0874 9.21 9.21 0 25 68276721.33333333 26083238.0 79657546.66666667 60935150.0 68564744.0 75330270.0 26905496.0 23870888.0 27473330.0 77360690.0 82281780.0 79330170.0 221.081 8.83 8.83 0 34 Piplartine COc1cc(/C=C/C(=O)N2CCC=CC2=O)cc(OC)c1OC InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+ 254787.80666666667 0.0 0.0 227627.2 163308.69 373427.53 0.0 0.0 0.0 0.0 0.0 0.0 615.2582 16.08 16.08 0 21 509718.96 0.0 9247.338 396194.06 78115.92 1054846.9 0.0 0.0 0.0 27742.014 0.0 0.0 467.1817 9.08 9.08 0 2 Piperlongumine CollisionEnergy:102040 COc1cc(C=CC(=O)N2CCC=CC2=O)cc(OC)c1OC "InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+" 55163.095 0.0 0.0 53049.363 34855.758 77584.164 0.0 0.0 0.0 0.0 0.0 0.0 625.2663 14.66 14.66 0 8 0.0 56511.095 652382.6266666666 0.0 0.0 0.0 46220.902 100055.125 23257.258 388094.44 721592.0 847461.44 293.1177 9.2 9.2 0 24 253420.97666666663 0.0 0.0 327674.3 207862.03 224726.6 0.0 0.0 0.0 0.0 0.0 0.0 600.4172 15.12 15.12 0 3 42530.30566666666 47885.30433333333 49566.95 45913.39 46763.703 34913.824 58779.19 44557.34 40319.383 60850.023 42382.71 45468.117 235.9524 0.86 0.86 0 62 12665.993333333334 0.0 48432.21 0.0 0.0 37997.98 0.0 0.0 0.0 0.0 75233.16 70063.47 487.1663 1.0 1.0 0 39 beta-Lactose - 40.0 eV C([C@@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)O[C@@H]2[C@H](O[C@H]([C@@H]([C@H]2O)O)O)CO)O)O)O)O InChI=1S/C12H22O11/c13-1-3-5(15)6(16)9(19)12(22-3)23-10-4(2-14)21-11(20)8(18)7(10)17/h3-20H,1-2H2/t3-,4-,5+,6+,7-,8-,9-,10-,11-,12+/m1/s1 27059.859666666667 0.0 0.0 22356.627 27206.602 31616.35 0.0 0.0 0.0 0.0 0.0 0.0 247.0604 3.47 3.47 0 19 naringenin CollisionEnergy:205060 O=C1CC(c2ccc(O)cc2)Oc2cc(O)cc(O)c21 "InChI=1S/C15H12O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-6,13,16-18H,7H2" 2380056.1666666665 12495.94 0.0 0.0 2831387.0 4308781.5 37487.82 0.0 0.0 0.0 0.0 0.0 595.2822 15.86 15.86 0 8 Pheophorbide A CCC1=C2C=C3C(=C4C(=O)C(C(=C5C(C(C(=N5)C=C6C(=C(C(=CC(=C1C)N2)N6)C=C)C)C)CCC(=O)O)C4=N3)C(=O)OC)C InChI=1S/C35H36N4O5/c1-8-19-15(3)22-12-24-17(5)21(10-11-28(40)41)32(38-24)30-31(35(43)44-7)34(42)29-18(6)25(39-33(29)30)14-27-20(9-2)16(4)23(37-27)13-26(19)36-22/h8,12-14,17,21,31,36-37H,1,9-11H2,2-7H3,(H,40,41) 629248.6066666666 0.0 0.0 369002.88 1135606.0 383136.94 0.0 0.0 0.0 0.0 0.0 0.0 871.5729 16.51 16.51 0 8 Chlorophyll a nan nan 196442.42 39246.684 0.0 191611.84 169328.86 228386.56 48594.31 35145.918 33999.824 0.0 0.0 0.0 837.3937 6.85 6.85 0 57 8388299.833333333 864730.82 303592.5366666667 9055552.0 6269028.5 9840319.0 874087.7 916791.2 803313.56 451216.53 281826.25 177734.83 328.1913 4.47 4.47 0 40 AC1L9EVY CollisionEnergy:102040 COc1ccc(CC2c3cc(OC)c(OC)cc3CC[N+]2(C)C)cc1OC "InChI=1S/C22H30NO4/c1-23(2)10-9-16-13-21(26-5)22(27-6)14-17(16)18(23)11-15-7-8-19(24-3)20(12-15)25-4/h7-8,12-14,18H,9-11H2,1-6H3/q+1" 3617870.466666667 309766.9666666667 0.0 3077655.2 3695431.2 4080525.0 216422.0 355194.78 357684.12 0.0 0.0 0.0 285.0762 9.64 9.64 0 8 5-hydroxy-2-(4-hydroxyphenyl)-7-methoxy-4H-chromen-4-one O=C1C=C(OC=2C=C(OC)C=C(O)C12)C=3C=CC(O)=CC3 InChI=1S/C16H12O5/c1-20-11-6-12(18)16-13(19)8-14(21-15(16)7-11)9-2-4-10(17)5-3-9/h2-8,17-18H,1H3 477930.1 1180864.4 664281.84 423244.62 578846.56 431699.12 1139284.6 1056142.8 1347165.8 710901.56 704052.4 577891.56 222.0612 1.21 1.21 0 31 2479-49-4 O=C(c1cc(C(=O)O)c(C(=O)O)cc1)c1cc(C(=O)O)c(C(=O)O)cc1 InChI=1S/C17H10O9/c18-13(7-1-3-9(14(19)20)11(5-7)16(23)24)8-2-4-10(15(21)22)12(6-8)17(25)26/h1-6H,(H,19,20)(H,21,22)(H,23,24)(H,25,26) 99713.617 0.0 0.0 129046.766 110073.12 60020.965 0.0 0.0 0.0 0.0 0.0 0.0 599.4102 12.56 12.56 0 3 0.0 151024.56999999998 139920.63533333334 0.0 0.0 0.0 125266.88 144231.0 183575.83 172984.6 120928.516 125848.79 282.0978 1.26 1.26 0 5 N-Methylglutamate - 40.0 eV CN[C@@H](CCC(=O)O)C(=O)O InChI=1S/C6H11NO4/c1-7-4(6(10)11)2-3-5(8)9/h4,7H,2-3H2,1H3,(H,8,9)(H,10,11)/t4-/m0/s1 75029.10066666667 0.0 0.0 93770.234 60855.258 70461.81 0.0 0.0 0.0 0.0 0.0 0.0 392.2715 14.07 14.07 0 3 CHEBI:181879 CC1(CO)CC(O)[C@]2(C(=O)O)CCC34CC3(C=CC3[C@]5(C)C(CC[C@]34C)C(C)(CO)[C@@H](O)[C@H](O)[C@@H]5O)C2C1 InChI=1S/C30H46O8/c1-24(14-31)11-18-28-8-6-17-26(3,29(28,13-28)9-10-30(18,23(37)38)19(33)12-24)7-5-16-25(2,15-32)21(35)20(34)22(36)27(16,17)4/h6,8,16-22,31-36H,5,7,9-15H2,1-4H3,(H,37,38)/t16?,17?,18?,19?,20-,21-,22-,24?,25?,26+,27-,28?,29?,30-/m0/s1 177776.37 39532.632333333335 39675.526666666665 146702.7 173822.3 212804.11 25771.738 25904.559 66921.6 39517.676 39775.08 39733.824 320.1499 8.26 8.26 0 2 Piplartine COc1cc(/C=C/C(=O)N2CCC=CC2=O)cc(OC)c1OC InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+ 564056.73 64627.37733333333 0.0 488314.97 520153.72 683701.5 24071.086 88407.28 81403.766 0.0 0.0 0.0 583.4152 16.6 16.6 0 3 CHEBI:181245 CC(CC(O)C(O)C(C)(C)O)C1CCC2(C)C3CCC4C(C)(C(=O)OC5OC(CO)C(O)C(O)C5O)C(O)CC(O)C45CC35CCC12C InChI=1S/C36H60O12/c1-17(13-19(38)28(44)31(2,3)46)18-9-10-33(5)21-7-8-22-34(6,30(45)48-29-27(43)26(42)25(41)20(15-37)47-29)23(39)14-24(40)36(22)16-35(21,36)12-11-32(18,33)4/h17-29,37-44,46H,7-16H2,1-6H3 32594.621000000003 31456.806666666667 75203.628 52403.758 0.0 45380.105 36349.96 28970.2 29050.26 80913.72 83393.25 61303.914 282.1494 5.83 5.83 0 9 301160.41333333333 0.0 9113.376333333334 262335.56 97244.38 543901.3 0.0 0.0 0.0 27340.129 0.0 0.0 455.2183 6.51 6.51 0 2 41210.222 0.0 0.0 43967.926 36234.59 43428.15 0.0 0.0 0.0 0.0 0.0 0.0 393.279 14.7 14.7 0 3 (2S,3S,4S,5R,6R)-6-[[(3S,4S,6aR,6bS,8R,8aR,9R,10R,12aS,14bR)-10-acetyloxy-8a-(acetyloxymethyl)-8,9-dihydroxy-4-(hydroxymethyl)-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-4-hydroxy-3,5-bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]oxane-2-carboxylic acid CC(=O)OC[C@@]12[C@@H](CC(C)(C)[C@@H](OC(C)=O)[C@@H]1O)C1=CCC3[C@@]4(C)CC[C@H](O[C@@H]5O[C@H](C(=O)O)[C@@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@H](O)[C@H]5O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@](C)(CO)C4CC[C@@]3(C)[C@]1(C)C[C@H]2O InChI=1S/C52H82O24/c1-21(56)69-20-52-24(15-47(3,4)42(41(52)66)70-22(2)57)23-9-10-28-48(5)13-12-30(49(6,19-55)27(48)11-14-50(28,7)51(23,8)16-29(52)58)73-46-39(75-45-36(64)34(62)32(60)26(18-54)72-45)37(65)38(40(76-46)43(67)68)74-44-35(63)33(61)31(59)25(17-53)71-44/h9,24-42,44-46,53-55,58-66H,10-20H2,1-8H3,(H,67,68)/t24-,25+,26+,27?,28?,29+,30-,31+,32+,33-,34-,35+,36+,37-,38-,39+,40-,41-,42-,44-,45-,46+,48-,49+,50+,51+,52-/m0/s1 74421.40666666666 11788.854 233867.2033333333 67992.72 71185.9 84085.6 0.0 35366.562 0.0 148054.61 208241.8 345305.2 369.17 9.72 9.72 0 24 "4-[(1R,5R)-6-(3,4-dimethoxyphenyl)-3,7-dioxabicyclo[3.3.0]oct-2-yl]-1,2-dimeth oxybenzene CollisionEnergy:205060" COc1ccc(C2OCC3C(c4ccc(OC)c(OC)c4)OCC23)cc1OC "InChI=1S/C22H26O6/c1-23-17-7-5-13(9-19(17)25-3)21-15-11-28-22(16(15)12-27-21)14-6-8-18(24-2)20(10-14)26-4/h5-10,15-16,21-22H,11-12H2,1-4H3/t15-,16-,21?,22?/m0/s1" 135917.55333333334 0.0 0.0 108996.84 113078.62 185677.2 0.0 0.0 0.0 0.0 0.0 0.0 738.4788 15.32 15.32 0 18 2178106.3666666667 0.0 0.0 2165543.5 1318649.4 3050126.2 0.0 0.0 0.0 0.0 0.0 0.0 651.2819 15.58 15.58 0 8 0.0 65113.52033333333 411954.25333333336 0.0 0.0 0.0 39372.24 127930.38 28037.941 139339.72 382364.94 714158.1 388.1761 10.11 10.11 0 24 Spectral Match to Arctigenin from NIST14 nan nan 37328.99033333333 0.0 0.0 26130.523 34767.848 51088.6 0.0 0.0 0.0 0.0 0.0 0.0 303.1959 14.09 14.09 0 27 260125.16 0.0 0.0 294067.53 251105.12 235202.83 0.0 0.0 0.0 0.0 0.0 0.0 824.5523 16.32 16.32 0 18 INT-767 CC[C@H]1[C@@H](O)[C@@H]2[C@H](CC[C@]3(C)[C@@H]([C@H](C)CCOS(=O)(=O)O)CC[C@@H]23)[C@@]2(C)CC[C@@H](O)C[C@@H]12 InChI=1S/C25H44O6S/c1-5-17-21-14-16(26)8-11-25(21,4)20-9-12-24(3)18(6-7-19(24)22(20)23(17)27)15(2)10-13-31-32(28,29)30/h15-23,26-27H,5-14H2,1-4H3,(H,28,29,30)/t15-,16-,17-,18-,19+,20+,21+,22+,23-,24-,25-/m1/s1 64673.996333333336 7886.405666666667 89017.51333333335 57875.445 62474.56 73671.984 0.0 23659.217 0.0 41998.19 82468.85 142585.5 201.0913 10.49 10.49 0 52 0.0 0.0 248360.9833333333 0.0 0.0 0.0 0.0 0.0 0.0 79068.01 282252.56 383762.38 341.1386 16.85 16.85 0 24 Knemolic acid B OC1=C(C(O)=O)C(CCCCCCC2=CC(OCO3)=C3C=C2)=CC=C1 InChI=1S/C20H22O5/c21-16-9-5-8-15(19(16)20(22)23)7-4-2-1-3-6-14-10-11-17-18(12-14)25-13-24-17/h5,8-12,21H,1-4,6-7,13H2,(H,22,23) 180269.5166666667 0.0 0.0 170508.58 163310.83 206989.14 0.0 0.0 0.0 0.0 0.0 0.0 599.41 16.66 16.66 0 3 718108.2000000001 132408.851 0.0 558532.0 750918.3 844874.3 62357.633 165771.31 169097.61 0.0 0.0 0.0 584.4218 16.6 16.6 0 3 CHEBI:181879 CC1(CO)CC(O)[C@]2(C(=O)O)CCC34CC3(C=CC3[C@]5(C)C(CC[C@]34C)C(C)(CO)[C@@H](O)[C@H](O)[C@@H]5O)C2C1 InChI=1S/C30H46O8/c1-24(14-31)11-18-28-8-6-17-26(3,29(28,13-28)9-10-30(18,23(37)38)19(33)12-24)7-5-16-25(2,15-32)21(35)20(34)22(36)27(16,17)4/h6,8,16-22,31-36H,5,7,9-15H2,1-4H3,(H,37,38)/t16?,17?,18?,19?,20-,21-,22-,24?,25?,26+,27-,28?,29?,30-/m0/s1 87833.97666666667 30414.051000000003 208275.412 60191.555 110006.055 93304.32 25300.133 65942.02 0.0 121566.336 202294.1 300965.8 387.1808 6.48 6.48 0 24 "4-[(1R,5R)-6-(3,4-dimethoxyphenyl)-3,7-dioxabicyclo[3.3.0]oct-2-yl]-1,2-dimeth oxybenzene CollisionEnergy:205060" COc1ccc(C2OCC3C(c4ccc(OC)c(OC)c4)OCC23)cc1OC "InChI=1S/C22H26O6/c1-23-17-7-5-13(9-19(17)25-3)21-15-11-28-22(16(15)12-27-21)14-6-8-18(24-2)20(10-14)26-4/h5-10,15-16,21-22H,11-12H2,1-4H3/t15-,16-,21?,22?/m0/s1" 2455577.3000000003 85818.63 240804.85666666663 2493831.5 1740507.2 3132393.2 89603.58 78769.08 89083.23 171749.48 384273.47 166391.62 286.1442 5.11 5.11 0 40 Coclaurine OC1=C(OC)C=C2C([C@@](CC3=CC=C(O)C=C3)([H])NCC2)=C1 InChI=1S/C17H19NO3/c1-21-17-9-12-6-7-18-15(14(12)10-16(17)20)8-11-2-4-13(19)5-3-11/h2-5,9-10,15,18-20H,6-8H2,1H3/t15-/m0/s1 682754.0066666667 0.0 0.0 330082.56 431142.66 1287036.8 0.0 0.0 0.0 0.0 0.0 0.0 635.3225 17.26 17.26 0 8 228496.2666666667 138193.44333333333 133624.22166666668 284874.1 79632.76 320981.94 114657.84 133540.6 166381.89 106169.375 157458.1 137245.19 360.1504 1.04 1.04 0 39 Melezitose OC[C@H]1O[C@H](O[C@H]2[C@H](O)[C@@H](CO)O[C@@]2(CO)O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@@H]1O InChI=1S/C18H32O16/c19-1-5-8(23)11(26)13(28)16(30-5)32-15-10(25)7(3-21)33-18(15,4-22)34-17-14(29)12(27)9(24)6(2-20)31-17/h5-17,19-29H,1-4H2/t5-,6-,7-,8-,9-,10-,11+,12+,13-,14-,15+,16-,17-,18+/m1/s1 479514.6166666667 0.0 0.0 628270.4 353511.25 456762.2 0.0 0.0 0.0 0.0 0.0 0.0 584.4225 15.19 15.19 0 3 Massbank:MSJ00118 Zeaxanthin CC1=C(C(C[C@@H](C1)O)(C)C)/C=C/C(=C/C=C/C(=C/C=C/C=C(/C=C/C=C(/C=C/C2=C(C[C@H](CC2(C)C)O)C)\\C)\\C)/C)/C 1S/C40H56O2/c1-29(17-13-19-31(3)21-23-37-33(5)25-35(41)27-39(37,7)8)15-11-12-16-30(2)18-14-20-32(4)22-24-38-34(6)26-36(42)28-40(38,9)10/h11-24,35-36,41-42H,25-28H2,1-10H3/b12-11+,17-13+,18-14+,23-21+,24-22+,29-15+,30-16+,31-19+,32-20+/t35-,36-/m1/s1 45890.98533333334 0.0 0.0 44171.773 39044.273 54456.91 0.0 0.0 0.0 0.0 0.0 0.0 333.2155 6.01 6.01 0 22 0.0 46781.10133333333 249635.26 0.0 0.0 0.0 69806.484 0.0 70536.82 252595.38 220870.06 275440.34 242.9828 1.27 1.27 0 51 67564.05133333334 0.0 0.0 59515.004 64890.41 78286.74 0.0 0.0 0.0 0.0 0.0 0.0 630.4266 16.61 16.61 0 3 NCGC00381199-01_C25H38O4_(3aR,5E,7S,10E,14E,16aS)-2,7-Dihydroxy-3-[(2S)-1-hydroxy-2-propanyl]-6,10,14,16a-tetramethyl-4,7,8,9,12,13,16,16a-octahydrocyclopenta[15]annulen-1(3aH)-one C[C@H](CO)C/1=C(O)/C(=O)[C@@]2(C)C/C=C(C)/CC/C=C(C)/CC[C@H](O)/C(=C/C[C@H]12)C InChI=1S/C25H38O4/c1-16-7-6-8-17(2)13-14-25(5)20(11-10-18(3)21(27)12-9-16)22(19(4)15-26)23(28)24(25)29/h7,10,13,19-21,26-28H,6,8-9,11-12,14-15H2,1-5H3/b16-7+,17-13+,18-10+/t19-,20-,21+,25+/m1/s1 16813.183 0.0 50604.70133333333 22982.535 0.0 27457.014 0.0 0.0 0.0 24024.336 58959.438 68830.33 325.1441 7.42 7.42 0 24 0.0 12456.28 90119.04333333332 0.0 0.0 0.0 0.0 37368.84 0.0 73645.07 80814.54 115897.52 219.102 7.31 7.31 0 34 (2R,3R,4S,5S,6R)-2-[[7-hydroxy-1-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-6-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol COc1cc(C2c3cc(O)c(OC)cc3CC(CO)C2CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)ccc1O InChI=1S/C26H34O11/c1-34-19-6-12(3-4-17(19)29)22-15-8-18(30)20(35-2)7-13(15)5-14(9-27)16(22)11-36-26-25(33)24(32)23(31)21(10-28)37-26/h3-4,6-8,14,16,21-33H,5,9-11H2,1-2H3/t14?,16?,21-,22?,23-,24+,25-,26-/m1/s1 53116.47400000001 22399.52133333333 72234.74066666666 57461.137 32827.395 69060.89 35342.906 31855.658 0.0 118924.73 55233.715 42545.777 316.1396 1.22 1.22 0 6 4499755.166666667 1383699.2333333334 0.0 4271774.5 4445410.0 4782081.0 1066081.9 1459145.2 1625870.6 0.0 0.0 0.0 360.2173 5.53 5.53 0 15 523788.86 6279.946 0.0 444309.28 434502.4 692554.9 0.0 18839.838 0.0 0.0 0.0 0.0 599.4101 16.09 16.09 0 3 350420.3133333333 0.0 0.0 408876.28 242045.56 400339.1 0.0 0.0 0.0 0.0 0.0 0.0 591.2607 15.77 15.77 0 8 0.0 0.0 78447.17866666666 0.0 0.0 0.0 0.0 0.0 0.0 59138.496 85307.73 90895.31 358.1413 9.2 9.2 0 24 100660.37333333334 44321.64000000001 0.0 0.0 157227.06 144754.06 0.0 0.0 132964.92 0.0 0.0 0.0 429.3732 14.96 14.96 0 64 Spectral Match to (+)-.alpha.-Tocopherol from NIST14 nan nan 0.0 89242.69233333333 51008.42166666666 0.0 0.0 0.0 117821.01 90338.84 59568.227 88105.79 33172.082 31747.393 236.0922 1.66 1.66 0 5 50954.23533333334 0.0 0.0 51920.582 34400.934 66541.19 0.0 0.0 0.0 0.0 0.0 0.0 631.2529 15.31 15.31 0 67 38775.047666666665 0.0 0.0 32698.014 31419.629 52207.5 0.0 0.0 0.0 0.0 0.0 0.0 627.232 9.54 9.54 0 4 87030.27333333333 38611.26933333334 58698.085 128170.71 0.0 132920.11 29826.125 35465.406 50542.277 30613.035 74457.13 71024.09 343.1239 1.03 1.03 0 39 Stachyose OC[C@H]1O[C@H](OC[C@H]2O[C@H](OC[C@H]3O[C@H](O[C@]4(CO)O[C@H](CO)[C@@H](O)[C@@H]4O)[C@H](O)[C@@H](O)[C@@H]3O)[C@H](O)[C@@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@H]1O InChI=1S/C24H42O21/c25-1-6-10(28)14(32)17(35)21(41-6)39-3-8-11(29)15(33)18(36)22(42-8)40-4-9-12(30)16(34)19(37)23(43-9)45-24(5-27)20(38)13(31)7(2-26)44-24/h6-23,25-38H,1-5H2/t6-,7-,8-,9-,10+,11+,12-,13-,14+,15+,16+,17-,18-,19-,20+,21+,22+,23-,24+/m1/s1 502442.3866666667 0.0 0.0 470944.9 337552.66 698829.6 0.0 0.0 0.0 0.0 0.0 0.0 625.2662 15.41 15.41 0 7 91817.592 0.0 0.0 97909.74 74272.336 103270.7 0.0 0.0 0.0 0.0 0.0 0.0 506.2754 4.96 4.96 0 15 1635812.0 408198.7333333333 0.0 0.0 2446829.0 2460607.0 0.0 1224596.2 0.0 0.0 0.0 0.0 301.1628 3.11 3.11 0 40 27343.375 977510.0666666668 4885133.166666667 0.0 0.0 82030.125 775741.0 1604855.2 551934.0 2575348.0 4604904.0 7475147.5 321.1127 9.93 9.93 0 24 hydrastinine CN1CCc2cc3c(cc2C1O)OCO3 "InChI=1S/C11H13NO3/c1-12-3-2-7-4-9-10(15-6-14-9)5-8(7)11(12)13/h4-5,11,13H,2-3,6H2,1H3" 68171.15166666667 33487.45333333333 0.0 59794.84 68718.875 75999.74 0.0 31614.01 68848.35 0.0 0.0 0.0 388.1606 5.99 5.99 0 75 332646.3133333333 14714.942 0.0 282622.0 289530.56 425786.38 0.0 21437.236 22707.59 0.0 0.0 0.0 634.2794 15.97 15.97 0 8 97053.54 1045227.8333333334 0.0 291160.62 0.0 0.0 0.0 1343544.6 1792138.9 0.0 0.0 0.0 758.5695 15.91 15.91 0 23 Spectral Match to 1-Stearoyl-2-linoleoyl-sn-glycero-3-phosphocholine from NIST14 CCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCC/C=C\\C/C=C\\CCCCC InChI=1S/C44H84NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-43(46)50-40-42(41-52-54(48,49)51-39-38-45(3,4)5)53-44(47)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h15,17,21,23,42H,6-14,16,18-20,22,24-41H2,1-5H3/b17-15-,23-21-/t42-/m1/s1 733342.4 108807.25133333332 23901.15566666667 612031.7 722697.9 865297.6 28466.314 58854.39 239101.05 0.0 39053.395 32650.072 657.2423 9.34 9.34 0 4 514422.26 504699.00666666665 1154345.2333333334 609154.8 780395.5 153716.48 516568.72 568117.2 429411.1 1250916.2 1144767.5 1067352.0 241.9999 0.88 0.88 0 5 0.0 0.0 182467.09666666668 0.0 0.0 0.0 0.0 0.0 0.0 43247.24 230308.3 273845.75 323.1283 16.98 16.98 0 24 4,4'-Dimethoxychalcone COc1ccc(/C=C/C(=O)c2ccc(OC)cc2)cc1 InChI=1S/C17H16O3/c1-19-15-8-3-13(4-9-15)5-12-17(18)14-6-10-16(20-2)11-7-14/h3-12H,1-2H3/b12-5+ 110761.01 138323.94 116682.23133333334 0.0 211078.31 121204.72 85389.84 132220.64 197361.34 61652.14 130167.414 158227.14 801.5494 17.26 17.26 0 26 Candidate GABA-C18:2 (delta mass:262.2306) nan nan 354604.9066666667 0.0 0.0 417497.7 250903.05 395413.97 0.0 0.0 0.0 0.0 0.0 0.0 584.4224 16.38 16.38 0 3 52209.99833333333 8402.52 44842.85833333334 82345.805 0.0 74284.19 25207.56 0.0 0.0 51412.152 42690.7 40425.723 265.1226 6.52 6.52 0 8 65005.418333333335 0.0 0.0 62379.79 27455.225 105181.24 0.0 0.0 0.0 0.0 0.0 0.0 316.1912 5.88 5.88 0 15 38732.780666666666 0.0 0.0 37568.77 38200.67 40428.902 0.0 0.0 0.0 0.0 0.0 0.0 613.4233 17.29 17.29 0 3 Massbank:MSJ00114 Nostoxanthin CC1=C(C([C@H]([C@@H](C1)O)O)(C)C)/C=C/C(=C/C=C/C(=C/C=C/C=C(/C=C/C=C(/C=C/C2=C(C[C@H]([C@@H](C2(C)C)O)O)C)\\C)\\C)/C)/C 1S/C40H56O4/c1-27(17-13-19-29(3)21-23-33-31(5)25-35(41)37(43)39(33,7)8)15-11-12-16-28(2)18-14-20-30(4)22-24-34-32(6)26-36(42)38(44)40(34,9)10/h11-24,35-38,41-44H,25-26H2,1-10H3/b12-11+,17-13+,18-14+,23-21+,24-22+,27-15+,28-16+,29-19+,30-20+/t35-,36-,37+,38+/m1/s1 0.0 0.0 65426.01066666667 0.0 0.0 0.0 0.0 0.0 0.0 21734.992 78991.97 95551.07 341.1385 16.69 16.69 0 24 Knemolic acid B OC1=C(C(O)=O)C(CCCCCCC2=CC(OCO3)=C3C=C2)=CC=C1 InChI=1S/C20H22O5/c21-16-9-5-8-15(19(16)20(22)23)7-4-2-1-3-6-14-10-11-17-18(12-14)25-13-24-17/h5,8-12,21H,1-4,6-7,13H2,(H,22,23) 10853.735 55743.41666666666 27042.47333333333 32561.205 0.0 0.0 0.0 0.0 167230.25 0.0 0.0 81127.42 708.5119 17.08 17.08 0 32 L-phenylalanine_dodecanoic acid CCCCCCCCCCCC(=O)N[C@@H](Cc1ccccc1)C(=O)O InChI=1S/C21H33NO3/c1-2-3-4-5-6-7-8-9-13-16-20(23)22-19(21(24)25)17-18-14-11-10-12-15-18/h10-12,14-15,19H,2-9,13,16-17H2,1H3,(H,22,23)(H,24,25)/t19-/m0/s1 24946.375 314529.51666666666 587425.66 0.0 74839.125 0.0 458167.7 205080.6 280340.25 1394941.1 167411.94 199923.94 252.2324 13.44 13.44 0 58 (2E,4E)-N-(2-methylpropyl)dodeca-2,4-dienamide CCCCCCC/C=C/C=C/C(O)=NCC(C)C InChI=1S/C16H29NO/c1-4-5-6-7-8-9-10-11-12-13-16(18)17-14-15(2)3/h10-13,15H,4-9,14H2,1-3H3,(H,17,18)/b11-10+,13-12+ 3101667.966666667 28471.243999999995 0.0 2842195.2 2510336.5 3952472.2 0.0 41218.92 44194.812 0.0 0.0 0.0 607.2556 14.35 14.35 0 8 114233.675 0.0 0.0 148893.69 106076.96 87730.375 0.0 0.0 0.0 0.0 0.0 0.0 599.4103 16.34 16.34 0 3 43176.01066666667 0.0 0.0 37330.992 35848.63 56348.41 0.0 0.0 0.0 0.0 0.0 0.0 609.2711 14.22 14.22 0 8 257885.20333333337 126421.83 237472.92666666667 258865.23 247191.1 267599.28 137345.48 104726.18 137193.83 233269.3 231780.88 247368.6 463.0564 8.81 8.81 0 20 28775.244666666666 457882.53333333327 91567.652 0.0 86325.734 0.0 572497.6 281426.94 519723.06 123431.97 79991.766 71279.22 302.1756 10.68 10.68 0 70 (4E)-N-Isobutyl-5-(1,3-benzodioxol-5-yl)-4-pentenamide CC(C)CNC(=O)CC/C=C/c1cc2c(cc1)OCO2 InChI=1S/C16H21NO3/c1-12(2)10-17-16(18)6-4-3-5-13-7-8-14-15(9-13)20-11-19-14/h3,5,7-9,12H,4,6,10-11H2,1-2H3,(H,17,18)/b5-3+ 599250.5066666667 573388.5766666667 1452661.2333333334 720386.06 916921.44 160444.02 597237.56 640796.2 482131.97 1572880.8 1431455.0 1353647.9 223.9894 0.88 0.88 0 5 0.0 0.0 61854.956000000006 0.0 0.0 0.0 0.0 0.0 0.0 33004.312 69869.29 82691.266 219.1019 9.2 9.2 0 34 "MLS002473104-01!(2R)-6-(2-hydroxyethyl)-2,5,7-trimethyl-2,3-dihydroinden-1-one" C[C@@H]1Cc2cc(C)c(CCO)c(C)c2C1=O InChI=1S/C14H18O2/c1-8-6-11-7-9(2)14(16)13(11)10(3)12(8)4-5-15/h6,9,15H,4-5,7H2,1-3H3/t9-/m1/s1 84085.36499999999 0.0 11304.548333333332 61946.43 63546.875 126762.79 0.0 0.0 0.0 33913.645 0.0 0.0 520.3405 12.32 12.32 0 23 Spectral Match to Lyso-PC(16:0) from NIST14 CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)O InChI=1S/C24H50NO7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-24(27)30-21-23(26)22-32-33(28,29)31-20-19-25(2,3)4/h23,26H,5-22H2,1-4H3/t23-/m1/s1 155137.17666666667 33242.194 0.0 122510.7 147507.47 195393.36 0.0 32101.957 67624.625 0.0 0.0 0.0 538.2076 9.99 9.99 0 28 432582.4666666666 113099.23333333334 0.0 496432.72 543004.9 258309.78 0.0 339297.7 0.0 0.0 0.0 0.0 234.0974 15.85 15.85 0 85 56529.19566666667 0.0 0.0 54031.227 52367.973 63188.387 0.0 0.0 0.0 0.0 0.0 0.0 691.2741 14.8 14.8 0 8 76407.90233333333 89612.90333333332 104633.33333333331 81860.984 95044.2 52318.523 90685.02 90176.68 87977.01 111550.44 103917.6 98431.96 255.9392 0.88 0.88 0 62 0.0 0.0 115744.138 0.0 0.0 0.0 0.0 0.0 0.0 67476.234 129283.38 150472.8 340.1161 9.2 9.2 0 24 29747.036666666663 7310.513333333333 22729.26166666667 36627.723 25257.037 27356.35 21931.54 0.0 0.0 0.0 22021.215 46166.57 432.2809 4.47 4.47 0 36 2456192.2 465477.7533333333 2528604.6 2081493.1 2561123.5 2725960.0 480719.6 417368.1 498345.56 2095246.5 2738438.5 2752128.8 320.1497 9.07 9.07 0 2 Piplartine COc1cc(/C=C/C(=O)N2CCC=CC2=O)cc(OC)c1OC InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+ 628068.8166666668 366744.4266666667 215945.10333333336 599254.6 634918.25 650033.6 350950.28 290717.3 458565.7 257655.56 205445.67 184734.08 363.1917 8.01 8.01 0 2 Piperlongumine CollisionEnergy:102040 COc1cc(C=CC(=O)N2CCC=CC2=O)cc(OC)c1OC "InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+" 75905.18333333333 0.0 0.0 59393.156 57891.66 110430.734 0.0 0.0 0.0 0.0 0.0 0.0 721.4524 15.29 15.29 0 18 104121.89666666668 145677.5116666667 575282.4966666667 98698.52 85917.16 127750.01 102245.38 223710.6 111076.555 345482.4 513839.84 866525.25 217.0863 8.95 8.95 0 34 dl-3-Indolelactic acid - 40.0 eV c1ccc2c(c1)c(c[nH]2)CC(C(=O)O)O InChI=1S/C11H11NO3/c13-10(11(14)15)5-7-6-12-9-4-2-1-3-8(7)9/h1-4,6,10,12-13H,5H2,(H,14,15) 21694.698666666667 41827.18033333333 82761.94466666666 0.0 30255.541 34828.555 28864.174 54366.09 42251.277 64359.168 76768.65 107158.016 219.102 7.93 7.93 0 34 (2R,3R,4S,5S,6R)-2-[[7-hydroxy-1-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-6-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol COc1cc(C2c3cc(O)c(OC)cc3CC(CO)C2CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)ccc1O InChI=1S/C26H34O11/c1-34-19-6-12(3-4-17(19)29)22-15-8-18(30)20(35-2)7-13(15)5-14(9-27)16(22)11-36-26-25(33)24(32)23(31)21(10-28)37-26/h3-4,6-8,14,16,21-33H,5,9-11H2,1-2H3/t14?,16?,21-,22?,23-,24+,25-,26-/m1/s1 0.0 478119.5866666666 108745.86666666664 0.0 0.0 0.0 0.0 614602.56 819756.2 0.0 0.0 326237.6 759.573 15.9 15.9 0 23 Spectral Match to 1-Oleoyl-2-palmitoyl-sn-glycero-3-phosphocholine from NIST14 CCCCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCC/C=C\\CCCCCCCC)COP(=O)([O-])OCC[N+](C)(C)C InChI=1S/C42H82NO8P/c1-6-8-10-12-14-16-18-20-21-23-24-26-28-30-32-34-41(44)48-38-40(39-50-52(46,47)49-37-36-43(3,4)5)51-42(45)35-33-31-29-27-25-22-19-17-15-13-11-9-7-2/h20-21,40H,6-19,22-39H2,1-5H3/b21-20-/t40-/m1/s1 134429.11666666667 30593.349666666665 0.0 124951.46 127586.06 150749.83 24015.969 42922.793 24841.287 0.0 0.0 0.0 355.1541 4.83 4.83 0 24 48254.64833333334 39152.98333333333 39438.501 57884.57 0.0 86879.375 53185.25 64273.7 0.0 0.0 48031.043 70284.46 556.4427 14.55 14.55 0 36 Spectral Match to Nonaethylene glycol from NIST14 nan nan 43493.424 0.0 0.0 42794.707 34905.805 52779.76 0.0 0.0 0.0 0.0 0.0 0.0 716.2221 4.04 4.04 0 60 5442819.833333333 1710791.5 5866145.666666667 5479867.0 5555102.5 5293490.0 1700030.4 1654050.1 1778294.0 5181899.5 5975437.5 6441100.0 657.2421 8.83 8.83 0 4 187581.19333333336 0.0 0.0 192331.92 191103.02 179308.64 0.0 0.0 0.0 0.0 0.0 0.0 514.1385 2.58 2.58 0 35 151654.25666666668 6478.362 161469.30166666667 130019.88 170332.36 154610.53 0.0 0.0 19435.086 112853.305 182401.48 189153.12 661.2738 9.07 9.07 0 45 0.0 68983.58666666667 0.0 0.0 0.0 0.0 40941.867 144909.7 21099.193 0.0 0.0 0.0 285.1239 3.96 3.96 0 90 0.0 24101.51833333333 210479.41666666663 0.0 0.0 0.0 0.0 72304.555 0.0 110805.66 195695.25 324937.34 337.144 9.24 9.24 0 24 77820.79833333334 0.0 0.0 82449.266 65002.043 86011.086 0.0 0.0 0.0 0.0 0.0 0.0 618.4279 14.17 14.17 0 3 40269.352000000006 0.0 41696.90666666667 37053.004 30674.172 53080.88 0.0 0.0 0.0 32881.227 43024.38 49185.113 579.1508 4.99 4.99 0 69 Procyanidin B3 40eV C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=CC(=CC(=C34)O)O)C5=CC(=C(C=C5)O)O)O)O)O)C6=CC(=C(C=C6)O)O)O XFZJEEAOWLFHDH-AVFWISQGSA-N 364132.4866666666 10731.431 0.0 333106.0 292901.66 466389.8 0.0 0.0 32194.293 0.0 0.0 0.0 599.4102 16.44 16.44 0 3 77511.748 0.0 0.0 66166.32 32826.824 133542.1 0.0 0.0 0.0 0.0 0.0 0.0 346.2015 6.25 6.25 0 15 26890.948666666667 0.0 0.0 21179.447 28681.309 30812.09 0.0 0.0 0.0 0.0 0.0 0.0 426.0667 8.02 8.02 0 2 "(2E)-1-(1,3-dimethylpyrazol-4-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one CollisionEnergy:102040" COc1cc(C=CC(=O)c2cn(C)nc2C)cc(OC)c1OC "InChI=1S/C17H20N2O4/c1-11-13(10-19(2)18-11)14(20)7-6-12-8-15(21-3)17(23-5)16(9-12)22-4/h6-10H,1-5H3/b7-6+" 19205.103 0.0 10013.445333333331 0.0 30967.014 26648.295 0.0 0.0 0.0 0.0 30040.336 0.0 454.2935 12.94 12.94 0 18 Spectral Match to 1-Palmitoyl-2-hydroxy-sn-glycero-3-phosphoethanolamine from NIST14 nan nan 457830.2833333334 273707.4 0.0 823318.25 0.0 550172.6 0.0 0.0 821122.2 0.0 0.0 0.0 783.5729 15.21 15.21 0 23 Spectral Match to 1-Oleoyl-2-palmitoyl-sn-glycero-3-phosphocholine from NIST14 CCCCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCC/C=C\\CCCCCCCC)COP(=O)([O-])OCC[N+](C)(C)C InChI=1S/C42H82NO8P/c1-6-8-10-12-14-16-18-20-21-23-24-26-28-30-32-34-41(44)48-38-40(39-50-52(46,47)49-37-36-43(3,4)5)51-42(45)35-33-31-29-27-25-22-19-17-15-13-11-9-7-2/h20-21,40H,6-19,22-39H2,1-5H3/b21-20-/t40-/m1/s1 54418.95166666667 10191.876666666669 0.0 37691.918 60738.375 64826.562 0.0 0.0 30575.63 0.0 0.0 0.0 499.317 14.09 14.09 0 11 0.0 291467.62666666665 75779.31666666667 0.0 0.0 0.0 220926.8 423676.6 229799.48 0.0 131141.05 96196.9 295.0719 3.78 3.78 0 5 Thelephoric acid O=C1c2c(c3c(cc(O)c(O)c3)o2)C(=O)c2c1c1c(o2)cc(c(c1)O)O "InChI=1S/C18H8O8/c19-7-1-5-11(3-9(7)21)25-17-13(5)15(23)18-14(16(17)24)6-2-8(20)10(22)4-12(6)26-18/h1-4,19-22H" 0.0 0.0 171843.99333333335 0.0 0.0 0.0 0.0 0.0 0.0 173856.23 285872.84 55802.91 354.0975 9.88 9.88 0 8 5-hydroxy-1,2,3-trimethoxyxanthone O=C1C2=C(OC)C(OC)=C(OC)C=C2OC3=C(O)C=CC=C31 InChI=1S/C16H14O6/c1-19-11-7-10-12(16(21-3)15(11)20-2)13(18)8-5-4-6-9(17)14(8)22-10/h4-7,17H,1-3H3 151735.90666666665 8407.166666666666 33160.056666666664 0.0 455207.72 0.0 0.0 25221.5 0.0 99480.17 0.0 0.0 279.0938 15.5 15.5 0 82 8546.655666666667 7419.114666666667 40675.852666666666 0.0 25639.967 0.0 22257.344 0.0 0.0 37701.16 38504.258 45822.14 207.0656 8.19 8.19 0 48 41333.98333333334 0.0 0.0 27173.305 42970.637 53858.008 0.0 0.0 0.0 0.0 0.0 0.0 207.0655 8.54 8.54 0 48 41845.420666666665 0.0 12079.12 40607.02 37629.902 47299.34 0.0 0.0 0.0 36237.36 0.0 0.0 205.1954 13.1 13.1 0 10 Bisabolol CollisionEnergy:205060 CC(C)=CCCC(C)(O)C1CC=C(C)CC1 "InChI=1S/C15H26O/c1-12(2)6-5-11-15(4,16)14-9-7-13(3)8-10-14/h6-7,14,16H,5,8-11H2,1-4H3" 203435.53333333333 76420.05333333333 235517.4933333333 188675.9 204220.31 217410.39 78047.52 69603.79 81608.85 218287.52 256367.08 231897.88 321.1421 8.83 8.83 0 81 116064.86666666664 598348.1466666667 3120009.8000000003 126771.86 91802.12 129620.62 415692.94 1077360.1 301991.4 1365213.4 3268084.0 4726732.0 205.1954 13.62 13.62 0 10 Bisabolol CollisionEnergy:205060 CC(C)=CCCC(C)(O)C1CC=C(C)CC1 "InChI=1S/C15H26O/c1-12(2)6-5-11-15(4,16)14-9-7-13(3)8-10-14/h6-7,14,16H,5,8-11H2,1-4H3" 48301.039 0.0 59712.170000000006 47602.883 47800.094 49500.14 0.0 0.0 0.0 56266.508 62118.44 60751.562 654.7352 8.82 8.82 0 79 0.0 0.0 58572.31633333334 0.0 0.0 0.0 0.0 0.0 0.0 43534.945 108052.41 24129.594 376.0797 9.88 9.88 0 8 60771.03666666666 0.0 0.0 57452.324 46348.176 78512.61 0.0 0.0 0.0 0.0 0.0 0.0 286.1442 3.88 3.88 0 40 N-methylcoclaurine OC1=C(OC)C=C2C([C@@](CC3=CC=C(O)C=C3)([H])N(C)CC2)=C1 InChI=1S/C18H21NO3/c1-19-8-7-13-10-18(22-2)17(21)11-15(13)16(19)9-12-3-5-14(20)6-4-12/h3-6,10-11,16,20-21H,7-9H2,1-2H3/t16-/m0/s1 1058746.6 77320.31533333333 0.0 1025206.1 1072029.1 1079004.6 47861.402 95419.414 88680.13 0.0 0.0 0.0 615.2582 15.85 15.85 0 21 65313.179 0.0 13468.146666666667 42876.605 54321.492 98741.44 0.0 0.0 0.0 40404.44 0.0 0.0 478.2935 12.27 12.27 0 18 Spectral Match to 1-Palmitoyl-2-hydroxy-sn-glycero-3-phosphoethanolamine from NIST14 nan nan 28884.033333333336 0.0 0.0 26884.63 22816.32 36951.15 0.0 0.0 0.0 0.0 0.0 0.0 757.2191 4.97 4.97 0 37 TYPHANEOSIDE CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC(=C(C=C5)O)OC)OC6C(C(C(C(O6)C)O)O)O)O)O)O)O)O "InChI=1S/C34H42O20/c1-10-20(38)24(42)27(45)32(49-10)48-9-18-22(40)26(44)31(54-33-28(46)25(43)21(39)11(2)50-33)34(52-18)53-30-23(41)19-15(37)7-13(35)8-17(19)51-29(30)12-4-5-14(36)16(6-12)47-3/h4-8,10-11,18,20-22,24-28,31-40,42-46H,9H2,1-3H3" 690699.1933333332 111341.51666666668 74414.83166666667 625720.44 680535.2 765841.94 99086.44 85467.72 149470.39 79141.875 72987.23 71115.39 288.1236 7.83 7.83 0 6 "3,4-DIMETHOXYCINNAMIC ACID CollisionEnergy:102040" COc1ccc(C=CC(=O)O)cc1OC "InChI=1S/C11H12O4/c1-14-9-5-3-8(4-6-11(12)13)7-10(9)15-2/h3-7H,1-2H3,(H,12,13)/b6-4+" 218386.24666666667 56789.16266666667 0.0 218819.95 181967.9 254370.89 38938.992 60879.016 70549.48 0.0 0.0 0.0 600.4179 15.01 15.01 0 3 1937777.0 537786.3333333334 8196.256 2015644.1 1604829.1 2192857.8 401884.06 582950.44 628524.5 0.0 0.0 24588.768 620.3005 17.04 17.04 0 8 65004.8 0.0 0.0 41671.5 38050.62 115292.28 0.0 0.0 0.0 0.0 0.0 0.0 532.3486 12.39 12.39 0 18 Spectral Match to Monolinolenin (9c,12c,15c) from NIST14 nan nan 1819525.566666667 0.0 0.0 1890772.6 1259748.9 2308055.2 0.0 0.0 0.0 0.0 0.0 0.0 300.1599 4.05 4.05 0 40 N,O-dimethylcoclaurine OC1=C(OC)C=C2C([C@@](CC3=CC=C(OC)C=C3)([H])N(C)CC2)=C1 InChI=1S/C19H23NO3/c1-20-9-8-14-11-19(23-3)18(21)12-16(14)17(20)10-13-4-6-15(22-2)7-5-13/h4-7,11-12,17,21H,8-10H2,1-3H3/t17-/m0/s1 89390.57666666666 87261.23666666666 0.0 0.0 183512.62 84659.11 0.0 103877.65 157906.06 0.0 0.0 0.0 497.4244 15.87 15.87 0 36 Spectral Match to Nonaethylene glycol from NIST14 nan nan 57646.405 0.0 61668.12899999999 53781.11 60155.395 59002.71 0.0 0.0 0.0 52903.645 68154.09 63946.652 503.1587 8.82 8.82 0 56 Piplartine COc1cc(/C=C/C(=O)N2CCC=CC2=O)cc(OC)c1OC InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+ 30928.961666666662 0.0 0.0 32874.055 30013.137 29899.693 0.0 0.0 0.0 0.0 0.0 0.0 681.3289 16.04 16.04 0 8 82922.83666666667 0.0 0.0 72271.12 86894.32 89603.07 0.0 0.0 0.0 0.0 0.0 0.0 355.227 12.52 12.52 0 14 NCGC00380882-01!5-chloro-2,4-dihydroxy-6-methyl-3-[(E)-3-methyl-5-[(1S,2R,6R)-1,2,6-trimethyl-3-oxocyclohexyl]pent-2-enyl]benzaldehyde [IIN-based on: CCMSLIB00000845779] C[C@@H]1CCC(=O)[C@H](C)[C@@]1(C)CC\\\\C(C)=C\\\\CC2=C(O)C(C=O)=C(C)C(Cl)=C2O InChI=1S/C23H31ClO4/c1-13(10-11-23(5)14(2)7-9-19(26)16(23)4)6-8-17-21(27)18(12-25)15(3)20(24)22(17)28/h6,12,14,16,27-28H,7-11H2,1-5H3/b13-6+/t14-,16+,23+/m1/s1 348815.38 0.0 0.0 371638.34 293674.3 381133.5 0.0 0.0 0.0 0.0 0.0 0.0 409.2741 13.57 13.57 0 3 (2S,3S,4S,5R,6R)-6-[[(3S,4S,6aR,6bS,8R,8aR,9R,10R,12aS,14bR)-10-acetyloxy-8a-(acetyloxymethyl)-8,9-dihydroxy-4-(hydroxymethyl)-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-4-hydroxy-3,5-bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]oxane-2-carboxylic acid CC(=O)OC[C@@]12[C@@H](CC(C)(C)[C@@H](OC(C)=O)[C@@H]1O)C1=CCC3[C@@]4(C)CC[C@H](O[C@@H]5O[C@H](C(=O)O)[C@@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@H](O)[C@H]5O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@](C)(CO)C4CC[C@@]3(C)[C@]1(C)C[C@H]2O InChI=1S/C52H82O24/c1-21(56)69-20-52-24(15-47(3,4)42(41(52)66)70-22(2)57)23-9-10-28-48(5)13-12-30(49(6,19-55)27(48)11-14-50(28,7)51(23,8)16-29(52)58)73-46-39(75-45-36(64)34(62)32(60)26(18-54)72-45)37(65)38(40(76-46)43(67)68)74-44-35(63)33(61)31(59)25(17-53)71-44/h9,24-42,44-46,53-55,58-66H,10-20H2,1-8H3,(H,67,68)/t24-,25+,26+,27?,28?,29+,30-,31+,32+,33-,34-,35+,36+,37-,38-,39+,40-,41-,42-,44-,45-,46+,48-,49+,50+,51+,52-/m0/s1 521549.6500000001 0.0 0.0 292083.06 244008.83 1028557.06 0.0 0.0 0.0 0.0 0.0 0.0 607.2921 16.14 16.14 0 8 Pheophorbide A CCC1=C2C=C3C(=C4C(=O)C(C(=C5C(C(C(=N5)C=C6C(=C(C(=CC(=C1C)N2)N6)C=C)C)C)CCC(=O)O)C4=N3)C(=O)OC)C InChI=1S/C35H36N4O5/c1-8-19-15(3)22-12-24-17(5)21(10-11-28(40)41)32(38-24)30-31(35(43)44-7)34(42)29-18(6)25(39-33(29)30)14-27-20(9-2)16(4)23(37-27)13-26(19)36-22/h8,12-14,17,21,31,36-37H,1,9-11H2,2-7H3,(H,40,41) 0.0 75996.91966666667 0.0 0.0 0.0 0.0 81762.266 64721.973 81506.52 0.0 0.0 0.0 219.102 5.46 5.46 0 34 (2R,3R,4S,5S,6R)-2-[[7-hydroxy-1-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-6-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol COc1cc(C2c3cc(O)c(OC)cc3CC(CO)C2CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)ccc1O InChI=1S/C26H34O11/c1-34-19-6-12(3-4-17(19)29)22-15-8-18(30)20(35-2)7-13(15)5-14(9-27)16(22)11-36-26-25(33)24(32)23(31)21(10-28)37-26/h3-4,6-8,14,16,21-33H,5,9-11H2,1-2H3/t14?,16?,21-,22?,23-,24+,25-,26-/m1/s1 144655.07666666666 0.0 0.0 154081.22 126272.65 153611.36 0.0 0.0 0.0 0.0 0.0 0.0 806.5417 16.52 16.52 0 18 1512171.1 155824.25 0.0 1384808.9 1411936.9 1739767.5 73821.29 213365.19 180286.27 0.0 0.0 0.0 567.4202 16.6 16.6 0 3 CHEBI:181245 CC(CC(O)C(O)C(C)(C)O)C1CCC2(C)C3CCC4C(C)(C(=O)OC5OC(CO)C(O)C(O)C5O)C(O)CC(O)C45CC35CCC12C InChI=1S/C36H60O12/c1-17(13-19(38)28(44)31(2,3)46)18-9-10-33(5)21-7-8-22-34(6,30(45)48-29-27(43)26(42)25(41)20(15-37)47-29)23(39)14-24(40)36(22)16-35(21,36)12-11-32(18,33)4/h17-29,37-44,46H,7-16H2,1-6H3 547246.0066666667 67793.838 42934.06666666667 487637.88 533342.2 620757.94 42981.434 60624.69 99775.39 35647.61 47180.035 45974.555 310.1056 7.83 7.83 0 45 85888.88799999999 105045.01666666666 65515.58533333333 86044.98 84594.45 87027.234 95689.75 104839.64 114605.66 102251.016 56386.22 37909.52 330.1704 3.72 3.72 0 40 Desvenlafaxine CN(C)CC(c1ccc(O)cc1)C1(O)CCCCC1 InChI=1S/C16H25NO2/c1-17(2)12-15(13-6-8-14(18)9-7-13)16(19)10-4-3-5-11-16/h6-9,15,18-19H,3-5,10-12H2,1-2H3 56546.85466666666 0.0 0.0 58630.06 45734.234 65276.27 0.0 0.0 0.0 0.0 0.0 0.0 391.2638 11.81 11.81 0 94 0.0 0.0 118039.2 0.0 0.0 0.0 0.0 0.0 0.0 53923.48 127103.72 173090.4 381.1314 9.21 9.21 0 -1 0.0 83702.83633333334 92246.71333333332 0.0 0.0 0.0 141849.56 42491.254 66767.695 115922.61 78383.99 82433.54 210.0401 3.77 3.77 0 -1 patulin CollisionEnergy:205060 O=C1C=C2C(=CCOC2O)O1 "InChI=1S/C7H6O4/c8-6-3-4-5(11-6)1-2-10-7(4)9/h1,3,7,9H,2H2" 803469.2533333333 56054.645 0.0 795644.0 689214.56 925549.2 97515.06 70648.875 0.0 0.0 0.0 0.0 801.346 6.69 6.69 0 -1 26751.658 0.0 0.0 26397.896 26285.863 27571.215 0.0 0.0 0.0 0.0 0.0 0.0 760.3339 8.81 8.81 0 -1 80968.67833333333 0.0 103840.59666666668 70256.33 82628.58 90021.125 0.0 0.0 0.0 65212.66 116505.44 129803.69 312.1212 8.74 8.74 0 -1 416612.9066666667 93303.02999999998 252640.36666666667 416561.88 405363.0 427913.84 70559.68 130035.32 79314.09 194580.16 266058.5 297282.44 252.1232 10.07 10.07 0 -1 8574.73 13741.855333333331 202743.98933333333 0.0 0.0 25724.19 0.0 41225.566 0.0 59400.168 163480.27 385351.53 393.1314 10.11 10.11 0 -1 0.0 34519.30333333334 214639.48666666663 0.0 0.0 0.0 26459.45 77098.46 0.0 78874.03 194803.55 370240.88 377.1002 10.71 10.71 0 -1 0.0 0.0 105438.055 0.0 0.0 0.0 0.0 0.0 0.0 88144.74 140498.73 87670.695 330.1707 4.59 4.59 0 -1 Reticuline CN1CCC2=CC(=C(C=C2C1CC3=CC(=C(C=C3)OC)O)O)OC InChI=1S/C19H23NO4/c1-20-7-6-13-10-19(24-3)17(22)11-14(13)15(20)8-12-4-5-18(23-2)16(21)9-12/h4-5,9-11,15,21-22H,6-8H2,1-3H3/t15-/m0/s1 28471.889333333336 0.0 0.0 23749.58 29892.24 31773.848 0.0 0.0 0.0 0.0 0.0 0.0 208.0439 8.02 8.02 0 -1 127231.07 15864.371 0.0 108952.28 127228.37 145512.56 0.0 0.0 47593.113 0.0 0.0 0.0 673.2161 9.34 9.34 0 -1 14493.870666666668 0.0 20173.411666666667 18939.342 24542.27 0.0 0.0 0.0 0.0 31932.479 0.0 28587.756 413.8713 0.88 0.88 0 -1 0.0 80856.65000000001 20224.707 0.0 0.0 0.0 58558.188 120416.125 63595.637 0.0 35580.266 25093.855 258.9802 3.78 3.78 0 -1 37748.98433333333 0.0 47180.62333333333 34718.465 34828.676 43699.812 0.0 0.0 0.0 0.0 49987.56 91554.31 233.081 10.49 10.49 0 -1 0.0 155127.80666666667 95155.80666666669 0.0 0.0 0.0 137098.1 114818.84 213466.48 0.0 151698.5 133768.92 321.0852 1.67 1.67 0 -1 76018.27399999999 0.0 50935.923 58285.277 75402.74 94366.805 0.0 0.0 0.0 28514.664 57597.215 66695.89 326.1006 7.69 7.69 0 -1 0.0 65130.871666666666 86880.488 0.0 0.0 0.0 39940.63 101442.13 54009.855 47609.13 110665.164 102367.17 447.2876 17.09 17.09 0 -1 99316.385 15634.44 0.0 74563.51 103054.95 120330.695 0.0 23351.709 23551.611 0.0 0.0 0.0 393.2042 13.36 13.36 0 -1 319533.01 61773.25666666666 0.0 487727.62 192412.47 278458.94 185319.77 0.0 0.0 0.0 0.0 0.0 368.8595 5.29 5.29 0 -1 70042.58833333333 0.0 0.0 52960.375 83127.33 74040.06 0.0 0.0 0.0 0.0 0.0 0.0 817.3925 7.83 7.83 0 -1 0.0 0.0 161034.80333333332 0.0 0.0 0.0 0.0 0.0 0.0 179613.47 131802.19 171688.75 438.9798 1.26 1.26 0 -1 104621.745 0.0 0.0 115996.85 100918.44 96949.945 0.0 0.0 0.0 0.0 0.0 0.0 449.1713 5.72 5.72 0 -1 339422.7833333333 0.0 0.0 374600.44 239620.69 404047.22 0.0 0.0 0.0 0.0 0.0 0.0 304.1508 0.99 0.99 0 -1 70172.94166666667 0.0 0.0 90684.69 55381.535 64452.6 0.0 0.0 0.0 0.0 0.0 0.0 376.2123 4.92 4.92 0 -1 0.0 0.0 183382.96 0.0 0.0 0.0 0.0 0.0 0.0 281695.78 235152.78 33300.32 398.1758 11.36 11.36 0 -1 Massbank:PR310506 Chalcone O=C(C=CC1=CC=CC=C1)C1=CC=CC=C1 1S/C15H12O/c16-15(14-9-5-2-6-10-14)12-11-13-7-3-1-4-8-13/h1-12H 0.0 82788.47566666667 19817.591333333334 0.0 0.0 0.0 49135.977 131485.06 67744.39 0.0 34518.254 24934.52 307.0018 3.78 3.78 0 -1 0.0 0.0 47201.326 0.0 0.0 0.0 0.0 0.0 0.0 51803.402 45201.746 44598.83 685.2768 7.21 7.21 0 -1 C38H40N2O10 COc1cc([C@@H]2c3c(OC)c(O)c(OC)cc3C=C(C(=O)NCCc3ccc(O)cc3)[C@H]2C(=O)NCCc2ccc(O)cc2)cc(OC)c1O InChI=1S/C38H40N2O10/c1-47-28-19-24(20-29(48-2)34(28)43)31-32-23(18-30(49-3)35(44)36(32)50-4)17-27(37(45)39-15-13-21-5-9-25(41)10-6-21)33(31)38(46)40-16-14-22-7-11-26(42)12-8-22/h5-12,17-20,31,33,41-44H,13-16H2,1-4H3,(H,39,45)(H,40,46)/t31-,33-/m1/s1 86089.25033333333 0.0 0.0 87283.945 70522.72 100461.086 0.0 0.0 0.0 0.0 0.0 0.0 663.2793 16.11 16.11 0 -1 0.0 0.0 62063.68666666667 0.0 0.0 0.0 0.0 0.0 0.0 48014.5 66557.79 71618.77 267.0979 1.27 1.27 0 -1 PYRIDOXAL 5'-PHOSPHATE - 30.0 eV CC1=NC=C(COP(O)(O)=O)C(C=O)=C1O InChI=1S/C8H10NO6P/c1-5-8(11)7(3-10)6(2-9-5)4-15-16(12,13)14/h2-3,11H,4H2,1H3,(H2,12,13,14) 0.0 0.0 53805.29433333333 0.0 0.0 0.0 0.0 0.0 0.0 61084.5 45692.637 54638.746 210.0612 1.26 1.26 0 -1 0.0 188961.20333333337 0.0 0.0 0.0 0.0 155089.6 154657.56 257136.45 0.0 0.0 0.0 427.1802 5.77 5.77 0 -1 43782.21333333334 0.0 0.0 28502.084 57350.906 45493.65 0.0 0.0 0.0 0.0 0.0 0.0 613.1765 3.65 3.65 0 -1 67072.99733333333 0.0 0.0 56720.402 65714.73 78783.86 0.0 0.0 0.0 0.0 0.0 0.0 673.2426 15.98 15.98 0 -1 94641.96666666667 115215.82833333332 93079.42133333332 95644.74 91251.41 97029.75 150828.16 90113.38 104705.945 113329.22 84967.06 80941.984 235.1332 10.87 10.87 0 -1 486297.3233333333 0.0 0.0 469440.47 414589.06 574862.44 0.0 0.0 0.0 0.0 0.0 0.0 764.4088 5.13 5.13 0 -1 0.0 40223.01933333333 45233.56 0.0 0.0 0.0 0.0 36208.938 84460.12 43699.5 57633.094 34368.086 331.8869 1.04 1.04 0 -1 46397.92999999999 52396.16533333333 21590.816666666666 43090.78 48067.21 48035.8 41756.016 66794.95 48637.53 14833.96 49938.49 0.0 207.0437 8.8 8.8 0 -1 82073.82333333335 46814.89333333333 0.0 62298.79 67643.13 116279.55 0.0 92307.9 48136.78 0.0 0.0 0.0 337.0942 1.09 1.09 0 -1 Spectral Match to Glutathione, oxidized from NIST14 C(CC(=O)N[C@@H](CSSC[C@@H](C(=O)NCC(=O)O)NC(=O)CC[C@@H](C(=O)O)N)C(=O)NCC(=O)O)[C@@H](C(=O)O)N InChI=1S/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/t9-,10-,11-,12-/m0/s1 116506.54466666664 0.0 27609.84633333333 127680.984 84274.04 137564.61 0.0 0.0 0.0 39472.105 43357.434 0.0 245.0864 1.25 1.25 0 -1 97485.88833333337 0.0 8327.756 80314.76 104506.625 107636.28 0.0 0.0 0.0 24983.268 0.0 0.0 211.0969 6.2 6.2 0 -1 (2R,3R)-2-(3,4-dihydroxyphenyl)-3,4-dihydro-2H-chromene-3,5,7-triol OC=1C=C(O)C2=C(OC(C3=CC=C(O)C(O)=C3)C(O)C2)C1 InChI=1S/C15H14O6/c16-8-4-11(18)9-6-13(20)15(21-14(9)5-8)7-1-2-10(17)12(19)3-7/h1-5,13,15-20H,6H2 0.0 36530.25466666667 12635.164 0.0 0.0 0.0 67893.6 41697.164 0.0 37905.492 0.0 0.0 233.9826 1.03 1.03 0 -1 171484.42666666664 0.0 0.0 182036.08 133801.12 198616.08 0.0 0.0 0.0 0.0 0.0 0.0 415.2108 5.38 5.38 0 -1 0.0 65937.48533333333 5755.771333333333 0.0 0.0 0.0 70664.54 94013.74 33134.176 0.0 17267.314 0.0 331.0931 1.26 1.26 0 -1 330724.0633333333 0.0 346366.55 0.0 496158.44 496013.75 0.0 0.0 0.0 0.0 516086.53 523013.12 350.2545 11.41 11.41 0 -1 43338.13033333333 0.0 0.0 39755.434 35952.203 54306.754 0.0 0.0 0.0 0.0 0.0 0.0 578.2533 15.86 15.86 0 -1 7520.955000000001 0.0 15198.060666666666 0.0 0.0 22562.865 0.0 0.0 0.0 23484.514 0.0 22109.668 311.0532 4.23 4.23 0 -1 83157.46333333333 8071.260999999999 50281.062 84623.38 80487.44 84361.57 0.0 24213.783 0.0 39276.562 52763.03 58803.594 235.0967 10.07 10.07 0 -1 0.0 265059.66233333334 22579.305333333334 0.0 0.0 0.0 50747.547 597637.6 146793.84 0.0 44909.164 22828.752 589.1359 3.77 3.77 0 -1 0.0 63990.02833333333 136736.17833333332 0.0 0.0 0.0 80084.28 81738.26 30147.545 150806.28 120221.805 139180.45 416.2075 10.13 10.13 0 -1 107713.762 22117.79333333333 69828.2 127884.266 0.0 195257.02 0.0 66353.38 0.0 0.0 102601.14 106883.46 490.177 1.02 1.02 0 -1 DUPA(OtBu)-OH CC(C)(C)OC(=O)CC[C@H](NC(=O)N[C@@H](CCC(=O)O)C(=O)OC(C)(C)C)C(=O)OC(C)(C)C InChI=1S/C23H40N2O9/c1-21(2,3)32-17(28)13-11-15(19(30)34-23(7,8)9)25-20(31)24-14(10-12-16(26)27)18(29)33-22(4,5)6/h14-15H,10-13H2,1-9H3,(H,26,27)(H2,24,25,31)/t14-,15-/m0/s1 185536.65 90994.30666666669 0.0 190445.69 148677.56 217486.7 115341.14 88956.22 68685.56 0.0 0.0 0.0 460.2183 4.33 4.33 0 -1 17690.416 0.0 8911.994666666667 25168.1 0.0 27903.148 0.0 0.0 0.0 0.0 0.0 26735.984 206.1026 1.08 1.08 0 -1 0.0 33409.77333333334 8490.891333333333 0.0 0.0 0.0 48412.95 51816.37 0.0 0.0 0.0 25472.674 231.9889 0.94 0.94 0 -1 152895.84333333335 18518.56333333333 0.0 119956.3 148091.84 190639.39 0.0 0.0 55555.69 0.0 0.0 0.0 617.25 9.59 9.59 0 -1 34597.867333333335 6630.258999999999 0.0 32877.535 32598.857 38317.21 0.0 19890.777 0.0 0.0 0.0 0.0 287.1259 6.9 6.9 0 -1 50977.04933333333 0.0 0.0 45219.895 51889.793 55821.46 0.0 0.0 0.0 0.0 0.0 0.0 653.2971 13.82 13.82 0 -1 16746.003 0.0 19108.991 0.0 24492.13 25745.879 0.0 0.0 0.0 0.0 27894.059 29432.914 356.1108 7.29 7.29 0 -1 25858.015666666663 0.0 0.0 26555.861 24899.684 26118.502 0.0 0.0 0.0 0.0 0.0 0.0 298.2382 12.91 12.91 0 -1 954487.1333333332 275432.4066666667 1082314.8666666667 861235.0 933776.4 1068450.0 318657.56 240902.0 266737.66 1011306.0 1140586.4 1095052.2 504.6572 8.83 8.83 0 -1 Piplartine COc1cc(/C=C/C(=O)N2CCC=CC2=O)cc(OC)c1OC InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+ 205313.6733333333 195965.24 475017.39 249504.27 302565.72 63871.03 221097.67 207366.39 159431.66 540984.0 459389.2 424678.97 200.9733 0.88 0.88 0 -1 31759.39633333333 4314.175 0.0 63353.484 31924.705 0.0 0.0 12942.525 0.0 0.0 0.0 0.0 652.2897 16.7 16.7 0 -1 112918.71666666667 37724.83466666667 113913.00966666666 98517.23 109809.96 130428.96 42861.44 30344.912 39968.152 115815.414 116771.625 109151.99 353.1157 8.83 8.83 0 -1 "(2E)-N-{[(4-methoxyphenyl)amino]thioxomethyl}-3-(3,4,5-trimethoxyphenyl)prop-2 -enamide CollisionEnergy:205060" COc1ccc(NC(=S)N=C(O)C=Cc2cc(OC)c(OC)c(OC)c2)cc1 "InChI=1S/C20H22N2O5S/c1-24-15-8-6-14(7-9-15)21-20(28)22-18(23)10-5-13-11-16(25-2)19(27-4)17(12-13)26-3/h5-12H,1-4H3,(H2,21,22,23,28)/b10-5+" 51692.01 0.0 0.0 53518.582 34057.008 67500.44 0.0 0.0 0.0 0.0 0.0 0.0 689.2377 15.59 15.59 0 -1 0.0 0.0 58122.824 0.0 0.0 0.0 0.0 0.0 0.0 28863.105 80174.734 65330.633 409.1839 4.39 4.39 0 -1 169899.99000000002 0.0 0.0 186900.88 157461.67 165337.42 0.0 0.0 0.0 0.0 0.0 0.0 613.266 16.47 16.47 0 -1 24854.950666666668 27915.056 40672.008 0.0 36853.418 37711.434 54343.465 29401.703 0.0 56597.953 33070.184 32347.887 371.2585 14.19 14.19 0 -1 40290.534 41814.56766666666 108385.365 53631.742 67239.86 0.0 47071.984 44824.965 33546.754 121711.79 104411.36 99032.945 201.9743 0.88 0.88 0 -1 116101.37666666666 0.0 0.0 119592.64 150952.28 77759.21 0.0 0.0 0.0 0.0 0.0 0.0 350.0696 3.47 3.47 0 -1 81736.56166666666 144900.28 98941.18 0.0 119888.805 125320.88 138531.81 126332.22 169836.81 110356.77 97584.74 88882.03 208.8843 0.95 0.95 0 -1 555099.2799999999 652877.3266666667 448766.42 500863.9 592346.94 572087.0 632859.1 563649.44 762123.44 503537.8 439874.06 402887.4 206.8862 0.95 0.95 0 -1 122681.89 0.0 0.0 85660.09 121755.05 160630.53 0.0 0.0 0.0 0.0 0.0 0.0 497.3114 12.14 12.14 0 -1 77486.675 37292.57033333333 31741.20166666667 78179.375 63739.44 90541.21 58431.414 53446.297 0.0 48978.0 0.0 46245.605 220.1184 2.61 2.61 0 -1 PANTOTHENIC ACID CC(C)(CO)C(/C(=N/CCC(=O)O)/O)O "InChI=1S/C9H17NO5/c1-9(2,5-11)7(14)8(15)10-4-3-6(12)13/h7,11,14H,3-5H2,1-2H3,(H,10,15)(H,12,13)" 135873.05666666667 0.0 180455.81333333332 189665.47 0.0 217953.7 0.0 0.0 0.0 171083.53 176752.27 193531.64 229.155 1.26 1.26 0 -1 0.0 52018.72 264148.8933333333 0.0 0.0 0.0 47545.94 46060.11 62450.11 300043.1 224049.08 268354.5 215.0167 1.26 1.26 0 -1 24501.224666666665 0.0 0.0 24051.947 20011.777 29439.95 0.0 0.0 0.0 0.0 0.0 0.0 342.1762 3.82 3.82 0 -1 362472.0633333333 38759.57 0.0 366988.94 187326.69 533100.56 116278.71 0.0 0.0 0.0 0.0 0.0 354.8521 5.1 5.1 0 -1 20528.74033333333 0.0 37554.00166666667 0.0 31503.012 30083.209 0.0 0.0 0.0 36898.465 37793.46 37970.08 411.1592 6.06 6.06 0 -1 97711.91833333332 0.0 0.0 107263.3 101478.15 84394.305 0.0 0.0 0.0 0.0 0.0 0.0 653.2975 14.63 14.63 0 -1 67243.868 0.0 0.0 84506.9 72039.45 45185.254 0.0 0.0 0.0 0.0 0.0 0.0 657.2921 15.63 15.63 0 -1 71329.26333333334 0.0 0.0 75248.28 72827.17 65912.34 0.0 0.0 0.0 0.0 0.0 0.0 501.3762 15.86 15.86 0 -1 10244.770333333334 5271.441666666667 6040.344333333333 0.0 15531.625 15202.686 0.0 15814.325 0.0 0.0 18121.033 0.0 352.8164 0.94 0.94 0 -1 109674.42633333332 0.0 0.0 115286.555 100801.99 112934.734 0.0 0.0 0.0 0.0 0.0 0.0 669.2923 15.07 15.07 0 -1 51399.00233333333 0.0 0.0 36761.74 51307.727 66127.54 0.0 0.0 0.0 0.0 0.0 0.0 643.2266 10.08 10.08 0 -1 0.0 0.0 168824.67333333334 0.0 0.0 0.0 0.0 0.0 0.0 112653.52 171056.86 222763.64 438.0403 9.92 9.92 0 -1 31159.002 35638.82466666666 0.0 48461.086 0.0 45015.92 29161.96 33106.28 44648.234 0.0 0.0 0.0 304.1912 4.87 4.87 0 -1 38510.45233333333 0.0 0.0 39759.867 32421.666 43349.824 0.0 0.0 0.0 0.0 0.0 0.0 303.108 5.73 5.73 0 -1 NCGC00169586-02!7-methyl-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylic acid CC1CCC2C1C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)OC=C2C(O)=O InChI=1S/C16H24O9/c1-6-2-3-7-8(14(21)22)5-23-15(10(6)7)25-16-13(20)12(19)11(18)9(4-17)24-16/h5-7,9-13,15-20H,2-4H2,1H3,(H,21,22)/t6?,7?,9-,10?,11-,12+,13-,15?,16+/m1/s1 25456.24333333333 0.0 20370.22133333333 22780.61 28091.17 25496.95 0.0 0.0 0.0 0.0 31373.469 29737.195 358.1053 9.07 9.07 0 -1 859460.9133333332 1007210.9133333332 692862.32 777419.44 913822.4 887140.9 967092.94 879936.4 1174603.4 772030.5 687151.4 619405.06 290.8478 0.95 0.95 0 -1 104445.16466666666 0.0 0.0 124975.87 59378.434 128981.19 0.0 0.0 0.0 0.0 0.0 0.0 640.262 5.6 5.6 0 -1 0.0 78735.05099999999 20953.946 0.0 0.0 0.0 31614.963 134116.44 70473.75 0.0 37995.305 24866.533 260.9958 3.78 3.78 0 -1 31433.039666666667 0.0 0.0 25654.318 29826.254 38818.547 0.0 0.0 0.0 0.0 0.0 0.0 597.2217 7.83 7.83 0 -1 175955.14333333334 0.0 0.0 165949.56 227340.48 134575.39 0.0 0.0 0.0 0.0 0.0 0.0 703.2982 10.38 10.38 0 -1 43073.966 0.0 0.0 36193.418 45350.984 47677.496 0.0 0.0 0.0 0.0 0.0 0.0 346.0937 9.59 9.59 0 -1 81345.28833333334 0.0 0.0 76842.52 65734.625 101458.72 0.0 0.0 0.0 0.0 0.0 0.0 623.25 15.87 15.87 0 -1 26265.553333333333 26957.371666666662 63905.768 35552.86 43243.8 0.0 26953.066 31889.336 22029.713 66366.14 63819.406 61531.758 270.9461 0.88 0.88 0 -1 0.0 24121.056 0.0 0.0 0.0 0.0 23327.604 26794.844 22240.72 0.0 0.0 0.0 311.1107 5.9 5.9 0 -1 111932.62 0.0 20970.447333333334 120790.12 75305.94 139701.8 0.0 0.0 0.0 0.0 29151.467 33759.875 595.1662 4.08 4.08 0 -1 apigenin 6,8-digalactoside O=c1cc(-c2ccc(O)cc2)oc2c(C3OC(CO)C(O)C(O)C3O)c(O)c(C3OC(CO)C(O)C(O)C3O)c(O)c12 InChI=1S/C27H30O15/c28-6-12-17(32)21(36)23(38)26(41-12)15-19(34)14-10(31)5-11(8-1-3-9(30)4-2-8)40-25(14)16(20(15)35)27-24(39)22(37)18(33)13(7-29)42-27/h1-5,12-13,17-18,21-24,26-30,32-39H,6-7H2 0.0 41571.868 0.0 0.0 0.0 0.0 33797.887 35666.797 55250.92 0.0 0.0 0.0 507.8386 1.05 1.05 0 -1 0.0 23735.916666666668 0.0 0.0 0.0 0.0 20016.086 19493.855 31697.809 0.0 0.0 0.0 399.1656 3.75 3.75 0 -1 NCGC00380580-01 CC(=O)O[C@@H]1[C@@H](CO)O[C@@](CO)(O[C@H]2O[C@H](COC(=O)/C=C/c3ccccc3)[C@@H](O)[C@H](O)[C@H]2O)[C@H]1O InChI=1S/C23H30O13/c1-12(26)33-20-14(9-24)35-23(11-25,21(20)31)36-22-19(30)18(29)17(28)15(34-22)10-32-16(27)8-7-13-5-3-2-4-6-13/h2-8,14-15,17-22,24-25,28-31H,9-11H2,1H3/b8-7+/t14-,15-,17-,18+,19-,20-,21+,22-,23+/m1/s1 29772.077666666664 0.0 0.0 30454.484 27321.36 31540.389 0.0 0.0 0.0 0.0 0.0 0.0 408.2665 11.81 11.81 0 -1 100762.172 0.0 0.0 116682.83 116395.67 69208.016 0.0 0.0 0.0 0.0 0.0 0.0 675.267 9.51 9.51 0 -1 44635.62066666666 0.0 53320.301666666666 40138.035 50710.46 43058.367 0.0 0.0 0.0 49295.355 53433.54 57232.01 343.1245 8.82 8.82 0 -1 67056.15766666667 0.0 0.0 67712.93 54165.973 79289.57 0.0 0.0 0.0 0.0 0.0 0.0 474.1739 2.97 2.97 0 -1 528331.47 71784.52333333333 0.0 525944.44 436130.72 622919.25 100996.24 59222.07 55135.26 0.0 0.0 0.0 610.2878 5.85 5.85 0 -1 25196.279666666665 0.0 63615.40666666668 28498.027 0.0 47090.812 0.0 0.0 0.0 78334.1 52178.86 60333.26 303.1346 1.13 1.13 0 -1 17714.733 33810.41166666667 21636.22266666667 28023.674 0.0 25120.525 38575.523 31745.53 31110.182 35539.082 0.0 29369.586 319.2849 14.65 14.65 0 -1 35044.386 7998.651000000001 0.0 36087.566 28388.768 40656.824 23995.953 0.0 0.0 0.0 0.0 0.0 263.128 4.34 4.34 0 -1 32180.86 0.0 0.0 23720.201 33933.414 38888.965 0.0 0.0 0.0 0.0 0.0 0.0 346.0937 8.02 8.02 0 -1 32593.516333333333 9884.923333333334 8929.540333333332 29637.127 29681.379 38462.043 29654.77 0.0 0.0 26788.621 0.0 0.0 298.0978 3.16 3.16 0 -1 Spectral Match to Adenosine, 5'-S-methyl-5'-thio- from NIST14 CSC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)O InChI=1S/C11H15N5O3S/c1-20-2-5-7(17)8(18)11(19-5)16-4-15-6-9(12)13-3-14-10(6)16/h3-5,7-8,11,17-18H,2H2,1H3,(H2,12,13,14)/t5-,7-,8-,11-/m1/s1 57385.651000000005 8354.392 35064.507333333335 56573.21 55644.953 59938.79 0.0 25063.176 0.0 38431.7 34570.074 32191.748 257.0785 10.07 10.07 0 -1 248409.07666666663 154443.20333333334 106816.12333333334 352225.88 108095.45 284905.9 126010.92 121551.3 215767.39 108932.94 106215.17 105300.26 381.08 0.98 0.98 0 -1 0.0 39694.776000000005 19072.75 0.0 0.0 0.0 25856.182 54185.31 39042.836 0.0 31901.15 25317.1 303.0746 5.57 5.57 0 -1 265470.82666666666 93922.13933333334 40249.82666666667 236200.22 274228.7 285983.56 51202.133 82560.305 148003.98 35378.312 44961.004 40410.164 356.0898 8.02 8.02 0 -1 0.0 28105.15 42501.98633333333 0.0 0.0 0.0 50807.74 33507.71 0.0 63221.977 29710.252 34573.73 448.3639 15.46 15.46 0 -1 0.0 0.0 43893.28400000001 0.0 0.0 0.0 0.0 0.0 0.0 21722.568 39671.344 70285.94 482.185 4.73 4.73 0 -1 67581.28733333333 62420.849 164137.07666666666 81321.805 103208.93 18213.127 58137.777 74565.37 54559.4 170650.4 170195.83 151565.0 268.9483 0.88 0.88 0 -1 0.0 0.0 60739.46933333333 0.0 0.0 0.0 0.0 0.0 0.0 25759.691 54379.637 102079.08 409.1055 10.12 10.12 0 -1 106536.61666666664 0.0 0.0 146060.27 35059.75 138489.83 0.0 0.0 0.0 0.0 0.0 0.0 234.1491 4.34 4.34 0 -1 19475.217666666667 15179.158 35163.79833333333 27147.309 31278.344 0.0 23819.857 21717.617 0.0 38409.31 33323.062 33759.023 385.8763 0.88 0.88 0 -1 74329.15333333334 42735.35666666667 59235.857 74670.09 68823.05 79494.32 42966.89 48902.09 36337.09 47894.855 68297.15 61515.566 240.0717 1.05 1.05 0 -1 32289.221666666668 33014.29866666667 0.0 33398.06 24882.55 38587.055 32459.693 42770.207 23812.996 0.0 0.0 0.0 404.1558 5.06 5.06 0 -1 36764.53133333333 0.0 49294.41 52401.867 0.0 57891.727 0.0 0.0 0.0 0.0 70452.65 77430.58 241.1549 1.26 1.26 0 -1 54002.35666666667 0.0 78132.19133333334 49431.082 54665.438 57910.55 0.0 0.0 0.0 39273.984 72893.33 122229.26 393.1315 10.49 10.49 0 -1 83272.09300000001 0.0 0.0 77473.734 66958.6 105383.945 0.0 0.0 0.0 0.0 0.0 0.0 319.097 10.79 10.79 0 -1 0.0 0.0 24315.48933333333 0.0 0.0 0.0 0.0 0.0 0.0 23981.39 22799.41 26165.668 239.0918 4.14 4.14 0 -1 59671.99066666667 27750.01833333333 40136.749 43013.562 29639.17 106363.24 0.0 0.0 83250.055 29349.057 0.0 91061.19 274.2744 9.71 9.71 0 -1 Massbank:LU100203 2,2'-(Tetradecylimino)diethanol|Tetradecyldiethanolamine CCCCCCCCCCCCCCN(CCO)CCO 1S/C18H39NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-19(15-17-20)16-18-21/h20-21H,2-18H2,1H3 50458.808 0.0 0.0 50397.09 43260.234 57719.1 0.0 0.0 0.0 0.0 0.0 0.0 238.0924 1.05 1.05 0 -1 0.0 72800.557 9687.400333333331 0.0 0.0 0.0 45193.438 115595.78 57612.453 0.0 29062.201 0.0 265.9749 3.78 3.78 0 -1 146647.63666666666 39286.95766666667 173522.30666666667 134840.75 143586.61 161515.55 47483.64 34459.113 35918.12 180216.14 160403.94 179946.84 487.6817 8.83 8.83 0 -1 Piplartine COc1cc(/C=C/C(=O)N2CCC=CC2=O)cc(OC)c1OC InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+ 0.0 0.0 32992.87433333333 0.0 0.0 0.0 0.0 0.0 0.0 31450.21 32600.686 34927.727 382.0354 6.0 6.0 0 -1 0.0 0.0 71033.36133333333 0.0 0.0 0.0 0.0 0.0 0.0 29716.809 76312.625 107070.65 739.2728 9.21 9.21 0 -1 21039.56133333333 29359.84833333333 0.0 0.0 0.0 63118.684 49574.895 38504.65 0.0 0.0 0.0 0.0 204.087 1.04 1.04 0 -1 [3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 10-[3-acetamido-6-[[4,5-dihydroxy-3-(3,4,5-trihydroxyoxan-2-yl)oxyoxan-2-yl]oxymethyl]-4,5-dihydroxyoxan-2-yl]oxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate CC(O)=NC1C(OC2CCC3(C)C(CCC4(C)C3CC=C3C5CC(C)(C)CCC5(C(=O)OC5OC(CO)C(O)C(O)C5O)CCC34C)C2(C)C)OC(COC2OCC(O)C(O)C2OC2OCC(O)C(O)C2O)C(O)C1O InChI=1S/C54H87NO21/c1-24(57)55-34-39(64)38(63)30(23-71-47-43(36(61)28(59)22-70-47)75-45-41(66)35(60)27(58)21-69-45)73-44(34)74-33-12-13-51(6)31(50(33,4)5)11-14-53(8)32(51)10-9-25-26-19-49(2,3)15-17-54(26,18-16-52(25,53)7)48(68)76-46-42(67)40(65)37(62)29(20-56)72-46/h9,26-47,56,58-67H,10-23H2,1-8H3,(H,55,57) 32818.10766666667 0.0 0.0 27619.766 34116.6 36717.957 0.0 0.0 0.0 0.0 0.0 0.0 409.1136 3.55 3.55 0 -1 NCGC00180273-02!7-hydroxy-2-(4-hydroxyphenyl)-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3-dihydrochromen-4-one OC[C@H]1O[C@@H](OC2=C3C(=O)CC(OC3=CC(O)=C2)C4=CC=C(O)C=C4)[C@H](O)[C@@H](O)[C@@H]1O InChI=1S/C21H22O10/c22-8-16-18(26)19(27)20(28)21(31-16)30-15-6-11(24)5-14-17(15)12(25)7-13(29-14)9-1-3-10(23)4-2-9/h1-6,13,16,18-24,26-28H,7-8H2/t13?,16-,18-,19+,20-,21-/m1/s1 38847.7 0.0 81236.27966666665 35780.44 36119.402 44643.258 0.0 0.0 0.0 61455.414 89122.3 93131.125 252.0869 4.68 4.68 0 -1 91461.48666666668 0.0 0.0 87099.195 97870.305 89414.96 0.0 0.0 0.0 0.0 0.0 0.0 653.2974 16.17 16.17 0 -1 66820.25666666667 0.0 537845.6533333333 0.0 0.0 200460.77 0.0 0.0 0.0 440106.16 530833.2 642597.6 203.1505 1.0 1.0 0 -1 N,N-dimethylarginine CN(C)C(N)=NCCC[C@H](N)C(=O)O InChI=1S/C8H18N4O2/c1-12(2)8(10)11-5-3-4-6(9)7(13)14/h6H,3-5,9H2,1-2H3,(H2,10,11)(H,13,14)/t6-/m0/s1 10538.998 7952.834 50604.60199999999 0.0 0.0 31616.994 0.0 23858.502 0.0 41601.598 58104.45 52107.758 450.1978 3.56 3.56 0 -1 (2R,3S,4S,5R,6R)-5-[(2S,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy-2-(hydroxymethyl)-6-[2-(4-hydroxyphenyl)ethoxy]oxane-3,4-diol OC[C@H]1O[C@@H](OCCc2ccc(O)cc2)[C@H](O[C@@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@@H]1O InChI=1S/C19H28O11/c20-7-12-13(23)14(24)15(30-18-16(25)19(26,8-21)9-28-18)17(29-12)27-6-5-10-1-3-11(22)4-2-10/h1-4,12-18,20-26H,5-9H2/t12-,13-,14+,15-,16+,17-,18+,19-/m1/s1 12644.11 0.0 17956.758666666665 37932.33 0.0 0.0 0.0 0.0 0.0 39086.1 14784.176 0.0 422.0549 8.81 8.81 0 -1 31918.993 31948.930333333334 22331.088666666667 31998.664 35549.285 28209.03 28326.064 37014.133 30506.594 0.0 34151.86 32841.406 257.115 10.87 10.87 0 -1 65784.40666666666 119280.635 0.0 0.0 80789.74 116563.48 107099.805 124001.71 126740.39 0.0 0.0 0.0 289.1287 5.9 5.9 0 -1 (1R)-(-)-Nopol CollisionEnergy:102040 CC1(C)C2CC=C(CCO)C1C2 "InChI=1S/C11H18O/c1-11(2)9-4-3-8(5-6-12)10(11)7-9/h3,9-10,12H,4-7H2,1-2H3/t9-,10?/m0/s1" 18526.856 0.0 29472.56233333333 25192.564 0.0 30388.004 0.0 0.0 0.0 0.0 36160.355 52257.332 325.1437 10.49 10.49 0 -1 547008.0733333334 52239.67466666666 0.0 563590.44 434360.38 643073.4 73915.23 41964.754 40839.04 0.0 0.0 0.0 718.3243 7.07 7.07 0 -1 233851.38 46686.52766666666 275463.8233333333 154276.56 297778.75 249498.83 61498.395 40995.055 37566.133 479488.66 146021.2 200881.61 326.1005 7.38 7.38 0 -1 0.0 52903.19066666666 0.0 0.0 0.0 0.0 23930.71 95355.55 39423.312 0.0 0.0 0.0 373.1839 4.29 4.29 0 -1 108079.64333333333 0.0 0.0 130906.766 129596.73 63735.434 0.0 0.0 0.0 0.0 0.0 0.0 685.2867 15.83 15.83 0 -1 54451.90333333333 0.0 0.0 41974.89 53685.17 67695.65 0.0 0.0 0.0 0.0 0.0 0.0 441.1548 9.34 9.34 0 -1 81962.353 0.0 0.0 73410.195 89204.2 83272.664 0.0 0.0 0.0 0.0 0.0 0.0 411.2148 12.69 12.69 0 -1 0.0 19631.375 54446.162 0.0 0.0 0.0 0.0 0.0 58894.125 0.0 77840.22 85498.266 210.9331 1.04 1.04 0 -1 135589.72333333333 52961.80433333333 161768.71333333335 115693.17 138083.61 152992.39 53836.19 50648.75 54400.473 158007.62 169278.97 158019.55 300.1234 8.82 8.82 0 -1 0.0 48182.954666666665 0.0 0.0 0.0 0.0 44048.26 61979.67 38520.934 0.0 0.0 0.0 329.0774 3.77 3.77 0 -1 126796.755 54424.81533333333 311186.1433333333 86768.805 158045.38 135576.08 30954.035 106871.14 25449.271 164640.3 308707.25 460210.88 427.1734 6.48 6.48 0 -1 106252.27933333332 26086.86333333333 58816.53 125134.19 46184.598 147438.05 0.0 0.0 78260.59 0.0 87133.56 89316.03 543.1328 1.0 1.0 0 -1 0.0 0.0 50469.53399999999 0.0 0.0 0.0 0.0 0.0 0.0 32013.797 50380.465 69014.34 434.2546 8.62 8.62 0 -1 26146.744666666666 22133.493333333336 32147.66 0.0 0.0 78440.234 31314.574 0.0 35085.906 0.0 96442.98 0.0 357.0932 8.83 8.83 0 -1 130587.51533333331 66821.96766666666 94742.69333333334 126041.88 126283.766 139436.9 62546.49 73689.28 64230.133 78181.76 93228.195 112818.125 212.1437 13.39 13.39 0 -1 64032.323 0.0 0.0 65383.41 72067.016 54646.543 0.0 0.0 0.0 0.0 0.0 0.0 413.324 15.85 15.85 0 -1 23013.13666666667 19092.516666666663 14104.2 0.0 33361.68 35677.73 0.0 57277.55 0.0 0.0 42312.6 0.0 208.0438 8.85 8.85 0 -1 68462.678 6947.351 99392.50733333331 63382.81 69701.914 72303.31 0.0 20842.053 0.0 45544.266 91976.586 160656.67 763.2727 10.49 10.49 0 -1 0.0 18590.020666666667 24138.28 0.0 0.0 0.0 0.0 0.0 55770.062 35400.31 37014.53 0.0 259.9017 1.04 1.04 0 -1 99617.389 0.0 0.0 86349.41 52547.277 159955.48 0.0 0.0 0.0 0.0 0.0 0.0 689.2584 15.44 15.44 0 -1 68253.22133333333 0.0 0.0 70242.625 51051.234 83465.805 0.0 0.0 0.0 0.0 0.0 0.0 511.2552 5.11 5.11 0 -1 0.0 27844.734666666667 100412.91666666669 0.0 0.0 0.0 46167.88 37366.324 0.0 164442.36 136796.39 0.0 287.9808 1.26 1.26 0 -1 49537.713 57586.31133333334 23160.97133333333 46962.777 48754.87 52895.492 39853.176 44832.383 88073.375 69482.914 0.0 0.0 322.0776 1.27 1.27 0 -1 0.0 0.0 49469.09666666667 0.0 0.0 0.0 0.0 0.0 0.0 47592.22 48937.87 51877.2 625.2557 8.29 8.29 0 -1 12408.304666666663 4646.1613333333335 17016.339666666667 22502.871 0.0 14722.043 0.0 13938.484 0.0 0.0 27612.988 23436.031 320.8668 0.93 0.93 0 -1 44283.75866666667 40588.511666666665 48946.15 65208.49 32010.098 35632.688 60646.867 0.0 61118.668 70774.87 0.0 76063.58 208.0439 8.8 8.8 0 -1 209768.29666666663 0.0 0.0 200357.69 145980.73 282966.47 0.0 0.0 0.0 0.0 0.0 0.0 299.2011 16.13 16.13 0 -1 8152.204333333334 0.0 47546.973666666665 0.0 0.0 24456.613 0.0 0.0 0.0 29836.717 58908.54 53895.664 621.1796 5.08 5.08 0 -1 Vicenin II O=C1C=C(OC2=C1C(O)=C(C(O)=C2C3OC(CO)C(O)C(O)C3O)C4OC(CO)C(O)C(O)C4O)C=5C=CC(O)=CC5 InChI=1S/C27H30O15/c28-6-12-17(32)21(36)23(38)26(41-12)15-19(34)14-10(31)5-11(8-1-3-9(30)4-2-8)40-25(14)16(20(15)35)27-24(39)22(37)18(33)13(7-29)42-27/h1-5,12-13,17-18,21-24,26-30,32-39H,6-7H2 0.0 7268.591 81532.972 0.0 0.0 0.0 0.0 21805.773 0.0 22666.186 72340.98 149591.75 731.2105 10.71 10.71 0 -1 17720.397666666668 18380.396666666667 34112.44066666667 24905.498 28255.695 0.0 30772.68 24368.51 0.0 41192.035 29968.484 31176.803 336.9014 0.87 0.87 0 -1 182254.77333333332 0.0 0.0 157859.39 203413.03 185491.9 0.0 0.0 0.0 0.0 0.0 0.0 280.0948 9.38 9.38 0 -1 57867.79 82260.01 85207.942 0.0 91537.67 82065.7 96434.74 64528.0 85817.29 88175.94 75463.836 91984.05 526.758 0.95 0.95 0 -1 0.0 41120.205 7552.75 0.0 0.0 0.0 39712.83 41891.633 41756.152 0.0 0.0 22658.25 670.2714 5.37 5.37 0 -1 2-[4-[(3S,3aR,6S,6aR)-6-[3-methoxy-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-3-yl]-2-methoxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol COc1cc([C@H]2OC[C@@H]3[C@@H](c4ccc(OC5OC(CO)C(O)C(O)C5O)c(OC)c4)OC[C@H]23)ccc1OC1OC(CO)C(O)C(O)C1O InChI=1S/C32H42O16/c1-41-19-7-13(3-5-17(19)45-31-27(39)25(37)23(35)21(9-33)47-31)29-15-11-44-30(16(15)12-43-29)14-4-6-18(20(8-14)42-2)46-32-28(40)26(38)24(36)22(10-34)48-32/h3-8,15-16,21-40H,9-12H2,1-2H3/t15-,16-,21?,22?,23?,24?,25?,26?,27?,28?,29+,30+,31?,32?/m0/s1 26608.518 0.0 26817.235 25214.643 22605.688 32005.223 0.0 0.0 0.0 26312.154 24993.074 29146.477 426.0515 4.22 4.22 0 -1 141930.86 325159.28 177869.9833333333 128467.87 153558.81 143765.9 320072.88 304507.16 350897.8 192396.28 186925.23 154288.44 227.0166 1.21 1.21 0 -1 176904.44333333336 132862.10133333332 57363.45333333333 187679.58 152964.69 190069.06 145719.02 149457.62 103409.664 104171.67 0.0 67918.69 248.0245 1.23 1.23 0 -1 95327.67666666668 0.0 0.0 90396.78 89595.266 105990.984 0.0 0.0 0.0 0.0 0.0 0.0 432.9889 2.97 2.97 0 -1 290334.64 65538.636 84666.75866666668 234487.45 321273.5 315242.97 67248.38 44028.348 85339.18 33151.97 74429.836 146418.47 205.0975 3.34 3.34 0 -1 Spectral Match to L-Tryptophan from NIST14 C1=CC=C2C(=C1)C(=CN2)C[C@@H](C(=O)O)N InChI=1S/C11H12N2O2/c12-9(11(14)15)5-7-6-13-10-4-2-1-3-8(7)10/h1-4,6,9,13H,5,12H2,(H,14,15)/t9-/m0/s1 0.0 25177.52733333333 235969.93 0.0 0.0 0.0 33618.234 41914.348 0.0 274389.22 270162.97 163357.6 316.1397 1.04 1.04 0 -1 232948.62666666668 0.0 0.0 201365.38 223945.88 273534.62 0.0 0.0 0.0 0.0 0.0 0.0 222.0844 9.59 9.59 0 -1 564639.79 64142.466666666674 268869.60000000003 523748.5 468780.62 701390.25 52444.33 67912.63 72070.44 119342.07 244938.23 442328.5 337.1075 10.76 10.76 0 -1 CCG-208458 CollisionEnergy:205060 c1cc2c(cc1C1OCC3C(c4ccc5c(c4)OCO5)OCC13)OCO2 "InChI=1S/C20H18O6/c1-3-15-17(25-9-23-15)5-11(1)19-13-7-22-20(14(13)8-21-19)12-2-4-16-18(6-12)26-10-24-16/h1-6,13-14,19-20H,7-10H2/t13-,14-,19?,20?/m0/s1" 42658.34333333333 0.0 0.0 31633.934 42339.92 54001.176 0.0 0.0 0.0 0.0 0.0 0.0 637.2727 9.58 9.58 0 -1 138112.49333333332 0.0 0.0 157475.52 125328.58 131533.38 0.0 0.0 0.0 0.0 0.0 0.0 669.2923 14.8 14.8 0 -1 0.0 23349.33133333333 9684.125 0.0 0.0 0.0 0.0 40824.99 29223.004 0.0 29052.375 0.0 289.999 2.89 2.89 0 -1 62582.42733333333 8595.539999999999 0.0 51819.75 61238.152 74689.38 0.0 0.0 25786.62 0.0 0.0 0.0 673.2163 9.59 9.59 0 -1 36108.088 0.0 38274.247 34861.844 29839.275 43623.145 0.0 0.0 0.0 40139.8 34299.574 40383.367 385.025 4.22 4.22 0 -1 151612.69333333333 7303.305333333334 0.0 164083.08 150386.47 140368.53 0.0 0.0 21909.916 0.0 0.0 0.0 447.2855 6.01 6.01 0 -1 0.0 0.0 33760.077333333335 0.0 0.0 0.0 0.0 0.0 0.0 23339.828 40769.65 37170.754 227.0918 3.85 3.85 0 -1 NCGC00385424-01 COc1cc(C(=O)OC[C@H]2O[C@@H](OC(C)(C)C(=O)O)[C@H](O)[C@@H](O)[C@@H]2O)cc(OC)c1O InChI=1S/C19H26O12/c1-19(2,18(25)26)31-17-15(23)14(22)13(21)11(30-17)7-29-16(24)8-5-9(27-3)12(20)10(6-8)28-4/h5-6,11,13-15,17,20-23H,7H2,1-4H3,(H,25,26)/t11-,13-,14+,15-,17+/m1/s1 58656.43266666667 0.0 42315.158 53197.484 60369.81 62402.004 0.0 0.0 0.0 35038.566 46875.31 45031.598 597.2216 8.5 8.5 0 -1 240588.5433333333 292254.01 200541.4833333333 223199.11 241979.12 256587.4 281193.5 253559.47 342009.06 222664.94 196952.73 182006.78 292.8459 0.95 0.95 0 -1 77576.54666666668 0.0 317177.4033333333 0.0 0.0 232729.64 0.0 0.0 0.0 240262.83 363935.94 347333.44 705.1858 0.98 0.98 0 -1 29091.667 7752.98 0.0 29540.484 28877.39 28857.127 23258.94 0.0 0.0 0.0 0.0 0.0 245.0136 7.31 7.31 0 -1 0.0 27349.252 0.0 0.0 0.0 0.0 25952.982 29320.36 26774.414 0.0 0.0 0.0 684.2505 5.06 5.06 0 -1 0.0 0.0 88419.20133333333 0.0 0.0 0.0 0.0 0.0 0.0 71368.38 93938.664 99950.56 458.0663 9.2 9.2 0 -1 19980658.666666668 0.0 0.0 20033192.0 18017964.0 21890820.0 0.0 0.0 0.0 0.0 0.0 0.0 345.2251 6.06 6.06 0 -1 feruloyltyramine COc1cc(/C=C/C(O)=NCCc2ccc(O)cc2)ccc1O InChI=1S/C18H19NO4/c1-23-17-12-14(4-8-16(17)21)5-9-18(22)19-11-10-13-2-6-15(20)7-3-13/h2-9,12,20-21H,10-11H2,1H3,(H,19,22)/b9-5+ 29281.01066666667 0.0 0.0 25989.584 29366.168 32487.28 0.0 0.0 0.0 0.0 0.0 0.0 575.21 4.83 4.83 0 -1 125384.10000000002 0.0 0.0 118303.77 99714.25 158134.28 0.0 0.0 0.0 0.0 0.0 0.0 205.1186 1.04 1.04 0 -1 DL-5-HYDROXYLYSINE - 60.0 eV NC[C@H](O)CC[C@H](N)C(O)=O InChI=1S/C6H14N2O3/c7-3-4(9)1-2-5(8)6(10)11/h4-5,9H,1-3,7-8H2,(H,10,11)/t4-,5+/m1/s1 31992.668 0.0 11830.313333333334 0.0 47251.348 48726.656 0.0 0.0 0.0 0.0 35490.94 0.0 450.3194 14.51 14.51 0 -1 55089.49 0.0 37071.085 80985.52 0.0 84282.95 0.0 0.0 0.0 0.0 52931.105 58282.15 527.1586 1.02 1.02 0 -1 113003.75833333336 0.0 0.0 82665.875 133478.23 122867.17 0.0 0.0 0.0 0.0 0.0 0.0 355.1024 3.65 3.65 0 -1 Chlorogenic acid C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)/b4-2+/t11-,12-,14-,16+/m1/s1 142787.2933333333 0.0 0.0 165470.67 136476.73 126414.48 0.0 0.0 0.0 0.0 0.0 0.0 829.5074 16.32 16.32 0 -1 115972.58666666668 0.0 0.0 116184.93 100325.66 131407.17 0.0 0.0 0.0 0.0 0.0 0.0 330.0976 4.52 4.52 0 -1 15.995 15 0.9485 0 198 155 6 Cosine 0.9485 -40.031 -40 0.783 0 198 337 6 Cosine 0.783 10.042 10 0.7242 0 198 109 6 Cosine 0.7242 13.98 13 0.9044 0 812 888 8 Cosine 0.9044 13.98 13 0.9067 0 812 881 8 Cosine 0.9067 -0.0 0 0.9492 0 812 795 8 Cosine 0.9492 -0.0 0 0.9936 0 462 445 34 Cosine 0.9936 -10.021 -10 0.7526 0 462 544 34 Cosine 0.7526 2.005 2 0.8048 0 462 388 34 Cosine 0.8048 -15.024 -15 0.7543 0 462 437 34 Cosine 0.7543 -0.0 0 0.9566 0 462 399 34 Cosine 0.9566 0.0 0 0.948 0 462 535 34 Cosine 0.948 2.005 2 0.8666 0 462 451 34 Cosine 0.8666 0.0 0 0.9645 0 462 351 34 Cosine 0.9645 -0.0 0 0.9915 0 462 386 34 Cosine 0.9915 0.0 0 0.9921 0 462 508 34 Cosine 0.9921 -28.99 -28 0.7941 0 116 226 39 Cosine 0.7941 41.995 41 0.7938 0 116 59 39 Cosine 0.7938 24.969 24 0.7685 0 116 52 39 Cosine 0.7685 6.958 6 0.7514 0 116 53 39 Cosine 0.7514 204.048 204 0.7074 0 116 49 39 Cosine 0.7074 -13.979 -13 0.7593 0 116 117 39 Cosine 0.7593 0.0 0 0.9738 0 116 131 39 Cosine 0.9738 18.01 18 0.79 0 582 581 24 Cosine 0.79 30.011 30 0.753 0 558 574 24 Cosine 0.753 -30.011 -30 0.7445 0 558 550 24 Cosine 0.7445 -30.011 -30 0.789 0 558 348 24 Cosine 0.789 0.0 0 0.7727 0 743 769 26 Cosine 0.7727 15.995 15 0.7507 0 743 825 26 Cosine 0.7507 -29.974 -29 0.7208 0 743 697 26 Cosine 0.7208 -86.073 -86 0.776 0 743 738 26 Cosine 0.776 2.016 2 0.8072 0 743 791 26 Cosine 0.8072 18.01 18 0.7998 0 743 839 26 Cosine 0.7998 0.0 0 0.9918 0 384 447 4 Cosine 0.9918 -0.0 0 0.7698 0 384 507 4 Cosine 0.7698 0.0 0 0.7873 0 384 536 4 Cosine 0.7873 -5.005 -5 0.8295 0 15 8 5 Cosine 0.8295 41.027 41 0.7125 0 15 17 5 Cosine 0.7125 -46.032 -46 0.8941 0 15 9 5 Cosine 0.8941 23.016 23 0.9657 0 15 19 5 Cosine 0.9657 -72.954 -72 0.78 0 15 26 5 Cosine 0.78 14.016 14 0.7525 0 472 355 34 Cosine 0.7525 12.0 12 0.8064 0 472 459 34 Cosine 0.8064 14.016 14 0.7448 0 472 282 34 Cosine 0.7448 -12.0 -12 0.8047 0 472 504 34 Cosine 0.8047 -14.016 -14 0.7127 0 472 473 34 Cosine 0.7127 14.016 14 0.7501 0 472 377 34 Cosine 0.7501 0.0 0 0.9667 0 637 680 10 Cosine 0.9667 0.0 0 0.9259 0 637 643 10 Cosine 0.9259 0.0 0 0.9695 0 637 646 10 Cosine 0.9695 0.0 0 0.9398 0 637 868 10 Cosine 0.9398 0.0 0 0.946 0 637 624 10 Cosine 0.946 0.0 0 0.9757 0 637 631 10 Cosine 0.9757 0.0 0 0.9619 0 637 640 10 Cosine 0.9619 0.0 0 0.9629 0 637 649 10 Cosine 0.9629 0.0 0 0.9564 0 637 660 10 Cosine 0.9564 0.0 0 0.969 0 637 667 10 Cosine 0.969 0.0 0 0.936 0 275 285 15 Cosine 0.936 15.995 15 0.8873 0 275 260 15 Cosine 0.8873 -14.016 -14 0.897 0 275 232 15 Cosine 0.897 -14.016 -14 0.9384 0 275 274 15 Cosine 0.9384 14.016 14 0.8818 0 275 283 15 Cosine 0.8818 -14.016 -14 0.8326 0 275 315 15 Cosine 0.8326 14.015 14 0.8225 0 366 244 24 Cosine 0.8225 -14.016 -14 0.8826 0 366 414 24 Cosine 0.8826 -14.016 -14 0.889 0 745 659 14 Cosine 0.889 -2.016 -2 0.8626 0 745 619 14 Cosine 0.8626 -44.062 -44 0.8089 0 745 620 14 Cosine 0.8089 -2.016 -2 0.8674 0 745 627 14 Cosine 0.8674 13.979 13 0.7067 0 745 633 14 Cosine 0.7067 0.0 0 0.9931 0 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18.01 18 0.7374 0 767 701 8 Cosine 0.7374 -6.037 -6 0.807 0 767 781 8 Cosine 0.807 -68.024 -68 0.732 0 767 795 8 Cosine 0.732 -66.008 -66 0.7706 0 795 766 8 Cosine 0.7706 -342.182 -342 0.7901 0 795 598 8 Cosine 0.7901 -372.193 -372 0.8283 0 795 517 8 Cosine 0.8283 -14.015 -14 0.8201 0 134 235 40 Cosine 0.8201 15.995 15 0.9561 0 134 161 40 Cosine 0.9561 -29.008 -29 0.7921 0 134 124 40 Cosine 0.7921 15.994 15 0.8382 0 758 817 18 Cosine 0.8382 34.005 34 0.7877 0 758 838 18 Cosine 0.7877 -28.01 -28 0.7892 0 300 59 39 Cosine 0.7892 -45.037 -45 0.7473 0 300 52 39 Cosine 0.7473 -14.016 -14 0.953 0 256 257 15 Cosine 0.953 1.979 1 0.7919 0 256 294 15 Cosine 0.7919 176.069 176 0.7363 0 256 301 15 Cosine 0.7363 146.058 146 0.754 0 256 324 15 Cosine 0.754 34.042 34 0.7123 0 220 106 5 Cosine 0.7123 34.042 34 0.7062 0 220 99 5 Cosine 0.7062 15.995 15 0.8317 0 294 257 15 Cosine 0.8317 -1.006 -1 0.9042 0 896 843 3 Cosine 0.9042 -17.001 -17 0.8938 0 896 844 3 Cosine 0.8938 0.0 0 0.9733 0 896 845 3 Cosine 0.9733 1.003 1 0.8011 0 422 425 20 Cosine 0.8011 2.015 2 0.8674 0 550 244 24 Cosine 0.8674 16.031 16 0.8545 0 550 520 24 Cosine 0.8545 -28.031 -28 0.9177 0 816 715 8 Cosine 0.9177 -28.031 -28 0.9217 0 816 742 8 Cosine 0.9217 -238.229 -238 0.7237 0 790 614 18 Cosine 0.7237 8.008 8 0.8116 0 2 28 62 Cosine 0.8116 -27.995 -27 0.8386 0 2 1 62 Cosine 0.8386 45.058 45 0.9467 0 530 532 28 Cosine 0.9467 142.111 142 0.7189 0 530 533 28 Cosine 0.7189 60.859 60 0.9458 0 398 382 2 Cosine 0.9458 -2.016 -2 0.9674 0 398 378 2 Cosine 0.9674 -101.974 -101 0.9521 0 398 467 2 Cosine 0.9521 -75.008 -75 0.7727 0 563 517 8 Cosine 0.7727 -515.228 -515 0.7109 0 319 318 55 Cosine 0.7109 -30.011 -30 0.9026 0 598 517 8 Cosine 0.9026 -15.995 -15 0.8803 0 235 227 40 Cosine 0.8803 -0.0 0 0.933 0 99 106 5 Cosine 0.933 46.006 46 0.775 0 99 88 5 Cosine 0.775 -0.0 0 0.7867 0 536 447 4 Cosine 0.7867 0.0 0 0.8365 0 536 492 4 Cosine 0.8365 -30.01 -30 0.7157 0 536 502 4 Cosine 0.7157 -45.058 -45 0.9356 0 372 371 6 Cosine 0.9356 -1.001 -1 0.8193 0 18 17 5 Cosine 0.8193 -14.016 -14 0.8572 0 260 286 15 Cosine 0.8572 -28.031 -28 0.887 0 700 794 8 Cosine 0.887 -179.08 -179 0.8845 0 590 616 18 Cosine 0.8845 -258.199 -258 0.79 0 590 826 18 Cosine 0.79 43.99 43 0.8686 0 98 93 51 Cosine 0.8686 151.001 151 0.7559 0 98 102 51 Cosine 0.7559 97.053 97 0.7699 0 532 533 28 Cosine 0.7699 1.007 1 0.8162 0 867 837 8 Cosine 0.8162 0.0 0 0.8365 0 368 397 48 Cosine 0.8365 0.0 0 0.8561 0 368 409 48 Cosine 0.8561 15.995 15 0.9082 0 750 824 3 Cosine 0.9082 -0.0 0 0.9859 0 750 727 3 Cosine 0.9859 0.001 0 0.976 0 750 725 3 Cosine 0.976 -14.016 -14 0.8749 0 246 329 24 Cosine 0.8749 -18.011 -18 0.884 0 246 244 24 Cosine 0.884 197.09 197 0.8641 0 246 245 24 Cosine 0.8641 0.0 0 0.9724 0 613 852 3 Cosine 0.9724 0.0 0 0.9271 0 613 819 3 Cosine 0.9271 0.0 0 0.8722 0 613 830 3 Cosine 0.8722 0.0 0 0.9324 0 613 623 3 Cosine 0.9324 0.0 0 0.9586 0 613 804 3 Cosine 0.9586 -28.032 -28 0.9474 0 721 654 58 Cosine 0.9474 213.085 213 0.8853 0 826 817 18 Cosine 0.8853 0.0 0 0.9666 0 742 715 8 Cosine 0.9666 30.01 30 0.7348 0 284 301 15 Cosine 0.7348 -14.016 -14 0.9205 0 284 286 15 Cosine 0.9205 -0.0 0 0.9229 0 188 259 69 Cosine 0.9229 15.995 15 0.9397 0 503 400 2 Cosine 0.9397 15.995 15 0.9497 0 503 463 2 Cosine 0.9497 14.016 14 0.9083 0 202 196 40 Cosine 0.9083 0.0 0 0.9617 0 202 270 40 Cosine 0.9617 -215.101 -215 0.795 0 245 244 24 Cosine 0.795 -15.995 -15 0.9384 0 161 163 40 Cosine 0.9384 -14.016 -14 0.9355 0 161 227 40 Cosine 0.9355 194.991 194 0.7337 0 93 102 51 Cosine 0.7337 0.0 0 0.9498 0 800 772 21 Cosine 0.9498 -147.032 -147 0.954 0 467 400 2 Cosine 0.954 -147.032 -147 0.9576 0 467 463 2 Cosine 0.9576 -103.99 -103 0.9809 0 467 378 2 Cosine 0.9809 -44.026 -44 0.7658 0 476 486 24 Cosine 0.7658 -27.995 -27 0.7486 0 476 528 24 Cosine 0.7486 -48.021 -48 0.7413 0 476 854 24 Cosine 0.7413 -48.021 -48 0.7576 0 476 864 24 Cosine 0.7576 -30.011 -30 0.7658 0 476 876 24 Cosine 0.7658 15.995 15 0.9047 0 727 824 3 Cosine 0.9047 0.001 0 0.9749 0 727 725 3 Cosine 0.9749 144.042 144 0.7649 0 44 52 39 Cosine 0.7649 -12.01 -12 0.8407 0 781 810 8 Cosine 0.8407 -4.022 -4 0.8325 0 781 766 8 Cosine 0.8325 11.973 11 0.7863 0 781 701 8 Cosine 0.7863 13.989 13 0.8211 0 781 693 8 Cosine 0.8211 1.979 1 0.8676 0 227 163 40 Cosine 0.8676 -27.029 -27 0.827 0 227 124 40 Cosine 0.827 -306.184 -306 0.7626 0 517 766 8 Cosine 0.7626 0.0 0 0.9398 0 623 852 3 Cosine 0.9398 -0.0 0 0.9228 0 623 819 3 Cosine 0.9228 0.0 0 0.9085 0 623 830 3 Cosine 0.9085 0.0 0 0.9453 0 623 804 3 Cosine 0.9453 46.006 46 0.7445 0 88 106 5 Cosine 0.7445 -1.007 -1 0.8845 0 682 716 3 Cosine 0.8845 43.042 43 0.933 0 400 378 2 Cosine 0.933 0.0 0 0.9817 0 400 463 2 Cosine 0.9817 15.995 15 0.8914 0 843 844 3 Cosine 0.8914 -1.007 -1 0.9164 0 843 845 3 Cosine 0.9164 18.011 18 0.8771 0 520 329 24 Cosine 0.8771 -14.016 -14 0.8114 0 520 244 24 Cosine 0.8114 -86.073 -86 0.8132 0 740 817 18 Cosine 0.8132 -17.026 -17 0.9147 0 740 737 18 Cosine 0.9147 -68.063 -68 0.8284 0 740 838 18 Cosine 0.8284 18.011 18 0.8136 0 817 838 18 Cosine 0.8136 18.01 18 0.929 0 864 876 24 Cosine 0.929 -0.0 0 0.9686 0 864 854 24 Cosine 0.9686 0.0 0 0.9584 0 852 804 3 Cosine 0.9584 0.0 0 0.9502 0 852 819 3 Cosine 0.9502 0.0 0 0.8983 0 852 830 3 Cosine 0.8983 14.016 14 0.9097 0 270 196 40 Cosine 0.9097 -28.03 -28 0.9238 0 893 810 8 Cosine 0.9238 -17.026 -17 0.8893 0 59 52 39 Cosine 0.8893 0.0 0 0.974 0 355 282 34 Cosine 0.974 0.0 0 0.9729 0 355 377 34 Cosine 0.9729 2.016 2 0.8418 0 355 459 34 Cosine 0.8418 -0.0 0 0.9283 0 804 819 3 Cosine 0.9283 -0.0 0 0.8937 0 804 830 3 Cosine 0.8937 18.01 18 0.8049 0 766 693 8 Cosine 0.8049 15.995 15 0.7432 0 766 701 8 Cosine 0.7432 -18.025 -18 0.8953 0 471 470 24 Cosine 0.8953 160.074 160 0.7663 0 257 324 15 Cosine 0.7663 190.084 190 0.7431 0 257 301 15 Cosine 0.7431 -29.008 -29 0.8024 0 124 163 40 Cosine 0.8024 -2.016 -2 0.775 0 528 876 24 Cosine 0.775 16.031 16 0.7043 0 528 486 24 Cosine 0.7043 13.979 13 0.9153 0 794 880 8 Cosine 0.9153 -238.229 -238 0.8033 0 789 615 23 Cosine 0.8033 25.003 25 0.9312 0 789 731 23 Cosine 0.9312 1.003 1 0.9455 0 789 788 23 Cosine 0.9455 -18.01 -18 0.7899 0 19 17 5 Cosine 0.7899 18.01 18 0.914 0 876 854 24 Cosine 0.914 15.995 15 0.8925 0 824 725 3 Cosine 0.8925 -30.01 -30 0.9548 0 301 324 15 Cosine 0.9548 2.016 2 0.7562 0 701 693 8 Cosine 0.7562 0.0 0 0.9192 0 819 830 3 Cosine 0.9192 -82.003 -82 0.7456 0 693 718 8 Cosine 0.7456 -2.016 -2 0.7215 0 473 459 34 Cosine 0.7215 -263.232 -263 0.7576 0 615 731 23 Cosine 0.7576 -239.232 -239 0.7556 0 615 788 23 Cosine 0.7556 -65.143 -65 0.7988 0 228 783 36 Cosine 0.7988 -124.162 -124 0.8674 0 228 707 36 Cosine 0.8674 43.042 43 0.9291 0 463 378 2 Cosine 0.9291 -62.875 -62 0.9339 0 378 382 2 Cosine 0.9339 2.016 2 0.8346 0 459 282 34 Cosine 0.8346 2.016 2 0.8352 0 459 377 34 Cosine 0.8352 0.0 0 0.9696 0 377 282 34 Cosine 0.9696 24.0 24 0.9732 0 788 731 23 Cosine 0.9732 59.018 59 0.7499 0 707 783 36 Cosine 0.7499 24.0 24 0.793 0 638 614 18 Cosine 0.793 0.0 0 0.9377 0 397 409 48 Cosine 0.9377 0.0 0 0.8892 0 643 660 10 Cosine 0.8892 -14.016 -14 0.8757 0 185 196 40 Cosine 0.8757 nf_output/networking/clustersummary_with_network.tsv0000644000000000000000000041671214664574440022460 0ustar rootrootcluster index parent mass RTMean ATTRIBUTE_Tissue:GNPSGROUP:Leaf ATTRIBUTE_Tissue:GNPSGROUP:Stem ATTRIBUTE_Tissue:GNPSGROUP:Root ATTRIBUTE_Replicate:GNPSGROUP:Leaf-r1 ATTRIBUTE_Replicate:GNPSGROUP:Leaf-r2 ATTRIBUTE_Replicate:GNPSGROUP:Leaf-r3 ATTRIBUTE_Replicate:GNPSGROUP:Stem-r1 ATTRIBUTE_Replicate:GNPSGROUP:Stem-r2 ATTRIBUTE_Replicate:GNPSGROUP:Stem-r3 ATTRIBUTE_Replicate:GNPSGROUP:Root-r1 ATTRIBUTE_Replicate:GNPSGROUP:Root-r2 ATTRIBUTE_Replicate:GNPSGROUP:Root-r3 component #Scan# Compound_Name 1 235.95235951583567 0.8630479 42530.30566666666 47885.30433333333 49566.95 45913.39 46763.703 34913.824 58779.19 44557.34 40319.383 60850.023 42382.71 45468.117 62 2 263.94717631156794 0.8636649 55832.96133333333 61651.73766666666 61658.44666666666 57624.188 60954.348 48920.348 75217.81 55883.473 53853.93 72569.14 53694.32 58711.88 62 3 249.92600383577096 0.8651288 48572.51233333334 44929.85666666667 49910.793 54626.785 54707.94 36382.812 53545.68 41897.48 39346.41 56053.367 45887.348 47791.664 1 4 244.94709660278235 0.8658273 84946.74333333333 80312.65466666665 89191.73666666665 95774.84 96472.29 62593.1 92545.734 76273.94 72118.29 99304.71 81280.4 86990.1 1 5 221.9313120112868 0.86600614 24560.259 23014.102666666666 24446.834666666666 36778.492 36902.285 0.0 38795.734 30246.574 0.0 39821.734 0.0 33518.77 1 6 272.94226277315965 0.86682564 85573.29166666667 79424.40333333334 89502.99866666667 95264.555 99530.46 61924.86 89143.15 76867.51 72262.55 95548.12 84927.766 88033.11 1 7 336.90143746124033 0.8730385 17720.397666666668 18380.396666666667 34112.44066666667 24905.498 28255.695 0.0 30772.68 24368.51 0.0 41192.035 29968.484 31176.803 -1 8 260.01035836677653 0.8747634 22205.164666666667 18221.888666666666 45963.17966666666 30661.984 35953.51 0.0 0.0 30792.254 23873.412 33893.625 55402.07 48593.844 5 9 218.98402928602343 0.87498426 117323.72866666668 119002.65666666668 262751.89666666667 145384.47 172040.45 34546.266 131642.14 124490.33 100875.5 303219.6 249149.78 235886.31 5 9.0 2,3,7,8-tetrahydroxychromeno[5,4,3-cde]chromene-5,10-dione 10 270.946117262364 0.87572044 26265.553333333333 26957.371666666662 63905.768 35552.86 43243.8 0.0 26953.066 31889.336 22029.713 66366.14 63819.406 61531.758 -1 11 385.8762917132882 0.87589514 19475.217666666667 15179.158 35163.79833333333 27147.309 31278.344 0.0 23819.857 21717.617 0.0 38409.31 33323.062 33759.023 -1 12 201.97430940110075 0.8763963 40290.534 41814.56766666666 108385.365 53631.742 67239.86 0.0 47071.984 44824.965 33546.754 121711.79 104411.36 99032.945 -1 13 220.98162801917667 0.8763999 26623.449000000004 29242.335000000003 65698.33466666668 35692.773 44177.574 0.0 32940.055 31667.725 23119.225 74547.97 62320.94 60226.094 5 13.0 Thelephoric acid 14 243.99749036040288 0.87675744 139769.89566666665 139187.32 318540.62666666665 167709.08 209993.88 41606.727 140684.88 156172.64 120704.44 343091.47 319064.97 293465.44 5 15 265.01589406340787 0.8770558 66571.31999999999 69867.519 168822.34 85084.81 114629.15 0.0 68246.69 82128.07 59227.797 174289.83 171734.19 160443.0 5 16 200.97331483569008 0.8773614 205313.6733333333 195965.24 475017.39 249504.27 302565.72 63871.03 221097.67 207366.39 159431.66 540984.0 459389.2 424678.97 -1 17 223.989432386154 0.8773614 599250.5066666667 573388.5766666667 1452661.2333333334 720386.06 916921.44 160444.02 597237.56 640796.2 482131.97 1572880.8 1431455.0 1353647.9 5 18 224.9905829016253 0.8773614 161330.179 155364.39333333334 414323.3366666666 192929.92 252893.75 38166.867 158928.97 179774.56 127389.65 446993.47 412218.38 383758.16 5 19 241.9999188305008 0.8773614 514422.26 504699.00666666665 1154345.2333333334 609154.8 780395.5 153716.48 516568.72 568117.2 429411.1 1250916.2 1144767.5 1067352.0 5 20 268.94832600566565 0.8773614 67581.28733333333 62420.849 164137.07666666666 81321.805 103208.93 18213.127 58137.777 74565.37 54559.4 170650.4 170195.83 151565.0 -1 21 286.95909171566205 0.87773526 36911.51 42408.771 82048.40333333334 50072.21 60662.32 0.0 39659.273 47405.65 40161.39 82697.08 88426.63 75021.5 5 22 382.9290861885838 0.87773526 45767.42333333334 44944.742666666665 132585.87000000002 59018.504 78283.766 0.0 40740.895 55550.293 38543.04 136306.72 135368.2 126082.69 5 23 400.9396554577765 0.8778197 26326.535666666663 17480.375666666667 71512.68766666666 34677.617 44301.99 0.0 0.0 30900.148 21540.979 74515.414 75195.055 64827.594 5 24 413.8713109402861 0.8781464 14493.870666666668 0.0 20173.411666666667 18939.342 24542.27 0.0 0.0 0.0 0.0 31932.479 0.0 28587.756 -1 25 287.9601006778761 0.87923694 7727.373666666666 0.0 30971.160333333333 0.0 23182.121 0.0 0.0 0.0 0.0 31622.719 31939.645 29351.117 5 26 337.97006661269904 0.87923515 8121.208333333333 6226.266666666666 36406.315 0.0 24363.625 0.0 0.0 18678.8 0.0 36157.195 36801.406 36260.344 5 27 232.9234154923418 0.8794258 0.0 17328.118 28636.267666666667 0.0 0.0 0.0 27302.012 24682.342 0.0 32227.652 27636.137 26045.014 62 28 255.93923050160188 0.8797364 76407.90233333333 89612.90333333332 104633.33333333331 81860.984 95044.2 52318.523 90685.02 90176.68 87977.01 111550.44 103917.6 98431.96 62 29 320.8668417294272 0.9325844 12408.304666666663 4646.1613333333335 17016.339666666667 22502.871 0.0 14722.043 0.0 13938.484 0.0 0.0 27612.988 23436.031 -1 30 352.8164424963716 0.93749416 10244.770333333334 5271.441666666667 6040.344333333333 0.0 15531.625 15202.686 0.0 15814.325 0.0 0.0 18121.033 0.0 -1 31 231.98887202790107 0.938467 0.0 33409.77333333334 8490.891333333333 0.0 0.0 0.0 48412.95 51816.37 0.0 0.0 0.0 25472.674 -1 32 526.757964638743 0.9510151 57867.79 82260.01 85207.942 0.0 91537.67 82065.7 96434.74 64528.0 85817.29 88175.94 75463.836 91984.05 -1 33 206.88616502603367 0.9513825 555099.2799999999 652877.3266666667 448766.42 500863.9 592346.94 572087.0 632859.1 563649.44 762123.44 503537.8 439874.06 402887.4 -1 34 290.847756064801 0.9513825 859460.9133333332 1007210.9133333332 692862.32 777419.44 913822.4 887140.9 967092.94 879936.4 1174603.4 772030.5 687151.4 619405.06 -1 35 292.8458648863933 0.9513825 240588.5433333333 292254.01 200541.4833333333 223199.11 241979.12 256587.4 281193.5 253559.47 342009.06 222664.94 196952.73 182006.78 -1 36 208.88428794577712 0.95190936 81736.56166666666 144900.28 98941.18 0.0 119888.805 125320.88 138531.81 126332.22 169836.81 110356.77 97584.74 88882.03 -1 37 381.0799637627612 0.9809907 248409.07666666663 154443.20333333334 106816.12333333334 352225.88 108095.45 284905.9 126010.92 121551.3 215767.39 108932.94 106215.17 105300.26 -1 38 705.1858030707835 0.9825038 77576.54666666668 0.0 317177.4033333333 0.0 0.0 232729.64 0.0 0.0 0.0 240262.83 363935.94 347333.44 -1 39 304.15077771272104 0.9891212 339422.7833333333 0.0 0.0 374600.44 239620.69 404047.22 0.0 0.0 0.0 0.0 0.0 0.0 -1 40 242.10257615471133 0.99513865 0.0 0.0 108639.52 0.0 0.0 0.0 0.0 0.0 0.0 92571.34 111893.55 121453.67 72 40.0 Dianthoside 41 203.15051454158848 0.99597985 66820.25666666667 0.0 537845.6533333333 0.0 0.0 200460.77 0.0 0.0 0.0 440106.16 530833.2 642597.6 -1 41.0 N,N-dimethylarginine 42 684.2563835620325 0.99713117 106862.393 18516.080666666665 165590.04166666666 124763.21 79578.805 116245.164 0.0 55548.242 0.0 98673.375 202768.17 195328.58 39 42.0 Manninotriose 43 543.1328094836607 0.9975011 106252.27933333332 26086.86333333333 58816.53 125134.19 46184.598 147438.05 0.0 0.0 78260.59 0.0 87133.56 89316.03 -1 44 487.16626878371886 0.9998968 12665.993333333334 0.0 48432.21 0.0 0.0 37997.98 0.0 0.0 0.0 0.0 75233.16 70063.47 39 44.0 beta-Lactose - 40.0 eV 45 505.1767157318995 1.0025502 45312.21666666667 0.0 72844.40999999999 67404.9 0.0 68531.75 0.0 0.0 0.0 0.0 110094.0 108439.23 39 45.0 beta-Lactose - 40.0 eV 46 258.1102096560252 1.0029247 220949.86333333337 618476.7866666667 0.0 310047.25 0.0 352802.34 1175971.9 329606.34 349852.12 0.0 0.0 0.0 23 46.0 L-alpha-Glycerylphosphorylcholine - 40.0 eV 47 558.0887101739319 1.0143573 96200.75666666668 54646.00366666666 54474.41666666666 122349.94 56273.74 109978.59 60159.074 51232.867 52546.07 73930.18 0.0 89493.07 13 48 527.1586302430198 1.0186338 55089.49 0.0 37071.085 80985.52 0.0 84282.95 0.0 0.0 0.0 0.0 52931.105 58282.15 -1 49 522.2034335100329 1.021157 188190.2633333333 36172.88333333333 118082.38333333332 245633.9 56663.23 262273.66 0.0 48521.69 59996.96 59482.2 143236.55 151528.4 39 49.0 Spectral Match to 4-O-.beta.-Galactopyranosyl-D-mannopyranose from NIST14 50 490.1770443768973 1.0225846 107713.762 22117.79333333333 69828.2 127884.266 0.0 195257.02 0.0 66353.38 0.0 0.0 102601.14 106883.46 -1 50.0 DUPA(OtBu)-OH 51 261.0370594481031 1.028642 13577.983333333332 0.0 33380.72 0.0 0.0 40733.95 0.0 0.0 0.0 0.0 53059.336 47082.824 72 51.0 Cori ester (alpha-anomer) - 40.0 eV 52 343.12391955501664 1.0309296 87030.27333333333 38611.26933333334 58698.085 128170.71 0.0 132920.11 29826.125 35465.406 50542.277 30613.035 74457.13 71024.09 39 52.0 Stachyose 53 325.1134962119126 1.0313233 208637.86333333337 118174.39666666668 169886.17 261670.05 69533.34 294710.2 115201.21 108965.43 130356.55 110186.94 203672.84 195798.73 39 53.0 Stachyose 54 233.9826083616101 1.0338651 0.0 36530.25466666667 12635.164 0.0 0.0 0.0 67893.6 41697.164 0.0 37905.492 0.0 0.0 -1 55 204.0870120681469 1.0350262 21039.56133333333 29359.84833333333 0.0 0.0 0.0 63118.684 49574.895 38504.65 0.0 0.0 0.0 0.0 -1 55.0 [3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 10-[3-acetamido-6-[[4,5-dihydroxy-3-(3,4,5-trihydroxyoxan-2-yl)oxyoxan-2-yl]oxymethyl]-4,5-dihydroxyoxan-2-yl]oxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate 56 353.9519745544646 1.0361236 42942.59733333333 0.0 0.0 43388.78 44667.77 40771.242 0.0 0.0 0.0 0.0 0.0 0.0 59 57 305.9675770561728 1.0375172 0.0 84556.98666666668 27772.656666666662 0.0 0.0 0.0 147732.14 105938.82 0.0 83317.97 0.0 0.0 59 58 323.9782103682032 1.0375172 0.0 55326.36333333334 19542.768333333333 0.0 0.0 0.0 96371.38 69607.71 0.0 58628.305 0.0 0.0 59 59 360.15037950586617 1.0386146 228496.2666666667 138193.44333333333 133624.22166666668 284874.1 79632.76 320981.94 114657.84 133540.6 166381.89 106169.375 157458.1 137245.19 39 59.0 Melezitose 60 396.03567737984815 1.0386146 93820.75666666668 88720.34333333334 56249.205 127219.086 40806.484 113436.7 87004.87 75491.71 103664.45 53660.242 63216.383 51870.99 13 61 331.88690461413887 1.0405837 0.0 40223.01933333333 45233.56 0.0 0.0 0.0 0.0 36208.938 84460.12 43699.5 57633.094 34368.086 -1 62 259.9016676560984 1.0415977 0.0 18590.020666666667 24138.28 0.0 0.0 0.0 0.0 0.0 55770.062 35400.31 37014.53 0.0 -1 63 210.93310757777 1.0422212 0.0 19631.375 54446.162 0.0 0.0 0.0 0.0 0.0 58894.125 0.0 77840.22 85498.266 -1 64 365.1057497611771 1.0422738 125315.19433333332 86009.93666666666 86884.14 152803.53 42949.223 180192.83 82617.71 74480.62 100931.48 75774.59 99273.59 85604.24 88 65 205.11857511576 1.0433908 125384.10000000002 0.0 0.0 118303.77 99714.25 158134.28 0.0 0.0 0.0 0.0 0.0 0.0 -1 65.0 DL-5-HYDROXYLYSINE - 60.0 eV 66 316.13970951661776 1.0445311 0.0 25177.52733333333 235969.93 0.0 0.0 0.0 33618.234 41914.348 0.0 274389.22 270162.97 163357.6 -1 67 507.8386396946568 1.0486933 0.0 41571.868 0.0 0.0 0.0 0.0 33797.887 35666.797 55250.92 0.0 0.0 0.0 -1 68 274.9364137241279 1.0499623 17884.443333333333 87290.645 18450.676666666663 0.0 53653.33 0.0 78788.65 79377.16 103706.125 55352.03 0.0 0.0 84 69 240.0717243831699 1.0507925 74329.15333333334 42735.35666666667 59235.857 74670.09 68823.05 79494.32 42966.89 48902.09 36337.09 47894.855 68297.15 61515.566 -1 70 202.95149360177044 1.0541131 264952.11 399928.9033333333 279813.7966666667 254604.27 338716.44 201535.62 409816.38 360696.8 429273.53 345560.7 266792.0 227088.69 84 71 238.0924299050957 1.054333 50458.808 0.0 0.0 50397.09 43260.234 57719.1 0.0 0.0 0.0 0.0 0.0 0.0 -1 72 206.102637615503 1.0833257 17690.416 0.0 8911.994666666667 25168.1 0.0 27903.148 0.0 0.0 0.0 0.0 0.0 26735.984 -1 73 337.09424893426024 1.0903232 82073.82333333335 46814.89333333333 0.0 62298.79 67643.13 116279.55 0.0 92307.9 48136.78 0.0 0.0 0.0 -1 73.0 Spectral Match to Glutathione, oxidized from NIST14 74 300.1447933398004 1.1164618 36479.60866666667 0.0 50125.10566666666 35424.91 30923.572 43090.344 0.0 0.0 0.0 49301.504 72808.055 28265.758 6 74.0 Anomuricine 75 303.1345985699363 1.13091 25196.279666666665 0.0 63615.40666666668 28498.027 0.0 47090.812 0.0 0.0 0.0 78334.1 52178.86 60333.26 -1 76 316.1397441009948 1.152027 92674.31166666666 8075.699333333334 0.0 94381.34 77409.195 106232.4 24227.098 0.0 0.0 0.0 0.0 0.0 6 77 277.9361635783316 1.1530056 31775.233333333337 46166.555666666674 69215.67833333333 37823.54 57502.16 0.0 52209.44 46557.387 39732.84 84561.1 65221.465 57864.47 73 78 205.95120286363647 1.1532425 10982.356666666668 18378.96833333333 23769.179 0.0 32947.07 0.0 32570.69 0.0 22566.215 0.0 36660.977 34646.56 73 79 222.06118763366143 1.2072697 477930.1 1180864.4 664281.84 423244.62 578846.56 431699.12 1139284.6 1056142.8 1347165.8 710901.56 704052.4 577891.56 31 79.0 2479-49-4 80 227.01660855538984 1.2072697 141930.86 325159.28 177869.9833333333 128467.87 153558.81 143765.9 320072.88 304507.16 350897.8 192396.28 186925.23 154288.44 -1 81 316.1396173473288 1.2198966 53116.47400000001 22399.52133333333 72234.74066666666 57461.137 32827.395 69060.89 35342.906 31855.658 0.0 118924.73 55233.715 42545.777 6 82 358.113483049946 1.2251896 200841.05666666664 578221.0966666667 384812.9166666667 268075.7 0.0 334447.47 559826.6 786314.44 388522.25 489896.34 352193.88 312348.53 6 82.0 DOPAMINE 83 248.02451459210872 1.2316294 176904.44333333336 132862.10133333332 57363.45333333333 187679.58 152964.69 190069.06 145719.02 149457.62 103409.664 104171.67 0.0 67918.69 -1 84 303.1344714596457 1.2360374 214381.16666666663 88462.40666666666 100197.669 270739.97 0.0 372403.53 265387.22 0.0 0.0 228490.58 40186.047 31916.38 6 85 245.08638025770523 1.2526807 116506.54466666664 0.0 27609.84633333333 127680.984 84274.04 137564.61 0.0 0.0 0.0 39472.105 43357.434 0.0 -1 86 215.0166800127835 1.2553027 0.0 52018.72 264148.8933333333 0.0 0.0 0.0 47545.94 46060.11 62450.11 300043.1 224049.08 268354.5 -1 87 438.97976661757656 1.2556311 0.0 0.0 161034.80333333332 0.0 0.0 0.0 0.0 0.0 0.0 179613.47 131802.19 171688.75 -1 88 282.0977829081002 1.2570852 0.0 151024.56999999998 139920.63533333334 0.0 0.0 0.0 125266.88 144231.0 183575.83 172984.6 120928.516 125848.79 5 88.0 N-Methylglutamate - 40.0 eV 89 287.9808094721181 1.257549 0.0 27844.734666666667 100412.91666666669 0.0 0.0 0.0 46167.88 37366.324 0.0 164442.36 136796.39 0.0 -1 90 312.1083189459417 1.2581733 0.0 119609.49 73272.97466666666 0.0 0.0 0.0 0.0 358828.47 0.0 59632.754 83596.04 76590.13 72 90.0 CCG-208508 CollisionEnergy:102040 91 229.15502079308763 1.2583922 135873.05666666667 0.0 180455.81333333332 189665.47 0.0 217953.7 0.0 0.0 0.0 171083.53 176752.27 193531.64 -1 92 331.0930727524433 1.2588755 0.0 65937.48533333333 5755.771333333333 0.0 0.0 0.0 70664.54 94013.74 33134.176 0.0 17267.314 0.0 -1 93 437.97344867673127 1.2592072 0.0 0.0 457098.7333333333 0.0 0.0 0.0 0.0 0.0 0.0 551191.2 354953.0 465152.0 51 94 462.2128107245835 1.2611223 145026.28333333333 0.0 0.0 114052.44 152083.64 168942.77 0.0 0.0 0.0 0.0 0.0 0.0 44 95 254.1614439346837 1.2615542 357379.34 8856.430333333334 0.0 353048.84 302155.62 416933.56 26569.291 0.0 0.0 0.0 0.0 0.0 87 96 241.1549462251537 1.2625823 36764.53133333333 0.0 49294.41 52401.867 0.0 57891.727 0.0 0.0 0.0 0.0 70452.65 77430.58 -1 97 210.0612313965115 1.2627951 0.0 0.0 53805.29433333333 0.0 0.0 0.0 0.0 0.0 0.0 61084.5 45692.637 54638.746 -1 98 393.9836724235304 1.2627951 0.0 0.0 142819.60466666668 0.0 0.0 0.0 0.0 0.0 0.0 172527.48 108691.164 147240.17 51 99 236.0921065189324 1.2660747 0.0 258150.88666666663 184657.1783333333 0.0 0.0 0.0 85665.81 358683.75 330103.1 114087.875 212814.06 227069.6 5 99.0 Indole-3-butyric acid CollisionEnergy:102040 100 267.0978635446997 1.2663741 0.0 0.0 62063.68666666667 0.0 0.0 0.0 0.0 0.0 0.0 48014.5 66557.79 71618.77 -1 100.0 PYRIDOXAL 5'-PHOSPHATE - 30.0 eV 101 300.1447398637798 1.2678518 131894.92333333334 11505.894 0.0 119659.07 121484.92 154540.78 0.0 15737.02 18780.662 0.0 0.0 0.0 6 102 242.98283720064063 1.2704161 0.0 46781.10133333333 249635.26 0.0 0.0 0.0 69806.484 0.0 70536.82 252595.38 220870.06 275440.34 51 103 322.0775716749342 1.2726034 49537.713 57586.31133333334 23160.97133333333 46962.777 48754.87 52895.492 39853.176 44832.383 88073.375 69482.914 0.0 0.0 -1 104 335.94179340227845 1.2743808 0.0 45804.920000000006 108923.04166666669 0.0 0.0 0.0 70107.72 0.0 67307.04 200874.5 125894.625 0.0 51 105 254.1615315652569 1.6063633 270470.4 10114.366 0.0 265905.06 237650.61 307855.53 30343.098 0.0 0.0 0.0 0.0 0.0 87 106 236.092150287714 1.6562923 0.0 89242.69233333333 51008.42166666666 0.0 0.0 0.0 117821.01 90338.84 59568.227 88105.79 33172.082 31747.393 5 107 321.08518893714984 1.6655324 0.0 155127.80666666667 95155.80666666669 0.0 0.0 0.0 137098.1 114818.84 213466.48 0.0 151698.5 133768.92 -1 108 462.212951406862 1.6703943 33130.737 0.0 0.0 27834.379 38240.234 33317.598 0.0 0.0 0.0 0.0 0.0 0.0 44 109 284.1498050126573 1.7111727 32605.78133333333 0.0 0.0 30048.531 30035.043 37733.77 0.0 0.0 0.0 0.0 0.0 0.0 6 110 300.1448882940901 1.7854755 84403.71966666666 24254.101666666666 0.0 77267.055 81480.62 94463.484 72762.305 0.0 0.0 0.0 0.0 0.0 6 111 476.2286083440904 2.4629261 191020.42 0.0 0.0 188506.84 166553.19 218001.23 0.0 0.0 0.0 0.0 0.0 0.0 44 112 514.1384629895498 2.5798113 187581.19333333336 0.0 0.0 192331.92 191103.02 179308.64 0.0 0.0 0.0 0.0 0.0 0.0 35 113 379.0642127352642 2.5939627 95580.04333333332 0.0 0.0 98520.19 71582.18 116637.76 0.0 0.0 0.0 0.0 0.0 0.0 78 113.0 NCGC00384821-01_C16H18O8_Cyclohexanecarboxylic acid, 1,3,4-trihydroxy-5-[[(2E)-3-(4-hydroxyphenyl)-1-oxo-2-propen-1-yl]oxy]-, (1R,3R,4S,5R)- 114 455.9992303511799 2.595041 68361.70533333333 0.0 0.0 71744.47 51088.176 82252.47 0.0 0.0 0.0 0.0 0.0 0.0 41 115 220.11842046208 2.609959 77486.675 37292.57033333333 31741.20166666667 78179.375 63739.44 90541.21 58431.414 53446.297 0.0 48978.0 0.0 46245.605 -1 115.0 PANTOTHENIC ACID 116 318.15532119888866 2.72993 221791.35 0.0 0.0 176658.31 234620.08 254095.66 0.0 0.0 0.0 0.0 0.0 0.0 39 116.0 Salidroside 117 332.1346819627294 2.8552463 54116.38533333333 0.0 0.0 45651.71 57004.38 59693.066 0.0 0.0 0.0 0.0 0.0 0.0 39 117.0 Amygdalin 118 289.99903269190605 2.8902953 0.0 23349.33133333333 9684.125 0.0 0.0 0.0 0.0 40824.99 29223.004 0.0 29052.375 0.0 -1 119 388.0881919626523 2.9668627 103207.465 0.0 0.0 80815.44 104571.08 124235.875 0.0 0.0 0.0 0.0 0.0 0.0 43 119.0 ESCULIN 120 432.9889269532191 2.970073 95327.67666666668 0.0 0.0 90396.78 89595.266 105990.984 0.0 0.0 0.0 0.0 0.0 0.0 -1 121 474.1738603080214 2.9700763 67056.15766666667 0.0 0.0 67712.93 54165.973 79289.57 0.0 0.0 0.0 0.0 0.0 0.0 -1 122 371.06141175916713 2.9732714 64392.81333333333 0.0 0.0 55533.99 58456.38 79188.07 0.0 0.0 0.0 0.0 0.0 0.0 43 122.0 ESCULIN 123 300.1599873997667 3.1093981 12077738.333333334 5892661.833333333 346421.5333333333 10982472.0 12602882.0 12647861.0 4946851.5 6344556.0 6386578.0 403845.53 410659.1 224759.97 40 123.0 Desvenlafaxine 124 301.1627750884432 3.1137774 1635812.0 408198.7333333333 0.0 0.0 2446829.0 2460607.0 0.0 1224596.2 0.0 0.0 0.0 0.0 40 125 298.14463223074813 3.1171553 99485.21 29599.903666666665 0.0 88982.4 105159.06 104314.17 43298.598 0.0 45501.113 0.0 0.0 0.0 40 126 330.1704755062671 3.1485684 65940.21666666666 0.0 0.0 69874.89 48510.04 79435.72 0.0 0.0 0.0 0.0 0.0 0.0 40 126.0 O-methylarmepavine 127 298.09781291728063 3.1581943 32593.516333333333 9884.923333333334 8929.540333333332 29637.127 29681.379 38462.043 29654.77 0.0 0.0 26788.621 0.0 0.0 -1 127.0 Spectral Match to Adenosine, 5'-S-methyl-5'-thio- from NIST14 128 374.1087319881969 3.2247093 44977.24133333333 0.0 0.0 37296.01 45550.562 52085.152 0.0 0.0 0.0 0.0 0.0 0.0 41 128.0 Saccatoside 129 446.2180227939602 3.2431755 39707.05333333334 0.0 0.0 31456.012 46384.824 41280.324 0.0 0.0 0.0 0.0 0.0 0.0 44 130 272.1284602541489 3.3063223 166266.12 0.0 0.0 113183.9 205369.44 180245.02 0.0 0.0 0.0 0.0 0.0 0.0 40 130.0 Higenamine 131 318.15529341116365 3.3133132 51768.76433333333 0.0 0.0 47583.133 49386.83 58336.33 0.0 0.0 0.0 0.0 0.0 0.0 39 131.0 Salidroside 132 205.0975267500236 3.3404171 290334.64 65538.636 84666.75866666668 234487.45 321273.5 315242.97 67248.38 44028.348 85339.18 33151.97 74429.836 146418.47 -1 132.0 Spectral Match to L-Tryptophan from NIST14 133 286.1443526721068 3.3839138 46298.43033333333 0.0 0.0 33719.33 54452.844 50723.117 0.0 0.0 0.0 0.0 0.0 0.0 40 133.0 Higenamine 134 330.17059484290274 3.40843 28931.98066666667 0.0 1562610.35 37482.402 0.0 49313.54 0.0 0.0 0.0 2275870.5 1610570.8 801389.75 40 134.0 O-methylarmepavine 135 328.1551627132885 3.419004 19646.424 0.0 44297.652 32169.139 26770.133 0.0 0.0 0.0 0.0 86074.086 46818.87 0.0 40 135.0 5-bromo-N-(1-(thiophen-2-yl)cyclopentyl)nicotinamide 136 247.060376786721 3.4683971 27059.859666666667 0.0 0.0 22356.627 27206.602 31616.35 0.0 0.0 0.0 0.0 0.0 0.0 19 136.0 naringenin CollisionEnergy:205060 137 350.0696018742779 3.469957 116101.37666666666 0.0 0.0 119592.64 150952.28 77759.21 0.0 0.0 0.0 0.0 0.0 0.0 -1 138 298.14441534905205 3.5103195 56394.494333333336 40078.87666666666 0.0 37187.15 83482.38 48513.953 27762.25 40925.61 51548.77 0.0 0.0 0.0 16 139 460.2335060013322 3.5350459 51397.756 0.0 0.0 54415.656 43082.312 56695.3 0.0 0.0 0.0 0.0 0.0 0.0 44 140 247.0603645282865 3.5437875 377506.0 7061.672 44393.96433333334 315170.03 390879.47 426468.5 0.0 0.0 21185.016 37233.3 46396.82 49551.773 19 140.0 naringenin CollisionEnergy:102040 141 409.11361845893424 3.5468643 32818.10766666667 0.0 0.0 27619.766 34116.6 36717.957 0.0 0.0 0.0 0.0 0.0 0.0 -1 141.0 NCGC00180273-02!7-hydroxy-2-(4-hydroxyphenyl)-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3-dihydrochromen-4-one 142 409.99370124281614 3.5505972 67628.34499999999 0.0 0.0 62343.395 71813.84 68727.8 0.0 0.0 0.0 0.0 0.0 0.0 41 143 419.0094736984677 3.5505972 102640.19333333331 0.0 0.0 97974.95 98211.91 111733.72 0.0 0.0 0.0 0.0 0.0 0.0 41 143.0 4-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypentan-2-yl (E)-3-(4-hydroxyphenyl)prop-2-enoate 144 455.99904455502127 3.5505972 78649.85666666667 0.0 0.0 72721.63 76831.85 86396.09 0.0 0.0 0.0 0.0 0.0 0.0 41 145 757.0732300044441 3.5505972 39878.31266666667 0.0 0.0 33818.29 38317.992 47498.656 0.0 0.0 0.0 0.0 0.0 0.0 41 146 339.0713726947942 3.5536413 99380.21666666666 0.0 0.0 88445.77 97004.9 112689.98 0.0 0.0 0.0 0.0 0.0 0.0 41 146.0 Saccatoside 147 379.0640242459414 3.5536413 329863.6533333333 0.0 0.0 304922.5 324172.16 360496.3 0.0 0.0 0.0 0.0 0.0 0.0 78 147.0 NCGC00384821-01_C16H18O8_Cyclohexanecarboxylic acid, 1,3,4-trihydroxy-5-[[(2E)-3-(4-hydroxyphenyl)-1-oxo-2-propen-1-yl]oxy]-, (1R,3R,4S,5R)- 148 735.1380827544244 3.5536413 45571.435 0.0 0.0 36896.547 42605.453 57212.305 0.0 0.0 0.0 0.0 0.0 0.0 78 149 766.0679502019804 3.5536413 53504.52066666667 0.0 0.0 48018.047 49872.535 62622.98 0.0 0.0 0.0 0.0 0.0 0.0 41 150 357.0819177535127 3.5568123 119790.44333333334 0.0 0.0 109883.85 110552.98 138934.5 0.0 0.0 0.0 0.0 0.0 0.0 41 150.0 (2S)-3-(4-hydroxyphenyl)-2-[[(Z)-3-(4-hydroxyphenyl)prop-2-enoyl]amino]propanoic acid 151 450.1977618580258 3.5635161 10538.998 7952.834 50604.60199999999 0.0 0.0 31616.994 0.0 23858.502 0.0 41601.598 58104.45 52107.758 -1 151.0 (2R,3S,4S,5R,6R)-5-[(2S,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy-2-(hydroxymethyl)-6-[2-(4-hydroxyphenyl)ethoxy]oxane-3,4-diol 152 265.1549324396733 3.585266 39441.399 959065.55 57829.12233333333 40622.39 26931.477 50770.33 895426.25 914476.0 1067294.4 73334.32 51351.145 48801.902 6 152.0 Ferulic acid 153 300.15985349884096 3.620275 1021482.6166666666 12755.523333333333 0.0 1143623.4 667518.25 1253306.2 0.0 0.0 38266.57 0.0 0.0 0.0 40 153.0 Higenamine 154 298.14435148876095 3.6234894 50932.51966666666 0.0 0.0 57125.074 35400.465 60272.02 0.0 0.0 0.0 0.0 0.0 0.0 40 154.0 PF-9366 155 290.10283150955314 3.6456516 0.0 0.0 65194.606 0.0 0.0 0.0 0.0 0.0 0.0 81298.625 76974.4 37310.793 6 156 355.1024194803496 3.651168 113003.75833333336 0.0 0.0 82665.875 133478.23 122867.17 0.0 0.0 0.0 0.0 0.0 0.0 -1 156.0 Chlorogenic acid 157 613.1764743439369 3.652902 43782.21333333334 0.0 0.0 28502.084 57350.906 45493.65 0.0 0.0 0.0 0.0 0.0 0.0 -1 158 326.13956666072863 3.6721017 0.0 0.0 409686.9666666666 0.0 0.0 0.0 0.0 0.0 0.0 595463.25 422123.38 211474.27 40 158.0 PJ34 159 327.1434016642263 3.6721017 0.0 0.0 78599.52799999999 0.0 0.0 0.0 0.0 0.0 0.0 115389.14 81766.664 38642.78 40 160 328.15492609976985 3.6721017 0.0 0.0 3069773.4666666663 0.0 0.0 0.0 0.0 0.0 0.0 3902455.0 3653004.8 1653860.6 9 160.0 Magnoflorine 161 314.1756508820692 3.682997 36289382.66666666 6887175.666666667 0.0 36821620.0 33144712.0 38901816.0 5536475.5 7459311.0 7665740.5 0.0 0.0 0.0 40 161.0 O-methylarmepavine 162 317.18407423444233 3.6848695 67429.59366666667 0.0 0.0 69396.086 59278.14 73614.555 0.0 0.0 0.0 0.0 0.0 0.0 40 163 330.17041733192855 3.7159967 85888.88799999999 105045.01666666666 65515.58533333333 86044.98 84594.45 87027.234 95689.75 104839.64 114605.66 102251.016 56386.22 37909.52 40 163.0 Desvenlafaxine 164 399.16563872790886 3.747495 0.0 23735.916666666668 0.0 0.0 0.0 0.0 20016.086 19493.855 31697.809 0.0 0.0 0.0 -1 164.0 NCGC00380580-01 165 439.1581196454956 3.7585142 0.0 47903.58266666666 0.0 0.0 0.0 0.0 28876.994 51744.16 63089.594 0.0 0.0 0.0 29 166 210.04012483683752 3.7665913 0.0 83702.83633333334 92246.71333333332 0.0 0.0 0.0 141849.56 42491.254 66767.695 115922.61 78383.99 82433.54 -1 166.0 patulin CollisionEnergy:205060 167 243.99324783705308 3.7680643 0.0 148400.56666666668 67195.989 0.0 0.0 0.0 92274.1 207981.16 144946.44 22179.287 97884.39 81524.29 105 168 267.0767133663512 3.7682116 0.0 36405.45 0.0 0.0 0.0 0.0 35085.844 45691.1 28439.406 0.0 0.0 0.0 5 169 329.07740099823803 3.7682116 0.0 48182.954666666665 0.0 0.0 0.0 0.0 44048.26 61979.67 38520.934 0.0 0.0 0.0 -1 170 589.1358627119546 3.7685478 0.0 265059.66233333334 22579.305333333334 0.0 0.0 0.0 50747.547 597637.6 146793.84 0.0 44909.164 22828.752 -1 171 442.1039585564709 3.7709334 0.0 191596.49 14987.789 0.0 0.0 0.0 64177.95 377261.97 133349.55 0.0 44963.367 0.0 42 171.0 STL464062 172 297.087511246618 3.7718499 0.0 262885.10000000003 38594.27833333333 0.0 0.0 0.0 60817.5 535420.6 192417.2 0.0 73162.03 42620.805 42 172.0 4-PYRIDOXATE - 60.0 eV 173 313.08246817462475 3.7718499 0.0 176348.08333333334 42381.992 0.0 0.0 0.0 133296.45 254030.03 141717.77 0.0 74619.836 52526.14 42 174 259.98803053263015 3.7772634 0.0 100881.17666666664 53535.105 0.0 0.0 0.0 91055.73 127517.49 84070.31 42420.227 62196.348 55988.74 105 175 311.0668612366178 3.7792711 0.0 103183.58333333331 17541.652333333335 0.0 0.0 0.0 101909.68 126904.03 80737.04 0.0 52624.957 0.0 5 175.0 Ellagic acid 176 260.9957668611993 3.7795646 0.0 78735.05099999999 20953.946 0.0 0.0 0.0 31614.963 134116.44 70473.75 0.0 37995.305 24866.533 -1 177 295.0719167144979 3.7795646 0.0 291467.62666666665 75779.31666666667 0.0 0.0 0.0 220926.8 423676.6 229799.48 0.0 131141.05 96196.9 5 177.0 Thelephoric acid 178 258.9802208506701 3.783956 0.0 80856.65000000001 20224.707 0.0 0.0 0.0 58558.188 120416.125 63595.637 0.0 35580.266 25093.855 -1 179 307.00175308474815 3.783956 0.0 82788.47566666667 19817.591333333334 0.0 0.0 0.0 49135.977 131485.06 67744.39 0.0 34518.254 24934.52 -1 180 265.9748873073869 3.784732 0.0 72800.557 9687.400333333331 0.0 0.0 0.0 45193.438 115595.78 57612.453 0.0 29062.201 0.0 -1 181 314.1393248267559 3.7858818 0.0 0.0 367320.3533333333 0.0 0.0 0.0 0.0 0.0 0.0 403680.12 509921.1 188359.84 8 182 342.1761927624613 3.822485 24501.224666666665 0.0 0.0 24051.947 20011.777 29439.95 0.0 0.0 0.0 0.0 0.0 0.0 -1 183 476.2283360650492 3.8268936 39145.335666666666 0.0 0.0 38381.203 35326.754 43728.05 0.0 0.0 0.0 0.0 0.0 0.0 44 184 227.0918420981621 3.854627 0.0 0.0 33760.077333333335 0.0 0.0 0.0 0.0 0.0 0.0 23339.828 40769.65 37170.754 -1 184.0 NCGC00385424-01 185 286.14417435480544 3.8772564 60771.03666666666 0.0 0.0 57452.324 46348.176 78512.61 0.0 0.0 0.0 0.0 0.0 0.0 40 185.0 N-methylcoclaurine 186 314.17554306957186 3.8936543 2882008.966666667 1021455.5666666668 3315363.8666666667 3166796.2 2297052.5 3182178.2 1056524.5 993092.0 1014750.2 4888362.5 3287564.5 1770164.6 40 186.0 O-methylarmepavine 187 463.08428128092254 3.8978376 194488.6533333333 0.0 0.0 166741.28 182099.08 234625.6 0.0 0.0 0.0 0.0 0.0 0.0 40 187.0 1-[(4-hydroxyphenyl)methyl]-6-methoxy-1,2,3,4-tetrahydroisoquinolin-7-ol 188 579.150381318193 3.913309 481715.5 20910.466333333334 421973.2166666666 462485.5 355499.75 627161.25 25228.852 0.0 37502.547 282017.47 473477.56 510424.62 69 188.0 Spectral Match to Procyanidin B2 from NIST14 189 298.14419811610225 3.916212 906583.6533333332 280037.2833333333 0.0 920570.5 865163.06 934017.4 204302.83 290215.9 345593.12 0.0 0.0 0.0 16 190 272.12827427949514 3.9174511 126085.59 0.0 0.0 100134.09 118468.37 159654.31 0.0 0.0 0.0 0.0 0.0 0.0 40 190.0 Coclaurine 191 344.1861210085429 3.9446158 32732.320333333333 15818.468 9407.17 52042.348 0.0 46154.613 23568.434 23886.97 0.0 28221.51 0.0 0.0 40 191.0 AC1L9EVY CollisionEnergy:102040 192 279.1708495209212 3.9491036 0.0 34461.39333333333 0.0 0.0 0.0 0.0 26241.963 22568.604 54573.613 0.0 0.0 0.0 6 192.0 NCGC00385009-01!(1S,3R,4R,5R)-1,3-dihydroxy-4,5-bis[[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxy]cyclohexane-1-carboxylic acid 193 285.12391449289174 3.9562223 0.0 68983.58666666667 0.0 0.0 0.0 0.0 40941.867 144909.7 21099.193 0.0 0.0 0.0 90 194 328.15478837519004 4.015082 122965.05166666668 0.0 0.0 122075.63 92100.695 154718.83 0.0 0.0 0.0 0.0 0.0 0.0 16 195 716.2220517597802 4.0439367 43493.424 0.0 0.0 42794.707 34905.805 52779.76 0.0 0.0 0.0 0.0 0.0 0.0 60 196 300.15991640458395 4.0490966 1819525.566666667 0.0 0.0 1890772.6 1259748.9 2308055.2 0.0 0.0 0.0 0.0 0.0 0.0 40 196.0 N,O-dimethylcoclaurine 197 434.1814655223639 4.073726 714062.2200000001 106701.662 0.0 612714.56 733586.4 795885.7 66870.586 113740.3 139494.1 0.0 0.0 0.0 35 197.0 NCGC00347814-02 198 274.1078189434561 4.0834303 0.0 0.0 63019.995 0.0 0.0 0.0 0.0 0.0 0.0 83769.805 67310.89 37979.29 6 198.0 Paprazine 199 595.1662120758889 4.0846915 111932.62 0.0 20970.447333333334 120790.12 75305.94 139701.8 0.0 0.0 0.0 0.0 29151.467 33759.875 -1 199.0 apigenin 6,8-digalactoside 200 366.1006980750337 4.086166 52645.25 0.0 0.0 42879.05 57479.766 57576.934 0.0 0.0 0.0 0.0 0.0 0.0 40 200.0 1-[(4-hydroxyphenyl)methyl]-6-methoxy-1,2,3,4-tetrahydroisoquinolin-7-ol 201 269.1173684649701 4.103914 73807.28666666667 0.0 0.0 71811.125 55651.895 93958.84 0.0 0.0 0.0 0.0 0.0 0.0 40 201.0 sophocarpine 202 286.1442562825428 4.1094885 4744020.100000001 64606.291 40946.81133333334 4665752.5 3692460.8 5873847.0 67329.08 63853.047 62636.746 42736.914 53300.19 26803.33 40 202.0 1-[(4-hydroxyphenyl)methyl]-6-methoxy-1,2,3,4-tetrahydroisoquinolin-7-ol 203 239.0917703311052 4.13982 0.0 0.0 24315.48933333333 0.0 0.0 0.0 0.0 0.0 0.0 23981.39 22799.41 26165.668 -1 204 300.15995899038546 4.1957464 105333.31166666666 0.0 11411.78 112514.375 63716.66 139768.9 0.0 0.0 0.0 0.0 34235.34 0.0 40 204.0 N,O-dimethylcoclaurine 205 426.05154123629086 4.218683 26608.518 0.0 26817.235 25214.643 22605.688 32005.223 0.0 0.0 0.0 26312.154 24993.074 29146.477 -1 206 291.0867753053311 4.220504 374460.1866666667 90802.35 438044.3033333334 347523.66 310899.34 464957.56 114430.78 59274.54 98701.73 404749.0 435681.88 473702.03 93 206.0 Catechin 207 385.0249772742104 4.220644 36108.088 0.0 38274.247 34861.844 29839.275 43623.145 0.0 0.0 0.0 40139.8 34299.574 40383.367 -1 208 388.2548456070381 4.220881 8879.985 7996.701333333333 16006.041666666666 26639.955 0.0 0.0 23990.104 0.0 0.0 0.0 0.0 48018.125 36 209 289.0712486998487 4.2261367 53036.492 0.0 65315.08866666667 49842.113 43390.293 65877.07 0.0 0.0 0.0 76082.9 56886.94 62975.426 93 209.0 Cianidanol CollisionEnergy:102040 210 311.05320506969537 4.226957 7520.955000000001 0.0 15198.060666666666 0.0 0.0 22562.865 0.0 0.0 0.0 23484.514 0.0 22109.668 -1 211 326.1393134243115 4.275189 0.0 0.0 155677.75333333333 0.0 0.0 0.0 0.0 0.0 0.0 133201.61 277516.84 56314.81 8 212 867.2131345571191 4.2899566 109365.72333333331 0.0 89876.62 98259.14 84283.48 145554.55 0.0 0.0 0.0 62379.38 96061.06 111189.42 69 212.0 Procyanidin C1 40eV 213 373.1839238161489 4.2916107 0.0 52903.19066666666 0.0 0.0 0.0 0.0 23930.71 95355.55 39423.312 0.0 0.0 0.0 -1 214 328.1549202014655 4.32138 0.0 0.0 204979.1 0.0 0.0 0.0 0.0 0.0 0.0 195702.8 249871.3 169363.2 9 214.0 Matairesinol 4'-O-beta-gentiobioside 215 460.2183088993704 4.334659 185536.65 90994.30666666669 0.0 190445.69 148677.56 217486.7 115341.14 88956.22 68685.56 0.0 0.0 0.0 -1 216 263.12797043158696 4.3351846 35044.386 7998.651000000001 0.0 36087.566 28388.768 40656.824 23995.953 0.0 0.0 0.0 0.0 0.0 -1 217 465.1736367396893 4.335401 101877.72000000002 53262.9 0.0 104035.93 81625.1 119972.13 61983.61 57097.77 40707.32 0.0 0.0 0.0 88 217.0 2034287-08-4 218 234.1491072534044 4.3385196 106536.61666666664 0.0 0.0 146060.27 35059.75 138489.83 0.0 0.0 0.0 0.0 0.0 0.0 -1 219 344.1859134454357 4.3699756 0.0 7587.31 977541.8533333332 0.0 0.0 0.0 0.0 0.0 22761.93 1737066.2 784125.3 411434.06 40 219.0 O-methylarmepavine 220 202.0502519564465 4.3792553 0.0 21188.694666666663 7398.427666666666 0.0 0.0 0.0 38188.586 25377.498 0.0 22195.283 0.0 0.0 5 221 342.08242654110046 4.386318 49733.83433333333 0.0 0.0 47010.863 47769.37 54421.27 0.0 0.0 0.0 0.0 0.0 0.0 31 222 207.13828810434825 4.3908267 27301.053666666663 37327.856 217780.382 38582.266 0.0 43320.895 29408.768 36477.97 46096.83 114774.086 294560.25 244006.81 61 222.0 3,5,5-Trimethyl-4beta-hydroxy-4-[3-(beta-D-glucopyranosyloxy)-1-butenyl]-2-cyclohexene-1-one 223 409.1838635776997 4.391768 0.0 0.0 58122.824 0.0 0.0 0.0 0.0 0.0 0.0 28863.105 80174.734 65330.633 -1 224 285.1239404924774 4.4041495 0.0 118082.27333333332 0.0 0.0 0.0 0.0 61391.535 262022.66 30832.625 0.0 0.0 0.0 90 224.0 """2-amino-6-(hydroxymethyl)-4-naphthyl-8-oxo-4H-pyrano[3,2-b]pyran-3-carbonitril e CollisionEnergy:102040""" 225 342.1706109379389 4.4111266 0.0 0.0 5694274.566666666 0.0 0.0 0.0 0.0 0.0 0.0 7618878.5 6258310.0 3205635.2 9 225.0 Spegatrine 226 347.1450655541491 4.4627857 138159.90466666667 0.0 0.0 46848.324 245305.39 122326.0 0.0 0.0 0.0 0.0 0.0 0.0 39 226.0 Amygdalin 227 328.1912960822878 4.4692326 8388299.833333333 864730.82 303592.5366666667 9055552.0 6269028.5 9840319.0 874087.7 916791.2 803313.56 451216.53 281826.25 177734.83 40 227.0 AC1L9EVY CollisionEnergy:102040 228 432.2809062938011 4.473739 29747.036666666663 7310.513333333333 22729.26166666667 36627.723 25257.037 27356.35 21931.54 0.0 0.0 0.0 22021.215 46166.57 36 229 342.17031583927627 4.5102983 77881.11700000001 0.0 0.0 61047.98 113924.266 58671.105 0.0 0.0 0.0 0.0 0.0 0.0 40 229.0 Mexiletine 230 330.0975628186358 4.520679 115972.58666666668 0.0 0.0 116184.93 100325.66 131407.17 0.0 0.0 0.0 0.0 0.0 0.0 -1 231 743.203538974241 4.5294585 44033.949 0.0 0.0 40794.96 35145.832 56161.055 0.0 0.0 0.0 0.0 0.0 0.0 37 231.0 Rutin 232 316.1913495932981 4.536697 44954.87533333333 40970.831 0.0 40952.742 49153.254 44758.63 31247.996 49926.97 41737.527 0.0 0.0 0.0 15 233 330.1706540745395 4.5903296 0.0 0.0 105438.055 0.0 0.0 0.0 0.0 0.0 0.0 88144.74 140498.73 87670.695 -1 233.0 Reticuline 234 360.21723653805066 4.5942273 145101.62 0.0 0.0 144949.86 116104.39 174250.61 0.0 0.0 0.0 0.0 0.0 0.0 38 235 344.1859820146121 4.6310844 231061.8533333333 0.0 0.0 167904.0 397711.97 127569.59 0.0 0.0 0.0 0.0 0.0 0.0 40 235.0 AC1L9EVY CollisionEnergy:102040 236 252.08687277034903 4.6847434 38847.7 0.0 81236.27966666665 35780.44 36119.402 44643.258 0.0 0.0 0.0 61455.414 89122.3 93131.125 -1 237 476.3069197792579 4.6910024 14586.644 0.0 12017.18 23957.979 0.0 19801.953 0.0 0.0 0.0 0.0 0.0 36051.54 36 238 482.1850189456295 4.732253 0.0 0.0 43893.28400000001 0.0 0.0 0.0 0.0 0.0 0.0 21722.568 39671.344 70285.94 -1 239 360.1081054051653 4.768384 368825.98 200630.96666666667 107395.988 376260.25 311740.75 418476.94 200608.86 191039.23 210244.81 92670.41 101291.14 128226.414 6 239.0 NCGC00169550-02!(E)-3-(4-hydroxy-3-methoxyphenyl)-N-[2-(4-hydroxyphenyl)ethyl]prop-2-enamide [IIN-based: Match] 240 328.1550016272345 4.7718167 0.0 0.0 67424.85666666667 0.0 0.0 0.0 0.0 0.0 0.0 76232.16 84202.91 41839.5 9 240.0 Laetanine 241 554.1695004323715 4.7836876 222226.41666666663 0.0 0.0 194320.64 218518.95 253839.66 0.0 0.0 0.0 0.0 0.0 0.0 60 241.0 NCGC00169057-02_C17H26O11_Methyl (1S,4aS,5R,7S,7aS)-1-(beta-D-glucopyranosyloxy)-5,7-dihydroxy-7-methyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylate 242 344.18601268878484 4.824577 0.0 0.0 43105.14633333334 0.0 0.0 0.0 0.0 0.0 0.0 69774.24 34467.402 25073.797 40 242.0 Mexiletine 243 314.17562247100227 4.8281884 13148969.0 3433567.833333333 4565558.5 12938732.0 12658942.0 13849233.0 2558223.5 3752168.5 3990311.5 6027316.0 5456652.0 2212707.5 40 243.0 O-methylarmepavine 244 355.15414136767026 4.8283043 134429.11666666667 30593.349666666665 0.0 124951.46 127586.06 150749.83 24015.969 42922.793 24841.287 0.0 0.0 0.0 24 245 570.2546849032911 4.8313823 123666.80666666666 20624.248000000003 0.0 115796.15 121370.16 133834.11 0.0 38257.707 23615.037 0.0 0.0 0.0 24 245.0 2-[4-[4-[hydroxy-(4-hydroxy-3-methoxyphenyl)methyl]-3-(hydroxymethyl)oxolan-2-yl]-2-methoxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol 246 373.1646578693502 4.8316236 72260.64 7843.082666666666 0.0 66918.25 68688.48 81175.19 0.0 23529.248 0.0 0.0 0.0 0.0 24 246.0 2-[4-[(3R,3aR,6S,6aR)-3-(3,4-dimethoxyphenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-6-yl]-2-methoxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol 247 575.2099699923 4.8331814 29281.01066666667 0.0 0.0 25989.584 29366.168 32487.28 0.0 0.0 0.0 0.0 0.0 0.0 -1 248 540.1898171547001 4.835503 270668.5533333333 0.0 0.0 255402.61 252879.45 303723.6 0.0 0.0 0.0 0.0 0.0 0.0 60 248.0 NCGC00169057-02_C17H26O11_Methyl (1S,4aS,5R,7S,7aS)-1-(beta-D-glucopyranosyloxy)-5,7-dihydroxy-7-methyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylate 249 727.2078137635617 4.8357353 221608.77333333332 0.0 15479.052333333331 230531.23 150892.19 283402.9 0.0 0.0 0.0 0.0 23822.027 22615.13 37 249.0 17353-03-6 250 595.1658210518963 4.8390083 32037.43133333333 0.0 0.0 33080.562 20971.232 42060.5 0.0 0.0 0.0 0.0 0.0 0.0 37 251 311.06689689108487 4.8411345 0.0 43649.513 0.0 0.0 0.0 0.0 50021.406 41757.11 39170.023 0.0 0.0 0.0 5 252 304.19119340300324 4.8721747 31159.002 35638.82466666666 0.0 48461.086 0.0 45015.92 29161.96 33106.28 44648.234 0.0 0.0 0.0 -1 253 382.7086273740625 4.8961434 265225.54333333333 0.0 0.0 263347.25 215806.6 316522.78 0.0 0.0 0.0 0.0 0.0 0.0 102 254 300.1599133161492 4.913668 853303.8166666668 0.0 0.0 950204.75 486842.1 1122864.6 0.0 0.0 0.0 0.0 0.0 0.0 40 254.0 Armepavine 255 376.212344250905 4.922169 70172.94166666667 0.0 0.0 90684.69 55381.535 64452.6 0.0 0.0 0.0 0.0 0.0 0.0 -1 256 492.25970132840666 4.9397798 89294.35333333333 0.0 0.0 73649.2 99338.08 94895.78 0.0 0.0 0.0 0.0 0.0 0.0 15 257 506.2753853802108 4.962706 91817.592 0.0 0.0 97909.74 74272.336 103270.7 0.0 0.0 0.0 0.0 0.0 0.0 15 258 757.2190580561668 4.9719872 28884.033333333336 0.0 0.0 26884.63 22816.32 36951.15 0.0 0.0 0.0 0.0 0.0 0.0 37 258.0 TYPHANEOSIDE 259 579.1508194438652 4.9856424 40269.352000000006 0.0 41696.90666666667 37053.004 30674.172 53080.88 0.0 0.0 0.0 32881.227 43024.38 49185.113 69 259.0 Procyanidin B3 40eV 260 346.20174373983315 4.9883127 64371.380000000005 139354.17 0.0 62436.99 61111.05 69566.1 108287.15 156216.02 153559.34 0.0 0.0 0.0 15 260.0 2-(hydroxymethyl)-6-[5-[3-(hydroxymethyl)-5-(3-hydroxypropyl)-7-methoxy-2,3-dihydro-1-benzofuran-2-yl]-2-methoxyphenoxy]oxane-3,4,5-triol 261 404.1558313354848 5.0599833 32289.221666666668 33014.29866666667 0.0 33398.06 24882.55 38587.055 32459.693 42770.207 23812.996 0.0 0.0 0.0 -1 262 684.250546880911 5.061235 0.0 27349.252 0.0 0.0 0.0 0.0 25952.982 29320.36 26774.414 0.0 0.0 0.0 -1 263 621.1796345456164 5.0822635 8152.204333333334 0.0 47546.973666666665 0.0 0.0 24456.613 0.0 0.0 0.0 29836.717 58908.54 53895.664 -1 263.0 Vicenin II 264 599.1977842452034 5.084072 250006.1 27898.898666666664 574126.2666666667 222296.36 230677.1 297044.84 34732.598 0.0 48964.098 353842.0 704732.3 663804.5 54 265 581.1871755787412 5.084224 27367.78933333333 0.0 68782.85933333333 23933.092 24673.076 33497.2 0.0 0.0 0.0 43000.918 84023.52 79324.14 54 266 300.15992053496143 5.0971384 687792.4700000001 33747.456666666665 133067.14666666667 719386.25 483421.06 860570.1 35893.805 32325.105 33023.46 104411.45 202025.38 92764.61 40 266.0 Coclaurine 267 354.8520599563667 5.09822 362472.0633333333 38759.57 0.0 366988.94 187326.69 533100.56 116278.71 0.0 0.0 0.0 0.0 0.0 -1 268 526.1920614614 5.0989 39979.545666666665 12001.198 0.0 33915.004 38896.863 47126.77 0.0 0.0 36003.594 0.0 0.0 0.0 53 269 347.11268126110235 5.100636 16977.024999999998 7040.343666666667 0.0 0.0 22954.275 27976.8 0.0 0.0 21121.031 0.0 0.0 0.0 53 270 286.1442363636948 5.1071033 2455577.3000000003 85818.63 240804.85666666663 2493831.5 1740507.2 3132393.2 89603.58 78769.08 89083.23 171749.48 384273.47 166391.62 40 270.0 Coclaurine 271 511.2552015213909 5.112412 68253.22133333333 0.0 0.0 70242.625 51051.234 83465.805 0.0 0.0 0.0 0.0 0.0 0.0 -1 272 764.4088146982941 5.1294355 486297.3233333333 0.0 0.0 469440.47 414589.06 574862.44 0.0 0.0 0.0 0.0 0.0 0.0 -1 273 382.7086378759285 5.1309333 3469276.1666666665 242966.09666666668 0.0 3323755.5 2862829.0 4221244.0 294518.6 227011.02 207368.67 0.0 0.0 0.0 102 274 316.191059142541 5.160055 107190.408 0.0 0.0 118813.21 72579.03 130178.984 0.0 0.0 0.0 0.0 0.0 0.0 15 275 330.2068806439381 5.185 96941.86 62649.37333333333 0.0 113712.71 72617.22 104495.65 52317.99 80189.28 55440.85 0.0 0.0 0.0 15 276 577.1349946069303 5.202927 31493.554666666663 0.0 43160.37466666666 30555.191 36123.785 27801.688 0.0 0.0 0.0 29232.65 51278.49 48969.984 37 276.0 Spectral Match to Procyanidin A1 from NIST14 277 368.85946525534746 5.2904367 319533.01 61773.25666666666 0.0 487727.62 192412.47 278458.94 185319.77 0.0 0.0 0.0 0.0 0.0 -1 278 251.10701366130675 5.32024 0.0 0.0 41252.375 0.0 0.0 0.0 0.0 0.0 0.0 41388.895 48596.664 33771.566 9 279 268.1335249061256 5.3229346 37416.46 45429.853 221759.02 61860.38 0.0 50389.0 51115.004 36697.188 48477.367 211725.64 266588.22 186963.2 9 279.0 Asimilobine 280 670.2714456214624 5.3685317 0.0 41120.205 7552.75 0.0 0.0 0.0 39712.83 41891.633 41756.152 0.0 0.0 22658.25 -1 280.0 2-[4-[(3S,3aR,6S,6aR)-6-[3-methoxy-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-3-yl]-2-methoxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol 281 415.2107629041238 5.377409 171484.42666666664 0.0 0.0 182036.08 133801.12 198616.08 0.0 0.0 0.0 0.0 0.0 0.0 -1 282 219.101962754612 5.4633327 0.0 75996.91966666667 0.0 0.0 0.0 0.0 81762.266 64721.973 81506.52 0.0 0.0 0.0 34 282.0 (2R,3R,4S,5S,6R)-2-[[7-hydroxy-1-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-6-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol 283 316.19117597061944 5.481192 842866.0133333333 223266.74666666667 0.0 874469.44 616036.4 1038092.2 153772.9 250343.28 265684.06 0.0 0.0 0.0 15 284 346.20149432460204 5.484856 81724.67333333334 0.0 0.0 72191.0 79198.58 93784.44 0.0 0.0 0.0 0.0 0.0 0.0 15 285 330.2068064877038 5.5215564 1928953.566666667 2529718.8666666667 0.0 2069788.1 1606132.4 2110940.2 1898568.6 2986029.5 2704558.5 0.0 0.0 0.0 15 286 360.21734303820904 5.533268 4499755.166666667 1383699.2333333334 0.0 4271774.5 4445410.0 4782081.0 1066081.9 1459145.2 1625870.6 0.0 0.0 0.0 15 287 358.20176432164203 5.538036 271740.0633333333 86026.00666666667 0.0 268036.75 273702.44 273481.0 89311.234 55893.176 112873.61 0.0 0.0 0.0 38 288 359.20571813105727 5.54364 57568.91333333333 0.0 0.0 56849.06 58954.176 56903.504 0.0 0.0 0.0 0.0 0.0 0.0 38 289 303.0745911973428 5.573634 0.0 39694.776000000005 19072.75 0.0 0.0 0.0 25856.182 54185.31 39042.836 0.0 31901.15 25317.1 -1 290 281.092545788418 5.574447 33726.27066666667 313568.98666666663 228224.21333333332 33348.746 42792.996 25037.07 291931.3 351320.72 297454.94 183593.42 273341.06 227738.16 5 290.0 2-oxindole-3-acetic acid CollisionEnergy:205060 291 313.0824253856824 5.5766907 0.0 35480.44533333334 7897.719333333333 0.0 0.0 0.0 55290.316 24379.07 26771.95 0.0 23693.158 0.0 42 292 640.261974890374 5.596907 104445.16466666666 0.0 0.0 124975.87 59378.434 128981.19 0.0 0.0 0.0 0.0 0.0 0.0 -1 293 489.2237100157043 5.667362 88053.928 0.0 10827.626333333334 81729.39 23939.334 158493.06 0.0 0.0 0.0 32482.879 0.0 0.0 2 293.0 Piperlongumine CollisionEnergy:102040 294 490.2802542807117 5.674305 114961.15466666664 0.0 0.0 118000.38 107373.17 119509.914 0.0 0.0 0.0 0.0 0.0 0.0 15 295 449.1712642632897 5.7228928 104621.745 0.0 0.0 115996.85 100918.44 96949.945 0.0 0.0 0.0 0.0 0.0 0.0 -1 296 303.1079930757557 5.7285714 38510.45233333333 0.0 0.0 39759.867 32421.666 43349.824 0.0 0.0 0.0 0.0 0.0 0.0 -1 296.0 NCGC00169586-02!7-methyl-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylic acid 297 427.1802349354505 5.77104 0.0 188961.20333333337 0.0 0.0 0.0 0.0 155089.6 154657.56 257136.45 0.0 0.0 0.0 -1 298 282.1494102927632 5.830323 32594.621000000003 31456.806666666667 75203.628 52403.758 0.0 45380.105 36349.96 28970.2 29050.26 80913.72 83393.25 61303.914 9 299 610.2877965375843 5.8452835 528331.47 71784.52333333333 0.0 525944.44 436130.72 622919.25 100996.24 59222.07 55135.26 0.0 0.0 0.0 -1 300 388.1608718129126 5.856827 0.0 30057.869666666666 0.0 0.0 0.0 0.0 21804.05 42831.895 25537.664 0.0 0.0 0.0 39 300.0 3-oxo-3-[[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(4-hydroxy-5-methyl-2-propan-2-ylphenoxy)oxan-2-yl]methoxy]propanoic acid 301 316.19118095500767 5.876037 65005.418333333335 0.0 0.0 62379.79 27455.225 105181.24 0.0 0.0 0.0 0.0 0.0 0.0 15 302 311.1106845054952 5.898153 0.0 24121.056 0.0 0.0 0.0 0.0 23327.604 26794.844 22240.72 0.0 0.0 0.0 -1 303 289.12866686608606 5.8983483 65784.40666666666 119280.635 0.0 0.0 80789.74 116563.48 107099.805 124001.71 126740.39 0.0 0.0 0.0 -1 303.0 (1R)-(-)-Nopol CollisionEnergy:102040 304 518.1877258648543 5.975929 0.0 17882.679 14017.944 0.0 0.0 0.0 22924.176 0.0 30723.861 42053.832 0.0 0.0 39 304.0 CHEBI:181517 305 388.1606019055652 5.986858 68171.15166666667 33487.45333333333 0.0 59794.84 68718.875 75999.74 0.0 31614.01 68848.35 0.0 0.0 0.0 75 306 382.0353927643044 6.003816 0.0 0.0 32992.87433333333 0.0 0.0 0.0 0.0 0.0 0.0 31450.21 32600.686 34927.727 -1 307 447.2854760832871 6.0134664 151612.69333333333 7303.305333333334 0.0 164083.08 150386.47 140368.53 0.0 0.0 21909.916 0.0 0.0 0.0 -1 308 333.2154767023249 6.013977 45890.98533333334 0.0 0.0 44171.773 39044.273 54456.91 0.0 0.0 0.0 0.0 0.0 0.0 22 309 330.2067561565381 6.018248 23986758.0 693757.53 0.0 23902842.0 20021526.0 28035906.0 504555.28 689156.56 887560.75 0.0 0.0 0.0 15 310 339.0979249098462 6.023494 0.0 61080.54 19477.796666666665 0.0 0.0 0.0 65707.53 79931.625 37602.465 28761.525 29671.865 0.0 5 311 411.1591637599613 6.0588984 20528.74033333333 0.0 37554.00166666667 0.0 31503.012 30083.209 0.0 0.0 0.0 36898.465 37793.46 37970.08 -1 312 345.2251266487121 6.0605426 19980658.666666668 0.0 0.0 20033192.0 18017964.0 21890820.0 0.0 0.0 0.0 0.0 0.0 0.0 -1 312.0 feruloyltyramine 313 347.23100792814967 6.063175 213157.62666666665 52289.286 0.0 218287.75 187721.83 233463.3 39132.55 55752.55 61982.758 0.0 0.0 0.0 22 314 687.4365487233495 6.06378 350235.0633333333 0.0 0.0 351329.0 307065.16 392311.03 0.0 0.0 0.0 0.0 0.0 0.0 15 315 344.22264122458387 6.0640283 87580175.33333333 21098932.33333333 0.0 87415910.0 79349120.0 95975496.0 16171185.0 22535002.0 24590610.0 0.0 0.0 0.0 15 316 285.14879838889414 6.064594 709199.1033333334 132948.62166666667 0.0 702276.56 637060.25 788260.5 104546.305 140956.5 153343.06 0.0 0.0 0.0 15 317 461.3008186661397 6.070127 74018.28833333333 0.0 0.0 79439.43 69001.445 73613.99 0.0 0.0 0.0 0.0 0.0 0.0 15 318 515.2326526637753 6.091084 93906.42533333332 0.0 0.0 79558.81 85855.016 116305.45 0.0 0.0 0.0 0.0 0.0 0.0 55 319 515.7341804690933 6.0957713 55113.58033333334 0.0 0.0 48518.453 51403.6 65418.688 0.0 0.0 0.0 0.0 0.0 0.0 55 320 402.139804049592 6.110324 28464.890666666663 33786.57033333334 0.0 39860.418 45534.254 0.0 0.0 36376.008 64983.703 0.0 0.0 0.0 75 321 211.09689201783013 6.2044034 97485.88833333337 0.0 8327.756 80314.76 104506.625 107636.28 0.0 0.0 0.0 24983.268 0.0 0.0 -1 321.0 (2R,3R)-2-(3,4-dihydroxyphenyl)-3,4-dihydro-2H-chromene-3,5,7-triol 322 264.2323430849934 6.2069926 0.0 13168.747333333333 25383.52733333333 0.0 0.0 0.0 0.0 39506.242 0.0 0.0 32064.59 44085.992 76 323 471.21319376858713 6.220943 21933.612 20652.443333333333 78186.85566666667 26452.871 39347.965 0.0 0.0 61957.33 0.0 143572.39 53396.29 37591.887 2 323.0 Cintriamide 324 346.20146362163865 6.247709 77511.748 0.0 0.0 66166.32 32826.824 133542.1 0.0 0.0 0.0 0.0 0.0 0.0 15 325 427.1733803806929 6.4757037 126796.755 54424.81533333333 311186.1433333333 86768.805 158045.38 135576.08 30954.035 106871.14 25449.271 164640.3 308707.25 460210.88 -1 326 201.0912724063551 6.476371 18367.964 0.0 60535.589 0.0 30249.494 24854.398 0.0 0.0 0.0 37960.14 56662.887 86983.74 52 327 369.17002083654575 6.4767385 160130.84333333335 67876.78033333334 385043.20333333337 113342.65 198767.28 168282.6 52148.15 119146.33 32335.861 242594.95 365952.06 546582.6 24 327.0 """4-[(1R,5R)-6-(3,4-dimethoxyphenyl)-3,7-dioxabicyclo[3.3.0]oct-2-yl]-1,2-dimeth oxybenzene CollisionEnergy:205060""" 328 422.2179967266926 6.477675 64110.46 16005.943333333336 151711.51833333334 41551.01 81754.15 69026.22 0.0 48017.83 0.0 82370.695 147623.75 225140.11 24 328.0 NCGC00380478-01!(3S,3aR,6S,6aR)-3,6-bis(3,4-dimethoxyphenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan 329 387.1808181194136 6.478314 87833.97666666667 30414.051000000003 208275.412 60191.555 110006.055 93304.32 25300.133 65942.02 0.0 121566.336 202294.1 300965.8 24 329.0 """4-[(1R,5R)-6-(3,4-dimethoxyphenyl)-3,7-dioxabicyclo[3.3.0]oct-2-yl]-1,2-dimeth oxybenzene CollisionEnergy:205060""" 330 450.2492350190379 6.4787474 128289.94333333331 62103.12100000001 318911.48666666663 88448.76 163679.67 132741.4 54723.85 100861.54 30723.973 235545.06 297401.5 423787.9 24 330.0 NCGC00380478-01!(3S,3aR,6S,6aR)-3,6-bis(3,4-dimethoxyphenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan 331 236.16789784531645 6.485542 70560.56333333334 0.0 134815.88999999998 211681.69 0.0 0.0 0.0 0.0 0.0 0.0 202693.05 201754.62 95 332 455.2182651444201 6.5106106 301160.41333333333 0.0 9113.376333333334 262335.56 97244.38 543901.3 0.0 0.0 0.0 27340.129 0.0 0.0 2 333 265.1225635783723 6.5215497 52209.99833333333 8402.52 44842.85833333334 82345.805 0.0 74284.19 25207.56 0.0 0.0 51412.152 42690.7 40425.723 8 334 282.1493747172636 6.5236797 215096.75333333333 81018.84733333334 158894.91333333333 294683.34 83759.7 266847.22 85547.766 73979.586 83529.19 174370.39 155450.27 146864.08 8 334.0 Massbank:NA002903 (-)-Nuciferine|Nuciferine|(6aR)-1,2-dimethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline 335 532.2032519476701 6.5772185 0.0 92094.07466666668 0.0 0.0 0.0 0.0 83404.164 119846.15 73031.91 0.0 0.0 0.0 39 335.0 3-oxo-3-[[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(4-hydroxy-5-methyl-2-propan-2-ylphenoxy)oxan-2-yl]methoxy]propanoic acid 336 344.149701221925 6.5808296 0.0 0.0 141062.9 0.0 0.0 0.0 0.0 0.0 0.0 145025.31 139742.36 138421.03 6 336.0 Moupinamide 337 314.13922645796185 6.6070232 179414.29666666666 64491.46333333334 520018.68333333335 158375.92 173413.25 206453.72 65253.0 74074.77 54146.62 459309.9 548656.9 552089.25 6 337.0 NCGC00169550-02!(E)-3-(4-hydroxy-3-methoxyphenyl)-N-[2-(4-hydroxyphenyl)ethyl]prop-2-enamide [IIN-based: Match] 338 801.3460301955008 6.6939545 803469.2533333333 56054.645 0.0 795644.0 689214.56 925549.2 97515.06 70648.875 0.0 0.0 0.0 0.0 -1 339 344.14972735192464 6.7741504 0.0 0.0 231572.78666666665 0.0 0.0 0.0 0.0 0.0 0.0 313168.75 176053.67 205495.94 6 339.0 NCGC00169550-02!(E)-3-(4-hydroxy-3-methoxyphenyl)-N-[2-(4-hydroxyphenyl)ethyl]prop-2-enamide [IIN-based: Match] 340 362.1789608900884 6.7940574 80465.428 0.0 0.0 77210.55 63202.754 100982.98 0.0 0.0 0.0 0.0 0.0 0.0 57 341 723.3505622921211 6.7940574 242919.5433333333 0.0 0.0 233125.08 196033.45 299600.1 0.0 0.0 0.0 0.0 0.0 0.0 57 342 419.2009699527905 6.851286 101155.49333333332 10019.057333333332 0.0 97303.23 83807.0 122356.25 30057.172 0.0 0.0 0.0 0.0 0.0 57 343 837.393655221279 6.852867 196442.42 39246.684 0.0 191611.84 169328.86 228386.56 48594.31 35145.918 33999.824 0.0 0.0 0.0 57 344 501.25997106842766 6.8744926 202608.3953333333 0.0 0.0 138504.9 38907.316 430412.97 0.0 0.0 0.0 0.0 0.0 0.0 2 344.0 Piperlongumine CollisionEnergy:102040 345 287.12589630141974 6.9010215 34597.867333333335 6630.258999999999 0.0 32877.535 32598.857 38317.21 0.0 19890.777 0.0 0.0 0.0 0.0 -1 346 247.1331320741328 6.9027677 217863.11666666667 135828.7666666667 35977.34566666667 202248.45 215828.0 235512.9 135621.7 133314.48 138550.12 21990.764 40516.066 45425.207 30 346.0 ABSCISIC ACID CollisionEnergy:205060 347 229.12267112853988 6.9031067 66534.77666666667 42015.677 0.0 62638.777 65023.363 71942.19 42884.242 40786.227 42376.562 0.0 0.0 0.0 30 347.0 abscisic acid CollisionEnergy:205060 348 353.13883108863934 7.0370216 27836.70233333333 0.0 63696.097 20387.494 32709.17 30413.443 0.0 0.0 0.0 33798.996 68189.92 89099.375 24 349 718.3243272730565 7.072655 547008.0733333334 52239.67466666666 0.0 563590.44 434360.38 643073.4 73915.23 41964.754 40839.04 0.0 0.0 0.0 -1 350 685.2767977007769 7.2103176 0.0 0.0 47201.326 0.0 0.0 0.0 0.0 0.0 0.0 51803.402 45201.746 44598.83 -1 350.0 C38H40N2O10 351 221.0812393247692 7.286678 107636.05366666667 27970.773666666664 127714.18133333333 92748.625 120790.336 109369.2 26537.266 25728.303 31646.752 126910.164 126287.07 129945.31 34 351.0 Piplartine 352 334.1291000495191 7.287695 137754.34 29326.866 153599.95 117889.44 150964.72 144408.86 28745.035 25746.887 33488.676 142621.69 159073.06 159105.1 2 352.0 Piplartine 353 356.1108160404916 7.2903867 16746.003 0.0 19108.991 0.0 24492.13 25745.879 0.0 0.0 0.0 0.0 27894.059 29432.914 -1 354 245.0136429223517 7.3093224 29091.667 7752.98 0.0 29540.484 28877.39 28857.127 23258.94 0.0 0.0 0.0 0.0 0.0 -1 355 219.1019641876466 7.313202 0.0 12456.28 90119.04333333332 0.0 0.0 0.0 0.0 37368.84 0.0 73645.07 80814.54 115897.52 34 355.0 (2R,3R,4S,5S,6R)-2-[[7-hydroxy-1-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-6-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol 356 467.1818754511202 7.319887 106737.31866666667 0.0 0.0 149732.14 76758.23 93721.586 0.0 0.0 0.0 0.0 0.0 0.0 2 356.0 """(2E)-N-{[(4-methoxyphenyl)amino]thioxomethyl}-3-(3,4,5-trimethoxyphenyl)prop-2 -enamide CollisionEnergy:102040""" 357 326.10045286358786 7.377026 233851.38 46686.52766666666 275463.8233333333 154276.56 297778.75 249498.83 61498.395 40995.055 37566.133 479488.66 146021.2 200881.61 -1 358 303.110846807614 7.3773365 43380.63033333333 0.0 50687.47066666666 32531.602 55190.555 42419.734 0.0 0.0 0.0 89113.59 27001.832 35946.99 6 358.0 SINAPIC ACID CollisionEnergy:102040 359 207.0655283015425 7.3785257 454365.8233333334 127259.84466666666 577057.1666666667 317765.53 571402.06 473929.88 192176.86 93599.51 96003.164 1046772.56 291479.84 392919.1 48 359.0 SINAPIC ACID CollisionEnergy:205060 360 304.11841817955604 7.3785257 609340.1133333334 164179.56833333333 739251.16 429531.34 761185.06 637303.94 241710.11 123599.125 127229.47 1308746.4 387479.2 521527.88 6 360.0 Sibiricose A6 361 325.14411544960706 7.422496 16813.183 0.0 50604.70133333333 22982.535 0.0 27457.014 0.0 0.0 0.0 24024.336 58959.438 68830.33 24 362 355.1544534675723 7.423309 36063.097 0.0 74263.74633333333 35292.766 29784.662 43111.863 0.0 0.0 0.0 34803.88 86404.445 101582.914 24 363 271.06044799645207 7.5552573 40349.834 0.0 0.0 26194.78 47359.16 47495.562 0.0 0.0 0.0 0.0 0.0 0.0 8 363.0 Luteolin - 40.0 eV 364 292.15495483335656 7.570791 22723.037333333337 20304.494666666666 105683.62466666668 0.0 38044.55 30124.562 60913.484 0.0 0.0 107111.38 89674.26 120265.234 6 364.0 Sibiricose A6 365 262.1440695517936 7.642426 20631.782666666662 15012.527333333332 20565.54566666667 0.0 31575.332 30320.016 45037.582 0.0 0.0 61696.637 0.0 0.0 6 365.0 NCGC00170014-03!(E)-N-(4-acetamidobutyl)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enamide [IIN-based: Match] 366 341.1388673757442 7.661775 0.0 8459.698666666667 85480.01833333333 0.0 0.0 0.0 0.0 25379.096 0.0 85283.09 71631.195 99525.77 24 366.0 NCGC00347864-02!5-[6-(3-hydroxy-4-methoxyphenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-3-yl]-2-methoxyphenol 367 326.1005559763556 7.6948256 76018.27399999999 0.0 50935.923 58285.277 75402.74 94366.805 0.0 0.0 0.0 28514.664 57597.215 66695.89 -1 368 207.0655942701616 7.6960115 133776.30466666666 17105.244666666666 87391.60166666668 107691.164 141488.02 152149.73 24917.857 0.0 26397.877 94373.195 78738.59 89063.02 48 369 304.1186075320819 7.6988735 231251.90666666665 38197.600333333336 127925.735 193051.03 238931.42 261773.27 33252.086 33087.973 48252.742 103735.625 134220.7 145820.88 6 369.0 Sibiricose A6 370 817.3925221340456 7.826965 70042.58833333333 0.0 0.0 52960.375 83127.33 74040.06 0.0 0.0 0.0 0.0 0.0 0.0 -1 371 288.1235884792308 7.8289347 690699.1933333332 111341.51666666668 74414.83166666667 625720.44 680535.2 765841.94 99086.44 85467.72 149470.39 79141.875 72987.23 71115.39 6 371.0 """3,4-DIMETHOXYCINNAMIC ACID CollisionEnergy:102040""" 372 333.181410023651 7.829359 62713.27133333334 0.0 0.0 60030.37 59691.934 68417.51 0.0 0.0 0.0 0.0 0.0 0.0 6 372.0 """(2E)-N-(3-acetylphenyl)-3-(3,4-dimethoxyphenyl)prop-2-enamide CollisionEnergy:102040""" 373 310.1055817229584 7.830084 547246.0066666667 67793.838 42934.06666666667 487637.88 533342.2 620757.94 42981.434 60624.69 99775.39 35647.61 47180.035 45974.555 45 374 597.2217187350716 7.8326554 31433.039666666667 0.0 0.0 25654.318 29826.254 38818.547 0.0 0.0 0.0 0.0 0.0 0.0 -1 375 403.1759343103354 7.8854184 71947.42466666667 13520.49 112899.47000000002 74920.83 57735.734 83185.71 0.0 40561.47 0.0 43100.605 106505.805 189092.0 86 375.0 6-[3-(3,4-dimethoxyphenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-6-yl]-4-methoxy-1,3-benzodioxole 376 448.233651570828 7.8858156 14583.843666666668 0.0 31655.139333333336 22201.873 0.0 21549.658 0.0 0.0 0.0 0.0 35188.504 59776.914 86 377 219.101969574596 7.9255056 21694.698666666667 41827.18033333333 82761.94466666666 0.0 30255.541 34828.555 28864.174 54366.09 42251.277 64359.168 76768.65 107158.016 34 377.0 (2R,3R,4S,5S,6R)-2-[[7-hydroxy-1-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-6-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol 378 363.1917432963157 8.013131 628068.8166666668 366744.4266666667 215945.10333333336 599254.6 634918.25 650033.6 350950.28 290717.3 458565.7 257655.56 205445.67 184734.08 2 378.0 Piperlongumine CollisionEnergy:102040 379 356.0897865385695 8.016802 265470.82666666666 93922.13933333334 40249.82666666667 236200.22 274228.7 285983.56 51202.133 82560.305 148003.98 35378.312 44961.004 40410.164 -1 380 206.05772791886875 8.017512 35798.587 0.0 0.0 30140.031 35114.17 42141.56 0.0 0.0 0.0 0.0 0.0 0.0 34 381 321.14200740221673 8.017512 29264.81466666666 0.0 0.0 23697.787 30628.602 33468.055 0.0 0.0 0.0 0.0 0.0 0.0 81 382 426.0666931671613 8.017512 26890.948666666667 0.0 0.0 21179.447 28681.309 30812.09 0.0 0.0 0.0 0.0 0.0 0.0 2 382.0 """(2E)-1-(1,3-dimethylpyrazol-4-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one CollisionEnergy:102040""" 383 435.06148946339664 8.017512 76305.11333333333 0.0 0.0 68050.17 75337.89 85527.28 0.0 0.0 0.0 0.0 0.0 0.0 20 383.0 Massbank:PR310505 Piperlongumine 384 657.2424366092469 8.017851 804883.6 196144.298 59383.791000000005 685526.75 815109.25 914014.8 75437.234 159658.0 353337.66 43693.613 70475.96 63981.8 4 385 317.1267240745583 8.018091 130891.28666666668 30051.099666666665 0.0 113830.74 131632.5 147210.62 0.0 28278.014 61875.285 0.0 0.0 0.0 20 385.0 Piplartine 386 221.0811148795292 8.018802 9368202.666666666 2099740.933333333 813360.5833333334 8045773.0 9231600.0 10827235.0 1185974.8 1579623.5 3533624.5 820527.25 844201.7 775352.8 34 386.0 Piplartine 387 318.1341965008574 8.018802 13614866.333333334 3281078.633333333 1324452.9666666666 11712899.0 13696620.0 15435080.0 1916528.6 2483266.8 5443440.5 1335800.5 1380016.0 1257542.4 2 387.0 Piplartine 388 223.0862924081081 8.019294 77139.74433333334 9384.901 0.0 64133.633 77129.61 90155.99 0.0 0.0 28154.703 0.0 0.0 0.0 34 389 340.1158595911903 8.0200405 5718073.333333333 1620444.5333333332 643613.5366666667 5114477.0 5720229.0 6319514.0 773922.6 1349907.2 2737503.8 536587.56 727100.75 667152.3 45 390 208.04385347595303 8.020466 28471.889333333336 0.0 0.0 23749.58 29892.24 31773.848 0.0 0.0 0.0 0.0 0.0 0.0 -1 391 346.09367265934225 8.02106 32180.86 0.0 0.0 23720.201 33933.414 38888.965 0.0 0.0 0.0 0.0 0.0 0.0 -1 392 418.0587747008725 8.02106 34970.09133333334 0.0 0.0 28347.031 33411.227 43152.016 0.0 0.0 0.0 0.0 0.0 0.0 2 392.0 Cinoctramide 393 463.0563003601526 8.02106 52597.954 0.0 0.0 47013.9 52257.992 58521.97 0.0 0.0 0.0 0.0 0.0 0.0 20 394 342.1339865195691 8.065052 7891.564333333333 0.0 226422.08 23674.693 0.0 0.0 0.0 0.0 0.0 221742.36 229235.1 228288.78 6 394.0 ILEPCIMIDE 395 246.22179558564224 8.066639 0.0 16731.813333333335 35870.355 0.0 0.0 0.0 0.0 50195.44 0.0 0.0 45008.125 62602.94 76 396 290.13920933651366 8.190822 676092.1533333333 357299.93999999994 1279404.8333333333 493571.4 854476.06 680229.0 720198.94 177442.5 174258.38 1108471.9 1252084.0 1477658.6 6 396.0 Sibiricose A6 397 207.0655776116218 8.191509 8546.655666666667 7419.114666666667 40675.852666666666 0.0 25639.967 0.0 22257.344 0.0 0.0 37701.16 38504.258 45822.14 48 398 365.20730424194215 8.256004 33238.73166666667 0.0 0.0 28057.412 32349.459 39309.324 0.0 0.0 0.0 0.0 0.0 0.0 2 398.0 Piperlongumine CollisionEnergy:102040 399 221.08112934497075 8.256236 120672.558 17066.911333333333 0.0 99283.984 115252.92 147480.77 0.0 0.0 51200.734 0.0 0.0 0.0 34 399.0 Piplartine 400 320.1498504911968 8.2574005 177776.37 39532.632333333335 39675.526666666665 146702.7 173822.3 212804.11 25771.738 25904.559 66921.6 39517.676 39775.08 39733.824 2 400.0 Piplartine 401 342.131506201424 8.25752 73384.66666666667 0.0 0.0 59992.88 69193.69 90967.43 0.0 0.0 0.0 0.0 0.0 0.0 45 402 625.2557402954975 8.286335 0.0 0.0 49469.09666666667 0.0 0.0 0.0 0.0 0.0 0.0 47592.22 48937.87 51877.2 -1 403 266.0813666001559 8.394593 0.0 0.0 1639421.2933333332 0.0 0.0 0.0 0.0 0.0 0.0 2090844.4 2407958.2 419461.28 8 403.0 Spectral Match to trans-Ferulic acid from NIST14 404 621.2449436965347 8.468948 49654.795666666665 0.0 0.0 29215.412 53572.145 66176.83 0.0 0.0 0.0 0.0 0.0 0.0 28 405 597.2215666359626 8.501861 58656.43266666667 0.0 42315.158 53197.484 60369.81 62402.004 0.0 0.0 0.0 35038.566 46875.31 45031.598 -1 406 288.12351254292264 8.502773 2228214.8000000003 411116.53333333327 1452937.6 1995230.2 2260195.0 2429219.2 455633.72 337263.16 440452.72 1394050.4 1458297.8 1506464.6 6 406.0 NCGC00384692-01 407 310.1054513700978 8.502833 1505366.933333333 306836.0966666667 1100452.6333333333 1390511.2 1514129.1 1611460.5 301002.62 272343.47 347162.2 978093.0 1152374.4 1170890.5 45 408 304.1184971407353 8.53613 71012.77500000001 0.0 0.0 48711.715 73342.73 90983.88 0.0 0.0 0.0 0.0 0.0 0.0 6 408.0 Sibiricose A6 409 207.0655191167584 8.538623 41333.98333333334 0.0 0.0 27173.305 42970.637 53858.008 0.0 0.0 0.0 0.0 0.0 0.0 48 410 339.15953159703804 8.543376 0.0 0.0 93035.16133333334 0.0 0.0 0.0 0.0 0.0 0.0 55828.934 102134.93 121141.62 24 411 276.15987930298985 8.576085 27368.869999999995 0.0 15883.429666666669 26848.44 22267.873 32990.297 0.0 0.0 0.0 0.0 23298.514 24351.775 6 411.0 (2E)-3-(4-chlorophenyl)-1-piperidylprop-2-en-1-one CollisionEnergy:102040 412 233.1175631056988 8.615888 0.0 39420.39766666666 534655.14 0.0 0.0 0.0 34913.543 83347.65 0.0 245448.62 536764.2 821752.6 34 413 434.2545737522731 8.616601 0.0 0.0 50469.53399999999 0.0 0.0 0.0 0.0 0.0 0.0 32013.797 50380.465 69014.34 -1 414 355.15439495896834 8.727345 56229.67633333334 18474.121 282670.8066666667 43658.074 62997.67 62033.285 0.0 55422.363 0.0 196001.66 244684.73 407326.03 24 414.0 2-[4-[(3R,3aR,6S,6aR)-3-(3,4-dimethoxyphenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-6-yl]-2-methoxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol 415 312.12115509514143 8.741996 80968.67833333333 0.0 103840.59666666668 70256.33 82628.58 90021.125 0.0 0.0 0.0 65212.66 116505.44 129803.69 -1 416 290.139156229952 8.74509 91017.02133333334 0.0 87330.19666666667 79242.08 91650.57 102158.414 0.0 0.0 0.0 70391.28 92300.26 99299.05 6 416.0 """3,4-DIMETHOXYCINNAMIC ACID CollisionEnergy:102040""" 417 208.04390444330755 8.799013 44283.75866666667 40588.511666666665 48946.15 65208.49 32010.098 35632.688 60646.867 0.0 61118.668 70774.87 0.0 76063.58 -1 418 436.0645184131695 8.802817 34414.57666666667 0.0 15763.25 53537.74 49705.99 0.0 0.0 0.0 0.0 0.0 0.0 47289.75 20 419 207.04369894440305 8.804556 46397.92999999999 52396.16533333333 21590.816666666666 43090.78 48067.21 48035.8 41756.016 66794.95 48637.53 14833.96 49938.49 0.0 -1 420 422.0548579731378 8.8073225 12644.11 0.0 17956.758666666665 37932.33 0.0 0.0 0.0 0.0 0.0 39086.1 14784.176 0.0 -1 421 760.333947617339 8.807671 26751.658 0.0 0.0 26397.896 26285.863 27571.215 0.0 0.0 0.0 0.0 0.0 0.0 -1 422 464.059568203285 8.809328 36536.49733333333 10785.381666666666 31964.673333333336 54035.176 0.0 55574.316 0.0 0.0 32356.145 51725.332 0.0 44168.688 20 423 426.0669382306239 8.811093 0.0 37684.74733333333 5410.912 0.0 0.0 0.0 46429.746 31285.762 35338.734 16232.736 0.0 0.0 2 424 345.09352883054135 8.812932 103827.27166666668 105993.94133333332 132579.13 96015.83 105440.18 110025.805 86858.93 125389.414 105733.48 106530.87 146190.94 145015.58 2 424.0 Piplartine 425 463.0563664046747 8.814259 257885.20333333337 126421.83 237472.92666666667 258865.23 247191.1 267599.28 137345.48 104726.18 137193.83 233269.3 231780.88 247368.6 20 426 435.0615494014393 8.81483 266827.99666666664 122149.98533333332 250643.55666666667 270095.03 259860.08 270528.88 131850.42 100671.586 133927.95 255792.23 248115.66 248022.78 20 426.0 Massbank:PR310505 Piperlongumine 427 346.09377067077844 8.815862 198791.71333333332 137110.13499999998 199946.76666666663 182938.28 195632.25 217804.61 141683.94 131019.695 138626.77 206455.53 198047.33 195337.44 2 427.0 Piplartine 428 459.06170113821855 8.81878 45898.087666666666 0.0 29070.685 47271.156 44093.22 46329.887 0.0 0.0 0.0 41815.688 45396.367 0.0 2 429 420.05938854566807 8.820171 106974.828 83953.87666666666 113046.305 105158.91 105678.66 110086.914 77934.3 85682.04 88245.29 101923.125 120823.76 116392.03 12 430 503.1587473516838 8.82154 57646.405 0.0 61668.12899999999 53781.11 60155.395 59002.71 0.0 0.0 0.0 52903.645 68154.09 63946.652 56 430.0 Piplartine 431 343.1245310956779 8.821567 44635.62066666666 0.0 53320.301666666666 40138.035 50710.46 43058.367 0.0 0.0 0.0 49295.355 53433.54 57232.01 -1 432 654.7352318670688 8.822164 48301.039 0.0 59712.170000000006 47602.883 47800.094 49500.14 0.0 0.0 0.0 56266.508 62118.44 60751.562 79 433 418.058863738456 8.82273 196931.77 111265.38333333336 198227.48 189816.69 180126.22 220852.4 102784.49 118173.05 112838.61 184972.92 201406.6 208302.92 2 433.0 (E)-3,4,5-Trimethoxycinnamic acid - 40.0 eV 434 317.1268555974364 8.8228 709799.6 298184.8566666667 747345.9333333332 679741.4 680478.4 769179.0 326360.7 258864.17 309329.7 771600.94 717091.8 753345.06 20 434.0 Piperlongumine CollisionEnergy:102040 435 737.1861141747734 8.823173 93243.14 35040.28366666666 94223.9 100391.86 92762.11 86575.45 34903.984 33117.312 37099.555 92597.1 89882.11 100192.49 12 436 300.1233677566183 8.823977 135589.72333333333 52961.80433333333 161768.71333333335 115693.17 138083.61 152992.39 53836.19 50648.75 54400.473 158007.62 169278.97 158019.55 -1 437 206.05770692158464 8.825176 271685.7 99059.27033333332 326633.2066666667 246474.88 265090.34 303491.88 105031.24 90311.055 101835.516 309112.53 336924.03 333863.06 34 437.0 9-methoxy-7H-furo[3,2-g]chromen-7-one 438 690.1871661867217 8.82515 53572.27 28568.985666666664 71485.381 45390.81 54876.027 60449.973 33351.01 23031.58 29324.367 88217.15 65989.61 60249.383 56 439 735.1849413671762 8.825169 206500.4233333333 57979.95066666667 222233.67666666667 199884.69 194573.72 225042.86 57209.49 58732.03 57998.332 214362.84 222920.5 229417.69 2 440 752.1874493537439 8.825395 56185.174666666666 0.0 50993.87033333333 54141.52 53307.188 61106.816 0.0 0.0 0.0 46972.734 50568.4 55440.477 20 441 357.0931511454285 8.825626 26146.744666666666 22133.493333333336 32147.66 0.0 0.0 78440.234 31314.574 0.0 35085.906 0.0 96442.98 0.0 -1 442 743.1927913026713 8.825899 31271.600333333336 9543.895333333334 57505.493333333325 45247.156 48567.645 0.0 28631.686 0.0 0.0 66567.06 49736.72 56212.7 2 443 340.1157706572716 8.826207 21193177.33333333 8559107.666666666 24802043.33333333 20239336.0 21203882.0 22136314.0 8422756.0 8399657.0 8854910.0 22257942.0 25650084.0 26498104.0 45 444 353.11569849918413 8.82622 112918.71666666667 37724.83466666667 113913.00966666666 98517.23 109809.96 130428.96 42861.44 30344.912 39968.152 115815.414 116771.625 109151.99 -1 444.0 """(2E)-N-{[(4-methoxyphenyl)amino]thioxomethyl}-3-(3,4,5-trimethoxyphenyl)prop-2 -enamide CollisionEnergy:205060""" 445 221.08102917364943 8.826338 68276721.33333333 26083238.0 79657546.66666667 60935150.0 68564744.0 75330270.0 26905496.0 23870888.0 27473330.0 77360690.0 82281780.0 79330170.0 34 445.0 Piplartine 446 495.6706524555688 8.826348 191110.8033333333 53321.03533333334 211441.66 173296.52 204402.2 195633.69 65595.74 43633.656 50733.71 207708.45 208573.45 218043.08 79 447 657.2421417161747 8.826509 5442819.833333333 1710791.5 5866145.666666667 5479867.0 5555102.5 5293490.0 1700030.4 1654050.1 1778294.0 5181899.5 5975437.5 6441100.0 4 448 504.6571637969972 8.826677 954487.1333333332 275432.4066666667 1082314.8666666667 861235.0 933776.4 1068450.0 318657.56 240902.0 266737.66 1011306.0 1140586.4 1095052.2 -1 448.0 Piplartine 449 654.2336185088535 8.826863 72644.63666666666 0.0 89503.65866666667 74040.41 73726.95 70166.55 0.0 0.0 0.0 84923.32 78960.016 104627.64 79 450 356.0897143339367 8.827389 467941.4266666667 198893.78666666665 549015.2466666667 456339.5 470675.9 476808.88 197039.73 195060.83 204580.8 515420.34 565085.4 566540.0 6 451 223.08627887346367 8.827519 598248.4866666667 224300.02 686081.1166666666 528394.56 604438.9 661912.0 231970.44 203557.2 237372.42 662694.9 710768.2 684780.25 34 452 318.13423531261384 8.827519 94890743.33333331 35549855.333333336 104197993.33333331 84792664.0 96475496.0 103404070.0 35200060.0 33031146.0 38418360.0 96387730.0 109298060.0 106908190.0 2 452.0 Piplartine 453 507.66002783771046 8.828113 73951.31166666666 13913.116 124521.08 0.0 106812.375 115041.56 41739.348 0.0 0.0 150030.92 110065.4 113466.92 2 453.0 Piplartine 454 321.1420649635657 8.82856 203435.53333333333 76420.05333333333 235517.4933333333 188675.9 204220.31 217410.39 78047.52 69603.79 81608.85 218287.52 256367.08 231897.88 81 455 487.6816897304239 8.828577 146647.63666666666 39286.95766666667 173522.30666666667 134840.75 143586.61 161515.55 47483.64 34459.113 35918.12 180216.14 160403.94 179946.84 -1 455.0 Piplartine 456 208.0438110465276 8.854464 23013.13666666667 19092.516666666663 14104.2 0.0 33361.68 35677.73 0.0 57277.55 0.0 0.0 42312.6 0.0 -1 457 233.1175192551408 8.886441 258559.31 368437.7233333333 831481.4166666666 254901.27 204026.56 316750.1 270949.97 537425.9 296937.3 510708.25 761559.6 1222176.4 34 458 306.170521217605 8.896023 101219.38333333336 30970.36666666667 436466.3666666667 85949.77 102684.0 115024.38 32986.6 31321.555 28602.945 358439.38 421629.62 529330.1 2 458.0 Piperlongumine CollisionEnergy:102040 459 217.0863020997406 8.953637 104121.89666666668 145677.5116666667 575282.4966666667 98698.52 85917.16 127750.01 102245.38 223710.6 111076.555 345482.4 513839.84 866525.25 34 459.0 dl-3-Indolelactic acid - 40.0 eV 460 342.2431036504564 8.992785 125257.09666666668 0.0 0.0 155134.2 71182.69 149454.4 0.0 0.0 0.0 0.0 0.0 0.0 65 461 296.0923364422093 9.023921 0.0 0.0 102731.413 0.0 0.0 0.0 0.0 0.0 0.0 79599.945 192036.2 36558.094 8 461.0 KU036-6-1 462 221.081153610012 9.067631 2816469.833333333 558860.4999999999 2517725.333333333 2394441.8 2809667.2 3245300.5 611261.7 421775.2 643544.6 2180122.2 2701326.0 2671727.8 34 462.0 Piplartine 463 320.149694303868 9.067631 2456192.2 465477.7533333333 2528604.6 2081493.1 2561123.5 2725960.0 480719.6 417368.1 498345.56 2095246.5 2738438.5 2752128.8 2 463.0 Piplartine 464 661.2737691313989 9.0685005 151654.25666666668 6478.362 161469.30166666667 130019.88 170332.36 154610.53 0.0 0.0 19435.086 112853.305 182401.48 189153.12 45 465 342.13157933917114 9.068829 892001.52 138489.40866666668 912770.9133333334 782628.06 943665.25 949711.25 119489.016 136645.27 159333.94 680304.0 1058955.8 999052.94 45 466 358.1053416601877 9.072126 25456.24333333333 0.0 20370.22133333333 22780.61 28091.17 25496.95 0.0 0.0 0.0 0.0 31373.469 29737.195 -1 467 467.1817057823471 9.081356 509718.96 0.0 9247.338 396194.06 78115.92 1054846.9 0.0 0.0 0.0 27742.014 0.0 0.0 2 467.0 Piperlongumine CollisionEnergy:102040 468 342.2430739979552 9.19176 82664.93333333333 0.0 0.0 106073.39 42650.38 99271.03 0.0 0.0 0.0 0.0 0.0 0.0 65 468.0 Methyl 3,4,5-trimethoxycinnamate 469 407.2587313083963 9.19176 40258.633 0.0 0.0 41306.938 34195.766 45273.195 0.0 0.0 0.0 0.0 0.0 0.0 3 469.0 CHEBI:181879 470 340.11606208292136 9.195305 0.0 0.0 115744.138 0.0 0.0 0.0 0.0 0.0 0.0 67476.234 129283.38 150472.8 24 471 358.14125349721235 9.198337 0.0 0.0 78447.17866666666 0.0 0.0 0.0 0.0 0.0 0.0 59138.496 85307.73 90895.31 24 472 205.0862157230821 9.201909 0.0 0.0 133119.37666666668 0.0 0.0 0.0 0.0 0.0 0.0 76045.69 148648.19 174664.25 34 473 219.10190381054807 9.201909 0.0 0.0 61854.956000000006 0.0 0.0 0.0 0.0 0.0 0.0 33004.312 69869.29 82691.266 34 473.0 """MLS002473104-01!(2R)-6-(2-hydroxyethyl)-2,5,7-trimethyl-2,3-dihydroinden-1-one""" 474 458.0663207664932 9.201909 0.0 0.0 88419.20133333333 0.0 0.0 0.0 0.0 0.0 0.0 71368.38 93938.664 99950.56 -1 475 770.2023834231883 9.201909 0.0 0.0 75351.481 0.0 0.0 0.0 0.0 0.0 0.0 42342.438 81674.805 102037.2 25 476 293.117700355999 9.203256 0.0 56511.095 652382.6266666666 0.0 0.0 0.0 46220.902 100055.125 23257.258 388094.44 721592.0 847461.44 24 477 341.1386795077722 9.203256 0.0 203100.1433333333 2286931.9 0.0 0.0 0.0 159422.05 361114.3 88764.08 1282363.5 2541196.0 3037236.2 24 477.0 Knemolic acid B 478 201.0912265032627 9.203428 0.0 16247.781333333332 321726.33666666667 0.0 0.0 0.0 0.0 48743.344 0.0 187272.27 352946.4 424960.34 34 479 717.2908536754878 9.203428 0.0 15326.312666666669 597518.9333333333 0.0 0.0 0.0 0.0 45978.938 0.0 247266.9 608566.5 936723.4 24 480 323.1284041756339 9.204757 70100.76666666666 925677.5066666668 10080570.0 56575.02 67896.59 85830.69 756216.5 1610783.9 410032.12 5876521.0 11172225.0 13192964.0 24 480.0 4,4'-Dimethoxychalcone 481 381.1313929712662 9.205475 0.0 0.0 118039.2 0.0 0.0 0.0 0.0 0.0 0.0 53923.48 127103.72 173090.4 -1 482 739.2727640876674 9.205475 0.0 0.0 71033.36133333333 0.0 0.0 0.0 0.0 0.0 0.0 29716.809 76312.625 107070.65 -1 483 453.08737594543663 9.208859 0.0 0.0 49603.818 0.0 0.0 0.0 0.0 0.0 0.0 41578.49 51552.754 55680.21 25 484 233.11745990566865 9.214008 0.0 9650.465 82829.009 0.0 0.0 0.0 0.0 28951.395 0.0 36146.207 94042.37 118298.45 34 485 274.144153192529 9.237416 95368.54133333334 0.0 33856.64233333333 98908.484 71310.4 115886.74 0.0 0.0 0.0 24866.23 35315.9 41387.797 6 485.0 """4-(methylethyl)phenyl (2E)-3-(2,4-dimethoxyphenyl)prop-2-enoate CollisionEnergy:102040""" 486 337.1440031086598 9.237583 0.0 24101.51833333333 210479.41666666663 0.0 0.0 0.0 0.0 72304.555 0.0 110805.66 195695.25 324937.34 24 487 538.2076381538243 9.334858 871643.5833333334 145855.892 37217.99333333334 692433.9 849416.75 1073080.1 51917.496 82953.15 302697.03 31743.922 44608.562 35301.496 28 488 680.3182780532438 9.3349695 824088.6699999999 226499.30333333332 85508.45666666667 686529.2 811898.75 973838.06 153243.8 132153.67 394100.44 101039.41 84394.02 71091.94 28 489 652.2871346638664 9.335364 1459167.066666667 230852.448 58172.525 1162177.9 1414011.5 1801311.8 70691.664 134351.06 487514.62 43083.92 72855.875 58577.78 28 490 635.2605772288753 9.335857 1854549.9666666668 299231.5733333333 75251.13666666667 1476633.0 1799511.4 2287505.5 99241.51 171530.11 626923.1 59722.26 93331.52 72699.63 28 491 441.1547932129461 9.336234 54451.90333333333 0.0 0.0 41974.89 53685.17 67695.65 0.0 0.0 0.0 0.0 0.0 0.0 -1 492 657.2423026230003 9.336568 733342.4 108807.25133333332 23901.15566666667 612031.7 722697.9 865297.6 28466.314 58854.39 239101.05 0.0 39053.395 32650.072 4 493 673.2160981764533 9.336809 127231.07 15864.371 0.0 108952.28 127228.37 145512.56 0.0 0.0 47593.113 0.0 0.0 0.0 -1 494 275.1028417163897 9.338037 38651.87733333334 0.0 0.0 30609.992 36733.26 48612.38 0.0 0.0 0.0 0.0 0.0 0.0 28 495 605.2498469682633 9.368891 143150.14133333333 7849.884666666666 0.0 126639.164 115653.64 187157.62 0.0 0.0 23549.654 0.0 0.0 0.0 28 496 508.1968240577245 9.37008 95411.85 0.0 0.0 82360.66 79397.52 124477.37 0.0 0.0 0.0 0.0 0.0 0.0 28 497 627.2317573940254 9.37008 71478.48366666667 0.0 0.0 61967.996 58466.445 94001.01 0.0 0.0 0.0 0.0 0.0 0.0 4 498 650.307595082832 9.373687 52167.94033333333 0.0 0.0 47755.387 45601.516 63146.918 0.0 0.0 0.0 0.0 0.0 0.0 28 499 280.094775017011 9.380947 182254.77333333332 0.0 0.0 157859.39 203413.03 185491.9 0.0 0.0 0.0 0.0 0.0 0.0 -1 500 675.2669649251446 9.509168 100762.172 0.0 0.0 116682.83 116395.67 69208.016 0.0 0.0 0.0 0.0 0.0 0.0 -1 501 288.12347228264093 9.538964 83351.51666666666 0.0 0.0 73433.12 66084.74 110536.69 0.0 0.0 0.0 0.0 0.0 0.0 6 501.0 """3,4-DIMETHOXYCINNAMIC ACID CollisionEnergy:102040""" 502 627.2320249368814 9.538964 38775.047666666665 0.0 0.0 32698.014 31419.629 52207.5 0.0 0.0 0.0 0.0 0.0 0.0 4 503 304.1548467775423 9.562534 351893.30666666664 71706.81266666666 465299.11 313862.5 341542.2 400275.22 85107.97 63156.234 66856.234 299617.47 507749.06 588530.8 2 503.0 Piplartine 504 217.08623452760352 9.569477 261618.6133333333 562177.4866666667 727632.4633333333 262199.62 215506.25 307149.97 431683.06 696643.2 558206.2 368579.75 705670.44 1108647.2 34 504.0 dl-3-Indolelactic acid - 40.0 eV 505 680.3184366078608 9.581763 445358.34 152734.16 34099.92566666667 364064.94 423682.28 548327.8 98675.05 98198.83 261328.6 36160.707 36951.242 29187.828 2 505.0 PIPERLONGUMINE 506 637.2726887260508 9.581922 42658.34333333333 0.0 0.0 31633.934 42339.92 54001.176 0.0 0.0 0.0 0.0 0.0 0.0 -1 507 657.2424883716509 9.582235 700200.6866666666 136214.0006666667 26327.589666666667 578670.06 679134.6 842797.4 31910.152 96221.82 280510.03 0.0 39843.023 39139.746 4 508 221.0811811702731 9.583428 2099210.4333333336 348526.64 450492.58 1649422.1 2111082.2 2537127.0 157440.86 264584.62 623554.44 350854.56 507605.78 493017.4 34 508.0 Piplartine 509 319.1373322451023 9.584641 338223.8333333333 0.0 33871.166666666664 478944.5 535727.0 0.0 0.0 0.0 0.0 0.0 0.0 101613.5 81 510 635.2603761029604 9.5863695 313393.75 49324.405 0.0 241149.03 299092.66 399939.56 0.0 31191.275 116781.94 0.0 0.0 0.0 17 511 318.1341246571045 9.586918 3215133.5666666664 536181.7433333333 382610.2466666666 2370707.2 3300639.0 3974054.5 216410.25 366317.38 1025817.6 365496.9 350163.56 432170.28 2 511.0 Piplartine 512 538.2075346356665 9.588102 217301.67666666667 26067.226666666666 0.0 170534.75 210539.94 270830.34 0.0 0.0 78201.68 0.0 0.0 0.0 17 513 617.249981827343 9.588102 152895.84333333335 18518.56333333333 0.0 119956.3 148091.84 190639.39 0.0 0.0 55555.69 0.0 0.0 0.0 -1 514 673.2163132347292 9.588102 62582.42733333333 8595.539999999999 0.0 51819.75 61238.152 74689.38 0.0 0.0 25786.62 0.0 0.0 0.0 -1 515 222.08440357524827 9.589138 232948.62666666668 0.0 0.0 201365.38 223945.88 273534.62 0.0 0.0 0.0 0.0 0.0 0.0 -1 516 346.0937157094327 9.589138 43073.966 0.0 0.0 36193.418 45350.984 47677.496 0.0 0.0 0.0 0.0 0.0 0.0 -1 517 285.07619191663906 9.637387 3617870.466666667 309766.9666666667 0.0 3077655.2 3695431.2 4080525.0 216422.0 355194.78 357684.12 0.0 0.0 0.0 8 517.0 5-hydroxy-2-(4-hydroxyphenyl)-7-methoxy-4H-chromen-4-one 518 344.2587011592225 9.641142 100675.95333333332 0.0 0.0 104255.04 80945.74 116827.08 0.0 0.0 0.0 0.0 0.0 0.0 65 519 274.2743909643132 9.706929 59671.99066666667 27750.01833333333 40136.749 43013.562 29639.17 106363.24 0.0 0.0 83250.055 29349.057 0.0 91061.19 -1 519.0 Massbank:LU100203 2,2'-(Tetradecylimino)diethanol|Tetradecyldiethanolamine 520 369.16999686263085 9.721804 74421.40666666666 11788.854 233867.2033333333 67992.72 71185.9 84085.6 0.0 35366.562 0.0 148054.61 208241.8 345305.2 24 520.0 """4-[(1R,5R)-6-(3,4-dimethoxyphenyl)-3,7-dioxabicyclo[3.3.0]oct-2-yl]-1,2-dimeth oxybenzene CollisionEnergy:205060""" 521 320.2588893156643 9.741315 55485.392 0.0 0.0 67716.88 29975.416 68763.88 0.0 0.0 0.0 0.0 0.0 0.0 83 521.0 Knemolone D 522 280.09728275802627 9.777656 8630.812666666667 0.0 850613.8433333334 25892.438 0.0 0.0 0.0 0.0 0.0 1129760.5 1112715.0 309366.03 8 523 315.0868458635623 9.822521 54243.87 0.0 0.0 48034.07 48831.6 65865.94 0.0 0.0 0.0 0.0 0.0 0.0 8 524 354.0975394644745 9.878169 0.0 0.0 171843.99333333335 0.0 0.0 0.0 0.0 0.0 0.0 173856.23 285872.84 55802.91 8 524.0 5-hydroxy-1,2,3-trimethoxyxanthone 525 376.0796794629352 9.878169 0.0 0.0 58572.31633333334 0.0 0.0 0.0 0.0 0.0 0.0 43534.945 108052.41 24129.594 8 526 438.0403294266992 9.923078 0.0 0.0 168824.67333333334 0.0 0.0 0.0 0.0 0.0 0.0 112653.52 171056.86 222763.64 -1 527 356.1256549127522 9.92792 0.0 40408.638 273287.74333333335 0.0 0.0 0.0 0.0 121225.914 0.0 160991.28 272162.75 386709.2 24 527.0 NCGC00180457-02!4-(1,3-benzodioxol-5-ylmethyl)-3-[(3,4-dimethoxyphenyl)methyl]oxolan-2-one 528 321.1126821418692 9.929307 27343.375 977510.0666666668 4885133.166666667 0.0 0.0 82030.125 775741.0 1604855.2 551934.0 2575348.0 4604904.0 7475147.5 24 528.0 hydrastinine 529 657.2425736969137 9.985113 217637.44333333336 128420.97766666666 66237.61333333334 161002.34 198583.05 293326.94 33930.633 152480.03 198852.27 44496.14 79573.46 74643.24 4 530 680.318473248181 9.986006 156932.275 92205.69433333332 10078.852333333334 123267.945 152335.05 195193.83 69206.63 51465.473 155944.98 30236.557 0.0 0.0 28 531 275.10296842145107 9.9865055 322630.16333333333 79075.719 23266.04233333333 253570.61 310670.16 403649.72 21587.793 70838.664 144800.7 0.0 40122.875 29675.252 28 531.0 1040655-37-5 532 635.2606417619273 9.986904 463295.87000000005 109782.74366666668 40546.374 366751.06 442819.75 580316.8 30245.691 95654.12 203448.42 25278.809 53775.918 42584.395 28 533 538.2075634552295 9.9874735 155137.17666666667 33242.194 0.0 122510.7 147507.47 195393.36 0.0 32101.957 67624.625 0.0 0.0 0.0 28 534 318.1340915384424 10.041885 679042.4633333333 125441.05333333334 0.0 535877.25 731850.44 769399.7 0.0 178206.64 198116.52 0.0 0.0 0.0 2 534.0 Piplartine 535 221.0811435734695 10.044681 359019.2133333334 24041.286666666667 0.0 250272.52 489992.72 336792.4 0.0 0.0 72123.86 0.0 0.0 0.0 34 535.0 Piplartine 536 657.2422128707834 10.058417 210576.68 0.0 0.0 168913.48 188887.62 273928.94 0.0 0.0 0.0 0.0 0.0 0.0 4 537 322.1082706081657 10.063104 0.0 0.0 203644.03333333333 0.0 0.0 0.0 0.0 0.0 0.0 315854.4 226089.56 68988.14 8 537.0 Massbank:PR300611 Palmatine 538 344.0896882683305 10.063106 0.0 0.0 209397.1533333333 0.0 0.0 0.0 0.0 0.0 0.0 257821.77 256640.92 113728.77 8 539 235.09673549746216 10.0692835 83157.46333333333 8071.260999999999 50281.062 84623.38 80487.44 84361.57 0.0 24213.783 0.0 39276.562 52763.03 58803.594 -1 540 252.1231611327227 10.069421 416612.9066666667 93303.02999999998 252640.36666666667 416561.88 405363.0 427913.84 70559.68 130035.32 79314.09 194580.16 266058.5 297282.44 -1 541 257.07850222580674 10.071928 57385.651000000005 8354.392 35064.507333333335 56573.21 55644.953 59938.79 0.0 25063.176 0.0 38431.7 34570.074 32191.748 -1 542 643.2265786376496 10.078261 51399.00233333333 0.0 0.0 36761.74 51307.727 66127.54 0.0 0.0 0.0 0.0 0.0 0.0 -1 543 201.09121716472893 10.081813 60289.116 0.0 0.0 51102.188 62505.24 67259.92 0.0 0.0 0.0 0.0 0.0 0.0 52 544 231.1017785484943 10.081813 48622.265666666666 0.0 0.0 41311.496 49535.418 55019.883 0.0 0.0 0.0 0.0 0.0 0.0 34 545 597.2212613115656 10.081813 33431.375 0.0 0.0 25543.879 27970.504 46779.742 0.0 0.0 0.0 0.0 0.0 0.0 4 546 741.2906882726211 10.081813 205823.41 0.0 0.0 171223.47 188948.12 257298.64 0.0 0.0 0.0 0.0 0.0 0.0 24 547 282.0890779787331 10.084862 61682.479 0.0 0.0 51573.727 66746.11 66727.6 0.0 0.0 0.0 0.0 0.0 0.0 47 548 323.12812270035005 10.084862 58277.117666666665 0.0 0.0 48327.56 61373.527 65130.266 0.0 0.0 0.0 0.0 0.0 0.0 71 549 335.12807277040173 10.087613 311571.0466666667 0.0 24015.666666666668 270933.16 323554.88 340225.1 0.0 0.0 0.0 0.0 28011.44 44035.56 8 550 353.1387256598412 10.088125 3529462.733333333 174065.02666666667 498556.7766666667 3064553.2 3652355.0 3871480.0 142352.8 221183.95 158658.33 295926.6 456861.53 742882.2 24 551 370.1413453910336 10.099309 165674.56999999998 0.0 80435.026 158324.97 158811.72 179887.02 0.0 0.0 0.0 45602.664 70920.914 124781.5 24 552 371.1488963342794 10.103814 152164.15666666665 94142.43 572100.75 133907.84 150980.16 171604.47 67258.26 172008.53 43160.5 250781.27 513008.38 952512.6 24 552.0 Massbank:PR303923 Arctigenin 553 393.1313917517495 10.105424 8574.73 13741.855333333331 202743.98933333333 0.0 0.0 25724.19 0.0 41225.566 0.0 59400.168 163480.27 385351.53 -1 554 388.1760639800168 10.114947 0.0 65113.52033333333 411954.25333333336 0.0 0.0 0.0 39372.24 127930.38 28037.941 139339.72 382364.94 714158.1 24 554.0 Spectral Match to Arctigenin from NIST14 555 286.14422303524816 10.116805 0.0 0.0 259545.84333333332 0.0 0.0 0.0 0.0 0.0 0.0 269626.78 245223.47 263787.28 6 555.0 Massbank:LU109603 Piperine|(2E,4E)-5-(1,3-benzodioxol-5-yl)-1-piperidin-1-ylpenta-2,4-dien-1-one 556 409.10547927539886 10.116805 0.0 0.0 60739.46933333333 0.0 0.0 0.0 0.0 0.0 0.0 25759.691 54379.637 102079.08 -1 557 416.2074800012517 10.131112 0.0 63990.02833333333 136736.17833333332 0.0 0.0 0.0 80084.28 81738.26 30147.545 150806.28 120221.805 139180.45 -1 558 383.1494772891055 10.257422 26444.971666666668 0.0 0.0 25955.508 22812.979 30566.428 0.0 0.0 0.0 0.0 0.0 0.0 24 559 310.1079704391895 10.260111 0.0 0.0 590687.2533333333 0.0 0.0 0.0 0.0 0.0 0.0 713830.25 912262.06 145969.45 8 559.0 KU036-6-1 560 703.2982171964162 10.38403 175955.14333333334 0.0 0.0 165949.56 227340.48 134575.39 0.0 0.0 0.0 0.0 0.0 0.0 -1 561 635.2605671334458 10.407281 50654.566 0.0 0.0 38699.91 50087.53 63176.258 0.0 0.0 0.0 0.0 0.0 0.0 2 562 338.1026951974418 10.459382 0.0 0.0 838231.96 0.0 0.0 0.0 0.0 0.0 0.0 846978.06 1480250.9 187466.92 8 563 360.0844530260538 10.477648 0.0 0.0 556052.4633333334 0.0 0.0 0.0 0.0 0.0 0.0 377717.75 1109654.5 180785.14 8 564 370.1412933395196 10.488749 249403.56 86198.15666666666 289897.78 237552.64 244925.44 265732.6 65327.67 124702.24 68564.56 182261.75 275230.06 412201.53 24 565 282.0891353469216 10.488902 63833.691 8345.936333333333 84589.52233333334 57475.81 58210.543 75814.72 0.0 25037.809 0.0 41078.777 78818.62 133871.17 47 566 393.1315071924859 10.489679 54002.35666666667 0.0 78132.19133333334 49431.082 54665.438 57910.55 0.0 0.0 0.0 39273.984 72893.33 122229.26 -1 567 201.09125027033 10.490446 64673.996333333336 7886.405666666667 89017.51333333335 57875.445 62474.56 73671.984 0.0 23659.217 0.0 41998.19 82468.85 142585.5 52 568 323.128171702333 10.490446 60053.42833333334 7458.894 86387.11899999999 54201.664 55625.637 70332.984 0.0 22376.682 0.0 40979.707 80245.85 137935.8 71 569 763.2726895518697 10.49055 68462.678 6947.351 99392.50733333331 63382.81 69701.914 72303.31 0.0 20842.053 0.0 45544.266 91976.586 160656.67 -1 570 233.0810104924987 10.491058 37748.98433333333 0.0 47180.62333333333 34718.465 34828.676 43699.812 0.0 0.0 0.0 0.0 49987.56 91554.31 -1 571 325.1437136761237 10.491127 18526.856 0.0 29472.56233333333 25192.564 0.0 30388.004 0.0 0.0 0.0 0.0 36160.355 52257.332 -1 572 231.10183872642264 10.491493 50629.43066666666 0.0 70109.93966666667 45730.367 47736.305 58421.62 0.0 0.0 0.0 32078.904 67898.29 110352.625 34 573 335.1281812436539 10.49185 323868.67 79655.591 429785.44333333336 289605.66 304201.97 377798.38 60105.535 130104.484 48756.754 218010.53 403449.7 667896.1 8 574 353.13876101367856 10.49185 3411344.0 876478.4 4408088.833333333 3097429.8 3199034.2 3937568.0 660207.8 1417721.1 551506.3 2292830.2 4178445.8 6752990.5 24 575 741.2907727429746 10.491847 342618.44 25124.736666666668 508134.53 299859.25 326351.6 401644.47 0.0 75374.21 0.0 172594.97 459971.12 891837.5 24 576 488.0766795972486 10.493558 33563.795333333335 0.0 28440.824666666667 33001.188 32747.898 34942.3 0.0 0.0 0.0 0.0 34602.54 50719.934 24 577 219.17463627590183 10.507724 49638.958333333336 0.0 0.0 44472.445 48028.637 56415.793 0.0 0.0 0.0 0.0 0.0 0.0 61 578 302.17561660413503 10.681975 28775.244666666666 457882.53333333327 91567.652 0.0 86325.734 0.0 572497.6 281426.94 519723.06 123431.97 79991.766 71279.22 70 578.0 (4E)-N-Isobutyl-5-(1,3-benzodioxol-5-yl)-4-pentenamide 579 731.2105409348137 10.7065 0.0 7268.591 81532.972 0.0 0.0 0.0 0.0 21805.773 0.0 22666.186 72340.98 149591.75 -1 580 377.1001938786486 10.709394 0.0 34519.30333333334 214639.48666666663 0.0 0.0 0.0 26459.45 77098.46 0.0 78874.03 194803.55 370240.88 -1 581 355.1176030752748 10.709804 0.0 168332.03133333335 724929.5666666668 0.0 0.0 0.0 128262.734 293461.78 83271.58 303017.1 678593.2 1193178.4 24 581.0 7,8-dihydromethysticin 582 337.10758560484004 10.715047 0.0 52860.58933333333 0.0 0.0 0.0 0.0 41872.816 91858.53 24850.422 0.0 0.0 0.0 24 582.0 NCGC00180457-02!4-(1,3-benzodioxol-5-ylmethyl)-3-[(3,4-dimethoxyphenyl)methyl]oxolan-2-one [IIN-based on: CCMSLIB00000847667] 583 237.1851388212021 10.741331 38037.573 14374.039 0.0 36480.867 38684.676 38947.176 0.0 43122.117 0.0 0.0 0.0 0.0 61 584 354.1098597178336 10.759791 48785.73533333334 17307.04566666667 124887.46666666667 46105.82 43761.48 56489.906 51921.137 0.0 0.0 0.0 0.0 374662.4 24 585 337.107545270431 10.762693 564639.79 64142.466666666674 268869.60000000003 523748.5 468780.62 701390.25 52444.33 67912.63 72070.44 119342.07 244938.23 442328.5 -1 585.0 CCG-208458 CollisionEnergy:205060 586 319.0969553430708 10.787818 83272.09300000001 0.0 0.0 77473.734 66958.6 105383.945 0.0 0.0 0.0 0.0 0.0 0.0 -1 587 353.10228468151104 10.794079 39043.55 0.0 0.0 38637.453 38996.957 39496.24 0.0 0.0 0.0 0.0 0.0 0.0 24 587.0 N-(3,5-dioxo-10-oxa-4-azatricyclo[5.2.1.0~2,6~]dec-8-en-4-yl)-2-methoxybenzamide 588 257.1150015256757 10.867416 31918.993 31948.930333333334 22331.088666666667 31998.664 35549.285 28209.03 28326.064 37014.133 30506.594 0.0 34151.86 32841.406 -1 589 235.1332021644412 10.869455 94641.96666666667 115215.82833333332 93079.42133333332 95644.74 91251.41 97029.75 150828.16 90113.38 104705.945 113329.22 84967.06 80941.984 -1 590 353.26887799548723 11.080991 56936.214 0.0 0.0 40844.832 57514.0 72449.81 0.0 0.0 0.0 0.0 0.0 0.0 18 590.0 Spectral Match to cis-5,8,11-Eicosatrienoic acid from NIST14 591 694.4012458343623 11.080991 139362.62333333332 0.0 0.0 98606.23 140908.64 178573.0 0.0 0.0 0.0 0.0 0.0 0.0 18 591.0 Spectral Match to Monolinolenin (9c,12c,15c) from NIST14 592 314.1757307848501 11.117692 0.0 27176.921666666665 547238.5299999999 0.0 0.0 0.0 55844.023 0.0 25686.742 1304839.2 158037.64 178838.75 70 593 599.4104619597102 11.1491375 122715.01866666666 16387.199333333334 0.0 114174.086 103739.2 150231.77 49161.598 0.0 0.0 0.0 0.0 0.0 3 594 518.3245452945513 11.247328 57544.024333333335 8203.115333333333 0.0 37637.348 64985.105 70009.62 0.0 24609.346 0.0 0.0 0.0 0.0 23 594.0 Sphingomyelin (d18:1/18:0) CollisionEnergy:102040 595 398.175829564442 11.358254 0.0 0.0 183382.96 0.0 0.0 0.0 0.0 0.0 0.0 281695.78 235152.78 33300.32 -1 595.0 Massbank:PR310506 Chalcone 596 350.2544533785527 11.412771 330724.0633333333 0.0 346366.55 0.0 496158.44 496013.75 0.0 0.0 0.0 0.0 516086.53 523013.12 -1 597 299.091972071523 11.650494 2891142.1 317935.01666666666 0.0 2532610.8 2718080.5 3422735.0 202706.75 343166.9 407931.4 0.0 0.0 0.0 8 597.0 acacetin CollisionEnergy:205060 598 315.0869105921273 11.778389 31224.119 74834.57900000001 0.0 28080.562 29865.342 35726.453 46074.543 76199.414 102229.78 0.0 0.0 0.0 8 598.0 """4',7-Dimethoxy-3-hydroxyflavone CollisionEnergy:102040""" 599 408.2664745005727 11.808632 29772.077666666664 0.0 0.0 30454.484 27321.36 31540.389 0.0 0.0 0.0 0.0 0.0 0.0 -1 600 373.2530558313583 11.810646 40848.61666666667 0.0 0.0 40968.25 33296.58 48281.02 0.0 0.0 0.0 0.0 0.0 0.0 94 601 391.263793272378 11.810646 56546.85466666666 0.0 0.0 58630.06 45734.234 65276.27 0.0 0.0 0.0 0.0 0.0 0.0 94 602 696.4171615277451 11.8774605 33506.58933333333 0.0 0.0 27081.213 28276.43 45162.125 0.0 0.0 0.0 0.0 0.0 0.0 18 602.0 Spectral Match to 1-Linoleoylglycerol from NIST14 603 231.13832668569304 11.917509 77469.06333333334 72952.918 65985.97666666667 79567.52 74849.96 77989.71 54955.336 111575.91 52327.508 68290.19 63318.22 66349.52 30 603.0 p-methoxycinnamic acid ethyl ester 604 478.2935016830377 12.004753 147890.92 81741.478 95343.268 100414.92 173452.5 169805.34 73903.164 84933.61 86387.66 96005.14 97703.0 92321.664 18 604.0 PE-DAG (16:1/18:2) 605 324.1236518674743 12.046184 0.0 0.0 70164.62966666667 0.0 0.0 0.0 0.0 0.0 0.0 111239.63 68473.05 30781.209 8 606 520.3404455318072 12.059999 225076.07333333333 89380.23999999999 93336.15666666668 154403.14 243400.3 277424.78 81743.92 97937.81 88458.99 97407.94 91800.64 90799.89 23 606.0 Sphingomyelin (d18:1/18:0) CollisionEnergy:102040 607 537.3038559056944 12.140541 96139.95333333332 0.0 0.0 65528.93 92380.63 130510.3 0.0 0.0 0.0 0.0 0.0 0.0 29 608 353.2688935762367 12.141862 219005.63 8297.591666666667 8575.137333333334 152801.22 213477.97 290737.7 0.0 24892.775 0.0 0.0 0.0 25725.412 18 608.0 Spectral Match to cis-5,8,11-Eicosatrienoic acid from NIST14 609 327.23231457960065 12.1437 35559.130333333334 0.0 0.0 37375.863 27321.434 41980.094 0.0 0.0 0.0 0.0 0.0 0.0 3 609.0 NCGC00385237-01 610 497.3113791003048 12.1437 122681.89 0.0 0.0 85660.09 121755.05 160630.53 0.0 0.0 0.0 0.0 0.0 0.0 -1 611 618.4285128856473 12.1437 172891.79133333333 0.0 0.0 171792.78 127917.734 218964.86 0.0 0.0 0.0 0.0 0.0 0.0 3 611.0 CHEBI:181879 612 532.3485925173915 12.144221 289913.39 28653.907 20668.803333333333 203218.8 288467.34 378054.03 26826.117 32230.604 26905.0 0.0 29231.9 32774.51 18 612.0 Spectral Match to Monolinolenin (9c,12c,15c) from NIST14 613 599.4103472480776 12.242858 456945.3 81530.83333333333 0.0 432639.62 397334.72 540861.56 0.0 142228.73 102363.77 0.0 0.0 0.0 3 614 478.293493201436 12.272694 65313.179 0.0 13468.146666666667 42876.605 54321.492 98741.44 0.0 0.0 0.0 40404.44 0.0 0.0 18 614.0 Spectral Match to 1-Palmitoyl-2-hydroxy-sn-glycero-3-phosphoethanolamine from NIST14 615 520.3404913896162 12.323925 84085.36499999999 0.0 11304.548333333332 61946.43 63546.875 126762.79 0.0 0.0 0.0 33913.645 0.0 0.0 23 615.0 Spectral Match to Lyso-PC(16:0) from NIST14 616 532.348591859395 12.394885 65004.8 0.0 0.0 41671.5 38050.62 115292.28 0.0 0.0 0.0 0.0 0.0 0.0 18 616.0 Spectral Match to Monolinolenin (9c,12c,15c) from NIST14 617 353.2689806201644 12.396319 55547.00133333334 0.0 0.0 36059.062 33163.992 97417.95 0.0 0.0 0.0 0.0 0.0 0.0 18 617.0 Spectral Match to cis-5,8,11-Eicosatrienoic acid from NIST14 618 203.1796403923295 12.418956 44364.389 0.0 0.0 43348.574 41119.543 48625.05 0.0 0.0 0.0 0.0 0.0 0.0 61 618.0 Spectral Match to Methyl hexadecanoate from NIST14 619 355.2269640150865 12.520339 82922.83666666667 0.0 0.0 72271.12 86894.32 89603.07 0.0 0.0 0.0 0.0 0.0 0.0 14 619.0 NCGC00380882-01!5-chloro-2,4-dihydroxy-6-methyl-3-[(E)-3-methyl-5-[(1S,2R,6R)-1,2,6-trimethyl-3-oxocyclohexyl]pent-2-enyl]benzaldehyde [IIN-based on: CCMSLIB00000845779] 620 313.18021927793376 12.523803 36143.498 0.0 0.0 31579.088 38822.332 38029.074 0.0 0.0 0.0 0.0 0.0 0.0 14 621 299.1646142173389 12.526944 42413.43666666667 0.0 0.0 36767.992 45897.4 44574.918 0.0 0.0 0.0 0.0 0.0 0.0 14 622 618.4283440683615 12.539547 99371.713 0.0 0.0 104659.984 75141.195 118313.96 0.0 0.0 0.0 0.0 0.0 0.0 3 623 599.4102336756728 12.557057 99713.617 0.0 0.0 129046.766 110073.12 60020.965 0.0 0.0 0.0 0.0 0.0 0.0 3 624 205.19538473348828 12.622451 29725.114 30115.744666666666 83343.746 26019.71 27837.932 35317.7 0.0 90347.234 0.0 47903.734 84039.02 118088.484 10 624.0 5-(5-methoxycarbonyl-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl)-3-methylpentanoic acid 625 299.16466740612094 12.637631 29564.839000000004 0.0 0.0 25380.898 32121.508 31192.111 0.0 0.0 0.0 0.0 0.0 0.0 14 626 264.2324891383133 12.647067 0.0 79929.37666666666 130289.81333333334 0.0 0.0 0.0 48537.91 191250.22 0.0 75498.13 130298.01 185073.3 100 627 355.22696023175007 12.68678 81680.28666666667 0.0 0.0 71642.96 84807.64 88590.26 0.0 0.0 0.0 0.0 0.0 0.0 14 627.0 NCGC00380882-01!5-chloro-2,4-dihydroxy-6-methyl-3-[(E)-3-methyl-5-[(1S,2R,6R)-1,2,6-trimethyl-3-oxocyclohexyl]pent-2-enyl]benzaldehyde [IIN-based on: CCMSLIB00000845779] 628 411.2148025382604 12.692578 81962.353 0.0 0.0 73410.195 89204.2 83272.664 0.0 0.0 0.0 0.0 0.0 0.0 -1 629 689.2459257081126 12.728104 161953.92333333334 0.0 0.0 150366.55 85156.19 250339.03 0.0 0.0 0.0 0.0 0.0 0.0 7 630 583.4154353681664 12.741025 353833.28 0.0 0.0 359955.7 290448.2 411095.94 0.0 0.0 0.0 0.0 0.0 0.0 3 631 205.19544077528823 12.756078 0.0 453751.2933333334 307794.58 0.0 0.0 0.0 173333.48 1035177.56 152742.84 262315.72 267972.3 393095.72 10 631.0 Bisabolol CollisionEnergy:205060 632 264.2324558466034 12.756078 0.0 702158.4400000001 543226.86 0.0 0.0 0.0 271501.97 1605146.6 229826.75 433847.8 495496.22 700336.56 100 632.0 (�)-alpha-Bisabolol - 40.0 eV 633 371.222028288211 12.818477 35034.308 0.0 0.0 31340.771 37671.703 36090.45 0.0 0.0 0.0 0.0 0.0 0.0 14 634 599.4101830171476 12.833718 66558.62133333333 0.0 0.0 61902.18 57448.754 80324.93 0.0 0.0 0.0 0.0 0.0 0.0 3 635 311.2585157062367 12.877548 56141.94666666668 0.0 0.0 38589.758 43671.168 86164.914 0.0 0.0 0.0 0.0 0.0 0.0 58 635.0 (2R,6R)-2-methyl-6-pentadecylpiperidine 636 298.23818236389496 12.90562 25858.015666666663 0.0 0.0 26555.861 24899.684 26118.502 0.0 0.0 0.0 0.0 0.0 0.0 -1 637 205.1953973986703 12.923927 22311.65566666667 96724.72766666666 465856.08 33853.527 0.0 33081.44 83889.12 152183.86 54101.203 274340.44 465632.7 657595.1 10 637.0 5-(5-methoxycarbonyl-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl)-3-methylpentanoic acid 638 454.2934533495422 12.942473 19205.103 0.0 10013.445333333331 0.0 30967.014 26648.295 0.0 0.0 0.0 0.0 30040.336 0.0 18 638.0 Spectral Match to 1-Palmitoyl-2-hydroxy-sn-glycero-3-phosphoethanolamine from NIST14 639 496.3404797631272 13.000169 35363.45766666666 0.0 10947.898333333333 33206.414 32301.744 40582.215 0.0 0.0 0.0 32843.695 0.0 0.0 23 639.0 Spectral Match to 1-Stearoyl-2-hydroxy-sn-glycero-3-phosphocholine from NIST14 640 205.1954293030158 13.004048 0.0 87870.32433333334 0.0 0.0 0.0 0.0 33844.953 199584.61 30181.41 0.0 0.0 0.0 10 640.0 Bisabolol CollisionEnergy:205060 641 264.2324263274582 13.004666 0.0 305476.4366666667 290272.9366666667 0.0 0.0 0.0 115379.74 684049.4 117000.17 202335.19 256950.28 411533.34 100 641.0 (�)-alpha-Bisabolol - 40.0 eV 642 534.364226414089 13.033815 32763.04 0.0 10106.545666666669 24993.46 29680.34 43615.32 0.0 0.0 0.0 0.0 0.0 30319.637 18 642.0 Spectral Match to 1-Linoleoylglycerol from NIST14 643 205.195403315532 13.099915 41845.420666666665 0.0 12079.12 40607.02 37629.902 47299.34 0.0 0.0 0.0 36237.36 0.0 0.0 10 643.0 Bisabolol CollisionEnergy:205060 644 371.2220224023984 13.112495 38887.54866666667 0.0 0.0 29347.365 38110.676 49204.605 0.0 0.0 0.0 0.0 0.0 0.0 14 645 618.428314420422 13.127875 57772.44066666666 0.0 0.0 60253.812 46184.78 66878.73 0.0 0.0 0.0 0.0 0.0 0.0 3 645.0 Spectral Match to .beta.-Cryptoxanthin from NIST14 646 205.1953981086132 13.200899 42219.623666666674 300877.66 1010321.2333333334 41298.027 34759.906 50600.938 159068.2 613110.25 130454.53 529130.56 978788.94 1523044.2 10 646.0 Bisabolol CollisionEnergy:205060 647 279.1596524230814 13.253494 0.0 25768.759 9214.674333333334 0.0 0.0 0.0 25857.104 24768.355 26680.818 0.0 0.0 27644.023 82 647.0 Spectral Match to Dibutyl phthalate from NIST14 648 404.3529075483535 13.318094 92932.01166666669 0.0 19776.336 123868.26 73745.08 81182.695 0.0 0.0 0.0 0.0 0.0 59329.008 83 648.0 Knemolone D 649 205.19542778660403 13.329582 0.0 0.0 157072.6366666667 0.0 0.0 0.0 0.0 0.0 0.0 80390.67 159637.66 231189.58 10 649.0 (.+/-.)-trans-Nerolidol - 40.0 eV 650 393.2041801522604 13.359372 99316.385 15634.44 0.0 74563.51 103054.95 120330.695 0.0 23351.709 23551.611 0.0 0.0 0.0 -1 651 371.2220487678566 13.359383 65586.64566666666 0.0 0.0 50487.617 67310.82 78961.5 0.0 0.0 0.0 0.0 0.0 0.0 14 652 313.27413683049514 13.382266 118948.23 0.0 0.0 79506.81 108944.19 168393.69 0.0 0.0 0.0 0.0 0.0 0.0 58 652.0 Spectral Match to Monolaurin from NIST14 653 212.1437253985099 13.386265 130587.51533333331 66821.96766666666 94742.69333333334 126041.88 126283.766 139436.9 62546.49 73689.28 64230.133 78181.76 93228.195 112818.125 -1 654 252.2323894207944 13.437548 24946.375 314529.51666666666 587425.66 0.0 74839.125 0.0 458167.7 205080.6 280340.25 1394941.1 167411.94 199923.94 58 654.0 (2E,4E)-N-(2-methylpropyl)dodeca-2,4-dienamide 655 409.2741772852103 13.438848 172693.75 0.0 0.0 188893.1 138482.62 190705.53 0.0 0.0 0.0 0.0 0.0 0.0 3 655.0 (2S,3S,4S,5R,6R)-6-[[(3S,4S,6aR,6bS,8R,8aR,9R,10R,12aS,14bR)-10-acetyloxy-8a-(acetyloxymethyl)-8,9-dihydroxy-4-(hydroxymethyl)-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-4-hydroxy-3,5-bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]oxane-2-carboxylic acid 656 657.2565590299619 13.515563 47912.24166666667 0.0 0.0 44102.72 36437.36 63196.645 0.0 0.0 0.0 0.0 0.0 0.0 8 657 391.2637749887978 13.56586 45714.29433333333 0.0 0.0 49855.004 37552.324 49735.555 0.0 0.0 0.0 0.0 0.0 0.0 94 658 409.2741403131934 13.56586 348815.38 0.0 0.0 371638.34 293674.3 381133.5 0.0 0.0 0.0 0.0 0.0 0.0 3 658.0 (2S,3S,4S,5R,6R)-6-[[(3S,4S,6aR,6bS,8R,8aR,9R,10R,12aS,14bR)-10-acetyloxy-8a-(acetyloxymethyl)-8,9-dihydroxy-4-(hydroxymethyl)-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-4-hydroxy-3,5-bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]oxane-2-carboxylic acid 659 343.2271587372488 13.601896 45382.10266666667 43728.121666666666 102897.27533333334 38596.59 45829.812 51719.906 28132.832 74467.51 28584.023 73627.266 88058.67 147005.89 14 659.0 NCGC00169961-02!4-hydroxy-3-[(2E,6E)-4-hydroxy-3,7,11-trimethyldodeca-2,6,10-trienyl]benzoic acid [IIN-based: Match] 660 205.19537363173683 13.6203575 116064.86666666664 598348.1466666667 3120009.8000000003 126771.86 91802.12 129620.62 415692.94 1077360.1 301991.4 1365213.4 3268084.0 4726732.0 10 660.0 Bisabolol CollisionEnergy:205060 661 623.2507725890979 13.63737 112006.19333333331 0.0 0.0 108748.21 69472.53 157797.84 0.0 0.0 0.0 0.0 0.0 0.0 8 661.0 ferulic acid CollisionEnergy:205060 662 600.4176378602062 13.674618 30439.25633333333 0.0 0.0 30761.992 24309.465 36246.312 0.0 0.0 0.0 0.0 0.0 0.0 3 663 349.25281730082355 13.698035 34457.020333333334 0.0 0.0 36003.008 26452.203 40915.85 0.0 0.0 0.0 0.0 0.0 0.0 3 663.0 (2S,3S,4S,5R,6R)-6-[[(3S,4S,6aR,6bS,8R,8aR,9R,10R,12aS,14bR)-10-acetyloxy-8a-(acetyloxymethyl)-8,9-dihydroxy-4-(hydroxymethyl)-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-4-hydroxy-3,5-bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]oxane-2-carboxylic acid 664 367.2631868419035 13.70437 42837.04033333333 0.0 0.0 45018.977 33272.742 50219.402 0.0 0.0 0.0 0.0 0.0 0.0 3 664.0 alisol A 24-acetate 665 618.4280114711152 13.740295 162986.05333333332 0.0 0.0 164884.28 138539.05 185534.83 0.0 0.0 0.0 0.0 0.0 0.0 3 666 655.3127716332415 13.766502 62580.62100000001 0.0 0.0 56706.848 50354.965 80680.05 0.0 0.0 0.0 0.0 0.0 0.0 68 667 205.1953600635457 13.78988 351309.32 560493.86 1528265.8333333333 405795.28 246961.52 401171.16 678806.94 494838.3 507836.34 762478.3 1542996.4 2279322.8 10 667.0 Bisabolol CollisionEnergy:205060 668 303.1959301893111 13.807391 46433.639 0.0 0.0 37443.605 48279.785 53577.527 0.0 0.0 0.0 0.0 0.0 0.0 27 669 454.25923516773867 13.808849 424548.39333333337 62946.35 0.0 323139.34 407456.28 543049.56 0.0 0.0 188839.05 0.0 0.0 0.0 11 670 476.24117478999455 13.810509 155206.92 0.0 0.0 92739.7 187912.75 184968.31 0.0 0.0 0.0 0.0 0.0 0.0 4 671 653.2971211936361 13.815136 50977.04933333333 0.0 0.0 45219.895 51889.793 55821.46 0.0 0.0 0.0 0.0 0.0 0.0 -1 672 499.3170031940512 13.836811 214232.04666666663 20323.411333333333 0.0 184768.27 209720.6 248207.27 0.0 0.0 60970.234 0.0 0.0 0.0 11 673 639.2454837601149 13.84703 87698.33133333332 0.0 0.0 79118.234 50836.43 133140.33 0.0 0.0 0.0 0.0 0.0 0.0 7 674 409.27412018374736 13.9326105 83888.66666666667 0.0 0.0 89551.74 71657.17 90457.09 0.0 0.0 0.0 0.0 0.0 0.0 3 675 476.24109561771775 13.985793 45399.757666666665 0.0 0.0 28846.504 47869.902 59482.867 0.0 0.0 0.0 0.0 0.0 0.0 4 676 454.25916651866487 13.985977 144931.31666666665 21861.588666666667 0.0 104734.67 143279.62 186779.66 0.0 0.0 65584.766 0.0 0.0 0.0 11 677 499.3169212811058 13.987773 62216.80233333333 0.0 0.0 40454.977 57237.7 88957.73 0.0 0.0 0.0 0.0 0.0 0.0 11 678 623.2505483708746 14.054061 227844.9233333333 0.0 0.0 213533.53 130623.86 339377.38 0.0 0.0 0.0 0.0 0.0 0.0 8 678.0 3.10S-Hydroxypheophorbide a 679 375.2685043469285 14.0613165 346858.4733333333 0.0 0.0 364467.22 295223.7 380884.5 0.0 0.0 0.0 0.0 0.0 0.0 3 679.0 (2S,3S,4S,5R,6R)-6-[[(3S,4S,6aR,6bS,8R,8aR,9R,10R,12aS,14bR)-10-acetyloxy-8a-(acetyloxymethyl)-8,9-dihydroxy-4-(hydroxymethyl)-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-4-hydroxy-3,5-bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]oxane-2-carboxylic acid 680 205.195406681048 14.063035 0.0 562850.13 553354.8766666666 0.0 0.0 0.0 125251.29 1341821.2 221477.9 369411.53 504695.16 785957.94 10 680.0 Bisabolol CollisionEnergy:205060 681 618.4277954292133 14.064129 80159.057 0.0 0.0 86621.055 66342.766 87513.35 0.0 0.0 0.0 0.0 0.0 0.0 3 682 392.2714517496816 14.067272 75029.10066666667 0.0 0.0 93770.234 60855.258 70461.81 0.0 0.0 0.0 0.0 0.0 0.0 3 682.0 CHEBI:181879 683 393.2788764120912 14.072368 292603.13 0.0 0.0 301332.94 255582.73 320893.72 0.0 0.0 0.0 0.0 0.0 0.0 3 683.0 NCGC00380456-01 684 476.2410931942006 14.088547 54265.348333333335 0.0 0.0 31043.78 50736.695 81015.57 0.0 0.0 0.0 0.0 0.0 0.0 4 685 303.1959035269701 14.091666 37328.99033333333 0.0 0.0 26130.523 34767.848 51088.6 0.0 0.0 0.0 0.0 0.0 0.0 27 686 454.2591067982909 14.091666 63215.744666666666 0.0 0.0 44078.027 60747.797 84821.41 0.0 0.0 0.0 0.0 0.0 0.0 11 687 499.3169909610537 14.092328 54418.95166666667 10191.876666666669 0.0 37691.918 60738.375 64826.562 0.0 0.0 30575.63 0.0 0.0 0.0 11 688 842.562419410205 14.121127 163863.16666666666 0.0 0.0 151422.14 115675.25 224492.11 0.0 0.0 0.0 0.0 0.0 0.0 18 689 618.4278831777374 14.16838 77820.79833333334 0.0 0.0 82449.266 65002.043 86011.086 0.0 0.0 0.0 0.0 0.0 0.0 3 690 600.4175405730531 14.180984 33528.85533333333 0.0 0.0 32597.994 27888.422 40100.15 0.0 0.0 0.0 0.0 0.0 0.0 89 691 371.25851329589767 14.190905 24854.950666666668 27915.056 40672.008 0.0 36853.418 37711.434 54343.465 29401.703 0.0 56597.953 33070.184 32347.887 -1 692 794.5782855572828 14.209641 1839060.1666666667 0.0 335958.60000000003 0.0 0.0 5517180.5 0.0 0.0 0.0 541310.0 466565.8 0.0 18 692.0 DG(18:2/18:3/0:0); [M+NH4]+ C39H70N1O5 693 609.2711296389783 14.221283 43176.01066666667 0.0 0.0 37330.992 35848.63 56348.41 0.0 0.0 0.0 0.0 0.0 0.0 8 694 602.4331670334952 14.265363 109677.35166666668 0.0 0.0 132385.67 80903.33 115743.055 0.0 0.0 0.0 0.0 0.0 0.0 3 694.0 CHEBI:181879 695 401.2842490879152 14.280833 31686.863666666668 0.0 0.0 33924.484 28180.525 32955.582 0.0 0.0 0.0 0.0 0.0 0.0 3 695.0 NCGC00380920-01 696 794.5781947866361 14.29673 0.0 678242.6 204359.46666666667 0.0 0.0 0.0 0.0 838208.9 1196518.9 0.0 0.0 613078.4 18 696.0 DG(18:2/18:3/0:0); [M+NH4]+ C39H70N1O5 697 799.5333203289559 14.312862 1824254.9 128726.13333333336 0.0 0.0 3255783.5 2216981.2 0.0 0.0 386178.4 0.0 0.0 0.0 26 698 663.1749913312107 14.341138 55795.65633333334 0.0 0.0 55987.34 46166.953 65232.676 0.0 0.0 0.0 0.0 0.0 0.0 8 699 629.2374413233073 14.344735 423404.4966666668 0.0 0.0 408222.34 339982.03 522009.12 0.0 0.0 0.0 0.0 0.0 0.0 21 700 606.2479790453839 14.344771 127742.76 0.0 0.0 113373.59 93314.36 176540.33 0.0 0.0 0.0 0.0 0.0 0.0 8 701 607.2556448007774 14.345934 3101667.966666667 28471.243999999995 0.0 2842195.2 2510336.5 3952472.2 0.0 41218.92 44194.812 0.0 0.0 0.0 8 702 655.3124001074908 14.352016 166739.62 0.0 0.0 178031.6 162707.38 159479.88 0.0 0.0 0.0 0.0 0.0 0.0 68 703 618.4277916338006 14.384658 173638.38 0.0 0.0 196083.92 145898.11 178933.11 0.0 0.0 0.0 0.0 0.0 0.0 3 704 662.4396036472825 14.446254 94288.70466666669 0.0 0.0 87220.8 73172.484 122472.83 0.0 0.0 0.0 0.0 0.0 0.0 18 705 450.3193907569219 14.507278 31992.668 0.0 11830.313333333334 0.0 47251.348 48726.656 0.0 0.0 0.0 0.0 35490.94 0.0 -1 706 375.2686023818092 14.508687 80462.088 0.0 0.0 93922.25 61189.85 86274.164 0.0 0.0 0.0 0.0 0.0 0.0 3 706.0 CHEBI:181245 707 556.4427266121103 14.548717 48254.64833333334 39152.98333333333 39438.501 57884.57 0.0 86879.375 53185.25 64273.7 0.0 0.0 48031.043 70284.46 36 707.0 Spectral Match to Nonaethylene glycol from NIST14 708 583.4152938337616 14.599556 111608.27666666669 0.0 0.0 110738.74 90263.17 133822.92 0.0 0.0 0.0 0.0 0.0 0.0 3 709 600.4179028370776 14.601158 807688.0800000001 104424.86766666669 0.0 804531.94 720789.5 897742.8 57139.113 142483.38 113652.11 0.0 0.0 0.0 3 710 468.3900788447129 14.614506 56157.143 95041.38333333336 85446.928 102312.695 0.0 66158.734 66653.84 80770.36 137699.95 87662.69 80347.484 88330.61 36 710.0 Polidocanol 711 607.2558573157403 14.632576 373315.2166666666 0.0 0.0 322206.75 189953.5 607785.4 0.0 0.0 0.0 0.0 0.0 0.0 8 712 653.2975349480962 14.632576 97711.91833333332 0.0 0.0 107263.3 101478.15 84394.305 0.0 0.0 0.0 0.0 0.0 0.0 -1 713 424.3639721954254 14.636617 45927.136666666665 65819.52 77301.98666666668 68913.56 0.0 68867.85 66779.555 70703.56 59975.445 73425.39 92911.125 65569.445 36 713.0 Polidocanol 714 319.284863936579 14.652605 17714.733 33810.41166666667 21636.22266666667 28023.674 0.0 25120.525 38575.523 31745.53 31110.182 35539.082 0.0 29369.586 -1 715 625.2663439473885 14.660892 55163.095 0.0 0.0 53049.363 34855.758 77584.164 0.0 0.0 0.0 0.0 0.0 0.0 8 716 393.2789950828424 14.70274 41210.222 0.0 0.0 43967.926 36234.59 43428.15 0.0 0.0 0.0 0.0 0.0 0.0 3 716.0 (2S,3S,4S,5R,6R)-6-[[(3S,4S,6aR,6bS,8R,8aR,9R,10R,12aS,14bR)-10-acetyloxy-8a-(acetyloxymethyl)-8,9-dihydroxy-4-(hydroxymethyl)-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-4-hydroxy-3,5-bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]oxane-2-carboxylic acid 717 669.2923373628189 14.799881 138112.49333333332 0.0 0.0 157475.52 125328.58 131533.38 0.0 0.0 0.0 0.0 0.0 0.0 -1 718 691.2740896293591 14.799881 56529.19566666667 0.0 0.0 54031.227 52367.973 63188.387 0.0 0.0 0.0 0.0 0.0 0.0 8 719 583.415118916245 14.824336 131523.35666666666 0.0 0.0 126476.99 102819.13 165273.95 0.0 0.0 0.0 0.0 0.0 0.0 3 720 600.417775019592 14.82595 1088104.7966666666 96370.50433333336 0.0 1244586.2 1036351.75 983376.44 42212.133 133332.2 113567.18 0.0 0.0 0.0 3 721 280.2640739286519 14.86385 0.0 31074.69133333333 83603.21333333333 0.0 0.0 0.0 59407.824 0.0 33816.25 250809.64 0.0 0.0 58 721.0 (2E,4E)-N-(2-methylpropyl)dodeca-2,4-dienamide 722 772.4764626904125 14.882097 100353.90333333332 25586.726666666666 0.0 92793.67 85656.98 122611.06 31454.15 0.0 45306.03 0.0 0.0 0.0 66 723 613.2663017186572 14.925663 86154.93466666667 0.0 0.0 102639.734 70658.51 85166.56 0.0 0.0 0.0 0.0 0.0 0.0 46 724 429.3732198853838 14.960373 100660.37333333334 44321.64000000001 0.0 0.0 157227.06 144754.06 0.0 0.0 132964.92 0.0 0.0 0.0 64 724.0 Spectral Match to (+)-.alpha.-Tocopherol from NIST14 725 600.4178790984064 15.009471 218386.24666666667 56789.16266666667 0.0 218819.95 181967.9 254370.89 38938.992 60879.016 70549.48 0.0 0.0 0.0 3 726 669.2923242415278 15.070121 109674.42633333332 0.0 0.0 115286.555 100801.99 112934.734 0.0 0.0 0.0 0.0 0.0 0.0 -1 727 600.4172446795143 15.123726 253420.97666666663 0.0 0.0 327674.3 207862.03 224726.6 0.0 0.0 0.0 0.0 0.0 0.0 3 728 583.4150415539449 15.190456 68019.63466666666 0.0 0.0 95463.77 59768.574 48826.56 0.0 0.0 0.0 0.0 0.0 0.0 3 729 584.4224925515047 15.190456 479514.6166666667 0.0 0.0 628270.4 353511.25 456762.2 0.0 0.0 0.0 0.0 0.0 0.0 3 729.0 Massbank:MSJ00118 Zeaxanthin 730 415.3000381573345 15.194084 92756.45166666666 0.0 0.0 104431.06 81787.24 92051.055 0.0 0.0 0.0 0.0 0.0 0.0 3 730.0 CHEBI:181076 731 783.5729184626285 15.211747 457830.2833333334 273707.4 0.0 823318.25 0.0 550172.6 0.0 0.0 821122.2 0.0 0.0 0.0 23 731.0 Spectral Match to 1-Oleoyl-2-palmitoyl-sn-glycero-3-phosphocholine from NIST14 732 932.630707623601 15.224842 1726224.7333333334 149595.19333333333 0.0 0.0 2725352.2 2453322.0 0.0 222109.69 226675.89 0.0 0.0 0.0 18 732.0 SQDG(16:0/18:3); [M+NH4]+ C43H80N1O12S1 733 583.4150117331668 15.265488 61278.51499999999 0.0 0.0 62350.562 45630.863 75854.12 0.0 0.0 0.0 0.0 0.0 0.0 3 734 600.4170910927302 15.265488 327851.2066666667 0.0 0.0 378298.84 234840.44 370414.34 0.0 0.0 0.0 0.0 0.0 0.0 3 735 599.4100925896558 15.269157 216987.52666666664 0.0 0.0 253082.52 198572.03 199308.03 0.0 0.0 0.0 0.0 0.0 0.0 3 736 638.4397038568458 15.269157 116101.995 0.0 0.0 113302.55 83827.375 151176.06 0.0 0.0 0.0 0.0 0.0 0.0 18 736.0 Spectral Match to 1-Hexadecanoyl-2-(9Z-octadecenoyl)-sn-glycero-3-phosphoethanolamine from NIST14 737 721.4523911932009 15.294224 75905.18333333333 0.0 0.0 59393.156 57891.66 110430.734 0.0 0.0 0.0 0.0 0.0 0.0 18 738 743.4344664937522 15.311943 252135.6833333333 0.0 0.0 144684.55 230390.78 381331.72 0.0 0.0 0.0 0.0 0.0 0.0 26 739 631.2529453619642 15.312467 50954.23533333334 0.0 0.0 51920.582 34400.934 66541.19 0.0 0.0 0.0 0.0 0.0 0.0 67 740 738.4788260849149 15.315608 135917.55333333334 0.0 0.0 108996.84 113078.62 185677.2 0.0 0.0 0.0 0.0 0.0 0.0 18 741 609.2711984272464 15.319219 733114.8866666667 0.0 0.0 634525.9 564434.7 1000384.06 0.0 0.0 0.0 0.0 0.0 0.0 8 741.0 3.10S-Hydroxypheophorbide a 742 625.2662328474194 15.333907 137660.67866666664 0.0 0.0 142009.94 88811.266 182160.83 0.0 0.0 0.0 0.0 0.0 0.0 8 743 829.5075036387854 15.341187 36934.29166666666 0.0 0.0 25389.275 31115.264 54298.336 0.0 0.0 0.0 0.0 0.0 0.0 26 744 236.16783409033744 15.343903 312785.99 0.0 138056.09333333335 228692.12 432698.38 276967.47 0.0 0.0 0.0 0.0 414168.28 0.0 95 745 357.24266691305826 15.348044 1129719.1 1098249.9200000002 1077519.6 1095342.8 1178336.4 1115478.1 850709.06 1560996.1 883044.6 632805.3 1058922.6 1540830.9 14 745.0 NCGC00380640-01!5-chloro-2,4-dihydroxy-6-methyl-3-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl]benzaldehyde 746 625.2661750933698 15.40667 502442.3866666667 0.0 0.0 470944.9 337552.66 698829.6 0.0 0.0 0.0 0.0 0.0 0.0 7 747 667.2765014927045 15.435233 455138.32666666666 0.0 0.0 423044.5 236804.58 705565.9 0.0 0.0 0.0 0.0 0.0 0.0 7 748 689.258425136485 15.435233 99617.389 0.0 0.0 86349.41 52547.277 159955.48 0.0 0.0 0.0 0.0 0.0 0.0 -1 749 448.3638922452072 15.4622555 0.0 28105.15 42501.98633333333 0.0 0.0 0.0 50807.74 33507.71 0.0 63221.977 29710.252 34573.73 -1 750 600.4172571091536 15.465566 362747.24 0.0 0.0 393086.75 303486.44 391668.53 0.0 0.0 0.0 0.0 0.0 0.0 3 751 583.4150932454661 15.47287 93100.46 0.0 0.0 97726.89 98594.14 82980.35 0.0 0.0 0.0 0.0 0.0 0.0 3 752 279.093841391454 15.501554 151735.90666666665 8407.166666666666 33160.056666666664 0.0 455207.72 0.0 0.0 25221.5 0.0 99480.17 0.0 0.0 82 753 282.2795551308557 15.5243635 185898.9833333333 0.0 0.0 173200.55 214248.4 170248.0 0.0 0.0 0.0 0.0 0.0 0.0 58 753.0 Spectral Match to .beta.-Citronellol from NIST14 754 651.2818728064489 15.582386 2178106.3666666667 0.0 0.0 2165543.5 1318649.4 3050126.2 0.0 0.0 0.0 0.0 0.0 0.0 8 755 673.2637607004893 15.582386 1461739.6 0.0 0.0 1461512.6 1029826.0 1893880.2 0.0 0.0 0.0 0.0 0.0 0.0 63 756 689.2377203836769 15.585625 51692.01 0.0 0.0 53518.582 34057.008 67500.44 0.0 0.0 0.0 0.0 0.0 0.0 -1 757 780.5537891126522 15.612569 952124.6333333332 1113151.1666666667 737772.18 0.0 1415434.5 1440939.4 0.0 1239746.0 2099707.5 0.0 1255890.1 957426.44 23 757.0 Spectral Match to N-Oleoyl-D-erythro-sphingosylphosphorylcholine from NIST14 758 840.546500197769 15.616952 64870.898 0.0 0.0 66664.484 76417.78 51530.43 0.0 0.0 0.0 0.0 0.0 0.0 18 759 609.271365745407 15.628054 1704871.4 19680.779666666665 0.0 1585712.1 1258050.6 2270851.5 36775.13 22267.209 0.0 0.0 0.0 0.0 8 759.0 3.10S-Hydroxypheophorbide a 760 608.263356791719 15.630944 62973.12899999999 0.0 0.0 58628.918 46622.555 83667.914 0.0 0.0 0.0 0.0 0.0 0.0 8 761 631.2531651955687 15.630944 211957.28000000003 0.0 0.0 198444.06 162756.38 274671.4 0.0 0.0 0.0 0.0 0.0 0.0 67 762 986.6050661249795 15.630955 67041.302 0.0 0.0 70686.75 68141.59 62295.566 0.0 0.0 0.0 0.0 0.0 0.0 18 762.0 Spectral Match to Dilinolenin (9c,12c,15c) from NIST14 763 748.4763047912363 15.633278 86834.578 14383.699333333332 0.0 82995.164 69508.586 107999.984 0.0 0.0 43151.098 0.0 0.0 0.0 66 764 657.2921024780879 15.634553 67243.868 0.0 0.0 84506.9 72039.45 45185.254 0.0 0.0 0.0 0.0 0.0 0.0 -1 765 584.4223721026763 15.769287 100410.95666666668 0.0 0.0 132095.14 75344.57 93793.16 0.0 0.0 0.0 0.0 0.0 0.0 89 766 591.2607344749631 15.769287 350420.3133333333 0.0 0.0 408876.28 242045.56 400339.1 0.0 0.0 0.0 0.0 0.0 0.0 8 767 589.2453071892586 15.786952 164810.88333333333 0.0 0.0 172029.22 138683.1 183720.33 0.0 0.0 0.0 0.0 0.0 0.0 8 768 824.5519393928802 15.786952 291478.0533333333 0.0 0.0 279585.5 210183.44 384665.22 0.0 0.0 0.0 0.0 0.0 0.0 18 768.0 Spectral Match to Stearidonic acid ethyl ester from NIST14 769 829.5072671377644 15.786952 359164.1333333333 0.0 0.0 347529.7 283920.7 446042.0 0.0 0.0 0.0 0.0 0.0 0.0 26 770 685.2866620637429 15.8306 108079.64333333333 0.0 0.0 130906.766 129596.73 63735.434 0.0 0.0 0.0 0.0 0.0 0.0 -1 771 234.0974136867844 15.8450775 432582.4666666666 113099.23333333334 0.0 496432.72 543004.9 258309.78 0.0 339297.7 0.0 0.0 0.0 0.0 85 772 615.2581654039924 15.845464 1058746.6 77320.31533333333 0.0 1025206.1 1072029.1 1079004.6 47861.402 95419.414 88680.13 0.0 0.0 0.0 21 773 413.3239878217669 15.845791 64032.323 0.0 0.0 65383.41 72067.016 54646.543 0.0 0.0 0.0 0.0 0.0 0.0 -1 774 591.2608927569216 15.855198 452778.86 0.0 0.0 435057.25 403159.8 520119.53 0.0 0.0 0.0 0.0 0.0 0.0 8 775 592.2685246979444 15.855899 4135696.233333333 47379.70133333333 0.0 3857592.2 3150999.5 5398497.0 0.0 72459.62 69679.484 0.0 0.0 0.0 8 776 593.276135792452 15.856303 42112957.333333336 956371.0 0.0 38257744.0 35211344.0 52869784.0 508414.6 1219918.9 1140779.5 0.0 0.0 0.0 8 776.0 Pheophorbide A 777 501.3762408107668 15.858727 71329.26333333334 0.0 0.0 75248.28 72827.17 65912.34 0.0 0.0 0.0 0.0 0.0 0.0 -1 778 578.2533032937885 15.858727 43338.13033333333 0.0 0.0 39755.434 35952.203 54306.754 0.0 0.0 0.0 0.0 0.0 0.0 -1 779 625.265266845087 15.858742 140666.7933333333 0.0 0.0 128958.945 124001.875 169039.56 0.0 0.0 0.0 0.0 0.0 0.0 8 780 637.2655178341028 15.858742 124967.39033333331 0.0 0.0 113017.586 109555.055 152329.53 0.0 0.0 0.0 0.0 0.0 0.0 8 781 595.2822321536019 15.8609915 2380056.1666666665 12495.94 0.0 0.0 2831387.0 4308781.5 37487.82 0.0 0.0 0.0 0.0 0.0 8 781.0 Pheophorbide A 782 623.2500130005425 15.865113 81345.28833333334 0.0 0.0 76842.52 65734.625 101458.72 0.0 0.0 0.0 0.0 0.0 0.0 -1 783 497.4243783843983 15.867422 89390.57666666666 87261.23666666666 0.0 0.0 183512.62 84659.11 0.0 103877.65 157906.06 0.0 0.0 0.0 36 783.0 Spectral Match to Nonaethylene glycol from NIST14 784 609.2703672131776 15.868657 134471.02 0.0 0.0 119309.87 111484.07 172619.12 0.0 0.0 0.0 0.0 0.0 0.0 8 785 607.2552052091722 15.871853 46498.76833333333 0.0 0.0 44157.742 36308.137 59030.426 0.0 0.0 0.0 0.0 0.0 0.0 8 786 457.3501663285441 15.876612 114535.87833333334 18928.693333333333 28838.04 116766.805 130149.74 96691.09 0.0 56786.08 0.0 0.0 0.0 86514.12 8 787 453.3983232525742 15.885543 22473.50533333333 0.0 125312.72166666666 0.0 0.0 67420.516 0.0 0.0 0.0 77565.195 152991.36 145381.61 36 787.0 Spectral Match to Nonaethylene glycol from NIST14 788 759.5729523863715 15.90358 0.0 478119.5866666666 108745.86666666664 0.0 0.0 0.0 0.0 614602.56 819756.2 0.0 0.0 326237.6 23 788.0 Spectral Match to 1-Oleoyl-2-palmitoyl-sn-glycero-3-phosphocholine from NIST14 789 758.5695324389661 15.905328 97053.54 1045227.8333333334 0.0 291160.62 0.0 0.0 0.0 1343544.6 1792138.9 0.0 0.0 0.0 23 789.0 Spectral Match to 1-Stearoyl-2-linoleoyl-sn-glycero-3-phosphocholine from NIST14 790 716.5223537768478 15.912628 15553.898333333333 484462.45333333337 0.0 46661.695 0.0 0.0 0.0 524649.8 928737.56 0.0 0.0 0.0 18 790.0 Spectral Match to 1-Hexadecanoyl-2-(9Z-octadecenoyl)-sn-glycero-3-phosphoethanolamine from NIST14 791 827.4916423508786 15.956616 132137.26333333334 0.0 0.0 136561.81 117910.21 141939.77 0.0 0.0 0.0 0.0 0.0 0.0 26 792 822.5362212604617 15.960034 99287.62666666666 0.0 0.0 81650.28 81671.24 134541.36 0.0 0.0 0.0 0.0 0.0 0.0 18 793 635.286978626238 15.965546 8310027.5 348215.2233333333 0.0 7308770.0 7361081.5 10260231.0 137293.27 404255.9 503096.5 0.0 0.0 0.0 8 794 634.279437711233 15.970192 332646.3133333333 14714.942 0.0 282622.0 289530.56 425786.38 0.0 21437.236 22707.59 0.0 0.0 0.0 8 795 657.2689736139241 15.971687 1084207.2333333334 107948.28166666666 0.0 1049998.9 1035530.0 1167092.8 30126.125 122225.56 171493.16 0.0 0.0 0.0 8 796 673.2425956132494 15.979397 67072.99733333333 0.0 0.0 56720.402 65714.73 78783.86 0.0 0.0 0.0 0.0 0.0 0.0 -1 797 431.35249392563367 16.009287 731843.7333333334 64015.35533333333 0.0 0.0 1450275.5 745255.7 0.0 84729.266 107316.8 0.0 0.0 0.0 64 798 822.536493439028 16.02126 65320.295000000006 0.0 0.0 58851.22 47120.215 89989.45 0.0 0.0 0.0 0.0 0.0 0.0 18 799 681.3288677236038 16.038893 30928.961666666662 0.0 0.0 32874.055 30013.137 29899.693 0.0 0.0 0.0 0.0 0.0 0.0 8 800 615.2582358064337 16.083487 254787.80666666667 0.0 0.0 227627.2 163308.69 373427.53 0.0 0.0 0.0 0.0 0.0 0.0 21 801 592.268537820321 16.087116 146723.82333333333 0.0 0.0 129275.24 82812.95 228083.28 0.0 0.0 0.0 0.0 0.0 0.0 8 802 593.2766674137335 16.087132 3247465.9 29244.563666666665 0.0 2740867.2 1880342.0 5121188.5 21040.105 66693.586 0.0 0.0 0.0 0.0 8 802.0 Pheophorbide A 803 600.4174530541612 16.088518 937986.4 104092.01833333333 0.0 882091.1 923312.8 1008555.3 27193.635 128602.26 156480.16 0.0 0.0 0.0 3 804 599.4101157543575 16.093554 523788.86 6279.946 0.0 444309.28 434502.4 692554.9 0.0 18839.838 0.0 0.0 0.0 0.0 3 805 434.2819184359143 16.09427 75868.22033333335 0.0 0.0 64357.508 59947.523 103299.63 0.0 0.0 0.0 0.0 0.0 0.0 3 806 761.1888351369917 16.09427 97264.69333333334 0.0 0.0 90827.18 72226.51 128740.39 0.0 0.0 0.0 0.0 0.0 0.0 8 806.0 Pheophytin a 807 641.2969033034001 16.105072 508479.6866666667 0.0 0.0 482623.78 402810.03 640005.25 0.0 0.0 0.0 0.0 0.0 0.0 46 808 663.2793009978105 16.105072 86089.25033333333 0.0 0.0 87283.945 70522.72 100461.086 0.0 0.0 0.0 0.0 0.0 0.0 -1 809 299.20106811794767 16.1289 209768.29666666663 0.0 0.0 200357.69 145980.73 282966.47 0.0 0.0 0.0 0.0 0.0 0.0 -1 810 607.2920514369245 16.142206 521549.6500000001 0.0 0.0 292083.06 244008.83 1028557.06 0.0 0.0 0.0 0.0 0.0 0.0 8 810.0 Pheophorbide A 811 653.297398898837 16.165873 91461.48666666668 0.0 0.0 87099.195 97870.305 89414.96 0.0 0.0 0.0 0.0 0.0 0.0 -1 812 657.2691262250186 16.165873 275228.03 0.0 0.0 261371.2 189994.61 374318.28 0.0 0.0 0.0 0.0 0.0 0.0 8 813 635.2869862186692 16.167423 1021129.2 22863.454 0.0 903421.5 624550.0 1535416.1 0.0 41254.266 27336.096 0.0 0.0 0.0 8 814 634.2795514524357 16.176237 87336.56933333333 0.0 0.0 83139.875 65385.703 113484.13 0.0 0.0 0.0 0.0 0.0 0.0 8 815 600.4176934704562 16.280315 373358.7766666667 13977.146666666667 0.0 438010.03 361814.1 320252.2 0.0 0.0 41931.44 0.0 0.0 0.0 3 816 653.2973341366541 16.288574 95077.95233333332 0.0 0.0 80003.79 47018.617 158211.45 0.0 0.0 0.0 0.0 0.0 0.0 8 817 824.5523278322631 16.320768 260125.16 0.0 0.0 294067.53 251105.12 235202.83 0.0 0.0 0.0 0.0 0.0 0.0 18 817.0 INT-767 818 829.5074152709816 16.324379 142787.2933333333 0.0 0.0 165470.67 136476.73 126414.48 0.0 0.0 0.0 0.0 0.0 0.0 -1 819 599.4103355340318 16.33996 114233.675 0.0 0.0 148893.69 106076.96 87730.375 0.0 0.0 0.0 0.0 0.0 0.0 3 820 780.5537133484748 16.347359 19254.126666666667 33548.32 24544.25533333333 0.0 0.0 57762.38 0.0 100644.96 0.0 0.0 73632.766 0.0 23 820.0 Spectral Match to N-Oleoyl-D-erythro-sphingosylphosphorylcholine from NIST14 821 535.270494854103 16.349901 201764.25666666668 0.0 0.0 107174.18 84732.15 413386.44 0.0 0.0 0.0 0.0 0.0 0.0 8 822 827.4919151072739 16.353563 47109.98533333334 0.0 0.0 49886.13 45619.01 45824.816 0.0 0.0 0.0 0.0 0.0 0.0 26 823 870.565747734796 16.367401 59795.451 0.0 0.0 52959.543 73741.19 52685.62 0.0 0.0 0.0 0.0 0.0 0.0 8 824 584.4224400306603 16.380919 354604.9066666667 0.0 0.0 417497.7 250903.05 395413.97 0.0 0.0 0.0 0.0 0.0 0.0 3 825 813.5126033813972 16.420671 352214.9266666667 0.0 0.0 342227.88 293117.34 421299.56 0.0 0.0 0.0 0.0 0.0 0.0 26 826 611.467616796287 16.424314 195231.03000000003 0.0 0.0 182775.0 156675.92 246242.17 0.0 0.0 0.0 0.0 0.0 0.0 18 826.0 Spectral Match to Eicosapentaenoic acid ethyl ester from NIST14 827 653.2974884154683 16.427439 197297.14 0.0 0.0 171367.08 123455.18 297069.16 0.0 0.0 0.0 0.0 0.0 0.0 8 828 600.4173553051716 16.433346 702344.9533333333 91707.508 0.0 729179.7 673726.06 704129.1 22491.748 99794.336 152836.44 0.0 0.0 0.0 3 829 808.5572481243122 16.434713 255730.6366666667 0.0 0.0 230749.38 208404.69 328037.84 0.0 0.0 0.0 0.0 0.0 0.0 18 830 599.4102099575832 16.436108 364132.4866666666 10731.431 0.0 333106.0 292901.66 466389.8 0.0 0.0 32194.293 0.0 0.0 0.0 3 831 434.2819166362004 16.438261 38375.47233333333 0.0 0.0 39954.793 30422.664 44748.96 0.0 0.0 0.0 0.0 0.0 0.0 3 832 435.2887079971849 16.438261 36860.87233333333 0.0 0.0 39143.98 33732.11 37706.527 0.0 0.0 0.0 0.0 0.0 0.0 3 833 583.4151970409847 16.445147 155356.44333333333 0.0 0.0 119043.76 185881.23 161144.34 0.0 0.0 0.0 0.0 0.0 0.0 3 834 584.4222508962561 16.446735 199889.96333333332 25983.944666666663 0.0 209680.11 152253.45 237736.33 0.0 27289.24 50662.594 0.0 0.0 0.0 89 835 613.2659581584002 16.470522 169899.99000000002 0.0 0.0 186900.88 157461.67 165337.42 0.0 0.0 0.0 0.0 0.0 0.0 -1 836 870.5657828860271 16.491598 73162.39833333333 0.0 0.0 70732.59 103663.96 45090.645 0.0 0.0 0.0 0.0 0.0 0.0 8 836.0 Pheophytin a 837 871.5729345488684 16.508245 629248.6066666666 0.0 0.0 369002.88 1135606.0 383136.94 0.0 0.0 0.0 0.0 0.0 0.0 8 837.0 Chlorophyll a 838 806.54168662266 16.518538 144655.07666666666 0.0 0.0 154081.22 126272.65 153611.36 0.0 0.0 0.0 0.0 0.0 0.0 18 839 811.4971251242586 16.518538 151890.6733333333 0.0 0.0 152043.55 127185.61 176442.86 0.0 0.0 0.0 0.0 0.0 0.0 26 840 789.5152222020914 16.532461 46262.411 0.0 0.0 49713.13 39371.273 49702.83 0.0 0.0 0.0 0.0 0.0 0.0 18 841 568.4264821196009 16.600586 1564795.9666666668 262994.9733333333 0.0 1367630.4 1578213.4 1748544.1 156891.88 332381.16 299711.88 0.0 0.0 0.0 3 841.0 CHEBI:181879 842 585.4275476108578 16.602032 431652.45333333337 8662.164666666666 0.0 418721.5 390011.8 486224.06 25986.494 0.0 0.0 0.0 0.0 0.0 3 842.0 CHEBI:181245 843 583.4151536275054 16.603046 564056.73 64627.37733333333 0.0 488314.97 520153.72 683701.5 24071.086 88407.28 81403.766 0.0 0.0 0.0 3 843.0 CHEBI:181245 844 567.4201703130815 16.603687 1512171.1 155824.25 0.0 1384808.9 1411936.9 1739767.5 73821.29 213365.19 180286.27 0.0 0.0 0.0 3 844.0 CHEBI:181245 845 584.4218182092715 16.604904 718108.2000000001 132408.851 0.0 558532.0 750918.3 844874.3 62357.633 165771.31 169097.61 0.0 0.0 0.0 3 845.0 CHEBI:181879 846 613.4235983540481 16.605387 139041.03666666665 0.0 0.0 142407.11 139852.94 134863.06 0.0 0.0 0.0 0.0 0.0 0.0 3 846.0 CHEBI:181879 847 629.4197823020507 16.605387 65519.283 0.0 0.0 67420.305 57823.164 71314.38 0.0 0.0 0.0 0.0 0.0 0.0 3 847.0 NCGC00381199-01_C25H38O4_(3aR,5E,7S,10E,14E,16aS)-2,7-Dihydroxy-3-[(2S)-1-hydroxy-2-propanyl]-6,10,14,16a-tetramethyl-4,7,8,9,12,13,16,16a-octahydrocyclopenta[15]annulen-1(3aH)-one 848 630.4265661495602 16.605387 67564.05133333334 0.0 0.0 59515.004 64890.41 78286.74 0.0 0.0 0.0 0.0 0.0 0.0 3 848.0 NCGC00381199-01_C25H38O4_(3aR,5E,7S,10E,14E,16aS)-2,7-Dihydroxy-3-[(2S)-1-hydroxy-2-propanyl]-6,10,14,16a-tetramethyl-4,7,8,9,12,13,16,16a-octahydrocyclopenta[15]annulen-1(3aH)-one 849 566.4116654625335 16.608961 68518.92866666666 0.0 0.0 58047.65 70956.766 76552.37 0.0 0.0 0.0 0.0 0.0 0.0 3 849.0 (2S,3S,4S,5R,6R)-6-[[(3S,4S,6aR,6bS,8R,8aR,9R,10R,12aS,14bR)-10-acetyloxy-8a-(acetyloxymethyl)-8,9-dihydroxy-4-(hydroxymethyl)-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-4-hydroxy-3,5-bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]oxane-2-carboxylic acid 850 612.4175167019096 16.613173 154029.39 23185.77133333333 0.0 155455.52 137206.62 169426.03 0.0 35315.984 34241.33 0.0 0.0 0.0 3 850.0 Massbank:MSJ00113 Lycopene-5,6-diol 851 600.4160510951285 16.655474 113282.34133333332 10800.675 0.0 111435.914 84067.88 144343.23 0.0 0.0 32402.025 0.0 0.0 0.0 3 852 599.4100335786369 16.656801 180269.5166666667 0.0 0.0 170508.58 163310.83 206989.14 0.0 0.0 0.0 0.0 0.0 0.0 3 853 234.09731079102824 16.687445 59169.37833333333 361881.4 0.0 94066.945 0.0 83441.19 0.0 0.0 1085644.2 0.0 0.0 0.0 85 854 341.13853718147857 16.687872 0.0 0.0 65426.01066666667 0.0 0.0 0.0 0.0 0.0 0.0 21734.992 78991.97 95551.07 24 854.0 Knemolic acid B 855 323.1281507233541 16.690187 0.0 5023.333333333333 266511.30666666664 0.0 0.0 0.0 0.0 15070.0 0.0 91764.2 316030.1 391739.62 24 855.0 4,4'-Dimethoxychalcone 856 653.2970086729658 16.690865 795481.0666666668 15635.786333333332 0.0 587346.1 371521.0 1427576.1 29001.105 17906.254 0.0 0.0 0.0 0.0 7 857 652.2897068921405 16.697603 31759.39633333333 4314.175 0.0 63353.484 31924.705 0.0 0.0 12942.525 0.0 0.0 0.0 0.0 -1 858 870.5656576201451 16.713228 156809.6066666667 0.0 0.0 118539.32 193014.73 158874.77 0.0 0.0 0.0 0.0 0.0 0.0 8 858.0 Pheophytin a 859 871.5725710692988 16.713228 681472.6533333333 0.0 0.0 404304.06 851239.3 788874.6 0.0 0.0 0.0 0.0 0.0 0.0 8 859.0 Chlorophyll a 860 610.6251418436163 16.750942 0.0 58015.81666666667 46788.72 0.0 0.0 0.0 0.0 84651.83 89395.62 0.0 81758.086 58608.074 50 861 659.2843405365837 16.766327 145799.69 0.0 0.0 141859.2 101925.18 193614.69 0.0 0.0 0.0 0.0 0.0 0.0 63 862 637.3013651195198 16.769728 1437212.9799999995 66119.46233333334 0.0 1347724.5 945081.44 2018833.0 106758.52 63586.867 28013.0 0.0 0.0 0.0 8 862.0 3.10S-Hydroxypheophorbide a 863 636.2950729677524 16.780737 363056.6566666667 70624.94066666666 0.0 390148.16 288266.06 410755.75 108233.695 72425.92 31215.207 0.0 0.0 0.0 8 864 341.13864327992343 16.845726 0.0 0.0 248360.9833333333 0.0 0.0 0.0 0.0 0.0 0.0 79068.01 282252.56 383762.38 24 864.0 Knemolic acid B 865 323.1282045585874 16.848984 0.0 24810.786666666667 990691.2866666669 0.0 0.0 0.0 0.0 74432.36 0.0 340989.56 1108597.5 1522486.8 24 865.0 4,4'-Dimethoxychalcone 866 871.5723680077882 16.849508 832502.6666666666 0.0 0.0 434392.8 975610.3 1087504.9 0.0 0.0 0.0 0.0 0.0 0.0 8 866.0 Chlorophyll a 867 870.5659710721942 16.855453 339330.87999999995 0.0 0.0 247364.2 401808.5 368819.94 0.0 0.0 0.0 0.0 0.0 0.0 8 867.0 Pheophytin a 868 205.1953548128104 16.875536 0.0 0.0 211205.96566666663 0.0 0.0 0.0 0.0 0.0 0.0 59783.867 246227.5 327606.53 10 868.0 Bisabolol CollisionEnergy:205060 869 587.5493063836734 16.878809 0.0 188320.6233333333 90578.79333333332 0.0 0.0 0.0 0.0 300404.25 264557.62 0.0 0.0 271736.38 8 870 567.4200796539757 16.882978 108844.325 0.0 0.0 97542.96 122748.96 106241.055 0.0 0.0 0.0 0.0 0.0 0.0 3 870.0 NCGC00381199-01_C25H38O4_(3aR,5E,7S,10E,14E,16aS)-2,7-Dihydroxy-3-[(2S)-1-hydroxy-2-propanyl]-6,10,14,16a-tetramethyl-4,7,8,9,12,13,16,16a-octahydrocyclopenta[15]annulen-1(3aH)-one 871 610.625096531858 16.883942 0.0 104295.22666666668 56899.282666666666 0.0 0.0 0.0 0.0 124690.04 188195.64 0.0 117757.93 52939.918 50 872 565.5673052335591 16.886215 70895.58333333333 607687.9333333333 656989.5833333334 212686.75 0.0 0.0 0.0 667507.2 1155556.6 0.0 1192548.0 778420.75 50 873 566.5706340408456 16.893557 27121.35 233672.68666666668 153719.62666666668 81364.05 0.0 0.0 0.0 255509.28 445508.78 0.0 461158.88 0.0 50 874 584.4216702793674 16.910444 155876.12 0.0 0.0 179004.69 147859.69 140763.98 0.0 0.0 0.0 0.0 0.0 0.0 3 875 619.292126871686 16.917765 33729.535 0.0 0.0 38858.355 24565.67 37764.58 0.0 0.0 0.0 0.0 0.0 0.0 8 876 323.1283079499228 16.983465 0.0 0.0 182467.09666666668 0.0 0.0 0.0 0.0 0.0 0.0 43247.24 230308.3 273845.75 24 876.0 4,4'-Dimethoxychalcone 877 663.4545273627155 17.007053 42289.06766666667 0.0 132578.24666666667 48446.69 29877.473 48543.04 0.0 0.0 0.0 224526.05 0.0 173208.69 32 877.0 L-phenylalanine_dodecanoic acid 878 680.4810068007021 17.014526 22741.06233333333 0.0 89429.85666666667 33999.445 0.0 34223.742 0.0 0.0 0.0 150127.88 0.0 118161.69 32 878.0 L-phenylalanine_dodecanoic acid 879 621.3068674862134 17.042088 8168710.5 1651761.5 31915.491 8306882.0 7380685.5 8818564.0 1049467.6 1915139.1 1990677.8 21237.053 35196.21 39313.21 8 879.0 Pheophorbide A 880 620.3004696600357 17.043848 1937777.0 537786.3333333334 8196.256 2015644.1 1604829.1 2192857.8 401884.06 582950.44 628524.5 0.0 0.0 24588.768 8 881 643.289521602258 17.06044 111026.86 83691.95166666666 0.0 85912.46 113133.82 134034.3 57871.145 99182.27 94022.44 0.0 0.0 0.0 8 882 665.2968748983963 17.06312 70590.93833333334 0.0 0.0 71513.945 62297.03 77961.84 0.0 0.0 0.0 0.0 0.0 0.0 8 883 708.5118622688665 17.07987 10853.735 55743.41666666666 27042.47333333333 32561.205 0.0 0.0 0.0 0.0 167230.25 0.0 0.0 81127.42 32 883.0 L-phenylalanine_dodecanoic acid 884 470.36347214387337 17.09019 0.0 5261.491333333333 23562.656 0.0 0.0 0.0 0.0 0.0 15784.474 17650.61 25549.014 27488.344 64 885 447.28760248052095 17.090754 0.0 65130.871666666666 86880.488 0.0 0.0 0.0 39940.63 101442.13 54009.855 47609.13 110665.164 102367.17 -1 886 425.3055592337807 17.092546 182481.61666666667 247648.06333333327 325125.16333333333 172631.27 167646.31 207167.27 141637.17 375191.62 226115.4 179490.52 400773.94 395111.03 64 886.0 NCGC00380368-01!methyl 3,15,21-tris[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]docosanoate 887 619.2918912084014 17.102898 48365.55666666666 0.0 0.0 39691.36 46074.23 59331.08 0.0 0.0 0.0 0.0 0.0 0.0 8 888 643.2893384190812 17.19935 111068.94666666666 0.0 0.0 139467.88 84991.62 108747.34 0.0 0.0 0.0 0.0 0.0 0.0 8 889 621.3068131160026 17.217493 2738093.4 218721.6533333333 0.0 2521977.5 2417314.2 3274988.5 136114.72 371920.44 148129.8 0.0 0.0 0.0 8 889.0 Pheophorbide A 890 620.3003979999877 17.21871 647353.6466666666 142275.24666666667 0.0 675282.4 608800.6 657977.94 112134.54 220161.39 94529.81 0.0 0.0 0.0 8 891 796.5939257058483 17.248676 505828.6 272512.0266666667 224485.50833333333 0.0 909564.9 607920.9 126743.89 266831.66 423960.53 107290.445 259083.52 307082.56 18 891.0 DG(18:2/0:0/18:2); [M+NH4]+ C39H72N1O5 892 801.5494131171647 17.256327 110761.01 138323.94 116682.23133333334 0.0 211078.31 121204.72 85389.84 132220.64 197361.34 61652.14 130167.414 158227.14 26 892.0 Candidate GABA-C18:2 (delta mass:262.2306) 893 635.322508893537 17.260612 682754.0066666667 0.0 0.0 330082.56 431142.66 1287036.8 0.0 0.0 0.0 0.0 0.0 0.0 8 894 567.4200237766154 17.285866 490673.9733333333 6673.035666666667 0.0 473603.66 413609.16 584809.1 0.0 0.0 20019.107 0.0 0.0 0.0 3 894.0 CHEBI:181245 895 566.4118600371949 17.28701 27340.142666666667 0.0 0.0 25897.883 26847.697 29274.848 0.0 0.0 0.0 0.0 0.0 0.0 3 895.0 (2S,3S,4S,5R,6R)-6-[[(3S,4S,6aR,6bS,8R,8aR,9R,10R,12aS,14bR)-10-acetyloxy-8a-(acetyloxymethyl)-8,9-dihydroxy-4-(hydroxymethyl)-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-4-hydroxy-3,5-bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]oxane-2-carboxylic acid 896 584.421447278875 17.28701 142125.19666666666 0.0 0.0 138300.83 132314.92 155759.84 0.0 0.0 0.0 0.0 0.0 0.0 3 896.0 Massbank:MSJ00113 Lycopene-5,6-diol 897 613.4232665978337 17.28701 38732.780666666666 0.0 0.0 37568.77 38200.67 40428.902 0.0 0.0 0.0 0.0 0.0 0.0 3 897.0 Massbank:MSJ00114 Nostoxanthin 898 612.4173657391578 17.294336 45260.14233333333 0.0 0.0 43576.055 45999.434 46204.938 0.0 0.0 0.0 0.0 0.0 0.0 3 898.0 Massbank:MSJ00121 Antheraxanthin nf_output/networking/clustersummary_with_groups.tsv0000644000000000000000000034373614664572151022310 0ustar rootrootcluster index parent mass RTMean ATTRIBUTE_Tissue:GNPSGROUP:Leaf ATTRIBUTE_Tissue:GNPSGROUP:Stem ATTRIBUTE_Tissue:GNPSGROUP:Root ATTRIBUTE_Replicate:GNPSGROUP:Leaf-r1 ATTRIBUTE_Replicate:GNPSGROUP:Leaf-r2 ATTRIBUTE_Replicate:GNPSGROUP:Leaf-r3 ATTRIBUTE_Replicate:GNPSGROUP:Stem-r1 ATTRIBUTE_Replicate:GNPSGROUP:Stem-r2 ATTRIBUTE_Replicate:GNPSGROUP:Stem-r3 ATTRIBUTE_Replicate:GNPSGROUP:Root-r1 ATTRIBUTE_Replicate:GNPSGROUP:Root-r2 ATTRIBUTE_Replicate:GNPSGROUP:Root-r3 1 235.95235951583567 0.8630479 42530.30566666666 47885.30433333333 49566.950000000004 45913.39 46763.703 34913.824 58779.19 44557.34 40319.383 60850.023 42382.71 45468.117 2 263.94717631156794 0.8636649 55832.96133333333 61651.73766666666 61658.44666666666 57624.188 60954.348 48920.348 75217.81 55883.473 53853.93 72569.14 53694.32 58711.88 3 249.92600383577096 0.8651288 48572.51233333334 44929.85666666667 49910.793 54626.785 54707.94 36382.812 53545.68 41897.48 39346.41 56053.367 45887.348 47791.664 4 244.94709660278235 0.8658273 84946.74333333333 80312.65466666665 89191.73666666665 95774.84 96472.29 62593.1 92545.734 76273.94 72118.29 99304.71 81280.4 86990.1 5 221.9313120112868 0.86600614 24560.259000000002 23014.102666666662 24446.834666666662 36778.492 36902.285 0.0 38795.734 30246.574 0.0 39821.734 0.0 33518.77 6 272.94226277315965 0.86682564 85573.29166666667 79424.40333333334 89502.99866666667 95264.555 99530.46 61924.86 89143.15 76867.51 72262.55 95548.12 84927.766 88033.11 7 336.90143746124033 0.8730385 17720.397666666668 18380.396666666667 34112.44066666667 24905.498 28255.695 0.0 30772.68 24368.51 0.0 41192.035 29968.484 31176.803 8 260.01035836677653 0.8747634 22205.164666666667 18221.888666666666 45963.17966666666 30661.984 35953.51 0.0 0.0 30792.254 23873.412 33893.625 55402.07 48593.844 9 218.98402928602343 0.87498426 117323.72866666668 119002.65666666668 262751.89666666667 145384.47 172040.45 34546.266 131642.14 124490.33 100875.5 303219.6 249149.78 235886.31 10 270.946117262364 0.87572044 26265.553333333333 26957.371666666662 63905.768000000004 35552.86 43243.8 0.0 26953.066 31889.336 22029.713 66366.14 63819.406 61531.758 11 385.8762917132882 0.87589514 19475.217666666667 15179.158000000001 35163.79833333333 27147.309 31278.344 0.0 23819.857 21717.617 0.0 38409.31 33323.062 33759.023 12 201.97430940110075 0.8763963 40290.534 41814.56766666666 108385.36499999999 53631.742 67239.86 0.0 47071.984 44824.965 33546.754 121711.79 104411.36 99032.945 13 220.98162801917667 0.8763999 26623.449000000004 29242.335000000003 65698.33466666668 35692.773 44177.574 0.0 32940.055 31667.725 23119.225 74547.97 62320.94 60226.094 14 243.99749036040288 0.87675744 139769.89566666665 139187.32 318540.62666666665 167709.08 209993.88 41606.727 140684.88 156172.64 120704.44 343091.47 319064.97 293465.44 15 265.01589406340787 0.8770558 66571.31999999999 69867.519 168822.34 85084.81 114629.15 0.0 68246.69 82128.07 59227.797 174289.83 171734.19 160443.0 16 200.97331483569008 0.8773614 205313.67333333334 195965.24 475017.38999999996 249504.27 302565.72 63871.03 221097.67 207366.39 159431.66 540984.0 459389.2 424678.97 17 223.989432386154 0.8773614 599250.5066666667 573388.5766666667 1452661.2333333334 720386.06 916921.44 160444.02 597237.56 640796.2 482131.97 1572880.8 1431455.0 1353647.9 18 224.9905829016253 0.8773614 161330.179 155364.39333333334 414323.3366666666 192929.92 252893.75 38166.867 158928.97 179774.56 127389.65 446993.47 412218.38 383758.16 19 241.9999188305008 0.8773614 514422.26 504699.00666666665 1154345.2333333334 609154.8 780395.5 153716.48 516568.72 568117.2 429411.1 1250916.2 1144767.5 1067352.0 20 268.94832600566565 0.8773614 67581.28733333333 62420.848999999995 164137.07666666666 81321.805 103208.93 18213.127 58137.777 74565.37 54559.4 170650.4 170195.83 151565.0 21 286.95909171566205 0.87773526 36911.51 42408.771 82048.40333333334 50072.21 60662.32 0.0 39659.273 47405.65 40161.39 82697.08 88426.63 75021.5 22 382.9290861885838 0.87773526 45767.42333333334 44944.742666666665 132585.87000000002 59018.504 78283.766 0.0 40740.895 55550.293 38543.04 136306.72 135368.2 126082.69 23 400.9396554577765 0.8778197 26326.535666666663 17480.375666666667 71512.68766666666 34677.617 44301.99 0.0 0.0 30900.148 21540.979 74515.414 75195.055 64827.594 24 413.8713109402861 0.8781464 14493.870666666668 0.0 20173.411666666667 18939.342 24542.27 0.0 0.0 0.0 0.0 31932.479 0.0 28587.756 25 287.9601006778761 0.87923694 7727.373666666666 0.0 30971.160333333333 0.0 23182.121 0.0 0.0 0.0 0.0 31622.719 31939.645 29351.117 26 337.97006661269904 0.87923515 8121.208333333333 6226.266666666666 36406.314999999995 0.0 24363.625 0.0 0.0 18678.8 0.0 36157.195 36801.406 36260.344 27 232.9234154923418 0.8794258 0.0 17328.118 28636.267666666667 0.0 0.0 0.0 27302.012 24682.342 0.0 32227.652 27636.137 26045.014 28 255.93923050160188 0.8797364 76407.90233333333 89612.90333333332 104633.33333333333 81860.984 95044.2 52318.523 90685.02 90176.68 87977.01 111550.44 103917.6 98431.96 29 320.8668417294272 0.9325844 12408.304666666665 4646.1613333333335 17016.339666666667 22502.871 0.0 14722.043 0.0 13938.484 0.0 0.0 27612.988 23436.031 30 352.8164424963716 0.93749416 10244.770333333334 5271.441666666667 6040.344333333333 0.0 15531.625 15202.686 0.0 15814.325 0.0 0.0 18121.033 0.0 31 231.98887202790107 0.938467 0.0 33409.77333333334 8490.891333333333 0.0 0.0 0.0 48412.95 51816.37 0.0 0.0 0.0 25472.674 32 526.757964638743 0.9510151 57867.79 82260.01 85207.942 0.0 91537.67 82065.7 96434.74 64528.0 85817.29 88175.94 75463.836 91984.05 33 206.88616502603367 0.9513825 555099.2799999999 652877.3266666667 448766.42 500863.9 592346.94 572087.0 632859.1 563649.44 762123.44 503537.8 439874.06 402887.4 34 290.847756064801 0.9513825 859460.9133333332 1007210.9133333332 692862.32 777419.44 913822.4 887140.9 967092.94 879936.4 1174603.4 772030.5 687151.4 619405.06 35 292.8458648863933 0.9513825 240588.54333333333 292254.01 200541.4833333333 223199.11 241979.12 256587.4 281193.5 253559.47 342009.06 222664.94 196952.73 182006.78 36 208.88428794577712 0.95190936 81736.56166666666 144900.28 98941.18 0.0 119888.805 125320.88 138531.81 126332.22 169836.81 110356.77 97584.74 88882.03 37 381.0799637627612 0.9809907 248409.07666666666 154443.20333333334 106816.12333333334 352225.88 108095.45 284905.9 126010.92 121551.3 215767.39 108932.94 106215.17 105300.26 38 705.1858030707835 0.9825038 77576.54666666668 0.0 317177.4033333333 0.0 0.0 232729.64 0.0 0.0 0.0 240262.83 363935.94 347333.44 39 304.15077771272104 0.9891212 339422.7833333333 0.0 0.0 374600.44 239620.69 404047.22 0.0 0.0 0.0 0.0 0.0 0.0 40 242.10257615471133 0.99513865 0.0 0.0 108639.52 0.0 0.0 0.0 0.0 0.0 0.0 92571.34 111893.55 121453.67 41 203.15051454158848 0.99597985 66820.25666666667 0.0 537845.6533333333 0.0 0.0 200460.77 0.0 0.0 0.0 440106.16 530833.2 642597.6 42 684.2563835620325 0.99713117 106862.393 18516.080666666665 165590.04166666666 124763.21 79578.805 116245.164 0.0 55548.242 0.0 98673.375 202768.17 195328.58 43 543.1328094836607 0.9975011 106252.27933333332 26086.86333333333 58816.53 125134.19 46184.598 147438.05 0.0 0.0 78260.59 0.0 87133.56 89316.03 44 487.16626878371886 0.9998968 12665.993333333334 0.0 48432.21 0.0 0.0 37997.98 0.0 0.0 0.0 0.0 75233.16 70063.47 45 505.1767157318995 1.0025502 45312.21666666667 0.0 72844.40999999999 67404.9 0.0 68531.75 0.0 0.0 0.0 0.0 110094.0 108439.23 46 258.1102096560252 1.0029247 220949.86333333337 618476.7866666667 0.0 310047.25 0.0 352802.34 1175971.9 329606.34 349852.12 0.0 0.0 0.0 47 558.0887101739319 1.0143573 96200.75666666667 54646.003666666664 54474.416666666664 122349.94 56273.74 109978.59 60159.074 51232.867 52546.07 73930.18 0.0 89493.07 48 527.1586302430198 1.0186338 55089.49 0.0 37071.085 80985.52 0.0 84282.95 0.0 0.0 0.0 0.0 52931.105 58282.15 49 522.2034335100329 1.021157 188190.26333333334 36172.88333333333 118082.38333333332 245633.9 56663.23 262273.66 0.0 48521.69 59996.96 59482.2 143236.55 151528.4 50 490.1770443768973 1.0225846 107713.76199999999 22117.793333333335 69828.2 127884.266 0.0 195257.02 0.0 66353.38 0.0 0.0 102601.14 106883.46 51 261.0370594481031 1.028642 13577.983333333332 0.0 33380.72 0.0 0.0 40733.95 0.0 0.0 0.0 0.0 53059.336 47082.824 52 343.12391955501664 1.0309296 87030.27333333333 38611.26933333334 58698.085 128170.71 0.0 132920.11 29826.125 35465.406 50542.277 30613.035 74457.13 71024.09 53 325.1134962119126 1.0313233 208637.86333333337 118174.39666666667 169886.17 261670.05 69533.34 294710.2 115201.21 108965.43 130356.55 110186.94 203672.84 195798.73 54 233.9826083616101 1.0338651 0.0 36530.25466666667 12635.163999999999 0.0 0.0 0.0 67893.6 41697.164 0.0 37905.492 0.0 0.0 55 204.0870120681469 1.0350262 21039.561333333335 29359.84833333333 0.0 0.0 0.0 63118.684 49574.895 38504.65 0.0 0.0 0.0 0.0 56 353.9519745544646 1.0361236 42942.59733333333 0.0 0.0 43388.78 44667.77 40771.242 0.0 0.0 0.0 0.0 0.0 0.0 57 305.9675770561728 1.0375172 0.0 84556.98666666668 27772.656666666666 0.0 0.0 0.0 147732.14 105938.82 0.0 83317.97 0.0 0.0 58 323.9782103682032 1.0375172 0.0 55326.36333333334 19542.768333333333 0.0 0.0 0.0 96371.38 69607.71 0.0 58628.305 0.0 0.0 59 360.15037950586617 1.0386146 228496.2666666667 138193.44333333333 133624.22166666668 284874.1 79632.76 320981.94 114657.84 133540.6 166381.89 106169.375 157458.1 137245.19 60 396.03567737984815 1.0386146 93820.75666666667 88720.34333333334 56249.204999999994 127219.086 40806.484 113436.7 87004.87 75491.71 103664.45 53660.242 63216.383 51870.99 61 331.88690461413887 1.0405837 0.0 40223.01933333333 45233.56 0.0 0.0 0.0 0.0 36208.938 84460.12 43699.5 57633.094 34368.086 62 259.9016676560984 1.0415977 0.0 18590.020666666667 24138.28 0.0 0.0 0.0 0.0 0.0 55770.062 35400.31 37014.53 0.0 63 210.93310757777 1.0422212 0.0 19631.375 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1.1532425 10982.356666666667 18378.968333333334 23769.179 0.0 32947.07 0.0 32570.69 0.0 22566.215 0.0 36660.977 34646.56 79 222.06118763366143 1.2072697 477930.10000000003 1180864.4000000001 664281.84 423244.62 578846.56 431699.12 1139284.6 1056142.8 1347165.8 710901.56 704052.4 577891.56 80 227.01660855538984 1.2072697 141930.86 325159.27999999997 177869.9833333333 128467.87 153558.81 143765.9 320072.88 304507.16 350897.8 192396.28 186925.23 154288.44 81 316.1396173473288 1.2198966 53116.47400000001 22399.521333333334 72234.74066666666 57461.137 32827.395 69060.89 35342.906 31855.658 0.0 118924.73 55233.715 42545.777 82 358.113483049946 1.2251896 200841.05666666664 578221.0966666667 384812.9166666667 268075.7 0.0 334447.47 559826.6 786314.44 388522.25 489896.34 352193.88 312348.53 83 248.02451459210872 1.2316294 176904.44333333336 132862.10133333332 57363.45333333333 187679.58 152964.69 190069.06 145719.02 149457.62 103409.664 104171.67 0.0 67918.69 84 303.1344714596457 1.2360374 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233672.68666666668 153719.62666666668 81364.05 0.0 0.0 0.0 255509.28 445508.78 0.0 461158.88 0.0 874 584.4216702793674 16.910444 155876.12 0.0 0.0 179004.69 147859.69 140763.98 0.0 0.0 0.0 0.0 0.0 0.0 875 619.292126871686 16.917765 33729.535 0.0 0.0 38858.355 24565.67 37764.58 0.0 0.0 0.0 0.0 0.0 0.0 876 323.1283079499228 16.983465 0.0 0.0 182467.09666666668 0.0 0.0 0.0 0.0 0.0 0.0 43247.24 230308.3 273845.75 877 663.4545273627155 17.007053 42289.06766666667 0.0 132578.24666666667 48446.69 29877.473 48543.04 0.0 0.0 0.0 224526.05 0.0 173208.69 878 680.4810068007021 17.014526 22741.062333333335 0.0 89429.85666666667 33999.445 0.0 34223.742 0.0 0.0 0.0 150127.88 0.0 118161.69 879 621.3068674862134 17.042088 8168710.5 1651761.5 31915.490999999998 8306882.0 7380685.5 8818564.0 1049467.6 1915139.1 1990677.8 21237.053 35196.21 39313.21 880 620.3004696600357 17.043848 1937777.0 537786.3333333334 8196.256 2015644.1 1604829.1 2192857.8 401884.06 582950.44 628524.5 0.0 0.0 24588.768 881 643.289521602258 17.06044 111026.86 83691.95166666666 0.0 85912.46 113133.82 134034.3 57871.145 99182.27 94022.44 0.0 0.0 0.0 882 665.2968748983963 17.06312 70590.93833333334 0.0 0.0 71513.945 62297.03 77961.84 0.0 0.0 0.0 0.0 0.0 0.0 883 708.5118622688665 17.07987 10853.735 55743.416666666664 27042.47333333333 32561.205 0.0 0.0 0.0 0.0 167230.25 0.0 0.0 81127.42 884 470.36347214387337 17.09019 0.0 5261.491333333333 23562.656 0.0 0.0 0.0 0.0 0.0 15784.474 17650.61 25549.014 27488.344 885 447.28760248052095 17.090754 0.0 65130.871666666666 86880.488 0.0 0.0 0.0 39940.63 101442.13 54009.855 47609.13 110665.164 102367.17 886 425.3055592337807 17.092546 182481.61666666667 247648.06333333332 325125.16333333333 172631.27 167646.31 207167.27 141637.17 375191.62 226115.4 179490.52 400773.94 395111.03 887 619.2918912084014 17.102898 48365.556666666664 0.0 0.0 39691.36 46074.23 59331.08 0.0 0.0 0.0 0.0 0.0 0.0 888 643.2893384190812 17.19935 111068.94666666666 0.0 0.0 139467.88 84991.62 108747.34 0.0 0.0 0.0 0.0 0.0 0.0 889 621.3068131160026 17.217493 2738093.4 218721.65333333332 0.0 2521977.5 2417314.2 3274988.5 136114.72 371920.44 148129.8 0.0 0.0 0.0 890 620.3003979999877 17.21871 647353.6466666666 142275.24666666667 0.0 675282.4 608800.6 657977.94 112134.54 220161.39 94529.81 0.0 0.0 0.0 891 796.5939257058483 17.248676 505828.60000000003 272512.0266666667 224485.50833333333 0.0 909564.9 607920.9 126743.89 266831.66 423960.53 107290.445 259083.52 307082.56 892 801.5494131171647 17.256327 110761.01000000001 138323.94 116682.23133333334 0.0 211078.31 121204.72 85389.84 132220.64 197361.34 61652.14 130167.414 158227.14 893 635.322508893537 17.260612 682754.0066666667 0.0 0.0 330082.56 431142.66 1287036.8 0.0 0.0 0.0 0.0 0.0 0.0 894 567.4200237766154 17.285866 490673.9733333333 6673.035666666667 0.0 473603.66 413609.16 584809.1 0.0 0.0 20019.107 0.0 0.0 0.0 895 566.4118600371949 17.28701 27340.142666666667 0.0 0.0 25897.883 26847.697 29274.848 0.0 0.0 0.0 0.0 0.0 0.0 896 584.421447278875 17.28701 142125.19666666666 0.0 0.0 138300.83 132314.92 155759.84 0.0 0.0 0.0 0.0 0.0 0.0 897 613.4232665978337 17.28701 38732.780666666666 0.0 0.0 37568.77 38200.67 40428.902 0.0 0.0 0.0 0.0 0.0 0.0 898 612.4173657391578 17.294336 45260.14233333333 0.0 0.0 43576.055 45999.434 46204.938 0.0 0.0 0.0 0.0 0.0 0.0 nf_output/networking/network.graphml0000644000000000000000000376714214664574442017077 0ustar rootroot 0.0 0.0 63019.995 0.0 0.0 0.0 0.0 0.0 0.0 83769.805 67310.89 37979.29 274.1078 4.08 4.08 0 6 Paprazine O=C(C=CC1=CC=C(O)C=C1)NCCC2=CC=C(O)C=C2 InChI=1S/C17H17NO3/c19-15-6-1-13(2-7-15)5-10-17(21)18-12-11-14-3-8-16(20)9-4-14/h1-10,19-20H,11-12H2,(H,18,21) 275228.03 0.0 0.0 261371.2 189994.61 374318.28 0.0 0.0 0.0 0.0 0.0 0.0 657.2691 16.17 16.17 0 8 2816469.833333333 558860.4999999999 2517725.333333333 2394441.8 2809667.2 3245300.5 611261.7 421775.2 643544.6 2180122.2 2701326.0 2671727.8 221.0812 9.07 9.07 0 34 Piplartine COc1cc(/C=C/C(=O)N2CCC=CC2=O)cc(OC)c1OC InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+ 221791.35 0.0 0.0 176658.31 234620.08 254095.66 0.0 0.0 0.0 0.0 0.0 0.0 318.1553 2.73 2.73 0 39 Salidroside OC[C@H]1O[C@@H](OCCc2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O InChI=1S/C14H20O7/c15-7-10-11(17)12(18)13(19)14(21-10)20-6-5-8-1-3-9(16)4-2-8/h1-4,10-19H,5-7H2/t10-,11-,12+,13-,14-/m1/s1 0.0 52860.58933333333 0.0 0.0 0.0 0.0 41872.816 91858.53 24850.422 0.0 0.0 0.0 337.1076 10.72 10.72 0 24 NCGC00180457-02!4-(1,3-benzodioxol-5-ylmethyl)-3-[(3,4-dimethoxyphenyl)methyl]oxolan-2-one [IIN-based on: CCMSLIB00000847667] COC1=C(OC)C=C(CC2C(CC3=CC4=C(OCO4)C=C3)COC2=O)C=C1 InChI=1S/C21H22O6/c1-23-17-5-3-14(9-19(17)24-2)8-16-15(11-25-21(16)22)7-13-4-6-18-20(10-13)27-12-26-18/h3-6,9-10,15-16H,7-8,11-12H2,1-2H3 26444.971666666668 0.0 0.0 25955.508 22812.979 30566.428 0.0 0.0 0.0 0.0 0.0 0.0 383.1495 10.26 10.26 0 24 36934.29166666666 0.0 0.0 25389.275 31115.264 54298.336 0.0 0.0 0.0 0.0 0.0 0.0 829.5075 15.34 15.34 0 26 804883.6 196144.298 59383.791000000005 685526.75 815109.25 914014.8 75437.234 159658.0 353337.66 43693.613 70475.96 63981.8 657.2424 8.02 8.02 0 4 66571.31999999999 69867.519 168822.34 85084.81 114629.15 0.0 68246.69 82128.07 59227.797 174289.83 171734.19 160443.0 265.0159 0.88 0.88 0 5 0.0 0.0 133119.37666666668 0.0 0.0 0.0 0.0 0.0 0.0 76045.69 148648.19 174664.25 205.0862 9.2 9.2 0 34 22311.65566666667 96724.72766666666 465856.08 33853.527 0.0 33081.44 83889.12 152183.86 54101.203 274340.44 465632.7 657595.1 205.1954 12.92 12.92 0 10 5-(5-methoxycarbonyl-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl)-3-methylpentanoic acid C=C1CCC2C(C)(C(=O)OC)CCCC2(C)C1CCC(C)CC(=O)O InChI=1S/C21H34O4/c1-14(13-18(22)23)7-9-16-15(2)8-10-17-20(16,3)11-6-12-21(17,4)19(24)25-5/h14,16-17H,2,6-13H2,1,3-5H3,(H,22,23) 96941.86 62649.37333333333 0.0 113712.71 72617.22 104495.65 52317.99 80189.28 55440.85 0.0 0.0 0.0 330.2069 5.18 5.18 0 15 0.0 8459.698666666667 85480.01833333333 0.0 0.0 0.0 0.0 25379.096 0.0 85283.09 71631.195 99525.77 341.1389 7.66 7.66 0 24 NCGC00347864-02!5-[6-(3-hydroxy-4-methoxyphenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-3-yl]-2-methoxyphenol COC1=CC=C(C=C1O)C2OCC3C2COC3C4=CC=C(OC)C(O)=C4 InChI=1S/C20H22O6/c1-23-17-5-3-11(7-15(17)21)19-13-9-26-20(14(13)10-25-19)12-4-6-18(24-2)16(22)8-12/h3-8,13-14,19-22H,9-10H2,1-2H3 1129719.1 1098249.9200000002 1077519.6 1095342.8 1178336.4 1115478.1 850709.06 1560996.1 883044.6 632805.3 1058922.6 1540830.9 357.2427 15.35 15.35 0 14 NCGC00380640-01!5-chloro-2,4-dihydroxy-6-methyl-3-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl]benzaldehyde CC(C)=CCC\\C(C)=C\\CC\\C(C)=C\\CC1=C(O)C(C=O)=C(C)C(Cl)=C1O InChI=1S/C23H31ClO3/c1-15(2)8-6-9-16(3)10-7-11-17(4)12-13-19-22(26)20(14-25)18(5)21(24)23(19)27/h8,10,12,14,26-27H,6-7,9,11,13H2,1-5H3/b16-10+,17-12+ 0.0 702158.4400000001 543226.86 0.0 0.0 0.0 271501.97 1605146.6 229826.75 433847.8 495496.22 700336.56 264.2325 12.76 12.76 0 100 ( )-alpha-Bisabolol - 40.0 eV nan nan 124967.39033333331 0.0 0.0 113017.586 109555.055 152329.53 0.0 0.0 0.0 0.0 0.0 0.0 637.2655 15.86 15.86 0 8 162986.05333333332 0.0 0.0 164884.28 138539.05 185534.83 0.0 0.0 0.0 0.0 0.0 0.0 618.428 13.74 13.74 0 3 265225.54333333333 0.0 0.0 263347.25 215806.6 316522.78 0.0 0.0 0.0 0.0 0.0 0.0 382.7086 4.9 4.9 0 102 431652.45333333337 8662.164666666666 0.0 418721.5 390011.8 486224.06 25986.494 0.0 0.0 0.0 0.0 0.0 585.4275 16.6 16.6 0 3 CHEBI:181245 CC(CC(O)C(O)C(C)(C)O)C1CCC2(C)C3CCC4C(C)(C(=O)OC5OC(CO)C(O)C(O)C5O)C(O)CC(O)C45CC35CCC12C InChI=1S/C36H60O12/c1-17(13-19(38)28(44)31(2,3)46)18-9-10-33(5)21-7-8-22-34(6,30(45)48-29-27(43)26(42)25(41)20(15-37)47-29)23(39)14-24(40)36(22)16-35(21,36)12-11-32(18,33)4/h17-29,37-44,46H,7-16H2,1-6H3 99371.713 0.0 0.0 104659.984 75141.195 118313.96 0.0 0.0 0.0 0.0 0.0 0.0 618.4283 12.54 12.54 0 3 702344.9533333333 91707.508 0.0 729179.7 673726.06 704129.1 22491.748 99794.336 152836.44 0.0 0.0 0.0 600.4174 16.43 16.43 0 3 55485.392 0.0 0.0 67716.88 29975.416 68763.88 0.0 0.0 0.0 0.0 0.0 0.0 320.2589 9.74 9.74 0 83 Knemolone D OC1=C(C(C)=O)C(CCCCCCCCC)=CC(O)=C1 InChI=1S/C17H26O3/c1-3-4-5-6-7-8-9-10-14-11-15(19)12-16(20)17(14)13(2)18/h11-12,19-20H,3-10H2,1-2H3 73807.28666666667 0.0 0.0 71811.125 55651.895 93958.84 0.0 0.0 0.0 0.0 0.0 0.0 269.1174 4.1 4.1 0 40 sophocarpine O=C1C=CCC2N1CC3CCCN4CCCC2C43 InChI=1S/C15H22N2O/c18-14-7-1-6-13-12-5-3-9-16-8-2-4-11(15(12)16)10-17(13)14/h1,7,11-13,15H,2-6,8-10H2 327851.2066666667 0.0 0.0 378298.84 234840.44 370414.34 0.0 0.0 0.0 0.0 0.0 0.0 600.4171 15.27 15.27 0 3 131894.92333333334 11505.894 0.0 119659.07 121484.92 154540.78 0.0 15737.02 18780.662 0.0 0.0 0.0 300.1447 1.27 1.27 0 6 36063.097 0.0 74263.74633333333 35292.766 29784.662 43111.863 0.0 0.0 0.0 34803.88 86404.445 101582.914 355.1545 7.42 7.42 0 24 0.0 119609.49 73272.97466666666 0.0 0.0 0.0 0.0 358828.47 0.0 59632.754 83596.04 76590.13 312.1083 1.26 1.26 0 72 CCG-208508 CollisionEnergy:102040 O=c1c(OC2OC(C(O)CO)C(O)C2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12 "InChI=1S/C21H20O12/c22-6-12(27)19-16(29)17(30)21(32-19)33-20-15(28)14-11(26)4-8(23)5-13(14)31-18(20)7-1-2-9(24)10(25)3-7/h1-5,12,16-17,19,21-27,29-30H,6H2/t12-,16-,17-,19?,21+/m1/s1" 122965.05166666668 0.0 0.0 122075.63 92100.695 154718.83 0.0 0.0 0.0 0.0 0.0 0.0 328.1548 4.02 4.02 0 16 13614866.333333334 3281078.633333333 1324452.9666666666 11712899.0 13696620.0 15435080.0 1916528.6 2483266.8 5443440.5 1335800.5 1380016.0 1257542.4 318.1342 8.02 8.02 0 2 Piplartine COc1cc(/C=C/C(=O)N2CCC=CC2=O)cc(OC)c1OC InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+ 95368.54133333334 0.0 33856.64233333333 98908.484 71310.4 115886.74 0.0 0.0 0.0 24866.23 35315.9 41387.797 274.1442 9.24 9.24 0 6 "4-(methylethyl)phenyl (2E)-3-(2,4-dimethoxyphenyl)prop-2-enoate CollisionEnergy:102040" COc1ccc(C=CC(=O)Oc2ccc(C(C)C)cc2)c(OC)c1 "InChI=1S/C20H22O4/c1-14(2)15-5-9-17(10-6-15)24-20(21)12-8-16-7-11-18(22-3)13-19(16)23-4/h5-14H,1-4H3/b12-8+" 853303.8166666668 0.0 0.0 950204.75 486842.1 1122864.6 0.0 0.0 0.0 0.0 0.0 0.0 300.1599 4.91 4.91 0 40 Armepavine COc1c(OC)cc2c(c1)CCN(C)[C@@H]2Cc1ccc(O)cc1 InChI=1S/C19H23NO3/c1-20-9-8-14-11-18(22-2)19(23-3)12-16(14)17(20)10-13-4-6-15(21)7-5-13/h4-7,11-12,17,21H,8-10H2,1-3H3/t17-/m1/s1 93100.46 0.0 0.0 97726.89 98594.14 82980.35 0.0 0.0 0.0 0.0 0.0 0.0 583.4151 15.47 15.47 0 3 906583.6533333332 280037.2833333333 0.0 920570.5 865163.06 934017.4 204302.83 290215.9 345593.12 0.0 0.0 0.0 298.1442 3.92 3.92 0 16 598248.4866666667 224300.02 686081.1166666666 528394.56 604438.9 661912.0 231970.44 203557.2 237372.42 662694.9 710768.2 684780.25 223.0863 8.83 8.83 0 34 832502.6666666666 0.0 0.0 434392.8 975610.3 1087504.9 0.0 0.0 0.0 0.0 0.0 0.0 871.5724 16.85 16.85 0 8 Chlorophyll a nan nan 61682.479 0.0 0.0 51573.727 66746.11 66727.6 0.0 0.0 0.0 0.0 0.0 0.0 282.0891 10.08 10.08 0 47 151890.6733333333 0.0 0.0 152043.55 127185.61 176442.86 0.0 0.0 0.0 0.0 0.0 0.0 811.4971 16.52 16.52 0 26 139041.03666666665 0.0 0.0 142407.11 139852.94 134863.06 0.0 0.0 0.0 0.0 0.0 0.0 613.4236 16.61 16.61 0 3 CHEBI:181879 CC1(CO)CC(O)[C@]2(C(=O)O)CCC34CC3(C=CC3[C@]5(C)C(CC[C@]34C)C(C)(CO)[C@@H](O)[C@H](O)[C@@H]5O)C2C1 InChI=1S/C30H46O8/c1-24(14-31)11-18-28-8-6-17-26(3,29(28,13-28)9-10-30(18,23(37)38)19(33)12-24)7-5-16-25(2,15-32)21(35)20(34)22(36)27(16,17)4/h6,8,16-22,31-36H,5,7,9-15H2,1-4H3,(H,37,38)/t16?,17?,18?,19?,20-,21-,22-,24?,25?,26+,27-,28?,29?,30-/m0/s1 33528.85533333333 0.0 0.0 32597.994 27888.422 40100.15 0.0 0.0 0.0 0.0 0.0 0.0 600.4175 14.18 14.18 0 89 0.0 37684.74733333333 5410.912 0.0 0.0 0.0 46429.746 31285.762 35338.734 16232.736 0.0 0.0 426.0669 8.81 8.81 0 2 84403.71966666666 24254.101666666666 0.0 77267.055 81480.62 94463.484 72762.305 0.0 0.0 0.0 0.0 0.0 300.1449 1.79 1.79 0 6 363056.6566666667 70624.94066666666 0.0 390148.16 288266.06 410755.75 108233.695 72425.92 31215.207 0.0 0.0 0.0 636.2951 16.78 16.78 0 8 106862.393 18516.080666666665 165590.04166666666 124763.21 79578.805 116245.164 0.0 55548.242 0.0 98673.375 202768.17 195328.58 684.2564 1.0 1.0 0 39 Manninotriose O=C[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO[C@H]1O[C@H](CO[C@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O InChI=1S/C18H32O16/c19-1-5(21)9(23)10(24)6(22)3-31-17-16(30)14(28)12(26)8(34-17)4-32-18-15(29)13(27)11(25)7(2-20)33-18/h1,5-18,20-30H,2-4H2/t5-,6+,7+,8+,9+,10+,11-,12-,13-,14-,15+,16+,17-,18-/m0/s1 126085.59 0.0 0.0 100134.09 118468.37 159654.31 0.0 0.0 0.0 0.0 0.0 0.0 272.1283 3.92 3.92 0 40 Coclaurine OC1=C(OC)C=C2C([C@@](CC3=CC=C(O)C=C3)([H])NCC2)=C1 InChI=1S/C17H19NO3/c1-21-17-9-12-6-7-18-15(14(12)10-16(17)20)8-11-2-4-13(19)5-3-11/h2-5,9-10,15,18-20H,6-8H2,1H3/t15-/m0/s1 84946.74333333333 80312.65466666665 89191.73666666665 95774.84 96472.29 62593.1 92545.734 76273.94 72118.29 99304.71 81280.4 86990.1 244.9471 0.87 0.87 0 1 39145.335666666666 0.0 0.0 38381.203 35326.754 43728.05 0.0 0.0 0.0 0.0 0.0 0.0 476.2283 3.83 3.83 0 44 100353.90333333332 25586.726666666666 0.0 92793.67 85656.98 122611.06 31454.15 0.0 45306.03 0.0 0.0 0.0 772.4765 14.88 14.88 0 66 0.0 9650.465 82829.009 0.0 0.0 0.0 0.0 28951.395 0.0 36146.207 94042.37 118298.45 233.1175 9.21 9.21 0 34 0.0 92094.07466666668 0.0 0.0 0.0 0.0 83404.164 119846.15 73031.91 0.0 0.0 0.0 532.2033 6.58 6.58 0 39 3-oxo-3-[[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(4-hydroxy-5-methyl-2-propan-2-ylphenoxy)oxan-2-yl]methoxy]propanoic acid Cc1cc(O[C@@H]2O[C@H](COC(=O)CC(=O)O)[C@@H](O)[C@H](O)[C@H]2O)c(C(C)C)cc1O InChI=1S/C19H26O10/c1-8(2)10-5-11(20)9(3)4-12(10)28-19-18(26)17(25)16(24)13(29-19)7-27-15(23)6-14(21)22/h4-5,8,13,16-20,24-26H,6-7H2,1-3H3,(H,21,22)/t13-,16-,17+,18-,19-/m1/s1 53036.492 0.0 65315.08866666667 49842.113 43390.293 65877.07 0.0 0.0 0.0 76082.9 56886.94 62975.426 289.0712 4.23 4.23 0 93 Cianidanol CollisionEnergy:102040 Oc1cc(O)c2c(c1)OC(c1ccc(O)c(O)c1)C(O)C2 "InChI=1S/C15H14O6/c16-8-4-11(18)9-6-13(20)15(21-14(9)5-8)7-1-2-10(17)12(19)3-7/h1-5,13,15-20H,6H2/t13-,15+/m0/s1" 3215133.5666666664 536181.7433333333 382610.2466666666 2370707.2 3300639.0 3974054.5 216410.25 366317.38 1025817.6 365496.9 350163.56 432170.28 318.1341 9.59 9.59 0 2 Piplartine COc1cc(/C=C/C(=O)N2CCC=CC2=O)cc(OC)c1OC InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+ 0.0 17882.679 14017.944 0.0 0.0 0.0 22924.176 0.0 30723.861 42053.832 0.0 0.0 518.1877 5.98 5.98 0 39 CHEBI:181517 O=C(Cc1ccccc1)OC[C@H]1O[C@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@@H]1O InChI=1S/C20H28O12/c21-7-10-13(23)15(25)17(27)19(30-10)32-20-18(28)16(26)14(24)11(31-20)8-29-12(22)6-9-4-2-1-3-5-9/h1-5,10-11,13-21,23-28H,6-8H2/t10-,11-,13-,14-,15+,16+,17-,18-,19-,20-/m1/s1 77881.11700000001 0.0 0.0 61047.98 113924.266 58671.105 0.0 0.0 0.0 0.0 0.0 0.0 342.1703 4.51 4.51 0 40 Mexiletine Cc1c(OCC(C)N)c(C)ccc1 InChI=1S/C11H17NO/c1-8-5-4-6-9(2)11(8)13-7-10(3)12/h4-6,10H,7,12H2,1-3H3 140666.7933333333 0.0 0.0 128958.945 124001.875 169039.56 0.0 0.0 0.0 0.0 0.0 0.0 625.2653 15.86 15.86 0 8 311571.0466666667 0.0 24015.666666666668 270933.16 323554.88 340225.1 0.0 0.0 0.0 0.0 28011.44 44035.56 335.1281 10.09 10.09 0 8 216987.52666666664 0.0 0.0 253082.52 198572.03 199308.03 0.0 0.0 0.0 0.0 0.0 0.0 599.4101 15.27 15.27 0 3 145026.28333333333 0.0 0.0 114052.44 152083.64 168942.77 0.0 0.0 0.0 0.0 0.0 0.0 462.2128 1.26 1.26 0 44 312785.99 0.0 138056.09333333335 228692.12 432698.38 276967.47 0.0 0.0 0.0 0.0 414168.28 0.0 236.1678 15.34 15.34 0 95 2099210.4333333336 348526.64 450492.58 1649422.1 2111082.2 2537127.0 157440.86 264584.62 623554.44 350854.56 507605.78 493017.4 221.0812 9.58 9.58 0 34 Piplartine COc1cc(/C=C/C(=O)N2CCC=CC2=O)cc(OC)c1OC InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+ 373315.2166666666 0.0 0.0 322206.75 189953.5 607785.4 0.0 0.0 0.0 0.0 0.0 0.0 607.2559 14.63 14.63 0 8 42942.59733333333 0.0 0.0 43388.78 44667.77 40771.242 0.0 0.0 0.0 0.0 0.0 0.0 353.952 1.04 1.04 0 59 676092.1533333333 357299.93999999994 1279404.8333333333 493571.4 854476.06 680229.0 720198.94 177442.5 174258.38 1108471.9 1252084.0 1477658.6 290.1392 8.19 8.19 0 6 Sibiricose A6 COc1cc(/C=C/C(=O)O[C@H]2[C@H](O)[C@@H](CO)O[C@@]2(CO)O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O InChI=1S/C23H32O15/c1-33-11-5-10(6-12(34-2)16(11)28)3-4-15(27)36-21-18(30)14(8-25)37-23(21,9-26)38-22-20(32)19(31)17(29)13(7-24)35-22/h3-6,13-14,17-22,24-26,28-32H,7-9H2,1-2H3/b4-3+/t13-,14-,17-,18-,19+,20-,21+,22-,23+/m1/s1 45382.10266666667 43728.121666666666 102897.27533333334 38596.59 45829.812 51719.906 28132.832 74467.51 28584.023 73627.266 88058.67 147005.89 343.2272 13.6 13.6 0 14 NCGC00169961-02!4-hydroxy-3-[(2E,6E)-4-hydroxy-3,7,11-trimethyldodeca-2,6,10-trienyl]benzoic acid [IIN-based: Match] CC(C)=CCC\\\\C(C)=C\\\\CC(O)C(\\\\C)=C\\\\CC1=C(O)C=CC(=C1)C(O)=O InChI=1S/C22H30O4/c1-15(2)6-5-7-16(3)8-12-20(23)17(4)9-10-18-14-19(22(25)26)11-13-21(18)24/h6,8-9,11,13-14,20,23-24H,5,7,10,12H2,1-4H3,(H,25,26)/b16-8+,17-9+ 0.0 0.0 203644.03333333333 0.0 0.0 0.0 0.0 0.0 0.0 315854.4 226089.56 68988.14 322.1083 10.06 10.06 0 8 Massbank:PR300611 Palmatine COC1=C(OC)C=C2C(CC[N+]3=C2C=C2C=CC(OC)=C(OC)C2=C3)=C1 1S/C21H22NO4/c1-23-18-6-5-13-9-17-15-11-20(25-3)19(24-2)10-14(15)7-8-22(17)12-16(13)21(18)26-4/h5-6,9-12H,7-8H2,1-4H3/q+1 173638.38 0.0 0.0 196083.92 145898.11 178933.11 0.0 0.0 0.0 0.0 0.0 0.0 618.4278 14.38 14.38 0 3 82664.93333333333 0.0 0.0 106073.39 42650.38 99271.03 0.0 0.0 0.0 0.0 0.0 0.0 342.2431 9.19 9.19 0 65 Methyl 3,4,5-trimethoxycinnamate COC(=O)/C=C/c1cc(OC)c(OC)c(OC)c1 InChI=1S/C13H16O5/c1-15-10-7-9(5-6-12(14)17-3)8-11(16-2)13(10)18-4/h5-8H,1-4H3/b6-5+ 0.0 47903.58266666666 0.0 0.0 0.0 0.0 28876.994 51744.16 63089.594 0.0 0.0 0.0 439.1581 3.76 3.76 0 29 85573.29166666667 79424.40333333334 89502.99866666667 95264.555 99530.46 61924.86 89143.15 76867.51 72262.55 95548.12 84927.766 88033.11 272.9423 0.87 0.87 0 1 0.0 0.0 204979.1 0.0 0.0 0.0 0.0 0.0 0.0 195702.8 249871.3 169363.2 328.1549 4.32 4.32 0 9 Matairesinol 4'-O-beta-gentiobioside O=C1OCC(CC2=CC=C(O)C(OC)=C2)C1CC3=CC=C(OC4OC(COC5OC(CO)C(O)C(O)C5O)C(O)C(O)C4O)C(OC)=C3 InChI=1S/C32H42O16/c1-42-20-9-14(3-5-18(20)34)7-16-12-44-30(41)17(16)8-15-4-6-19(21(10-15)43-2)46-32-29(40)27(38)25(36)23(48-32)13-45-31-28(39)26(37)24(35)22(11-33)47-31/h3-6,9-10,16-17,22-29,31-40H,7-8,11-13H2,1-2H3 0.0 0.0 838231.96 0.0 0.0 0.0 0.0 0.0 0.0 846978.06 1480250.9 187466.92 338.1027 10.46 10.46 0 8 42112957.333333336 956371.0 0.0 38257744.0 35211344.0 52869784.0 508414.6 1219918.9 1140779.5 0.0 0.0 0.0 593.2761 15.86 15.86 0 8 Pheophorbide A CCC1=C2C=C3C(=C4C(=O)C(C(=C5C(C(C(=N5)C=C6C(=C(C(=CC(=C1C)N2)N6)C=C)C)C)CCC(=O)O)C4=N3)C(=O)OC)C InChI=1S/C35H36N4O5/c1-8-19-15(3)22-12-24-17(5)21(10-11-28(40)41)32(38-24)30-31(35(43)44-7)34(42)29-18(6)25(39-33(29)30)14-27-20(9-2)16(4)23(37-27)13-26(19)36-22/h8,12-14,17,21,31,36-37H,1,9-11H2,2-7H3,(H,40,41) 76305.11333333333 0.0 0.0 68050.17 75337.89 85527.28 0.0 0.0 0.0 0.0 0.0 0.0 435.0615 8.02 8.02 0 20 Massbank:PR310505 Piperlongumine COC1=CC(C=CC(=O)N2CCC=CC2=O)=CC(OC)=C1OC 1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3 154029.39 23185.77133333333 0.0 155455.52 137206.62 169426.03 0.0 35315.984 34241.33 0.0 0.0 0.0 612.4175 16.61 16.61 0 3 Massbank:MSJ00113 Lycopene-5,6-diol CC(=CCC/C(=C/C=C/C(=C/C=C/C(=C/C=C/C=C(\\C)/C=C/C=C(\\C)/C=C/C(C(C)(CCC=C(C)C)O)O)/C)/C)/C)C 1S/C40H58O2/c1-32(2)18-13-22-36(7)25-15-27-37(8)26-14-23-34(5)20-11-12-21-35(6)24-16-28-38(9)29-30-39(41)40(10,42)31-17-19-33(3)4/h11-12,14-16,18-21,23-30,39,41-42H,13,17,22,31H2,1-10H3/b12-11+,23-14+,24-16+,27-15+,30-29+,34-20+,35-21+,36-25+,37-26+,38-28+ 117323.72866666668 119002.65666666668 262751.89666666667 145384.47 172040.45 34546.266 131642.14 124490.33 100875.5 303219.6 249149.78 235886.31 218.984 0.87 0.87 0 5 2,3,7,8-tetrahydroxychromeno[5,4,3-cde]chromene-5,10-dione O=C1OC2=C(O)C(O)=CC=3C(=O)OC=4C(O)=C(O)C=C1C4C23 InChI=1S/C14H6O8/c15-5-1-3-7-8-4(14(20)22-11(7)9(5)17)2-6(16)10(18)12(8)21-13(3)19/h1-2,15-18H 200841.05666666664 578221.0966666667 384812.9166666667 268075.7 0.0 334447.47 559826.6 786314.44 388522.25 489896.34 352193.88 312348.53 358.1135 1.23 1.23 0 6 DOPAMINE C1=CC(=C(C=C1CCN)O)O InChI=1S/C8H11NO2/c9-4-3-6-1-2-7(10)8(11)5-6/h1-2,5,10-11H,3-4,9H2 12077738.333333334 5892661.833333333 346421.5333333333 10982472.0 12602882.0 12647861.0 4946851.5 6344556.0 6386578.0 403845.53 410659.1 224759.97 300.16 3.11 3.11 0 40 Desvenlafaxine CN(C)CC(c1ccc(O)cc1)C1(O)CCCCC1 InChI=1S/C16H25NO2/c1-17(2)12-15(13-6-8-14(18)9-7-13)16(19)10-4-3-5-11-16/h6-9,15,18-19H,3-5,10-12H2,1-2H3 108844.325 0.0 0.0 97542.96 122748.96 106241.055 0.0 0.0 0.0 0.0 0.0 0.0 567.4201 16.88 16.88 0 3 NCGC00381199-01_C25H38O4_(3aR,5E,7S,10E,14E,16aS)-2,7-Dihydroxy-3-[(2S)-1-hydroxy-2-propanyl]-6,10,14,16a-tetramethyl-4,7,8,9,12,13,16,16a-octahydrocyclopenta[15]annulen-1(3aH)-one C[C@H](CO)C/1=C(O)/C(=O)[C@@]2(C)C/C=C(C)/CC/C=C(C)/CC[C@H](O)/C(=C/C[C@H]12)C InChI=1S/C25H38O4/c1-16-7-6-8-17(2)13-14-25(5)20(11-10-18(3)21(27)12-9-16)22(19(4)15-26)23(28)24(25)29/h7,10,13,19-21,26-28H,6,8-9,11-12,14-15H2,1-5H3/b16-7+,17-13+,18-10+/t19-,20-,21+,25+/m1/s1 0.0 39420.39766666666 534655.14 0.0 0.0 0.0 34913.543 83347.65 0.0 245448.62 536764.2 821752.6 233.1176 8.62 8.62 0 34 1505366.933333333 306836.0966666667 1100452.6333333333 1390511.2 1514129.1 1611460.5 301002.62 272343.47 347162.2 978093.0 1152374.4 1170890.5 310.1055 8.5 8.5 0 45 27340.142666666667 0.0 0.0 25897.883 26847.697 29274.848 0.0 0.0 0.0 0.0 0.0 0.0 566.4119 17.29 17.29 0 3 (2S,3S,4S,5R,6R)-6-[[(3S,4S,6aR,6bS,8R,8aR,9R,10R,12aS,14bR)-10-acetyloxy-8a-(acetyloxymethyl)-8,9-dihydroxy-4-(hydroxymethyl)-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-4-hydroxy-3,5-bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]oxane-2-carboxylic acid CC(=O)OC[C@@]12[C@@H](CC(C)(C)[C@@H](OC(C)=O)[C@@H]1O)C1=CCC3[C@@]4(C)CC[C@H](O[C@@H]5O[C@H](C(=O)O)[C@@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@H](O)[C@H]5O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@](C)(CO)C4CC[C@@]3(C)[C@]1(C)C[C@H]2O InChI=1S/C52H82O24/c1-21(56)69-20-52-24(15-47(3,4)42(41(52)66)70-22(2)57)23-9-10-28-48(5)13-12-30(49(6,19-55)27(48)11-14-50(28,7)51(23,8)16-29(52)58)73-46-39(75-45-36(64)34(62)32(60)26(18-54)72-45)37(65)38(40(76-46)43(67)68)74-44-35(63)33(61)31(59)25(17-53)71-44/h9,24-42,44-46,53-55,58-66H,10-20H2,1-8H3,(H,67,68)/t24-,25+,26+,27?,28?,29+,30-,31+,32+,33-,34-,35+,36+,37-,38-,39+,40-,41-,42-,44-,45-,46+,48-,49+,50+,51+,52-/m0/s1 0.0 0.0 67424.85666666667 0.0 0.0 0.0 0.0 0.0 0.0 76232.16 84202.91 41839.5 328.155 4.77 4.77 0 9 Laetanine OC=1C=C2C=3C(OC)=C(O)C=C4C3C(NCC4)CC2=CC1OC InChI=1S/C18H19NO4/c1-22-15-7-10-5-12-16-9(3-4-19-12)6-14(21)18(23-2)17(16)11(10)8-13(15)20/h6-8,12,19-21H,3-5H2,1-2H3 70560.56333333334 0.0 134815.88999999998 211681.69 0.0 0.0 0.0 0.0 0.0 0.0 202693.05 201754.62 236.1679 6.49 6.49 0 95 1854549.9666666668 299231.5733333333 75251.13666666667 1476633.0 1799511.4 2287505.5 99241.51 171530.11 626923.1 59722.26 93331.52 72699.63 635.2606 9.34 9.34 0 28 161953.92333333334 0.0 0.0 150366.55 85156.19 250339.03 0.0 0.0 0.0 0.0 0.0 0.0 689.2459 12.73 12.73 0 7 3247465.9 29244.563666666665 0.0 2740867.2 1880342.0 5121188.5 21040.105 66693.586 0.0 0.0 0.0 0.0 593.2767 16.09 16.09 0 8 Pheophorbide A CCC1=C2C=C3C(=C4C(=O)C(C(=C5C(C(C(=N5)C=C6C(=C(C(=CC(=C1C)N2)N6)C=C)C)C)CCC(=O)O)C4=N3)C(=O)OC)C InChI=1S/C35H36N4O5/c1-8-19-15(3)22-12-24-17(5)21(10-11-28(40)41)32(38-24)30-31(35(43)44-7)34(42)29-18(6)25(39-33(29)30)14-27-20(9-2)16(4)23(37-27)13-26(19)36-22/h8,12-14,17,21,31,36-37H,1,9-11H2,2-7H3,(H,40,41) 0.0 40408.638 273287.74333333335 0.0 0.0 0.0 0.0 121225.914 0.0 160991.28 272162.75 386709.2 356.1257 9.93 9.93 0 24 NCGC00180457-02!4-(1,3-benzodioxol-5-ylmethyl)-3-[(3,4-dimethoxyphenyl)methyl]oxolan-2-one COC1=C(OC)C=C(CC2C(CC3=CC4=C(OCO4)C=C3)COC2=O)C=C1 InChI=1S/C21H22O6/c1-23-17-5-3-14(9-19(17)24-2)8-16-15(11-25-21(16)22)7-13-4-6-18-20(10-13)27-12-26-18/h3-6,9-10,15-16H,7-8,11-12H2,1-2H3 68019.63466666666 0.0 0.0 95463.77 59768.574 48826.56 0.0 0.0 0.0 0.0 0.0 0.0 583.415 15.19 15.19 0 3 21193177.33333333 8559107.666666666 24802043.33333333 20239336.0 21203882.0 22136314.0 8422756.0 8399657.0 8854910.0 22257942.0 25650084.0 26498104.0 340.1158 8.83 8.83 0 45 33726.27066666667 313568.98666666663 228224.21333333332 33348.746 42792.996 25037.07 291931.3 351320.72 297454.94 183593.42 273341.06 227738.16 281.0925 5.57 5.57 0 5 2-oxindole-3-acetic acid CollisionEnergy:205060 C1=CC=C2C(=C1)C(C(=O)N2)CC(=O)O "InChI=1S/C10H9NO3/c12-9(13)5-7-6-3-1-2-4-8(6)11-10(7)14/h1-4,7H,5H2,(H,11,14)(H,12,13)" 266827.99666666664 122149.98533333332 250643.55666666667 270095.03 259860.08 270528.88 131850.42 100671.586 133927.95 255792.23 248115.66 248022.78 435.0615 8.81 8.81 0 20 Massbank:PR310505 Piperlongumine COC1=CC(C=CC(=O)N2CCC=CC2=O)=CC(OC)=C1OC 1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3 67041.302 0.0 0.0 70686.75 68141.59 62295.566 0.0 0.0 0.0 0.0 0.0 0.0 986.6051 15.63 15.63 0 18 Spectral Match to Dilinolenin (9c,12c,15c) from NIST14 nan nan 52167.94033333333 0.0 0.0 47755.387 45601.516 63146.918 0.0 0.0 0.0 0.0 0.0 0.0 650.3076 9.37 9.37 0 28 70895.58333333333 607687.9333333333 656989.5833333334 212686.75 0.0 0.0 0.0 667507.2 1155556.6 0.0 1192548.0 778420.75 565.5673 16.89 16.89 0 50 17884.443333333333 87290.645 18450.676666666663 0.0 53653.33 0.0 78788.65 79377.16 103706.125 55352.03 0.0 0.0 274.9364 1.05 1.05 0 84 145101.62 0.0 0.0 144949.86 116104.39 174250.61 0.0 0.0 0.0 0.0 0.0 0.0 360.2172 4.59 4.59 0 38 250006.1 27898.898666666664 574126.2666666667 222296.36 230677.1 297044.84 34732.598 0.0 48964.098 353842.0 704732.3 663804.5 599.1978 5.08 5.08 0 54 1824254.9 128726.13333333336 0.0 0.0 3255783.5 2216981.2 0.0 0.0 386178.4 0.0 0.0 0.0 799.5333 14.31 14.31 0 26 54243.87 0.0 0.0 48034.07 48831.6 65865.94 0.0 0.0 0.0 0.0 0.0 0.0 315.0868 9.82 9.82 0 8 1088104.7966666666 96370.50433333336 0.0 1244586.2 1036351.75 983376.44 42212.133 133332.2 113567.18 0.0 0.0 0.0 600.4178 14.83 14.83 0 3 77469.06333333334 72952.918 65985.97666666667 79567.52 74849.96 77989.71 54955.336 111575.91 52327.508 68290.19 63318.22 66349.52 231.1383 11.92 11.92 0 30 p-methoxycinnamic acid ethyl ester O=C(OCC)C=CC1=CC=C(OC)C=C1 InChI=1S/C12H14O3/c1-3-15-12(13)9-6-10-4-7-11(14-2)8-5-10/h4-9H,3H2,1-2H3 103827.27166666668 105993.94133333332 132579.13 96015.83 105440.18 110025.805 86858.93 125389.414 105733.48 106530.87 146190.94 145015.58 345.0935 8.81 8.81 0 2 Piplartine COc1cc(/C=C/C(=O)N2CCC=CC2=O)cc(OC)c1OC InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+ 101155.49333333332 10019.057333333332 0.0 97303.23 83807.0 122356.25 30057.172 0.0 0.0 0.0 0.0 0.0 419.201 6.85 6.85 0 57 270668.5533333333 0.0 0.0 255402.61 252879.45 303723.6 0.0 0.0 0.0 0.0 0.0 0.0 540.1898 4.84 4.84 0 60 NCGC00169057-02_C17H26O11_Methyl (1S,4aS,5R,7S,7aS)-1-(beta-D-glucopyranosyloxy)-5,7-dihydroxy-7-methyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylate COC(=O)\\C1=C\\O[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]3[C@@H]1[C@H](O)C[C@]3(C)O InChI=1S/C17H26O11/c1-17(24)3-7(19)9-6(14(23)25-2)5-26-15(10(9)17)28-16-13(22)12(21)11(20)8(4-18)27-16/h5,7-13,15-16,18-22,24H,3-4H2,1-2H3/t7-,8-,9+,10-,11-,12+,13-,15+,16+,17+/m1/s1 27368.869999999995 0.0 15883.429666666669 26848.44 22267.873 32990.297 0.0 0.0 0.0 0.0 23298.514 24351.775 276.1599 8.58 8.58 0 6 (2E)-3-(4-chlorophenyl)-1-piperidylprop-2-en-1-one CollisionEnergy:102040 O=C(C=Cc1ccc(Cl)cc1)N1CCCCC1 "InChI=1S/C14H16ClNO/c15-13-7-4-12(5-8-13)6-9-14(17)16-10-2-1-3-11-16/h4-9H,1-3,10-11H2/b9-6+" 28464.890666666663 33786.57033333334 0.0 39860.418 45534.254 0.0 0.0 36376.008 64983.703 0.0 0.0 0.0 402.1398 6.11 6.11 0 75 338223.8333333333 0.0 33871.166666666664 478944.5 535727.0 0.0 0.0 0.0 0.0 0.0 0.0 101613.5 319.1373 9.58 9.58 0 81 57568.91333333333 0.0 0.0 56849.06 58954.176 56903.504 0.0 0.0 0.0 0.0 0.0 0.0 359.2057 5.54 5.54 0 38 201764.25666666668 0.0 0.0 107174.18 84732.15 413386.44 0.0 0.0 0.0 0.0 0.0 0.0 535.2705 16.35 16.35 0 8 1928953.566666667 2529718.8666666667 0.0 2069788.1 1606132.4 2110940.2 1898568.6 2986029.5 2704558.5 0.0 0.0 0.0 330.2068 5.52 5.52 0 15 227844.9233333333 0.0 0.0 213533.53 130623.86 339377.38 0.0 0.0 0.0 0.0 0.0 0.0 623.2505 14.05 14.05 0 8 3.10S-Hydroxypheophorbide a OC(CC[C@H]1[C@@H](C2=N/C1=C([C@](C(OC)=O)(O)C3=O)\\C4=C3C(C)=C(N4)/C=C5N=C(C(C)=C\\5CC)/C=C(N/6)/C(C=C)=C(C6=C\\2)C)C)=O InChI=1S/C35H36N4O6/c1-8-19-15(3)22-12-24-17(5)21(10-11-28(40)41)31(38-24)30-32-29(33(42)35(30,44)34(43)45-7)18(6)25(39-32)14-27-20(9-2)16(4)23(37-27)13-26(19)36-22/h8,12-14,17,21,36,39,44H,1,9-11H2,2-7H3,(H,40,41)/t17-,21-,35-/m0/s1 255730.6366666667 0.0 0.0 230749.38 208404.69 328037.84 0.0 0.0 0.0 0.0 0.0 0.0 808.5572 16.43 16.43 0 18 0.0 0.0 1639421.2933333332 0.0 0.0 0.0 0.0 0.0 0.0 2090844.4 2407958.2 419461.28 266.0814 8.39 8.39 0 8 Spectral Match to trans-Ferulic acid from NIST14 COC1=C(C=CC(=C1)/C=C/C(=O)O)O InChI=1S/C10H10O4/c1-14-9-6-7(2-4-8(9)11)3-5-10(12)13/h2-6,11H,1H3,(H,12,13)/b5-3+ 647353.6466666666 142275.24666666667 0.0 675282.4 608800.6 657977.94 112134.54 220161.39 94529.81 0.0 0.0 0.0 620.3004 17.22 17.22 0 8 42219.623666666674 300877.66 1010321.2333333334 41298.027 34759.906 50600.938 159068.2 613110.25 130454.53 529130.56 978788.94 1523044.2 205.1954 13.2 13.2 0 10 Bisabolol CollisionEnergy:205060 CC(C)=CCCC(C)(O)C1CC=C(C)CC1 "InChI=1S/C15H26O/c1-12(2)6-5-11-15(4,16)14-9-7-13(3)8-10-14/h6-7,14,16H,5,8-11H2,1-4H3" 206500.4233333333 57979.95066666667 222233.67666666667 199884.69 194573.72 225042.86 57209.49 58732.03 57998.332 214362.84 222920.5 229417.69 735.1849 8.83 8.83 0 2 202608.3953333333 0.0 0.0 138504.9 38907.316 430412.97 0.0 0.0 0.0 0.0 0.0 0.0 501.26 6.87 6.87 0 2 Piperlongumine CollisionEnergy:102040 COc1cc(C=CC(=O)N2CCC=CC2=O)cc(OC)c1OC "InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+" 13148969.0 3433567.833333333 4565558.5 12938732.0 12658942.0 13849233.0 2558223.5 3752168.5 3990311.5 6027316.0 5456652.0 2212707.5 314.1756 4.83 4.83 0 40 O-methylarmepavine [H][C@@]1(CC2=CC=C(OC)C=C2)C3=CC(OC)=C(OC)C=C3CCN1C InChI=1S/C20H25NO3/c1-21-10-9-15-12-19(23-3)20(24-4)13-17(15)18(21)11-14-5-7-16(22-2)8-6-14/h5-8,12-13,18H,9-11H2,1-4H3/t18-/m1/s1 51397.756 0.0 0.0 54415.656 43082.312 56695.3 0.0 0.0 0.0 0.0 0.0 0.0 460.2335 3.54 3.54 0 44 271685.7 99059.27033333332 326633.2066666667 246474.88 265090.34 303491.88 105031.24 90311.055 101835.516 309112.53 336924.03 333863.06 206.0577 8.83 8.83 0 34 9-methoxy-7H-furo[3,2-g]chromen-7-one O=C1OC2=C(OC)C=3OC=CC3C=C2C=C1 InChI=1S/C12H8O4/c1-14-12-10-8(4-5-15-10)6-7-2-3-9(13)16-11(7)12/h2-6H,1H3 8879.985 7996.701333333333 16006.041666666666 26639.955 0.0 0.0 23990.104 0.0 0.0 0.0 0.0 48018.125 388.2548 4.22 4.22 0 36 68518.92866666666 0.0 0.0 58047.65 70956.766 76552.37 0.0 0.0 0.0 0.0 0.0 0.0 566.4117 16.61 16.61 0 3 (2S,3S,4S,5R,6R)-6-[[(3S,4S,6aR,6bS,8R,8aR,9R,10R,12aS,14bR)-10-acetyloxy-8a-(acetyloxymethyl)-8,9-dihydroxy-4-(hydroxymethyl)-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-4-hydroxy-3,5-bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]oxane-2-carboxylic acid CC(=O)OC[C@@]12[C@@H](CC(C)(C)[C@@H](OC(C)=O)[C@@H]1O)C1=CCC3[C@@]4(C)CC[C@H](O[C@@H]5O[C@H](C(=O)O)[C@@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@H](O)[C@H]5O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@](C)(CO)C4CC[C@@]3(C)[C@]1(C)C[C@H]2O InChI=1S/C52H82O24/c1-21(56)69-20-52-24(15-47(3,4)42(41(52)66)70-22(2)57)23-9-10-28-48(5)13-12-30(49(6,19-55)27(48)11-14-50(28,7)51(23,8)16-29(52)58)73-46-39(75-45-36(64)34(62)32(60)26(18-54)72-45)37(65)38(40(76-46)43(67)68)74-44-35(63)33(61)31(59)25(17-53)71-44/h9,24-42,44-46,53-55,58-66H,10-20H2,1-8H3,(H,67,68)/t24-,25+,26+,27?,28?,29+,30-,31+,32+,33-,34-,35+,36+,37-,38-,39+,40-,41-,42-,44-,45-,46+,48-,49+,50+,51+,52-/m0/s1 0.0 43649.513 0.0 0.0 0.0 0.0 50021.406 41757.11 39170.023 0.0 0.0 0.0 311.0669 4.84 4.84 0 5 871643.5833333334 145855.892 37217.99333333334 692433.9 849416.75 1073080.1 51917.496 82953.15 302697.03 31743.922 44608.562 35301.496 538.2076 9.33 9.33 0 28 57544.024333333335 8203.115333333333 0.0 37637.348 64985.105 70009.62 0.0 24609.346 0.0 0.0 0.0 0.0 518.3245 11.25 11.25 0 23 Sphingomyelin (d18:1/18:0) CollisionEnergy:102040 CCCCCCCCCCCCC/C=C/[C@@H](O)[C@H](COP(=O)(O)OCC[N+](C)(C)C)N=C(O)CCCCCCCCCCCCCCCCC "InChI=1S/C41H83N2O6P/c1-6-8-10-12-14-16-18-20-21-23-25-27-29-31-33-35-41(45)42-39(38-49-50(46,47)48-37-36-43(3,4)5)40(44)34-32-30-28-26-24-22-19-17-15-13-11-9-7-2/h32,34,39-40,44H,6-31,33,35-38H2,1-5H3,(H-,42,45,46,47)/p+1/b34-32+/t39-,40+/m0/s1" 44954.87533333333 40970.831 0.0 40952.742 49153.254 44758.63 31247.996 49926.97 41737.527 0.0 0.0 0.0 316.1913 4.54 4.54 0 15 0.0 0.0 209397.1533333333 0.0 0.0 0.0 0.0 0.0 0.0 257821.77 256640.92 113728.77 344.0897 10.06 10.06 0 8 111608.27666666669 0.0 0.0 110738.74 90263.17 133822.92 0.0 0.0 0.0 0.0 0.0 0.0 583.4153 14.6 14.6 0 3 377506.0 7061.672 44393.96433333334 315170.03 390879.47 426468.5 0.0 0.0 21185.016 37233.3 46396.82 49551.773 247.0604 3.54 3.54 0 19 naringenin CollisionEnergy:102040 O=C1CC(c2ccc(O)cc2)Oc2cc(O)cc(O)c21 "InChI=1S/C15H12O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-6,13,16-18H,7H2" 39043.55 0.0 0.0 38637.453 38996.957 39496.24 0.0 0.0 0.0 0.0 0.0 0.0 353.1023 10.79 10.79 0 24 N-(3,5-dioxo-10-oxa-4-azatricyclo[5.2.1.0~2,6~]dec-8-en-4-yl)-2-methoxybenzamide COc1ccccc1C(=O)NN1C(=O)C2C3C=CC(O3)C2C1=O InChI=1S/C16H14N2O5/c1-22-9-5-3-2-4-8(9)14(19)17-18-15(20)12-10-6-7-11(23-10)13(12)16(18)21/h2-7,10-13H,1H3,(H,17,19) 59169.37833333333 361881.4 0.0 94066.945 0.0 83441.19 0.0 0.0 1085644.2 0.0 0.0 0.0 234.0973 16.69 16.69 0 85 0.0 0.0 367320.3533333333 0.0 0.0 0.0 0.0 0.0 0.0 403680.12 509921.1 188359.84 314.1393 3.79 3.79 0 8 0.0 0.0 78599.52799999999 0.0 0.0 0.0 0.0 0.0 0.0 115389.14 81766.664 38642.78 327.1434 3.67 3.67 0 40 106974.828 83953.87666666666 113046.305 105158.91 105678.66 110086.914 77934.3 85682.04 88245.29 101923.125 120823.76 116392.03 420.0594 8.82 8.82 0 12 23986758.0 693757.53 0.0 23902842.0 20021526.0 28035906.0 504555.28 689156.56 887560.75 0.0 0.0 0.0 330.2068 6.02 6.02 0 15 211957.28000000003 0.0 0.0 198444.06 162756.38 274671.4 0.0 0.0 0.0 0.0 0.0 0.0 631.2532 15.63 15.63 0 67 19254.126666666667 33548.32 24544.25533333333 0.0 0.0 57762.38 0.0 100644.96 0.0 0.0 73632.766 0.0 780.5537 16.35 16.35 0 23 Spectral Match to N-Oleoyl-D-erythro-sphingosylphosphorylcholine from NIST14 CCCCCCCCCCCCC/C=C/[C@H]([C@H](COP(=O)([O-])OCC[N+](C)(C)C)NC(=O)CCCCCCC/C=C\\CCCCCCCC)O InChI=1S/C41H81N2O6P/c1-6-8-10-12-14-16-18-20-21-23-25-27-29-31-33-35-41(45)42-39(38-49-50(46,47)48-37-36-43(3,4)5)40(44)34-32-30-28-26-24-22-19-17-15-13-11-9-7-2/h20-21,32,34,39-40,44H,6-19,22-31,33,35-38H2,1-5H3,(H-,42,45,46,47)/b21-20-,34-32+/t39-,40+/m0/s1 271740.0633333333 86026.00666666667 0.0 268036.75 273702.44 273481.0 89311.234 55893.176 112873.61 0.0 0.0 0.0 358.2018 5.54 5.54 0 38 714062.2200000001 106701.662 0.0 612714.56 733586.4 795885.7 66870.586 113740.3 139494.1 0.0 0.0 0.0 434.1815 4.07 4.07 0 35 NCGC00347814-02 CC(=O)N1CCc2c(c(OC3OC(COC4OCC(O)(CO)C4O)C(O)C(O)C3O)c(O)cc2)C1Cc1ccc(O)cc1 InChI=1S/C29H37NO13/c1-14(32)30-9-8-16-4-7-19(34)25(21(16)18(30)10-15-2-5-17(33)6-3-15)43-27-24(37)23(36)22(35)20(42-27)11-40-28-26(38)29(39,12-31)13-41-28/h2-7,18,20,22-24,26-28,31,33-39H,8-13H2,1H3 99485.21 29599.903666666665 0.0 88982.4 105159.06 104314.17 43298.598 0.0 45501.113 0.0 0.0 0.0 298.1446 3.12 3.12 0 40 29264.81466666666 0.0 0.0 23697.787 30628.602 33468.055 0.0 0.0 0.0 0.0 0.0 0.0 321.142 8.02 8.02 0 81 0.0 0.0 102731.413 0.0 0.0 0.0 0.0 0.0 0.0 79599.945 192036.2 36558.094 296.0923 9.02 9.02 0 8 KU036-6-1 O=C1C2=C(O)C(OC)=C(OC)C=C2OC(C3=CC=C(O)C=C3)=C1 InChI=1S/C17H14O6/c1-21-14-8-13-15(16(20)17(14)22-2)11(19)7-12(23-13)9-3-5-10(18)6-4-9/h3-8,18,20H,1-2H3 14583.843666666668 0.0 31655.139333333336 22201.873 0.0 21549.658 0.0 0.0 0.0 0.0 35188.504 59776.914 448.2337 7.89 7.89 0 86 134471.02 0.0 0.0 119309.87 111484.07 172619.12 0.0 0.0 0.0 0.0 0.0 0.0 609.2704 15.87 15.87 0 8 45399.757666666665 0.0 0.0 28846.504 47869.902 59482.867 0.0 0.0 0.0 0.0 0.0 0.0 476.2411 13.99 13.99 0 4 0.0 453751.2933333334 307794.58 0.0 0.0 0.0 173333.48 1035177.56 152742.84 262315.72 267972.3 393095.72 205.1954 12.76 12.76 0 10 Bisabolol CollisionEnergy:205060 CC(C)=CCCC(C)(O)C1CC=C(C)CC1 "InChI=1S/C15H26O/c1-12(2)6-5-11-15(4,16)14-9-7-13(3)8-10-14/h6-7,14,16H,5,8-11H2,1-4H3" 1461739.6 0.0 0.0 1461512.6 1029826.0 1893880.2 0.0 0.0 0.0 0.0 0.0 0.0 673.2638 15.58 15.58 0 63 45767.42333333334 44944.742666666665 132585.87000000002 59018.504 78283.766 0.0 40740.895 55550.293 38543.04 136306.72 135368.2 126082.69 382.9291 0.88 0.88 0 5 42837.04033333333 0.0 0.0 45018.977 33272.742 50219.402 0.0 0.0 0.0 0.0 0.0 0.0 367.2632 13.7 13.7 0 3 alisol A 24-acetate CC(=O)O[C@H]([C@@H](O)C[C@@H](C)C1=C2C[C@H](O)[C@H]3[C@@]4(C)CCC(=O)C(C)(C)[C@@H]4CC[C@]3(C)[C@@]2(C)CC1)C(C)(C)O InChI=1S/C32H52O6/c1-18(16-23(35)27(29(5,6)37)38-19(2)33)20-10-14-31(8)21(20)17-22(34)26-30(7)13-12-25(36)28(3,4)24(30)11-15-32(26,31)9/h18,22-24,26-27,34-35,37H,10-17H2,1-9H3/t18-,22+,23+,24+,26+,27-,30+,31+,32+/m1/s1 709199.1033333334 132948.62166666667 0.0 702276.56 637060.25 788260.5 104546.305 140956.5 153343.06 0.0 0.0 0.0 285.1488 6.06 6.06 0 15 359019.2133333334 24041.286666666667 0.0 250272.52 489992.72 336792.4 0.0 0.0 72123.86 0.0 0.0 0.0 221.0811 10.04 10.04 0 34 Piplartine COc1cc(/C=C/C(=O)N2CCC=CC2=O)cc(OC)c1OC InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+ 87698.33133333332 0.0 0.0 79118.234 50836.43 133140.33 0.0 0.0 0.0 0.0 0.0 0.0 639.2455 13.85 13.85 0 7 50654.566 0.0 0.0 38699.91 50087.53 63176.258 0.0 0.0 0.0 0.0 0.0 0.0 635.2606 10.41 10.41 0 2 42413.43666666667 0.0 0.0 36767.992 45897.4 44574.918 0.0 0.0 0.0 0.0 0.0 0.0 299.1646 12.53 12.53 0 14 217301.67666666667 26067.226666666666 0.0 170534.75 210539.94 270830.34 0.0 0.0 78201.68 0.0 0.0 0.0 538.2075 9.59 9.59 0 17 33431.375 0.0 0.0 25543.879 27970.504 46779.742 0.0 0.0 0.0 0.0 0.0 0.0 597.2213 10.08 10.08 0 4 59795.451 0.0 0.0 52959.543 73741.19 52685.62 0.0 0.0 0.0 0.0 0.0 0.0 870.5657 16.37 16.37 0 8 0.0 24810.786666666667 990691.2866666669 0.0 0.0 0.0 0.0 74432.36 0.0 340989.56 1108597.5 1522486.8 323.1282 16.85 16.85 0 24 4,4'-Dimethoxychalcone COc1ccc(/C=C/C(=O)c2ccc(OC)cc2)cc1 InChI=1S/C17H16O3/c1-19-15-8-3-13(4-9-15)5-12-17(18)14-6-10-16(20-2)11-7-14/h3-12H,1-2H3/b12-5+ 107636.05366666667 27970.773666666664 127714.18133333333 92748.625 120790.336 109369.2 26537.266 25728.303 31646.752 126910.164 126287.07 129945.31 221.0812 7.29 7.29 0 34 Piplartine COc1cc(/C=C/C(=O)N2CCC=CC2=O)cc(OC)c1OC InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+ 467941.4266666667 198893.78666666665 549015.2466666667 456339.5 470675.9 476808.88 197039.73 195060.83 204580.8 515420.34 565085.4 566540.0 356.0897 8.83 8.83 0 6 9368202.666666666 2099740.933333333 813360.5833333334 8045773.0 9231600.0 10827235.0 1185974.8 1579623.5 3533624.5 820527.25 844201.7 775352.8 221.0811 8.02 8.02 0 34 Piplartine COc1cc(/C=C/C(=O)N2CCC=CC2=O)cc(OC)c1OC InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+ 3469276.1666666665 242966.09666666668 0.0 3323755.5 2862829.0 4221244.0 294518.6 227011.02 207368.67 0.0 0.0 0.0 382.7086 5.13 5.13 0 102 252135.6833333333 0.0 0.0 144684.55 230390.78 381331.72 0.0 0.0 0.0 0.0 0.0 0.0 743.4345 15.31 15.31 0 26 0.0 0.0 141062.9 0.0 0.0 0.0 0.0 0.0 0.0 145025.31 139742.36 138421.03 344.1497 6.58 6.58 0 6 Moupinamide O=C(C=CC1=CC=C(O)C(OC)=C1)NCCC2=CC=C(O)C=C2 InChI=1S/C18H19NO4/c1-23-17-12-14(4-8-16(17)21)5-9-18(22)19-11-10-13-2-6-15(20)7-3-13/h2-9,12,20-21H,10-11H2,1H3,(H,19,22) 221608.77333333332 0.0 15479.052333333331 230531.23 150892.19 283402.9 0.0 0.0 0.0 0.0 23822.027 22615.13 727.2078 4.84 4.84 0 37 17353-03-6 C[C@@H]1O[C@@H](O[C@H]2[C@H](Oc3cc(O)c4c(=O)c(O)c(-c5ccc(O)cc5)oc4c3)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O InChI=1S/C27H30O15/c1-9-17(31)20(34)23(37)26(38-9)42-25-21(35)18(32)15(8-28)41-27(25)39-12-6-13(30)16-14(7-12)40-24(22(36)19(16)33)10-2-4-11(29)5-3-10/h2-7,9,15,17-18,20-21,23,25-32,34-37H,8H2,1H3/t9-,15+,17-,18+,20+,21-,23+,25+,26-,27+/m0/s1 22205.164666666667 18221.888666666666 45963.17966666666 30661.984 35953.51 0.0 0.0 30792.254 23873.412 33893.625 55402.07 48593.844 260.0104 0.87 0.87 0 5 249403.56 86198.15666666666 289897.78 237552.64 244925.44 265732.6 65327.67 124702.24 68564.56 182261.75 275230.06 412201.53 370.1413 10.49 10.49 0 24 49733.83433333333 0.0 0.0 47010.863 47769.37 54421.27 0.0 0.0 0.0 0.0 0.0 0.0 342.0824 4.39 4.39 0 31 92756.45166666666 0.0 0.0 104431.06 81787.24 92051.055 0.0 0.0 0.0 0.0 0.0 0.0 415.3 15.19 15.19 0 3 CHEBI:181076 CC(=O)O[C@@H]1CC2C(/C=C(\\C)C(=O)[C@@]3(O)C[C@@H](C)[C@H](OC(=O)c4ccccc4)C3/C=C/1C)C2(C)C InChI=1S/C29H36O6/c1-16-12-23-25(35-27(32)20-10-8-7-9-11-20)18(3)15-29(23,33)26(31)17(2)13-21-22(28(21,5)6)14-24(16)34-19(4)30/h7-13,18,21-25,33H,14-15H2,1-6H3/b16-12+,17-13+/t18-,21?,22?,23?,24-,25+,29-/m1/s1 111026.86 83691.95166666666 0.0 85912.46 113133.82 134034.3 57871.145 99182.27 94022.44 0.0 0.0 0.0 643.2895 17.06 17.06 0 8 48572.51233333334 44929.85666666667 49910.793 54626.785 54707.94 36382.812 53545.68 41897.48 39346.41 56053.367 45887.348 47791.664 249.926 0.87 0.87 0 1 166266.12 0.0 0.0 113183.9 205369.44 180245.02 0.0 0.0 0.0 0.0 0.0 0.0 272.1285 3.31 3.31 0 40 Higenamine OC1=CC=C(C=C1)CC2NCCC3=CC(O)=C(O)C=C32 InChI=1S/C16H17NO3/c18-12-3-1-10(2-4-12)7-14-13-9-16(20)15(19)8-11(13)5-6-17-14/h1-4,8-9,14,17-20H,5-7H2 31271.600333333336 9543.895333333334 57505.493333333325 45247.156 48567.645 0.0 28631.686 0.0 0.0 66567.06 49736.72 56212.7 743.1928 8.83 8.83 0 2 0.0 0.0 590687.2533333333 0.0 0.0 0.0 0.0 0.0 0.0 713830.25 912262.06 145969.45 310.108 10.26 10.26 0 8 KU036-6-1 O=C1C2=C(O)C(OC)=C(OC)C=C2OC(C3=CC=C(O)C=C3)=C1 InChI=1S/C17H14O6/c1-21-14-8-13-15(16(20)17(14)22-2)11(19)7-12(23-13)9-3-5-10(18)6-4-9/h3-8,18,20H,1-2H3 242919.5433333333 0.0 0.0 233125.08 196033.45 299600.1 0.0 0.0 0.0 0.0 0.0 0.0 723.3506 6.79 6.79 0 57 0.0 0.0 41252.375 0.0 0.0 0.0 0.0 0.0 0.0 41388.895 48596.664 33771.566 251.107 5.32 5.32 0 9 824088.6699999999 226499.30333333332 85508.45666666667 686529.2 811898.75 973838.06 153243.8 132153.67 394100.44 101039.41 84394.02 71091.94 680.3183 9.33 9.33 0 28 130891.28666666668 30051.099666666665 0.0 113830.74 131632.5 147210.62 0.0 28278.014 61875.285 0.0 0.0 0.0 317.1267 8.02 8.02 0 20 Piplartine O=C(N1CCC=CC1=O)/C=C/C2=CC(OC)=C(OC)C(OC)=C2 InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+ 73951.31166666666 13913.116 124521.08 0.0 106812.375 115041.56 41739.348 0.0 0.0 150030.92 110065.4 113466.92 507.66 8.83 8.83 0 2 Piplartine COc1cc(/C=C/C(=O)N2CCC=CC2=O)cc(OC)c1OC InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+ 86154.93466666667 0.0 0.0 102639.734 70658.51 85166.56 0.0 0.0 0.0 0.0 0.0 0.0 613.2663 14.93 14.93 0 46 687792.4700000001 33747.456666666665 133067.14666666667 719386.25 483421.06 860570.1 35893.805 32325.105 33023.46 104411.45 202025.38 92764.61 300.1599 5.1 5.1 0 40 Coclaurine OC1=C(OC)C=C2C([C@@](CC3=CC=C(O)C=C3)([H])NCC2)=C1 InChI=1S/C17H19NO3/c1-21-17-9-12-6-7-18-15(14(12)10-16(17)20)8-11-2-4-13(19)5-3-11/h2-5,9-10,15,18-20H,6-8H2,1H3/t15-/m0/s1 81680.28666666667 0.0 0.0 71642.96 84807.64 88590.26 0.0 0.0 0.0 0.0 0.0 0.0 355.227 12.69 12.69 0 14 NCGC00380882-01!5-chloro-2,4-dihydroxy-6-methyl-3-[(E)-3-methyl-5-[(1S,2R,6R)-1,2,6-trimethyl-3-oxocyclohexyl]pent-2-enyl]benzaldehyde [IIN-based on: CCMSLIB00000845779] C[C@@H]1CCC(=O)[C@H](C)[C@@]1(C)CC\\\\C(C)=C\\\\CC2=C(O)C(C=O)=C(C)C(Cl)=C2O InChI=1S/C23H31ClO4/c1-13(10-11-23(5)14(2)7-9-19(26)16(23)4)6-8-17-21(27)18(12-25)15(3)20(24)22(17)28/h6,12,14,16,27-28H,7-11H2,1-5H3/b13-6+/t14-,16+,23+/m1/s1 34970.09133333334 0.0 0.0 28347.031 33411.227 43152.016 0.0 0.0 0.0 0.0 0.0 0.0 418.0588 8.02 8.02 0 2 Cinoctramide COc1cc(/C=C/C(=O)N2CCCCCCC2)cc(OC)c1OC InChI=1S/C19H27NO4/c1-22-16-13-15(14-17(23-2)19(16)24-3)9-10-18(21)20-11-7-5-4-6-8-12-20/h9-10,13-14H,4-8,11-12H2,1-3H3/b10-9+ 188190.2633333333 36172.88333333333 118082.38333333332 245633.9 56663.23 262273.66 0.0 48521.69 59996.96 59482.2 143236.55 151528.4 522.2034 1.02 1.02 0 39 Spectral Match to 4-O-.beta.-Galactopyranosyl-D-mannopyranose from NIST14 C(C1[C@@H](C([C@@H]([C@@H](O1)O[C@@H]2C(O[C@@H]([C@@H](C2O)O)O)CO)O)O)O)O InChI=1S/C12H22O11/c13-1-3-5(15)6(16)9(19)12(22-3)23-10-4(2-14)21-11(20)8(18)7(10)17/h3-20H,1-2H2/t3?,4?,5-,6?,7?,8+,9-,10+,11-,12-/m0/s1 22741.06233333333 0.0 89429.85666666667 33999.445 0.0 34223.742 0.0 0.0 0.0 150127.88 0.0 118161.69 680.481 17.01 17.01 0 32 L-phenylalanine_dodecanoic acid CCCCCCCCCCCC(=O)N[C@@H](Cc1ccccc1)C(=O)O InChI=1S/C21H33NO3/c1-2-3-4-5-6-7-8-9-13-16-20(23)22-19(21(24)25)17-18-14-11-10-12-15-18/h10-12,14-15,19H,2-9,13,16-17H2,1H3,(H,22,23)(H,24,25)/t19-/m0/s1 490673.9733333333 6673.035666666667 0.0 473603.66 413609.16 584809.1 0.0 0.0 20019.107 0.0 0.0 0.0 567.42 17.29 17.29 0 3 CHEBI:181245 CC(CC(O)C(O)C(C)(C)O)C1CCC2(C)C3CCC4C(C)(C(=O)OC5OC(CO)C(O)C(O)C5O)C(O)CC(O)C45CC35CCC12C InChI=1S/C36H60O12/c1-17(13-19(38)28(44)31(2,3)46)18-9-10-33(5)21-7-8-22-34(6,30(45)48-29-27(43)26(42)25(41)20(15-37)47-29)23(39)14-24(40)36(22)16-35(21,36)12-11-32(18,33)4/h17-29,37-44,46H,7-16H2,1-6H3 357379.34 8856.430333333334 0.0 353048.84 302155.62 416933.56 26569.291 0.0 0.0 0.0 0.0 0.0 254.1614 1.26 1.26 0 87 38887.54866666667 0.0 0.0 29347.365 38110.676 49204.605 0.0 0.0 0.0 0.0 0.0 0.0 371.222 13.11 13.11 0 14 1726224.7333333334 149595.19333333333 0.0 0.0 2725352.2 2453322.0 0.0 222109.69 226675.89 0.0 0.0 0.0 932.6307 15.22 15.22 0 18 SQDG(16:0/18:3); [M+NH4]+ C43H80N1O12S1 nan nan 346858.4733333333 0.0 0.0 364467.22 295223.7 380884.5 0.0 0.0 0.0 0.0 0.0 0.0 375.2685 14.06 14.06 0 3 (2S,3S,4S,5R,6R)-6-[[(3S,4S,6aR,6bS,8R,8aR,9R,10R,12aS,14bR)-10-acetyloxy-8a-(acetyloxymethyl)-8,9-dihydroxy-4-(hydroxymethyl)-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-4-hydroxy-3,5-bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]oxane-2-carboxylic acid CC(=O)OC[C@@]12[C@@H](CC(C)(C)[C@@H](OC(C)=O)[C@@H]1O)C1=CCC3[C@@]4(C)CC[C@H](O[C@@H]5O[C@H](C(=O)O)[C@@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@H](O)[C@H]5O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@](C)(CO)C4CC[C@@]3(C)[C@]1(C)C[C@H]2O InChI=1S/C52H82O24/c1-21(56)69-20-52-24(15-47(3,4)42(41(52)66)70-22(2)57)23-9-10-28-48(5)13-12-30(49(6,19-55)27(48)11-14-50(28,7)51(23,8)16-29(52)58)73-46-39(75-45-36(64)34(62)32(60)26(18-54)72-45)37(65)38(40(76-46)43(67)68)74-44-35(63)33(61)31(59)25(17-53)71-44/h9,24-42,44-46,53-55,58-66H,10-20H2,1-8H3,(H,67,68)/t24-,25+,26+,27?,28?,29+,30-,31+,32+,33-,34-,35+,36+,37-,38-,39+,40-,41-,42-,44-,45-,46+,48-,49+,50+,51+,52-/m0/s1 0.0 7587.31 977541.8533333332 0.0 0.0 0.0 0.0 0.0 22761.93 1737066.2 784125.3 411434.06 344.1859 4.37 4.37 0 40 O-methylarmepavine [H][C@@]1(CC2=CC=C(OC)C=C2)C3=CC(OC)=C(OC)C=C3CCN1C InChI=1S/C20H25NO3/c1-21-10-9-15-12-19(23-3)20(24-4)13-17(15)18(21)11-14-5-7-16(22-2)8-6-14/h5-8,12-13,18H,9-11H2,1-4H3/t18-/m1/s1 198791.71333333332 137110.13499999998 199946.76666666663 182938.28 195632.25 217804.61 141683.94 131019.695 138626.77 206455.53 198047.33 195337.44 346.0938 8.82 8.82 0 2 Piplartine COc1cc(/C=C/C(=O)N2CCC=CC2=O)cc(OC)c1OC InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+ 62216.80233333333 0.0 0.0 40454.977 57237.7 88957.73 0.0 0.0 0.0 0.0 0.0 0.0 499.3169 13.99 13.99 0 11 261618.6133333333 562177.4866666667 727632.4633333333 262199.62 215506.25 307149.97 431683.06 696643.2 558206.2 368579.75 705670.44 1108647.2 217.0862 9.57 9.57 0 34 dl-3-Indolelactic acid - 40.0 eV c1ccc2c(c1)c(c[nH]2)CC(C(=O)O)O InChI=1S/C11H11NO3/c13-10(11(14)15)5-7-6-12-9-4-2-1-3-8(7)9/h1-4,6,10,12-13H,5H2,(H,14,15) 27836.70233333333 0.0 63696.097 20387.494 32709.17 30413.443 0.0 0.0 0.0 33798.996 68189.92 89099.375 353.1388 7.04 7.04 0 24 10982.356666666668 18378.96833333333 23769.179 0.0 32947.07 0.0 32570.69 0.0 22566.215 0.0 36660.977 34646.56 205.9512 1.15 1.15 0 73 91017.02133333334 0.0 87330.19666666667 79242.08 91650.57 102158.414 0.0 0.0 0.0 70391.28 92300.26 99299.05 290.1392 8.75 8.75 0 6 "3,4-DIMETHOXYCINNAMIC ACID CollisionEnergy:102040" COc1ccc(C=CC(=O)O)cc1OC "InChI=1S/C11H12O4/c1-14-9-5-3-8(4-6-11(12)13)7-10(9)15-2/h3-7H,1-2H3,(H,12,13)/b6-4+" 75868.22033333335 0.0 0.0 64357.508 59947.523 103299.63 0.0 0.0 0.0 0.0 0.0 0.0 434.2819 16.09 16.09 0 3 35798.587 0.0 0.0 30140.031 35114.17 42141.56 0.0 0.0 0.0 0.0 0.0 0.0 206.0577 8.02 8.02 0 34 35363.45766666666 0.0 10947.898333333333 33206.414 32301.744 40582.215 0.0 0.0 0.0 32843.695 0.0 0.0 496.3405 13.0 13.0 0 23 Spectral Match to 1-Stearoyl-2-hydroxy-sn-glycero-3-phosphocholine from NIST14 nan nan 0.0 16247.781333333332 321726.33666666667 0.0 0.0 0.0 0.0 48743.344 0.0 187272.27 352946.4 424960.34 201.0912 9.2 9.2 0 34 74018.28833333333 0.0 0.0 79439.43 69001.445 73613.99 0.0 0.0 0.0 0.0 0.0 0.0 461.3008 6.07 6.07 0 15 2891142.1 317935.01666666666 0.0 2532610.8 2718080.5 3422735.0 202706.75 343166.9 407931.4 0.0 0.0 0.0 299.092 11.65 11.65 0 8 acacetin CollisionEnergy:205060 COc1ccc(-c2cc(=O)c3c(O)cc(O)cc3o2)cc1 "InChI=1S/C16H12O5/c1-20-11-4-2-9(3-5-11)14-8-13(19)16-12(18)6-10(17)7-15(16)21-14/h2-8,17-18H,1H3" 80465.428 0.0 0.0 77210.55 63202.754 100982.98 0.0 0.0 0.0 0.0 0.0 0.0 362.179 6.79 6.79 0 57 0.0 0.0 75351.481 0.0 0.0 0.0 0.0 0.0 0.0 42342.438 81674.805 102037.2 770.2024 9.2 9.2 0 25 18367.964 0.0 60535.589 0.0 30249.494 24854.398 0.0 0.0 0.0 37960.14 56662.887 86983.74 201.0913 6.48 6.48 0 52 39441.399 959065.55 57829.12233333333 40622.39 26931.477 50770.33 895426.25 914476.0 1067294.4 73334.32 51351.145 48801.902 265.1549 3.59 3.59 0 6 Ferulic acid COC1=C(C=CC(=C1)C=CC(=O)O)O InChI=1S/C10H10O4/c1-14-9-6-7(2-4-8(9)11)3-5-10(12)13/h2-6,11H,1H3,(H,12,13) 96200.75666666668 54646.00366666666 54474.41666666666 122349.94 56273.74 109978.59 60159.074 51232.867 52546.07 73930.18 0.0 89493.07 558.0887 1.01 1.01 0 13 155876.12 0.0 0.0 179004.69 147859.69 140763.98 0.0 0.0 0.0 0.0 0.0 0.0 584.4217 16.91 16.91 0 3 65320.295000000006 0.0 0.0 58851.22 47120.215 89989.45 0.0 0.0 0.0 0.0 0.0 0.0 822.5365 16.02 16.02 0 18 55795.65633333334 0.0 0.0 55987.34 46166.953 65232.676 0.0 0.0 0.0 0.0 0.0 0.0 663.175 14.34 14.34 0 8 0.0 34461.39333333333 0.0 0.0 0.0 0.0 26241.963 22568.604 54573.613 0.0 0.0 0.0 279.1708 3.95 3.95 0 6 NCGC00385009-01!(1S,3R,4R,5R)-1,3-dihydroxy-4,5-bis[[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxy]cyclohexane-1-carboxylic acid COC1=CC(\\C=C\\C(=O)O[C@@H]2C[C@@](O)(C[C@@H](O)[C@H]2OC(=O)\\C=C\\C3=CC=C(O)C(OC)=C3)C(O)=O)=CC=C1O InChI=1S/C27H28O12/c1-36-20-11-15(3-7-17(20)28)5-9-23(31)38-22-14-27(35,26(33)34)13-19(30)25(22)39-24(32)10-6-16-4-8-18(29)21(12-16)37-2/h3-12,19,22,25,28-30,35H,13-14H2,1-2H3,(H,33,34)/b9-5+,10-6+/t19-,22-,25-,27+/m1/s1 132137.26333333334 0.0 0.0 136561.81 117910.21 141939.77 0.0 0.0 0.0 0.0 0.0 0.0 827.4916 15.96 15.96 0 26 16977.024999999998 7040.343666666667 0.0 0.0 22954.275 27976.8 0.0 0.0 21121.031 0.0 0.0 0.0 347.1127 5.1 5.1 0 53 31686.863666666668 0.0 0.0 33924.484 28180.525 32955.582 0.0 0.0 0.0 0.0 0.0 0.0 401.2842 14.28 14.28 0 3 NCGC00380920-01 CC(=O)OC1C(O)CC2(C)C(CCC3(C)C2CC=C2C4C5(CCC(CO[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)(OC5=O)C4(C)O)C(O)CC23C)C1(C)C InChI=1S/C38H58O13/c1-18(40)49-29-20(41)14-33(4)22(32(29,2)3)10-11-34(5)23(33)9-8-19-28-36(7,47)37(17-48-30-27(45)26(44)25(43)21(16-39)50-30)12-13-38(28,31(46)51-37)24(42)15-35(19,34)6/h8,20-30,39,41-45,47H,9-17H2,1-7H3/t20?,21-,22?,23?,24?,25-,26+,27-,28?,29?,30-,33?,34?,35?,36?,37?,38?/m1/s1 68361.70533333333 0.0 0.0 71744.47 51088.176 82252.47 0.0 0.0 0.0 0.0 0.0 0.0 455.9992 2.6 2.6 0 41 44033.949 0.0 0.0 40794.96 35145.832 56161.055 0.0 0.0 0.0 0.0 0.0 0.0 743.2035 4.53 4.53 0 37 Rutin C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)OC[C@@H]2[C@H]([C@@H]([C@H]([C@@H](O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC(=C(C=C5)O)O)O)O)O)O)O)O 1S/C27H30O16/c1-8-17(32)20(35)22(37)26(40-8)39-7-15-18(33)21(36)23(38)27(42-15)43-25-19(34)16-13(31)5-10(28)6-14(16)41-24(25)9-2-3-11(29)12(30)4-9/h2-6,8,15,17-18,20-23,26-33,35-38H,7H2,1H3/t8-,15+,17-,18+,20+,21-,22+,23+,26+,27-/m0/s1 56229.67633333334 18474.121 282670.8066666667 43658.074 62997.67 62033.285 0.0 55422.363 0.0 196001.66 244684.73 407326.03 355.1544 8.73 8.73 0 24 2-[4-[(3R,3aR,6S,6aR)-3-(3,4-dimethoxyphenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-6-yl]-2-methoxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol COc1ccc([C@@H]2OC[C@@H]3[C@@H](c4ccc(OC5OC(CO)C(O)C(O)C5O)c(OC)c4)OC[C@H]23)cc1OC InChI=1S/C27H34O11/c1-32-17-6-4-13(8-19(17)33-2)25-15-11-36-26(16(15)12-35-25)14-5-7-18(20(9-14)34-3)37-27-24(31)23(30)22(29)21(10-28)38-27/h4-9,15-16,21-31H,10-12H2,1-3H3/t15-,16-,21?,22?,23?,24?,25-,26+,27?/m0/s1 44364.389 0.0 0.0 43348.574 41119.543 48625.05 0.0 0.0 0.0 0.0 0.0 0.0 203.1796 12.42 12.42 0 61 Spectral Match to Methyl hexadecanoate from NIST14 nan nan 205823.41 0.0 0.0 171223.47 188948.12 257298.64 0.0 0.0 0.0 0.0 0.0 0.0 741.2907 10.08 10.08 0 24 609340.1133333334 164179.56833333333 739251.16 429531.34 761185.06 637303.94 241710.11 123599.125 127229.47 1308746.4 387479.2 521527.88 304.1184 7.38 7.38 0 6 Sibiricose A6 COc1cc(/C=C/C(=O)O[C@H]2[C@H](O)[C@@H](CO)O[C@@]2(CO)O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O InChI=1S/C23H32O15/c1-33-11-5-10(6-12(34-2)16(11)28)3-4-15(27)36-21-18(30)14(8-25)37-23(21,9-26)38-22-20(32)19(31)17(29)13(7-24)35-22/h3-6,13-14,17-22,24-26,28-32H,7-9H2,1-2H3/b4-3+/t13-,14-,17-,18-,19+,20-,21+,22-,23+/m1/s1 33563.795333333335 0.0 28440.824666666667 33001.188 32747.898 34942.3 0.0 0.0 0.0 0.0 34602.54 50719.934 488.0767 10.49 10.49 0 24 19646.424 0.0 44297.652 32169.139 26770.133 0.0 0.0 0.0 0.0 86074.086 46818.87 0.0 328.1552 3.42 3.42 0 40 5-bromo-N-(1-(thiophen-2-yl)cyclopentyl)nicotinamide O=C(NC1(c2cccs2)CCCC1)c1cc(Br)cnc1 InChI=1S/C15H15BrN2OS/c16-12-8-11(9-17-10-12)14(19)18-15(5-1-2-6-15)13-4-3-7-20-13/h3-4,7-10H,1-2,5-6H2,(H,18,19) 2228214.8000000003 411116.53333333327 1452937.6 1995230.2 2260195.0 2429219.2 455633.72 337263.16 440452.72 1394050.4 1458297.8 1506464.6 288.1235 8.5 8.5 0 6 NCGC00384692-01 COc1c(OC)cc(/C=C/C(=O)O[C@@H]2[C@@H](O)[C@H](C)O[C@@H](OC3C4C=COC(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)C4C4(CO)OC34)[C@@H]2O)cc1 InChI=1S/C32H42O17/c1-13-21(36)27(46-19(35)7-5-14-4-6-16(41-2)17(10-14)42-3)25(40)31(44-13)47-26-15-8-9-43-29(20(15)32(12-34)28(26)49-32)48-30-24(39)23(38)22(37)18(11-33)45-30/h4-10,13,15,18,20-31,33-34,36-40H,11-12H2,1-3H3/b7-5+/t13-,15?,18+,20?,21-,22+,23-,24+,25+,26?,27+,28?,29?,30-,31-,32?/m0/s1 83351.51666666666 0.0 0.0 73433.12 66084.74 110536.69 0.0 0.0 0.0 0.0 0.0 0.0 288.1235 9.54 9.54 0 6 "3,4-DIMETHOXYCINNAMIC ACID CollisionEnergy:102040" COc1ccc(C=CC(=O)O)cc1OC "InChI=1S/C11H12O4/c1-14-9-5-3-8(4-6-11(12)13)7-10(9)15-2/h3-7H,1-2H3,(H,12,13)/b6-4+" 39707.05333333334 0.0 0.0 31456.012 46384.824 41280.324 0.0 0.0 0.0 0.0 0.0 0.0 446.218 3.24 3.24 0 44 0.0 45804.920000000006 108923.04166666669 0.0 0.0 0.0 70107.72 0.0 67307.04 200874.5 125894.625 0.0 335.9418 1.27 1.27 0 51 53504.52066666667 0.0 0.0 48018.047 49872.535 62622.98 0.0 0.0 0.0 0.0 0.0 0.0 766.068 3.55 3.55 0 41 92674.31166666666 8075.699333333334 0.0 94381.34 77409.195 106232.4 24227.098 0.0 0.0 0.0 0.0 0.0 316.1397 1.15 1.15 0 6 50629.43066666666 0.0 70109.93966666667 45730.367 47736.305 58421.62 0.0 0.0 0.0 32078.904 67898.29 110352.625 231.1018 10.49 10.49 0 34 952124.6333333332 1113151.1666666667 737772.18 0.0 1415434.5 1440939.4 0.0 1239746.0 2099707.5 0.0 1255890.1 957426.44 780.5538 15.61 15.61 0 23 Spectral Match to N-Oleoyl-D-erythro-sphingosylphosphorylcholine from NIST14 CCCCCCCCCCCCC/C=C/[C@H]([C@H](COP(=O)([O-])OCC[N+](C)(C)C)NC(=O)CCCCCCC/C=C\\CCCCCCCC)O InChI=1S/C41H81N2O6P/c1-6-8-10-12-14-16-18-20-21-23-25-27-29-31-33-35-41(45)42-39(38-49-50(46,47)48-37-36-43(3,4)5)40(44)34-32-30-28-26-24-22-19-17-15-13-11-9-7-2/h20-21,32,34,39-40,44H,6-19,22-31,33,35-38H2,1-5H3,(H-,42,45,46,47)/b21-20-,34-32+/t39-,40+/m0/s1 40349.834 0.0 0.0 26194.78 47359.16 47495.562 0.0 0.0 0.0 0.0 0.0 0.0 271.0604 7.56 7.56 0 8 Luteolin - 40.0 eV c1cc(c(cc1c2cc(=O)c3c(cc(cc3o2)O)O)O)O InChI=1S/C15H10O6/c16-8-4-11(19)15-12(20)6-13(21-14(15)5-8)7-1-2-9(17)10(18)3-7/h1-6,16-19H 194488.6533333333 0.0 0.0 166741.28 182099.08 234625.6 0.0 0.0 0.0 0.0 0.0 0.0 463.0843 3.9 3.9 0 40 1-[(4-hydroxyphenyl)methyl]-6-methoxy-1,2,3,4-tetrahydroisoquinolin-7-ol COc(cc(CCNC1Cc(cc2)ccc2O)c1c1)c1O InChI=1S/C17H19NO3/c1-21-17-9-12-6-7-18-15(14(12)10-16(17)20)8-11-2-4-13(19)5-3-11/h2-5,9-10,15,18-20H,6-8H2,1H3/t15-/m0/s1 31493.554666666663 0.0 43160.37466666666 30555.191 36123.785 27801.688 0.0 0.0 0.0 29232.65 51278.49 48969.984 577.135 5.2 5.2 0 37 Spectral Match to Procyanidin A1 from NIST14 C1[C@@H]([C@H](OC2=C1C(=CC3=C2[C@@H]4[C@H]([C@](O3)(OC5=CC(=CC(=C45)O)O)C6=CC(=C(C=C6)O)O)O)O)C7=CC(=C(C=C7)O)O)O InChI=1S/C30H24O12/c31-13-7-20(37)24-22(8-13)41-30(12-2-4-16(33)19(36)6-12)29(39)26(24)25-23(42-30)10-17(34)14-9-21(38)27(40-28(14)25)11-1-3-15(32)18(35)5-11/h1-8,10,21,26-27,29,31-39H,9H2/t21-,26+,27+,29+,30-/m0/s1 196931.77 111265.38333333336 198227.48 189816.69 180126.22 220852.4 102784.49 118173.05 112838.61 184972.92 201406.6 208302.92 418.0589 8.82 8.82 0 2 (E)-3,4,5-Trimethoxycinnamic acid - 40.0 eV COc1cc(cc(c1OC)OC)/C=C/C(=O)O InChI=1S/C12H14O5/c1-15-9-6-8(4-5-11(13)14)7-10(16-2)12(9)17-3/h4-7H,1-3H3,(H,13,14)/b5-4+ 7727.373666666666 0.0 30971.160333333333 0.0 23182.121 0.0 0.0 0.0 0.0 31622.719 31939.645 29351.117 287.9601 0.88 0.88 0 5 0.0 562850.13 553354.8766666666 0.0 0.0 0.0 125251.29 1341821.2 221477.9 369411.53 504695.16 785957.94 205.1954 14.06 14.06 0 10 Bisabolol CollisionEnergy:205060 CC(C)=CCCC(C)(O)C1CC=C(C)CC1 "InChI=1S/C15H26O/c1-12(2)6-5-11-15(4,16)14-9-7-13(3)8-10-14/h6-7,14,16H,5,8-11H2,1-4H3" 43380.63033333333 0.0 50687.47066666666 32531.602 55190.555 42419.734 0.0 0.0 0.0 89113.59 27001.832 35946.99 303.1108 7.38 7.38 0 6 SINAPIC ACID CollisionEnergy:102040 COc1cc(C=CC(=O)O)cc(OC)c1O "InChI=1S/C11H12O5/c1-15-8-5-7(3-4-10(12)13)6-9(16-2)11(8)14/h3-6,14H,1-2H3,(H,12,13)/b4-3+" 892001.52 138489.40866666668 912770.9133333334 782628.06 943665.25 949711.25 119489.016 136645.27 159333.94 680304.0 1058955.8 999052.94 342.1316 9.07 9.07 0 45 55547.00133333334 0.0 0.0 36059.062 33163.992 97417.95 0.0 0.0 0.0 0.0 0.0 0.0 353.269 12.4 12.4 0 18 Spectral Match to cis-5,8,11-Eicosatrienoic acid from NIST14 CCCCCCCC/C=C\\C/C=C\\C/C=C\\CCCC(=O)O InChI=1S/C20H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h9-10,12-13,15-16H,2-8,11,14,17-19H2,1H3,(H,21,22)/b10-9-,13-12-,16-15- 94288.70466666669 0.0 0.0 87220.8 73172.484 122472.83 0.0 0.0 0.0 0.0 0.0 0.0 662.4396 14.45 14.45 0 18 36143.498 0.0 0.0 31579.088 38822.332 38029.074 0.0 0.0 0.0 0.0 0.0 0.0 313.1802 12.52 12.52 0 14 1704871.4 19680.779666666665 0.0 1585712.1 1258050.6 2270851.5 36775.13 22267.209 0.0 0.0 0.0 0.0 609.2714 15.63 15.63 0 8 3.10S-Hydroxypheophorbide a OC(CC[C@H]1[C@@H](C2=N/C1=C([C@](C(OC)=O)(O)C3=O)\\C4=C3C(C)=C(N4)/C=C5N=C(C(C)=C\\5CC)/C=C(N/6)/C(C=C)=C(C6=C\\2)C)C)=O InChI=1S/C35H36N4O6/c1-8-19-15(3)22-12-24-17(5)21(10-11-28(40)41)31(38-24)30-32-29(33(42)35(30,44)34(43)45-7)18(6)25(39-32)14-27-20(9-2)16(4)23(37-27)13-26(19)36-22/h8,12-14,17,21,36,39,44H,1,9-11H2,2-7H3,(H,40,41)/t17-,21-,35-/m0/s1 72644.63666666666 0.0 89503.65866666667 74040.41 73726.95 70166.55 0.0 0.0 0.0 84923.32 78960.016 104627.64 654.2336 8.83 8.83 0 79 0.0 0.0 3069773.4666666663 0.0 0.0 0.0 0.0 0.0 0.0 3902455.0 3653004.8 1653860.6 328.1549 3.67 3.67 0 9 Magnoflorine C[N+]1(CCC2=CC(=C(C3=C2C1CC4=C3C(=C(C=C4)OC)O)O)OC)C 1S/C20H23NO4/c1-21(2)8-7-12-10-15(25-4)20(23)18-16(12)13(21)9-11-5-6-14(24-3)19(22)17(11)18/h5-6,10,13H,7-9H2,1-4H3,(H-,22,23)/p+1/t13-/m0/s1 36911.51 42408.771 82048.40333333334 50072.21 60662.32 0.0 39659.273 47405.65 40161.39 82697.08 88426.63 75021.5 286.9591 0.88 0.88 0 5 99380.21666666666 0.0 0.0 88445.77 97004.9 112689.98 0.0 0.0 0.0 0.0 0.0 0.0 339.0714 3.55 3.55 0 41 Saccatoside C[C@@H]1O[C@@H](O[C@H]2[C@@H]3C=CO[C@@H](O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H]3[C@@]3(CO)O[C@@H]23)[C@H](OC(=O)/C=C/c2ccc(O)cc2)[C@H](O)[C@H]1O InChI=1S/C30H38O16/c1-12-19(35)22(38)25(43-17(34)7-4-13-2-5-14(33)6-3-13)29(41-12)44-24-15-8-9-40-27(18(15)30(11-32)26(24)46-30)45-28-23(39)21(37)20(36)16(10-31)42-28/h2-9,12,15-16,18-29,31-33,35-39H,10-11H2,1H3/b7-4+/t12-,15+,16+,18+,19-,20+,21-,22+,23+,24-,25+,26-,27-,28-,29-,30+/m0/s1 166739.62 0.0 0.0 178031.6 162707.38 159479.88 0.0 0.0 0.0 0.0 0.0 0.0 655.3124 14.35 14.35 0 68 219005.63 8297.591666666667 8575.137333333334 152801.22 213477.97 290737.7 0.0 24892.775 0.0 0.0 0.0 25725.412 353.2689 12.14 12.14 0 18 Spectral Match to cis-5,8,11-Eicosatrienoic acid from NIST14 CCCCCCCC/C=C\\C/C=C\\C/C=C\\CCCC(=O)O InChI=1S/C20H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h9-10,12-13,15-16H,2-8,11,14,17-19H2,1H3,(H,21,22)/b10-9-,13-12-,16-15- 185898.9833333333 0.0 0.0 173200.55 214248.4 170248.0 0.0 0.0 0.0 0.0 0.0 0.0 282.2796 15.52 15.52 0 58 Spectral Match to .beta.-Citronellol from NIST14 CC(CCC=C(C)C)CCO InChI=1S/C10H20O/c1-9(2)5-4-6-10(3)7-8-11/h5,10-11H,4,6-8H2,1-3H3 172693.75 0.0 0.0 188893.1 138482.62 190705.53 0.0 0.0 0.0 0.0 0.0 0.0 409.2742 13.44 13.44 0 3 (2S,3S,4S,5R,6R)-6-[[(3S,4S,6aR,6bS,8R,8aR,9R,10R,12aS,14bR)-10-acetyloxy-8a-(acetyloxymethyl)-8,9-dihydroxy-4-(hydroxymethyl)-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-4-hydroxy-3,5-bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]oxane-2-carboxylic acid CC(=O)OC[C@@]12[C@@H](CC(C)(C)[C@@H](OC(C)=O)[C@@H]1O)C1=CCC3[C@@]4(C)CC[C@H](O[C@@H]5O[C@H](C(=O)O)[C@@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@H](O)[C@H]5O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@](C)(CO)C4CC[C@@]3(C)[C@]1(C)C[C@H]2O InChI=1S/C52H82O24/c1-21(56)69-20-52-24(15-47(3,4)42(41(52)66)70-22(2)57)23-9-10-28-48(5)13-12-30(49(6,19-55)27(48)11-14-50(28,7)51(23,8)16-29(52)58)73-46-39(75-45-36(64)34(62)32(60)26(18-54)72-45)37(65)38(40(76-46)43(67)68)74-44-35(63)33(61)31(59)25(17-53)71-44/h9,24-42,44-46,53-55,58-66H,10-20H2,1-8H3,(H,67,68)/t24-,25+,26+,27?,28?,29+,30-,31+,32+,33-,34-,35+,36+,37-,38-,39+,40-,41-,42-,44-,45-,46+,48-,49+,50+,51+,52-/m0/s1 0.0 5023.333333333333 266511.30666666664 0.0 0.0 0.0 0.0 15070.0 0.0 91764.2 316030.1 391739.62 323.1282 16.69 16.69 0 24 4,4'-Dimethoxychalcone COc1ccc(/C=C/C(=O)c2ccc(OC)cc2)cc1 InChI=1S/C17H16O3/c1-19-15-8-3-13(4-9-15)5-12-17(18)14-6-10-16(20-2)11-7-14/h3-12H,1-2H3/b12-5+ 67628.34499999999 0.0 0.0 62343.395 71813.84 68727.8 0.0 0.0 0.0 0.0 0.0 0.0 409.9937 3.55 3.55 0 41 8310027.5 348215.2233333333 0.0 7308770.0 7361081.5 10260231.0 137293.27 404255.9 503096.5 0.0 0.0 0.0 635.287 15.97 15.97 0 8 0.0 35480.44533333334 7897.719333333333 0.0 0.0 0.0 55290.316 24379.07 26771.95 0.0 23693.158 0.0 313.0824 5.58 5.58 0 42 0.0 27176.921666666665 547238.5299999999 0.0 0.0 0.0 55844.023 0.0 25686.742 1304839.2 158037.64 178838.75 314.1757 11.12 11.12 0 70 508479.6866666667 0.0 0.0 482623.78 402810.03 640005.25 0.0 0.0 0.0 0.0 0.0 0.0 641.2969 16.11 16.11 0 46 2882008.966666667 1021455.5666666668 3315363.8666666667 3166796.2 2297052.5 3182178.2 1056524.5 993092.0 1014750.2 4888362.5 3287564.5 1770164.6 314.1755 3.89 3.89 0 40 O-methylarmepavine [H][C@@]1(CC2=CC=C(OC)C=C2)C3=CC(OC)=C(OC)C=C3CCN1C InChI=1S/C20H25NO3/c1-21-10-9-15-12-19(23-3)20(24-4)13-17(15)18(21)11-14-5-7-16(22-2)8-6-14/h5-8,12-13,18H,9-11H2,1-4H3/t18-/m1/s1 351309.32 560493.86 1528265.8333333333 405795.28 246961.52 401171.16 678806.94 494838.3 507836.34 762478.3 1542996.4 2279322.8 205.1954 13.79 13.79 0 10 Bisabolol CollisionEnergy:205060 CC(C)=CCCC(C)(O)C1CC=C(C)CC1 "InChI=1S/C15H26O/c1-12(2)6-5-11-15(4,16)14-9-7-13(3)8-10-14/h6-7,14,16H,5,8-11H2,1-4H3" 208637.86333333337 118174.39666666668 169886.17 261670.05 69533.34 294710.2 115201.21 108965.43 130356.55 110186.94 203672.84 195798.73 325.1135 1.03 1.03 0 39 Stachyose OC[C@H]1O[C@H](OC[C@H]2O[C@H](OC[C@H]3O[C@H](O[C@]4(CO)O[C@H](CO)[C@@H](O)[C@@H]4O)[C@H](O)[C@@H](O)[C@@H]3O)[C@H](O)[C@@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@H]1O InChI=1S/C24H42O21/c25-1-6-10(28)14(32)17(35)21(41-6)39-3-8-11(29)15(33)18(36)22(42-8)40-4-9-12(30)16(34)19(37)23(43-9)45-24(5-27)20(38)13(31)7(2-26)44-24/h6-23,25-38H,1-5H2/t6-,7-,8-,9-,10+,11+,12-,13-,14+,15+,16+,17-,18-,19-,20+,21+,22+,23-,24+/m1/s1 139769.89566666665 139187.32 318540.62666666665 167709.08 209993.88 41606.727 140684.88 156172.64 120704.44 343091.47 319064.97 293465.44 243.9975 0.88 0.88 0 5 452778.86 0.0 0.0 435057.25 403159.8 520119.53 0.0 0.0 0.0 0.0 0.0 0.0 591.2609 15.86 15.86 0 8 5718073.333333333 1620444.5333333332 643613.5366666667 5114477.0 5720229.0 6319514.0 773922.6 1349907.2 2737503.8 536587.56 727100.75 667152.3 340.1159 8.02 8.02 0 45 0.0 0.0 157072.6366666667 0.0 0.0 0.0 0.0 0.0 0.0 80390.67 159637.66 231189.58 205.1954 13.33 13.33 0 10 (.+/-.)-trans-Nerolidol - 40.0 eV CC(=CCC/C(=C/CCC(C)(C=C)O)/C)C InChI=1S/C15H26O/c1-6-15(5,16)12-8-11-14(4)10-7-9-13(2)3/h6,9,11,16H,1,7-8,10,12H2,2-5H3/b14-11+ 56157.143 95041.38333333336 85446.928 102312.695 0.0 66158.734 66653.84 80770.36 137699.95 87662.69 80347.484 88330.61 468.3901 14.61 14.61 0 36 Polidocanol CCCCCCCCCCCCOCCOCCOCCOCCOCCOCCOCCOCCOCCO "InChI=1S/C30H62O10/c1-2-3-4-5-6-7-8-9-10-11-13-32-15-17-34-19-21-36-23-25-38-27-29-40-30-28-39-26-24-37-22-20-35-18-16-33-14-12-31/h31H,2-30H2,1H3" 807688.0800000001 104424.86766666669 0.0 804531.94 720789.5 897742.8 57139.113 142483.38 113652.11 0.0 0.0 0.0 600.4179 14.6 14.6 0 3 0.0 0.0 155677.75333333333 0.0 0.0 0.0 0.0 0.0 0.0 133201.61 277516.84 56314.81 326.1393 4.28 4.28 0 8 42289.06766666667 0.0 132578.24666666667 48446.69 29877.473 48543.04 0.0 0.0 0.0 224526.05 0.0 173208.69 663.4545 17.01 17.01 0 32 L-phenylalanine_dodecanoic acid CCCCCCCCCCCC(=O)N[C@@H](Cc1ccccc1)C(=O)O InChI=1S/C21H33NO3/c1-2-3-4-5-6-7-8-9-13-16-20(23)22-19(21(24)25)17-18-14-11-10-12-15-18/h10-12,14-15,19H,2-9,13,16-17H2,1H3,(H,22,23)(H,24,25)/t19-/m0/s1 95580.04333333332 0.0 0.0 98520.19 71582.18 116637.76 0.0 0.0 0.0 0.0 0.0 0.0 379.0642 2.59 2.59 0 78 NCGC00384821-01_C16H18O8_Cyclohexanecarboxylic acid, 1,3,4-trihydroxy-5-[[(2E)-3-(4-hydroxyphenyl)-1-oxo-2-propen-1-yl]oxy]-, (1R,3R,4S,5R)- O[C@@H]1C[C@@](O)(C[C@@H](OC(=O)\\C=C\\C2=CC=C(O)C=C2)[C@H]1O)C(O)=O InChI=1S/C16H18O8/c17-10-4-1-9(2-5-10)3-6-13(19)24-12-8-16(23,15(21)22)7-11(18)14(12)20/h1-6,11-12,14,17-18,20,23H,7-8H2,(H,21,22)/b6-3+/t11-,12-,14+,16-/m1/s1 220949.86333333337 618476.7866666667 0.0 310047.25 0.0 352802.34 1175971.9 329606.34 349852.12 0.0 0.0 0.0 258.1102 1.0 1.0 0 23 L-alpha-Glycerylphosphorylcholine - 40.0 eV C[N+](C)(C)CCOP(=O)([O-])OC[C@@H](CO)O InChI=1S/C8H20NO6P/c1-9(2,3)4-5-14-16(12,13)15-7-8(11)6-10/h8,10-11H,4-7H2,1-3H3/t8-/m1/s1 0.0 305476.4366666667 290272.9366666667 0.0 0.0 0.0 115379.74 684049.4 117000.17 202335.19 256950.28 411533.34 264.2324 13.0 13.0 0 100 ( )-alpha-Bisabolol - 40.0 eV nan nan 32037.43133333333 0.0 0.0 33080.562 20971.232 42060.5 0.0 0.0 0.0 0.0 0.0 0.0 595.1658 4.84 4.84 0 37 45260.14233333333 0.0 0.0 43576.055 45999.434 46204.938 0.0 0.0 0.0 0.0 0.0 0.0 612.4174 17.29 17.29 0 3 Massbank:MSJ00121 Antheraxanthin CC1=C(C(C[C@@H](C1)O)(C)C)/C=C/C(=C/C=C/C(=C/C=C/C=C(\\C)/C=C/C=C(\\C)/C=C/[C@]23[C@](O2)(C[C@H](CC3(C)C)O)C)/C)/C 1S/C40H56O3/c1-29(17-13-19-31(3)21-22-36-33(5)25-34(41)26-37(36,6)7)15-11-12-16-30(2)18-14-20-32(4)23-24-40-38(8,9)27-35(42)28-39(40,10)43-40/h11-24,34-35,41-42H,25-28H2,1-10H3/b12-11+,17-13+,18-14+,22-21+,24-23+,29-15+,30-16+,31-19+,32-20+/t34-,35+,39-,40+/m1/s1 144931.31666666665 21861.588666666667 0.0 104734.67 143279.62 186779.66 0.0 0.0 65584.766 0.0 0.0 0.0 454.2592 13.99 13.99 0 11 125257.09666666668 0.0 0.0 155134.2 71182.69 149454.4 0.0 0.0 0.0 0.0 0.0 0.0 342.2431 8.99 8.99 0 65 92932.01166666669 0.0 19776.336 123868.26 73745.08 81182.695 0.0 0.0 0.0 0.0 0.0 59329.008 404.3529 13.32 13.32 0 83 Knemolone D OC1=C(C(C)=O)C(CCCCCCCCC)=CC(O)=C1 InChI=1S/C17H26O3/c1-3-4-5-6-7-8-9-10-14-11-15(19)12-16(20)17(14)13(2)18/h11-12,19-20H,3-10H2,1-2H3 8630.812666666667 0.0 850613.8433333334 25892.438 0.0 0.0 0.0 0.0 0.0 1129760.5 1112715.0 309366.03 280.0973 9.78 9.78 0 8 131523.35666666666 0.0 0.0 126476.99 102819.13 165273.95 0.0 0.0 0.0 0.0 0.0 0.0 583.4151 14.82 14.82 0 3 93820.75666666668 88720.34333333334 56249.205 127219.086 40806.484 113436.7 87004.87 75491.71 103664.45 53660.242 63216.383 51870.99 396.0357 1.04 1.04 0 13 65519.283 0.0 0.0 67420.305 57823.164 71314.38 0.0 0.0 0.0 0.0 0.0 0.0 629.4198 16.61 16.61 0 3 NCGC00381199-01_C25H38O4_(3aR,5E,7S,10E,14E,16aS)-2,7-Dihydroxy-3-[(2S)-1-hydroxy-2-propanyl]-6,10,14,16a-tetramethyl-4,7,8,9,12,13,16,16a-octahydrocyclopenta[15]annulen-1(3aH)-one C[C@H](CO)C/1=C(O)/C(=O)[C@@]2(C)C/C=C(C)/CC/C=C(C)/CC[C@H](O)/C(=C/C[C@H]12)C InChI=1S/C25H38O4/c1-16-7-6-8-17(2)13-14-25(5)20(11-10-18(3)21(27)12-9-16)22(19(4)15-26)23(28)24(25)29/h7,10,13,19-21,26-28H,6,8-9,11-12,14-15H2,1-5H3/b16-7+,17-13+,18-10+/t19-,20-,21+,25+/m1/s1 0.0 0.0 70164.62966666667 0.0 0.0 0.0 0.0 0.0 0.0 111239.63 68473.05 30781.209 324.1237 12.05 12.05 0 8 51768.76433333333 0.0 0.0 47583.133 49386.83 58336.33 0.0 0.0 0.0 0.0 0.0 0.0 318.1553 3.31 3.31 0 39 Salidroside OC[C@H]1O[C@@H](OCCc2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O InChI=1S/C14H20O7/c15-7-10-11(17)12(18)13(19)14(21-10)20-6-5-8-1-3-9(16)4-2-8/h1-4,10-19H,5-7H2/t10-,11-,12+,13-,14-/m1/s1 66558.62133333333 0.0 0.0 61902.18 57448.754 80324.93 0.0 0.0 0.0 0.0 0.0 0.0 599.4102 12.83 12.83 0 3 54265.348333333335 0.0 0.0 31043.78 50736.695 81015.57 0.0 0.0 0.0 0.0 0.0 0.0 476.2411 14.09 14.09 0 4 138159.90466666667 0.0 0.0 46848.324 245305.39 122326.0 0.0 0.0 0.0 0.0 0.0 0.0 347.1451 4.46 4.46 0 39 Amygdalin N#C[C@H](OC1O[C@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O)c1ccccc1 InChI=1S/C20H27NO11/c21-6-10(9-4-2-1-3-5-9)30-20-18(28)16(26)14(24)12(32-20)8-29-19-17(27)15(25)13(23)11(7-22)31-19/h1-5,10-20,22-28H,7-8H2/t10-,11+,12+,13+,14+,15-,16-,17+,18+,19+,20?/m0/s1 0.0 678242.6 204359.46666666667 0.0 0.0 0.0 0.0 838208.9 1196518.9 0.0 0.0 613078.4 794.5782 14.3 14.3 0 18 DG(18:2/18:3/0:0); [M+NH4]+ C39H70N1O5 nan nan 146723.82333333333 0.0 0.0 129275.24 82812.95 228083.28 0.0 0.0 0.0 0.0 0.0 0.0 592.2685 16.09 16.09 0 8 373358.7766666667 13977.146666666667 0.0 438010.03 361814.1 320252.2 0.0 0.0 41931.44 0.0 0.0 0.0 600.4177 16.28 16.28 0 3 0.0 25768.759 9214.674333333334 0.0 0.0 0.0 25857.104 24768.355 26680.818 0.0 0.0 27644.023 279.1597 13.25 13.25 0 82 Spectral Match to Dibutyl phthalate from NIST14 nan nan 1459167.066666667 230852.448 58172.525 1162177.9 1414011.5 1801311.8 70691.664 134351.06 487514.62 43083.92 72855.875 58577.78 652.2871 9.34 9.34 0 28 80462.088 0.0 0.0 93922.25 61189.85 86274.164 0.0 0.0 0.0 0.0 0.0 0.0 375.2686 14.51 14.51 0 3 CHEBI:181245 CC(CC(O)C(O)C(C)(C)O)C1CCC2(C)C3CCC4C(C)(C(=O)OC5OC(CO)C(O)C(O)C5O)C(O)CC(O)C45CC35CCC12C InChI=1S/C36H60O12/c1-17(13-19(38)28(44)31(2,3)46)18-9-10-33(5)21-7-8-22-34(6,30(45)48-29-27(43)26(42)25(41)20(15-37)47-29)23(39)14-24(40)36(22)16-35(21,36)12-11-32(18,33)4/h17-29,37-44,46H,7-16H2,1-6H3 46298.43033333333 0.0 0.0 33719.33 54452.844 50723.117 0.0 0.0 0.0 0.0 0.0 0.0 286.1444 3.38 3.38 0 40 Higenamine Oc1ccc(CC2NCCc3cc(O)c(O)cc32)cc1 InChI=1S/C16H17NO3/c18-12-3-1-10(2-4-12)7-14-13-9-16(20)15(19)8-11(13)5-6-17-14/h1-4,8-9,14,17-20H,5-7H2 64110.46 16005.943333333336 151711.51833333334 41551.01 81754.15 69026.22 0.0 48017.83 0.0 82370.695 147623.75 225140.11 422.218 6.48 6.48 0 24 NCGC00380478-01!(3S,3aR,6S,6aR)-3,6-bis(3,4-dimethoxyphenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan COC1=C(OC)C=C(C=C1)[C@H]2OC[C@H]3[C@@H]2CO[C@@H]3C4=CC(OC)=C(OC)C=C4 InChI=1S/C22H26O6/c1-23-17-7-5-13(9-19(17)25-3)21-15-11-28-22(16(15)12-27-21)14-6-8-18(24-2)20(10-14)26-4/h5-10,15-16,21-22H,11-12H2,1-4H3/t15-,16-,21+,22+/m0/s1 0.0 5261.491333333333 23562.656 0.0 0.0 0.0 0.0 0.0 15784.474 17650.61 25549.014 27488.344 470.3635 17.09 17.09 0 64 322630.16333333333 79075.719 23266.04233333333 253570.61 310670.16 403649.72 21587.793 70838.664 144800.7 0.0 40122.875 29675.252 275.103 9.99 9.99 0 28 1040655-37-5 O=C(Cc1csc(Nc2cc(Cl)ccc2)n1)NCc1ccco1 InChI=1S/C16H14ClN3O2S/c17-11-3-1-4-12(7-11)19-16-20-13(10-23-16)8-15(21)18-9-14-5-2-6-22-14/h1-7,10H,8-9H2,(H,18,21)(H,19,20) 182481.61666666667 247648.06333333327 325125.16333333333 172631.27 167646.31 207167.27 141637.17 375191.62 226115.4 179490.52 400773.94 395111.03 425.3056 17.09 17.09 0 64 NCGC00380368-01!methyl 3,15,21-tris[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]docosanoate COC(=O)CC(CCCCCCCCCCCC(CCCCCC(C)OC1OC(CO)C(O)C(O)C1O)OC1OC(CO)C(O)C(O)C1O)OC1OC(CO)C(O)C(O)C1O InChI=1S/C41H76O20/c1-23(56-39-36(52)33(49)30(46)26(20-42)59-39)15-11-10-14-17-24(57-40-37(53)34(50)31(47)27(21-43)60-40)16-12-8-6-4-3-5-7-9-13-18-25(19-29(45)55-2)58-41-38(54)35(51)32(48)28(22-44)61-41/h23-28,30-44,46-54H,3-22H2,1-2H3 29564.839000000004 0.0 0.0 25380.898 32121.508 31192.111 0.0 0.0 0.0 0.0 0.0 0.0 299.1647 12.64 12.64 0 14 681472.6533333333 0.0 0.0 404304.06 851239.3 788874.6 0.0 0.0 0.0 0.0 0.0 0.0 871.5726 16.71 16.71 0 8 Chlorophyll a nan nan 0.0 61080.54 19477.796666666665 0.0 0.0 0.0 65707.53 79931.625 37602.465 28761.525 29671.865 0.0 339.0979 6.02 6.02 0 5 47912.24166666667 0.0 0.0 44102.72 36437.36 63196.645 0.0 0.0 0.0 0.0 0.0 0.0 657.2566 13.52 13.52 0 8 709799.6 298184.8566666667 747345.9333333332 679741.4 680478.4 769179.0 326360.7 258864.17 309329.7 771600.94 717091.8 753345.06 317.1269 8.82 8.82 0 20 Piperlongumine CollisionEnergy:102040 COc1cc(C=CC(=O)N2CCC=CC2=O)cc(OC)c1OC "InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+" 155206.92 0.0 0.0 92739.7 187912.75 184968.31 0.0 0.0 0.0 0.0 0.0 0.0 476.2412 13.81 13.81 0 4 291478.0533333333 0.0 0.0 279585.5 210183.44 384665.22 0.0 0.0 0.0 0.0 0.0 0.0 824.5519 15.79 15.79 0 18 Spectral Match to Stearidonic acid ethyl ester from NIST14 CCC=CCC=CCC=CCC=CCCCCC(=O)OCC InChI=1S/C20H32O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22-4-2/h5-6,8-9,11-12,14-15H,3-4,7,10,13,16-19H2,1-2H3 0.0 0.0 259545.84333333332 0.0 0.0 0.0 0.0 0.0 0.0 269626.78 245223.47 263787.28 286.1442 10.12 10.12 0 6 Massbank:LU109603 Piperine|(2E,4E)-5-(1,3-benzodioxol-5-yl)-1-piperidin-1-ylpenta-2,4-dien-1-one O=C(\\C=C\\C=C\\C1=CC=C2OCOC2=C1)N1CCCCC1 1S/C17H19NO3/c19-17(18-10-4-1-5-11-18)7-3-2-6-14-8-9-15-16(12-14)21-13-20-15/h2-3,6-9,12H,1,4-5,10-11,13H2/b6-2+,7-3+ 27121.35 233672.68666666668 153719.62666666668 81364.05 0.0 0.0 0.0 255509.28 445508.78 0.0 461158.88 0.0 566.5706 16.89 16.89 0 50 53572.27 28568.985666666664 71485.381 45390.81 54876.027 60449.973 33351.01 23031.58 29324.367 88217.15 65989.61 60249.383 690.1872 8.83 8.83 0 56 679042.4633333333 125441.05333333334 0.0 535877.25 731850.44 769399.7 0.0 178206.64 198116.52 0.0 0.0 0.0 318.1341 10.04 10.04 0 2 Piplartine COc1cc(/C=C/C(=O)N2CCC=CC2=O)cc(OC)c1OC InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+ 155356.44333333333 0.0 0.0 119043.76 185881.23 161144.34 0.0 0.0 0.0 0.0 0.0 0.0 583.4152 16.45 16.45 0 3 139362.62333333332 0.0 0.0 98606.23 140908.64 178573.0 0.0 0.0 0.0 0.0 0.0 0.0 694.4012 11.08 11.08 0 18 Spectral Match to Monolinolenin (9c,12c,15c) from NIST14 nan nan 368825.98 200630.96666666667 107395.988 376260.25 311740.75 418476.94 200608.86 191039.23 210244.81 92670.41 101291.14 128226.414 360.1081 4.77 4.77 0 6 NCGC00169550-02!(E)-3-(4-hydroxy-3-methoxyphenyl)-N-[2-(4-hydroxyphenyl)ethyl]prop-2-enamide [IIN-based: Match] COC1=C(O)C=CC(\\\\C=C\\\\C(=O)NCCC2=CC=C(O)C=C2)=C1 InChI=1S/C18H19NO4/c1-23-17-12-14(4-8-16(17)21)5-9-18(22)19-11-10-13-2-6-15(20)7-3-13/h2-9,12,20-21H,10-11H2,1H3,(H,19,22)/b9-5+ 145799.69 0.0 0.0 141859.2 101925.18 193614.69 0.0 0.0 0.0 0.0 0.0 0.0 659.2843 16.77 16.77 0 63 77139.74433333334 9384.901 0.0 64133.633 77129.61 90155.99 0.0 0.0 28154.703 0.0 0.0 0.0 223.0863 8.02 8.02 0 34 22723.037333333337 20304.494666666666 105683.62466666668 0.0 38044.55 30124.562 60913.484 0.0 0.0 107111.38 89674.26 120265.234 292.155 7.57 7.57 0 6 Sibiricose A6 COc1cc(/C=C/C(=O)O[C@H]2[C@H](O)[C@@H](CO)O[C@@]2(CO)O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O InChI=1S/C23H32O15/c1-33-11-5-10(6-12(34-2)16(11)28)3-4-15(27)36-21-18(30)14(8-25)37-23(21,9-26)38-22-20(32)19(31)17(29)13(7-24)35-22/h3-6,13-14,17-22,24-26,28-32H,7-9H2,1-2H3/b4-3+/t13-,14-,17-,18-,19+,20-,21+,22-,23+/m1/s1 119790.44333333334 0.0 0.0 109883.85 110552.98 138934.5 0.0 0.0 0.0 0.0 0.0 0.0 357.0819 3.56 3.56 0 41 (2S)-3-(4-hydroxyphenyl)-2-[[(Z)-3-(4-hydroxyphenyl)prop-2-enoyl]amino]propanoic acid O=C(O)[C@H](Cc1ccc(O)cc1)N=C(O)/C=C\\c1ccc(O)cc1 InChI=1S/C18H17NO5/c20-14-6-1-12(2-7-14)5-10-17(22)19-16(18(23)24)11-13-3-8-15(21)9-4-13/h1-10,16,20-21H,11H2,(H,19,22)(H,23,24)/b10-5-/t16-/m0/s1 937986.4 104092.01833333333 0.0 882091.1 923312.8 1008555.3 27193.635 128602.26 156480.16 0.0 0.0 0.0 600.4175 16.09 16.09 0 3 87336.56933333333 0.0 0.0 83139.875 65385.703 113484.13 0.0 0.0 0.0 0.0 0.0 0.0 634.2796 16.18 16.18 0 8 101877.72000000002 53262.9 0.0 104035.93 81625.1 119972.13 61983.61 57097.77 40707.32 0.0 0.0 0.0 465.1736 4.34 4.34 0 88 2034287-08-4 CCNC(=O)N1CCC(Cc2n[nH]c(=O)n2-c2ccccc2F)CC1 InChI=1S/C17H22FN5O2/c1-2-19-16(24)22-9-7-12(8-10-22)11-15-20-21-17(25)23(15)14-6-4-3-5-13(14)18/h3-6,12H,2,7-11H2,1H3,(H,19,24)(H,21,25) 48785.73533333334 17307.04566666667 124887.46666666667 46105.82 43761.48 56489.906 51921.137 0.0 0.0 0.0 0.0 374662.4 354.1099 10.76 10.76 0 24 40848.61666666667 0.0 0.0 40968.25 33296.58 48281.02 0.0 0.0 0.0 0.0 0.0 0.0 373.2531 11.81 11.81 0 94 107190.408 0.0 0.0 118813.21 72579.03 130178.984 0.0 0.0 0.0 0.0 0.0 0.0 316.1911 5.16 5.16 0 15 329863.6533333333 0.0 0.0 304922.5 324172.16 360496.3 0.0 0.0 0.0 0.0 0.0 0.0 379.064 3.55 3.55 0 78 NCGC00384821-01_C16H18O8_Cyclohexanecarboxylic acid, 1,3,4-trihydroxy-5-[[(2E)-3-(4-hydroxyphenyl)-1-oxo-2-propen-1-yl]oxy]-, (1R,3R,4S,5R)- O[C@@H]1C[C@@](O)(C[C@@H](OC(=O)\\C=C\\C2=CC=C(O)C=C2)[C@H]1O)C(O)=O InChI=1S/C16H18O8/c17-10-4-1-9(2-5-10)3-6-13(19)24-12-8-16(23,15(21)22)7-11(18)14(12)20/h1-6,11-12,14,17-18,20,23H,7-8H2,(H,21,22)/b6-3+/t11-,12-,14+,16-/m1/s1 49638.958333333336 0.0 0.0 44472.445 48028.637 56415.793 0.0 0.0 0.0 0.0 0.0 0.0 219.1746 10.51 10.51 0 61 52597.954 0.0 0.0 47013.9 52257.992 58521.97 0.0 0.0 0.0 0.0 0.0 0.0 463.0563 8.02 8.02 0 20 88053.928 0.0 10827.626333333334 81729.39 23939.334 158493.06 0.0 0.0 0.0 32482.879 0.0 0.0 489.2237 5.67 5.67 0 2 Piperlongumine CollisionEnergy:102040 COc1cc(C=CC(=O)N2CCC=CC2=O)cc(OC)c1OC "InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+" 0.0 104295.22666666668 56899.282666666666 0.0 0.0 0.0 0.0 124690.04 188195.64 0.0 117757.93 52939.918 610.6251 16.88 16.88 0 50 54116.38533333333 0.0 0.0 45651.71 57004.38 59693.066 0.0 0.0 0.0 0.0 0.0 0.0 332.1347 2.86 2.86 0 39 Amygdalin N#C[C@H](OC1O[C@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O)c1ccccc1 InChI=1S/C20H27NO11/c21-6-10(9-4-2-1-3-5-9)30-20-18(28)16(26)14(24)12(32-20)8-29-19-17(27)15(25)13(23)11(7-22)31-19/h1-5,10-20,22-28H,7-8H2/t10-,11+,12+,13+,14+,15-,16-,17+,18+,19+,20?/m0/s1 0.0 118082.27333333332 0.0 0.0 0.0 0.0 61391.535 262022.66 30832.625 0.0 0.0 0.0 285.1239 4.4 4.4 0 90 "2-amino-6-(hydroxymethyl)-4-naphthyl-8-oxo-4H-pyrano[3,2-b]pyran-3-carbonitril e CollisionEnergy:102040" N#CC1=C(N)Oc2c(oc(CO)cc2=O)C1c1cccc2ccccc12 "InChI=1S/C20H14N2O4/c21-9-15-17(14-7-3-5-11-4-1-2-6-13(11)14)19-18(26-20(15)22)16(24)8-12(10-23)25-19/h1-8,17,23H,10,22H2" 0.0 0.0 5694274.566666666 0.0 0.0 0.0 0.0 0.0 0.0 7618878.5 6258310.0 3205635.2 342.1706 4.41 4.41 0 9 Spegatrine C/C=C1/C[N+]2(C)C3Cc4c([nH]c5ccc(O)cc45)[C@@H]2C[C@H]1[C@H]3CO InChI=1S/C20H24N2O2/c1-3-11-9-22(2)18-8-15-14-6-12(24)4-5-17(14)21-20(15)19(22)7-13(11)16(18)10-23/h3-6,13,16,18-19,21,23H,7-10H2,1-2H3/p+1/b11-3-/t13-,16-,18?,19+,22?/m1/s1 101219.38333333336 30970.36666666667 436466.3666666667 85949.77 102684.0 115024.38 32986.6 31321.555 28602.945 358439.38 421629.62 529330.1 306.1705 8.9 8.9 0 2 Piperlongumine CollisionEnergy:102040 COc1cc(C=CC(=O)N2CCC=CC2=O)cc(OC)c1OC "InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+" 65586.64566666666 0.0 0.0 50487.617 67310.82 78961.5 0.0 0.0 0.0 0.0 0.0 0.0 371.222 13.36 13.36 0 14 38651.87733333334 0.0 0.0 30609.992 36733.26 48612.38 0.0 0.0 0.0 0.0 0.0 0.0 275.1028 9.34 9.34 0 28 152164.15666666665 94142.43 572100.75 133907.84 150980.16 171604.47 67258.26 172008.53 43160.5 250781.27 513008.38 952512.6 371.1489 10.1 10.1 0 24 Massbank:PR303923 Arctigenin COC1=C(OC)C=C(C[C@H]2COC(=O)[C@@H]2CC2=CC(OC)=C(O)C=C2)C=C1 1S/C21H24O6/c1-24-18-7-5-13(11-20(18)26-3)8-15-12-27-21(23)16(15)9-14-4-6-17(22)19(10-14)25-2/h4-7,10-11,15-16,22H,8-9,12H2,1-3H3/t15-,16+/m0/s1 342618.44 25124.736666666668 508134.53 299859.25 326351.6 401644.47 0.0 75374.21 0.0 172594.97 459971.12 891837.5 741.2908 10.49 10.49 0 24 113282.34133333332 10800.675 0.0 111435.914 84067.88 144343.23 0.0 0.0 32402.025 0.0 0.0 0.0 600.4161 16.66 16.66 0 3 80159.057 0.0 0.0 86621.055 66342.766 87513.35 0.0 0.0 0.0 0.0 0.0 0.0 618.4278 14.06 14.06 0 3 36479.60866666667 0.0 50125.10566666666 35424.91 30923.572 43090.344 0.0 0.0 0.0 49301.504 72808.055 28265.758 300.1448 1.12 1.12 0 6 Anomuricine COC1=CC=C(C[C@]2([H])NCCC3=C2C=C(OC)C(OC)=C3O)C=C1 InChI=1S/C19H23NO4/c1-22-13-6-4-12(5-7-13)10-16-15-11-17(23-2)19(24-3)18(21)14(15)8-9-20-16/h4-7,11,16,20-21H,8-10H2,1-3H3/t16-/m0/s1 0.0 0.0 65194.606 0.0 0.0 0.0 0.0 0.0 0.0 81298.625 76974.4 37310.793 290.1028 3.65 3.65 0 6 214381.16666666663 88462.40666666666 100197.669 270739.97 0.0 372403.53 265387.22 0.0 0.0 228490.58 40186.047 31916.38 303.1345 1.24 1.24 0 6 102640.19333333331 0.0 0.0 97974.95 98211.91 111733.72 0.0 0.0 0.0 0.0 0.0 0.0 419.0095 3.55 3.55 0 41 4-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypentan-2-yl (E)-3-(4-hydroxyphenyl)prop-2-enoate CC(CC(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)OC(=O)/C=C/c1ccc(O)cc1 InChI=1S/C20H28O9/c1-11(27-16(23)8-5-13-3-6-14(22)7-4-13)9-12(2)28-20-19(26)18(25)17(24)15(10-21)29-20/h3-8,11-12,15,17-22,24-26H,9-10H2,1-2H3/b8-5+/t11?,12?,15-,17-,18+,19-,20-/m1/s1 38037.573 14374.039 0.0 36480.867 38684.676 38947.176 0.0 43122.117 0.0 0.0 0.0 0.0 237.1851 10.74 10.74 0 61 103207.465 0.0 0.0 80815.44 104571.08 124235.875 0.0 0.0 0.0 0.0 0.0 0.0 388.0882 2.97 2.97 0 43 ESCULIN C1=CC(=O)OC2=C1C=C(C(=C2)O)O[C@H]3[C@@H]([C@H]([C@@H]([C@@H](CO)O3)O)O)O "InChI=1S/C15H16O9/c16-5-10-12(19)13(20)14(21)15(24-10)23-9-3-6-1-2-11(18)22-8(6)4-7(9)17/h1-4,10,12-17,19-21H,5H2/t10-,12-,13+,14-,15-/m1/s1" 58277.117666666665 0.0 0.0 48327.56 61373.527 65130.266 0.0 0.0 0.0 0.0 0.0 0.0 323.1281 10.08 10.08 0 71 45927.136666666665 65819.52 77301.98666666668 68913.56 0.0 68867.85 66779.555 70703.56 59975.445 73425.39 92911.125 65569.445 424.364 14.64 14.64 0 36 Polidocanol CCCCCCCCCCCCOCCOCCOCCOCCOCCOCCOCCOCCOCCO "InChI=1S/C30H62O10/c1-2-3-4-5-6-7-8-9-10-11-13-32-15-17-34-19-21-36-23-25-38-27-29-40-30-28-39-26-24-37-22-20-35-18-16-33-14-12-31/h31H,2-30H2,1H3" 57772.44066666666 0.0 0.0 60253.812 46184.78 66878.73 0.0 0.0 0.0 0.0 0.0 0.0 618.4283 13.13 13.13 0 3 Spectral Match to .beta.-Cryptoxanthin from NIST14 nan nan 20631.782666666662 15012.527333333332 20565.54566666667 0.0 31575.332 30320.016 45037.582 0.0 0.0 61696.637 0.0 0.0 262.1441 7.64 7.64 0 6 NCGC00170014-03!(E)-N-(4-acetamidobutyl)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enamide [IIN-based: Match] COC1=C(O)C=CC(\\\\C=C\\\\C(=O)NCCCCNC(C)=O)=C1 InChI=1S/C16H22N2O4/c1-12(19)17-9-3-4-10-18-16(21)8-6-13-5-7-14(20)15(11-13)22-2/h5-8,11,20H,3-4,9-10H2,1-2H3,(H,17,19)(H,18,21)/b8-6+ 292603.13 0.0 0.0 301332.94 255582.73 320893.72 0.0 0.0 0.0 0.0 0.0 0.0 393.2789 14.07 14.07 0 3 NCGC00380456-01 CC(C)(O)C1CCC(C)(C2CCC3(C)C4CCC5C(C)(C(=O)OC6OC(CO)C(O)C(O)C6O)C(O)CC(O)C56CC46CCC23C)O1 InChI=1S/C36H58O11/c1-30(2,44)24-10-12-33(5,47-24)19-9-11-31(3)20-7-8-21-34(6,29(43)46-28-27(42)26(41)25(40)18(16-37)45-28)22(38)15-23(39)36(21)17-35(20,36)14-13-32(19,31)4/h18-28,37-42,44H,7-17H2,1-6H3 56185.174666666666 0.0 50993.87033333333 54141.52 53307.188 61106.816 0.0 0.0 0.0 46972.734 50568.4 55440.477 752.1874 8.83 8.83 0 20 33130.737 0.0 0.0 27834.379 38240.234 33317.598 0.0 0.0 0.0 0.0 0.0 0.0 462.213 1.67 1.67 0 44 0.0 79929.37666666666 130289.81333333334 0.0 0.0 0.0 48537.91 191250.22 0.0 75498.13 130298.01 185073.3 264.2325 12.65 12.65 0 100 0.0 100881.17666666664 53535.105 0.0 0.0 0.0 91055.73 127517.49 84070.31 42420.227 62196.348 55988.74 259.988 3.78 3.78 0 105 795481.0666666668 15635.786333333332 0.0 587346.1 371521.0 1427576.1 29001.105 17906.254 0.0 0.0 0.0 0.0 653.297 16.69 16.69 0 7 83888.66666666667 0.0 0.0 89551.74 71657.17 90457.09 0.0 0.0 0.0 0.0 0.0 0.0 409.2741 13.93 13.93 0 3 35559.130333333334 0.0 0.0 37375.863 27321.434 41980.094 0.0 0.0 0.0 0.0 0.0 0.0 327.2323 12.14 12.14 0 3 NCGC00385237-01 CC(C(O)/C=C/C(C)(C)O)C1CCC2(C)C3C(=O)C=C4C(CCC(O)C4(C)C)C3(C)CCC12C InChI=1S/C30H48O4/c1-18(22(31)12-13-26(2,3)34)19-11-14-30(8)25-23(32)17-21-20(9-10-24(33)27(21,4)5)28(25,6)15-16-29(19,30)7/h12-13,17-20,22,24-25,31,33-34H,9-11,14-16H2,1-8H3/b13-12+ 165674.56999999998 0.0 80435.026 158324.97 158811.72 179887.02 0.0 0.0 0.0 45602.664 70920.914 124781.5 370.1413 10.1 10.1 0 24 46433.639 0.0 0.0 37443.605 48279.785 53577.527 0.0 0.0 0.0 0.0 0.0 0.0 303.1959 13.81 13.81 0 27 0.0 13168.747333333333 25383.52733333333 0.0 0.0 0.0 0.0 39506.242 0.0 0.0 32064.59 44085.992 264.2323 6.21 6.21 0 76 116101.995 0.0 0.0 113302.55 83827.375 151176.06 0.0 0.0 0.0 0.0 0.0 0.0 638.4397 15.27 15.27 0 18 Spectral Match to 1-Hexadecanoyl-2-(9Z-octadecenoyl)-sn-glycero-3-phosphoethanolamine from NIST14 CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)(O)OCCN)OC(=O)CCCCCCC/C=C\\CCCCCCCC InChI=1S/C39H76NO8P/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-30-32-39(42)48-37(36-47-49(43,44)46-34-33-40)35-45-38(41)31-29-27-25-23-21-19-16-14-12-10-8-6-4-2/h17-18,37H,3-16,19-36,40H2,1-2H3,(H,43,44)/b18-17-/t37-/m1/s1 100675.95333333332 0.0 0.0 104255.04 80945.74 116827.08 0.0 0.0 0.0 0.0 0.0 0.0 344.2587 9.64 9.64 0 65 14586.644 0.0 12017.18 23957.979 0.0 19801.953 0.0 0.0 0.0 0.0 0.0 36051.54 476.3069 4.69 4.69 0 36 94890743.33333331 35549855.333333336 104197993.33333331 84792664.0 96475496.0 103404070.0 35200060.0 33031146.0 38418360.0 96387730.0 109298060.0 106908190.0 318.1342 8.83 8.83 0 2 Piplartine COc1cc(/C=C/C(=O)N2CCC=CC2=O)cc(OC)c1OC InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+ 33506.58933333333 0.0 0.0 27081.213 28276.43 45162.125 0.0 0.0 0.0 0.0 0.0 0.0 696.4172 11.88 11.88 0 18 Spectral Match to 1-Linoleoylglycerol from NIST14 nan nan 109365.72333333331 0.0 89876.62 98259.14 84283.48 145554.55 0.0 0.0 0.0 62379.38 96061.06 111189.42 867.2131 4.29 4.29 0 69 Procyanidin C1 40eV C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=C(C(=CC(=C34)O)O)C5C(C(OC6=CC(=CC(=C56)O)O)C7=CC(=C(C=C7)O)O)O)C8=CC(=C(C=C8)O)O)O)O)O)C9=CC(=C(C=C9)O)O)O MOJZMWJRUKIQGL-XILRTYJMSA-N 105333.31166666666 0.0 11411.78 112514.375 63716.66 139768.9 0.0 0.0 0.0 0.0 34235.34 0.0 300.16 4.2 4.2 0 40 N,O-dimethylcoclaurine OC1=C(OC)C=C2C([C@@](CC3=CC=C(OC)C=C3)([H])N(C)CC2)=C1 InChI=1S/C19H23NO3/c1-20-9-8-14-11-19(23-3)18(21)12-16(14)17(20)10-13-4-6-15(22-2)7-5-13/h4-7,11-12,17,21H,8-10H2,1-3H3/t17-/m0/s1 733114.8866666667 0.0 0.0 634525.9 564434.7 1000384.06 0.0 0.0 0.0 0.0 0.0 0.0 609.2712 15.32 15.32 0 8 3.10S-Hydroxypheophorbide a OC(CC[C@H]1[C@@H](C2=N/C1=C([C@](C(OC)=O)(O)C3=O)\\C4=C3C(C)=C(N4)/C=C5N=C(C(C)=C\\5CC)/C=C(N/6)/C(C=C)=C(C6=C\\2)C)C)=O InChI=1S/C35H36N4O6/c1-8-19-15(3)22-12-24-17(5)21(10-11-28(40)41)31(38-24)30-32-29(33(42)35(30,44)34(43)45-7)18(6)25(39-32)14-27-20(9-2)16(4)23(37-27)13-26(19)36-22/h8,12-14,17,21,36,39,44H,1,9-11H2,2-7H3,(H,40,41)/t17-,21-,35-/m0/s1 71012.77500000001 0.0 0.0 48711.715 73342.73 90983.88 0.0 0.0 0.0 0.0 0.0 0.0 304.1185 8.54 8.54 0 6 Sibiricose A6 COc1cc(/C=C/C(=O)O[C@H]2[C@H](O)[C@@H](CO)O[C@@]2(CO)O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O InChI=1S/C23H32O15/c1-33-11-5-10(6-12(34-2)16(11)28)3-4-15(27)36-21-18(30)14(8-25)37-23(21,9-26)38-22-20(32)19(31)17(29)13(7-24)35-22/h3-6,13-14,17-22,24-26,28-32H,7-9H2,1-2H3/b4-3+/t13-,14-,17-,18-,19+,20-,21+,22-,23+/m1/s1 359164.1333333333 0.0 0.0 347529.7 283920.7 446042.0 0.0 0.0 0.0 0.0 0.0 0.0 829.5073 15.79 15.79 0 26 191110.8033333333 53321.03533333334 211441.66 173296.52 204402.2 195633.69 65595.74 43633.656 50733.71 207708.45 208573.45 218043.08 495.6707 8.83 8.83 0 79 0.0 17328.118 28636.267666666667 0.0 0.0 0.0 27302.012 24682.342 0.0 32227.652 27636.137 26045.014 232.9234 0.88 0.88 0 62 87580175.33333333 21098932.33333333 0.0 87415910.0 79349120.0 95975496.0 16171185.0 22535002.0 24590610.0 0.0 0.0 0.0 344.2226 6.06 6.06 0 15 0.0 0.0 43105.14633333334 0.0 0.0 0.0 0.0 0.0 0.0 69774.24 34467.402 25073.797 344.186 4.82 4.82 0 40 Mexiletine Cc1c(OCC(C)N)c(C)ccc1 InChI=1S/C11H17NO/c1-8-5-4-6-9(2)11(8)13-7-10(3)12/h4-6,10H,7,12H2,1-3H3 97264.69333333334 0.0 0.0 90827.18 72226.51 128740.39 0.0 0.0 0.0 0.0 0.0 0.0 761.1888 16.09 16.09 0 8 Pheophytin a nan nan 62973.12899999999 0.0 0.0 58628.918 46622.555 83667.914 0.0 0.0 0.0 0.0 0.0 0.0 608.2634 15.63 15.63 0 8 35034.308 0.0 0.0 31340.771 37671.703 36090.45 0.0 0.0 0.0 0.0 0.0 0.0 371.222 12.82 12.82 0 14 225076.07333333333 89380.23999999999 93336.15666666668 154403.14 243400.3 277424.78 81743.92 97937.81 88458.99 97407.94 91800.64 90799.89 520.3404 12.06 12.06 0 23 Sphingomyelin (d18:1/18:0) CollisionEnergy:102040 CCCCCCCCCCCCC/C=C/[C@@H](O)[C@H](COP(=O)(O)OCC[N+](C)(C)C)N=C(O)CCCCCCCCCCCCCCCCC "InChI=1S/C41H83N2O6P/c1-6-8-10-12-14-16-18-20-21-23-25-27-29-31-33-35-41(45)42-39(38-49-50(46,47)48-37-36-43(3,4)5)40(44)34-32-30-28-26-24-22-19-17-15-13-11-9-7-2/h32,34,39-40,44H,6-31,33,35-38H2,1-5H3,(H-,42,45,46,47)/p+1/b34-32+/t39-,40+/m0/s1" 48622.265666666666 0.0 0.0 41311.496 49535.418 55019.883 0.0 0.0 0.0 0.0 0.0 0.0 231.1018 10.08 10.08 0 34 7891.564333333333 0.0 226422.08 23674.693 0.0 0.0 0.0 0.0 0.0 221742.36 229235.1 228288.78 342.134 8.07 8.07 0 6 ILEPCIMIDE O=C(C=Cc1cc2c(cc1)OCO2)N1CCCCC1 "InChI=1S/C15H17NO3/c17-15(16-8-2-1-3-9-16)7-5-12-4-6-13-14(10-12)19-11-18-13/h4-7,10H,1-3,8-9,11H2/b7-5+" 0.0 0.0 93035.16133333334 0.0 0.0 0.0 0.0 0.0 0.0 55828.934 102134.93 121141.62 339.1595 8.54 8.54 0 24 47109.98533333334 0.0 0.0 49886.13 45619.01 45824.816 0.0 0.0 0.0 0.0 0.0 0.0 827.4919 16.35 16.35 0 26 73384.66666666667 0.0 0.0 59992.88 69193.69 90967.43 0.0 0.0 0.0 0.0 0.0 0.0 342.1315 8.26 8.26 0 45 63833.691 8345.936333333333 84589.52233333334 57475.81 58210.543 75814.72 0.0 25037.809 0.0 41078.777 78818.62 133871.17 282.0891 10.49 10.49 0 47 0.0 58015.81666666667 46788.72 0.0 0.0 0.0 0.0 84651.83 89395.62 0.0 81758.086 58608.074 610.6251 16.75 16.75 0 50 122715.01866666666 16387.199333333334 0.0 114174.086 103739.2 150231.77 49161.598 0.0 0.0 0.0 0.0 0.0 599.4105 11.15 11.15 0 3 46262.411 0.0 0.0 49713.13 39371.273 49702.83 0.0 0.0 0.0 0.0 0.0 0.0 789.5152 16.53 16.53 0 18 147890.92 81741.478 95343.268 100414.92 173452.5 169805.34 73903.164 84933.61 86387.66 96005.14 97703.0 92321.664 478.2935 12.0 12.0 0 18 PE-DAG (16:1/18:2) nan nan 27367.78933333333 0.0 68782.85933333333 23933.092 24673.076 33497.2 0.0 0.0 0.0 43000.918 84023.52 79324.14 581.1872 5.08 5.08 0 54 60053.42833333334 7458.894 86387.11899999999 54201.664 55625.637 70332.984 0.0 22376.682 0.0 40979.707 80245.85 137935.8 323.1282 10.49 10.49 0 71 30439.25633333333 0.0 0.0 30761.992 24309.465 36246.312 0.0 0.0 0.0 0.0 0.0 0.0 600.4176 13.67 13.67 0 3 32732.320333333333 15818.468 9407.17 52042.348 0.0 46154.613 23568.434 23886.97 0.0 28221.51 0.0 0.0 344.1861 3.94 3.94 0 40 AC1L9EVY CollisionEnergy:102040 COc1ccc(CC2c3cc(OC)c(OC)cc3CC[N+]2(C)C)cc1OC "InChI=1S/C22H30NO4/c1-23(2)10-9-16-13-21(26-5)22(27-6)14-17(16)18(23)11-15-7-8-19(24-3)20(12-15)25-4/h7-8,12-14,18H,9-11H2,1-6H3/q+1" 8121.208333333333 6226.266666666666 36406.315 0.0 24363.625 0.0 0.0 18678.8 0.0 36157.195 36801.406 36260.344 337.9701 0.88 0.88 0 5 163863.16666666666 0.0 0.0 151422.14 115675.25 224492.11 0.0 0.0 0.0 0.0 0.0 0.0 842.5624 14.12 14.12 0 18 0.0 55326.36333333334 19542.768333333333 0.0 0.0 0.0 96371.38 69607.71 0.0 58628.305 0.0 0.0 323.9782 1.04 1.04 0 59 40258.633 0.0 0.0 41306.938 34195.766 45273.195 0.0 0.0 0.0 0.0 0.0 0.0 407.2587 9.19 9.19 0 3 CHEBI:181879 CC1(CO)CC(O)[C@]2(C(=O)O)CCC34CC3(C=CC3[C@]5(C)C(CC[C@]34C)C(C)(CO)[C@@H](O)[C@H](O)[C@@H]5O)C2C1 InChI=1S/C30H46O8/c1-24(14-31)11-18-28-8-6-17-26(3,29(28,13-28)9-10-30(18,23(37)38)19(33)12-24)7-5-16-25(2,15-32)21(35)20(34)22(36)27(16,17)4/h6,8,16-22,31-36H,5,7,9-15H2,1-4H3,(H,37,38)/t16?,17?,18?,19?,20-,21-,22-,24?,25?,26+,27-,28?,29?,30-/m0/s1 48365.55666666666 0.0 0.0 39691.36 46074.23 59331.08 0.0 0.0 0.0 0.0 0.0 0.0 619.2919 17.1 17.1 0 8 33729.535 0.0 0.0 38858.355 24565.67 37764.58 0.0 0.0 0.0 0.0 0.0 0.0 619.2921 16.92 16.92 0 8 109677.35166666668 0.0 0.0 132385.67 80903.33 115743.055 0.0 0.0 0.0 0.0 0.0 0.0 602.4332 14.27 14.27 0 3 CHEBI:181879 CC1(CO)CC(O)[C@]2(C(=O)O)CCC34CC3(C=CC3[C@]5(C)C(CC[C@]34C)C(C)(CO)[C@@H](O)[C@H](O)[C@@H]5O)C2C1 InChI=1S/C30H46O8/c1-24(14-31)11-18-28-8-6-17-26(3,29(28,13-28)9-10-30(18,23(37)38)19(33)12-24)7-5-16-25(2,15-32)21(35)20(34)22(36)27(16,17)4/h6,8,16-22,31-36H,5,7,9-15H2,1-4H3,(H,37,38)/t16?,17?,18?,19?,20-,21-,22-,24?,25?,26+,27-,28?,29?,30-/m0/s1 197297.14 0.0 0.0 171367.08 123455.18 297069.16 0.0 0.0 0.0 0.0 0.0 0.0 653.2975 16.43 16.43 0 8 842866.0133333333 223266.74666666667 0.0 874469.44 616036.4 1038092.2 153772.9 250343.28 265684.06 0.0 0.0 0.0 316.1912 5.48 5.48 0 15 50932.51966666666 0.0 0.0 57125.074 35400.465 60272.02 0.0 0.0 0.0 0.0 0.0 0.0 298.1444 3.62 3.62 0 40 PF-9366 CN(C)CCc1nnc2cc(-c3ccccc3)c3c(ccc(Cl)c3)n12 InChI=1S/C20H19ClN4/c1-24(2)11-10-19-22-23-20-13-16(14-6-4-3-5-7-14)17-12-15(21)8-9-18(17)25(19)20/h3-9,12-13H,10-11H2,1-2H3 36860.87233333333 0.0 0.0 39143.98 33732.11 37706.527 0.0 0.0 0.0 0.0 0.0 0.0 435.2887 16.44 16.44 0 3 222226.41666666663 0.0 0.0 194320.64 218518.95 253839.66 0.0 0.0 0.0 0.0 0.0 0.0 554.1695 4.78 4.78 0 60 NCGC00169057-02_C17H26O11_Methyl (1S,4aS,5R,7S,7aS)-1-(beta-D-glucopyranosyloxy)-5,7-dihydroxy-7-methyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylate COC(=O)\\C1=C\\O[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]3[C@@H]1[C@H](O)C[C@]3(C)O InChI=1S/C17H26O11/c1-17(24)3-7(19)9-6(14(23)25-2)5-26-15(10(9)17)28-16-13(22)12(21)11(20)8(4-18)27-16/h5,7-13,15-16,18-22,24H,3-4H2,1-2H3/t7-,8-,9+,10-,11-,12+,13-,15+,16+,17+/m1/s1 323868.67 79655.591 429785.44333333336 289605.66 304201.97 377798.38 60105.535 130104.484 48756.754 218010.53 403449.7 667896.1 335.1282 10.49 10.49 0 8 289913.39 28653.907 20668.803333333333 203218.8 288467.34 378054.03 26826.117 32230.604 26905.0 0.0 29231.9 32774.51 532.3486 12.14 12.14 0 18 Spectral Match to Monolinolenin (9c,12c,15c) from NIST14 nan nan 111068.94666666666 0.0 0.0 139467.88 84991.62 108747.34 0.0 0.0 0.0 0.0 0.0 0.0 643.2893 17.2 17.2 0 8 93243.14 35040.28366666666 94223.9 100391.86 92762.11 86575.45 34903.984 33117.312 37099.555 92597.1 89882.11 100192.49 737.1861 8.82 8.82 0 12 2738093.4 218721.6533333333 0.0 2521977.5 2417314.2 3274988.5 136114.72 371920.44 148129.8 0.0 0.0 0.0 621.3068 17.22 17.22 0 8 Pheophorbide A CCC1=C2C=C3C(=C4C(=O)C(C(=C5C(C(C(=N5)C=C6C(=C(C(=CC(=C1C)N2)N6)C=C)C)C)CCC(=O)O)C4=N3)C(=O)OC)C InChI=1S/C35H36N4O5/c1-8-19-15(3)22-12-24-17(5)21(10-11-28(40)41)32(38-24)30-31(35(43)44-7)34(42)29-18(6)25(39-33(29)30)14-27-20(9-2)16(4)23(37-27)13-26(19)36-22/h8,12-14,17,21,31,36-37H,1,9-11H2,2-7H3,(H,40,41) 1437212.9799999995 66119.46233333334 0.0 1347724.5 945081.44 2018833.0 106758.52 63586.867 28013.0 0.0 0.0 0.0 637.3014 16.77 16.77 0 8 3.10S-Hydroxypheophorbide a OC(CC[C@H]1[C@@H](C2=N/C1=C([C@](C(OC)=O)(O)C3=O)\\C4=C3C(C)=C(N4)/C=C5N=C(C(C)=C\\5CC)/C=C(N/6)/C(C=C)=C(C6=C\\2)C)C)=O InChI=1S/C35H36N4O6/c1-8-19-15(3)22-12-24-17(5)21(10-11-28(40)41)31(38-24)30-32-29(33(42)35(30,44)34(43)45-7)18(6)25(39-32)14-27-20(9-2)16(4)23(37-27)13-26(19)36-22/h8,12-14,17,21,36,39,44H,1,9-11H2,2-7H3,(H,40,41)/t17-,21-,35-/m0/s1 99287.62666666666 0.0 0.0 81650.28 81671.24 134541.36 0.0 0.0 0.0 0.0 0.0 0.0 822.5362 15.96 15.96 0 18 118948.23 0.0 0.0 79506.81 108944.19 168393.69 0.0 0.0 0.0 0.0 0.0 0.0 313.2741 13.38 13.38 0 58 Spectral Match to Monolaurin from NIST14 CCCCCCCCCCCC(=O)OCC(CO)O InChI=1S/C15H30O4/c1-2-3-4-5-6-7-8-9-10-11-15(18)19-13-14(17)12-16/h14,16-17H,2-13H2,1H3 70100.76666666666 925677.5066666668 10080570.0 56575.02 67896.59 85830.69 756216.5 1610783.9 410032.12 5876521.0 11172225.0 13192964.0 323.1284 9.2 9.2 0 24 4,4'-Dimethoxychalcone COc1ccc(/C=C/C(=O)c2ccc(OC)cc2)cc1 InChI=1S/C17H16O3/c1-19-15-8-3-13(4-9-15)5-12-17(18)14-6-10-16(20-2)11-7-14/h3-12H,1-2H3/b12-5+ 52645.25 0.0 0.0 42879.05 57479.766 57576.934 0.0 0.0 0.0 0.0 0.0 0.0 366.1007 4.09 4.09 0 40 1-[(4-hydroxyphenyl)methyl]-6-methoxy-1,2,3,4-tetrahydroisoquinolin-7-ol COc(cc(CCNC1Cc(cc2)ccc2O)c1c1)c1O InChI=1S/C17H19NO3/c1-21-17-9-12-6-7-18-15(14(12)10-16(17)20)8-11-2-4-13(19)5-3-11/h2-5,9-10,15,18-20H,6-8H2,1H3/t15-/m0/s1 423404.4966666668 0.0 0.0 408222.34 339982.03 522009.12 0.0 0.0 0.0 0.0 0.0 0.0 629.2374 14.34 14.34 0 21 86834.578 14383.699333333332 0.0 82995.164 69508.586 107999.984 0.0 0.0 43151.098 0.0 0.0 0.0 748.4763 15.63 15.63 0 66 258559.31 368437.7233333333 831481.4166666666 254901.27 204026.56 316750.1 270949.97 537425.9 296937.3 510708.25 761559.6 1222176.4 233.1175 8.89 8.89 0 34 44977.24133333333 0.0 0.0 37296.01 45550.562 52085.152 0.0 0.0 0.0 0.0 0.0 0.0 374.1087 3.22 3.22 0 41 Saccatoside C[C@@H]1O[C@@H](O[C@H]2[C@@H]3C=CO[C@@H](O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H]3[C@@]3(CO)O[C@@H]23)[C@H](OC(=O)/C=C/c2ccc(O)cc2)[C@H](O)[C@H]1O InChI=1S/C30H38O16/c1-12-19(35)22(38)25(43-17(34)7-4-13-2-5-14(33)6-3-13)29(41-12)44-24-15-8-9-40-27(18(15)30(11-32)26(24)46-30)45-28-23(39)21(37)20(36)16(10-31)42-28/h2-9,12,15-16,18-29,31-33,35-39H,10-11H2,1H3/b7-4+/t12-,15+,16+,18+,19-,20+,21-,22+,23+,24-,25+,26-,27-,28-,29-,30+/m0/s1 63215.744666666666 0.0 0.0 44078.027 60747.797 84821.41 0.0 0.0 0.0 0.0 0.0 0.0 454.2591 14.09 14.09 0 11 32763.04 0.0 10106.545666666669 24993.46 29680.34 43615.32 0.0 0.0 0.0 0.0 0.0 30319.637 534.3642 13.03 13.03 0 18 Spectral Match to 1-Linoleoylglycerol from NIST14 CCCCC/C=C\\C/C=C\\CCCCCCCC(=O)OCC(CO)O InChI=1S/C21H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-19-20(23)18-22/h6-7,9-10,20,22-23H,2-5,8,11-19H2,1H3/b7-6-,10-9- 95411.85 0.0 0.0 82360.66 79397.52 124477.37 0.0 0.0 0.0 0.0 0.0 0.0 508.1968 9.37 9.37 0 28 56141.94666666668 0.0 0.0 38589.758 43671.168 86164.914 0.0 0.0 0.0 0.0 0.0 0.0 311.2585 12.88 12.88 0 58 (2R,6R)-2-methyl-6-pentadecylpiperidine CCCCCCCCCCCCCCC[C@@H]1N[C@@H](C)CCC1 InChI=1S/C21H43N/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-18-21-19-16-17-20(2)22-21/h20-22H,3-19H2,1-2H3/t20-,21-/m0/s1 120672.558 17066.911333333333 0.0 99283.984 115252.92 147480.77 0.0 0.0 51200.734 0.0 0.0 0.0 221.0811 8.26 8.26 0 34 Piplartine COc1cc(/C=C/C(=O)N2CCC=CC2=O)cc(OC)c1OC InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+ 0.0 188320.6233333333 90578.79333333332 0.0 0.0 0.0 0.0 300404.25 264557.62 0.0 0.0 271736.38 587.5493 16.88 16.88 0 8 39979.545666666665 12001.198 0.0 33915.004 38896.863 47126.77 0.0 0.0 36003.594 0.0 0.0 0.0 526.1921 5.1 5.1 0 53 0.0 176348.08333333334 42381.992 0.0 0.0 0.0 133296.45 254030.03 141717.77 0.0 74619.836 52526.14 313.0825 3.77 3.77 0 42 374460.1866666667 90802.35 438044.3033333334 347523.66 310899.34 464957.56 114430.78 59274.54 98701.73 404749.0 435681.88 473702.03 291.0868 4.22 4.22 0 93 Catechin Oc1cc(O)c2c(c1)O[C@H](c1ccc(O)c(O)c1)[C@H](O)C2 InChI=1S/C15H14O6/c16-8-4-11(18)9-6-13(20)15(21-14(9)5-8)7-1-2-10(17)12(19)3-7/h1-5,13,15-20H,6H2/t13-,15-/m1/s1 49654.795666666665 0.0 0.0 29215.412 53572.145 66176.83 0.0 0.0 0.0 0.0 0.0 0.0 621.2449 8.47 8.47 0 28 1021129.2 22863.454 0.0 903421.5 624550.0 1535416.1 0.0 41254.266 27336.096 0.0 0.0 0.0 635.287 16.17 16.17 0 8 213157.62666666665 52289.286 0.0 218287.75 187721.83 233463.3 39132.55 55752.55 61982.758 0.0 0.0 0.0 347.231 6.06 6.06 0 22 353833.28 0.0 0.0 359955.7 290448.2 411095.94 0.0 0.0 0.0 0.0 0.0 0.0 583.4154 12.74 12.74 0 3 137754.34 29326.866 153599.95 117889.44 150964.72 144408.86 28745.035 25746.887 33488.676 142621.69 159073.06 159105.1 334.1291 7.29 7.29 0 2 Piplartine COc1cc(/C=C/C(=O)N2CCC=CC2=O)cc(OC)c1OC InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+ 112006.19333333331 0.0 0.0 108748.21 69472.53 157797.84 0.0 0.0 0.0 0.0 0.0 0.0 623.2508 13.64 13.64 0 8 ferulic acid CollisionEnergy:205060 COc1cc(C=CC(=O)O)ccc1O "InChI=1S/C10H10O4/c1-14-9-6-7(2-4-8(9)11)3-5-10(12)13/h2-6,11H,1H3,(H,12,13)/b5-3+" 70590.93833333334 0.0 0.0 71513.945 62297.03 77961.84 0.0 0.0 0.0 0.0 0.0 0.0 665.2969 17.06 17.06 0 8 45714.29433333333 0.0 0.0 49855.004 37552.324 49735.555 0.0 0.0 0.0 0.0 0.0 0.0 391.2638 13.57 13.57 0 94 61278.51499999999 0.0 0.0 62350.562 45630.863 75854.12 0.0 0.0 0.0 0.0 0.0 0.0 583.415 15.27 15.27 0 3 0.0 0.0 108639.52 0.0 0.0 0.0 0.0 0.0 0.0 92571.34 111893.55 121453.67 242.1026 1.0 1.0 0 72 Dianthoside Cc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(=O)cco1 InChI=1S/C12H16O8/c1-5-11(6(14)2-3-18-5)20-12-10(17)9(16)8(15)7(4-13)19-12/h2-3,7-10,12-13,15-17H,4H2,1H3/t7-,8-,9+,10-,12+/m1/s1 78649.85666666667 0.0 0.0 72721.63 76831.85 86396.09 0.0 0.0 0.0 0.0 0.0 0.0 455.999 3.55 3.55 0 41 29725.114 30115.744666666666 83343.746 26019.71 27837.932 35317.7 0.0 90347.234 0.0 47903.734 84039.02 118088.484 205.1954 12.62 12.62 0 10 5-(5-methoxycarbonyl-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl)-3-methylpentanoic acid C=C1CCC2C(C)(C(=O)OC)CCCC2(C)C1CCC(C)CC(=O)O InChI=1S/C21H34O4/c1-14(13-18(22)23)7-9-16-15(2)8-10-17-20(16,3)11-6-12-21(17,4)19(24)25-5/h14,16-17H,2,6-13H2,1,3-5H3,(H,22,23) 172891.79133333333 0.0 0.0 171792.78 127917.734 218964.86 0.0 0.0 0.0 0.0 0.0 0.0 618.4285 12.14 12.14 0 3 CHEBI:181879 CC1(CO)CC(O)[C@]2(C(=O)O)CCC34CC3(C=CC3[C@]5(C)C(CC[C@]34C)C(C)(CO)[C@@H](O)[C@H](O)[C@@H]5O)C2C1 InChI=1S/C30H46O8/c1-24(14-31)11-18-28-8-6-17-26(3,29(28,13-28)9-10-30(18,23(37)38)19(33)12-24)7-5-16-25(2,15-32)21(35)20(34)22(36)27(16,17)4/h6,8,16-22,31-36H,5,7,9-15H2,1-4H3,(H,37,38)/t16?,17?,18?,19?,20-,21-,22-,24?,25?,26+,27-,28?,29?,30-/m0/s1 0.0 0.0 211205.96566666663 0.0 0.0 0.0 0.0 0.0 0.0 59783.867 246227.5 327606.53 205.1954 16.88 16.88 0 10 Bisabolol CollisionEnergy:205060 CC(C)=CCCC(C)(O)C1CC=C(C)CC1 "InChI=1S/C15H26O/c1-12(2)6-5-11-15(4,16)14-9-7-13(3)8-10-14/h6-7,14,16H,5,8-11H2,1-4H3" 731843.7333333334 64015.35533333333 0.0 0.0 1450275.5 745255.7 0.0 84729.266 107316.8 0.0 0.0 0.0 431.3525 16.01 16.01 0 64 26623.449000000004 29242.335000000003 65698.33466666668 35692.773 44177.574 0.0 32940.055 31667.725 23119.225 74547.97 62320.94 60226.094 220.9816 0.88 0.88 0 5 Thelephoric acid O=C1c2c(c3c(cc(O)c(O)c3)o2)C(=O)c2c1c1c(o2)cc(c(c1)O)O "InChI=1S/C18H8O8/c19-7-1-5-11(3-9(7)21)25-17-13(5)15(23)18-14(16(17)24)6-2-8(20)10(22)4-12(6)26-18/h1-4,19-22H" 231251.90666666665 38197.600333333336 127925.735 193051.03 238931.42 261773.27 33252.086 33087.973 48252.742 103735.625 134220.7 145820.88 304.1186 7.7 7.7 0 6 Sibiricose A6 COc1cc(/C=C/C(=O)O[C@H]2[C@H](O)[C@@H](CO)O[C@@]2(CO)O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(OC)c1O InChI=1S/C23H32O15/c1-33-11-5-10(6-12(34-2)16(11)28)3-4-15(27)36-21-18(30)14(8-25)37-23(21,9-26)38-22-20(32)19(31)17(29)13(7-24)35-22/h3-6,13-14,17-22,24-26,28-32H,7-9H2,1-2H3/b4-3+/t13-,14-,17-,18-,19+,20-,21+,22-,23+/m1/s1 37416.46 45429.853 221759.02 61860.38 0.0 50389.0 51115.004 36697.188 48477.367 211725.64 266588.22 186963.2 268.1335 5.32 5.32 0 9 Asimilobine 215096.75333333333 81018.84733333334 158894.91333333333 294683.34 83759.7 266847.22 85547.766 73979.586 83529.19 174370.39 155450.27 146864.08 282.1494 6.52 6.52 0 8 Massbank:NA002903 (-)-Nuciferine|Nuciferine|(6aR)-1,2-dimethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline CN1CCc2cc(c(c-3c2[C@H]1Cc4c3cccc4)OC)OC 1S/C19H21NO2/c1-20-9-8-13-11-16(21-2)19(22-3)18-14-7-5-4-6-12(14)10-15(20)17(13)18/h4-7,11,15H,8-10H2,1-3H3/t15-/m1/s1 73162.39833333333 0.0 0.0 70732.59 103663.96 45090.645 0.0 0.0 0.0 0.0 0.0 0.0 870.5658 16.49 16.49 0 8 Pheophytin a nan nan 21933.612 20652.443333333333 78186.85566666667 26452.871 39347.965 0.0 0.0 61957.33 0.0 143572.39 53396.29 37591.887 471.2132 6.22 6.22 0 2 Cintriamide COc1cc(C=CC(N)=O)cc(OC)c1OC "InChI=1S/C12H15NO4/c1-15-9-6-8(4-5-11(13)14)7-10(16-2)12(9)17-3/h4-7H,1-3H3,(H2,13,14)/b5-4+" 179414.29666666666 64491.46333333334 520018.68333333335 158375.92 173413.25 206453.72 65253.0 74074.77 54146.62 459309.9 548656.9 552089.25 314.1392 6.61 6.61 0 6 NCGC00169550-02!(E)-3-(4-hydroxy-3-methoxyphenyl)-N-[2-(4-hydroxyphenyl)ethyl]prop-2-enamide [IIN-based: Match] COC1=C(O)C=CC(\\\\C=C\\\\C(=O)NCCC2=CC=C(O)C=C2)=C1 InChI=1S/C18H19NO4/c1-23-17-12-14(4-8-16(17)21)5-9-18(22)19-11-10-13-2-6-15(20)7-3-13/h2-9,12,20-21H,10-11H2,1H3,(H,19,22)/b9-5+ 45898.087666666666 0.0 29070.685 47271.156 44093.22 46329.887 0.0 0.0 0.0 41815.688 45396.367 0.0 459.0617 8.82 8.82 0 2 700200.6866666666 136214.0006666667 26327.589666666667 578670.06 679134.6 842797.4 31910.152 96221.82 280510.03 0.0 39843.023 39139.746 657.2425 9.58 9.58 0 4 45312.21666666667 0.0 72844.40999999999 67404.9 0.0 68531.75 0.0 0.0 0.0 0.0 110094.0 108439.23 505.1767 1.0 1.0 0 39 beta-Lactose - 40.0 eV C([C@@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)O[C@@H]2[C@H](O[C@H]([C@@H]([C@H]2O)O)O)CO)O)O)O)O InChI=1S/C12H22O11/c13-1-3-5(15)6(16)9(19)12(22-3)23-10-4(2-14)21-11(20)8(18)7(10)17/h3-20H,1-2H2/t3-,4-,5+,6+,7-,8-,9-,10-,11-,12+/m1/s1 106737.31866666667 0.0 0.0 149732.14 76758.23 93721.586 0.0 0.0 0.0 0.0 0.0 0.0 467.1819 7.32 7.32 0 2 "(2E)-N-{[(4-methoxyphenyl)amino]thioxomethyl}-3-(3,4,5-trimethoxyphenyl)prop-2 -enamide CollisionEnergy:102040" COc1ccc(NC(=S)N=C(O)C=Cc2cc(OC)c(OC)c(OC)c2)cc1 "InChI=1S/C20H22N2O5S/c1-24-15-8-6-14(7-9-15)21-20(28)22-18(23)10-5-13-11-16(25-2)19(27-4)17(12-13)26-3/h5-12H,1-4H3,(H2,21,22,23,28)/b10-5+" 217637.44333333336 128420.97766666666 66237.61333333334 161002.34 198583.05 293326.94 33930.633 152480.03 198852.27 44496.14 79573.46 74643.24 657.2426 9.99 9.99 0 4 67429.59366666667 0.0 0.0 69396.086 59278.14 73614.555 0.0 0.0 0.0 0.0 0.0 0.0 317.1841 3.68 3.68 0 40 0.0 203100.1433333333 2286931.9 0.0 0.0 0.0 159422.05 361114.3 88764.08 1282363.5 2541196.0 3037236.2 341.1387 9.2 9.2 0 24 Knemolic acid B OC1=C(C(O)=O)C(CCCCCCC2=CC(OCO3)=C3C=C2)=CC=C1 InChI=1S/C20H22O5/c21-16-9-5-8-15(19(16)20(22)23)7-4-2-1-3-6-14-10-11-17-18(12-14)25-13-24-17/h5,8-12,21H,1-4,6-7,13H2,(H,22,23) 191020.42 0.0 0.0 188506.84 166553.19 218001.23 0.0 0.0 0.0 0.0 0.0 0.0 476.2286 2.46 2.46 0 44 1564795.9666666668 262994.9733333333 0.0 1367630.4 1578213.4 1748544.1 156891.88 332381.16 299711.88 0.0 0.0 0.0 568.4265 16.6 16.6 0 3 CHEBI:181879 CC1(CO)CC(O)[C@]2(C(=O)O)CCC34CC3(C=CC3[C@]5(C)C(CC[C@]34C)C(C)(CO)[C@@H](O)[C@H](O)[C@@H]5O)C2C1 InChI=1S/C30H46O8/c1-24(14-31)11-18-28-8-6-17-26(3,29(28,13-28)9-10-30(18,23(37)38)19(33)12-24)7-5-16-25(2,15-32)21(35)20(34)22(36)27(16,17)4/h6,8,16-22,31-36H,5,7,9-15H2,1-4H3,(H,37,38)/t16?,17?,18?,19?,20-,21-,22-,24?,25?,26+,27-,28?,29?,30-/m0/s1 62580.62100000001 0.0 0.0 56706.848 50354.965 80680.05 0.0 0.0 0.0 0.0 0.0 0.0 655.3128 13.77 13.77 0 68 39878.31266666667 0.0 0.0 33818.29 38317.992 47498.656 0.0 0.0 0.0 0.0 0.0 0.0 757.0732 3.55 3.55 0 41 96139.95333333332 0.0 0.0 65528.93 92380.63 130510.3 0.0 0.0 0.0 0.0 0.0 0.0 537.3039 12.14 12.14 0 29 65940.21666666666 0.0 0.0 69874.89 48510.04 79435.72 0.0 0.0 0.0 0.0 0.0 0.0 330.1705 3.15 3.15 0 40 O-methylarmepavine [H][C@@]1(CC2=CC=C(OC)C=C2)C3=CC(OC)=C(OC)C=C3CCN1C InChI=1S/C20H25NO3/c1-21-10-9-15-12-19(23-3)20(24-4)13-17(15)18(21)11-14-5-7-16(22-2)8-6-14/h5-8,12-13,18H,9-11H2,1-4H3/t18-/m1/s1 505828.6 272512.0266666667 224485.50833333333 0.0 909564.9 607920.9 126743.89 266831.66 423960.53 107290.445 259083.52 307082.56 796.5939 17.25 17.25 0 18 DG(18:2/0:0/18:2); [M+NH4]+ C39H72N1O5 nan nan 4135696.233333333 47379.70133333333 0.0 3857592.2 3150999.5 5398497.0 0.0 72459.62 69679.484 0.0 0.0 0.0 592.2685 15.86 15.86 0 8 1021482.6166666666 12755.523333333333 0.0 1143623.4 667518.25 1253306.2 0.0 0.0 38266.57 0.0 0.0 0.0 300.1599 3.62 3.62 0 40 Higenamine OC1=CC=C(C=C1)CC2NCCC3=CC(O)=C(O)C=C32 InChI=1S/C16H17NO3/c18-12-3-1-10(2-4-12)7-14-13-9-16(20)15(19)8-11(13)5-6-17-14/h1-4,8-9,14,17-20H,5-7H2 38375.47233333333 0.0 0.0 39954.793 30422.664 44748.96 0.0 0.0 0.0 0.0 0.0 0.0 434.2819 16.44 16.44 0 3 71478.48366666667 0.0 0.0 61967.996 58466.445 94001.01 0.0 0.0 0.0 0.0 0.0 0.0 627.2318 9.37 9.37 0 4 0.0 0.0 231572.78666666665 0.0 0.0 0.0 0.0 0.0 0.0 313168.75 176053.67 205495.94 344.1497 6.77 6.77 0 6 NCGC00169550-02!(E)-3-(4-hydroxy-3-methoxyphenyl)-N-[2-(4-hydroxyphenyl)ethyl]prop-2-enamide [IIN-based: Match] COC1=C(O)C=CC(\\\\C=C\\\\C(=O)NCCC2=CC=C(O)C=C2)=C1 InChI=1S/C18H19NO4/c1-23-17-12-14(4-8-16(17)21)5-9-18(22)19-11-10-13-2-6-15(20)7-3-13/h2-9,12,20-21H,10-11H2,1H3,(H,19,22)/b9-5+ 32605.78133333333 0.0 0.0 30048.531 30035.043 37733.77 0.0 0.0 0.0 0.0 0.0 0.0 284.1498 1.71 1.71 0 6 1839060.1666666667 0.0 335958.60000000003 0.0 0.0 5517180.5 0.0 0.0 0.0 541310.0 466565.8 0.0 794.5783 14.21 14.21 0 18 DG(18:2/18:3/0:0); [M+NH4]+ C39H70N1O5 nan nan 128289.94333333331 62103.12100000001 318911.48666666663 88448.76 163679.67 132741.4 54723.85 100861.54 30723.973 235545.06 297401.5 423787.9 450.2492 6.48 6.48 0 24 NCGC00380478-01!(3S,3aR,6S,6aR)-3,6-bis(3,4-dimethoxyphenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan COC1=C(OC)C=C(C=C1)[C@H]2OC[C@H]3[C@@H]2CO[C@@H]3C4=CC(OC)=C(OC)C=C4 InChI=1S/C22H26O6/c1-23-17-7-5-13(9-19(17)25-3)21-15-11-28-22(16(15)12-27-21)14-6-8-18(24-2)20(10-14)26-4/h5-10,15-16,21-22H,11-12H2,1-4H3/t15-,16-,21+,22+/m0/s1 45571.435 0.0 0.0 36896.547 42605.453 57212.305 0.0 0.0 0.0 0.0 0.0 0.0 735.1381 3.55 3.55 0 78 8168710.5 1651761.5 31915.491 8306882.0 7380685.5 8818564.0 1049467.6 1915139.1 1990677.8 21237.053 35196.21 39313.21 621.3069 17.04 17.04 0 8 Pheophorbide A CCC1=C2C=C3C(=C4C(=O)C(C(=C5C(C(C(=N5)C=C6C(=C(C(=CC(=C1C)N2)N6)C=C)C)C)CCC(=O)O)C4=N3)C(=O)OC)C InChI=1S/C35H36N4O5/c1-8-19-15(3)22-12-24-17(5)21(10-11-28(40)41)32(38-24)30-31(35(43)44-7)34(42)29-18(6)25(39-33(29)30)14-27-20(9-2)16(4)23(37-27)13-26(19)36-22/h8,12-14,17,21,31,36-37H,1,9-11H2,2-7H3,(H,40,41) 214232.04666666663 20323.411333333333 0.0 184768.27 209720.6 248207.27 0.0 0.0 60970.234 0.0 0.0 0.0 499.317 13.84 13.84 0 11 26326.535666666663 17480.375666666667 71512.68766666666 34677.617 44301.99 0.0 0.0 30900.148 21540.979 74515.414 75195.055 64827.594 400.9397 0.88 0.88 0 5 66534.77666666667 42015.677 0.0 62638.777 65023.363 71942.19 42884.242 40786.227 42376.562 0.0 0.0 0.0 229.1227 6.9 6.9 0 30 abscisic acid CollisionEnergy:205060 CC1=CC(=O)CC([C@]1(/C=C/C(=C\\C(=O)O)/C)O)(C)C "InChI=1S/C15H20O4/c1-10(7-13(17)18)5-6-15(19)11(2)8-12(16)9-14(15,3)4/h5-8,19H,9H2,1-4H3,(H,17,18)/b6-5+,10-7-/t15-/m1/s1" 46498.76833333333 0.0 0.0 44157.742 36308.137 59030.426 0.0 0.0 0.0 0.0 0.0 0.0 607.2552 15.87 15.87 0 8 424548.39333333337 62946.35 0.0 323139.34 407456.28 543049.56 0.0 0.0 188839.05 0.0 0.0 0.0 454.2592 13.81 13.81 0 11 454365.8233333334 127259.84466666666 577057.1666666667 317765.53 571402.06 473929.88 192176.86 93599.51 96003.164 1046772.56 291479.84 392919.1 207.0655 7.38 7.38 0 48 SINAPIC ACID CollisionEnergy:205060 COc1cc(C=CC(=O)O)cc(OC)c1O "InChI=1S/C11H12O5/c1-15-8-5-7(3-4-10(12)13)6-9(16-2)11(8)14/h3-6,14H,1-2H3,(H,12,13)/b4-3+" 156809.6066666667 0.0 0.0 118539.32 193014.73 158874.77 0.0 0.0 0.0 0.0 0.0 0.0 870.5657 16.71 16.71 0 8 Pheophytin a nan nan 22473.50533333333 0.0 125312.72166666666 0.0 0.0 67420.516 0.0 0.0 0.0 77565.195 152991.36 145381.61 453.3983 15.89 15.89 0 36 Spectral Match to Nonaethylene glycol from NIST14 nan nan 0.0 15326.312666666669 597518.9333333333 0.0 0.0 0.0 0.0 45978.938 0.0 247266.9 608566.5 936723.4 717.2909 9.2 9.2 0 24 34414.57666666667 0.0 15763.25 53537.74 49705.99 0.0 0.0 0.0 0.0 0.0 0.0 47289.75 436.0645 8.8 8.8 0 20 264952.11 399928.9033333333 279813.7966666667 254604.27 338716.44 201535.62 409816.38 360696.8 429273.53 345560.7 266792.0 227088.69 202.9515 1.05 1.05 0 84 0.0 168332.03133333335 724929.5666666668 0.0 0.0 0.0 128262.734 293461.78 83271.58 303017.1 678593.2 1193178.4 355.1176 10.71 10.71 0 24 7,8-dihydromethysticin COC1=CC(=O)O[C@@H](CCc2ccc3c(c2)OCO3)C1 InChI=1S/C15H16O5/c1-17-12-7-11(20-15(16)8-12)4-2-10-3-5-13-14(6-10)19-9-18-13/h3,5-6,8,11H,2,4,7,9H2,1H3/t11-/m0/s1 60289.116 0.0 0.0 51102.188 62505.24 67259.92 0.0 0.0 0.0 0.0 0.0 0.0 201.0912 10.08 10.08 0 52 0.0 0.0 409686.9666666666 0.0 0.0 0.0 0.0 0.0 0.0 595463.25 422123.38 211474.27 326.1396 3.67 3.67 0 40 PJ34 CN(C)CC(=O)Nc1cc2c(cc1)[nH]c(=O)c1ccccc12 InChI=1S/C17H17N3O2/c1-20(2)10-16(21)18-11-7-8-15-14(9-11)12-5-3-4-6-13(12)17(22)19-15/h3-9H,10H2,1-2H3,(H,18,21)(H,19,22) 160130.84333333335 67876.78033333334 385043.20333333337 113342.65 198767.28 168282.6 52148.15 119146.33 32335.861 242594.95 365952.06 546582.6 369.17 6.48 6.48 0 24 "4-[(1R,5R)-6-(3,4-dimethoxyphenyl)-3,7-dioxabicyclo[3.3.0]oct-2-yl]-1,2-dimeth oxybenzene CollisionEnergy:205060" COc1ccc(C2OCC3C(c4ccc(OC)c(OC)c4)OCC23)cc1OC "InChI=1S/C22H26O6/c1-23-17-7-5-13(9-19(17)25-3)21-15-11-28-22(16(15)12-27-21)14-6-8-18(24-2)20(10-14)26-4/h5-10,15-16,21-22H,11-12H2,1-4H3/t15-,16-,21?,22?/m0/s1" 0.0 84556.98666666668 27772.656666666662 0.0 0.0 0.0 147732.14 105938.82 0.0 83317.97 0.0 0.0 305.9676 1.04 1.04 0 59 0.0 262885.10000000003 38594.27833333333 0.0 0.0 0.0 60817.5 535420.6 192417.2 0.0 73162.03 42620.805 297.0875 3.77 3.77 0 42 4-PYRIDOXATE - 60.0 eV CC1=NC=C(CO)C(C(O)=O)=C1O InChI=1S/C8H9NO4/c1-4-7(11)6(8(12)13)5(3-10)2-9-4/h2,10-11H,3H2,1H3,(H,12,13) 0.0 87870.32433333334 0.0 0.0 0.0 0.0 33844.953 199584.61 30181.41 0.0 0.0 0.0 205.1954 13.0 13.0 0 10 Bisabolol CollisionEnergy:205060 CC(C)=CCCC(C)(O)C1CC=C(C)CC1 "InChI=1S/C15H26O/c1-12(2)6-5-11-15(4,16)14-9-7-13(3)8-10-14/h6-7,14,16H,5,8-11H2,1-4H3" 0.0 103183.58333333331 17541.652333333335 0.0 0.0 0.0 101909.68 126904.03 80737.04 0.0 52624.957 0.0 311.0669 3.78 3.78 0 5 Ellagic acid O=C1OC2=C(O)C(O)=CC=3C(=O)OC=4C(O)=C(O)C=C1C4C23 InChI=1S/C14H6O8/c15-5-1-3-7-8-4(14(20)22-11(7)9(5)17)2-6(16)10(18)12(8)21-13(3)19/h1-2,15-18H 34457.020333333334 0.0 0.0 36003.008 26452.203 40915.85 0.0 0.0 0.0 0.0 0.0 0.0 349.2528 13.7 13.7 0 3 (2S,3S,4S,5R,6R)-6-[[(3S,4S,6aR,6bS,8R,8aR,9R,10R,12aS,14bR)-10-acetyloxy-8a-(acetyloxymethyl)-8,9-dihydroxy-4-(hydroxymethyl)-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-4-hydroxy-3,5-bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]oxane-2-carboxylic acid CC(=O)OC[C@@]12[C@@H](CC(C)(C)[C@@H](OC(C)=O)[C@@H]1O)C1=CCC3[C@@]4(C)CC[C@H](O[C@@H]5O[C@H](C(=O)O)[C@@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@H](O)[C@H]5O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@](C)(CO)C4CC[C@@]3(C)[C@]1(C)C[C@H]2O InChI=1S/C52H82O24/c1-21(56)69-20-52-24(15-47(3,4)42(41(52)66)70-22(2)57)23-9-10-28-48(5)13-12-30(49(6,19-55)27(48)11-14-50(28,7)51(23,8)16-29(52)58)73-46-39(75-45-36(64)34(62)32(60)26(18-54)72-45)37(65)38(40(76-46)43(67)68)74-44-35(63)33(61)31(59)25(17-53)71-44/h9,24-42,44-46,53-55,58-66H,10-20H2,1-8H3,(H,67,68)/t24-,25+,26+,27?,28?,29+,30-,31+,32+,33-,34-,35+,36+,37-,38-,39+,40-,41-,42-,44-,45-,46+,48-,49+,50+,51+,52-/m0/s1 3411344.0 876478.4 4408088.833333333 3097429.8 3199034.2 3937568.0 660207.8 1417721.1 551506.3 2292830.2 4178445.8 6752990.5 353.1388 10.49 10.49 0 24 143150.14133333333 7849.884666666666 0.0 126639.164 115653.64 187157.62 0.0 0.0 23549.654 0.0 0.0 0.0 605.2498 9.37 9.37 0 28 350235.0633333333 0.0 0.0 351329.0 307065.16 392311.03 0.0 0.0 0.0 0.0 0.0 0.0 687.4365 6.06 6.06 0 15 100410.95666666668 0.0 0.0 132095.14 75344.57 93793.16 0.0 0.0 0.0 0.0 0.0 0.0 584.4224 15.77 15.77 0 89 114535.87833333334 18928.693333333333 28838.04 116766.805 130149.74 96691.09 0.0 56786.08 0.0 0.0 0.0 86514.12 457.3502 15.88 15.88 0 8 199889.96333333332 25983.944666666663 0.0 209680.11 152253.45 237736.33 0.0 27289.24 50662.594 0.0 0.0 0.0 584.4223 16.45 16.45 0 89 0.0 36405.45 0.0 0.0 0.0 0.0 35085.844 45691.1 28439.406 0.0 0.0 0.0 267.0767 3.77 3.77 0 5 164810.88333333333 0.0 0.0 172029.22 138683.1 183720.33 0.0 0.0 0.0 0.0 0.0 0.0 589.2453 15.79 15.79 0 8 1084207.2333333334 107948.28166666666 0.0 1049998.9 1035530.0 1167092.8 30126.125 122225.56 171493.16 0.0 0.0 0.0 657.269 15.97 15.97 0 8 28931.98066666667 0.0 1562610.35 37482.402 0.0 49313.54 0.0 0.0 0.0 2275870.5 1610570.8 801389.75 330.1706 3.41 3.41 0 40 O-methylarmepavine [H][C@@]1(CC2=CC=C(OC)C=C2)C3=CC(OC)=C(OC)C=C3CCN1C InChI=1S/C20H25NO3/c1-21-10-9-15-12-19(23-3)20(24-4)13-17(15)18(21)11-14-5-7-16(22-2)8-6-14/h5-8,12-13,18H,9-11H2,1-4H3/t18-/m1/s1 270470.4 10114.366 0.0 265905.06 237650.61 307855.53 30343.098 0.0 0.0 0.0 0.0 0.0 254.1615 1.61 1.61 0 87 64870.898 0.0 0.0 66664.484 76417.78 51530.43 0.0 0.0 0.0 0.0 0.0 0.0 840.5465 15.62 15.62 0 18 352214.9266666667 0.0 0.0 342227.88 293117.34 421299.56 0.0 0.0 0.0 0.0 0.0 0.0 813.5126 16.42 16.42 0 26 0.0 30057.869666666666 0.0 0.0 0.0 0.0 21804.05 42831.895 25537.664 0.0 0.0 0.0 388.1609 5.86 5.86 0 39 3-oxo-3-[[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(4-hydroxy-5-methyl-2-propan-2-ylphenoxy)oxan-2-yl]methoxy]propanoic acid Cc1cc(O[C@@H]2O[C@H](COC(=O)CC(=O)O)[C@@H](O)[C@H](O)[C@H]2O)c(C(C)C)cc1O InChI=1S/C19H26O10/c1-8(2)10-5-11(20)9(3)4-12(10)28-19-18(26)17(25)16(24)13(29-19)7-27-15(23)6-14(21)22/h4-5,8,13,16-20,24-26H,6-7H2,1-3H3,(H,21,22)/t13-,16-,17+,18-,19-/m1/s1 89294.35333333333 0.0 0.0 73649.2 99338.08 94895.78 0.0 0.0 0.0 0.0 0.0 0.0 492.2597 4.94 4.94 0 15 0.0 21188.694666666663 7398.427666666666 0.0 0.0 0.0 38188.586 25377.498 0.0 22195.283 0.0 0.0 202.0503 4.38 4.38 0 5 114961.15466666664 0.0 0.0 118000.38 107373.17 119509.914 0.0 0.0 0.0 0.0 0.0 0.0 490.2803 5.67 5.67 0 15 142125.19666666666 0.0 0.0 138300.83 132314.92 155759.84 0.0 0.0 0.0 0.0 0.0 0.0 584.4214 17.29 17.29 0 3 Massbank:MSJ00113 Lycopene-5,6-diol CC(=CCC/C(=C/C=C/C(=C/C=C/C(=C/C=C/C=C(\\C)/C=C/C=C(\\C)/C=C/C(C(C)(CCC=C(C)C)O)O)/C)/C)/C)C 1S/C40H58O2/c1-32(2)18-13-22-36(7)25-15-27-37(8)26-14-23-34(5)20-11-12-21-35(6)24-16-28-38(9)29-30-39(41)40(10,42)31-17-19-33(3)4/h11-12,14-16,18-21,23-30,39,41-42H,13,17,22,31H2,1-10H3/b12-11+,23-14+,24-16+,27-15+,30-29+,34-20+,35-21+,36-25+,37-26+,38-28+ 36536.49733333333 10785.381666666666 31964.673333333336 54035.176 0.0 55574.316 0.0 0.0 32356.145 51725.332 0.0 44168.688 464.0596 8.81 8.81 0 20 3529462.733333333 174065.02666666667 498556.7766666667 3064553.2 3652355.0 3871480.0 142352.8 221183.95 158658.33 295926.6 456861.53 742882.2 353.1387 10.09 10.09 0 24 95077.95233333332 0.0 0.0 80003.79 47018.617 158211.45 0.0 0.0 0.0 0.0 0.0 0.0 653.2973 16.29 16.29 0 8 15553.898333333333 484462.45333333337 0.0 46661.695 0.0 0.0 0.0 524649.8 928737.56 0.0 0.0 0.0 716.5224 15.91 15.91 0 18 Spectral Match to 1-Hexadecanoyl-2-(9Z-octadecenoyl)-sn-glycero-3-phosphoethanolamine from NIST14 CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)(O)OCCN)OC(=O)CCCCCCC/C=C\\CCCCCCCC InChI=1S/C39H76NO8P/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-30-32-39(42)48-37(36-47-49(43,44)46-34-33-40)35-45-38(41)31-29-27-25-23-21-19-16-14-12-10-8-6-4-2/h17-18,37H,3-16,19-36,40H2,1-2H3,(H,43,44)/b18-17-/t37-/m1/s1 55832.96133333333 61651.73766666666 61658.44666666666 57624.188 60954.348 48920.348 75217.81 55883.473 53853.93 72569.14 53694.32 58711.88 263.9472 0.86 0.86 0 62 156932.275 92205.69433333332 10078.852333333334 123267.945 152335.05 195193.83 69206.63 51465.473 155944.98 30236.557 0.0 0.0 680.3185 9.99 9.99 0 28 33238.73166666667 0.0 0.0 28057.412 32349.459 39309.324 0.0 0.0 0.0 0.0 0.0 0.0 365.2073 8.26 8.26 0 2 Piperlongumine CollisionEnergy:102040 COc1cc(C=CC(=O)N2CCC=CC2=O)cc(OC)c1OC "InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+" 0.0 0.0 556052.4633333334 0.0 0.0 0.0 0.0 0.0 0.0 377717.75 1109654.5 180785.14 360.0845 10.48 10.48 0 8 55113.58033333334 0.0 0.0 48518.453 51403.6 65418.688 0.0 0.0 0.0 0.0 0.0 0.0 515.7342 6.1 6.1 0 55 31224.119 74834.57900000001 0.0 28080.562 29865.342 35726.453 46074.543 76199.414 102229.78 0.0 0.0 0.0 315.0869 11.78 11.78 0 8 "4',7-Dimethoxy-3-hydroxyflavone CollisionEnergy:102040" COc1ccc(-c2oc3cc(OC)ccc3c(=O)c2O)cc1 "InChI=1S/C17H14O5/c1-20-11-5-3-10(4-6-11)17-16(19)15(18)13-8-7-12(21-2)9-14(13)22-17/h3-9,19H,1-2H3" 445358.34 152734.16 34099.92566666667 364064.94 423682.28 548327.8 98675.05 98198.83 261328.6 36160.707 36951.242 29187.828 680.3184 9.58 9.58 0 2 PIPERLONGUMINE COC1=CC(=CC(=C1OC)OC)C=CC(=O)N2CCC=CC2=O "InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3" 231061.8533333333 0.0 0.0 167904.0 397711.97 127569.59 0.0 0.0 0.0 0.0 0.0 0.0 344.186 4.63 4.63 0 40 AC1L9EVY CollisionEnergy:102040 COc1ccc(CC2c3cc(OC)c(OC)cc3CC[N+]2(C)C)cc1OC "InChI=1S/C22H30NO4/c1-23(2)10-9-16-13-21(26-5)22(27-6)14-17(16)18(23)11-15-7-8-19(24-3)20(12-15)25-4/h7-8,12-14,18H,9-11H2,1-6H3/q+1" 0.0 258150.88666666663 184657.1783333333 0.0 0.0 0.0 85665.81 358683.75 330103.1 114087.875 212814.06 227069.6 236.0921 1.27 1.27 0 5 Indole-3-butyric acid CollisionEnergy:102040 O=C(O)CCCc1c[nH]c2ccccc12 "InChI=1S/C12H13NO2/c14-12(15)7-3-4-9-8-13-11-6-2-1-5-10(9)11/h1-2,5-6,8,13H,3-4,7H2,(H,14,15)" 0.0 16731.813333333335 35870.355 0.0 0.0 0.0 0.0 50195.44 0.0 0.0 45008.125 62602.94 246.2218 8.07 8.07 0 76 210576.68 0.0 0.0 168913.48 188887.62 273928.94 0.0 0.0 0.0 0.0 0.0 0.0 657.2422 10.06 10.06 0 4 71947.42466666667 13520.49 112899.47000000002 74920.83 57735.734 83185.71 0.0 40561.47 0.0 43100.605 106505.805 189092.0 403.1759 7.89 7.89 0 86 6-[3-(3,4-dimethoxyphenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-6-yl]-4-methoxy-1,3-benzodioxole COc1ccc(C2OCC3C(c4cc(OC)c5c(c4)OCO5)OCC23)cc1OC InChI=1S/C22H24O7/c1-23-16-5-4-12(6-17(16)24-2)20-14-9-27-21(15(14)10-26-20)13-7-18(25-3)22-19(8-13)28-11-29-22/h4-8,14-15,20-21H,9-11H2,1-3H3 62713.27133333334 0.0 0.0 60030.37 59691.934 68417.51 0.0 0.0 0.0 0.0 0.0 0.0 333.1814 7.83 7.83 0 6 "(2E)-N-(3-acetylphenyl)-3-(3,4-dimethoxyphenyl)prop-2-enamide CollisionEnergy:102040" COc1ccc(C=CC(O)=Nc2cccc(C(C)=O)c2)cc1OC "InChI=1S/C19H19NO4/c1-13(21)15-5-4-6-16(12-15)20-19(22)10-8-14-7-9-17(23-2)18(11-14)24-3/h4-12H,1-3H3,(H,20,22)/b10-8+" 13577.983333333332 0.0 33380.72 0.0 0.0 40733.95 0.0 0.0 0.0 0.0 53059.336 47082.824 261.0371 1.03 1.03 0 72 Cori ester (alpha-anomer) - 40.0 eV C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)OP(=O)(O)O)O)O)O)O InChI=1S/C6H13O9P/c7-1-2-3(8)4(9)5(10)6(14-2)15-16(11,12)13/h2-10H,1H2,(H2,11,12,13)/t2-,3-,4+,5-,6-/m1/s1 64392.81333333333 0.0 0.0 55533.99 58456.38 79188.07 0.0 0.0 0.0 0.0 0.0 0.0 371.0614 2.97 2.97 0 43 ESCULIN C1=CC(=O)OC2=C1C=C(C(=C2)O)O[C@H]3[C@@H]([C@H]([C@@H]([C@@H](CO)O3)O)O)O "InChI=1S/C15H16O9/c16-5-10-12(19)13(20)14(21)15(24-10)23-9-3-6-1-2-11(18)22-8(6)4-7(9)17/h1-4,10,12-17,19-21H,5H2/t10-,12-,13+,14-,15-/m1/s1" 161330.179 155364.39333333334 414323.3366666666 192929.92 252893.75 38166.867 158928.97 179774.56 127389.65 446993.47 412218.38 383758.16 224.9906 0.88 0.88 0 5 27301.053666666663 37327.856 217780.382 38582.266 0.0 43320.895 29408.768 36477.97 46096.83 114774.086 294560.25 244006.81 207.1383 4.39 4.39 0 61 3,5,5-Trimethyl-4beta-hydroxy-4-[3-(beta-D-glucopyranosyloxy)-1-butenyl]-2-cyclohexene-1-one CC1=CC(=O)CC(C)(C)[C@@]1(O)/C=C/C(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O InChI=1S/C19H30O8/c1-10-7-12(21)8-18(3,4)19(10,25)6-5-11(2)26-17-16(24)15(23)14(22)13(9-20)27-17/h5-7,11,13-17,20,22-25H,8-9H2,1-4H3/b6-5+/t11?,13-,14-,15+,16-,17-,19-/m1/s1 64371.380000000005 139354.17 0.0 62436.99 61111.05 69566.1 108287.15 156216.02 153559.34 0.0 0.0 0.0 346.2017 4.99 4.99 0 15 2-(hydroxymethyl)-6-[5-[3-(hydroxymethyl)-5-(3-hydroxypropyl)-7-methoxy-2,3-dihydro-1-benzofuran-2-yl]-2-methoxyphenoxy]oxane-3,4,5-triol COc1ccc(C2Oc3c(OC)cc(CCCO)cc3C2CO)cc1OC1OC(CO)C(O)C(O)C1O InChI=1S/C26H34O11/c1-33-17-6-5-14(10-18(17)35-26-23(32)22(31)21(30)20(12-29)36-26)24-16(11-28)15-8-13(4-3-7-27)9-19(34-2)25(15)37-24/h5-6,8-10,16,20-24,26-32H,3-4,7,11-12H2,1-2H3 127742.76 0.0 0.0 113373.59 93314.36 176540.33 0.0 0.0 0.0 0.0 0.0 0.0 606.248 14.34 14.34 0 8 56936.214 0.0 0.0 40844.832 57514.0 72449.81 0.0 0.0 0.0 0.0 0.0 0.0 353.2689 11.08 11.08 0 18 Spectral Match to cis-5,8,11-Eicosatrienoic acid from NIST14 CCCCCCCC/C=C\\C/C=C\\C/C=C\\CCCC(=O)O InChI=1S/C20H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h9-10,12-13,15-16H,2-8,11,14,17-19H2,1H3,(H,21,22)/b10-9-,13-12-,16-15- 0.0 0.0 142819.60466666668 0.0 0.0 0.0 0.0 0.0 0.0 172527.48 108691.164 147240.17 393.9837 1.26 1.26 0 51 24560.259 23014.102666666666 24446.834666666666 36778.492 36902.285 0.0 38795.734 30246.574 0.0 39821.734 0.0 33518.77 221.9313 0.87 0.87 0 1 463295.87000000005 109782.74366666668 40546.374 366751.06 442819.75 580316.8 30245.691 95654.12 203448.42 25278.809 53775.918 42584.395 635.2606 9.99 9.99 0 28 339330.87999999995 0.0 0.0 247364.2 401808.5 368819.94 0.0 0.0 0.0 0.0 0.0 0.0 870.566 16.86 16.86 0 8 Pheophytin a nan nan 0.0 148400.56666666668 67195.989 0.0 0.0 0.0 92274.1 207981.16 144946.44 22179.287 97884.39 81524.29 243.9932 3.77 3.77 0 105 133776.30466666666 17105.244666666666 87391.60166666668 107691.164 141488.02 152149.73 24917.857 0.0 26397.877 94373.195 78738.59 89063.02 207.0656 7.7 7.7 0 48 362747.24 0.0 0.0 393086.75 303486.44 391668.53 0.0 0.0 0.0 0.0 0.0 0.0 600.4173 15.47 15.47 0 3 455138.32666666666 0.0 0.0 423044.5 236804.58 705565.9 0.0 0.0 0.0 0.0 0.0 0.0 667.2765 15.44 15.44 0 7 0.0 191596.49 14987.789 0.0 0.0 0.0 64177.95 377261.97 133349.55 0.0 44963.367 0.0 442.104 3.77 3.77 0 42 STL464062 CSCC[C@@H](NC(=O)Cc1c(C)c2cc3c(cc2oc1=O)occ3-c1ccc(C)cc1)C(=O)O InChI=1S/C26H25NO6S/c1-14-4-6-16(7-5-14)20-13-32-22-12-23-17(10-19(20)22)15(2)18(26(31)33-23)11-24(28)27-21(25(29)30)8-9-34-3/h4-7,10,12-13,21H,8-9,11H2,1-3H3,(H,27,28)(H,29,30)/t21-/m1/s1 93906.42533333332 0.0 0.0 79558.81 85855.016 116305.45 0.0 0.0 0.0 0.0 0.0 0.0 515.2327 6.09 6.09 0 55 313393.75 49324.405 0.0 241149.03 299092.66 399939.56 0.0 31191.275 116781.94 0.0 0.0 0.0 635.2604 9.59 9.59 0 17 72260.64 7843.082666666666 0.0 66918.25 68688.48 81175.19 0.0 23529.248 0.0 0.0 0.0 0.0 373.1647 4.83 4.83 0 24 2-[4-[(3R,3aR,6S,6aR)-3-(3,4-dimethoxyphenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-6-yl]-2-methoxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol COc1ccc([C@@H]2OC[C@@H]3[C@@H](c4ccc(OC5OC(CO)C(O)C(O)C5O)c(OC)c4)OC[C@H]23)cc1OC InChI=1S/C27H34O11/c1-32-17-6-4-13(8-19(17)33-2)25-15-11-36-26(16(15)12-35-25)14-5-7-18(20(9-14)34-3)37-27-24(31)23(30)22(29)21(10-28)38-27/h4-9,15-16,21-31H,10-12H2,1-3H3/t15-,16-,21?,22?,23?,24?,25-,26+,27?/m0/s1 456945.3 81530.83333333333 0.0 432639.62 397334.72 540861.56 0.0 142228.73 102363.77 0.0 0.0 0.0 599.4103 12.24 12.24 0 3 125315.19433333332 86009.93666666666 86884.14 152803.53 42949.223 180192.83 82617.71 74480.62 100931.48 75774.59 99273.59 85604.24 365.1057 1.04 1.04 0 88 0.0 31074.69133333333 83603.21333333333 0.0 0.0 0.0 59407.824 0.0 33816.25 250809.64 0.0 0.0 280.2641 14.86 14.86 0 58 (2E,4E)-N-(2-methylpropyl)dodeca-2,4-dienamide CCCCCCC/C=C/C=C/C(O)=NCC(C)C InChI=1S/C16H29NO/c1-4-5-6-7-8-9-10-11-12-13-16(18)17-14-15(2)3/h10-13,15H,4-9,14H2,1-3H3,(H,17,18)/b11-10+,13-12+ 195231.03000000003 0.0 0.0 182775.0 156675.92 246242.17 0.0 0.0 0.0 0.0 0.0 0.0 611.4676 16.42 16.42 0 18 Spectral Match to Eicosapentaenoic acid ethyl ester from NIST14 CC/C=C\\C/C=C\\C/C=C\\C/C=C\\C/C=C\\CCCC(=O)OCC InChI=1S/C22H34O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24-4-2/h5-6,8-9,11-12,14-15,17-18H,3-4,7,10,13,16,19-21H2,1-2H3/b6-5-,9-8-,12-11-,15-14-,18-17- 137660.67866666664 0.0 0.0 142009.94 88811.266 182160.83 0.0 0.0 0.0 0.0 0.0 0.0 625.2662 15.33 15.33 0 8 31775.233333333337 46166.555666666674 69215.67833333333 37823.54 57502.16 0.0 52209.44 46557.387 39732.84 84561.1 65221.465 57864.47 277.9362 1.15 1.15 0 73 56394.494333333336 40078.87666666666 0.0 37187.15 83482.38 48513.953 27762.25 40925.61 51548.77 0.0 0.0 0.0 298.1444 3.51 3.51 0 16 81724.67333333334 0.0 0.0 72191.0 79198.58 93784.44 0.0 0.0 0.0 0.0 0.0 0.0 346.2015 5.48 5.48 0 15 481715.5 20910.466333333334 421973.2166666666 462485.5 355499.75 627161.25 25228.852 0.0 37502.547 282017.47 473477.56 510424.62 579.1504 3.91 3.91 0 69 Spectral Match to Procyanidin B2 from NIST14 C1[C@H]([C@H](OC2=C1C(=CC(=C2[C@@H]3[C@H]([C@H](OC4=CC(=CC(=C34)O)O)C5=CC(=C(C=C5)O)O)O)O)O)C6=CC(=C(C=C6)O)O)O InChI=1S/C30H26O12/c31-13-7-20(37)24-23(8-13)41-29(12-2-4-16(33)19(36)6-12)27(40)26(24)25-21(38)10-17(34)14-9-22(39)28(42-30(14)25)11-1-3-15(32)18(35)5-11/h1-8,10,22,26-29,31-40H,9H2/t22-,26-,27-,28-,29-/m1/s1 351893.30666666664 71706.81266666666 465299.11 313862.5 341542.2 400275.22 85107.97 63156.234 66856.234 299617.47 507749.06 588530.8 304.1548 9.56 9.56 0 2 Piplartine COc1cc(/C=C/C(=O)N2CCC=CC2=O)cc(OC)c1OC InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+ 4744020.100000001 64606.291 40946.81133333334 4665752.5 3692460.8 5873847.0 67329.08 63853.047 62636.746 42736.914 53300.19 26803.33 286.1443 4.11 4.11 0 40 1-[(4-hydroxyphenyl)methyl]-6-methoxy-1,2,3,4-tetrahydroisoquinolin-7-ol COc(cc(CCNC1Cc(cc2)ccc2O)c1c1)c1O InChI=1S/C17H19NO3/c1-21-17-9-12-6-7-18-15(14(12)10-16(17)20)8-11-2-4-13(19)5-3-11/h2-5,9-10,15,18-20H,6-8H2,1H3/t15-/m0/s1 123666.80666666666 20624.248000000003 0.0 115796.15 121370.16 133834.11 0.0 38257.707 23615.037 0.0 0.0 0.0 570.2547 4.83 4.83 0 24 2-[4-[4-[hydroxy-(4-hydroxy-3-methoxyphenyl)methyl]-3-(hydroxymethyl)oxolan-2-yl]-2-methoxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol COc1cc(C(O)C2COC(c3ccc(OC4OC(CO)C(O)C(O)C4O)c(OC)c3)C2CO)ccc1O InChI=1S/C26H34O12/c1-34-18-7-12(3-5-16(18)29)21(30)15-11-36-25(14(15)9-27)13-4-6-17(19(8-13)35-2)37-26-24(33)23(32)22(31)20(10-28)38-26/h3-8,14-15,20-33H,9-11H2,1-2H3 36289382.66666666 6887175.666666667 0.0 36821620.0 33144712.0 38901816.0 5536475.5 7459311.0 7665740.5 0.0 0.0 0.0 314.1757 3.68 3.68 0 40 O-methylarmepavine [H][C@@]1(CC2=CC=C(OC)C=C2)C3=CC(OC)=C(OC)C=C3CCN1C InChI=1S/C20H25NO3/c1-21-10-9-15-12-19(23-3)20(24-4)13-17(15)18(21)11-14-5-7-16(22-2)8-6-14/h5-8,12-13,18H,9-11H2,1-4H3/t18-/m1/s1 217863.11666666667 135828.7666666667 35977.34566666667 202248.45 215828.0 235512.9 135621.7 133314.48 138550.12 21990.764 40516.066 45425.207 247.1331 6.9 6.9 0 30 ABSCISIC ACID CollisionEnergy:205060 CC(C=CC1(O)C(C)=CC(=O)CC1(C)C)=CC(=O)O "InChI=1S/C15H20O4/c1-10(7-13(17)18)5-6-15(19)11(2)8-12(16)9-14(15,3)4/h5-8,19H,9H2,1-4H3,(H,17,18)/b6-5+,10-7-" 0.0 0.0 457098.7333333333 0.0 0.0 0.0 0.0 0.0 0.0 551191.2 354953.0 465152.0 437.9734 1.26 1.26 0 51 0.0 0.0 49603.818 0.0 0.0 0.0 0.0 0.0 0.0 41578.49 51552.754 55680.21 453.0874 9.21 9.21 0 25 68276721.33333333 26083238.0 79657546.66666667 60935150.0 68564744.0 75330270.0 26905496.0 23870888.0 27473330.0 77360690.0 82281780.0 79330170.0 221.081 8.83 8.83 0 34 Piplartine COc1cc(/C=C/C(=O)N2CCC=CC2=O)cc(OC)c1OC InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+ 254787.80666666667 0.0 0.0 227627.2 163308.69 373427.53 0.0 0.0 0.0 0.0 0.0 0.0 615.2582 16.08 16.08 0 21 509718.96 0.0 9247.338 396194.06 78115.92 1054846.9 0.0 0.0 0.0 27742.014 0.0 0.0 467.1817 9.08 9.08 0 2 Piperlongumine CollisionEnergy:102040 COc1cc(C=CC(=O)N2CCC=CC2=O)cc(OC)c1OC "InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+" 55163.095 0.0 0.0 53049.363 34855.758 77584.164 0.0 0.0 0.0 0.0 0.0 0.0 625.2663 14.66 14.66 0 8 0.0 56511.095 652382.6266666666 0.0 0.0 0.0 46220.902 100055.125 23257.258 388094.44 721592.0 847461.44 293.1177 9.2 9.2 0 24 253420.97666666663 0.0 0.0 327674.3 207862.03 224726.6 0.0 0.0 0.0 0.0 0.0 0.0 600.4172 15.12 15.12 0 3 42530.30566666666 47885.30433333333 49566.95 45913.39 46763.703 34913.824 58779.19 44557.34 40319.383 60850.023 42382.71 45468.117 235.9524 0.86 0.86 0 62 12665.993333333334 0.0 48432.21 0.0 0.0 37997.98 0.0 0.0 0.0 0.0 75233.16 70063.47 487.1663 1.0 1.0 0 39 beta-Lactose - 40.0 eV C([C@@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)O[C@@H]2[C@H](O[C@H]([C@@H]([C@H]2O)O)O)CO)O)O)O)O InChI=1S/C12H22O11/c13-1-3-5(15)6(16)9(19)12(22-3)23-10-4(2-14)21-11(20)8(18)7(10)17/h3-20H,1-2H2/t3-,4-,5+,6+,7-,8-,9-,10-,11-,12+/m1/s1 27059.859666666667 0.0 0.0 22356.627 27206.602 31616.35 0.0 0.0 0.0 0.0 0.0 0.0 247.0604 3.47 3.47 0 19 naringenin CollisionEnergy:205060 O=C1CC(c2ccc(O)cc2)Oc2cc(O)cc(O)c21 "InChI=1S/C15H12O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-6,13,16-18H,7H2" 2380056.1666666665 12495.94 0.0 0.0 2831387.0 4308781.5 37487.82 0.0 0.0 0.0 0.0 0.0 595.2822 15.86 15.86 0 8 Pheophorbide A CCC1=C2C=C3C(=C4C(=O)C(C(=C5C(C(C(=N5)C=C6C(=C(C(=CC(=C1C)N2)N6)C=C)C)C)CCC(=O)O)C4=N3)C(=O)OC)C InChI=1S/C35H36N4O5/c1-8-19-15(3)22-12-24-17(5)21(10-11-28(40)41)32(38-24)30-31(35(43)44-7)34(42)29-18(6)25(39-33(29)30)14-27-20(9-2)16(4)23(37-27)13-26(19)36-22/h8,12-14,17,21,31,36-37H,1,9-11H2,2-7H3,(H,40,41) 629248.6066666666 0.0 0.0 369002.88 1135606.0 383136.94 0.0 0.0 0.0 0.0 0.0 0.0 871.5729 16.51 16.51 0 8 Chlorophyll a nan nan 196442.42 39246.684 0.0 191611.84 169328.86 228386.56 48594.31 35145.918 33999.824 0.0 0.0 0.0 837.3937 6.85 6.85 0 57 8388299.833333333 864730.82 303592.5366666667 9055552.0 6269028.5 9840319.0 874087.7 916791.2 803313.56 451216.53 281826.25 177734.83 328.1913 4.47 4.47 0 40 AC1L9EVY CollisionEnergy:102040 COc1ccc(CC2c3cc(OC)c(OC)cc3CC[N+]2(C)C)cc1OC "InChI=1S/C22H30NO4/c1-23(2)10-9-16-13-21(26-5)22(27-6)14-17(16)18(23)11-15-7-8-19(24-3)20(12-15)25-4/h7-8,12-14,18H,9-11H2,1-6H3/q+1" 3617870.466666667 309766.9666666667 0.0 3077655.2 3695431.2 4080525.0 216422.0 355194.78 357684.12 0.0 0.0 0.0 285.0762 9.64 9.64 0 8 5-hydroxy-2-(4-hydroxyphenyl)-7-methoxy-4H-chromen-4-one O=C1C=C(OC=2C=C(OC)C=C(O)C12)C=3C=CC(O)=CC3 InChI=1S/C16H12O5/c1-20-11-6-12(18)16-13(19)8-14(21-15(16)7-11)9-2-4-10(17)5-3-9/h2-8,17-18H,1H3 477930.1 1180864.4 664281.84 423244.62 578846.56 431699.12 1139284.6 1056142.8 1347165.8 710901.56 704052.4 577891.56 222.0612 1.21 1.21 0 31 2479-49-4 O=C(c1cc(C(=O)O)c(C(=O)O)cc1)c1cc(C(=O)O)c(C(=O)O)cc1 InChI=1S/C17H10O9/c18-13(7-1-3-9(14(19)20)11(5-7)16(23)24)8-2-4-10(15(21)22)12(6-8)17(25)26/h1-6H,(H,19,20)(H,21,22)(H,23,24)(H,25,26) 99713.617 0.0 0.0 129046.766 110073.12 60020.965 0.0 0.0 0.0 0.0 0.0 0.0 599.4102 12.56 12.56 0 3 0.0 151024.56999999998 139920.63533333334 0.0 0.0 0.0 125266.88 144231.0 183575.83 172984.6 120928.516 125848.79 282.0978 1.26 1.26 0 5 N-Methylglutamate - 40.0 eV CN[C@@H](CCC(=O)O)C(=O)O InChI=1S/C6H11NO4/c1-7-4(6(10)11)2-3-5(8)9/h4,7H,2-3H2,1H3,(H,8,9)(H,10,11)/t4-/m0/s1 75029.10066666667 0.0 0.0 93770.234 60855.258 70461.81 0.0 0.0 0.0 0.0 0.0 0.0 392.2715 14.07 14.07 0 3 CHEBI:181879 CC1(CO)CC(O)[C@]2(C(=O)O)CCC34CC3(C=CC3[C@]5(C)C(CC[C@]34C)C(C)(CO)[C@@H](O)[C@H](O)[C@@H]5O)C2C1 InChI=1S/C30H46O8/c1-24(14-31)11-18-28-8-6-17-26(3,29(28,13-28)9-10-30(18,23(37)38)19(33)12-24)7-5-16-25(2,15-32)21(35)20(34)22(36)27(16,17)4/h6,8,16-22,31-36H,5,7,9-15H2,1-4H3,(H,37,38)/t16?,17?,18?,19?,20-,21-,22-,24?,25?,26+,27-,28?,29?,30-/m0/s1 177776.37 39532.632333333335 39675.526666666665 146702.7 173822.3 212804.11 25771.738 25904.559 66921.6 39517.676 39775.08 39733.824 320.1499 8.26 8.26 0 2 Piplartine COc1cc(/C=C/C(=O)N2CCC=CC2=O)cc(OC)c1OC InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+ 564056.73 64627.37733333333 0.0 488314.97 520153.72 683701.5 24071.086 88407.28 81403.766 0.0 0.0 0.0 583.4152 16.6 16.6 0 3 CHEBI:181245 CC(CC(O)C(O)C(C)(C)O)C1CCC2(C)C3CCC4C(C)(C(=O)OC5OC(CO)C(O)C(O)C5O)C(O)CC(O)C45CC35CCC12C InChI=1S/C36H60O12/c1-17(13-19(38)28(44)31(2,3)46)18-9-10-33(5)21-7-8-22-34(6,30(45)48-29-27(43)26(42)25(41)20(15-37)47-29)23(39)14-24(40)36(22)16-35(21,36)12-11-32(18,33)4/h17-29,37-44,46H,7-16H2,1-6H3 32594.621000000003 31456.806666666667 75203.628 52403.758 0.0 45380.105 36349.96 28970.2 29050.26 80913.72 83393.25 61303.914 282.1494 5.83 5.83 0 9 301160.41333333333 0.0 9113.376333333334 262335.56 97244.38 543901.3 0.0 0.0 0.0 27340.129 0.0 0.0 455.2183 6.51 6.51 0 2 41210.222 0.0 0.0 43967.926 36234.59 43428.15 0.0 0.0 0.0 0.0 0.0 0.0 393.279 14.7 14.7 0 3 (2S,3S,4S,5R,6R)-6-[[(3S,4S,6aR,6bS,8R,8aR,9R,10R,12aS,14bR)-10-acetyloxy-8a-(acetyloxymethyl)-8,9-dihydroxy-4-(hydroxymethyl)-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-4-hydroxy-3,5-bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]oxane-2-carboxylic acid CC(=O)OC[C@@]12[C@@H](CC(C)(C)[C@@H](OC(C)=O)[C@@H]1O)C1=CCC3[C@@]4(C)CC[C@H](O[C@@H]5O[C@H](C(=O)O)[C@@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@H](O)[C@H]5O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@](C)(CO)C4CC[C@@]3(C)[C@]1(C)C[C@H]2O InChI=1S/C52H82O24/c1-21(56)69-20-52-24(15-47(3,4)42(41(52)66)70-22(2)57)23-9-10-28-48(5)13-12-30(49(6,19-55)27(48)11-14-50(28,7)51(23,8)16-29(52)58)73-46-39(75-45-36(64)34(62)32(60)26(18-54)72-45)37(65)38(40(76-46)43(67)68)74-44-35(63)33(61)31(59)25(17-53)71-44/h9,24-42,44-46,53-55,58-66H,10-20H2,1-8H3,(H,67,68)/t24-,25+,26+,27?,28?,29+,30-,31+,32+,33-,34-,35+,36+,37-,38-,39+,40-,41-,42-,44-,45-,46+,48-,49+,50+,51+,52-/m0/s1 74421.40666666666 11788.854 233867.2033333333 67992.72 71185.9 84085.6 0.0 35366.562 0.0 148054.61 208241.8 345305.2 369.17 9.72 9.72 0 24 "4-[(1R,5R)-6-(3,4-dimethoxyphenyl)-3,7-dioxabicyclo[3.3.0]oct-2-yl]-1,2-dimeth oxybenzene CollisionEnergy:205060" COc1ccc(C2OCC3C(c4ccc(OC)c(OC)c4)OCC23)cc1OC "InChI=1S/C22H26O6/c1-23-17-7-5-13(9-19(17)25-3)21-15-11-28-22(16(15)12-27-21)14-6-8-18(24-2)20(10-14)26-4/h5-10,15-16,21-22H,11-12H2,1-4H3/t15-,16-,21?,22?/m0/s1" 135917.55333333334 0.0 0.0 108996.84 113078.62 185677.2 0.0 0.0 0.0 0.0 0.0 0.0 738.4788 15.32 15.32 0 18 2178106.3666666667 0.0 0.0 2165543.5 1318649.4 3050126.2 0.0 0.0 0.0 0.0 0.0 0.0 651.2819 15.58 15.58 0 8 0.0 65113.52033333333 411954.25333333336 0.0 0.0 0.0 39372.24 127930.38 28037.941 139339.72 382364.94 714158.1 388.1761 10.11 10.11 0 24 Spectral Match to Arctigenin from NIST14 nan nan 37328.99033333333 0.0 0.0 26130.523 34767.848 51088.6 0.0 0.0 0.0 0.0 0.0 0.0 303.1959 14.09 14.09 0 27 260125.16 0.0 0.0 294067.53 251105.12 235202.83 0.0 0.0 0.0 0.0 0.0 0.0 824.5523 16.32 16.32 0 18 INT-767 CC[C@H]1[C@@H](O)[C@@H]2[C@H](CC[C@]3(C)[C@@H]([C@H](C)CCOS(=O)(=O)O)CC[C@@H]23)[C@@]2(C)CC[C@@H](O)C[C@@H]12 InChI=1S/C25H44O6S/c1-5-17-21-14-16(26)8-11-25(21,4)20-9-12-24(3)18(6-7-19(24)22(20)23(17)27)15(2)10-13-31-32(28,29)30/h15-23,26-27H,5-14H2,1-4H3,(H,28,29,30)/t15-,16-,17-,18-,19+,20+,21+,22+,23-,24-,25-/m1/s1 64673.996333333336 7886.405666666667 89017.51333333335 57875.445 62474.56 73671.984 0.0 23659.217 0.0 41998.19 82468.85 142585.5 201.0913 10.49 10.49 0 52 0.0 0.0 248360.9833333333 0.0 0.0 0.0 0.0 0.0 0.0 79068.01 282252.56 383762.38 341.1386 16.85 16.85 0 24 Knemolic acid B OC1=C(C(O)=O)C(CCCCCCC2=CC(OCO3)=C3C=C2)=CC=C1 InChI=1S/C20H22O5/c21-16-9-5-8-15(19(16)20(22)23)7-4-2-1-3-6-14-10-11-17-18(12-14)25-13-24-17/h5,8-12,21H,1-4,6-7,13H2,(H,22,23) 180269.5166666667 0.0 0.0 170508.58 163310.83 206989.14 0.0 0.0 0.0 0.0 0.0 0.0 599.41 16.66 16.66 0 3 718108.2000000001 132408.851 0.0 558532.0 750918.3 844874.3 62357.633 165771.31 169097.61 0.0 0.0 0.0 584.4218 16.6 16.6 0 3 CHEBI:181879 CC1(CO)CC(O)[C@]2(C(=O)O)CCC34CC3(C=CC3[C@]5(C)C(CC[C@]34C)C(C)(CO)[C@@H](O)[C@H](O)[C@@H]5O)C2C1 InChI=1S/C30H46O8/c1-24(14-31)11-18-28-8-6-17-26(3,29(28,13-28)9-10-30(18,23(37)38)19(33)12-24)7-5-16-25(2,15-32)21(35)20(34)22(36)27(16,17)4/h6,8,16-22,31-36H,5,7,9-15H2,1-4H3,(H,37,38)/t16?,17?,18?,19?,20-,21-,22-,24?,25?,26+,27-,28?,29?,30-/m0/s1 87833.97666666667 30414.051000000003 208275.412 60191.555 110006.055 93304.32 25300.133 65942.02 0.0 121566.336 202294.1 300965.8 387.1808 6.48 6.48 0 24 "4-[(1R,5R)-6-(3,4-dimethoxyphenyl)-3,7-dioxabicyclo[3.3.0]oct-2-yl]-1,2-dimeth oxybenzene CollisionEnergy:205060" COc1ccc(C2OCC3C(c4ccc(OC)c(OC)c4)OCC23)cc1OC "InChI=1S/C22H26O6/c1-23-17-7-5-13(9-19(17)25-3)21-15-11-28-22(16(15)12-27-21)14-6-8-18(24-2)20(10-14)26-4/h5-10,15-16,21-22H,11-12H2,1-4H3/t15-,16-,21?,22?/m0/s1" 2455577.3000000003 85818.63 240804.85666666663 2493831.5 1740507.2 3132393.2 89603.58 78769.08 89083.23 171749.48 384273.47 166391.62 286.1442 5.11 5.11 0 40 Coclaurine OC1=C(OC)C=C2C([C@@](CC3=CC=C(O)C=C3)([H])NCC2)=C1 InChI=1S/C17H19NO3/c1-21-17-9-12-6-7-18-15(14(12)10-16(17)20)8-11-2-4-13(19)5-3-11/h2-5,9-10,15,18-20H,6-8H2,1H3/t15-/m0/s1 682754.0066666667 0.0 0.0 330082.56 431142.66 1287036.8 0.0 0.0 0.0 0.0 0.0 0.0 635.3225 17.26 17.26 0 8 228496.2666666667 138193.44333333333 133624.22166666668 284874.1 79632.76 320981.94 114657.84 133540.6 166381.89 106169.375 157458.1 137245.19 360.1504 1.04 1.04 0 39 Melezitose OC[C@H]1O[C@H](O[C@H]2[C@H](O)[C@@H](CO)O[C@@]2(CO)O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@@H]1O InChI=1S/C18H32O16/c19-1-5-8(23)11(26)13(28)16(30-5)32-15-10(25)7(3-21)33-18(15,4-22)34-17-14(29)12(27)9(24)6(2-20)31-17/h5-17,19-29H,1-4H2/t5-,6-,7-,8-,9-,10-,11+,12+,13-,14-,15+,16-,17-,18+/m1/s1 479514.6166666667 0.0 0.0 628270.4 353511.25 456762.2 0.0 0.0 0.0 0.0 0.0 0.0 584.4225 15.19 15.19 0 3 Massbank:MSJ00118 Zeaxanthin CC1=C(C(C[C@@H](C1)O)(C)C)/C=C/C(=C/C=C/C(=C/C=C/C=C(/C=C/C=C(/C=C/C2=C(C[C@H](CC2(C)C)O)C)\\C)\\C)/C)/C 1S/C40H56O2/c1-29(17-13-19-31(3)21-23-37-33(5)25-35(41)27-39(37,7)8)15-11-12-16-30(2)18-14-20-32(4)22-24-38-34(6)26-36(42)28-40(38,9)10/h11-24,35-36,41-42H,25-28H2,1-10H3/b12-11+,17-13+,18-14+,23-21+,24-22+,29-15+,30-16+,31-19+,32-20+/t35-,36-/m1/s1 45890.98533333334 0.0 0.0 44171.773 39044.273 54456.91 0.0 0.0 0.0 0.0 0.0 0.0 333.2155 6.01 6.01 0 22 0.0 46781.10133333333 249635.26 0.0 0.0 0.0 69806.484 0.0 70536.82 252595.38 220870.06 275440.34 242.9828 1.27 1.27 0 51 67564.05133333334 0.0 0.0 59515.004 64890.41 78286.74 0.0 0.0 0.0 0.0 0.0 0.0 630.4266 16.61 16.61 0 3 NCGC00381199-01_C25H38O4_(3aR,5E,7S,10E,14E,16aS)-2,7-Dihydroxy-3-[(2S)-1-hydroxy-2-propanyl]-6,10,14,16a-tetramethyl-4,7,8,9,12,13,16,16a-octahydrocyclopenta[15]annulen-1(3aH)-one C[C@H](CO)C/1=C(O)/C(=O)[C@@]2(C)C/C=C(C)/CC/C=C(C)/CC[C@H](O)/C(=C/C[C@H]12)C InChI=1S/C25H38O4/c1-16-7-6-8-17(2)13-14-25(5)20(11-10-18(3)21(27)12-9-16)22(19(4)15-26)23(28)24(25)29/h7,10,13,19-21,26-28H,6,8-9,11-12,14-15H2,1-5H3/b16-7+,17-13+,18-10+/t19-,20-,21+,25+/m1/s1 16813.183 0.0 50604.70133333333 22982.535 0.0 27457.014 0.0 0.0 0.0 24024.336 58959.438 68830.33 325.1441 7.42 7.42 0 24 0.0 12456.28 90119.04333333332 0.0 0.0 0.0 0.0 37368.84 0.0 73645.07 80814.54 115897.52 219.102 7.31 7.31 0 34 (2R,3R,4S,5S,6R)-2-[[7-hydroxy-1-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-6-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol COc1cc(C2c3cc(O)c(OC)cc3CC(CO)C2CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)ccc1O InChI=1S/C26H34O11/c1-34-19-6-12(3-4-17(19)29)22-15-8-18(30)20(35-2)7-13(15)5-14(9-27)16(22)11-36-26-25(33)24(32)23(31)21(10-28)37-26/h3-4,6-8,14,16,21-33H,5,9-11H2,1-2H3/t14?,16?,21-,22?,23-,24+,25-,26-/m1/s1 53116.47400000001 22399.52133333333 72234.74066666666 57461.137 32827.395 69060.89 35342.906 31855.658 0.0 118924.73 55233.715 42545.777 316.1396 1.22 1.22 0 6 4499755.166666667 1383699.2333333334 0.0 4271774.5 4445410.0 4782081.0 1066081.9 1459145.2 1625870.6 0.0 0.0 0.0 360.2173 5.53 5.53 0 15 523788.86 6279.946 0.0 444309.28 434502.4 692554.9 0.0 18839.838 0.0 0.0 0.0 0.0 599.4101 16.09 16.09 0 3 350420.3133333333 0.0 0.0 408876.28 242045.56 400339.1 0.0 0.0 0.0 0.0 0.0 0.0 591.2607 15.77 15.77 0 8 0.0 0.0 78447.17866666666 0.0 0.0 0.0 0.0 0.0 0.0 59138.496 85307.73 90895.31 358.1413 9.2 9.2 0 24 100660.37333333334 44321.64000000001 0.0 0.0 157227.06 144754.06 0.0 0.0 132964.92 0.0 0.0 0.0 429.3732 14.96 14.96 0 64 Spectral Match to (+)-.alpha.-Tocopherol from NIST14 nan nan 0.0 89242.69233333333 51008.42166666666 0.0 0.0 0.0 117821.01 90338.84 59568.227 88105.79 33172.082 31747.393 236.0922 1.66 1.66 0 5 50954.23533333334 0.0 0.0 51920.582 34400.934 66541.19 0.0 0.0 0.0 0.0 0.0 0.0 631.2529 15.31 15.31 0 67 38775.047666666665 0.0 0.0 32698.014 31419.629 52207.5 0.0 0.0 0.0 0.0 0.0 0.0 627.232 9.54 9.54 0 4 87030.27333333333 38611.26933333334 58698.085 128170.71 0.0 132920.11 29826.125 35465.406 50542.277 30613.035 74457.13 71024.09 343.1239 1.03 1.03 0 39 Stachyose OC[C@H]1O[C@H](OC[C@H]2O[C@H](OC[C@H]3O[C@H](O[C@]4(CO)O[C@H](CO)[C@@H](O)[C@@H]4O)[C@H](O)[C@@H](O)[C@@H]3O)[C@H](O)[C@@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@H]1O InChI=1S/C24H42O21/c25-1-6-10(28)14(32)17(35)21(41-6)39-3-8-11(29)15(33)18(36)22(42-8)40-4-9-12(30)16(34)19(37)23(43-9)45-24(5-27)20(38)13(31)7(2-26)44-24/h6-23,25-38H,1-5H2/t6-,7-,8-,9-,10+,11+,12-,13-,14+,15+,16+,17-,18-,19-,20+,21+,22+,23-,24+/m1/s1 502442.3866666667 0.0 0.0 470944.9 337552.66 698829.6 0.0 0.0 0.0 0.0 0.0 0.0 625.2662 15.41 15.41 0 7 91817.592 0.0 0.0 97909.74 74272.336 103270.7 0.0 0.0 0.0 0.0 0.0 0.0 506.2754 4.96 4.96 0 15 1635812.0 408198.7333333333 0.0 0.0 2446829.0 2460607.0 0.0 1224596.2 0.0 0.0 0.0 0.0 301.1628 3.11 3.11 0 40 27343.375 977510.0666666668 4885133.166666667 0.0 0.0 82030.125 775741.0 1604855.2 551934.0 2575348.0 4604904.0 7475147.5 321.1127 9.93 9.93 0 24 hydrastinine CN1CCc2cc3c(cc2C1O)OCO3 "InChI=1S/C11H13NO3/c1-12-3-2-7-4-9-10(15-6-14-9)5-8(7)11(12)13/h4-5,11,13H,2-3,6H2,1H3" 68171.15166666667 33487.45333333333 0.0 59794.84 68718.875 75999.74 0.0 31614.01 68848.35 0.0 0.0 0.0 388.1606 5.99 5.99 0 75 332646.3133333333 14714.942 0.0 282622.0 289530.56 425786.38 0.0 21437.236 22707.59 0.0 0.0 0.0 634.2794 15.97 15.97 0 8 97053.54 1045227.8333333334 0.0 291160.62 0.0 0.0 0.0 1343544.6 1792138.9 0.0 0.0 0.0 758.5695 15.91 15.91 0 23 Spectral Match to 1-Stearoyl-2-linoleoyl-sn-glycero-3-phosphocholine from NIST14 CCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCC/C=C\\C/C=C\\CCCCC InChI=1S/C44H84NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-43(46)50-40-42(41-52-54(48,49)51-39-38-45(3,4)5)53-44(47)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h15,17,21,23,42H,6-14,16,18-20,22,24-41H2,1-5H3/b17-15-,23-21-/t42-/m1/s1 733342.4 108807.25133333332 23901.15566666667 612031.7 722697.9 865297.6 28466.314 58854.39 239101.05 0.0 39053.395 32650.072 657.2423 9.34 9.34 0 4 514422.26 504699.00666666665 1154345.2333333334 609154.8 780395.5 153716.48 516568.72 568117.2 429411.1 1250916.2 1144767.5 1067352.0 241.9999 0.88 0.88 0 5 0.0 0.0 182467.09666666668 0.0 0.0 0.0 0.0 0.0 0.0 43247.24 230308.3 273845.75 323.1283 16.98 16.98 0 24 4,4'-Dimethoxychalcone COc1ccc(/C=C/C(=O)c2ccc(OC)cc2)cc1 InChI=1S/C17H16O3/c1-19-15-8-3-13(4-9-15)5-12-17(18)14-6-10-16(20-2)11-7-14/h3-12H,1-2H3/b12-5+ 110761.01 138323.94 116682.23133333334 0.0 211078.31 121204.72 85389.84 132220.64 197361.34 61652.14 130167.414 158227.14 801.5494 17.26 17.26 0 26 Candidate GABA-C18:2 (delta mass:262.2306) nan nan 354604.9066666667 0.0 0.0 417497.7 250903.05 395413.97 0.0 0.0 0.0 0.0 0.0 0.0 584.4224 16.38 16.38 0 3 52209.99833333333 8402.52 44842.85833333334 82345.805 0.0 74284.19 25207.56 0.0 0.0 51412.152 42690.7 40425.723 265.1226 6.52 6.52 0 8 65005.418333333335 0.0 0.0 62379.79 27455.225 105181.24 0.0 0.0 0.0 0.0 0.0 0.0 316.1912 5.88 5.88 0 15 38732.780666666666 0.0 0.0 37568.77 38200.67 40428.902 0.0 0.0 0.0 0.0 0.0 0.0 613.4233 17.29 17.29 0 3 Massbank:MSJ00114 Nostoxanthin CC1=C(C([C@H]([C@@H](C1)O)O)(C)C)/C=C/C(=C/C=C/C(=C/C=C/C=C(/C=C/C=C(/C=C/C2=C(C[C@H]([C@@H](C2(C)C)O)O)C)\\C)\\C)/C)/C 1S/C40H56O4/c1-27(17-13-19-29(3)21-23-33-31(5)25-35(41)37(43)39(33,7)8)15-11-12-16-28(2)18-14-20-30(4)22-24-34-32(6)26-36(42)38(44)40(34,9)10/h11-24,35-38,41-44H,25-26H2,1-10H3/b12-11+,17-13+,18-14+,23-21+,24-22+,27-15+,28-16+,29-19+,30-20+/t35-,36-,37+,38+/m1/s1 0.0 0.0 65426.01066666667 0.0 0.0 0.0 0.0 0.0 0.0 21734.992 78991.97 95551.07 341.1385 16.69 16.69 0 24 Knemolic acid B OC1=C(C(O)=O)C(CCCCCCC2=CC(OCO3)=C3C=C2)=CC=C1 InChI=1S/C20H22O5/c21-16-9-5-8-15(19(16)20(22)23)7-4-2-1-3-6-14-10-11-17-18(12-14)25-13-24-17/h5,8-12,21H,1-4,6-7,13H2,(H,22,23) 10853.735 55743.41666666666 27042.47333333333 32561.205 0.0 0.0 0.0 0.0 167230.25 0.0 0.0 81127.42 708.5119 17.08 17.08 0 32 L-phenylalanine_dodecanoic acid CCCCCCCCCCCC(=O)N[C@@H](Cc1ccccc1)C(=O)O InChI=1S/C21H33NO3/c1-2-3-4-5-6-7-8-9-13-16-20(23)22-19(21(24)25)17-18-14-11-10-12-15-18/h10-12,14-15,19H,2-9,13,16-17H2,1H3,(H,22,23)(H,24,25)/t19-/m0/s1 24946.375 314529.51666666666 587425.66 0.0 74839.125 0.0 458167.7 205080.6 280340.25 1394941.1 167411.94 199923.94 252.2324 13.44 13.44 0 58 (2E,4E)-N-(2-methylpropyl)dodeca-2,4-dienamide CCCCCCC/C=C/C=C/C(O)=NCC(C)C InChI=1S/C16H29NO/c1-4-5-6-7-8-9-10-11-12-13-16(18)17-14-15(2)3/h10-13,15H,4-9,14H2,1-3H3,(H,17,18)/b11-10+,13-12+ 3101667.966666667 28471.243999999995 0.0 2842195.2 2510336.5 3952472.2 0.0 41218.92 44194.812 0.0 0.0 0.0 607.2556 14.35 14.35 0 8 114233.675 0.0 0.0 148893.69 106076.96 87730.375 0.0 0.0 0.0 0.0 0.0 0.0 599.4103 16.34 16.34 0 3 43176.01066666667 0.0 0.0 37330.992 35848.63 56348.41 0.0 0.0 0.0 0.0 0.0 0.0 609.2711 14.22 14.22 0 8 257885.20333333337 126421.83 237472.92666666667 258865.23 247191.1 267599.28 137345.48 104726.18 137193.83 233269.3 231780.88 247368.6 463.0564 8.81 8.81 0 20 28775.244666666666 457882.53333333327 91567.652 0.0 86325.734 0.0 572497.6 281426.94 519723.06 123431.97 79991.766 71279.22 302.1756 10.68 10.68 0 70 (4E)-N-Isobutyl-5-(1,3-benzodioxol-5-yl)-4-pentenamide CC(C)CNC(=O)CC/C=C/c1cc2c(cc1)OCO2 InChI=1S/C16H21NO3/c1-12(2)10-17-16(18)6-4-3-5-13-7-8-14-15(9-13)20-11-19-14/h3,5,7-9,12H,4,6,10-11H2,1-2H3,(H,17,18)/b5-3+ 599250.5066666667 573388.5766666667 1452661.2333333334 720386.06 916921.44 160444.02 597237.56 640796.2 482131.97 1572880.8 1431455.0 1353647.9 223.9894 0.88 0.88 0 5 0.0 0.0 61854.956000000006 0.0 0.0 0.0 0.0 0.0 0.0 33004.312 69869.29 82691.266 219.1019 9.2 9.2 0 34 "MLS002473104-01!(2R)-6-(2-hydroxyethyl)-2,5,7-trimethyl-2,3-dihydroinden-1-one" C[C@@H]1Cc2cc(C)c(CCO)c(C)c2C1=O InChI=1S/C14H18O2/c1-8-6-11-7-9(2)14(16)13(11)10(3)12(8)4-5-15/h6,9,15H,4-5,7H2,1-3H3/t9-/m1/s1 84085.36499999999 0.0 11304.548333333332 61946.43 63546.875 126762.79 0.0 0.0 0.0 33913.645 0.0 0.0 520.3405 12.32 12.32 0 23 Spectral Match to Lyso-PC(16:0) from NIST14 CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)O InChI=1S/C24H50NO7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-24(27)30-21-23(26)22-32-33(28,29)31-20-19-25(2,3)4/h23,26H,5-22H2,1-4H3/t23-/m1/s1 155137.17666666667 33242.194 0.0 122510.7 147507.47 195393.36 0.0 32101.957 67624.625 0.0 0.0 0.0 538.2076 9.99 9.99 0 28 432582.4666666666 113099.23333333334 0.0 496432.72 543004.9 258309.78 0.0 339297.7 0.0 0.0 0.0 0.0 234.0974 15.85 15.85 0 85 56529.19566666667 0.0 0.0 54031.227 52367.973 63188.387 0.0 0.0 0.0 0.0 0.0 0.0 691.2741 14.8 14.8 0 8 76407.90233333333 89612.90333333332 104633.33333333331 81860.984 95044.2 52318.523 90685.02 90176.68 87977.01 111550.44 103917.6 98431.96 255.9392 0.88 0.88 0 62 0.0 0.0 115744.138 0.0 0.0 0.0 0.0 0.0 0.0 67476.234 129283.38 150472.8 340.1161 9.2 9.2 0 24 29747.036666666663 7310.513333333333 22729.26166666667 36627.723 25257.037 27356.35 21931.54 0.0 0.0 0.0 22021.215 46166.57 432.2809 4.47 4.47 0 36 2456192.2 465477.7533333333 2528604.6 2081493.1 2561123.5 2725960.0 480719.6 417368.1 498345.56 2095246.5 2738438.5 2752128.8 320.1497 9.07 9.07 0 2 Piplartine COc1cc(/C=C/C(=O)N2CCC=CC2=O)cc(OC)c1OC InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+ 628068.8166666668 366744.4266666667 215945.10333333336 599254.6 634918.25 650033.6 350950.28 290717.3 458565.7 257655.56 205445.67 184734.08 363.1917 8.01 8.01 0 2 Piperlongumine CollisionEnergy:102040 COc1cc(C=CC(=O)N2CCC=CC2=O)cc(OC)c1OC "InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+" 75905.18333333333 0.0 0.0 59393.156 57891.66 110430.734 0.0 0.0 0.0 0.0 0.0 0.0 721.4524 15.29 15.29 0 18 104121.89666666668 145677.5116666667 575282.4966666667 98698.52 85917.16 127750.01 102245.38 223710.6 111076.555 345482.4 513839.84 866525.25 217.0863 8.95 8.95 0 34 dl-3-Indolelactic acid - 40.0 eV c1ccc2c(c1)c(c[nH]2)CC(C(=O)O)O InChI=1S/C11H11NO3/c13-10(11(14)15)5-7-6-12-9-4-2-1-3-8(7)9/h1-4,6,10,12-13H,5H2,(H,14,15) 21694.698666666667 41827.18033333333 82761.94466666666 0.0 30255.541 34828.555 28864.174 54366.09 42251.277 64359.168 76768.65 107158.016 219.102 7.93 7.93 0 34 (2R,3R,4S,5S,6R)-2-[[7-hydroxy-1-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-6-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol COc1cc(C2c3cc(O)c(OC)cc3CC(CO)C2CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)ccc1O InChI=1S/C26H34O11/c1-34-19-6-12(3-4-17(19)29)22-15-8-18(30)20(35-2)7-13(15)5-14(9-27)16(22)11-36-26-25(33)24(32)23(31)21(10-28)37-26/h3-4,6-8,14,16,21-33H,5,9-11H2,1-2H3/t14?,16?,21-,22?,23-,24+,25-,26-/m1/s1 0.0 478119.5866666666 108745.86666666664 0.0 0.0 0.0 0.0 614602.56 819756.2 0.0 0.0 326237.6 759.573 15.9 15.9 0 23 Spectral Match to 1-Oleoyl-2-palmitoyl-sn-glycero-3-phosphocholine from NIST14 CCCCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCC/C=C\\CCCCCCCC)COP(=O)([O-])OCC[N+](C)(C)C InChI=1S/C42H82NO8P/c1-6-8-10-12-14-16-18-20-21-23-24-26-28-30-32-34-41(44)48-38-40(39-50-52(46,47)49-37-36-43(3,4)5)51-42(45)35-33-31-29-27-25-22-19-17-15-13-11-9-7-2/h20-21,40H,6-19,22-39H2,1-5H3/b21-20-/t40-/m1/s1 134429.11666666667 30593.349666666665 0.0 124951.46 127586.06 150749.83 24015.969 42922.793 24841.287 0.0 0.0 0.0 355.1541 4.83 4.83 0 24 48254.64833333334 39152.98333333333 39438.501 57884.57 0.0 86879.375 53185.25 64273.7 0.0 0.0 48031.043 70284.46 556.4427 14.55 14.55 0 36 Spectral Match to Nonaethylene glycol from NIST14 nan nan 43493.424 0.0 0.0 42794.707 34905.805 52779.76 0.0 0.0 0.0 0.0 0.0 0.0 716.2221 4.04 4.04 0 60 5442819.833333333 1710791.5 5866145.666666667 5479867.0 5555102.5 5293490.0 1700030.4 1654050.1 1778294.0 5181899.5 5975437.5 6441100.0 657.2421 8.83 8.83 0 4 187581.19333333336 0.0 0.0 192331.92 191103.02 179308.64 0.0 0.0 0.0 0.0 0.0 0.0 514.1385 2.58 2.58 0 35 151654.25666666668 6478.362 161469.30166666667 130019.88 170332.36 154610.53 0.0 0.0 19435.086 112853.305 182401.48 189153.12 661.2738 9.07 9.07 0 45 0.0 68983.58666666667 0.0 0.0 0.0 0.0 40941.867 144909.7 21099.193 0.0 0.0 0.0 285.1239 3.96 3.96 0 90 0.0 24101.51833333333 210479.41666666663 0.0 0.0 0.0 0.0 72304.555 0.0 110805.66 195695.25 324937.34 337.144 9.24 9.24 0 24 77820.79833333334 0.0 0.0 82449.266 65002.043 86011.086 0.0 0.0 0.0 0.0 0.0 0.0 618.4279 14.17 14.17 0 3 40269.352000000006 0.0 41696.90666666667 37053.004 30674.172 53080.88 0.0 0.0 0.0 32881.227 43024.38 49185.113 579.1508 4.99 4.99 0 69 Procyanidin B3 40eV C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=CC(=CC(=C34)O)O)C5=CC(=C(C=C5)O)O)O)O)O)C6=CC(=C(C=C6)O)O)O XFZJEEAOWLFHDH-AVFWISQGSA-N 364132.4866666666 10731.431 0.0 333106.0 292901.66 466389.8 0.0 0.0 32194.293 0.0 0.0 0.0 599.4102 16.44 16.44 0 3 77511.748 0.0 0.0 66166.32 32826.824 133542.1 0.0 0.0 0.0 0.0 0.0 0.0 346.2015 6.25 6.25 0 15 26890.948666666667 0.0 0.0 21179.447 28681.309 30812.09 0.0 0.0 0.0 0.0 0.0 0.0 426.0667 8.02 8.02 0 2 "(2E)-1-(1,3-dimethylpyrazol-4-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one CollisionEnergy:102040" COc1cc(C=CC(=O)c2cn(C)nc2C)cc(OC)c1OC "InChI=1S/C17H20N2O4/c1-11-13(10-19(2)18-11)14(20)7-6-12-8-15(21-3)17(23-5)16(9-12)22-4/h6-10H,1-5H3/b7-6+" 19205.103 0.0 10013.445333333331 0.0 30967.014 26648.295 0.0 0.0 0.0 0.0 30040.336 0.0 454.2935 12.94 12.94 0 18 Spectral Match to 1-Palmitoyl-2-hydroxy-sn-glycero-3-phosphoethanolamine from NIST14 nan nan 457830.2833333334 273707.4 0.0 823318.25 0.0 550172.6 0.0 0.0 821122.2 0.0 0.0 0.0 783.5729 15.21 15.21 0 23 Spectral Match to 1-Oleoyl-2-palmitoyl-sn-glycero-3-phosphocholine from NIST14 CCCCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCC/C=C\\CCCCCCCC)COP(=O)([O-])OCC[N+](C)(C)C InChI=1S/C42H82NO8P/c1-6-8-10-12-14-16-18-20-21-23-24-26-28-30-32-34-41(44)48-38-40(39-50-52(46,47)49-37-36-43(3,4)5)51-42(45)35-33-31-29-27-25-22-19-17-15-13-11-9-7-2/h20-21,40H,6-19,22-39H2,1-5H3/b21-20-/t40-/m1/s1 54418.95166666667 10191.876666666669 0.0 37691.918 60738.375 64826.562 0.0 0.0 30575.63 0.0 0.0 0.0 499.317 14.09 14.09 0 11 0.0 291467.62666666665 75779.31666666667 0.0 0.0 0.0 220926.8 423676.6 229799.48 0.0 131141.05 96196.9 295.0719 3.78 3.78 0 5 Thelephoric acid O=C1c2c(c3c(cc(O)c(O)c3)o2)C(=O)c2c1c1c(o2)cc(c(c1)O)O "InChI=1S/C18H8O8/c19-7-1-5-11(3-9(7)21)25-17-13(5)15(23)18-14(16(17)24)6-2-8(20)10(22)4-12(6)26-18/h1-4,19-22H" 0.0 0.0 171843.99333333335 0.0 0.0 0.0 0.0 0.0 0.0 173856.23 285872.84 55802.91 354.0975 9.88 9.88 0 8 5-hydroxy-1,2,3-trimethoxyxanthone O=C1C2=C(OC)C(OC)=C(OC)C=C2OC3=C(O)C=CC=C31 InChI=1S/C16H14O6/c1-19-11-7-10-12(16(21-3)15(11)20-2)13(18)8-5-4-6-9(17)14(8)22-10/h4-7,17H,1-3H3 151735.90666666665 8407.166666666666 33160.056666666664 0.0 455207.72 0.0 0.0 25221.5 0.0 99480.17 0.0 0.0 279.0938 15.5 15.5 0 82 8546.655666666667 7419.114666666667 40675.852666666666 0.0 25639.967 0.0 22257.344 0.0 0.0 37701.16 38504.258 45822.14 207.0656 8.19 8.19 0 48 41333.98333333334 0.0 0.0 27173.305 42970.637 53858.008 0.0 0.0 0.0 0.0 0.0 0.0 207.0655 8.54 8.54 0 48 41845.420666666665 0.0 12079.12 40607.02 37629.902 47299.34 0.0 0.0 0.0 36237.36 0.0 0.0 205.1954 13.1 13.1 0 10 Bisabolol CollisionEnergy:205060 CC(C)=CCCC(C)(O)C1CC=C(C)CC1 "InChI=1S/C15H26O/c1-12(2)6-5-11-15(4,16)14-9-7-13(3)8-10-14/h6-7,14,16H,5,8-11H2,1-4H3" 203435.53333333333 76420.05333333333 235517.4933333333 188675.9 204220.31 217410.39 78047.52 69603.79 81608.85 218287.52 256367.08 231897.88 321.1421 8.83 8.83 0 81 116064.86666666664 598348.1466666667 3120009.8000000003 126771.86 91802.12 129620.62 415692.94 1077360.1 301991.4 1365213.4 3268084.0 4726732.0 205.1954 13.62 13.62 0 10 Bisabolol CollisionEnergy:205060 CC(C)=CCCC(C)(O)C1CC=C(C)CC1 "InChI=1S/C15H26O/c1-12(2)6-5-11-15(4,16)14-9-7-13(3)8-10-14/h6-7,14,16H,5,8-11H2,1-4H3" 48301.039 0.0 59712.170000000006 47602.883 47800.094 49500.14 0.0 0.0 0.0 56266.508 62118.44 60751.562 654.7352 8.82 8.82 0 79 0.0 0.0 58572.31633333334 0.0 0.0 0.0 0.0 0.0 0.0 43534.945 108052.41 24129.594 376.0797 9.88 9.88 0 8 60771.03666666666 0.0 0.0 57452.324 46348.176 78512.61 0.0 0.0 0.0 0.0 0.0 0.0 286.1442 3.88 3.88 0 40 N-methylcoclaurine OC1=C(OC)C=C2C([C@@](CC3=CC=C(O)C=C3)([H])N(C)CC2)=C1 InChI=1S/C18H21NO3/c1-19-8-7-13-10-18(22-2)17(21)11-15(13)16(19)9-12-3-5-14(20)6-4-12/h3-6,10-11,16,20-21H,7-9H2,1-2H3/t16-/m0/s1 1058746.6 77320.31533333333 0.0 1025206.1 1072029.1 1079004.6 47861.402 95419.414 88680.13 0.0 0.0 0.0 615.2582 15.85 15.85 0 21 65313.179 0.0 13468.146666666667 42876.605 54321.492 98741.44 0.0 0.0 0.0 40404.44 0.0 0.0 478.2935 12.27 12.27 0 18 Spectral Match to 1-Palmitoyl-2-hydroxy-sn-glycero-3-phosphoethanolamine from NIST14 nan nan 28884.033333333336 0.0 0.0 26884.63 22816.32 36951.15 0.0 0.0 0.0 0.0 0.0 0.0 757.2191 4.97 4.97 0 37 TYPHANEOSIDE CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC(=C(C=C5)O)OC)OC6C(C(C(C(O6)C)O)O)O)O)O)O)O)O "InChI=1S/C34H42O20/c1-10-20(38)24(42)27(45)32(49-10)48-9-18-22(40)26(44)31(54-33-28(46)25(43)21(39)11(2)50-33)34(52-18)53-30-23(41)19-15(37)7-13(35)8-17(19)51-29(30)12-4-5-14(36)16(6-12)47-3/h4-8,10-11,18,20-22,24-28,31-40,42-46H,9H2,1-3H3" 690699.1933333332 111341.51666666668 74414.83166666667 625720.44 680535.2 765841.94 99086.44 85467.72 149470.39 79141.875 72987.23 71115.39 288.1236 7.83 7.83 0 6 "3,4-DIMETHOXYCINNAMIC ACID CollisionEnergy:102040" COc1ccc(C=CC(=O)O)cc1OC "InChI=1S/C11H12O4/c1-14-9-5-3-8(4-6-11(12)13)7-10(9)15-2/h3-7H,1-2H3,(H,12,13)/b6-4+" 218386.24666666667 56789.16266666667 0.0 218819.95 181967.9 254370.89 38938.992 60879.016 70549.48 0.0 0.0 0.0 600.4179 15.01 15.01 0 3 1937777.0 537786.3333333334 8196.256 2015644.1 1604829.1 2192857.8 401884.06 582950.44 628524.5 0.0 0.0 24588.768 620.3005 17.04 17.04 0 8 65004.8 0.0 0.0 41671.5 38050.62 115292.28 0.0 0.0 0.0 0.0 0.0 0.0 532.3486 12.39 12.39 0 18 Spectral Match to Monolinolenin (9c,12c,15c) from NIST14 nan nan 1819525.566666667 0.0 0.0 1890772.6 1259748.9 2308055.2 0.0 0.0 0.0 0.0 0.0 0.0 300.1599 4.05 4.05 0 40 N,O-dimethylcoclaurine OC1=C(OC)C=C2C([C@@](CC3=CC=C(OC)C=C3)([H])N(C)CC2)=C1 InChI=1S/C19H23NO3/c1-20-9-8-14-11-19(23-3)18(21)12-16(14)17(20)10-13-4-6-15(22-2)7-5-13/h4-7,11-12,17,21H,8-10H2,1-3H3/t17-/m0/s1 89390.57666666666 87261.23666666666 0.0 0.0 183512.62 84659.11 0.0 103877.65 157906.06 0.0 0.0 0.0 497.4244 15.87 15.87 0 36 Spectral Match to Nonaethylene glycol from NIST14 nan nan 57646.405 0.0 61668.12899999999 53781.11 60155.395 59002.71 0.0 0.0 0.0 52903.645 68154.09 63946.652 503.1587 8.82 8.82 0 56 Piplartine COc1cc(/C=C/C(=O)N2CCC=CC2=O)cc(OC)c1OC InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3/b8-7+ 30928.961666666662 0.0 0.0 32874.055 30013.137 29899.693 0.0 0.0 0.0 0.0 0.0 0.0 681.3289 16.04 16.04 0 8 82922.83666666667 0.0 0.0 72271.12 86894.32 89603.07 0.0 0.0 0.0 0.0 0.0 0.0 355.227 12.52 12.52 0 14 NCGC00380882-01!5-chloro-2,4-dihydroxy-6-methyl-3-[(E)-3-methyl-5-[(1S,2R,6R)-1,2,6-trimethyl-3-oxocyclohexyl]pent-2-enyl]benzaldehyde [IIN-based on: CCMSLIB00000845779] C[C@@H]1CCC(=O)[C@H](C)[C@@]1(C)CC\\\\C(C)=C\\\\CC2=C(O)C(C=O)=C(C)C(Cl)=C2O InChI=1S/C23H31ClO4/c1-13(10-11-23(5)14(2)7-9-19(26)16(23)4)6-8-17-21(27)18(12-25)15(3)20(24)22(17)28/h6,12,14,16,27-28H,7-11H2,1-5H3/b13-6+/t14-,16+,23+/m1/s1 348815.38 0.0 0.0 371638.34 293674.3 381133.5 0.0 0.0 0.0 0.0 0.0 0.0 409.2741 13.57 13.57 0 3 (2S,3S,4S,5R,6R)-6-[[(3S,4S,6aR,6bS,8R,8aR,9R,10R,12aS,14bR)-10-acetyloxy-8a-(acetyloxymethyl)-8,9-dihydroxy-4-(hydroxymethyl)-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-4-hydroxy-3,5-bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]oxane-2-carboxylic acid CC(=O)OC[C@@]12[C@@H](CC(C)(C)[C@@H](OC(C)=O)[C@@H]1O)C1=CCC3[C@@]4(C)CC[C@H](O[C@@H]5O[C@H](C(=O)O)[C@@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)[C@H](O)[C@H]5O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@](C)(CO)C4CC[C@@]3(C)[C@]1(C)C[C@H]2O InChI=1S/C52H82O24/c1-21(56)69-20-52-24(15-47(3,4)42(41(52)66)70-22(2)57)23-9-10-28-48(5)13-12-30(49(6,19-55)27(48)11-14-50(28,7)51(23,8)16-29(52)58)73-46-39(75-45-36(64)34(62)32(60)26(18-54)72-45)37(65)38(40(76-46)43(67)68)74-44-35(63)33(61)31(59)25(17-53)71-44/h9,24-42,44-46,53-55,58-66H,10-20H2,1-8H3,(H,67,68)/t24-,25+,26+,27?,28?,29+,30-,31+,32+,33-,34-,35+,36+,37-,38-,39+,40-,41-,42-,44-,45-,46+,48-,49+,50+,51+,52-/m0/s1 521549.6500000001 0.0 0.0 292083.06 244008.83 1028557.06 0.0 0.0 0.0 0.0 0.0 0.0 607.2921 16.14 16.14 0 8 Pheophorbide A CCC1=C2C=C3C(=C4C(=O)C(C(=C5C(C(C(=N5)C=C6C(=C(C(=CC(=C1C)N2)N6)C=C)C)C)CCC(=O)O)C4=N3)C(=O)OC)C InChI=1S/C35H36N4O5/c1-8-19-15(3)22-12-24-17(5)21(10-11-28(40)41)32(38-24)30-31(35(43)44-7)34(42)29-18(6)25(39-33(29)30)14-27-20(9-2)16(4)23(37-27)13-26(19)36-22/h8,12-14,17,21,31,36-37H,1,9-11H2,2-7H3,(H,40,41) 0.0 75996.91966666667 0.0 0.0 0.0 0.0 81762.266 64721.973 81506.52 0.0 0.0 0.0 219.102 5.46 5.46 0 34 (2R,3R,4S,5S,6R)-2-[[7-hydroxy-1-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-6-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol COc1cc(C2c3cc(O)c(OC)cc3CC(CO)C2CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)ccc1O InChI=1S/C26H34O11/c1-34-19-6-12(3-4-17(19)29)22-15-8-18(30)20(35-2)7-13(15)5-14(9-27)16(22)11-36-26-25(33)24(32)23(31)21(10-28)37-26/h3-4,6-8,14,16,21-33H,5,9-11H2,1-2H3/t14?,16?,21-,22?,23-,24+,25-,26-/m1/s1 144655.07666666666 0.0 0.0 154081.22 126272.65 153611.36 0.0 0.0 0.0 0.0 0.0 0.0 806.5417 16.52 16.52 0 18 1512171.1 155824.25 0.0 1384808.9 1411936.9 1739767.5 73821.29 213365.19 180286.27 0.0 0.0 0.0 567.4202 16.6 16.6 0 3 CHEBI:181245 CC(CC(O)C(O)C(C)(C)O)C1CCC2(C)C3CCC4C(C)(C(=O)OC5OC(CO)C(O)C(O)C5O)C(O)CC(O)C45CC35CCC12C InChI=1S/C36H60O12/c1-17(13-19(38)28(44)31(2,3)46)18-9-10-33(5)21-7-8-22-34(6,30(45)48-29-27(43)26(42)25(41)20(15-37)47-29)23(39)14-24(40)36(22)16-35(21,36)12-11-32(18,33)4/h17-29,37-44,46H,7-16H2,1-6H3 547246.0066666667 67793.838 42934.06666666667 487637.88 533342.2 620757.94 42981.434 60624.69 99775.39 35647.61 47180.035 45974.555 310.1056 7.83 7.83 0 45 85888.88799999999 105045.01666666666 65515.58533333333 86044.98 84594.45 87027.234 95689.75 104839.64 114605.66 102251.016 56386.22 37909.52 330.1704 3.72 3.72 0 40 Desvenlafaxine CN(C)CC(c1ccc(O)cc1)C1(O)CCCCC1 InChI=1S/C16H25NO2/c1-17(2)12-15(13-6-8-14(18)9-7-13)16(19)10-4-3-5-11-16/h6-9,15,18-19H,3-5,10-12H2,1-2H3 56546.85466666666 0.0 0.0 58630.06 45734.234 65276.27 0.0 0.0 0.0 0.0 0.0 0.0 391.2638 11.81 11.81 0 94 15.995 15 0.9485 0 198 155 6 Cosine 0.9485 -40.031 -40 0.783 0 198 337 6 Cosine 0.783 10.042 10 0.7242 0 198 109 6 Cosine 0.7242 13.98 13 0.9044 0 812 888 8 Cosine 0.9044 13.98 13 0.9067 0 812 881 8 Cosine 0.9067 -0.0 0 0.9492 0 812 795 8 Cosine 0.9492 -0.0 0 0.9936 0 462 445 34 Cosine 0.9936 -10.021 -10 0.7526 0 462 544 34 Cosine 0.7526 2.005 2 0.8048 0 462 388 34 Cosine 0.8048 -15.024 -15 0.7543 0 462 437 34 Cosine 0.7543 -0.0 0 0.9566 0 462 399 34 Cosine 0.9566 0.0 0 0.948 0 462 535 34 Cosine 0.948 2.005 2 0.8666 0 462 451 34 Cosine 0.8666 0.0 0 0.9645 0 462 351 34 Cosine 0.9645 -0.0 0 0.9915 0 462 386 34 Cosine 0.9915 0.0 0 0.9921 0 462 508 34 Cosine 0.9921 -28.99 -28 0.7941 0 116 226 39 Cosine 0.7941 41.995 41 0.7938 0 116 59 39 Cosine 0.7938 24.969 24 0.7685 0 116 52 39 Cosine 0.7685 6.958 6 0.7514 0 116 53 39 Cosine 0.7514 204.048 204 0.7074 0 116 49 39 Cosine 0.7074 -13.979 -13 0.7593 0 116 117 39 Cosine 0.7593 0.0 0 0.9738 0 116 131 39 Cosine 0.9738 18.01 18 0.79 0 582 581 24 Cosine 0.79 30.011 30 0.753 0 558 574 24 Cosine 0.753 -30.011 -30 0.7445 0 558 550 24 Cosine 0.7445 -30.011 -30 0.789 0 558 348 24 Cosine 0.789 0.0 0 0.7727 0 743 769 26 Cosine 0.7727 15.995 15 0.7507 0 743 825 26 Cosine 0.7507 -29.974 -29 0.7208 0 743 697 26 Cosine 0.7208 -86.073 -86 0.776 0 743 738 26 Cosine 0.776 2.016 2 0.8072 0 743 791 26 Cosine 0.8072 18.01 18 0.7998 0 743 839 26 Cosine 0.7998 0.0 0 0.9918 0 384 447 4 Cosine 0.9918 -0.0 0 0.7698 0 384 507 4 Cosine 0.7698 0.0 0 0.7873 0 384 536 4 Cosine 0.7873 -5.005 -5 0.8295 0 15 8 5 Cosine 0.8295 41.027 41 0.7125 0 15 17 5 Cosine 0.7125 -46.032 -46 0.8941 0 15 9 5 Cosine 0.8941 23.016 23 0.9657 0 15 19 5 Cosine 0.9657 -72.954 -72 0.78 0 15 26 5 Cosine 0.78 14.016 14 0.7525 0 472 355 34 Cosine 0.7525 12.0 12 0.8064 0 472 459 34 Cosine 0.8064 14.016 14 0.7448 0 472 282 34 Cosine 0.7448 -12.0 -12 0.8047 0 472 504 34 Cosine 0.8047 -14.016 -14 0.7127 0 472 473 34 Cosine 0.7127 14.016 14 0.7501 0 472 377 34 Cosine 0.7501 0.0 0 0.9667 0 637 680 10 Cosine 0.9667 0.0 0 0.9259 0 637 643 10 Cosine 0.9259 0.0 0 0.9695 0 637 646 10 Cosine 0.9695 0.0 0 0.9398 0 637 868 10 Cosine 0.9398 0.0 0 0.946 0 637 624 10 Cosine 0.946 0.0 0 0.9757 0 637 631 10 Cosine 0.9757 0.0 0 0.9619 0 637 640 10 Cosine 0.9619 0.0 0 0.9629 0 637 649 10 Cosine 0.9629 0.0 0 0.9564 0 637 660 10 Cosine 0.9564 0.0 0 0.969 0 637 667 10 Cosine 0.969 0.0 0 0.936 0 275 285 15 Cosine 0.936 15.995 15 0.8873 0 275 260 15 Cosine 0.8873 -14.016 -14 0.897 0 275 232 15 Cosine 0.897 -14.016 -14 0.9384 0 275 274 15 Cosine 0.9384 14.016 14 0.8818 0 275 283 15 Cosine 0.8818 -14.016 -14 0.8326 0 275 315 15 Cosine 0.8326 14.015 14 0.8225 0 366 244 24 Cosine 0.8225 -14.016 -14 0.8826 0 366 414 24 Cosine 0.8826 -14.016 -14 0.889 0 745 659 14 Cosine 0.889 -2.016 -2 0.8626 0 745 619 14 Cosine 0.8626 -44.062 -44 0.8089 0 745 620 14 Cosine 0.8089 -2.016 -2 0.8674 0 745 627 14 Cosine 0.8674 13.979 13 0.7067 0 745 633 14 Cosine 0.7067 0.0 0 0.9931 0 632 641 100 Cosine 0.9931 0.0 0 0.9713 0 632 626 100 Cosine 0.9713 -27.994 -27 0.7624 0 780 741 8 Cosine 0.7624 -27.994 -27 0.7636 0 780 759 8 Cosine 0.7636 -46.005 -46 0.8534 0 780 774 8 Cosine 0.8534 27.995 27 0.7479 0 780 784 8 Cosine 0.7479 -28.031 -28 0.7287 0 780 882 8 Cosine 0.7287 18.01 18 0.884 0 665 720 3 Cosine 0.884 0.0 0 0.9345 0 665 681 3 Cosine 0.9345 0.0 0 0.9589 0 665 689 3 Cosine 0.9589 0.0 0 0.9736 0 665 703 3 Cosine 0.9736 18.01 18 0.8834 0 665 709 3 Cosine 0.8834 18.01 18 0.8813 0 665 725 3 Cosine 0.8813 18.011 18 0.893 0 665 727 3 Cosine 0.893 18.011 18 0.8917 0 665 734 3 Cosine 0.8917 18.011 18 0.8977 0 665 750 3 Cosine 0.8977 34.006 34 0.8911 0 665 824 3 Cosine 0.8911 0.0 0 0.9609 0 253 273 102 Cosine 0.9609 14.99 14 0.8543 0 842 662 3 Cosine 0.8543 -43.992 -43 0.8525 0 842 847 3 Cosine 0.8525 -44.999 -44 0.8459 0 842 848 3 Cosine 0.8459 34.007 34 0.9027 0 622 896 3 Cosine 0.9027 0.0 0 0.8964 0 622 645 3 Cosine 0.8964 34.006 34 0.8984 0 622 845 3 Cosine 0.8984 -19.018 -19 0.8659 0 622 593 3 Cosine 0.8659 0.0 0 0.9712 0 622 611 3 Cosine 0.9712 15.995 15 0.9057 0 622 694 3 Cosine 0.9057 34.006 34 0.9168 0 622 729 3 Cosine 0.9168 35.013 35 0.8994 0 622 843 3 Cosine 0.8994 0.0 0 0.8983 0 828 815 3 Cosine 0.8983 -1.007 -1 0.8449 0 828 613 3 Cosine 0.8449 0.0 0 0.9847 0 828 803 3 Cosine 0.9847 0.001 0 0.9115 0 828 851 3 Cosine 0.9115 -84.094 -84 0.9191 0 521 648 83 Cosine 0.9191 31.043 31 0.8117 0 201 196 40 Cosine 0.8117 -31.043 -31 0.8315 0 201 204 40 Cosine 0.8315 17.027 17 0.7113 0 201 185 40 Cosine 0.7113 3.011 3 0.7677 0 201 130 40 Cosine 0.7677 3.011 3 0.7647 0 201 190 40 Cosine 0.7647 96.983 96 0.7681 0 201 200 40 Cosine 0.7681 -17.027 -17 0.936 0 201 202 40 Cosine 0.936 -31.043 -31 0.8129 0 201 266 40 Cosine 0.8129 -17.027 -17 0.8945 0 201 270 40 Cosine 0.8945 -0.001 0 0.9011 0 734 815 3 Cosine 0.9011 0.001 0 0.9782 0 734 720 3 Cosine 0.9782 -1.007 -1 0.8895 0 734 593 3 Cosine 0.8895 18.011 18 0.8795 0 734 703 3 Cosine 0.8795 0.001 0 0.9766 0 734 709 3 Cosine 0.9766 0.001 0 0.9692 0 734 725 3 Cosine 0.9692 0.0 0 0.9782 0 734 727 3 Cosine 0.9782 -0.0 0 0.9817 0 734 750 3 Cosine 0.9817 15.995 15 0.9029 0 734 824 3 Cosine 0.9029 15.995 15 0.8197 0 101 76 6 Cosine 0.8197 57.969 57 0.8045 0 101 82 6 Cosine 0.8045 15.995 15 0.9249 0 101 109 6 Cosine 0.9249 -0.0 0 0.9673 0 101 110 6 Cosine 0.9673 14.016 14 0.7011 0 362 327 24 Cosine 0.7011 -30.01 -30 0.7513 0 362 361 24 Cosine 0.7513 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0 618 577 61 Cosine 0.7682 388.152 388 0.7987 0 546 574 24 Cosine 0.7987 388.152 388 0.7999 0 546 550 24 Cosine 0.7999 -0.0 0 0.9887 0 546 575 24 Cosine 0.9887 370.142 370 0.7711 0 546 552 24 Cosine 0.7711 -1.008 -1 0.8854 0 360 358 6 Cosine 0.8854 11.963 11 0.9152 0 360 364 6 Cosine 0.9152 -0.0 0 0.9356 0 360 369 6 Cosine 0.9356 -0.0 0 0.9706 0 360 408 6 Cosine 0.9706 30.011 30 0.8616 0 135 154 40 Cosine 0.8616 2.016 2 0.8538 0 135 158 40 Cosine 0.8538 45.058 45 0.9281 0 406 372 6 Cosine 0.9281 0.0 0 0.9959 0 406 371 6 Cosine 0.9959 0.0 0 0.9633 0 406 501 6 Cosine 0.9633 45.058 45 0.9265 0 501 372 6 Cosine 0.9265 0.0 0 0.9677 0 501 371 6 Cosine 0.9677 15.995 15 0.8833 0 129 108 44 Cosine 0.8833 -92.959 -92 0.7731 0 104 102 51 Cosine 0.7731 -310.069 -310 0.8477 0 149 144 41 Cosine 0.8477 -15.995 -15 0.8426 0 76 74 6 Cosine 0.8426 0.0 0 0.7781 0 76 81 6 Cosine 0.7781 -10.021 -10 0.7607 0 572 399 34 Cosine 0.7607 0.0 0 0.9144 0 572 544 34 Cosine 0.9144 -260.213 -260 0.8097 0 757 615 23 Cosine 0.8097 -260.213 -260 0.9757 0 757 606 23 Cosine 0.9757 3.019 3 0.9162 0 757 731 23 Cosine 0.9162 20.981 20 0.93 0 757 788 23 Cosine 0.93 21.984 21 0.9779 0 757 789 23 Cosine 0.9779 -14.016 -14 0.8927 0 363 517 8 Cosine 0.8927 -44.027 -44 0.7878 0 363 598 8 Cosine 0.7878 96.984 96 0.723 0 187 200 40 Cosine 0.723 -1.001 -1 0.8249 0 25 21 5 Cosine 0.8249 0.0 0 0.9143 0 680 624 10 Cosine 0.9143 0.0 0 0.9658 0 680 640 10 Cosine 0.9658 0.0 0 0.9123 0 680 643 10 Cosine 0.9123 0.0 0 0.9285 0 680 649 10 Cosine 0.9285 0.0 0 0.9955 0 680 660 10 Cosine 0.9955 0.0 0 0.997 0 680 667 10 Cosine 0.997 0.0 0 0.9724 0 680 868 10 Cosine 0.9724 10.956 10 0.8124 0 358 364 6 Cosine 0.8124 -1.008 -1 0.8691 0 358 408 6 Cosine 0.8691 -1.008 -1 0.8489 0 358 369 6 Cosine 0.8489 -2.016 -2 0.7728 0 465 389 45 Cosine 0.7728 319.142 319 0.7276 0 465 464 45 Cosine 0.7276 -0.0 0 0.9481 0 617 590 18 Cosine 0.9481 341.132 341 0.8025 0 617 591 18 Cosine 0.8025 -0.0 0 0.939 0 617 608 18 Cosine 0.939 179.08 179 0.8641 0 617 612 18 Cosine 0.8641 179.08 179 0.8859 0 617 616 18 Cosine 0.8859 -258.199 -258 0.784 0 617 826 18 Cosine 0.784 -54.083 -54 0.7655 0 704 790 18 Cosine 0.7655 -128.075 -128 0.7406 0 704 642 18 Cosine 0.7406 -184.146 -184 0.8417 0 704 604 18 Cosine 0.8417 -184.146 -184 0.7061 0 704 614 18 Cosine 0.7061 24.0 24 0.9009 0 704 736 18 Cosine 0.9009 42.047 42 0.823 0 620 619 14 Cosine 0.823 13.979 13 0.9039 0 759 661 8 Cosine 0.9039 -0.0 0 0.9668 0 759 741 8 Cosine 0.9668 -28.03 -28 0.8476 0 759 862 8 Cosine 0.8476 0.502 0 0.8497 0 449 432 79 Cosine 0.8497 -158.563 -158 0.9378 0 449 446 79 Cosine 0.9378 -14.016 -14 0.8572 0 160 225 9 Cosine 0.8572 -113.981 -113 0.7101 0 21 23 5 Cosine 0.7101 79.938 79 0.9079 0 146 143 41 Cosine 0.9079 -18.01 -18 0.9563 0 146 150 41 Cosine 0.9563 35.037 35 0.9728 0 146 128 41 Cosine 0.9728 116.928 116 0.8463 0 146 144 41 Cosine 0.8463 418.002 418 0.8765 0 146 145 41 Cosine 0.8765 0.0 0 0.8733 0 702 666 68 Cosine 0.8733 0.0 0 0.966 0 608 590 18 Cosine 0.966 -258.199 -258 0.8036 0 608 826 18 Cosine 0.8036 -179.08 -179 0.8974 0 608 616 18 Cosine 0.8974 341.132 341 0.8481 0 608 591 18 Cosine 0.8481 -179.08 -179 0.9185 0 608 612 18 Cosine 0.9185 28.979 28 0.8217 0 753 635 58 Cosine 0.8217 -30.047 -30 0.7742 0 753 654 58 Cosine 0.7742 -2.016 -2 0.7904 0 753 721 58 Cosine 0.7904 0.0 0 0.9363 0 655 674 3 Cosine 0.9363 -2.016 -2 0.8522 0 655 469 3 Cosine 0.8522 0.0 0 0.9877 0 655 658 3 Cosine 0.9877 0.0 0 0.988 0 855 480 24 Cosine 0.988 394.163 394 0.9074 0 855 479 24 Cosine 0.9074 16.031 16 0.7918 0 855 410 24 Cosine 0.7918 -30.01 -30 0.7673 0 855 476 24 Cosine 0.7673 18.01 18 0.874 0 855 477 24 Cosine 0.874 -2.016 -2 0.7787 0 855 528 24 Cosine 0.7787 18.01 18 0.916 0 855 854 24 Cosine 0.916 -18.01 -18 0.9326 0 855 864 24 Cosine 0.9326 -0.0 0 0.9884 0 855 876 24 Cosine 0.9884 -46.005 -46 0.7702 0 142 144 41 Cosine 0.7702 13.98 13 0.8465 0 793 879 8 Cosine 0.8465 0.0 0 0.9365 0 793 813 8 Cosine 0.9365 -46.042 -46 0.7793 0 793 799 8 Cosine 0.7793 -28.031 -28 0.9074 0 793 701 8 Cosine 0.9074 -28.032 -28 0.776 0 793 785 8 Cosine 0.776 21.97 21 0.8118 0 793 656 8 Cosine 0.8118 15.995 15 0.7913 0 793 887 8 Cosine 0.7913 13.98 13 0.8761 0 793 889 8 Cosine 0.8761 0.0 0 0.7999 0 291 173 42 Cosine 0.7999 -12.0 -12 0.7205 0 592 578 70 Cosine 0.7205 15.995 15 0.9062 0 186 126 40 Cosine 0.9062 15.995 15 0.958 0 186 134 40 Cosine 0.958 -14.016 -14 0.9237 0 186 153 40 Cosine 0.9237 0.0 0 0.9878 0 186 161 40 Cosine 0.9878 15.995 15 0.923 0 186 163 40 Cosine 0.923 -14.016 -14 0.9362 0 186 227 40 Cosine 0.9362 -30.01 -30 0.9248 0 186 242 40 Cosine 0.9248 0.0 0 0.9065 0 667 643 10 Cosine 0.9065 0.0 0 0.9724 0 667 868 10 Cosine 0.9724 0.0 0 0.9096 0 667 624 10 Cosine 0.9096 0.0 0 0.9287 0 667 649 10 Cosine 0.9287 0.0 0 0.9961 0 667 660 10 Cosine 0.9961 0.0 0 0.9637 0 667 640 10 Cosine 0.9637 180.063 180 0.8061 0 53 45 39 Cosine 0.8061 -22.032 -22 0.8727 0 53 226 39 Cosine 0.8727 -35.037 -35 0.8468 0 53 59 39 Cosine 0.8468 -63.047 -63 0.7067 0 53 300 39 Cosine 0.7067 18.01 18 0.9069 0 53 52 39 Cosine 0.9069 162.053 162 0.7501 0 53 44 39 Cosine 0.7501 -7.021 -7 0.8081 0 53 117 39 Cosine 0.8081 6.958 6 0.7182 0 53 131 39 Cosine 0.7182 -23.016 -23 0.8781 0 14 13 5 Cosine 0.8781 1.998 1 0.959 0 14 19 5 Cosine 0.959 17.003 17 0.7028 0 774 760 8 Cosine 0.7028 15.995 15 0.7229 0 774 701 8 Cosine 0.7229 -2.016 -2 0.7128 0 389 401 45 Cosine 0.7128 0.0 0 0.9095 0 649 643 10 Cosine 0.9095 0.0 0 0.9005 0 649 868 10 Cosine 0.9005 0.0 0 0.929 0 649 624 10 Cosine 0.929 0.0 0 0.9339 0 649 640 10 Cosine 0.9339 0.0 0 0.9135 0 649 660 10 Cosine 0.9135 -36.109 -36 0.806 0 710 228 36 Cosine 0.806 7.917 7 0.7963 0 710 237 36 Cosine 0.7963 88.053 88 0.8536 0 710 707 36 Cosine 0.8536 44.026 44 0.8935 0 710 713 36 Cosine 0.8935 -29.034 -29 0.7186 0 710 783 36 Cosine 0.7186 14.992 14 0.7541 0 710 787 36 Cosine 0.7541 0.0 0 0.8833 0 709 815 3 Cosine 0.8833 15.995 15 0.8884 0 709 824 3 Cosine 0.8884 0.001 0 0.9722 0 709 727 3 Cosine 0.9722 -1.007 -1 0.8775 0 709 593 3 Cosine 0.8775 0.0 0 0.9667 0 709 725 3 Cosine 0.9667 0.001 0 0.9765 0 709 750 3 Cosine 0.9765 46.042 46 0.8491 0 211 522 8 Cosine 0.8491 -49.94 -49 0.774 0 211 525 8 Cosine 0.774 -45.057 -45 0.9229 0 877 883 32 Cosine 0.9229 0.0 0 0.9282 0 113 147 78 Cosine 0.9282 -356.074 -356 0.8116 0 113 148 78 Cosine 0.8116 -262.23 -262 0.8378 0 46 615 23 Cosine 0.8378 0.0 0 0.9768 0 641 626 100 Cosine 0.9768 1.006 1 0.8812 0 898 897 3 Cosine 0.8812 0.0 0 0.8919 0 676 669 11 Cosine 0.8919 45.058 45 0.7424 0 676 672 11 Cosine 0.7424 0.0 0 0.7142 0 676 686 11 Cosine 0.7142 -2.016 -2 0.8749 0 460 518 65 Cosine 0.8749 -34.99 -34 0.7489 0 522 598 8 Cosine 0.7489 0.0 0 0.7983 0 719 733 3 Cosine 0.7983 -29.002 -29 0.8533 0 847 662 3 Cosine 0.8533 -1.007 -1 0.8564 0 847 848 3 Cosine 0.8564 -59.001 -59 0.7102 0 605 333 8 Cosine 0.7102 29.974 29 0.8627 0 605 524 8 Cosine 0.8627 -28.99 -28 0.7607 0 131 226 39 Cosine 0.7607 41.995 41 0.7624 0 131 59 39 Cosine 0.7624 13.979 13 0.7347 0 131 117 39 Cosine 0.7347 0.0 0 0.9533 0 634 613 3 Cosine 0.9533 0.0 0 0.9571 0 634 623 3 Cosine 0.9571 0.0 0 0.9572 0 634 804 3 Cosine 0.9572 -0.0 0 0.9183 0 634 819 3 Cosine 0.9183 0.0 0 0.9037 0 634 830 3 Cosine 0.9037 165.128 165 0.8025 0 634 831 3 Cosine 0.8025 -1.006 -1 0.8267 0 634 851 3 Cosine 0.8267 0.0 0 0.9563 0 634 852 3 Cosine 0.9563 181.001 181 0.7502 0 684 507 4 Cosine 0.7502 0.0 0 0.8676 0 684 670 4 Cosine 0.8676 181.001 181 0.7994 0 684 536 4 Cosine 0.7994 158.032 158 0.809 0 226 45 39 Cosine 0.809 -4.021 -4 0.9013 0 226 52 39 Cosine 0.9013 13.005 13 0.8831 0 226 59 39 Cosine 0.8831 -15.01 -15 0.8681 0 226 117 39 Cosine 0.8681 -41.016 -41 0.7785 0 226 300 39 Cosine 0.7785 0.0 0 0.9674 0 696 692 18 Cosine 0.9674 -262.23 -262 0.8174 0 696 616 18 Cosine 0.8174 -29.974 -29 0.8317 0 696 768 18 Cosine 0.8317 -29.974 -29 0.8337 0 696 817 18 Cosine 0.8337 56.099 56 0.8685 0 696 740 18 Cosine 0.8685 -100.177 -100 0.8073 0 696 591 18 Cosine 0.8073 -262.23 -262 0.8448 0 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706 683 3 Cosine 0.9526 -48.036 -48 0.929 0 706 609 3 Cosine 0.929 -26.016 -26 0.9338 0 706 663 3 Cosine 0.9338 17.003 17 0.8779 0 706 682 3 Cosine 0.8779 -18.01 -18 0.9418 0 706 716 3 Cosine 0.9418 -14.016 -14 0.9101 0 133 196 40 Cosine 0.9101 -14.016 -14 0.9173 0 133 204 40 Cosine 0.9173 0.0 0 0.9274 0 133 185 40 Cosine 0.9274 -14.016 -14 0.8383 0 133 153 40 Cosine 0.8383 148.037 148 0.7004 0 328 245 24 Cosine 0.7004 -53.048 -53 0.8102 0 328 327 24 Cosine 0.8102 35.037 35 0.921 0 328 329 24 Cosine 0.921 -28.031 -28 0.9462 0 328 330 24 Cosine 0.9462 53.048 53 0.7429 0 328 520 24 Cosine 0.7429 45.058 45 0.9185 0 884 886 64 Cosine 0.9185 330.147 330 0.7365 0 531 495 28 Cosine 0.7365 -0.0 0 0.8187 0 531 494 28 Cosine 0.8187 6.047 6 0.7102 0 886 797 64 Cosine 0.7102 -1.007 -1 0.8081 0 859 858 8 Cosine 0.8081 1.007 1 0.8156 0 859 867 8 Cosine 0.8156 0.0 0 0.989 0 859 837 8 Cosine 0.989 -1.007 -1 0.8141 0 859 836 8 Cosine 0.8141 -110.384 -110 0.8333 0 859 806 8 Cosine 0.8333 21.97 21 0.8446 0 656 813 8 Cosine 0.8446 181.001 181 0.7098 0 670 507 4 Cosine 0.7098 181.001 181 0.7639 0 670 536 4 Cosine 0.7639 15.995 15 0.8154 0 768 758 18 Cosine 0.8154 -29.974 -29 0.8468 0 768 692 18 Cosine 0.8468 18.01 18 0.9005 0 768 688 18 Cosine 0.9005 -292.203 -292 0.8024 0 768 612 18 Cosine 0.8024 -0.0 0 0.9033 0 768 817 18 Cosine 0.9033 18.01 18 0.8598 0 768 838 18 Cosine 0.8598 35.037 35 0.8155 0 768 840 18 Cosine 0.8155 44.055 44 0.7488 0 873 860 50 Cosine 0.7488 44.055 44 0.752 0 873 871 50 Cosine 0.752 -187.029 -187 0.8983 0 438 430 56 Cosine 0.8983 15.995 15 0.9897 0 534 352 2 Cosine 0.9897 45.058 45 0.9298 0 534 378 2 Cosine 0.9298 2.016 2 0.9884 0 534 400 2 Cosine 0.9884 0.0 0 0.9843 0 534 452 2 Cosine 0.9843 -11.964 -11 0.9485 0 534 458 2 Cosine 0.9485 2.016 2 0.984 0 534 463 2 Cosine 0.984 149.048 149 0.9509 0 534 467 2 Cosine 0.9509 -13.979 -13 0.9487 0 534 503 2 Cosine 0.9487 0.0 0 0.9315 0 833 630 3 Cosine 0.9315 15.995 15 0.8578 0 833 819 3 Cosine 0.8578 15.995 15 0.8389 0 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0.9117 0 217 64 88 Cosine 0.9117 4.031 4 0.7857 0 584 471 24 Cosine 0.7857 1.008 1 0.7987 0 584 581 24 Cosine 0.7987 -18.011 -18 0.8242 0 600 601 94 Cosine 0.8242 -0.0 0 0.943 0 274 283 15 Cosine 0.943 -356.074 -356 0.8281 0 147 148 78 Cosine 0.8281 -18.01 -18 0.7449 0 577 583 61 Cosine 0.7449 -0.0 0 0.9664 0 393 425 20 Cosine 0.9664 -1.003 -1 0.8006 0 393 422 20 Cosine 0.8006 -289.131 -289 0.8464 0 393 440 20 Cosine 0.8464 18.01 18 0.8997 0 293 323 2 Cosine 0.8997 -191.095 -191 0.8161 0 293 505 2 Cosine 0.8161 0.0 0 0.9656 0 871 860 50 Cosine 0.9656 173.042 173 0.7375 0 117 45 39 Cosine 0.7375 28.016 28 0.8135 0 117 59 39 Cosine 0.8135 -56.026 -56 0.7231 0 117 300 39 Cosine 0.7231 10.989 10 0.8248 0 117 52 39 Cosine 0.8248 0.0 0 0.713 0 224 193 90 Cosine 0.713 11.964 11 0.9442 0 458 452 2 Cosine 0.9442 27.959 27 0.9433 0 458 352 2 Cosine 0.9433 57.021 57 0.929 0 458 378 2 Cosine 0.929 13.979 13 0.9522 0 458 400 2 Cosine 0.9522 -13.979 -13 0.9497 0 458 463 2 Cosine 0.9497 -161.011 -161 0.9424 0 458 467 2 Cosine 0.9424 2.016 2 0.952 0 458 503 2 Cosine 0.952 0.0 0 0.7161 0 651 633 14 Cosine 0.7161 -330.147 -330 0.7407 0 494 495 28 Cosine 0.7407 16.032 16 0.7734 0 552 329 24 Cosine 0.7734 18.01 18 0.8198 0 552 574 24 Cosine 0.8198 -18.01 -18 0.8222 0 552 550 24 Cosine 0.8222 2.016 2 0.7574 0 552 246 24 Cosine 0.7574 -370.142 -370 0.7783 0 552 575 24 Cosine 0.7783 16.031 16 0.7576 0 552 581 24 Cosine 0.7576 -17.027 -17 0.9005 0 552 554 24 Cosine 0.9005 -388.152 -388 0.8052 0 575 574 24 Cosine 0.8052 -388.152 -388 0.8055 0 575 550 24 Cosine 0.8055 1.006 1 0.8424 0 851 852 3 Cosine 0.8424 -1.006 -1 0.841 0 851 613 3 Cosine 0.841 -1.006 -1 0.8248 0 851 623 3 Cosine 0.8248 -1.006 -1 0.836 0 851 804 3 Cosine 0.836 -0.0 0 0.9578 0 681 689 3 Cosine 0.9578 -15.995 -15 0.7431 0 74 81 6 Cosine 0.7431 15.995 15 0.8599 0 74 109 6 Cosine 0.8599 13.032 13 0.7142 0 155 84 6 Cosine 0.7142 -44.901 -44 0.9169 0 143 128 41 Cosine 0.9169 -36.99 -36 0.7898 0 143 144 41 Cosine 0.7898 -338.064 -338 0.8715 0 143 145 41 Cosine 0.8715 -30.047 -30 0.746 0 583 222 61 Cosine 0.746 17.027 17 0.8543 0 119 122 43 Cosine 0.8543 -0.0 0 0.9326 0 548 568 71 Cosine 0.9326 7.917 7 0.8183 0 713 228 36 Cosine 0.8183 51.943 51 0.8171 0 713 237 36 Cosine 0.8171 132.079 132 0.8743 0 713 707 36 Cosine 0.8743 -29.034 -29 0.7973 0 713 787 36 Cosine 0.7973 0.0 0 0.8749 0 645 611 3 Cosine 0.8749 18.011 18 0.8858 0 645 662 3 Cosine 0.8858 15.995 15 0.8913 0 645 694 3 Cosine 0.8913 5.005 5 0.862 0 645 897 3 Cosine 0.862 51.995 51 0.8208 0 365 337 6 Cosine 0.8208 82.006 82 0.8873 0 365 339 6 Cosine 0.8873 -174.141 -174 0.919 0 683 844 3 Cosine 0.919 -44.026 -44 0.9185 0 683 663 3 Cosine 0.9185 -1.007 -1 0.9166 0 683 682 3 Cosine 0.9166 -0.0 0 0.9349 0 683 716 3 Cosine 0.9349 -289.131 -289 0.8385 0 440 425 20 Cosine 0.8385 -14.016 -14 0.932 0 108 111 44 Cosine 0.932 -15.995 -15 0.7169 0 174 167 105 Cosine 0.7169 -28.031 -28 0.9053 0 856 746 7 Cosine 0.9053 13.979 13 0.8951 0 856 747 7 Cosine 0.8951 -2.015 -2 0.8603 0 674 469 3 Cosine 0.8603 0.0 0 0.932 0 674 658 3 Cosine 0.932 -66.047 -66 0.9202 0 609 716 3 Cosine 0.9202 -22.021 -22 0.9063 0 609 663 3 Cosine 0.9063 -30.982 -30 0.7608 0 551 410 24 Cosine 0.7608 0.0 0 0.8684 0 668 685 27 Cosine 0.8684 18.01 18 0.7263 0 322 395 76 Cosine 0.7263 -78.083 -78 0.763 0 736 790 18 Cosine 0.763 -160.146 -160 0.7221 0 736 604 18 Cosine 0.7221 -80.136 -80 0.8675 0 237 707 36 Cosine 0.8675 -44.026 -44 0.9212 0 237 228 36 Cosine 0.9212 22.909 22 0.801 0 237 787 36 Cosine 0.801 15.995 15 0.984 0 452 352 2 Cosine 0.984 2.016 2 0.9816 0 452 400 2 Cosine 0.9816 -2.016 -2 0.9951 0 452 463 2 Cosine 0.9951 -149.048 -149 0.9474 0 452 467 2 Cosine 0.9474 13.979 13 0.9514 0 452 503 2 Cosine 0.9514 218.124 218 0.7913 0 602 604 18 Cosine 0.7913 162.053 162 0.9066 0 602 642 18 Cosine 0.9066 -100.177 -100 0.8018 0 602 891 18 Cosine 0.8018 -288.063 -288 0.8883 0 212 188 69 Cosine 0.8883 288.062 288 0.8609 0 212 259 69 Cosine 0.8609 -0.0 0 0.9463 0 204 196 40 Cosine 0.9463 -14.016 -14 0.8917 0 204 185 40 Cosine 0.8917 65.941 65 0.8271 0 204 200 40 Cosine 0.8271 -14.016 -14 0.9001 0 204 202 40 Cosine 0.9001 14.016 14 0.8969 0 204 270 40 Cosine 0.8969 13.98 13 0.8842 0 741 661 8 Cosine 0.8842 -28.03 -28 0.8072 0 741 862 8 Cosine 0.8072 0.0 0 0.9304 0 408 369 6 Cosine 0.9304 2.015 2 0.7836 0 769 822 26 Cosine 0.7836 15.995 15 0.9184 0 769 825 26 Cosine 0.9184 159.065 159 0.9057 0 446 432 79 Cosine 0.9057 -23.016 -23 0.8177 0 27 28 62 Cosine 0.8177 148.037 148 0.784 0 315 256 15 Cosine 0.784 -1.979 -1 0.9564 0 315 324 15 Cosine 0.9564 -28.031 -28 0.9441 0 315 301 15 Cosine 0.9441 162.053 162 0.8092 0 315 257 15 Cosine 0.8092 15.995 15 0.9214 0 315 286 15 Cosine 0.9214 -27.002 -27 0.7167 0 242 162 40 Cosine 0.7167 -44.026 -44 0.8227 0 242 153 40 Cosine 0.8227 -30.01 -30 0.9276 0 242 161 40 Cosine 0.9276 -14.016 -14 0.9273 0 242 163 40 Cosine 0.9273 -15.995 -15 0.8927 0 242 227 40 Cosine 0.8927 -110.384 -110 0.8384 0 806 837 8 Cosine 0.8384 -2.015 -2 0.7043 0 760 700 8 Cosine 0.7043 -15.995 -15 0.7385 0 633 619 14 Cosine 0.7385 -0.0 0 0.8407 0 606 615 23 Cosine 0.8407 -263.232 -263 0.9062 0 606 731 23 Cosine 0.9062 -239.233 -239 0.9202 0 606 788 23 Cosine 0.9202 -238.229 -238 0.975 0 606 789 23 Cosine 0.975 -10.021 -10 0.7474 0 544 445 34 Cosine 0.7474 -10.021 -10 0.761 0 544 399 34 Cosine 0.761 2.016 2 0.9431 0 394 339 6 Cosine 0.9431 16.031 16 0.7836 0 410 480 24 Cosine 0.7836 16.031 16 0.7942 0 410 876 24 Cosine 0.7942 2.015 2 0.7448 0 410 486 24 Cosine 0.7448 13.979 13 0.7811 0 822 825 26 Cosine 0.7811 0.0 0 0.8976 0 593 819 3 Cosine 0.8976 -1.007 -1 0.8994 0 593 727 3 Cosine 0.8994 15.995 15 0.8871 0 593 630 3 Cosine 0.8871 -1.007 -1 0.8932 0 593 725 3 Cosine 0.8932 -1.007 -1 0.8941 0 593 750 3 Cosine 0.8941 51.031 51 0.8197 0 840 758 18 Cosine 0.8197 53.047 53 0.7888 0 840 688 18 Cosine 0.7888 -68.063 -68 0.7922 0 840 737 18 Cosine 0.7922 17.026 17 0.9112 0 840 838 18 Cosine 0.9112 -238.229 -238 0.8144 0 604 790 18 Cosine 0.8144 -56.071 -56 0.8256 0 604 642 18 Cosine 0.8256 0.0 0 0.8553 0 604 614 18 Cosine 0.8553 -318.3 -318 0.8642 0 604 891 18 Cosine 0.8642 -14.016 -14 0.8473 0 191 126 40 Cosine 0.8473 0.0 0 0.8409 0 191 235 40 Cosine 0.8409 15.995 15 0.9028 0 191 227 40 Cosine 0.9028 -14.016 -14 0.87 0 191 134 40 Cosine 0.87 -95.97 -95 0.7013 0 26 19 5 Cosine 0.7013 2.016 2 0.7666 0 688 758 18 Cosine 0.7666 18.01 18 0.8067 0 688 817 18 Cosine 0.8067 36.021 36 0.8261 0 688 838 18 Cosine 0.8261 -18.011 -18 0.8709 0 58 57 59 Cosine 0.8709 -28.03 -28 0.7821 0 469 832 3 Cosine 0.7821 -2.015 -2 0.8586 0 469 658 3 Cosine 0.8586 2.015 2 0.8983 0 887 879 8 Cosine 0.8983 0.0 0 0.7712 0 887 875 8 Cosine 0.7712 15.995 15 0.7875 0 887 813 8 Cosine 0.7875 18.01 18 0.7526 0 887 862 8 Cosine 0.7526 -10.021 -10 0.7626 0 887 693 8 Cosine 0.7626 -2.015 -2 0.9088 0 887 889 8 Cosine 0.9088 -2.015 -2 0.8063 0 875 879 8 Cosine 0.8063 -10.021 -10 0.8647 0 875 693 8 Cosine 0.8647 -28.031 -28 0.8351 0 875 766 8 Cosine 0.8351 -30.047 -30 0.7882 0 875 767 8 Cosine 0.7882 -24.01 -24 0.7968 0 875 781 8 Cosine 0.7968 37.977 37 0.7411 0 875 795 8 Cosine 0.7411 18.012 18 0.9265 0 694 896 3 Cosine 0.9265 18.011 18 0.9253 0 694 845 3 Cosine 0.9253 34.007 34 0.9017 0 694 841 3 Cosine 0.9017 19.018 19 0.888 0 694 843 3 Cosine 0.888 15.995 15 0.8993 0 694 611 3 Cosine 0.8993 18.011 18 0.8875 0 694 729 3 Cosine 0.8875 -28.031 -28 0.9463 0 827 715 8 Cosine 0.9463 -28.031 -28 0.9514 0 827 742 8 Cosine 0.9514 -0.0 0 0.9509 0 827 816 8 Cosine 0.9509 -27.995 -27 0.9368 0 154 158 40 Cosine 0.9368 -1.007 -1 0.7993 0 832 831 3 Cosine 0.7993 162.053 162 0.9257 0 241 195 60 Cosine 0.9257 -70.006 -70 0.7475 0 573 333 8 Cosine 0.7475 -179.08 -179 0.8836 0 612 590 18 Cosine 0.8836 -262.23 -262 0.8564 0 612 692 18 Cosine 0.8564 0.0 0 0.9528 0 612 616 18 Cosine 0.9528 -2.016 -2 0.8691 0 612 642 18 Cosine 0.8691 -54.044 -54 0.7471 0 888 767 8 Cosine 0.7471 13.98 13 0.9115 0 888 795 8 Cosine 0.9115 0.0 0 0.9608 0 889 879 8 Cosine 0.9608 13.98 13 0.8818 0 889 813 8 Cosine 0.8818 -26.025 -26 0.79 0 889 781 8 Cosine 0.79 -14.016 -14 0.8667 0 889 893 8 Cosine 0.8667 -14.051 -14 0.7251 0 862 661 8 Cosine 0.7251 13.981 13 0.8902 0 862 754 8 Cosine 0.8902 -27.995 -27 0.7355 0 862 882 8 Cosine 0.7355 -84.057 -84 0.8222 0 792 740 18 Cosine 0.8222 15.995 15 0.8554 0 792 838 18 Cosine 0.8554 -2.016 -2 0.7875 0 652 635 58 Cosine 0.7875 -30.011 -30 0.7701 0 480 476 24 Cosine 0.7701 18.01 18 0.8813 0 480 477 24 Cosine 0.8813 394.163 394 0.902 0 480 479 24 Cosine 0.902 2.016 2 0.7753 0 480 528 24 Cosine 0.7753 -18.01 -18 0.9079 0 480 854 24 Cosine 0.9079 -18.01 -18 0.9273 0 480 864 24 Cosine 0.9273 0.0 0 0.9819 0 480 876 24 Cosine 0.9819 -65.941 -65 0.8128 0 200 196 40 Cosine 0.8128 79.956 79 0.8584 0 200 202 40 Cosine 0.8584 79.957 79 0.8501 0 200 270 40 Cosine 0.8501 13.979 13 0.8713 0 699 772 21 Cosine 0.8713 13.979 13 0.8337 0 699 800 21 Cosine 0.8337 -14.015 -14 0.7998 0 457 355 34 Cosine 0.7998 -14.015 -14 0.7933 0 457 282 34 Cosine 0.7933 -14.015 -14 0.7837 0 457 377 34 Cosine 0.7837 -81.89 -81 0.8448 0 128 144 41 Cosine 0.8448 -382.964 -382 0.8833 0 128 145 41 Cosine 0.8833 0.0 0 0.8726 0 686 669 11 Cosine 0.8726 -45.058 -45 0.8211 0 686 687 11 Cosine 0.8211 45.058 45 0.841 0 686 672 11 Cosine 0.841 -182.158 -182 0.7074 0 642 790 18 Cosine 0.7074 -2.016 -2 0.856 0 642 616 18 Cosine 0.856 -262.23 -262 0.8305 0 642 891 18 Cosine 0.8305 97.053 97 0.7788 0 496 495 28 Cosine 0.7788 -30.011 -30 0.723 0 496 533 28 Cosine 0.723 0.0 0 0.9541 0 399 445 34 Cosine 0.9541 -130.199 -130 0.9261 0 869 786 8 Cosine 0.9261 -302.473 -302 0.8418 0 869 517 8 Cosine 0.8418 129.022 129 0.7954 0 173 171 42 Cosine 0.7954 -15.995 -15 0.7923 0 173 172 42 Cosine 0.7923 -14.016 -14 0.8284 0 404 532 28 Cosine 0.8284 15.995 15 0.8763 0 404 495 28 Cosine 0.8763 -59.074 -59 0.7529 0 404 530 28 Cosine 0.7529 13.98 13 0.7904 0 813 879 8 Cosine 0.7904 -28.031 -28 0.779 0 813 701 8 Cosine 0.779 -28.032 -28 0.7422 0 813 785 8 Cosine 0.7422 46.042 46 0.8214 0 813 799 8 Cosine 0.8214 -14.015 -14 0.8734 0 313 308 22 Cosine 0.8734 -15.995 -15 0.8683 0 630 819 3 Cosine 0.8683 0.0 0 0.8841 0 630 843 3 Cosine 0.8841 -29.063 -29 0.9356 0 352 378 2 Cosine 0.9356 13.979 13 0.987 0 352 400 2 Cosine 0.987 13.979 13 0.98 0 352 463 2 Cosine 0.98 -133.053 -133 0.9603 0 352 467 2 Cosine 0.9603 29.974 29 0.9475 0 352 503 2 Cosine 0.9475 -28.031 -28 0.7675 0 661 754 8 Cosine 0.7675 0.0 0 0.9155 0 657 601 94 Cosine 0.9155 -18.935 -18 0.9143 0 40 51 72 Cosine 0.9143 -301.074 -301 0.7724 0 144 145 41 Cosine 0.7724 0.0 0 0.9768 0 624 643 10 Cosine 0.9768 0.0 0 0.8912 0 624 868 10 Cosine 0.8912 0.0 0 0.964 0 624 640 10 Cosine 0.964 0.0 0 0.891 0 624 660 10 Cosine 0.891 34.007 34 0.8929 0 611 896 3 Cosine 0.8929 34.007 34 0.8959 0 611 845 3 Cosine 0.8959 35.013 35 0.8982 0 611 843 3 Cosine 0.8982 34.006 34 0.9241 0 611 729 3 Cosine 0.9241 0.0 0 0.8926 0 868 643 10 Cosine 0.8926 0.0 0 0.9454 0 868 640 10 Cosine 0.9454 0.0 0 0.971 0 868 660 10 Cosine 0.971 -1.979 -1 0.8613 0 797 724 64 Cosine 0.8613 -90.085 -90 0.7455 0 13 175 5 Cosine 0.7455 -74.09 -74 0.7863 0 13 177 5 Cosine 0.7863 -14.016 -14 0.8224 0 279 298 9 Cosine 0.8224 -17.027 -17 0.8846 0 334 333 8 Cosine 0.8846 0.0 0 0.9736 0 836 858 8 Cosine 0.9736 -0.0 0 0.9712 0 836 867 8 Cosine 0.9712 -278.297 -278 0.7977 0 836 775 8 Cosine 0.7977 -1.007 -1 0.8216 0 836 837 8 Cosine 0.8216 15.995 15 0.9724 0 323 332 2 Cosine 0.9724 -30.01 -30 0.91 0 337 339 6 Cosine 0.91 -0.0 0 0.769 0 507 447 4 Cosine 0.769 -30.01 -30 0.7907 0 507 502 4 Cosine 0.7907 0.0 0 0.9118 0 507 536 4 Cosine 0.9118 -18.01 -18 0.8051 0 45 44 39 Cosine 0.8051 162.053 162 0.8366 0 45 52 39 Cosine 0.8366 145.026 145 0.7812 0 45 59 39 Cosine 0.7812 41.115 41 0.8961 0 356 382 2 Cosine 0.8961 101.975 101 0.9328 0 356 398 2 Cosine 0.9328 103.99 103 0.9447 0 356 378 2 Cosine 0.9447 -0.0 0 0.8879 0 529 492 4 Cosine 0.8879 -30.011 -30 0.8027 0 529 497 4 Cosine 0.8027 -16.021 -16 0.896 0 162 124 40 Cosine 0.896 -12.986 -12 0.7553 0 162 163 40 Cosine 0.7553 -376.152 -376 0.8494 0 477 479 24 Cosine 0.8494 -48.021 -48 0.7517 0 477 476 24 Cosine 0.7517 -13.979 -13 0.7982 0 477 581 24 Cosine 0.7982 18.01 18 0.8666 0 477 876 24 Cosine 0.8666 0.0 0 0.9476 0 477 854 24 Cosine 0.9476 0.0 0 0.9716 0 477 864 24 Cosine 0.9716 -15.995 -15 0.9244 0 841 896 3 Cosine 0.9244 1.006 1 0.9225 0 841 844 3 Cosine 0.9225 -15.995 -15 0.9218 0 841 845 3 Cosine 0.9218 15.996 15 0.9077 0 841 729 3 Cosine 0.9077 -44.997 -44 0.8875 0 841 897 3 Cosine 0.8875 -29.008 -29 0.8122 0 126 124 40 Cosine 0.8122 -0.0 0 0.9221 0 126 134 40 Cosine 0.9221 15.995 15 0.9148 0 126 161 40 Cosine 0.9148 0.0 0 0.7838 0 126 163 40 Cosine 0.7838 -2.016 -2 0.9289 0 891 692 18 Cosine 0.9289 -318.3 -318 0.7255 0 891 614 18 Cosine 0.7255 -278.297 -278 0.8041 0 775 858 8 Cosine 0.8041 -278.297 -278 0.8105 0 775 867 8 Cosine 0.8105 13.979 13 0.9093 0 775 700 8 Cosine 0.9093 -28.032 -28 0.9081 0 775 880 8 Cosine 0.9081 14.016 14 0.8279 0 153 185 40 Cosine 0.8279 -14.016 -14 0.9203 0 153 161 40 Cosine 0.9203 -28.031 -28 0.8714 0 153 227 40 Cosine 0.8714 1.003 1 0.8206 0 153 124 40 Cosine 0.8206 30.011 30 0.8402 0 153 134 40 Cosine 0.8402 30.01 30 0.8276 0 497 492 4 Cosine 0.8276 -262.23 -262 0.8026 0 692 616 18 Cosine 0.8026 56.099 56 0.862 0 692 740 18 Cosine 0.862 -29.974 -29 0.848 0 692 817 18 Cosine 0.848 -11.963 -11 0.8204 0 692 838 18 Cosine 0.8204 -63.068 -63 0.8798 0 330 329 24 Cosine 0.8798 -81.079 -81 0.796 0 330 327 24 Cosine 0.796 81.079 81 0.7192 0 330 520 24 Cosine 0.7192 -30.046 -30 0.7942 0 879 766 8 Cosine 0.7942 -26.025 -26 0.8425 0 879 781 8 Cosine 0.8425 -14.016 -14 0.9117 0 879 893 8 Cosine 0.9117 -45.058 -45 0.8371 0 672 669 11 Cosine 0.8371 0.0 0 0.8415 0 672 687 11 Cosine 0.8415 18.01 18 0.7891 0 347 346 30 Cosine 0.7891 -0.0 0 0.8817 0 359 368 48 Cosine 0.8817 -0.0 0 0.7973 0 359 397 48 Cosine 0.7973 0.0 0 0.8382 0 359 409 48 Cosine 0.8382 1.007 1 0.8106 0 858 837 8 Cosine 0.8106 -0.0 0 0.9793 0 858 867 8 Cosine 0.9793 44.026 44 0.8607 0 787 783 36 Cosine 0.8607 103.044 103 0.7616 0 787 707 36 Cosine 0.7616 -21.117 -21 0.7959 0 787 228 36 Cosine 0.7959 376.152 376 0.8747 0 479 854 24 Cosine 0.8747 376.152 376 0.8701 0 479 864 24 Cosine 0.8701 394.163 394 0.9041 0 479 876 24 Cosine 0.9041 -27.995 -27 0.8985 0 418 422 20 Cosine 0.8985 13.979 13 0.7936 0 581 854 24 Cosine 0.7936 13.979 13 0.8076 0 581 864 24 Cosine 0.8076 -0.0 0 0.8877 0 543 567 52 Cosine 0.8877 -18.011 -18 0.9336 0 327 329 24 Cosine 0.9336 16.031 16 0.8548 0 327 574 24 Cosine 0.8548 16.031 16 0.8544 0 327 550 24 Cosine 0.8544 -14.016 -14 0.8441 0 327 244 24 Cosine 0.8441 0.0 0 0.9163 0 327 520 24 Cosine 0.9163 145.017 145 0.8735 0 172 171 42 Cosine 0.8735 0.0 0 0.9625 0 640 643 10 Cosine 0.9625 0.0 0 0.953 0 640 660 10 Cosine 0.953 -43.99 -43 0.7179 0 175 168 5 Cosine 0.7179 15.995 15 0.7686 0 175 177 5 Cosine 0.7686 109.017 109 0.7082 0 175 220 5 Cosine 0.7082 -44.026 -44 0.9272 0 663 716 3 Cosine 0.9272 -43.019 -43 0.8618 0 663 682 3 Cosine 0.8618 2.015 2 0.8703 0 574 244 24 Cosine 0.8703 16.031 16 0.8566 0 574 520 24 Cosine 0.8566 -0.0 0 0.9946 0 574 550 24 Cosine 0.9946 -30.011 -30 0.9217 0 495 532 28 Cosine 0.9217 -75.069 -75 0.7606 0 495 530 28 Cosine 0.7606 -195.177 -195 0.7478 0 314 256 15 Cosine 0.7478 -181.161 -181 0.803 0 314 257 15 Cosine 0.803 -197.156 -197 0.7623 0 314 294 15 Cosine 0.7623 0.0 0 0.8008 0 765 834 89 Cosine 0.8008 -27.995 -27 0.7615 0 168 177 5 Cosine 0.7615 2.015 2 0.9419 0 767 766 8 Cosine 0.9419 20.026 20 0.7543 0 767 693 8 Cosine 0.7543 18.01 18 0.7374 0 767 701 8 Cosine 0.7374 -6.037 -6 0.807 0 767 781 8 Cosine 0.807 -68.024 -68 0.732 0 767 795 8 Cosine 0.732 -66.008 -66 0.7706 0 795 766 8 Cosine 0.7706 -342.182 -342 0.7901 0 795 598 8 Cosine 0.7901 -372.193 -372 0.8283 0 795 517 8 Cosine 0.8283 -14.015 -14 0.8201 0 134 235 40 Cosine 0.8201 15.995 15 0.9561 0 134 161 40 Cosine 0.9561 -29.008 -29 0.7921 0 134 124 40 Cosine 0.7921 15.994 15 0.8382 0 758 817 18 Cosine 0.8382 34.005 34 0.7877 0 758 838 18 Cosine 0.7877 -28.01 -28 0.7892 0 300 59 39 Cosine 0.7892 -45.037 -45 0.7473 0 300 52 39 Cosine 0.7473 -14.016 -14 0.953 0 256 257 15 Cosine 0.953 1.979 1 0.7919 0 256 294 15 Cosine 0.7919 176.069 176 0.7363 0 256 301 15 Cosine 0.7363 146.058 146 0.754 0 256 324 15 Cosine 0.754 34.042 34 0.7123 0 220 106 5 Cosine 0.7123 34.042 34 0.7062 0 220 99 5 Cosine 0.7062 15.995 15 0.8317 0 294 257 15 Cosine 0.8317 -1.006 -1 0.9042 0 896 843 3 Cosine 0.9042 -17.001 -17 0.8938 0 896 844 3 Cosine 0.8938 0.0 0 0.9733 0 896 845 3 Cosine 0.9733 1.003 1 0.8011 0 422 425 20 Cosine 0.8011 2.015 2 0.8674 0 550 244 24 Cosine 0.8674 16.031 16 0.8545 0 550 520 24 Cosine 0.8545 -28.031 -28 0.9177 0 816 715 8 Cosine 0.9177 -28.031 -28 0.9217 0 816 742 8 Cosine 0.9217 -238.229 -238 0.7237 0 790 614 18 Cosine 0.7237 8.008 8 0.8116 0 2 28 62 Cosine 0.8116 -27.995 -27 0.8386 0 2 1 62 Cosine 0.8386 45.058 45 0.9467 0 530 532 28 Cosine 0.9467 142.111 142 0.7189 0 530 533 28 Cosine 0.7189 60.859 60 0.9458 0 398 382 2 Cosine 0.9458 -2.016 -2 0.9674 0 398 378 2 Cosine 0.9674 -101.974 -101 0.9521 0 398 467 2 Cosine 0.9521 -75.008 -75 0.7727 0 563 517 8 Cosine 0.7727 -515.228 -515 0.7109 0 319 318 55 Cosine 0.7109 -30.011 -30 0.9026 0 598 517 8 Cosine 0.9026 -15.995 -15 0.8803 0 235 227 40 Cosine 0.8803 -0.0 0 0.933 0 99 106 5 Cosine 0.933 46.006 46 0.775 0 99 88 5 Cosine 0.775 -0.0 0 0.7867 0 536 447 4 Cosine 0.7867 0.0 0 0.8365 0 536 492 4 Cosine 0.8365 -30.01 -30 0.7157 0 536 502 4 Cosine 0.7157 -45.058 -45 0.9356 0 372 371 6 Cosine 0.9356 -1.001 -1 0.8193 0 18 17 5 Cosine 0.8193 -14.016 -14 0.8572 0 260 286 15 Cosine 0.8572 -28.031 -28 0.887 0 700 794 8 Cosine 0.887 -179.08 -179 0.8845 0 590 616 18 Cosine 0.8845 -258.199 -258 0.79 0 590 826 18 Cosine 0.79 43.99 43 0.8686 0 98 93 51 Cosine 0.8686 151.001 151 0.7559 0 98 102 51 Cosine 0.7559 97.053 97 0.7699 0 532 533 28 Cosine 0.7699 1.007 1 0.8162 0 867 837 8 Cosine 0.8162 0.0 0 0.8365 0 368 397 48 Cosine 0.8365 0.0 0 0.8561 0 368 409 48 Cosine 0.8561 15.995 15 0.9082 0 750 824 3 Cosine 0.9082 -0.0 0 0.9859 0 750 727 3 Cosine 0.9859 0.001 0 0.976 0 750 725 3 Cosine 0.976 -14.016 -14 0.8749 0 246 329 24 Cosine 0.8749 -18.011 -18 0.884 0 246 244 24 Cosine 0.884 197.09 197 0.8641 0 246 245 24 Cosine 0.8641 0.0 0 0.9724 0 613 852 3 Cosine 0.9724 0.0 0 0.9271 0 613 819 3 Cosine 0.9271 0.0 0 0.8722 0 613 830 3 Cosine 0.8722 0.0 0 0.9324 0 613 623 3 Cosine 0.9324 0.0 0 0.9586 0 613 804 3 Cosine 0.9586 -28.032 -28 0.9474 0 721 654 58 Cosine 0.9474 213.085 213 0.8853 0 826 817 18 Cosine 0.8853 0.0 0 0.9666 0 742 715 8 Cosine 0.9666 30.01 30 0.7348 0 284 301 15 Cosine 0.7348 -14.016 -14 0.9205 0 284 286 15 Cosine 0.9205 -0.0 0 0.9229 0 188 259 69 Cosine 0.9229 15.995 15 0.9397 0 503 400 2 Cosine 0.9397 15.995 15 0.9497 0 503 463 2 Cosine 0.9497 14.016 14 0.9083 0 202 196 40 Cosine 0.9083 0.0 0 0.9617 0 202 270 40 Cosine 0.9617 -215.101 -215 0.795 0 245 244 24 Cosine 0.795 -15.995 -15 0.9384 0 161 163 40 Cosine 0.9384 -14.016 -14 0.9355 0 161 227 40 Cosine 0.9355 194.991 194 0.7337 0 93 102 51 Cosine 0.7337 0.0 0 0.9498 0 800 772 21 Cosine 0.9498 -147.032 -147 0.954 0 467 400 2 Cosine 0.954 -147.032 -147 0.9576 0 467 463 2 Cosine 0.9576 -103.99 -103 0.9809 0 467 378 2 Cosine 0.9809 -44.026 -44 0.7658 0 476 486 24 Cosine 0.7658 -27.995 -27 0.7486 0 476 528 24 Cosine 0.7486 -48.021 -48 0.7413 0 476 854 24 Cosine 0.7413 -48.021 -48 0.7576 0 476 864 24 Cosine 0.7576 -30.011 -30 0.7658 0 476 876 24 Cosine 0.7658 15.995 15 0.9047 0 727 824 3 Cosine 0.9047 0.001 0 0.9749 0 727 725 3 Cosine 0.9749 144.042 144 0.7649 0 44 52 39 Cosine 0.7649 -12.01 -12 0.8407 0 781 810 8 Cosine 0.8407 -4.022 -4 0.8325 0 781 766 8 Cosine 0.8325 11.973 11 0.7863 0 781 701 8 Cosine 0.7863 13.989 13 0.8211 0 781 693 8 Cosine 0.8211 1.979 1 0.8676 0 227 163 40 Cosine 0.8676 -27.029 -27 0.827 0 227 124 40 Cosine 0.827 -306.184 -306 0.7626 0 517 766 8 Cosine 0.7626 0.0 0 0.9398 0 623 852 3 Cosine 0.9398 -0.0 0 0.9228 0 623 819 3 Cosine 0.9228 0.0 0 0.9085 0 623 830 3 Cosine 0.9085 0.0 0 0.9453 0 623 804 3 Cosine 0.9453 46.006 46 0.7445 0 88 106 5 Cosine 0.7445 -1.007 -1 0.8845 0 682 716 3 Cosine 0.8845 43.042 43 0.933 0 400 378 2 Cosine 0.933 0.0 0 0.9817 0 400 463 2 Cosine 0.9817 15.995 15 0.8914 0 843 844 3 Cosine 0.8914 -1.007 -1 0.9164 0 843 845 3 Cosine 0.9164 18.011 18 0.8771 0 520 329 24 Cosine 0.8771 -14.016 -14 0.8114 0 520 244 24 Cosine 0.8114 -86.073 -86 0.8132 0 740 817 18 Cosine 0.8132 -17.026 -17 0.9147 0 740 737 18 Cosine 0.9147 -68.063 -68 0.8284 0 740 838 18 Cosine 0.8284 18.011 18 0.8136 0 817 838 18 Cosine 0.8136 18.01 18 0.929 0 864 876 24 Cosine 0.929 -0.0 0 0.9686 0 864 854 24 Cosine 0.9686 0.0 0 0.9584 0 852 804 3 Cosine 0.9584 0.0 0 0.9502 0 852 819 3 Cosine 0.9502 0.0 0 0.8983 0 852 830 3 Cosine 0.8983 14.016 14 0.9097 0 270 196 40 Cosine 0.9097 -28.03 -28 0.9238 0 893 810 8 Cosine 0.9238 -17.026 -17 0.8893 0 59 52 39 Cosine 0.8893 0.0 0 0.974 0 355 282 34 Cosine 0.974 0.0 0 0.9729 0 355 377 34 Cosine 0.9729 2.016 2 0.8418 0 355 459 34 Cosine 0.8418 -0.0 0 0.9283 0 804 819 3 Cosine 0.9283 -0.0 0 0.8937 0 804 830 3 Cosine 0.8937 18.01 18 0.8049 0 766 693 8 Cosine 0.8049 15.995 15 0.7432 0 766 701 8 Cosine 0.7432 -18.025 -18 0.8953 0 471 470 24 Cosine 0.8953 160.074 160 0.7663 0 257 324 15 Cosine 0.7663 190.084 190 0.7431 0 257 301 15 Cosine 0.7431 -29.008 -29 0.8024 0 124 163 40 Cosine 0.8024 -2.016 -2 0.775 0 528 876 24 Cosine 0.775 16.031 16 0.7043 0 528 486 24 Cosine 0.7043 13.979 13 0.9153 0 794 880 8 Cosine 0.9153 -238.229 -238 0.8033 0 789 615 23 Cosine 0.8033 25.003 25 0.9312 0 789 731 23 Cosine 0.9312 1.003 1 0.9455 0 789 788 23 Cosine 0.9455 -18.01 -18 0.7899 0 19 17 5 Cosine 0.7899 18.01 18 0.914 0 876 854 24 Cosine 0.914 15.995 15 0.8925 0 824 725 3 Cosine 0.8925 -30.01 -30 0.9548 0 301 324 15 Cosine 0.9548 2.016 2 0.7562 0 701 693 8 Cosine 0.7562 0.0 0 0.9192 0 819 830 3 Cosine 0.9192 -82.003 -82 0.7456 0 693 718 8 Cosine 0.7456 -2.016 -2 0.7215 0 473 459 34 Cosine 0.7215 -263.232 -263 0.7576 0 615 731 23 Cosine 0.7576 -239.232 -239 0.7556 0 615 788 23 Cosine 0.7556 -65.143 -65 0.7988 0 228 783 36 Cosine 0.7988 -124.162 -124 0.8674 0 228 707 36 Cosine 0.8674 43.042 43 0.9291 0 463 378 2 Cosine 0.9291 -62.875 -62 0.9339 0 378 382 2 Cosine 0.9339 2.016 2 0.8346 0 459 282 34 Cosine 0.8346 2.016 2 0.8352 0 459 377 34 Cosine 0.8352 0.0 0 0.9696 0 377 282 34 Cosine 0.9696 24.0 24 0.9732 0 788 731 23 Cosine 0.9732 59.018 59 0.7499 0 707 783 36 Cosine 0.7499 24.0 24 0.793 0 638 614 18 Cosine 0.793 0.0 0 0.9377 0 397 409 48 Cosine 0.9377 0.0 0 0.8892 0 643 660 10 Cosine 0.8892 -14.016 -14 0.8757 0 185 196 40 Cosine 0.8757 nf_output/BERKELEY-LAB.mgf.tsv0000644000000000000000000000000114664572140014703 0ustar rootroot nf_output/GNPS-NIH-NATURALPRODUCTSLIBRARY.mgf.tsv0000644000000000000000000000000114664572140017605 0ustar rootroot nf_output/BILELIB19.mgf.tsv0000644000000000000000000000000114664572141014322 0ustar rootroot nf_output/library_intermediate/0000755000000000000000000000000014664574406016015 5ustar rootrootnf_output/library_intermediate/merged_results.tsv0000644000000000000000000026425614664574406021616 0ustar rootroot#Scan# SpectrumFile Annotation OrigAnnotation Protein dbIndex numMods matchOrientation startMass Charge MQScore p-value isDecoy StrictEnvelopeScore UnstrictEvelopeScore CompoundName Organism FileScanUniqueID FDR LibraryName mzErrorPPM LibMetaData Smiles Inchi LibSearchSharedPeaks Abundance ParentMassDiff SpecMZ ExactMass LibrarySpectrumID 462 spectra_filtered.mgf *..* :27261 48242 -1 0 318.134 1 0.998567 0 0 515.198 35860000.0 Piplartine [M+H]+ MONA temp/spectra_filtered.mgf462 -1 MONA.mgf 305069.0 9 0 97.0528 221.081 0 CCMSLIB00004720842 508 spectra_filtered.mgf *..* :27261 48242 -1 0 318.134 1 0.998483 0 0 515.198 19350000.0 Piplartine [M+H]+ MONA temp/spectra_filtered.mgf508 -1 MONA.mgf 305069.0 9 0 97.0528 221.081 0 CCMSLIB00004720842 351 spectra_filtered.mgf *..* :27261 48242 -1 0 318.134 1 0.997876 0 0 515.198 3540600.0 Piplartine [M+H]+ MONA temp/spectra_filtered.mgf351 -1 MONA.mgf 305069.0 9 0 97.0528 221.081 0 CCMSLIB00004720842 334 spectra_filtered.mgf *..* :42902 54901 -1 0 296.164 1 0.99588 0 0 1234980.0 22788900.0 Massbank:NA002903 (-)-Nuciferine|Nuciferine|(6aR)-1,2-dimethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline M+H MASSBANK temp/spectra_filtered.mgf334 -1 MASSBANK.mgf 47320.4 6 0 14.0146 282.149 0 CCMSLIB00005768453 555 spectra_filtered.mgf *..* :36051 48050 -1 0 286.144 1 0.995327 0 0 30973100.0 11481000.0 Massbank:LU109603 Piperine|(2E,4E)-5-(1,3-benzodioxol-5-yl)-1-piperidin-1-ylpenta-2,4-dien-1-one M+H MASSBANK temp/spectra_filtered.mgf555 -1 MASSBANK.mgf 0.639907 12 0 0.000183105 286.144 0 CCMSLIB00005761602 378 spectra_filtered.mgf *..* :3824 4270 -1 0 318.134 1 0.993382 0 0 19136400.0 58349200.0 Piperlongumine CollisionEnergy:102040 M+H BERKELEY-LAB temp/spectra_filtered.mgf378 -1 BERKELEY-LAB.mgf 141631.0 7 0 45.0577 363.192 0 CCMSLIB00010106258 59 spectra_filtered.mgf *..* :15039 33502 -1 0 522.203 1 0.991533 0 0 305.497 29635900.0 Melezitose [M+NH4]+ MONA temp/spectra_filtered.mgf59 -1 MONA.mgf 310325.0 8 0 162.053 360.15 0 CCMSLIB00004706102 206 spectra_filtered.mgf *..* :2049 47236 -1 0 291.086 1 0.991504 0 0 227.859 39385000.0 Catechin [M+H]+ MONA temp/spectra_filtered.mgf206 -1 MONA.mgf 2.72585 14 0 0.000793457 291.087 0 CCMSLIB00004719836 156 spectra_filtered.mgf *..* :760 3988 -1 0 355.102 1 0.988831 0 0 168477000.0 5859300.0 Chlorogenic acid M+H GNPS-LIBRARY temp/spectra_filtered.mgf156 -1 GNPS-LIBRARY.mgf 1.11722 9 0 0.000396729 355.102 0 CCMSLIB00004684185 398 spectra_filtered.mgf *..* :3824 4270 -1 0 318.134 1 0.98733 0 0 19136400.0 2492300.0 Piperlongumine CollisionEnergy:102040 M+H BERKELEY-LAB temp/spectra_filtered.mgf398 -1 BERKELEY-LAB.mgf 147967.0 6 0 47.0733 365.207 0 CCMSLIB00010106258 360 spectra_filtered.mgf *..* :96485 96485 -1 0 566.208 1 0.987162 0 0 240.056 77450500.0 Sibiricose A6 [M+NH4]+ MSNLIB-POSITIVE temp/spectra_filtered.mgf360 -1 MSNLIB-POSITIVE.mgf 462886.0 7 0 262.09 304.118 0 CCMSLIB00012447737 372 spectra_filtered.mgf *..* :4359 4805 -1 0 326.139 1 0.986752 0 0 7214400.0 7562800.0 (2E)-N-(3-acetylphenyl)-3-(3,4-dimethoxyphenyl)prop-2-enamide CollisionEnergy:102040 M+H BERKELEY-LAB temp/spectra_filtered.mgf372 -1 BERKELEY-LAB.mgf 21593.2 6 0 7.04239 333.181 0 CCMSLIB00010106793 49 spectra_filtered.mgf *..* :183 3979 -1 0 343.123 1 0.985903 0 0 14011600.0 12909300.0 Spectral Match to 4-O-.beta.-Galactopyranosyl-D-mannopyranose from NIST14 M+H GNPS-NIST14-MATCHES temp/spectra_filtered.mgf49 -1 GNPS-NIST14-MATCHES.mgf 521913.0 11 0 179.08 522.203 0 CCMSLIB00003138466 467 spectra_filtered.mgf *..* :3824 4270 -1 0 318.134 1 0.984531 0 0 19136400.0 19702100.0 Piperlongumine CollisionEnergy:102040 M+H BERKELEY-LAB temp/spectra_filtered.mgf467 -1 BERKELEY-LAB.mgf 468506.0 6 0 149.048 467.182 0 CCMSLIB00010106258 41 spectra_filtered.mgf *..* :33656 33656 -1 0 203.15 1 0.984293 0 0 254.472 27165000.0 N,N-dimethylarginine [M+H]+ MSNLIB-POSITIVE temp/spectra_filtered.mgf41 -1 MSNLIB-POSITIVE.mgf 2.47866 8 0 0.00050354 203.15 0 CCMSLIB00012335082 233 spectra_filtered.mgf *..* :662 13903 -1 0 330.17 1 0.983845 0 0 2050850000.0 6193600.0 Reticuline M+H GNPS-LIBRARY temp/spectra_filtered.mgf233 -1 GNPS-LIBRARY.mgf 2.03346 16 0 0.000671387 330.171 0 CCMSLIB00012060262 416 spectra_filtered.mgf *..* :8498 8944 -1 0 209.081 1 0.983003 0 0 15637700.0 12404900.0 3,4-DIMETHOXYCINNAMIC ACID CollisionEnergy:102040 M+H BERKELEY-LAB temp/spectra_filtered.mgf416 -1 BERKELEY-LAB.mgf 387688.0 8 0 81.0582 290.139 0 CCMSLIB00010110932 132 spectra_filtered.mgf *..* :473 3141 -1 0 205.097 1 0.982914 0 0 101686.0 43531000.0 Spectral Match to L-Tryptophan from NIST14 M+H GNPS-NIST14-MATCHES temp/spectra_filtered.mgf132 -1 GNPS-NIST14-MATCHES.mgf 2.45513 7 0 0.00050354 205.098 0 CCMSLIB00003137628 222 spectra_filtered.mgf *..* :94707 94707 -1 0 387.201 1 0.982606 0 0 194.589 3860000.0 3,5,5-Trimethyl-4beta-hydroxy-4-[3-(beta-D-glucopyranosyloxy)-1-butenyl]-2-cyclohexene-1-one [M+H]+ MSNLIB-POSITIVE temp/spectra_filtered.mgf222 -1 MSNLIB-POSITIVE.mgf 465037.0 9 0 180.063 207.138 0 CCMSLIB00012445959 606 spectra_filtered.mgf *..* :755 1201 -1 0 731.606 1 0.981796 0 0 33576000.0 23024500.0 Sphingomyelin (d18:1/18:0) CollisionEnergy:102040 M BERKELEY-LAB temp/spectra_filtered.mgf606 -1 BERKELEY-LAB.mgf 288770.0 8 0 211.266 520.34 0 CCMSLIB00010103189 371 spectra_filtered.mgf *..* :8498 8944 -1 0 209.081 1 0.981794 0 0 15637700.0 37269400.0 3,4-DIMETHOXYCINNAMIC ACID CollisionEnergy:102040 M+H BERKELEY-LAB temp/spectra_filtered.mgf371 -1 BERKELEY-LAB.mgf 378048.0 9 0 79.0426 288.124 0 CCMSLIB00010110932 406 spectra_filtered.mgf *..* :94495 94495 -1 0 716.276 1 0.980689 0 0 162.813 196507000.0 NCGC00384692-01 [M+NH4]+ MSNLIB-POSITIVE temp/spectra_filtered.mgf406 -1 MSNLIB-POSITIVE.mgf 597748.0 8 0 428.152 288.124 0 CCMSLIB00012445747 501 spectra_filtered.mgf *..* :8498 8944 -1 0 209.081 1 0.979989 0 0 15637700.0 5372000.0 3,4-DIMETHOXYCINNAMIC ACID CollisionEnergy:102040 M+H BERKELEY-LAB temp/spectra_filtered.mgf501 -1 BERKELEY-LAB.mgf 378047.0 9 0 79.0425 288.124 0 CCMSLIB00010110932 46 spectra_filtered.mgf *..* :5288 5288 -1 0 258.11 1 0.977899 0 0 252243000.0 26381100.0 L-alpha-Glycerylphosphorylcholine - 40.0 eV M+H BIRMINGHAM-UHPLC-MS-POS temp/spectra_filtered.mgf46 -1 BIRMINGHAM-UHPLC-MS-POS.mgf 0.827643 10 0 0.000213623 258.11 0 CCMSLIB00006121557 789 spectra_filtered.mgf *..* :8144 2056 -1 0 786.599 1 0.977086 0 0 3596160.0 49208700.0 Spectral Match to 1-Stearoyl-2-linoleoyl-sn-glycero-3-phosphocholine from NIST14 M+H GNPS-NIST14-MATCHES temp/spectra_filtered.mgf789 -1 GNPS-NIST14-MATCHES.mgf 35633.8 6 0 28.0295 758.57 0 CCMSLIB00003136543 594 spectra_filtered.mgf *..* :755 1201 -1 0 731.606 1 0.976975 0 0 33576000.0 4683300.0 Sphingomyelin (d18:1/18:0) CollisionEnergy:102040 M BERKELEY-LAB temp/spectra_filtered.mgf594 -1 BERKELEY-LAB.mgf 291525.0 8 0 213.281 518.325 0 CCMSLIB00010103189 535 spectra_filtered.mgf *..* :27261 48242 -1 0 318.134 1 0.975429 0 0 515.198 2729000.0 Piplartine [M+H]+ MONA temp/spectra_filtered.mgf535 -1 MONA.mgf 305069.0 8 0 97.0529 221.081 0 CCMSLIB00004720842 757 spectra_filtered.mgf *..* :8781 2530 -1 0 729.59 1 0.975046 0 0 3187030.0 96810900.0 Spectral Match to N-Oleoyl-D-erythro-sphingosylphosphorylcholine from NIST14 M+H GNPS-NIST14-MATCHES temp/spectra_filtered.mgf757 -1 GNPS-NIST14-MATCHES.mgf 69852.6 6 0 50.9637 780.554 0 CCMSLIB00003137017 337 spectra_filtered.mgf *..* :5160 7186 -1 0 314.139 1 0.974384 0 0 802700.0 34412400.0 NCGC00169550-02!(E)-3-(4-hydroxy-3-methoxyphenyl)-N-[2-(4-hydroxyphenyl)ethyl]prop-2-enamide [IIN-based: Match] [M+H]+ GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE temp/spectra_filtered.mgf337 -1 GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE.mgf 0.58288 9 0 0.000183105 314.139 0 CCMSLIB00005722482 788 spectra_filtered.mgf *..* :2543 3301 -1 0 760.585 1 0.974338 0 0 1091760.0 2801600.0 Spectral Match to 1-Oleoyl-2-palmitoyl-sn-glycero-3-phosphocholine from NIST14 M+H GNPS-NIST14-MATCHES temp/spectra_filtered.mgf788 -1 GNPS-NIST14-MATCHES.mgf 1330.59 7 0 1.01202 759.573 0 CCMSLIB00003137788 386 spectra_filtered.mgf *..* :27261 48242 -1 0 318.134 1 0.973917 0 0 515.198 84800000.0 Piplartine [M+H]+ MONA temp/spectra_filtered.mgf386 -1 MONA.mgf 305069.0 8 0 97.0529 221.081 0 CCMSLIB00004720842 615 spectra_filtered.mgf *..* :2489 5545 -1 0 496.339 1 0.973817 0 0 1695730.0 5124400.0 Spectral Match to Lyso-PC(16:0) from NIST14 M+H GNPS-NIST14-MATCHES temp/spectra_filtered.mgf615 -1 GNPS-NIST14-MATCHES.mgf 48357.1 11 0 24.0015 520.341 0 CCMSLIB00003140032 445 spectra_filtered.mgf *..* :27261 48242 -1 0 318.134 1 0.973791 0 0 515.198 1249000000.0 Piplartine [M+H]+ MONA temp/spectra_filtered.mgf445 -1 MONA.mgf 305070.0 8 0 97.053 221.081 0 CCMSLIB00004720842 519 spectra_filtered.mgf *..* :41254 53253 -1 0 302.305 1 0.973185 0 0 21056000.0 4372400.0 Massbank:LU100203 2,2'-(Tetradecylimino)diethanol|Tetradecyldiethanolamine M+H MASSBANK temp/spectra_filtered.mgf519 -1 MASSBANK.mgf 92722.8 9 0 28.0306 274.274 0 CCMSLIB00005766805 356 spectra_filtered.mgf *..* :7977 8423 -1 0 403.132 1 0.971912 0 0 10043100.0 6809300.0 (2E)-N-{[(4-methoxyphenyl)amino]thioxomethyl}-3-(3,4,5-trimethoxyphenyl)prop-2 -enamide CollisionEnergy:102040 M+H BERKELEY-LAB temp/spectra_filtered.mgf356 -1 BERKELEY-LAB.mgf 158881.0 7 0 64.0499 467.182 0 CCMSLIB00010110411 387 spectra_filtered.mgf *..* :27260 48241 -1 0 318.134 1 0.971754 0 0 274.903 457519000.0 Piplartine [M+H]+ MONA temp/spectra_filtered.mgf387 -1 MONA.mgf 0.575561 7 0 0.000183105 318.134 0 CCMSLIB00004720841 427 spectra_filtered.mgf *..* :27259 48240 -1 0 318.134 1 0.971734 0 0 146.572 2992800.0 Piplartine [M+H]+ MONA temp/spectra_filtered.mgf427 -1 MONA.mgf 87886.9 8 0 27.9598 346.094 0 CCMSLIB00004720840 452 spectra_filtered.mgf *..* :27260 48241 -1 0 318.134 1 0.971726 0 0 274.903 7631750000.0 Piplartine [M+H]+ MONA temp/spectra_filtered.mgf452 -1 MONA.mgf 0.575561 7 0 0.000183105 318.134 0 CCMSLIB00004720841 534 spectra_filtered.mgf *..* :27260 48241 -1 0 318.134 1 0.97046 0 0 274.903 18116600.0 Piplartine [M+H]+ MONA temp/spectra_filtered.mgf534 -1 MONA.mgf 0.28778 7 0 9.15527e-05 318.134 0 CCMSLIB00004720841 146 spectra_filtered.mgf *..* :97333 97333 -1 0 672.25 1 0.970287 0 0 130.378 3295900.0 Saccatoside [M+NH4]+ MSNLIB-POSITIVE temp/spectra_filtered.mgf146 -1 MSNLIB-POSITIVE.mgf 495617.0 6 0 333.179 339.071 0 CCMSLIB00012448585 300 spectra_filtered.mgf *..* :9016 27479 -1 0 432.186 1 0.970123 0 0 397.089 1501000.0 3-oxo-3-[[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(4-hydroxy-5-methyl-2-propan-2-ylphenoxy)oxan-2-yl]methoxy]propanoic acid [M+NH4]+ MONA temp/spectra_filtered.mgf300 -1 MONA.mgf 101866.0 10 0 44.0251 388.161 0 CCMSLIB00004700079 408 spectra_filtered.mgf *..* :96485 96485 -1 0 566.208 1 0.969968 0 0 240.056 4728400.0 Sibiricose A6 [M+NH4]+ MSNLIB-POSITIVE temp/spectra_filtered.mgf408 -1 MSNLIB-POSITIVE.mgf 462886.0 7 0 262.09 304.118 0 CCMSLIB00012447737 511 spectra_filtered.mgf *..* :27260 48241 -1 0 318.134 1 0.969703 0 0 274.903 101423000.0 Piplartine [M+H]+ MONA temp/spectra_filtered.mgf511 -1 MONA.mgf 0.28778 7 0 9.15527e-05 318.134 0 CCMSLIB00004720841 400 spectra_filtered.mgf *..* :27260 48241 -1 0 318.134 1 0.968293 0 0 274.903 10167500.0 Piplartine [M+H]+ MONA temp/spectra_filtered.mgf400 -1 MONA.mgf 6336.64 7 0 2.0159 320.15 0 CCMSLIB00004720841 463 spectra_filtered.mgf *..* :27260 48241 -1 0 318.134 1 0.96828 0 0 274.903 177915000.0 Piplartine [M+H]+ MONA temp/spectra_filtered.mgf463 -1 MONA.mgf 6335.97 7 0 2.01569 320.15 0 CCMSLIB00004720841 154 spectra_filtered.mgf *..* :15706 15706 -1 0 351.137 1 0.967859 0 0 106.76 2381700.0 PF-9366 [M+H]+ MSNLIB-POSITIVE temp/spectra_filtered.mgf154 -1 MSNLIB-POSITIVE.mgf 150917.0 6 0 52.9926 298.144 0 CCMSLIB00012294315 42 spectra_filtered.mgf *..* :45620 45620 -1 0 487.166 1 0.966504 0 0 416.54 12684300.0 Manninotriose [M+H-H2O]+ MSNLIB-POSITIVE temp/spectra_filtered.mgf42 -1 MSNLIB-POSITIVE.mgf 404565.0 6 0 197.09 684.256 0 CCMSLIB00012359145 352 spectra_filtered.mgf *..* :27260 48241 -1 0 318.134 1 0.966173 0 0 274.903 20161900.0 Piplartine [M+H]+ MONA temp/spectra_filtered.mgf352 -1 MONA.mgf 50277.8 6 0 15.9951 334.129 0 CCMSLIB00004720841 128 spectra_filtered.mgf *..* :97333 97333 -1 0 672.25 1 0.965577 0 0 130.378 4904600.0 Saccatoside [M+NH4]+ MSNLIB-POSITIVE temp/spectra_filtered.mgf128 -1 MSNLIB-POSITIVE.mgf 443498.0 6 0 298.141 374.109 0 CCMSLIB00012448585 608 spectra_filtered.mgf *..* :4558 5483 -1 0 307.262 1 0.964801 0 0 480367.0 6509700.0 Spectral Match to cis-5,8,11-Eicosatrienoic acid from NIST14 M+H GNPS-NIST14-MATCHES temp/spectra_filtered.mgf608 -1 GNPS-NIST14-MATCHES.mgf 149732.0 12 0 46.0069 353.269 0 CCMSLIB00003139970 731 spectra_filtered.mgf *..* :2543 3301 -1 0 760.585 1 0.96232 0 0 1091760.0 4009400.0 Spectral Match to 1-Oleoyl-2-palmitoyl-sn-glycero-3-phosphocholine from NIST14 M+H GNPS-NIST14-MATCHES temp/spectra_filtered.mgf731 -1 GNPS-NIST14-MATCHES.mgf 30223.9 7 0 22.9879 783.573 0 CCMSLIB00003137788 631 spectra_filtered.mgf *..* :20521 20967 -1 0 205.195 1 0.96212 0 0 5833410.0 24254000.0 Bisabolol CollisionEnergy:205060 M+H-H2O BERKELEY-LAB temp/spectra_filtered.mgf631 -1 BERKELEY-LAB.mgf 1.93342 7 0 0.000396729 205.195 0 CCMSLIB00010122956 53 spectra_filtered.mgf *..* :38211 38211 -1 0 684.256 1 0.961768 0 0 314.022 4427700.0 Stachyose [M+NH4]+ MSNLIB-POSITIVE temp/spectra_filtered.mgf53 -1 MSNLIB-POSITIVE.mgf 524866.0 8 0 359.142 325.113 0 CCMSLIB00012344200 660 spectra_filtered.mgf *..* :20521 20967 -1 0 205.195 1 0.96168 0 0 5833410.0 153400000.0 Bisabolol CollisionEnergy:205060 M+H-H2O BERKELEY-LAB temp/spectra_filtered.mgf660 -1 BERKELEY-LAB.mgf 1.93342 7 0 0.000396729 205.195 0 CCMSLIB00010122956 680 spectra_filtered.mgf *..* :20521 20967 -1 0 205.195 1 0.961633 0 0 5833410.0 52170000.0 Bisabolol CollisionEnergy:205060 M+H-H2O BERKELEY-LAB temp/spectra_filtered.mgf680 -1 BERKELEY-LAB.mgf 1.93342 7 0 0.000396729 205.195 0 CCMSLIB00010122956 590 spectra_filtered.mgf *..* :4558 5483 -1 0 307.262 1 0.960558 0 0 480367.0 2659400.0 Spectral Match to cis-5,8,11-Eicosatrienoic acid from NIST14 M+H GNPS-NIST14-MATCHES temp/spectra_filtered.mgf590 -1 GNPS-NIST14-MATCHES.mgf 149732.0 12 0 46.0069 353.269 0 CCMSLIB00003139970 667 spectra_filtered.mgf *..* :20521 20967 -1 0 205.195 1 0.959926 0 0 5833410.0 116670000.0 Bisabolol CollisionEnergy:205060 M+H-H2O BERKELEY-LAB temp/spectra_filtered.mgf667 -1 BERKELEY-LAB.mgf 1.93342 7 0 0.000396729 205.195 0 CCMSLIB00010122956 639 spectra_filtered.mgf *..* :2749 3352 -1 0 524.37 1 0.958658 0 0 1240120.0 2612300.0 Spectral Match to 1-Stearoyl-2-hydroxy-sn-glycero-3-phosphocholine from NIST14 M+H GNPS-NIST14-MATCHES temp/spectra_filtered.mgf639 -1 GNPS-NIST14-MATCHES.mgf 53453.6 10 0 28.0295 496.341 0 CCMSLIB00003137839 51 spectra_filtered.mgf *..* :155 155 -1 0 261.037 1 0.956976 0 0 3265370.0 1644500.0 Cori ester (alpha-anomer) - 40.0 eV M+H BIRMINGHAM-UHPLC-MS-POS temp/spectra_filtered.mgf51 -1 BIRMINGHAM-UHPLC-MS-POS.mgf 0.467636 7 0 0.00012207 261.037 0 CCMSLIB00006113011 347 spectra_filtered.mgf *..* :1757 281 -1 0 229.122 1 0.956791 0 0 4700850.0 1449000.0 abscisic acid CollisionEnergy:205060 M-2H2O+H BERKELEY-LAB temp/spectra_filtered.mgf347 -1 BERKELEY-LAB.mgf 3.06345 10 0 0.000701904 229.123 0 CCMSLIB00010102268 279 spectra_filtered.mgf *..* :1 4655 -1 0 268.129 1 0.956613 0 0 88152.2 14264900.0 Asimilobine M+H GNPS-LIBRARY temp/spectra_filtered.mgf279 -1 GNPS-LIBRARY.mgf 16.8449 6 0 0.0045166 268.134 0 CCMSLIB00005436078 188 spectra_filtered.mgf *..* :580 1750 -1 0 579.15 1 0.956027 0 0 217499.0 26402500.0 Spectral Match to Procyanidin B2 from NIST14 M+H GNPS-NIST14-MATCHES temp/spectra_filtered.mgf188 -1 GNPS-NIST14-MATCHES.mgf 0.632325 13 0 0.000366211 579.15 0 CCMSLIB00003136237 868 spectra_filtered.mgf *..* :20521 20967 -1 0 205.195 1 0.955838 0 0 5833410.0 12755000.0 Bisabolol CollisionEnergy:205060 M+H-H2O BERKELEY-LAB temp/spectra_filtered.mgf868 -1 BERKELEY-LAB.mgf 1.93342 7 0 0.000396729 205.195 0 CCMSLIB00010122956 202 spectra_filtered.mgf *..* :558 7451 -1 0 286.144 1 0.955722 0 0 188588000.0 102200000.0 1-[(4-hydroxyphenyl)methyl]-6-methoxy-1,2,3,4-tetrahydroisoquinolin-7-ol M+H GNPS-LIBRARY temp/spectra_filtered.mgf202 -1 GNPS-LIBRARY.mgf 0.95986 11 0 0.000274658 286.144 0 CCMSLIB00005724962 190 spectra_filtered.mgf *..* :1 4624 -1 0 286.144 1 0.954755 0 0 123857.0 5582400.0 Coclaurine M+H GNPS-LIBRARY temp/spectra_filtered.mgf190 -1 GNPS-LIBRARY.mgf 48981.3 12 0 14.0157 272.128 0 CCMSLIB00005436045 45 spectra_filtered.mgf *..* :131 131 -1 0 343.124 1 0.954748 0 0 1680600.0 1369300.0 beta-Lactose - 40.0 eV M+H BIRMINGHAM-UHPLC-MS-POS temp/spectra_filtered.mgf45 -1 BIRMINGHAM-UHPLC-MS-POS.mgf 472286.0 10 0 162.053 505.177 0 CCMSLIB00006112954 640 spectra_filtered.mgf *..* :20521 20967 -1 0 205.195 1 0.95438 0 0 5833410.0 1819000.0 Bisabolol CollisionEnergy:205060 M+H-H2O BERKELEY-LAB temp/spectra_filtered.mgf640 -1 BERKELEY-LAB.mgf 1.93342 7 0 0.000396729 205.195 0 CCMSLIB00010122956 270 spectra_filtered.mgf *..* :1 4624 -1 0 286.144 1 0.953892 0 0 123857.0 67868000.0 Coclaurine M+H GNPS-LIBRARY temp/spectra_filtered.mgf270 -1 GNPS-LIBRARY.mgf 0.639907 12 0 0.000183105 286.144 0 CCMSLIB00005436045 40 spectra_filtered.mgf *..* :97690 97690 -1 0 289.092 1 0.950988 0 0 110.372 5610600.0 Dianthoside [M+H]+ MSNLIB-POSITIVE temp/spectra_filtered.mgf40 -1 MSNLIB-POSITIVE.mgf 162541.0 6 0 46.9894 242.103 0 CCMSLIB00012448942 654 spectra_filtered.mgf *..* :6002 24465 -1 0 252.232 1 0.950973 0 0 405.157 13220000.0 (2E,4E)-N-(2-methylpropyl)dodeca-2,4-dienamide [M+H]+ MONA temp/spectra_filtered.mgf654 -1 MONA.mgf 1.63337 9 0 0.000411987 252.232 0 CCMSLIB00004697065 243 spectra_filtered.mgf *..* :1 4626 -1 0 328.192 1 0.948365 0 0 565264.0 440000000.0 O-methylarmepavine M+H GNPS-LIBRARY temp/spectra_filtered.mgf243 -1 GNPS-LIBRARY.mgf 42707.9 12 0 14.0164 314.176 0 CCMSLIB00005436047 130 spectra_filtered.mgf *..* :85146 85146 -1 0 272.12 1 0.948173 0 0 1896.0 8217000.0 Higenamine [M+H]+ BMDMS-NP temp/spectra_filtered.mgf130 -1 BMDMS-NP.mgf 31.2892 9 0 0.0085144 272.129 0 CCMSLIB00006439446 517 spectra_filtered.mgf *..* :55594 55594 -1 0 285.08 1 0.948111 0 0 1082.0 14212000.0 5-hydroxy-2-(4-hydroxyphenyl)-7-methoxy-4H-chromen-4-one [M+H]+ BMDMS-NP temp/spectra_filtered.mgf517 -1 BMDMS-NP.mgf 13.2741 10 0 0.00378418 285.076 0 CCMSLIB00006409894 424 spectra_filtered.mgf *..* :27259 48240 -1 0 318.134 1 0.947025 0 0 146.572 2112200.0 Piplartine [M+H]+ MONA temp/spectra_filtered.mgf424 -1 MONA.mgf 84742.6 7 0 26.9595 345.094 0 CCMSLIB00004720840 597 spectra_filtered.mgf *..* :16609 17055 -1 0 285.076 1 0.946771 0 0 4644200.0 11333000.0 acacetin CollisionEnergy:205060 M+H BERKELEY-LAB temp/spectra_filtered.mgf597 -1 BERKELEY-LAB.mgf 49165.9 8 0 14.016 299.092 0 CCMSLIB00010119044 239 spectra_filtered.mgf *..* :5160 7186 -1 0 314.139 1 0.946482 0 0 802700.0 39927000.0 NCGC00169550-02!(E)-3-(4-hydroxy-3-methoxyphenyl)-N-[2-(4-hydroxyphenyl)ethyl]prop-2-enamide [IIN-based: Match] [M+H]+ GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE temp/spectra_filtered.mgf239 -1 GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE.mgf 146334.0 6 0 45.9691 360.108 0 CCMSLIB00005722482 201 spectra_filtered.mgf *..* :85139 85139 -1 0 269.16 1 0.946062 0 0 1498.0 1543500.0 sophocarpine [M+Na]+ BMDMS-NP temp/spectra_filtered.mgf201 -1 BMDMS-NP.mgf 158.28 9 0 0.0426025 269.117 0 CCMSLIB00006439439 158 spectra_filtered.mgf *..* :16424 16424 -1 0 296.139 1 0.94381 0 0 109.448 13218200.0 PJ34 [M+H]+ MSNLIB-POSITIVE temp/spectra_filtered.mgf158 -1 MSNLIB-POSITIVE.mgf 101306.0 6 0 30.0006 326.14 0 CCMSLIB00012296728 82 spectra_filtered.mgf *..* :614 167 -1 0 154.09 1 0.943155 0 0 4602370.0 34635000.0 DOPAMINE M+H GNPS-EMBL-MCF temp/spectra_filtered.mgf82 -1 GNPS-EMBL-MCF.mgf 1324050.0 6 0 204.023 358.113 0 CCMSLIB00000577949 52 spectra_filtered.mgf *..* :38211 38211 -1 0 684.256 1 0.942893 0 0 314.022 1528600.0 Stachyose [M+NH4]+ MSNLIB-POSITIVE temp/spectra_filtered.mgf52 -1 MSNLIB-POSITIVE.mgf 498545.0 8 0 341.132 343.124 0 CCMSLIB00012344200 753 spectra_filtered.mgf *..* :53 1766 -1 0 157.158 1 0.942362 0 0 231995.0 3818000.0 Spectral Match to .beta.-Citronellol from NIST14 M+H GNPS-NIST14-MATCHES temp/spectra_filtered.mgf753 -1 GNPS-NIST14-MATCHES.mgf 796152.0 6 0 125.122 282.28 0 CCMSLIB00003136253 365 spectra_filtered.mgf *..* :9745 7750 -1 0 307.165 1 0.941574 0 0 9086500.0 2378700.0 NCGC00170014-03!(E)-N-(4-acetamidobutyl)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enamide [IIN-based: Match] [M+H]+ GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE temp/spectra_filtered.mgf365 -1 GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE.mgf 146569.0 7 0 45.0209 262.144 0 CCMSLIB00005723046 646 spectra_filtered.mgf *..* :20521 20967 -1 0 205.195 1 0.941517 0 0 5833410.0 57300000.0 Bisabolol CollisionEnergy:205060 M+H-H2O BERKELEY-LAB temp/spectra_filtered.mgf646 -1 BERKELEY-LAB.mgf 1.93342 7 0 0.000396729 205.195 0 CCMSLIB00010122956 231 spectra_filtered.mgf *..* :1 12023 -1 0 611.161 1 0.939945 0 0 616672.0 1789700.0 Rutin M+H GNPS-LIBRARY temp/spectra_filtered.mgf231 -1 GNPS-LIBRARY.mgf 216052.0 8 0 132.042 743.203 0 CCMSLIB00010012048 151 spectra_filtered.mgf *..* :9091 27554 -1 0 450.197 1 0.93989 0 0 513.367 3060000.0 (2R,3S,4S,5R,6R)-5-[(2S,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy-2-(hydroxymethyl)-6-[2-(4-hydroxyphenyl)ethoxy]oxane-3,4-diol [M+NH4]+ MONA temp/spectra_filtered.mgf151 -1 MONA.mgf 1.83025 13 0 0.000823975 450.198 0 CCMSLIB00004700154 249 spectra_filtered.mgf *..* :88171 88171 -1 0 595.166 1 0.93977 0 0 118.919 4273100.0 17353-03-6 [M+H]+ MSNLIB-POSITIVE temp/spectra_filtered.mgf249 -1 MSNLIB-POSITIVE.mgf 221857.0 8 0 132.042 727.208 0 CCMSLIB00012439423 505 spectra_filtered.mgf *..* :519 324 -1 0 318.134 1 0.939493 0 0 324737000.0 25922000.0 PIPERLONGUMINE M+H LEAFBOT temp/spectra_filtered.mgf505 -1 LEAFBOT.mgf 1138460.0 6 0 362.184 680.318 0 CCMSLIB00011428096 820 spectra_filtered.mgf *..* :8781 2530 -1 0 729.59 1 0.937547 0 0 3187030.0 3109100.0 Spectral Match to N-Oleoyl-D-erythro-sphingosylphosphorylcholine from NIST14 M+H GNPS-NIST14-MATCHES temp/spectra_filtered.mgf820 -1 GNPS-NIST14-MATCHES.mgf 69852.5 6 0 50.9637 780.554 0 CCMSLIB00003137017 140 spectra_filtered.mgf *..* :2788 3234 -1 0 273.076 1 0.937538 0 0 6031590.0 13405900.0 naringenin CollisionEnergy:102040 M+H BERKELEY-LAB temp/spectra_filtered.mgf140 -1 BERKELEY-LAB.mgf 95268.7 8 0 26.0156 247.06 0 CCMSLIB00010105222 152 spectra_filtered.mgf *..* :1708 179 -1 0 195.065 1 0.937481 0 0 17421400.0 49399000.0 Ferulic acid M+H TUEBINGEN-NATURAL-PRODUCT-COLLECTION temp/spectra_filtered.mgf152 -1 TUEBINGEN-NATURAL-PRODUCT-COLLECTION.mgf 359316.0 6 0 70.0899 265.155 0 CCMSLIB00011906145 99 spectra_filtered.mgf *..* :8427 8873 -1 0 204.102 1 0.936357 0 0 7598040.0 14576300.0 Indole-3-butyric acid CollisionEnergy:102040 M+H BERKELEY-LAB temp/spectra_filtered.mgf99 -1 BERKELEY-LAB.mgf 156736.0 6 0 31.9901 236.092 0 CCMSLIB00010110861 131 spectra_filtered.mgf *..* :11087 29550 -1 0 318.155 1 0.936346 0 0 252.091 2341700.0 Salidroside [M+NH4]+ MONA temp/spectra_filtered.mgf131 -1 MONA.mgf 0.959205 9 0 0.000305176 318.155 0 CCMSLIB00004702150 266 spectra_filtered.mgf *..* :1 4624 -1 0 286.144 1 0.935882 0 0 123857.0 21220000.0 Coclaurine M+H GNPS-LIBRARY temp/spectra_filtered.mgf266 -1 GNPS-LIBRARY.mgf 48982.0 11 0 14.0159 300.16 0 CCMSLIB00005436045 396 spectra_filtered.mgf *..* :96485 96485 -1 0 566.208 1 0.935855 0 0 240.056 102639000.0 Sibiricose A6 [M+NH4]+ MSNLIB-POSITIVE temp/spectra_filtered.mgf396 -1 MSNLIB-POSITIVE.mgf 487575.0 7 0 276.069 290.139 0 CCMSLIB00012447737 200 spectra_filtered.mgf *..* :558 7451 -1 0 286.144 1 0.93475 0 0 188588000.0 2909300.0 1-[(4-hydroxyphenyl)methyl]-6-methoxy-1,2,3,4-tetrahydroisoquinolin-7-ol M+H GNPS-LIBRARY temp/spectra_filtered.mgf200 -1 GNPS-LIBRARY.mgf 279428.0 10 0 79.9567 366.101 0 CCMSLIB00005724962 458 spectra_filtered.mgf *..* :3824 4270 -1 0 318.134 1 0.934674 0 0 19136400.0 20382300.0 Piperlongumine CollisionEnergy:102040 M+H BERKELEY-LAB temp/spectra_filtered.mgf458 -1 BERKELEY-LAB.mgf 37605.2 7 0 11.9635 306.171 0 CCMSLIB00010106258 115 spectra_filtered.mgf *..* :3476 54600 -1 0 220.118 1 0.933371 0 0 281.1 5360000.0 PANTOTHENIC ACID M+H MONA temp/spectra_filtered.mgf115 -1 MONA.mgf 1.80234 9 0 0.000396729 220.118 0 CCMSLIB00006683629 339 spectra_filtered.mgf *..* :5160 7186 -1 0 314.139 1 0.93323 0 0 802700.0 14593000.0 NCGC00169550-02!(E)-3-(4-hydroxy-3-methoxyphenyl)-N-[2-(4-hydroxyphenyl)ethyl]prop-2-enamide [IIN-based: Match] [M+H]+ GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE temp/spectra_filtered.mgf339 -1 GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE.mgf 95533.1 7 0 30.0107 344.15 0 CCMSLIB00005722482 649 spectra_filtered.mgf *..* :6669 6669 -1 0 205.195 1 0.933158 0 0 88320700.0 5760000.0 (.+/-.)-trans-Nerolidol - 40.0 eV Unknown BIRMINGHAM-UHPLC-MS-POS temp/spectra_filtered.mgf649 -1 BIRMINGHAM-UHPLC-MS-POS.mgf 1.93342 9 0 0.000396729 205.195 0 CCMSLIB00006124013 369 spectra_filtered.mgf *..* :96485 96485 -1 0 566.208 1 0.932911 0 0 240.056 11245500.0 Sibiricose A6 [M+NH4]+ MSNLIB-POSITIVE temp/spectra_filtered.mgf369 -1 MSNLIB-POSITIVE.mgf 462885.0 6 0 262.089 304.119 0 CCMSLIB00012447737 133 spectra_filtered.mgf *..* :26473 26473 -1 0 272.128 1 0.932097 0 0 216.057 1695200.0 Higenamine [M+H]+ MSNLIB-POSITIVE temp/spectra_filtered.mgf133 -1 MSNLIB-POSITIVE.mgf 51506.7 9 0 14.0164 286.144 0 CCMSLIB00012320438 150 spectra_filtered.mgf *..* :17285 35748 -1 0 328.118 1 0.931531 0 0 137.935 2178400.0 (2S)-3-(4-hydroxyphenyl)-2-[[(Z)-3-(4-hydroxyphenyl)prop-2-enoyl]amino]propanoic acid [M+H]+ MONA temp/spectra_filtered.mgf150 -1 MONA.mgf 88272.8 6 0 28.9639 357.082 0 CCMSLIB00004708348 618 spectra_filtered.mgf *..* :4422 5197 -1 0 219.21 1 0.931461 0 0 153482.0 1628000.0 Spectral Match to Methyl hexadecanoate from NIST14 219.2 GNPS-NIST14-MATCHES temp/spectra_filtered.mgf618 -1 GNPS-NIST14-MATCHES.mgf 73128.1 7 0 16.0304 203.18 0 CCMSLIB00003139684 116 spectra_filtered.mgf *..* :11087 29550 -1 0 318.155 1 0.931135 0 0 252.091 4873200.0 Salidroside [M+NH4]+ MONA temp/spectra_filtered.mgf116 -1 MONA.mgf 0.959205 8 0 0.000305176 318.155 0 CCMSLIB00004702150 503 spectra_filtered.mgf *..* :27260 48241 -1 0 318.134 1 0.930858 0 0 274.903 31664000.0 Piplartine [M+H]+ MONA temp/spectra_filtered.mgf503 -1 MONA.mgf 43941.3 7 0 13.9792 304.155 0 CCMSLIB00004720841 13 spectra_filtered.mgf *..* :1 657 -1 0 353.03 1 0.930464 0 0 421766.0 594600.0 Thelephoric acid [M+H] LDB_POSITIVE temp/spectra_filtered.mgf13 -1 LDB_POSITIVE.mgf 374043.0 7 0 132.048 220.982 0 CCMSLIB00005720085 226 spectra_filtered.mgf *..* :26897 47878 -1 0 475.192 1 0.928291 0 0 181.533 628200.0 Amygdalin [M+NH4]+ MONA temp/spectra_filtered.mgf226 -1 MONA.mgf 269463.0 6 0 128.047 347.145 0 CCMSLIB00004720478 198 spectra_filtered.mgf *..* :51312 51312 -1 0 284.13 1 0.928231 0 0 1935.0 2876300.0 Paprazine [M+H]+ BMDMS-NP temp/spectra_filtered.mgf198 -1 BMDMS-NP.mgf 35273.3 6 0 10.0222 274.108 0 CCMSLIB00006405612 652 spectra_filtered.mgf *..* :3441 4352 -1 0 257.211 1 0.927748 0 0 426301.0 2329600.0 Spectral Match to Monolaurin from NIST14 M+H-H2O GNPS-NIST14-MATCHES temp/spectra_filtered.mgf652 -1 GNPS-NIST14-MATCHES.mgf 217965.0 7 0 56.0631 313.274 0 CCMSLIB00003138839 177 spectra_filtered.mgf *..* :1 657 -1 0 353.03 1 0.924457 0 0 421766.0 4706700.0 Thelephoric acid [M+H] LDB_POSITIVE temp/spectra_filtered.mgf177 -1 LDB_POSITIVE.mgf 164173.0 7 0 57.9581 295.072 0 CCMSLIB00005720085 394 spectra_filtered.mgf *..* :18223 15860 -1 0 260.128 1 0.924126 0 0 135.044 10551200.0 ILEPCIMIDE [M+H]+ CMMC-REFRAME-POSITIVE-LIBRARY temp/spectra_filtered.mgf394 -1 CMMC-REFRAME-POSITIVE-LIBRARY.mgf 315253.0 6 0 82.006 342.134 0 CCMSLIB00012270173 172 spectra_filtered.mgf *..* :856 9151 -1 0 184.06 1 0.923386 0 0 2670060.0 6870500.0 4-PYRIDOXATE - 60.0 eV M+H GNPS-LIBRARY temp/spectra_filtered.mgf172 -1 GNPS-LIBRARY.mgf 614080.0 8 0 113.027 297.087 0 CCMSLIB00005884009 453 spectra_filtered.mgf *..* :27259 48240 -1 0 318.134 1 0.923274 0 0 146.572 930300.0 Piplartine [M+H]+ MONA temp/spectra_filtered.mgf453 -1 MONA.mgf 595743.0 7 0 189.526 507.66 0 CCMSLIB00004720840 359 spectra_filtered.mgf *..* :22232 22678 -1 0 207.065 1 0.923115 0 0 5684720.0 17480000.0 SINAPIC ACID CollisionEnergy:205060 M+H-H2O BERKELEY-LAB temp/spectra_filtered.mgf359 -1 BERKELEY-LAB.mgf 2.4318 8 0 0.00050354 207.066 0 CCMSLIB00010124668 637 spectra_filtered.mgf *..* :92992 92992 -1 0 368.28 1 0.922607 0 0 438.735 21156000.0 5-(5-methoxycarbonyl-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl)-3-methylpentanoic acid [M+NH4]+ MSNLIB-POSITIVE temp/spectra_filtered.mgf637 -1 MSNLIB-POSITIVE.mgf 442828.0 8 0 163.085 205.195 0 CCMSLIB00012444244 185 spectra_filtered.mgf *..* :1 4625 -1 0 300.16 1 0.922056 0 0 126573.0 2818600.0 N-methylcoclaurine M+H GNPS-LIBRARY temp/spectra_filtered.mgf185 -1 GNPS-LIBRARY.mgf 46694.5 10 0 14.0158 286.144 0 CCMSLIB00005436046 214 spectra_filtered.mgf *..* :91316 91316 -1 0 683.26 1 0.920742 0 0 3198.0 7320000.0 Matairesinol 4'-O-beta-gentiobioside [M+H]+ BMDMS-NP temp/spectra_filtered.mgf214 -1 BMDMS-NP.mgf 519722.0 8 0 355.105 328.155 0 CCMSLIB00006445616 411 spectra_filtered.mgf *..* :2738 3184 -1 0 250.099 1 0.919127 0 0 3821010.0 2904700.0 (2E)-3-(4-chlorophenyl)-1-piperidylprop-2-en-1-one CollisionEnergy:102040 M+H BERKELEY-LAB temp/spectra_filtered.mgf411 -1 BERKELEY-LAB.mgf 104202.0 6 0 26.0609 276.16 0 CCMSLIB00010105172 127 spectra_filtered.mgf *..* :704 906 -1 0 298.09 1 0.916755 0 0 4180990.0 1688000.0 Spectral Match to Adenosine, 5'-S-methyl-5'-thio- from NIST14 M+H GNPS-NIST14-MATCHES temp/spectra_filtered.mgf127 -1 GNPS-NIST14-MATCHES.mgf 26.2085 6 0 0.0078125 298.098 0 CCMSLIB00003135392 859 spectra_filtered.mgf *..* :1814 10720 -1 0 893.539 1 0.915403 0 0 174769000.0 32600700.0 Chlorophyll a M+H GNPS-LIBRARY temp/spectra_filtered.mgf859 -1 GNPS-LIBRARY.mgf 24583.6 9 0 21.9664 871.573 0 CCMSLIB00006678134 837 spectra_filtered.mgf *..* :1814 10720 -1 0 893.539 1 0.915281 0 0 174769000.0 18936600.0 Chlorophyll a M+H GNPS-LIBRARY temp/spectra_filtered.mgf837 -1 GNPS-LIBRARY.mgf 24583.3 8 0 21.9661 871.573 0 CCMSLIB00006678134 364 spectra_filtered.mgf *..* :96485 96485 -1 0 566.208 1 0.914882 0 0 240.056 8533400.0 Sibiricose A6 [M+NH4]+ MSNLIB-POSITIVE temp/spectra_filtered.mgf364 -1 MSNLIB-POSITIVE.mgf 484015.0 6 0 274.053 292.155 0 CCMSLIB00012447737 199 spectra_filtered.mgf *..* :4939 23402 -1 0 595.166 1 0.914225 0 0 558.826 5502200.0 apigenin 6,8-digalactoside [M+H]+ MONA temp/spectra_filtered.mgf199 -1 MONA.mgf 0.307654 19 0 0.000183105 595.166 0 CCMSLIB00004696002 524 spectra_filtered.mgf *..* :1 36 -1 0 303.09 1 0.913163 0 0 447208.0 1592500.0 5-hydroxy-1,2,3-trimethoxyxanthone M-H XANTHONES-DB temp/spectra_filtered.mgf524 -1 XANTHONES-DB.mgf 168292.0 8 0 51.0075 354.098 0 CCMSLIB00011429077 258 spectra_filtered.mgf *..* :507 373 -1 0 771.234 1 0.911914 0 0 96350000.0 2043600.0 TYPHANEOSIDE M+H LEAFBOT temp/spectra_filtered.mgf258 -1 LEAFBOT.mgf 18172.0 7 0 14.0149 757.219 0 CCMSLIB00011428145 706 spectra_filtered.mgf *..* :82001 82001 -1 0 702.442 1 0.909653 0 0 602.622 3112600.0 CHEBI:181245 [M+NH4]+ MSNLIB-POSITIVE temp/spectra_filtered.mgf706 -1 MSNLIB-POSITIVE.mgf 465766.0 8 0 327.173 375.269 0 CCMSLIB00012432214 9 spectra_filtered.mgf *..* :61184 61184 -1 0 303.01 1 0.909027 0 0 3450.0 11543000.0 2,3,7,8-tetrahydroxychromeno[5,4,3-cde]chromene-5,10-dione [M+H]+ BMDMS-NP temp/spectra_filtered.mgf9 -1 BMDMS-NP.mgf 277304.0 7 0 84.026 218.984 0 CCMSLIB00006415484 350 spectra_filtered.mgf *..* :87055 87055 -1 0 685.276 1 0.90844 0 0 361.997 3114100.0 C38H40N2O10 [M+H]+ MSNLIB-POSITIVE temp/spectra_filtered.mgf350 -1 MSNLIB-POSITIVE.mgf 1.15786 14 0 0.000793457 685.277 0 CCMSLIB00012438307 254 spectra_filtered.mgf *..* :35660 35660 -1 0 314.175 1 0.906803 0 0 225.204 26810000.0 Armepavine [M+H]+ MSNLIB-POSITIVE temp/spectra_filtered.mgf254 -1 MSNLIB-POSITIVE.mgf 44609.1 12 0 14.0151 300.16 0 CCMSLIB00012339100 204 spectra_filtered.mgf *..* :1 4628 -1 0 314.175 1 0.904785 0 0 92953.4 4395300.0 N,O-dimethylcoclaurine M+H GNPS-LIBRARY temp/spectra_filtered.mgf204 -1 GNPS-LIBRARY.mgf 44608.8 11 0 14.015 300.16 0 CCMSLIB00005436049 683 spectra_filtered.mgf *..* :92247 92247 -1 0 684.432 1 0.904573 0 0 536.649 4300000.0 NCGC00380456-01 [M+NH4]+ MSNLIB-POSITIVE temp/spectra_filtered.mgf683 -1 MSNLIB-POSITIVE.mgf 425394.0 8 0 291.153 393.279 0 CCMSLIB00012443499 399 spectra_filtered.mgf *..* :27261 48242 -1 0 318.134 1 0.904561 0 0 515.198 2276300.0 Piplartine [M+H]+ MONA temp/spectra_filtered.mgf399 -1 MONA.mgf 305069.0 9 0 97.0529 221.081 0 CCMSLIB00004720842 616 spectra_filtered.mgf *..* :2997 3931 -1 0 353.269 1 0.904184 0 0 538621.0 1028400.0 Spectral Match to Monolinolenin (9c,12c,15c) from NIST14 M+H GNPS-NIST14-MATCHES temp/spectra_filtered.mgf616 -1 GNPS-NIST14-MATCHES.mgf 506921.0 11 0 179.08 532.349 0 CCMSLIB00003138418 196 spectra_filtered.mgf *..* :1 4628 -1 0 314.175 1 0.903156 0 0 92953.4 46690000.0 N,O-dimethylcoclaurine M+H GNPS-LIBRARY temp/spectra_filtered.mgf196 -1 GNPS-LIBRARY.mgf 44609.1 11 0 14.0151 300.16 0 CCMSLIB00005436049 716 spectra_filtered.mgf *..* :22686 41149 -1 0 1108.55 1 0.903106 0 0 684.218 1767300.0 (2S,3S,4S,5R,6R)-6-[[(3S,4S,6aR,6bS,8R,8aR,9R,10R,12aS,14bR)-10-acetyloxy-8a-(acetyloxymethyl)-8,9-dihydroxy-4-(hydroxymethyl)-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-4-hydroxy-3,5-bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]oxane-2-carboxylic acid [M+NH4]+ MONA temp/spectra_filtered.mgf716 -1 MONA.mgf 645231.0 10 0 715.271 393.279 0 CCMSLIB00004713749 50 spectra_filtered.mgf *..* :44393 44393 -1 0 489.281 1 0.900615 0 0 275.619 8075100.0 DUPA(OtBu)-OH [M+H]+ MSNLIB-POSITIVE temp/spectra_filtered.mgf50 -1 MSNLIB-POSITIVE.mgf 1831.25 6 0 0.895996 490.177 0 CCMSLIB00012356682 65 spectra_filtered.mgf *..* :1604 9899 -1 0 163.108 1 0.899804 0 0 475976.0 8404000.0 DL-5-HYDROXYLYSINE - 60.0 eV M+H GNPS-LIBRARY temp/spectra_filtered.mgf65 -1 GNPS-LIBRARY.mgf 257563.0 6 0 42.0106 205.119 0 CCMSLIB00005884757 559 spectra_filtered.mgf *..* :1 5648 -1 0 315.086 1 0.898518 0 0 1096840.0 12016900.0 KU036-6-1 M+H GNPS-LIBRARY temp/spectra_filtered.mgf559 -1 GNPS-LIBRARY.mgf 15798.9 6 0 4.978 310.108 0 CCMSLIB00005716555 336 spectra_filtered.mgf *..* :52391 52391 -1 0 314.14 1 0.898444 0 0 4145.0 9885600.0 Moupinamide [M+H]+ BMDMS-NP temp/spectra_filtered.mgf336 -1 BMDMS-NP.mgf 95529.6 8 0 30.0097 344.15 0 CCMSLIB00006406691 866 spectra_filtered.mgf *..* :1814 10720 -1 0 893.539 1 0.898189 0 0 174769000.0 20895200.0 Chlorophyll a M+H GNPS-LIBRARY temp/spectra_filtered.mgf866 -1 GNPS-LIBRARY.mgf 24583.8 9 0 21.9666 871.572 0 CCMSLIB00006678134 732 spectra_filtered.mgf *..* :7997 7997 -1 0 834.54 1 0.8964 0 0 12200600.0 43989200.0 SQDG(16:0/18:3); [M+NH4]+ C43H80N1O12S1 M+NH4 PNNL-LIPIDS-POSITIVE temp/spectra_filtered.mgf732 -1 PNNL-LIPIDS-POSITIVE.mgf 117539.0 16 0 98.0907 932.631 0 CCMSLIB00010069471 642 spectra_filtered.mgf *..* :4900 3988 -1 0 355.284 1 0.896089 0 0 827993.0 2014500.0 Spectral Match to 1-Linoleoylglycerol from NIST14 M+H GNPS-NIST14-MATCHES temp/spectra_filtered.mgf642 -1 GNPS-NIST14-MATCHES.mgf 504048.0 12 0 179.08 534.364 0 CCMSLIB00003138475 602 spectra_filtered.mgf *..* :4194 450 -1 0 355.284 1 0.893951 0 0 20954300.0 1379900.0 Spectral Match to 1-Linoleoylglycerol from NIST14 M+H GNPS-NIST14-MATCHES temp/spectra_filtered.mgf602 -1 GNPS-NIST14-MATCHES.mgf 960170.0 12 0 341.133 696.417 0 CCMSLIB00003134936 721 spectra_filtered.mgf *..* :6002 24465 -1 0 252.232 1 0.892912 0 0 405.157 2751000.0 (2E,4E)-N-(2-methylpropyl)dodeca-2,4-dienamide [M+H]+ MONA temp/spectra_filtered.mgf721 -1 MONA.mgf 111136.0 9 0 28.0321 280.264 0 CCMSLIB00004697065 787 spectra_filtered.mgf *..* :1744 1925 -1 0 415.25 1 0.892869 0 0 10525700.0 392900.0 Spectral Match to Nonaethylene glycol from NIST14 M+H GNPS-NIST14-MATCHES temp/spectra_filtered.mgf787 -1 GNPS-NIST14-MATCHES.mgf 91868.2 8 0 38.1483 453.398 0 CCMSLIB00003136412 647 spectra_filtered.mgf *..* :2824 4240 -1 0 279.158 1 0.891581 0 0 371546.0 3864200.0 Spectral Match to Dibutyl phthalate from NIST14 M+H GNPS-NIST14-MATCHES temp/spectra_filtered.mgf647 -1 GNPS-NIST14-MATCHES.mgf 6.12193 6 0 0.00170898 279.16 0 CCMSLIB00003138727 444 spectra_filtered.mgf *..* :19315 19761 -1 0 403.132 2 0.890942 0 0 5882960.0 7068200.0 (2E)-N-{[(4-methoxyphenyl)amino]thioxomethyl}-3-(3,4,5-trimethoxyphenyl)prop-2 -enamide CollisionEnergy:205060 M+H BERKELEY-LAB temp/spectra_filtered.mgf444 -1 BERKELEY-LAB.mgf 124069.0 6 0 302.092 353.116 0 CCMSLIB00010121750 759 spectra_filtered.mgf *..* :3 12340 -1 0 609.272 1 0.88828 0 0 96450000.0 51338400.0 3.10S-Hydroxypheophorbide a M+H GNPS-LIBRARY temp/spectra_filtered.mgf759 -1 GNPS-LIBRARY.mgf 0.901595 15 0 0.000549316 609.271 0 CCMSLIB00010128701 225 spectra_filtered.mgf *..* :25127 43590 -1 0 343.225 1 0.887698 0 0 281.533 103725000.0 Spegatrine [M+NH4]+ MONA temp/spectra_filtered.mgf225 -1 MONA.mgf 3072.07 9 0 1.05441 342.171 0 CCMSLIB00004716190 448 spectra_filtered.mgf *..* :27259 48240 -1 0 318.134 1 0.88767 0 0 146.572 73663900.0 Piplartine [M+H]+ MONA temp/spectra_filtered.mgf448 -1 MONA.mgf 586304.0 8 0 186.523 504.657 0 CCMSLIB00004720840 197 spectra_filtered.mgf *..* :93010 93010 -1 0 608.234 1 0.886724 0 0 369.445 28328700.0 NCGC00347814-02 [M+H]+ MSNLIB-POSITIVE temp/spectra_filtered.mgf197 -1 MSNLIB-POSITIVE.mgf 286160.0 12 0 174.053 434.181 0 CCMSLIB00012444262 461 spectra_filtered.mgf *..* :1 5648 -1 0 315.086 1 0.886504 0 0 1096840.0 2782300.0 KU036-6-1 M+H GNPS-LIBRARY temp/spectra_filtered.mgf461 -1 GNPS-LIBRARY.mgf 60281.0 6 0 18.9937 296.092 0 CCMSLIB00005716555 276 spectra_filtered.mgf *..* :1367 2521 -1 0 577.134 1 0.886413 0 0 95780.0 4864100.0 Spectral Match to Procyanidin A1 from NIST14 M+H GNPS-NIST14-MATCHES temp/spectra_filtered.mgf276 -1 GNPS-NIST14-MATCHES.mgf 1.79785 14 0 0.0010376 577.135 0 CCMSLIB00003137008 612 spectra_filtered.mgf *..* :2997 3931 -1 0 353.269 1 0.885971 0 0 538621.0 9931300.0 Spectral Match to Monolinolenin (9c,12c,15c) from NIST14 M+H GNPS-NIST14-MATCHES temp/spectra_filtered.mgf612 -1 GNPS-NIST14-MATCHES.mgf 506921.0 11 0 179.08 532.349 0 CCMSLIB00003138418 609 spectra_filtered.mgf *..* :96511 96511 -1 0 473.363 1 0.885693 0 0 670.327 1203300.0 NCGC00385237-01 [M+H]+ MSNLIB-POSITIVE temp/spectra_filtered.mgf609 -1 MSNLIB-POSITIVE.mgf 308708.0 9 0 146.131 327.232 0 CCMSLIB00012447763 227 spectra_filtered.mgf *..* :6244 6690 -1 0 372.217 1 0.885209 0 0 8912850.0 209750000.0 AC1L9EVY CollisionEnergy:102040 M BERKELEY-LAB temp/spectra_filtered.mgf227 -1 BERKELEY-LAB.mgf 118280.0 9 0 44.0257 328.191 0 CCMSLIB00010108678 713 spectra_filtered.mgf *..* :7446 6502 -1 0 600.468 1 0.883006 0 0 284.423 3818100.0 Polidocanol [M+NH4]+ CMMC-REFRAME-POSITIVE-LIBRARY temp/spectra_filtered.mgf713 -1 CMMC-REFRAME-POSITIVE-LIBRARY.mgf 293278.0 7 0 176.104 424.364 0 CCMSLIB00012254917 635 spectra_filtered.mgf *..* :2620 7140 -1 0 310.347 1 0.881647 0 0 75363200.0 1217500.0 (2R,6R)-2-methyl-6-pentadecylpiperidine M+H GNPS-LIBRARY temp/spectra_filtered.mgf635 -1 GNPS-LIBRARY.mgf 2937.13 6 0 0.91153 311.259 0 CCMSLIB00005724651 617 spectra_filtered.mgf *..* :4558 5483 -1 0 307.262 1 0.880219 0 0 480367.0 811100.0 Spectral Match to cis-5,8,11-Eicosatrienoic acid from NIST14 M+H GNPS-NIST14-MATCHES temp/spectra_filtered.mgf617 -1 GNPS-NIST14-MATCHES.mgf 149732.0 11 0 46.007 353.269 0 CCMSLIB00003139970 175 spectra_filtered.mgf *..* :16042 16042 -1 0 303.01 1 0.87888 0 0 2962.0 1844300.0 Ellagic acid [M+H]+ BMDMS-NP temp/spectra_filtered.mgf175 -1 BMDMS-NP.mgf 26589.5 6 0 8.05688 311.067 0 CCMSLIB00006370342 679 spectra_filtered.mgf *..* :22686 41149 -1 0 1108.55 1 0.878807 0 0 684.218 12386000.0 (2S,3S,4S,5R,6R)-6-[[(3S,4S,6aR,6bS,8R,8aR,9R,10R,12aS,14bR)-10-acetyloxy-8a-(acetyloxymethyl)-8,9-dihydroxy-4-(hydroxymethyl)-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-4-hydroxy-3,5-bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]oxane-2-carboxylic acid [M+NH4]+ MONA temp/spectra_filtered.mgf679 -1 MONA.mgf 661478.0 9 0 733.282 375.268 0 CCMSLIB00004713749 100 spectra_filtered.mgf *..* :1123 9418 -1 0 248.032 1 0.875217 0 0 753328.0 1608200.0 PYRIDOXAL 5'-PHOSPHATE - 30.0 eV M+H GNPS-LIBRARY temp/spectra_filtered.mgf100 -1 GNPS-LIBRARY.mgf 76868.7 6 0 19.0659 267.098 0 CCMSLIB00005884276 166 spectra_filtered.mgf *..* :23414 23860 -1 0 155.034 1 0.874911 0 0 2069610.0 6976000.0 patulin CollisionEnergy:205060 M+H BERKELEY-LAB temp/spectra_filtered.mgf166 -1 BERKELEY-LAB.mgf 354800.0 6 0 55.0061 210.04 0 CCMSLIB00010125850 741 spectra_filtered.mgf *..* :3 12340 -1 0 609.272 1 0.874499 0 0 96450000.0 17000700.0 3.10S-Hydroxypheophorbide a M+H GNPS-LIBRARY temp/spectra_filtered.mgf741 -1 GNPS-LIBRARY.mgf 1.3023 14 0 0.000793457 609.271 0 CCMSLIB00010128701 638 spectra_filtered.mgf *..* :3975 5202 -1 0 454.293 1 0.872298 0 0 5025040.0 560300.0 Spectral Match to 1-Palmitoyl-2-hydroxy-sn-glycero-3-phosphoethanolamine from NIST14 M+H GNPS-NIST14-MATCHES temp/spectra_filtered.mgf638 -1 GNPS-NIST14-MATCHES.mgf 1.07482 9 0 0.000488281 454.293 0 CCMSLIB00003139689 191 spectra_filtered.mgf *..* :6244 6690 -1 0 372.217 1 0.871727 0 0 8912850.0 2029200.0 AC1L9EVY CollisionEnergy:102040 M BERKELEY-LAB temp/spectra_filtered.mgf191 -1 BERKELEY-LAB.mgf 75308.0 10 0 28.0309 344.186 0 CCMSLIB00010108678 44 spectra_filtered.mgf *..* :131 131 -1 0 343.124 1 0.867827 0 0 1680600.0 760300.0 beta-Lactose - 40.0 eV M+H BIRMINGHAM-UHPLC-MS-POS temp/spectra_filtered.mgf44 -1 BIRMINGHAM-UHPLC-MS-POS.mgf 419797.0 10 0 144.042 487.166 0 CCMSLIB00006112954 73 spectra_filtered.mgf *..* :345 2142 -1 0 307.083 1 0.866322 0 0 876087.0 3232000.0 Spectral Match to Glutathione, oxidized from NIST14 M+2H GNPS-NIST14-MATCHES temp/spectra_filtered.mgf73 -1 GNPS-NIST14-MATCHES.mgf 97729.9 10 0 30.0112 337.094 0 CCMSLIB00003136629 783 spectra_filtered.mgf *..* :1744 1925 -1 0 415.25 1 0.866101 0 0 10525700.0 288800.0 Spectral Match to Nonaethylene glycol from NIST14 M+H GNPS-NIST14-MATCHES temp/spectra_filtered.mgf783 -1 GNPS-NIST14-MATCHES.mgf 197891.0 8 0 82.1744 497.424 0 CCMSLIB00003136412 485 spectra_filtered.mgf *..* :5401 5847 -1 0 327.159 1 0.865381 0 0 105868000.0 7353000.0 4-(methylethyl)phenyl (2E)-3-(2,4-dimethoxyphenyl)prop-2-enoate CollisionEnergy:102040 M+H BERKELEY-LAB temp/spectra_filtered.mgf485 -1 BERKELEY-LAB.mgf 162046.0 6 0 53.0148 274.144 0 CCMSLIB00010107835 117 spectra_filtered.mgf *..* :26897 47878 -1 0 475.192 1 0.865268 0 0 181.533 1087900.0 Amygdalin [M+NH4]+ MONA temp/spectra_filtered.mgf117 -1 MONA.mgf 301052.0 6 0 143.057 332.135 0 CCMSLIB00004720478 624 spectra_filtered.mgf *..* :92992 92992 -1 0 368.28 1 0.864559 0 0 438.735 9857000.0 5-(5-methoxycarbonyl-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl)-3-methylpentanoic acid [M+NH4]+ MSNLIB-POSITIVE temp/spectra_filtered.mgf624 -1 MSNLIB-POSITIVE.mgf 442828.0 8 0 163.085 205.195 0 CCMSLIB00012444244 781 spectra_filtered.mgf *..* :8149 1076 -1 0 593.269 1 0.864235 0 0 380848.0 12194000.0 Pheophorbide A M+H GNPS-LIBRARY temp/spectra_filtered.mgf781 -1 GNPS-LIBRARY.mgf 3393.48 9 0 2.01324 595.282 0 CCMSLIB00000076748 192 spectra_filtered.mgf *..* :360 1919 -1 0 545.165 1 0.864109 0 0 428484.0 2041900.0 NCGC00385009-01!(1S,3R,4R,5R)-1,3-dihydroxy-4,5-bis[[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxy]cyclohexane-1-carboxylic acid M+H GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE temp/spectra_filtered.mgf192 -1 GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE.mgf 487915.0 6 0 265.994 279.171 0 CCMSLIB00000848212 136 spectra_filtered.mgf *..* :14125 14571 -1 0 273.076 1 0.864072 0 0 6391160.0 1369500.0 naringenin CollisionEnergy:205060 M+H BERKELEY-LAB temp/spectra_filtered.mgf136 -1 BERKELEY-LAB.mgf 95268.7 6 0 26.0156 247.06 0 CCMSLIB00010116559 554 spectra_filtered.mgf *..* :2151 963 -1 0 390.191 1 0.862796 0 0 421095.0 16411200.0 Spectral Match to Arctigenin from NIST14 M+NH4 GNPS-NIST14-MATCHES temp/spectra_filtered.mgf554 -1 GNPS-NIST14-MATCHES.mgf 5163.94 11 0 2.01492 388.176 0 CCMSLIB00003135449 692 spectra_filtered.mgf *..* :8939 8939 -1 0 632.525 1 0.86262 0 0 1317540.0 29996600.0 DG(18:2/18:3/0:0); [M+NH4]+ C39H70N1O5 M+NH4 PNNL-LIPIDS-POSITIVE temp/spectra_filtered.mgf692 -1 PNNL-LIPIDS-POSITIVE.mgf 256201.0 18 0 162.053 794.578 0 CCMSLIB00010071406 293 spectra_filtered.mgf *..* :3824 4270 -1 0 318.134 1 0.862468 0 0 19136400.0 5392500.0 Piperlongumine CollisionEnergy:102040 M+H BERKELEY-LAB temp/spectra_filtered.mgf293 -1 BERKELEY-LAB.mgf 537791.0 6 0 171.09 489.224 0 CCMSLIB00010106258 430 spectra_filtered.mgf *..* :27259 48240 -1 0 318.134 1 0.862463 0 0 146.572 1600000.0 Piplartine [M+H]+ MONA temp/spectra_filtered.mgf430 -1 MONA.mgf 581594.0 6 0 185.025 503.159 0 CCMSLIB00004720840 552 spectra_filtered.mgf *..* :15313 27312 -1 0 373.165 1 0.861834 0 0 1563.0 18904000.0 Massbank:PR303923 Arctigenin M+H MASSBANK temp/spectra_filtered.mgf552 -1 MASSBANK.mgf 5402.74 9 0 2.01611 371.149 0 CCMSLIB00005740864 598 spectra_filtered.mgf *..* :1889 2335 -1 0 299.091 1 0.861048 0 0 260118.0 1002300.0 4',7-Dimethoxy-3-hydroxyflavone CollisionEnergy:102040 M+H BERKELEY-LAB temp/spectra_filtered.mgf598 -1 BERKELEY-LAB.mgf 53481.8 10 0 15.9959 315.087 0 CCMSLIB00010104323 707 spectra_filtered.mgf *..* :1744 1925 -1 0 415.25 1 0.860977 0 0 10525700.0 2802000.0 Spectral Match to Nonaethylene glycol from NIST14 M+H GNPS-NIST14-MATCHES temp/spectra_filtered.mgf707 -1 GNPS-NIST14-MATCHES.mgf 340018.0 6 0 141.193 556.443 0 CCMSLIB00003136412 865 spectra_filtered.mgf *..* :28033 28033 -1 0 269.117 1 0.860732 0 0 275.687 29487000.0 4,4'-Dimethoxychalcone [M+H]+ MSNLIB-POSITIVE temp/spectra_filtered.mgf865 -1 MSNLIB-POSITIVE.mgf 200698.0 6 0 54.0112 323.128 0 CCMSLIB00012323684 806 spectra_filtered.mgf *..* :12175 10721 -1 0 871.571 1 0.858291 0 0 71381000.0 4758500.0 Pheophytin a M+H GNPS-LIBRARY temp/spectra_filtered.mgf806 -1 GNPS-LIBRARY.mgf 126647.0 6 0 110.382 761.189 0 CCMSLIB00006678135 877 spectra_filtered.mgf *..* :89 1537 -1 0 663.45 1 0.857926 0 0 392.588 8969300.0 L-phenylalanine_dodecanoic acid [2M-3H2O+Na]+ CMMC-LIBRARY temp/spectra_filtered.mgf877 -1 CMMC-LIBRARY.mgf 6.80775 7 0 0.0045166 663.455 0 CCMSLIB00012472792 186 spectra_filtered.mgf *..* :1 4626 -1 0 328.192 1 0.85789 0 0 565264.0 149600000.0 O-methylarmepavine M+H GNPS-LIBRARY temp/spectra_filtered.mgf186 -1 GNPS-LIBRARY.mgf 42708.2 12 0 14.0165 314.176 0 CCMSLIB00005436047 335 spectra_filtered.mgf *..* :9016 27479 -1 0 432.186 1 0.857759 0 0 397.089 3719200.0 3-oxo-3-[[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(4-hydroxy-5-methyl-2-propan-2-ylphenoxy)oxan-2-yl]methoxy]propanoic acid [M+NH4]+ MONA temp/spectra_filtered.mgf335 -1 MONA.mgf 231422.0 9 0 100.017 532.203 0 CCMSLIB00004700079 235 spectra_filtered.mgf *..* :6244 6690 -1 0 372.217 1 0.8573 0 0 8912850.0 6607600.0 AC1L9EVY CollisionEnergy:102040 M BERKELEY-LAB temp/spectra_filtered.mgf235 -1 BERKELEY-LAB.mgf 75308.2 12 0 28.031 344.186 0 CCMSLIB00010108678 776 spectra_filtered.mgf *..* :8149 1076 -1 0 593.269 1 0.855708 0 0 380848.0 544340000.0 Pheophorbide A M+H GNPS-LIBRARY temp/spectra_filtered.mgf776 -1 GNPS-LIBRARY.mgf 12.0369 9 0 0.00714111 593.276 0 CCMSLIB00000076748 217 spectra_filtered.mgf *..* :70210 70210 -1 0 348.183 1 0.855699 0 0 128.424 4596700.0 2034287-08-4 [M+H]+ MSNLIB-POSITIVE temp/spectra_filtered.mgf217 -1 MSNLIB-POSITIVE.mgf 336003.0 6 0 116.991 465.174 0 CCMSLIB00012408499 581 spectra_filtered.mgf *..* :743 19206 -1 0 277.107 1 0.854787 0 0 202.301 25344000.0 7,8-dihydromethysticin [M+H]+ MONA temp/spectra_filtered.mgf581 -1 MONA.mgf 281518.0 6 0 78.0106 355.118 0 CCMSLIB00004691806 876 spectra_filtered.mgf *..* :28033 28033 -1 0 269.117 1 0.851563 0 0 275.687 4722000.0 4,4'-Dimethoxychalcone [M+H]+ MSNLIB-POSITIVE temp/spectra_filtered.mgf876 -1 MSNLIB-POSITIVE.mgf 200698.0 6 0 54.0113 323.128 0 CCMSLIB00012323684 531 spectra_filtered.mgf *..* :65348 65348 -1 0 348.057 1 0.851435 0 0 141.931 7514200.0 1040655-37-5 [M+H]+ MSNLIB-POSITIVE temp/spectra_filtered.mgf531 -1 MSNLIB-POSITIVE.mgf 209604.0 6 0 72.954 275.103 0 CCMSLIB00012398710 263 spectra_filtered.mgf *..* :70764 70764 -1 0 617.15 1 0.850282 0 0 5620.0 1080300.0 Vicenin II [M+Na]+ BMDMS-NP temp/spectra_filtered.mgf263 -1 BMDMS-NP.mgf 6529.37 15 0 4.0296 621.18 0 CCMSLIB00006425064 710 spectra_filtered.mgf *..* :7446 6502 -1 0 600.468 1 0.850232 0 0 284.423 4616100.0 Polidocanol [M+NH4]+ CMMC-REFRAME-POSITIVE-LIBRARY temp/spectra_filtered.mgf710 -1 CMMC-REFRAME-POSITIVE-LIBRARY.mgf 219958.0 7 0 132.078 468.39 0 CCMSLIB00012254917 119 spectra_filtered.mgf *..* :4410 55534 -1 0 341.087 1 0.850112 0 0 215.8 3948100.0 ESCULIN M+H MONA temp/spectra_filtered.mgf119 -1 MONA.mgf 137798.0 7 0 47.0012 388.088 0 CCMSLIB00006684563 480 spectra_filtered.mgf *..* :28033 28033 -1 0 269.117 1 0.849013 0 0 275.687 275530000.0 4,4'-Dimethoxychalcone [M+H]+ MSNLIB-POSITIVE temp/spectra_filtered.mgf480 -1 MSNLIB-POSITIVE.mgf 200699.0 6 0 54.0114 323.128 0 CCMSLIB00012323684 855 spectra_filtered.mgf *..* :28033 28033 -1 0 269.117 1 0.848167 0 0 275.687 9361000.0 4,4'-Dimethoxychalcone [M+H]+ MSNLIB-POSITIVE temp/spectra_filtered.mgf855 -1 MSNLIB-POSITIVE.mgf 200698.0 6 0 54.0112 323.128 0 CCMSLIB00012323684 883 spectra_filtered.mgf *..* :90 1538 -1 0 694.492 1 0.847993 0 0 429.06 5124700.0 L-phenylalanine_dodecanoic acid [2M]+ CMMC-LIBRARY temp/spectra_filtered.mgf883 -1 CMMC-LIBRARY.mgf 20187.3 7 0 14.0199 708.512 0 CCMSLIB00012472793 663 spectra_filtered.mgf *..* :22689 41152 -1 0 1091.53 1 0.847782 0 0 590.459 945900.0 (2S,3S,4S,5R,6R)-6-[[(3S,4S,6aR,6bS,8R,8aR,9R,10R,12aS,14bR)-10-acetyloxy-8a-(acetyloxymethyl)-8,9-dihydroxy-4-(hydroxymethyl)-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-4-hydroxy-3,5-bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]oxane-2-carboxylic acid [M+H]+ MONA temp/spectra_filtered.mgf663 -1 MONA.mgf 680034.0 7 0 742.277 349.253 0 CCMSLIB00004713752 212 spectra_filtered.mgf *..* :112 280 -1 0 867.213 1 0.847113 0 0 921.0 4149600.0 Procyanidin C1 40eV M+H PHENOLICSDB temp/spectra_filtered.mgf212 -1 PHENOLICSDB.mgf 0.0703808 19 0 6.10352e-05 867.213 0 CCMSLIB00012079701 641 spectra_filtered.mgf *..* :6625 6625 -1 0 205.195 1 0.84587 0 0 44892700.0 15577300.0 ()-alpha-Bisabolol - 40.0 eV Unknown BIRMINGHAM-UHPLC-MS-POS temp/spectra_filtered.mgf641 -1 BIRMINGHAM-UHPLC-MS-POS.mgf 287714.0 6 0 59.0374 264.232 0 CCMSLIB00006123930 355 spectra_filtered.mgf *..* :21564 40027 -1 0 523.217 1 0.844567 0 0 423.523 4152400.0 (2R,3R,4S,5S,6R)-2-[[7-hydroxy-1-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-6-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol [M+H]+ MONA temp/spectra_filtered.mgf355 -1 MONA.mgf 581241.0 7 0 304.115 219.102 0 CCMSLIB00004712627 282 spectra_filtered.mgf *..* :21564 40027 -1 0 523.217 1 0.84364 0 0 423.523 2633000.0 (2R,3R,4S,5S,6R)-2-[[7-hydroxy-1-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-6-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol [M+H]+ MONA temp/spectra_filtered.mgf282 -1 MONA.mgf 581241.0 7 0 304.115 219.102 0 CCMSLIB00004712627 209 spectra_filtered.mgf *..* :8690 9136 -1 0 291.086 1 0.843138 0 0 3150670.0 5371000.0 Cianidanol CollisionEnergy:102040 M+H BERKELEY-LAB temp/spectra_filtered.mgf209 -1 BERKELEY-LAB.mgf 6921.67 9 0 2.0148 289.071 0 CCMSLIB00010111124 135 spectra_filtered.mgf *..* :49655 49655 -1 0 349.002 1 0.843077 0 0 121.468 2010700.0 5-bromo-N-(1-(thiophen-2-yl)cyclopentyl)nicotinamide [M-H]- MSNLIB-NEGATIVE temp/spectra_filtered.mgf135 -1 MSNLIB-NEGATIVE.mgf 59732.6 6 0 20.8468 328.155 0 CCMSLIB00012380008 377 spectra_filtered.mgf *..* :21564 40027 -1 0 523.217 1 0.843025 0 0 423.523 5357400.0 (2R,3R,4S,5S,6R)-2-[[7-hydroxy-1-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-6-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol [M+H]+ MONA temp/spectra_filtered.mgf377 -1 MONA.mgf 581241.0 7 0 304.115 219.102 0 CCMSLIB00004712627 259 spectra_filtered.mgf *..* :110 278 -1 0 579.15 1 0.842399 0 0 513.0 3623900.0 Procyanidin B3 40eV M+H PHENOLICSDB temp/spectra_filtered.mgf259 -1 PHENOLICSDB.mgf 1.37004 13 0 0.000793457 579.151 0 CCMSLIB00012079699 171 spectra_filtered.mgf *..* :53445 53445 -1 0 480.148 1 0.84028 0 0 112.415 3730000.0 STL464062 [M+H]+ MSNLIB-POSITIVE temp/spectra_filtered.mgf171 -1 MSNLIB-POSITIVE.mgf 79233.9 7 0 38.044 442.104 0 CCMSLIB00012374786 161 spectra_filtered.mgf *..* :1 4626 -1 0 328.192 1 0.840246 0 0 565264.0 883500000.0 O-methylarmepavine M+H GNPS-LIBRARY temp/spectra_filtered.mgf161 -1 GNPS-LIBRARY.mgf 42707.6 12 0 14.0163 314.176 0 CCMSLIB00005436047 878 spectra_filtered.mgf *..* :90 1538 -1 0 694.492 1 0.838769 0 0 429.06 4814700.0 L-phenylalanine_dodecanoic acid [2M]+ CMMC-LIBRARY temp/spectra_filtered.mgf878 -1 CMMC-LIBRARY.mgf 20174.4 7 0 14.011 680.481 0 CCMSLIB00012472793 591 spectra_filtered.mgf *..* :2997 3931 -1 0 353.269 1 0.837865 0 0 538621.0 5135200.0 Spectral Match to Monolinolenin (9c,12c,15c) from NIST14 M+H GNPS-NIST14-MATCHES temp/spectra_filtered.mgf591 -1 GNPS-NIST14-MATCHES.mgf 965644.0 11 0 341.132 694.401 0 CCMSLIB00003138418 363 spectra_filtered.mgf *..* :3263 3263 -1 0 287.055 1 0.837841 0 0 37818800.0 225300.0 Luteolin - 40.0 eV M+H BIRMINGHAM-UHPLC-MS-POS temp/spectra_filtered.mgf363 -1 BIRMINGHAM-UHPLC-MS-POS.mgf 55719.6 8 0 15.9946 271.06 0 CCMSLIB00006118163 682 spectra_filtered.mgf *..* :92390 92390 -1 0 535.327 1 0.836019 0 0 506.077 1433700.0 CHEBI:181879 [M+H]+ MSNLIB-POSITIVE temp/spectra_filtered.mgf682 -1 MSNLIB-POSITIVE.mgf 267230.0 9 0 143.056 392.272 0 CCMSLIB00012443642 123 spectra_filtered.mgf *..* :33103 33103 -1 0 264.196 1 0.834053 0 0 124.091 209750000.0 Desvenlafaxine [M+H]+ MSNLIB-POSITIVE temp/spectra_filtered.mgf123 -1 MSNLIB-POSITIVE.mgf 136126.0 6 0 35.964 300.16 0 CCMSLIB00012333962 841 spectra_filtered.mgf *..* :92390 92390 -1 0 535.327 1 0.833241 0 0 506.077 6395900.0 CHEBI:181879 [M+H]+ MSNLIB-POSITIVE temp/spectra_filtered.mgf841 -1 MSNLIB-POSITIVE.mgf 61830.4 9 0 33.0995 568.427 0 CCMSLIB00012443642 845 spectra_filtered.mgf *..* :92390 92390 -1 0 535.327 1 0.83293 0 0 506.077 4361400.0 CHEBI:181879 [M+H]+ MSNLIB-POSITIVE temp/spectra_filtered.mgf845 -1 MSNLIB-POSITIVE.mgf 91709.9 10 0 49.0948 584.422 0 CCMSLIB00012443642 537 spectra_filtered.mgf *..* :19563 31562 -1 0 352.154 1 0.832842 0 0 1565.0 1642000.0 Massbank:PR300611 Palmatine M MASSBANK temp/spectra_filtered.mgf537 -1 MASSBANK.mgf 85319.7 6 0 30.0457 322.108 0 CCMSLIB00005745114 619 spectra_filtered.mgf *..* :10617 7838 -1 0 389.188 1 0.832692 0 0 582100.0 4212100.0 NCGC00380882-01!5-chloro-2,4-dihydroxy-6-methyl-3-[(E)-3-methyl-5-[(1S,2R,6R)-1,2,6-trimethyl-3-oxocyclohexyl]pent-2-enyl]benzaldehyde [IIN-based on: CCMSLIB00000845779] [M-H2O+H]+ GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE temp/spectra_filtered.mgf619 -1 GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE.mgf 87261.2 12 0 33.961 355.227 0 CCMSLIB00005723134 280 spectra_filtered.mgf *..* :8185 26648 -1 0 700.281 1 0.832076 0 0 252.856 3002300.0 2-[4-[(3S,3aR,6S,6aR)-6-[3-methoxy-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-3-yl]-2-methoxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol [M+NH4]+ MONA temp/spectra_filtered.mgf280 -1 MONA.mgf 42853.6 16 0 30.0096 670.271 0 CCMSLIB00004699248 219 spectra_filtered.mgf *..* :1 4626 -1 0 328.192 1 0.830746 0 0 565264.0 31600000.0 O-methylarmepavine M+H GNPS-LIBRARY temp/spectra_filtered.mgf219 -1 GNPS-LIBRARY.mgf 48733.4 12 0 15.9939 344.186 0 CCMSLIB00005436047 141 spectra_filtered.mgf *..* :273 1622 -1 0 435.128 1 0.830027 0 0 537957.0 920400.0 NCGC00180273-02!7-hydroxy-2-(4-hydroxyphenyl)-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3-dihydrochromen-4-one M+H GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE temp/spectra_filtered.mgf141 -1 GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE.mgf 59785.6 11 0 26.0144 409.114 0 CCMSLIB00000847896 889 spectra_filtered.mgf *..* :8149 1076 -1 0 593.269 1 0.829846 0 0 380848.0 40740000.0 Pheophorbide A M+H GNPS-LIBRARY temp/spectra_filtered.mgf889 -1 GNPS-LIBRARY.mgf 47259.9 7 0 28.0378 621.307 0 CCMSLIB00000076748 90 spectra_filtered.mgf *..* :10714 11160 -1 0 465.103 1 0.828692 0 0 5879350.0 2247000.0 CCG-208508 CollisionEnergy:102040 M+H BERKELEY-LAB temp/spectra_filtered.mgf90 -1 BERKELEY-LAB.mgf 328948.0 6 0 152.995 312.108 0 CCMSLIB00010113148 627 spectra_filtered.mgf *..* :10617 7838 -1 0 389.188 1 0.826118 0 0 582100.0 3149000.0 NCGC00380882-01!5-chloro-2,4-dihydroxy-6-methyl-3-[(E)-3-methyl-5-[(1S,2R,6R)-1,2,6-trimethyl-3-oxocyclohexyl]pent-2-enyl]benzaldehyde [IIN-based on: CCMSLIB00000845779] [M-H2O+H]+ GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE temp/spectra_filtered.mgf627 -1 GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE.mgf 87261.2 8 0 33.961 355.227 0 CCMSLIB00005723134 385 spectra_filtered.mgf *..* :1 1211 -1 0 318.14 1 0.824802 0 0 2023080.0 6642200.0 Piplartine M+H GNPS-LIBRARY temp/spectra_filtered.mgf385 -1 GNPS-LIBRARY.mgf 3185.09 6 0 1.01331 317.127 0 CCMSLIB00000078864 585 spectra_filtered.mgf *..* :21745 22191 -1 0 337.107 1 0.824363 0 0 5789750.0 27332000.0 CCG-208458 CollisionEnergy:205060 M+H-H2O BERKELEY-LAB temp/spectra_filtered.mgf585 -1 BERKELEY-LAB.mgf 1.53897 12 0 0.000518799 337.108 0 CCMSLIB00010124181 134 spectra_filtered.mgf *..* :1 4626 -1 0 328.192 1 0.822387 0 0 565264.0 51593000.0 O-methylarmepavine M+H GNPS-LIBRARY temp/spectra_filtered.mgf134 -1 GNPS-LIBRARY.mgf 6028.81 12 0 1.97861 330.171 0 CCMSLIB00005436047 802 spectra_filtered.mgf *..* :8149 1076 -1 0 593.269 1 0.821116 0 0 380848.0 74963600.0 Pheophorbide A M+H GNPS-LIBRARY temp/spectra_filtered.mgf802 -1 GNPS-LIBRARY.mgf 12.9628 9 0 0.00769043 593.277 0 CCMSLIB00000076748 632 spectra_filtered.mgf *..* :6625 6625 -1 0 205.195 1 0.819984 0 0 44892700.0 52326000.0 ()-alpha-Bisabolol - 40.0 eV Unknown BIRMINGHAM-UHPLC-MS-POS temp/spectra_filtered.mgf632 -1 BIRMINGHAM-UHPLC-MS-POS.mgf 287714.0 6 0 59.0375 264.233 0 CCMSLIB00006123930 88 spectra_filtered.mgf *..* :1056 1056 -1 0 162.076 1 0.81979 0 0 315082000.0 9033100.0 N-Methylglutamate - 40.0 eV M+H BIRMINGHAM-UHPLC-MS-POS temp/spectra_filtered.mgf88 -1 BIRMINGHAM-UHPLC-MS-POS.mgf 740528.0 6 0 120.022 282.098 0 CCMSLIB00006114467 614 spectra_filtered.mgf *..* :3975 5202 -1 0 454.293 1 0.819639 0 0 5025040.0 936000.0 Spectral Match to 1-Palmitoyl-2-hydroxy-sn-glycero-3-phosphoethanolamine from NIST14 M+H GNPS-NIST14-MATCHES temp/spectra_filtered.mgf614 -1 GNPS-NIST14-MATCHES.mgf 52830.4 8 0 24.0005 478.293 0 CCMSLIB00003139689 810 spectra_filtered.mgf *..* :8149 1076 -1 0 593.269 1 0.819538 0 0 380848.0 8122400.0 Pheophorbide A M+H GNPS-LIBRARY temp/spectra_filtered.mgf810 -1 GNPS-LIBRARY.mgf 23637.1 9 0 14.0231 607.292 0 CCMSLIB00000076748 240 spectra_filtered.mgf *..* :84734 84734 -1 0 314.14 1 0.819266 0 0 1967.0 3050600.0 Laetanine [M+H]+ BMDMS-NP temp/spectra_filtered.mgf240 -1 BMDMS-NP.mgf 44613.8 6 0 14.015 328.155 0 CCMSLIB00006439034 595 spectra_filtered.mgf *..* :20156 32155 -1 0 209.096 1 0.818024 0 0 17139.0 10035000.0 Massbank:PR310506 Chalcone M+H MASSBANK temp/spectra_filtered.mgf595 -1 MASSBANK.mgf 904273.0 6 0 189.08 398.176 0 CCMSLIB00005745707 122 spectra_filtered.mgf *..* :4410 55534 -1 0 341.087 1 0.81654 0 0 215.8 2353300.0 ESCULIN M+H MONA temp/spectra_filtered.mgf122 -1 MONA.mgf 87879.0 7 0 29.9744 371.061 0 CCMSLIB00006684563 344 spectra_filtered.mgf *..* :3824 4270 -1 0 318.134 1 0.816524 0 0 19136400.0 9105800.0 Piperlongumine CollisionEnergy:102040 M+H BERKELEY-LAB temp/spectra_filtered.mgf344 -1 BERKELEY-LAB.mgf 575625.0 6 0 183.126 501.26 0 CCMSLIB00010106258 842 spectra_filtered.mgf *..* :82001 82001 -1 0 702.442 1 0.816251 0 0 602.622 253400.0 CHEBI:181245 [M+NH4]+ MSNLIB-POSITIVE temp/spectra_filtered.mgf842 -1 MSNLIB-POSITIVE.mgf 166582.0 8 0 117.015 585.427 0 CCMSLIB00012432214 696 spectra_filtered.mgf *..* :3471 3471 -1 0 632.525 1 0.815696 0 0 262484.0 17426100.0 DG(18:2/18:3/0:0); [M+NH4]+ C39H70N1O5 M+NH4 PNNL-LIPIDS-POSITIVE temp/spectra_filtered.mgf696 -1 PNNL-LIPIDS-POSITIVE.mgf 256200.0 16 0 162.053 794.578 0 CCMSLIB00010058733 664 spectra_filtered.mgf *..* :9272 9272 -1 0 515.373 1 0.814749 0 0 554.955 1914100.0 alisol A 24-acetate [M+H-H2O]+ MSNLIB-POSITIVE temp/spectra_filtered.mgf664 -1 MSNLIB-POSITIVE.mgf 287384.0 8 0 148.11 367.263 0 CCMSLIB00012283573 582 spectra_filtered.mgf *..* :2664 6992 -1 0 353.139 1 0.813404 0 0 763500.0 1270200.0 NCGC00180457-02!4-(1,3-benzodioxol-5-ylmethyl)-3-[(3,4-dimethoxyphenyl)methyl]oxolan-2-one [IIN-based on: CCMSLIB00000847667] [M-H2O+H]+ GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE temp/spectra_filtered.mgf582 -1 GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE.mgf 45396.9 9 0 16.0314 337.108 0 CCMSLIB00005722288 879 spectra_filtered.mgf *..* :8149 1076 -1 0 593.269 1 0.813153 0 0 380848.0 77607700.0 Pheophorbide A M+H GNPS-LIBRARY temp/spectra_filtered.mgf879 -1 GNPS-LIBRARY.mgf 47260.0 7 0 28.0379 621.307 0 CCMSLIB00000076748 330 spectra_filtered.mgf *..* :451 2656 -1 0 404.207 1 0.812684 0 0 28374.0 2476800.0 NCGC00380478-01!(3S,3aR,6S,6aR)-3,6-bis(3,4-dimethoxyphenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan M+NH4 GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE temp/spectra_filtered.mgf330 -1 GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE.mgf 113907.0 11 0 46.0422 450.249 0 CCMSLIB00000849000 643 spectra_filtered.mgf *..* :20521 20967 -1 0 205.195 1 0.812032 0 0 5833410.0 3912000.0 Bisabolol CollisionEnergy:205060 M+H-H2O BERKELEY-LAB temp/spectra_filtered.mgf643 -1 BERKELEY-LAB.mgf 1.93342 6 0 0.000396729 205.195 0 CCMSLIB00010122956 74 spectra_filtered.mgf *..* :1 9 -1 0 330.171 1 0.810591 0 0 285948.0 3884700.0 Anomuricine M+H IQAMDB temp/spectra_filtered.mgf74 -1 IQAMDB.mgf 90941.3 6 0 30.0262 300.145 0 CCMSLIB00008851205 854 spectra_filtered.mgf *..* :3115 14455 -1 0 325.143 1 0.809906 0 0 20710000.0 2079300.0 Knemolic acid B M+H-H2O GNPS-LIBRARY temp/spectra_filtered.mgf854 -1 GNPS-LIBRARY.mgf 49195.2 6 0 15.9955 341.138 0 CCMSLIB00012475058 434 spectra_filtered.mgf *..* :3824 4270 -1 0 318.134 1 0.808241 0 0 19136400.0 54036000.0 Piperlongumine CollisionEnergy:102040 M+H BERKELEY-LAB temp/spectra_filtered.mgf434 -1 BERKELEY-LAB.mgf 3165.68 6 0 1.00711 317.127 0 CCMSLIB00010106258 659 spectra_filtered.mgf *..* :6908 7418 -1 0 341.211 1 0.806981 0 0 1117800.0 6087900.0 NCGC00169961-02!4-hydroxy-3-[(2E,6E)-4-hydroxy-3,7,11-trimethyldodeca-2,6,10-trienyl]benzoic acid [IIN-based: Match] [M-H2O+H]+ GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE temp/spectra_filtered.mgf659 -1 GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE.mgf 5908.97 13 0 2.0162 343.227 0 CCMSLIB00005722714 891 spectra_filtered.mgf *..* :11345 11345 -1 0 634.541 1 0.805669 0 0 1010120.0 26149600.0 DG(18:2/0:0/18:2); [M+NH4]+ C39H72N1O5 M+NH4 PNNL-LIPIDS-POSITIVE temp/spectra_filtered.mgf891 -1 PNNL-LIPIDS-POSITIVE.mgf 255386.0 16 0 162.053 796.594 0 CCMSLIB00010076562 695 spectra_filtered.mgf *..* :94082 94082 -1 0 740.422 1 0.80512 0 0 576.066 1460700.0 NCGC00380920-01 [M+NH4]+ MSNLIB-POSITIVE temp/spectra_filtered.mgf695 -1 MSNLIB-POSITIVE.mgf 458033.0 8 0 339.138 401.284 0 CCMSLIB00012445334 382 spectra_filtered.mgf *..* :1689 2135 -1 0 317.15 1 0.804974 0 0 6589270.0 1014100.0 (2E)-1-(1,3-dimethylpyrazol-4-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one CollisionEnergy:102040 M+H BERKELEY-LAB temp/spectra_filtered.mgf382 -1 BERKELEY-LAB.mgf 343423.0 6 0 108.917 426.067 0 CCMSLIB00010104123 730 spectra_filtered.mgf *..* :96356 96356 -1 0 503.24 1 0.804583 0 0 387.585 3003800.0 CHEBI:181076 [M+Na]+ MSNLIB-POSITIVE temp/spectra_filtered.mgf730 -1 MSNLIB-POSITIVE.mgf 174748.0 6 0 87.94 415.3 0 CCMSLIB00012447608 504 spectra_filtered.mgf *..* :828 828 -1 0 206.081 1 0.804205 0 0 4338310.0 54254000.0 dl-3-Indolelactic acid - 40.0 eV M+H BIRMINGHAM-UHPLC-MS-POS temp/spectra_filtered.mgf504 -1 BIRMINGHAM-UHPLC-MS-POS.mgf 53402.3 6 0 11.0052 217.086 0 CCMSLIB00006114078 661 spectra_filtered.mgf *..* :20490 20936 -1 0 195.065 1 0.802362 0 0 6274280.0 4036700.0 ferulic acid CollisionEnergy:205060 M+H BERKELEY-LAB temp/spectra_filtered.mgf661 -1 BERKELEY-LAB.mgf 2195090.0 6 0 428.186 623.251 0 CCMSLIB00010122925 459 spectra_filtered.mgf *..* :828 828 -1 0 206.081 1 0.801655 0 0 4338310.0 24511000.0 dl-3-Indolelactic acid - 40.0 eV M+H BIRMINGHAM-UHPLC-MS-POS temp/spectra_filtered.mgf459 -1 BIRMINGHAM-UHPLC-MS-POS.mgf 53402.8 6 0 11.0053 217.086 0 CCMSLIB00006114078 392 spectra_filtered.mgf *..* :37367 37367 -1 0 334.201 1 0.801569 0 0 123.079 776500.0 Cinoctramide [M+H]+ MSNLIB-POSITIVE temp/spectra_filtered.mgf392 -1 MSNLIB-POSITIVE.mgf 250920.0 6 0 83.8578 418.059 0 CCMSLIB00012342517 164 spectra_filtered.mgf *..* :95062 95062 -1 0 532.202 1 0.800345 0 0 153.288 1461200.0 NCGC00380580-01 [M+NH4]+ MSNLIB-POSITIVE temp/spectra_filtered.mgf164 -1 MSNLIB-POSITIVE.mgf 249974.0 6 0 133.036 399.166 0 CCMSLIB00012446314 604 spectra_filtered.mgf *..* :3563 10666 -1 0 714.506 1 0.79999 0 0 59856000.0 10341300.0 PE-DAG (16:1/18:2) M+H GNPS-LIBRARY temp/spectra_filtered.mgf604 -1 GNPS-LIBRARY.mgf 330596.0 12 0 236.212 478.293 0 CCMSLIB00006678080 578 spectra_filtered.mgf *..* :82243 82243 -1 0 276.159 1 0.799726 0 0 88.074 21792500.0 (4E)-N-Isobutyl-5-(1,3-benzodioxol-5-yl)-4-pentenamide [M+H]+ MSNLIB-POSITIVE temp/spectra_filtered.mgf578 -1 MSNLIB-POSITIVE.mgf 94208.8 6 0 26.0166 302.176 0 CCMSLIB00012432703 864 spectra_filtered.mgf *..* :3115 14455 -1 0 325.143 1 0.798835 0 0 20710000.0 6175000.0 Knemolic acid B M+H-H2O GNPS-LIBRARY temp/spectra_filtered.mgf864 -1 GNPS-LIBRARY.mgf 49195.6 6 0 15.9956 341.139 0 CCMSLIB00012475058 844 spectra_filtered.mgf *..* :82001 82001 -1 0 702.442 1 0.797576 0 0 602.622 11265000.0 CHEBI:181245 [M+NH4]+ MSNLIB-POSITIVE temp/spectra_filtered.mgf844 -1 MSNLIB-POSITIVE.mgf 192218.0 8 0 135.022 567.42 0 CCMSLIB00012432214 147 spectra_filtered.mgf *..* :399 3000 -1 0 361.089 1 0.794795 0 0 13898.0 2217200.0 NCGC00384821-01_C16H18O8_Cyclohexanecarboxylic acid, 1,3,4-trihydroxy-5-[[(2E)-3-(4-hydroxyphenyl)-1-oxo-2-propen-1-yl]oxy]-, (1R,3R,4S,5R)- M+Na GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE temp/spectra_filtered.mgf147 -1 GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE.mgf 49780.0 6 0 17.975 379.064 0 CCMSLIB00000849957 323 spectra_filtered.mgf *..* :17431 15176 -1 0 238.107 1 0.793159 0 0 156.126 6297400.0 Cintriamide [M+H]+ CMMC-REFRAME-POSITIVE-LIBRARY temp/spectra_filtered.mgf323 -1 CMMC-REFRAME-POSITIVE-LIBRARY.mgf 978998.0 6 0 233.106 471.213 0 CCMSLIB00012269489 245 spectra_filtered.mgf *..* :24421 42884 -1 0 556.239 1 0.791507 0 0 378.438 2152700.0 2-[4-[4-[hydroxy-(4-hydroxy-3-methoxyphenyl)methyl]-3-(hydroxymethyl)oxolan-2-yl]-2-methoxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol [M+NH4]+ MONA temp/spectra_filtered.mgf245 -1 MONA.mgf 25197.2 13 0 14.0157 570.255 0 CCMSLIB00004715484 477 spectra_filtered.mgf *..* :3115 14455 -1 0 325.143 1 0.789999 0 0 20710000.0 44430000.0 Knemolic acid B M+H-H2O GNPS-LIBRARY temp/spectra_filtered.mgf477 -1 GNPS-LIBRARY.mgf 49195.9 6 0 15.9957 341.139 0 CCMSLIB00012475058 303 spectra_filtered.mgf *..* :12143 12589 -1 0 149.132 1 0.787037 0 0 1022840.0 7098200.0 (1R)-(-)-Nopol CollisionEnergy:102040 M+H-H2O BERKELEY-LAB temp/spectra_filtered.mgf303 -1 BERKELEY-LAB.mgf 938743.0 6 0 139.997 289.129 0 CCMSLIB00010114577 894 spectra_filtered.mgf *..* :82001 82001 -1 0 702.442 1 0.786603 0 0 602.622 19248100.0 CHEBI:181245 [M+NH4]+ MSNLIB-POSITIVE temp/spectra_filtered.mgf894 -1 MSNLIB-POSITIVE.mgf 192218.0 8 0 135.022 567.42 0 CCMSLIB00012432214 603 spectra_filtered.mgf *..* :206402 206401 -1 0 229.08 1 0.786243 0 0 2049.0 8240000.0 p-methoxycinnamic acid ethyl ester [M+Na]+ BMDMS-NP temp/spectra_filtered.mgf603 -1 BMDMS-NP.mgf 8985.09 7 0 2.0583 231.138 0 CCMSLIB00006560703 153 spectra_filtered.mgf *..* :85074 85074 -1 0 272.12 1 0.785688 0 0 2888.0 27970000.0 Higenamine [M+H]+ BMDMS-NP temp/spectra_filtered.mgf153 -1 BMDMS-NP.mgf 103042.0 8 0 28.0399 300.16 0 CCMSLIB00006439374 694 spectra_filtered.mgf *..* :92390 92390 -1 0 535.327 1 0.784711 0 0 506.077 1899100.0 CHEBI:181879 [M+H]+ MSNLIB-POSITIVE temp/spectra_filtered.mgf694 -1 MSNLIB-POSITIVE.mgf 125356.0 9 0 67.1062 602.433 0 CCMSLIB00012443642 143 spectra_filtered.mgf *..* :7691 26154 -1 0 430.207 1 0.78279 0 0 158.022 2948000.0 4-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypentan-2-yl (E)-3-(4-hydroxyphenyl)prop-2-enoate [M+NH4]+ MONA temp/spectra_filtered.mgf143 -1 MONA.mgf 26028.2 6 0 11.1975 419.009 0 CCMSLIB00004698754 163 spectra_filtered.mgf *..* :6070 6070 -1 0 246.185 1 0.781514 0 0 128.449 8087800.0 Desvenlafaxine [M+H-H2O]+ MSNLIB-POSITIVE temp/spectra_filtered.mgf163 -1 MSNLIB-POSITIVE.mgf 341148.0 6 0 83.9854 330.17 0 CCMSLIB00012280371 328 spectra_filtered.mgf *..* :451 2656 -1 0 404.207 1 0.780915 0 0 28374.0 7627700.0 NCGC00380478-01!(3S,3aR,6S,6aR)-3,6-bis(3,4-dimethoxyphenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan M+NH4 GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE temp/spectra_filtered.mgf328 -1 GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE.mgf 44558.8 11 0 18.011 422.218 0 CCMSLIB00000849000 896 spectra_filtered.mgf *..* :51724 63723 -1 0 571.451 1 0.779682 0 0 546419.0 4338600.0 Massbank:MSJ00113 Lycopene-5,6-diol M+H MASSBANK temp/spectra_filtered.mgf896 -1 MASSBANK.mgf 22697.3 12 0 12.9704 584.421 0 CCMSLIB00005777275 433 spectra_filtered.mgf *..* :1241 1241 -1 0 239.091 1 0.777717 0 0 91253000.0 3568300.0 (E)-3,4,5-Trimethoxycinnamic acid - 40.0 eV M+H BIRMINGHAM-UHPLC-MS-POS temp/spectra_filtered.mgf433 -1 BIRMINGHAM-UHPLC-MS-POS.mgf 748535.0 6 0 178.968 418.059 0 CCMSLIB00006114729 437 spectra_filtered.mgf *..* :63015 63015 -1 0 217.05 1 0.777121 0 0 2405.0 2583000.0 9-methoxy-7H-furo[3,2-g]chromen-7-one [M+H]+ BMDMS-NP temp/spectra_filtered.mgf437 -1 BMDMS-NP.mgf 50644.1 6 0 10.9923 206.058 0 CCMSLIB00006417315 358 spectra_filtered.mgf *..* :10908 11354 -1 0 207.065 1 0.777066 0 0 4910150.0 4504000.0 SINAPIC ACID CollisionEnergy:102040 M+H-H2O BERKELEY-LAB temp/spectra_filtered.mgf358 -1 BERKELEY-LAB.mgf 463844.0 6 0 96.0458 303.111 0 CCMSLIB00010113342 897 spectra_filtered.mgf *..* :51736 63735 -1 0 601.425 1 0.776634 0 0 71318.0 397900.0 Massbank:MSJ00114 Nostoxanthin M+H MASSBANK temp/spectra_filtered.mgf897 -1 MASSBANK.mgf 19949.8 10 0 11.9983 613.423 0 CCMSLIB00005777287 848 spectra_filtered.mgf *..* :751 4527 -1 0 385.273 1 0.774954 0 0 323339.0 285100.0 NCGC00381199-01_C25H38O4_(3aR,5E,7S,10E,14E,16aS)-2,7-Dihydroxy-3-[(2S)-1-hydroxy-2-propanyl]-6,10,14,16a-tetramethyl-4,7,8,9,12,13,16,16a-octahydrocyclopenta[15]annulen-1(3aH)-one M-H2O+H GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE temp/spectra_filtered.mgf848 -1 GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE.mgf 636311.0 8 0 245.154 630.427 0 CCMSLIB00000853579 645 spectra_filtered.mgf *..* :5205 1104 -1 0 552.43 1 0.772892 0 0 1574100.0 1774300.0 Spectral Match to .beta.-Cryptoxanthin from NIST14 M] GNPS-NIST14-MATCHES temp/spectra_filtered.mgf645 -1 GNPS-NIST14-MATCHES.mgf 119469.0 10 0 65.9983 618.428 0 CCMSLIB00003135590 898 spectra_filtered.mgf *..* :51721 63720 -1 0 585.43 1 0.77234 0 0 99767.0 1056900.0 Massbank:MSJ00121 Antheraxanthin M+H MASSBANK temp/spectra_filtered.mgf898 -1 MASSBANK.mgf 46098.5 9 0 26.9874 612.417 0 CCMSLIB00005777272 290 spectra_filtered.mgf *..* :1320 127 -1 0 174.054 1 0.771373 0 0 9393050.0 13572000.0 2-oxindole-3-acetic acid CollisionEnergy:205060 M-H2O+H BERKELEY-LAB temp/spectra_filtered.mgf290 -1 BERKELEY-LAB.mgf 614973.0 6 0 107.038 281.092 0 CCMSLIB00010102114 184 spectra_filtered.mgf *..* :98634 98634 -1 0 464.176 1 0.76985 0 0 154.625 1227000.0 NCGC00385424-01 [M+NH4]+ MSNLIB-POSITIVE temp/spectra_filtered.mgf184 -1 MSNLIB-POSITIVE.mgf 510764.0 6 0 237.084 227.092 0 CCMSLIB00012449886 678 spectra_filtered.mgf *..* :3 12340 -1 0 609.272 1 0.769148 0 0 96450000.0 7214300.0 3.10S-Hydroxypheophorbide a M+H GNPS-LIBRARY temp/spectra_filtered.mgf678 -1 GNPS-LIBRARY.mgf 22943.0 7 0 13.9785 623.25 0 CCMSLIB00010128701 346 spectra_filtered.mgf *..* :17162 17608 -1 0 247.133 1 0.768615 0 0 9375640.0 11100000.0 ABSCISIC ACID CollisionEnergy:205060 M+H-H2O BERKELEY-LAB temp/spectra_filtered.mgf346 -1 BERKELEY-LAB.mgf 0.432203 10 0 0.000106812 247.133 0 CCMSLIB00010119597 304 spectra_filtered.mgf *..* :92630 92630 -1 0 478.192 1 0.766618 0 0 161.544 1413300.0 CHEBI:181517 [M+NH4]+ MSNLIB-POSITIVE temp/spectra_filtered.mgf304 -1 MSNLIB-POSITIVE.mgf 83639.4 6 0 39.9957 518.188 0 CCMSLIB00012443882 648 spectra_filtered.mgf *..* :3401 14453 -1 0 279.195 1 0.766049 0 0 13215000.0 8549400.0 Knemolone D M+H GNPS-LIBRARY temp/spectra_filtered.mgf648 -1 GNPS-LIBRARY.mgf 448281.0 7 0 125.158 404.353 0 CCMSLIB00012475056 160 spectra_filtered.mgf *..* :380 12231 -1 0 342.17 1 0.765154 0 0 33553000.0 74672000.0 Magnoflorine M+ GNPS-LIBRARY temp/spectra_filtered.mgf160 -1 GNPS-LIBRARY.mgf 40959.5 7 0 14.0151 328.155 0 CCMSLIB00010127350 329 spectra_filtered.mgf *..* :19065 19511 -1 0 387.18 1 0.764921 0 0 840923.0 13134200.0 4-[(1R,5R)-6-(3,4-dimethoxyphenyl)-3,7-dioxabicyclo[3.3.0]oct-2-yl]-1,2-dimeth oxybenzene CollisionEnergy:205060 M+H BERKELEY-LAB temp/spectra_filtered.mgf329 -1 BERKELEY-LAB.mgf 2.04932 11 0 0.000793457 387.181 0 CCMSLIB00010121500 724 spectra_filtered.mgf *..* :5799 1822 -1 0 431.38 1 0.764476 0 0 39916200.0 4493900.0 Spectral Match to (+)-.alpha.-Tocopherol from NIST14 M+H GNPS-NIST14-MATCHES temp/spectra_filtered.mgf724 -1 GNPS-NIST14-MATCHES.mgf 4652.06 10 0 2.00681 429.373 0 CCMSLIB00003136309 521 spectra_filtered.mgf *..* :3401 14453 -1 0 279.195 1 0.763389 0 0 13215000.0 4205400.0 Knemolone D M+H GNPS-LIBRARY temp/spectra_filtered.mgf521 -1 GNPS-LIBRARY.mgf 147080.0 6 0 41.0639 320.259 0 CCMSLIB00012475056 55 spectra_filtered.mgf *..* :8688 27151 -1 0 1103.61 1 0.762762 0 0 331.3 847000.0 [3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 10-[3-acetamido-6-[[4,5-dihydroxy-3-(3,4,5-trihydroxyoxan-2-yl)oxyoxan-2-yl]oxymethyl]-4,5-dihydroxyoxan-2-yl]oxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate [M+NH4]+ MONA temp/spectra_filtered.mgf55 -1 MONA.mgf 815073.0 6 0 899.523 204.087 0 CCMSLIB00004699751 790 spectra_filtered.mgf *..* :4152 543 -1 0 718.537 1 0.762038 0 0 3255490.0 7806400.0 Spectral Match to 1-Hexadecanoyl-2-(9Z-octadecenoyl)-sn-glycero-3-phosphoethanolamine from NIST14 M+H GNPS-NIST14-MATCHES temp/spectra_filtered.mgf790 -1 GNPS-NIST14-MATCHES.mgf 2803.74 13 0 2.01459 716.522 0 CCMSLIB00003135029 229 spectra_filtered.mgf *..* :22345 22345 -1 0 180.138 1 0.758132 0 0 117.07 3224700.0 Mexiletine [M+H]+ MSNLIB-POSITIVE temp/spectra_filtered.mgf229 -1 MSNLIB-POSITIVE.mgf 899490.0 6 0 162.032 342.17 0 CCMSLIB00012311675 414 spectra_filtered.mgf *..* :9182 27645 -1 0 552.244 1 0.757374 0 0 551.521 9946000.0 2-[4-[(3R,3aR,6S,6aR)-3-(3,4-dimethoxyphenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-6-yl]-2-methoxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol [M+NH4]+ MONA temp/spectra_filtered.mgf414 -1 MONA.mgf 356889.0 13 0 197.09 355.154 0 CCMSLIB00004700245 850 spectra_filtered.mgf *..* :51724 63723 -1 0 571.451 1 0.756156 0 0 546419.0 1976800.0 Massbank:MSJ00113 Lycopene-5,6-diol M+H MASSBANK temp/spectra_filtered.mgf850 -1 MASSBANK.mgf 71688.5 11 0 40.9665 612.417 0 CCMSLIB00005777275 113 spectra_filtered.mgf *..* :399 3000 -1 0 361.089 1 0.755286 0 0 13898.0 1841500.0 NCGC00384821-01_C16H18O8_Cyclohexanecarboxylic acid, 1,3,4-trihydroxy-5-[[(2E)-3-(4-hydroxyphenyl)-1-oxo-2-propen-1-yl]oxy]-, (1R,3R,4S,5R)- M+Na GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE temp/spectra_filtered.mgf113 -1 GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE.mgf 49780.6 6 0 17.9752 379.064 0 CCMSLIB00000849957 520 spectra_filtered.mgf *..* :19064 19510 -1 0 369.17 1 0.751886 0 0 4720340.0 11623200.0 4-[(1R,5R)-6-(3,4-dimethoxyphenyl)-3,7-dioxabicyclo[3.3.0]oct-2-yl]-1,2-dimeth oxybenzene CollisionEnergy:205060 M+H-H2O BERKELEY-LAB temp/spectra_filtered.mgf520 -1 BERKELEY-LAB.mgf 0.0 12 0 0.0 369.17 0 CCMSLIB00010121499 846 spectra_filtered.mgf *..* :92390 92390 -1 0 535.327 1 0.751057 0 0 506.077 2824300.0 CHEBI:181879 [M+H]+ MSNLIB-POSITIVE temp/spectra_filtered.mgf846 -1 MSNLIB-POSITIVE.mgf 145886.0 9 0 78.0966 613.424 0 CCMSLIB00012443642 847 spectra_filtered.mgf *..* :751 4527 -1 0 385.273 1 0.746441 0 0 323339.0 662400.0 NCGC00381199-01_C25H38O4_(3aR,5E,7S,10E,14E,16aS)-2,7-Dihydroxy-3-[(2S)-1-hydroxy-2-propanyl]-6,10,14,16a-tetramethyl-4,7,8,9,12,13,16,16a-octahydrocyclopenta[15]annulen-1(3aH)-one M-H2O+H GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE temp/spectra_filtered.mgf847 -1 GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE.mgf 633698.0 8 0 244.147 629.42 0 CCMSLIB00000853579 248 spectra_filtered.mgf *..* :379 3348 -1 0 407.155 1 0.745846 0 0 203079.0 7142400.0 NCGC00169057-02_C17H26O11_Methyl (1S,4aS,5R,7S,7aS)-1-(beta-D-glucopyranosyloxy)-5,7-dihydroxy-7-methyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylate M+H GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE temp/spectra_filtered.mgf248 -1 GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE.mgf 326742.0 6 0 133.035 540.19 0 CCMSLIB00000851023 729 spectra_filtered.mgf *..* :51760 63759 -1 0 569.435 1 0.742282 0 0 718170.0 6661000.0 Massbank:MSJ00118 Zeaxanthin M+H MASSBANK temp/spectra_filtered.mgf729 -1 MASSBANK.mgf 26319.9 7 0 14.9875 584.422 0 CCMSLIB00005777311 817 spectra_filtered.mgf *..* :43649 43649 -1 0 437.272 1 0.740895 0 0 526.683 6436500.0 INT-767 [M+H-2H2O]+ MSNLIB-POSITIVE temp/spectra_filtered.mgf817 -1 MSNLIB-POSITIVE.mgf 885674.0 7 0 387.28 824.552 0 CCMSLIB00012355195 473 spectra_filtered.mgf *..* :1892 788 -1 0 219.139 1 0.737758 0 0 88084.0 2076900.0 MLS002473104-01!(2R)-6-(2-hydroxyethyl)-2,5,7-trimethyl-2,3-dihydroinden-1-one M+H GNPS-NIH-NATURALPRODUCTSLIBRARY temp/spectra_filtered.mgf473 -1 GNPS-NIH-NATURALPRODUCTSLIBRARY.mgf 169.342 6 0 0.0371094 219.102 0 CCMSLIB00000080140 587 spectra_filtered.mgf *..* :74490 74490 -1 0 315.098 1 0.736191 0 0 152.929 1330000.0 N-(3,5-dioxo-10-oxa-4-azatricyclo[5.2.1.0~2,6~]dec-8-en-4-yl)-2-methoxybenzamide [M+H]+ MSNLIB-POSITIVE temp/spectra_filtered.mgf587 -1 MSNLIB-POSITIVE.mgf 120611.0 6 0 38.0043 353.102 0 CCMSLIB00012417104 768 spectra_filtered.mgf *..* :4113 1430 -1 0 305.247 1 0.735811 0 0 1151310.0 7001900.0 Spectral Match to Stearidonic acid ethyl ester from NIST14 M+H GNPS-NIST14-MATCHES temp/spectra_filtered.mgf768 -1 GNPS-NIST14-MATCHES.mgf 1701260.0 8 0 519.305 824.552 0 CCMSLIB00003135917 892 spectra_filtered.mgf *..* :2165 2165 -1 0 366.301 1 0.734632 0 0 11302200.0 8330600.0 Candidate GABA-C18:2 (delta mass:262.2306) M+H GNPS-N-ACYL-LIPIDS-MASSQL temp/spectra_filtered.mgf892 -1 GNPS-N-ACYL-LIPIDS-MASSQL.mgf 1188230.0 6 0 435.248 801.549 0 CCMSLIB00012717563 375 spectra_filtered.mgf *..* :7678 26141 -1 0 401.159 1 0.734495 0 0 393.685 10979000.0 6-[3-(3,4-dimethoxyphenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-6-yl]-4-methoxy-1,3-benzodioxole [M+H]+ MONA temp/spectra_filtered.mgf375 -1 MONA.mgf 5027.7 10 0 2.01691 403.176 0 CCMSLIB00004698741 126 spectra_filtered.mgf *..* :1 4626 -1 0 328.192 1 0.732991 0 0 565264.0 2379600.0 O-methylarmepavine M+H GNPS-LIBRARY temp/spectra_filtered.mgf126 -1 GNPS-LIBRARY.mgf 6028.53 9 0 1.97852 330.171 0 CCMSLIB00005436047 241 spectra_filtered.mgf *..* :379 3348 -1 0 407.155 1 0.732409 0 0 203079.0 8384600.0 NCGC00169057-02_C17H26O11_Methyl (1S,4aS,5R,7S,7aS)-1-(beta-D-glucopyranosyloxy)-5,7-dihydroxy-7-methyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylate M+H GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE temp/spectra_filtered.mgf241 -1 GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE.mgf 361077.0 7 0 147.014 554.169 0 CCMSLIB00000851023 366 spectra_filtered.mgf *..* :351 1496 -1 0 341.138 1 0.731117 0 0 82523.0 3160100.0 NCGC00347864-02!5-[6-(3-hydroxy-4-methoxyphenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-3-yl]-2-methoxyphenol M-H2O+H GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE temp/spectra_filtered.mgf366 -1 GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE.mgf 2.59429 8 0 0.00088501 341.139 0 CCMSLIB00000847762 296 spectra_filtered.mgf *..* :262 1887 -1 0 378.176 1 0.729431 0 0 8460.0 596500.0 NCGC00169586-02!7-methyl-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylic acid M+NH4 GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE temp/spectra_filtered.mgf296 -1 GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE.mgf 198500.0 6 0 75.068 303.108 0 CCMSLIB00000848177 849 spectra_filtered.mgf *..* :22686 41149 -1 0 1108.55 1 0.728236 0 0 684.218 872400.0 (2S,3S,4S,5R,6R)-6-[[(3S,4S,6aR,6bS,8R,8aR,9R,10R,12aS,14bR)-10-acetyloxy-8a-(acetyloxymethyl)-8,9-dihydroxy-4-(hydroxymethyl)-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-4-hydroxy-3,5-bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]oxane-2-carboxylic acid [M+NH4]+ MONA temp/spectra_filtered.mgf849 -1 MONA.mgf 489052.0 8 0 542.138 566.412 0 CCMSLIB00004713749 870 spectra_filtered.mgf *..* :751 4527 -1 0 385.273 1 0.726392 0 0 323339.0 821100.0 NCGC00381199-01_C25H38O4_(3aR,5E,7S,10E,14E,16aS)-2,7-Dihydroxy-3-[(2S)-1-hydroxy-2-propanyl]-6,10,14,16a-tetramethyl-4,7,8,9,12,13,16,16a-octahydrocyclopenta[15]annulen-1(3aH)-one M-H2O+H GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE temp/spectra_filtered.mgf870 -1 GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE.mgf 472774.0 8 0 182.147 567.42 0 CCMSLIB00000853579 528 spectra_filtered.mgf *..* :10793 9347 -1 0 190.086 1 0.725608 0 0 7.302 120276000.0 hydrastinine [M-H2O+H]+ CMMC-REFRAME-POSITIVE-LIBRARY temp/spectra_filtered.mgf528 -1 CMMC-REFRAME-POSITIVE-LIBRARY.mgf 689302.0 7 0 131.027 321.113 0 CCMSLIB00012261903 886 spectra_filtered.mgf *..* :83937 83937 -1 0 906.527 1 0.725386 0 0 387.658 19645900.0 NCGC00380368-01!methyl 3,15,21-tris[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]docosanoate [M+NH4]+ MSNLIB-POSITIVE temp/spectra_filtered.mgf886 -1 MSNLIB-POSITIVE.mgf 530841.0 6 0 481.221 425.306 0 CCMSLIB00012435189 246 spectra_filtered.mgf *..* :9181 27644 -1 0 552.244 1 0.725204 0 0 492.265 1199200.0 2-[4-[(3R,3aR,6S,6aR)-3-(3,4-dimethoxyphenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-6-yl]-2-methoxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol [M+NH4]+ MONA temp/spectra_filtered.mgf246 -1 MONA.mgf 324276.0 10 0 179.079 373.165 0 CCMSLIB00004700244 79 spectra_filtered.mgf *..* :21649 21649 -1 0 376.066 1 0.724086 0 0 334.57 7209000.0 2479-49-4 [M+NH4]+ MSNLIB-POSITIVE temp/spectra_filtered.mgf79 -1 MSNLIB-POSITIVE.mgf 409515.0 7 0 154.005 222.061 0 CCMSLIB00012310125 658 spectra_filtered.mgf *..* :22689 41152 -1 0 1091.53 1 0.723653 0 0 590.459 10257900.0 (2S,3S,4S,5R,6R)-6-[[(3S,4S,6aR,6bS,8R,8aR,9R,10R,12aS,14bR)-10-acetyloxy-8a-(acetyloxymethyl)-8,9-dihydroxy-4-(hydroxymethyl)-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-4-hydroxy-3,5-bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]oxane-2-carboxylic acid [M+H]+ MONA temp/spectra_filtered.mgf658 -1 MONA.mgf 625046.0 7 0 682.256 409.274 0 CCMSLIB00004713752 469 spectra_filtered.mgf *..* :92390 92390 -1 0 535.327 1 0.722963 0 0 506.077 1227000.0 CHEBI:181879 [M+H]+ MSNLIB-POSITIVE temp/spectra_filtered.mgf469 -1 MSNLIB-POSITIVE.mgf 239234.0 8 0 128.068 407.259 0 CCMSLIB00012443642 383 spectra_filtered.mgf *..* :18272 30271 -1 0 318.134 1 0.722706 0 0 5979.0 3162700.0 Massbank:PR310505 Piperlongumine M+H MASSBANK temp/spectra_filtered.mgf383 -1 MASSBANK.mgf 367542.0 6 0 116.927 435.061 0 CCMSLIB00005743823 426 spectra_filtered.mgf *..* :18272 30271 -1 0 318.134 1 0.722303 0 0 5979.0 13474300.0 Massbank:PR310505 Piperlongumine M+H MASSBANK temp/spectra_filtered.mgf426 -1 MASSBANK.mgf 367542.0 7 0 116.927 435.061 0 CCMSLIB00005743823 895 spectra_filtered.mgf *..* :22686 41149 -1 0 1108.55 1 0.722061 0 0 684.218 581300.0 (2S,3S,4S,5R,6R)-6-[[(3S,4S,6aR,6bS,8R,8aR,9R,10R,12aS,14bR)-10-acetyloxy-8a-(acetyloxymethyl)-8,9-dihydroxy-4-(hydroxymethyl)-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-4-hydroxy-3,5-bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]oxane-2-carboxylic acid [M+NH4]+ MONA temp/spectra_filtered.mgf895 -1 MONA.mgf 489052.0 9 0 542.138 566.412 0 CCMSLIB00004713749 826 spectra_filtered.mgf *..* :6484 4231 -1 0 331.263 1 0.717752 0 0 16546700.0 3050400.0 Spectral Match to Eicosapentaenoic acid ethyl ester from NIST14 M+H GNPS-NIST14-MATCHES temp/spectra_filtered.mgf826 -1 GNPS-NIST14-MATCHES.mgf 845867.0 9 0 280.205 611.468 0 CCMSLIB00003138718 843 spectra_filtered.mgf *..* :82001 82001 -1 0 702.442 1 0.717043 0 0 602.622 5878500.0 CHEBI:181245 [M+NH4]+ MSNLIB-POSITIVE temp/spectra_filtered.mgf843 -1 MSNLIB-POSITIVE.mgf 169447.0 7 0 119.027 583.415 0 CCMSLIB00012432214 327 spectra_filtered.mgf *..* :19065 19511 -1 0 387.18 1 0.717027 0 0 840923.0 14889000.0 4-[(1R,5R)-6-(3,4-dimethoxyphenyl)-3,7-dioxabicyclo[3.3.0]oct-2-yl]-1,2-dimeth oxybenzene CollisionEnergy:205060 M+H BERKELEY-LAB temp/spectra_filtered.mgf327 -1 BERKELEY-LAB.mgf 46515.8 10 0 18.01 369.17 0 CCMSLIB00010121500 312 spectra_filtered.mgf *..* :1186 19649 -1 0 314.139 1 0.715948 0 0 181.126 318200.0 feruloyltyramine [M+H]+ MONA temp/spectra_filtered.mgf312 -1 MONA.mgf 98956.5 6 0 31.0861 345.225 0 CCMSLIB00004692249 468 spectra_filtered.mgf *..* :4383 22846 -1 0 270.134 1 0.715166 0 0 525.015 923900.0 Methyl 3,4,5-trimethoxycinnamate [M+NH4]+ MONA temp/spectra_filtered.mgf468 -1 MONA.mgf 266938.0 6 0 72.1091 342.243 0 CCMSLIB00004695446 321 spectra_filtered.mgf *..* :56877 56877 -1 0 291.09 1 0.713989 0 0 3259.0 4210000.0 (2R,3R)-2-(3,4-dihydroxyphenyl)-3,4-dihydro-2H-chromene-3,5,7-triol [M+H]+ BMDMS-NP temp/spectra_filtered.mgf321 -1 BMDMS-NP.mgf 274805.0 7 0 79.9931 211.097 0 CCMSLIB00006411177 867 spectra_filtered.mgf *..* :12175 10721 -1 0 871.571 1 0.713855 0 0 71381000.0 5533900.0 Pheophytin a M+H GNPS-LIBRARY temp/spectra_filtered.mgf867 -1 GNPS-LIBRARY.mgf 1153.1 9 0 1.005 870.566 0 CCMSLIB00006678135 455 spectra_filtered.mgf *..* :27259 48240 -1 0 318.134 1 0.713116 0 0 146.572 11041700.0 Piplartine [M+H]+ MONA temp/spectra_filtered.mgf455 -1 MONA.mgf 532944.0 6 0 169.548 487.682 0 CCMSLIB00004720840 224 spectra_filtered.mgf *..* :8330 8776 -1 0 347.103 1 0.71311 0 0 3121720.0 4102800.0 2-amino-6-(hydroxymethyl)-4-naphthyl-8-oxo-4H-pyrano[3,2-b]pyran-3-carbonitril e CollisionEnergy:102040 M+H BERKELEY-LAB temp/spectra_filtered.mgf224 -1 BERKELEY-LAB.mgf 178561.0 6 0 61.9791 285.124 0 CCMSLIB00010110764 403 spectra_filtered.mgf *..* :848 1678 -1 0 177.055 1 0.712911 0 0 5534.0 3407800.0 Spectral Match to trans-Ferulic acid from NIST14 M+H-H2O GNPS-NIST14-MATCHES temp/spectra_filtered.mgf403 -1 GNPS-NIST14-MATCHES.mgf 502818.0 6 0 89.0264 266.081 0 CCMSLIB00003136165 655 spectra_filtered.mgf *..* :22689 41152 -1 0 1091.53 1 0.712279 0 0 590.459 5308200.0 (2S,3S,4S,5R,6R)-6-[[(3S,4S,6aR,6bS,8R,8aR,9R,10R,12aS,14bR)-10-acetyloxy-8a-(acetyloxymethyl)-8,9-dihydroxy-4-(hydroxymethyl)-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-4-hydroxy-3,5-bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]oxane-2-carboxylic acid [M+H]+ MONA temp/spectra_filtered.mgf655 -1 MONA.mgf 625045.0 7 0 682.256 409.274 0 CCMSLIB00004713752 527 spectra_filtered.mgf *..* :447 1406 -1 0 371.149 1 0.707626 0 0 961367.0 6900200.0 NCGC00180457-02!4-(1,3-benzodioxol-5-ylmethyl)-3-[(3,4-dimethoxyphenyl)methyl]oxolan-2-one M+H GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE temp/spectra_filtered.mgf527 -1 GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE.mgf 40477.8 6 0 15.0233 356.126 0 CCMSLIB00000847665 836 spectra_filtered.mgf *..* :12175 10721 -1 0 871.571 1 0.707449 0 0 71381000.0 1884600.0 Pheophytin a M+H GNPS-LIBRARY temp/spectra_filtered.mgf836 -1 GNPS-LIBRARY.mgf 1153.31 9 0 1.00519 870.566 0 CCMSLIB00006678135 745 spectra_filtered.mgf *..* :745 1761 -1 0 391.203 1 0.706958 0 0 147871.0 115910000.0 NCGC00380640-01!5-chloro-2,4-dihydroxy-6-methyl-3-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl]benzaldehyde M+H GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE temp/spectra_filtered.mgf745 -1 GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE.mgf 86809.9 7 0 33.9603 357.243 0 CCMSLIB00000848041 736 spectra_filtered.mgf *..* :4152 543 -1 0 718.537 1 0.705197 0 0 3255490.0 3254200.0 Spectral Match to 1-Hexadecanoyl-2-(9Z-octadecenoyl)-sn-glycero-3-phosphoethanolamine from NIST14 M+H GNPS-NIST14-MATCHES temp/spectra_filtered.mgf736 -1 GNPS-NIST14-MATCHES.mgf 111473.0 14 0 80.0973 638.44 0 CCMSLIB00003135029 611 spectra_filtered.mgf *..* :92390 92390 -1 0 535.327 1 0.704725 0 0 506.077 3877100.0 CHEBI:181879 [M+H]+ MSNLIB-POSITIVE temp/spectra_filtered.mgf611 -1 MSNLIB-POSITIVE.mgf 155235.0 10 0 83.1015 618.429 0 CCMSLIB00012443642 242 spectra_filtered.mgf *..* :22346 22346 -1 0 180.138 1 0.703721 0 0 119.938 1429800.0 Mexiletine [M+H]+ MSNLIB-POSITIVE temp/spectra_filtered.mgf242 -1 MSNLIB-POSITIVE.mgf 910680.0 6 0 164.048 344.186 0 CCMSLIB00012311677 862 spectra_filtered.mgf *..* :3 12340 -1 0 609.272 1 0.703174 0 0 96450000.0 49040300.0 3.10S-Hydroxypheophorbide a M+H GNPS-LIBRARY temp/spectra_filtered.mgf862 -1 GNPS-LIBRARY.mgf 46004.8 9 0 28.0294 637.301 0 CCMSLIB00010128701 187 spectra_filtered.mgf *..* :556 7453 -1 0 571.28 1 0.70281 0 0 1909850.0 3319600.0 1-[(4-hydroxyphenyl)methyl]-6-methoxy-1,2,3,4-tetrahydroisoquinolin-7-ol 2M+H GNPS-LIBRARY temp/spectra_filtered.mgf187 -1 GNPS-LIBRARY.mgf 189392.0 8 0 108.196 463.084 0 CCMSLIB00005724964 762 spectra_filtered.mgf *..* :5001 1826 -1 0 613.483 1 0.702769 0 0 1879820.0 1775800.0 Spectral Match to Dilinolenin (9c,12c,15c) from NIST14 M+H GNPS-NIST14-MATCHES temp/spectra_filtered.mgf762 -1 GNPS-NIST14-MATCHES.mgf 608203.0 10 0 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181.9359 25000.0 182.9436 14000.0 183.9521 18000.0 184.1487 2600.0 185.9274 3300.0 187.9255 19000.0 188.9717 6400.0 190.4268 2700.0 191.9201 66000.0 193.9473 7100.0 194.9435 14000.0 198.5703 2600.0 198.9576 3900.0 203.4747 2600.0 203.9194 12000.0 203.9389 2800.0 204.9279 71000.0 205.9354 2500.0 209.9305 33000.0 219.9144 5300.0 221.9309 92000.0 222.9386 12000.0 224.3337 2400.0 END IONS BEGIN IONS SCANS=4 PEPMASS=244.9471 CHARGE=1 COLLISION_ENERGY=0.0 44.4631 2300.0 46.3288 2200.0 46.9387 2200.0 48.759 4600.0 48.9989 2300.0 49.6719 2200.0 49.9031 2200.0 51.3132 2300.0 51.5103 2300.0 52.249 2200.0 52.3312 2200.0 53.1602 2200.0 55.2373 2300.0 55.3285 2200.0 55.4657 2300.0 55.9344 270000.0 56.0811 2500.0 59.1862 2400.0 60.0906 2300.0 60.6917 3000.0 61.1935 2300.0 63.8319 2900.0 64.5645 2300.0 65.832 2300.0 66.9189 2800.0 67.9957 3100.0 69.7489 2100.0 72.9769 2500.0 75.2225 2700.0 77.1293 2600.0 79.2943 2300.0 82.2237 2500.0 83.4417 2900.0 85.9308 2400.0 86.9928 3600.0 87.6035 2400.0 87.7196 2100.0 88.9163 2400.0 92.639 2900.0 96.5193 3000.0 98.6941 2400.0 99.6545 2300.0 101.976 4100.0 102.1469 2400.0 105.0033 9100.0 107.3847 2300.0 109.8813 2400.0 111.5175 2600.0 111.9094 42000.0 118.3182 2500.0 118.8867 2500.0 118.9862 12000.0 119.9866 23000.0 125.4637 2400.0 127.9041 15000.0 128.9706 2200.0 129.2347 2400.0 129.92 31000.0 129.971 9700.0 131.9353 54000.0 136.0001 5500.0 136.9965 57000.0 137.9972 120000.0 140.1784 2300.0 141.2366 2200.0 141.9208 8400.0 145.9148 85000.0 145.9844 3400.0 146.9225 91000.0 146.9806 17000.0 147.9302 48000.0 147.9818 66000.0 148.9383 150000.0 149.6826 4500.0 149.6928 5500.0 149.9461 65000.0 155.0072 2600.0 156.0073 12000.0 156.6639 2300.0 156.9658 4700.0 157.9666 25000.0 158.4279 2200.0 159.9304 270000.0 162.7523 2300.0 163.6707 2600.0 163.9253 250000.0 163.94 3800.0 164.9332 270000.0 164.9915 50000.0 165.9256 3500.0 165.9411 510000.0 165.9925 150000.0 166.9488 79000.0 167.2271 2600.0 173.528 55000.0 173.5396 35000.0 173.9101 84000.0 173.9793 8700.0 174.9763 72000.0 175.9772 290000.0 177.9412 160000.0 178.8557 2700.0 181.936 460000.0 182.0459 2500.0 182.0711 2400.0 182.9438 350000.0 183.9516 350000.0 184.7391 2400.0 184.9613 3100.0 185.9099 10000.0 185.9616 24000.0 191.9008 5300.0 191.9203 1000000.0 191.9361 7200.0 191.9896 16000.0 192.9866 130000.0 193.9362 20000.0 193.9877 530000.0 202.9713 57000.0 203.8993 3900.0 203.9206 310000.0 203.9724 380000.0 204.0032 2800.0 204.776 2400.0 209.9076 7100.0 209.931 740000.0 209.954 9800.0 212.7159 2700.0 216.0887 2200.0 220.7064 2500.0 220.9818 82000.0 221.8788 3900.0 221.9309 3000000.0 221.9571 11000.0 221.983 470000.0 223.9347 12000.0 227.9418 14000.0 235.3344 2400.0 239.9413 48000.0 241.9969 2400.0 244.9487 3000.0 END IONS BEGIN IONS SCANS=5 PEPMASS=221.9313 CHARGE=1 COLLISION_ENERGY=0.0 43.536 2300.0 47.1735 2500.0 47.6819 2400.0 52.7669 2300.0 54.5471 2300.0 54.6997 2300.0 55.9342 41000.0 55.9567 2300.0 58.0651 6200.0 59.1568 2600.0 63.4673 2300.0 68.124 2200.0 69.8471 2600.0 70.4632 2800.0 73.3325 2300.0 74.6466 2500.0 75.3665 2400.0 80.5591 2200.0 84.8107 2400.0 85.5658 2400.0 91.0538 14000.0 119.0487 2600.0 119.9863 17000.0 125.4487 2300.0 129.8425 2200.0 129.9704 3200.0 130.8529 2400.0 131.9357 2300.0 135.0437 6100.0 135.9996 6800.0 136.9964 30000.0 137.997 100000.0 140.1405 2100.0 145.914 2400.0 146.9805 9200.0 147.9817 47000.0 148.9378 9200.0 149.9454 2800.0 151.2477 2800.0 154.3143 2400.0 155.1219 2400.0 156.0074 10000.0 157.9657 13000.0 159.9303 16000.0 163.9255 22000.0 163.9947 3400.0 164.9334 9100.0 164.9913 16000.0 165.9409 39000.0 165.9923 110000.0 166.949 3600.0 173.5239 15000.0 173.5362 44000.0 173.9804 2700.0 174.9767 4000.0 175.977 120000.0 177.9407 12000.0 181.9357 54000.0 182.944 15000.0 183.9516 15000.0 191.9201 59000.0 191.9898 5800.0 192.9862 13000.0 193.9874 230000.0 203.9724 72000.0 209.9307 38000.0 219.2902 2700.0 221.9308 78000.0 221.9828 99000.0 END IONS BEGIN IONS SCANS=6 PEPMASS=272.9423 CHARGE=1 COLLISION_ENERGY=0.0 46.2772 2300.0 48.8216 2100.0 49.6768 2500.0 49.7211 2200.0 53.7564 2500.0 54.9395 2800.0 55.1708 2400.0 55.3341 2200.0 55.5395 2200.0 55.9342 250000.0 55.9452 3100.0 56.4961 2400.0 58.056 2500.0 61.5151 2500.0 62.4029 2200.0 65.4889 2000.0 65.6388 2800.0 65.6815 2200.0 68.0352 2400.0 75.7279 2400.0 79.8329 2500.0 80.1364 2600.0 85.4859 2300.0 86.9924 6100.0 91.7684 2300.0 96.3038 2200.0 99.6888 2100.0 105.0031 6700.0 106.695 2200.0 110.504 2100.0 110.6316 2300.0 111.3822 2200.0 111.9094 12000.0 120.0916 2700.0 131.9353 20000.0 136.1769 2200.0 144.9228 2600.0 145.0409 2700.0 145.9144 40000.0 146.0304 2600.0 146.9224 51000.0 147.9301 20000.0 147.9414 2600.0 148.4328 2400.0 148.938 76000.0 149.9458 38000.0 152.8641 2500.0 155.8027 3000.0 158.9231 8200.0 159.9303 110000.0 162.992 2500.0 163.9252 110000.0 164.9331 130000.0 165.9408 290000.0 165.954 4900.0 166.9488 79000.0 167.9532 2400.0 169.915 8900.0 173.5249 4900.0 173.5338 73000.0 173.5423 5300.0 173.6501 2200.0 173.9096 39000.0 175.9367 64000.0 176.9331 370000.0 176.9506 2700.0 177.941 130000.0 181.5338 2300.0 181.9358 280000.0 182.9437 250000.0 183.9514 270000.0 186.9178 65000.0 187.9252 420000.0 188.1027 2300.0 191.9201 540000.0 191.9398 5100.0 192.9285 13000.0 193.934 17000.0 193.9472 51000.0 194.9436 240000.0 199.1201 2300.0 200.953 3200.0 201.904 11000.0 203.9208 120000.0 203.9347 4600.0 204.9056 4700.0 204.9279 1500000.0 204.9493 24000.0 205.9358 240000.0 209.9075 10000.0 209.9308 660000.0 209.9542 9900.0 210.9393 8300.0 219.9152 200000.0 221.9308 2900000.0 221.9567 11000.0 221.9817 13000.0 222.9135 19000.0 222.9385 730000.0 223.9342 6300.0 226.7182 3100.0 227.942 27000.0 231.926 15000.0 232.9236 8100.0 234.9645 21000.0 237.9254 53000.0 239.9413 100000.0 243.5209 2500.0 244.9475 25000.0 249.9267 49000.0 250.1465 2400.0 254.2738 2400.0 262.918 25000.0 262.9593 12000.0 276.1037 2700.0 END IONS BEGIN IONS SCANS=7 PEPMASS=336.9014 CHARGE=1 COLLISION_ENERGY=0.0 52.4581 2300.0 60.4387 2100.0 68.3728 2300.0 76.3385 2200.0 96.2359 3100.0 101.1362 2300.0 159.2096 2500.0 171.9507 2400.0 172.9774 2700.0 173.5271 7800.0 173.537 12000.0 190.9883 11000.0 200.9729 20000.0 209.6976 2300.0 212.936 4000.0 218.9837 31000.0 220.9821 8200.0 226.2951 2400.0 230.5443 2500.0 238.0503 2200.0 244.9078 6400.0 246.9183 2800.0 255.0513 2400.0 260.9412 3700.0 262.9193 11000.0 265.7062 3400.0 270.927 9800.0 272.9036 14000.0 273.9042 14000.0 280.9108 4200.0 290.9165 2700.0 291.9143 3400.0 298.9215 37000.0 316.9303 4600.0 343.7459 2800.0 END IONS BEGIN IONS SCANS=8 PEPMASS=260.0104 CHARGE=1 COLLISION_ENERGY=0.0 79.3252 2100.0 84.9596 20000.0 86.9558 2700.0 124.9869 2200.0 134.9989 20000.0 141.3143 2200.0 144.9834 6900.0 146.0298 3900.0 153.0092 3600.0 162.9938 28000.0 172.9784 29000.0 173.5379 19000.0 180.9305 4000.0 182.9634 5500.0 190.9576 2900.0 190.9685 4800.0 190.9887 150000.0 191.0089 2900.0 198.9406 6100.0 200.9732 68000.0 204.0206 12000.0 212.267 2400.0 214.0053 3800.0 215.0816 19000.0 218.9464 3900.0 218.9838 280000.0 231.9701 7300.0 232.0155 39000.0 241.9527 6000.0 242.0917 2600.0 247.0127 2600.0 249.979 4400.0 250.0713 2700.0 259.9653 5200.0 END IONS BEGIN IONS SCANS=9 PEPMASS=218.984 CHARGE=1 COLLISION_ENERGY=0.0 44.4118 2800.0 47.7459 3200.0 48.9832 2300.0 49.2307 2200.0 50.404 2500.0 51.066 2600.0 54.5881 2200.0 56.2209 2300.0 62.7547 2300.0 68.9822 16000.0 70.4684 2700.0 75.5198 2600.0 80.9675 9700.0 82.9827 16000.0 84.9596 41000.0 86.9927 56000.0 87.3321 2300.0 89.6031 2300.0 91.3671 2300.0 92.3268 2700.0 98.9777 170000.0 104.2269 2200.0 104.3814 2200.0 104.6796 2500.0 105.0032 63000.0 108.1228 2300.0 108.9631 23000.0 116.9882 470000.0 118.9925 2500.0 126.9728 130000.0 133.2961 2500.0 134.9988 1700000.0 135.0163 3600.0 136.1255 2200.0 137.003 8900.0 138.9729 13000.0 144.9715 6800.0 144.9832 1000000.0 150.747 2300.0 153.0094 250000.0 153.0231 3300.0 154.9679 240000.0 154.9821 3500.0 156.9719 2400.0 158.0151 4000.0 162.9712 3400.0 162.9938 1800000.0 163.0063 3700.0 164.9982 13000.0 172.9435 13000.0 172.9497 3800.0 172.9656 13000.0 172.9783 2100000.0 173.0133 7900.0 173.5264 8900.0 173.5371 35000.0 174.982 3300.0 177.9353 2900.0 180.9701 2600.0 181.0045 7200.0 182.9629 110000.0 186.0104 3400.0 186.5668 2400.0 190.9371 3900.0 190.9484 7200.0 190.9887 3100000.0 191.0033 10000.0 191.0202 5000.0 191.0296 10000.0 191.6455 2700.0 191.9909 2800.0 192.9931 18000.0 195.9944 4300.0 200.9732 1100000.0 200.9941 5100.0 203.1454 2700.0 212.0156 2700.0 214.0049 15000.0 218.9584 7500.0 218.9839 1300000.0 219.1743 14000.0 220.155 2700.0 223.9882 3100.0 END IONS BEGIN IONS SCANS=10 PEPMASS=270.9461 CHARGE=1 COLLISION_ENERGY=0.0 57.1852 2100.0 65.1515 2700.0 67.4107 2400.0 94.538 3400.0 94.7701 2000.0 116.6482 2200.0 120.2827 2700.0 149.6798 4400.0 149.6916 5400.0 163.9458 3500.0 173.5282 5100.0 173.9804 3500.0 174.9377 4100.0 185.93 6100.0 189.9243 6900.0 191.9898 4800.0 201.9249 3400.0 201.9746 4100.0 202.9327 21000.0 207.936 4400.0 213.9538 2300.0 214.956 5200.0 219.9357 28000.0 219.9857 5400.0 232.9673 19000.0 242.9523 12000.0 260.9625 7100.0 266.2681 2000.0 END IONS BEGIN IONS SCANS=11 PEPMASS=385.8763 CHARGE=1 COLLISION_ENERGY=0.0 66.3013 2000.0 72.5639 2300.0 89.8834 2500.0 93.4654 2500.0 112.7887 2400.0 116.0387 2600.0 165.7143 2500.0 173.5372 11000.0 226.6456 2300.0 240.953 9400.0 241.9524 3200.0 243.9513 3700.0 257.9005 7900.0 258.9651 7100.0 275.9044 4100.0 285.8962 74000.0 302.8991 6000.0 303.9072 14000.0 304.4391 2900.0 312.8836 7700.0 313.8909 28000.0 317.8857 3500.0 320.9082 4000.0 330.8935 29000.0 331.9003 6300.0 335.8987 5400.0 340.8797 4000.0 348.9038 5700.0 357.8812 33000.0 358.8883 20000.0 375.8921 2900.0 376.9012 3800.0 END IONS BEGIN IONS SCANS=12 PEPMASS=201.9743 CHARGE=1 COLLISION_ENERGY=0.0 51.0861 2200.0 51.7642 2400.0 55.9344 3100.0 82.4017 2300.0 86.9923 2500.0 95.9308 2300.0 114.1716 2100.0 117.9888 3100.0 133.9585 2700.0 135.9995 13000.0 144.985 2500.0 145.984 11000.0 163.9946 16000.0 173.5274 15000.0 173.5452 4400.0 173.979 6900.0 177.6848 3100.0 191.9898 11000.0 197.0051 2300.0 202.0758 2200.0 END IONS BEGIN IONS SCANS=13 PEPMASS=220.9816 CHARGE=1 COLLISION_ENERGY=0.0 56.2829 2500.0 100.9752 8100.0 105.003 2800.0 118.9857 20000.0 119.0493 3300.0 123.2931 2300.0 128.9703 3700.0 130.0412 4800.0 134.9987 5300.0 135.0435 3000.0 135.9993 3500.0 136.9962 91000.0 146.9806 41000.0 147.0436 8900.0 149.0609 2600.0 155.0065 19000.0 156.9653 8300.0 160.0524 2500.0 162.0669 7600.0 162.9938 4800.0 163.0389 15000.0 164.9912 110000.0 172.9789 2800.0 173.5315 9800.0 174.9579 5300.0 174.9758 76000.0 175.0397 8400.0 177.0545 2500.0 178.0627 9200.0 184.9601 3400.0 190.062 8900.0 190.9888 4100.0 191.034 5900.0 191.9881 2900.0 192.9864 210000.0 193.0852 4500.0 202.9711 36000.0 220.9817 92000.0 END IONS BEGIN IONS SCANS=14 PEPMASS=243.9975 CHARGE=1 COLLISION_ENERGY=0.0 48.2452 3300.0 48.2474 4000.0 50.7436 2800.0 55.2436 2900.0 67.6687 2100.0 84.98 5200.0 86.9924 6300.0 88.0227 2900.0 88.9523 3100.0 88.9901 5400.0 97.4662 2400.0 99.9782 3000.0 100.9752 36000.0 105.0028 4800.0 107.0009 5900.0 110.9531 2100.0 110.9609 8300.0 111.9683 3000.0 116.9879 7100.0 117.9891 5400.0 118.9858 96000.0 128.9703 28000.0 129.3957 2600.0 134.9987 23000.0 135.9995 25000.0 136.9964 410000.0 139.0006 2500.0 140.9704 5800.0 144.9831 10000.0 145.9838 9400.0 146.9809 230000.0 149.7509 2700.0 153.0087 2800.0 155.0071 56000.0 156.9654 100000.0 157.1405 2200.0 162.9938 20000.0 163.9946 18000.0 164.9916 420000.0 166.9954 4900.0 172.9782 25000.0 173.5353 9800.0 173.9792 30000.0 174.9762 900000.0 175.0117 4300.0 176.9802 3300.0 183.9623 2600.0 184.9609 76000.0 188.0077 3100.0 190.9888 31000.0 191.9898 41000.0 192.9339 3700.0 192.9868 1300000.0 193.0538 3300.0 193.9922 3000.0 194.9911 11000.0 197.9912 4300.0 200.9735 6900.0 201.9744 25000.0 202.9714 940000.0 203.0161 4100.0 203.882 2400.0 204.9764 2900.0 215.9589 3000.0 216.0028 5500.0 218.9839 6600.0 219.985 26000.0 220.9321 4200.0 220.9418 6700.0 220.9821 1000000.0 221.9834 3700.0 222.9862 3500.0 225.9866 4200.0 243.9988 5900.0 END IONS BEGIN IONS SCANS=15 PEPMASS=265.0159 CHARGE=1 COLLISION_ENERGY=0.0 47.391 2100.0 47.7467 39000.0 47.7483 3900.0 50.2424 31000.0 50.2446 7900.0 54.3586 2400.0 54.7454 47000.0 54.7475 8400.0 58.5121 2500.0 62.5281 2400.0 63.5575 2600.0 68.5156 2300.0 68.9825 18000.0 70.4228 2200.0 74.3953 2100.0 75.4429 2300.0 75.6608 2200.0 77.084 2500.0 79.0198 2200.0 80.9676 4300.0 82.983 19000.0 86.9927 67000.0 91.0079 2800.0 94.4168 2300.0 95.8831 2400.0 96.713 2200.0 98.7404 2200.0 98.9778 190000.0 102.402 2500.0 102.5301 2400.0 103.7264 2200.0 105.0032 76000.0 105.5531 2400.0 108.9637 65000.0 110.5262 2100.0 114.4533 2700.0 116.979 4900.0 116.9884 530000.0 125.6883 2300.0 126.9728 160000.0 127.9836 2700.0 134.9898 5200.0 134.9989 2000000.0 135.0087 4900.0 137.0035 14000.0 137.9667 17000.0 138.9733 44000.0 144.9833 1200000.0 144.9938 2800.0 145.0023 3600.0 149.6697 3600.0 149.6805 3600.0 149.6907 6200.0 153.0095 310000.0 153.0233 5800.0 154.9568 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27000.0 218.9338 110000.0 218.945 75000.0 218.9656 120000.0 218.984 14000000.0 219.024 67000.0 219.0338 90000.0 219.0489 22000.0 219.0618 9000.0 219.9895 18000.0 220.9883 57000.0 221.9319 3100.0 223.9285 9000.0 223.9897 51000.0 231.9473 8700.0 232.83 3000.0 232.9994 21000.0 241.9325 9100.0 242.0003 69000.0 END IONS BEGIN IONS SCANS=16 PEPMASS=200.9733 CHARGE=1 COLLISION_ENERGY=0.0 40.2668 2100.0 42.0337 6800.0 42.8274 2600.0 44.4054 2600.0 44.5527 2400.0 46.1446 3300.0 47.3785 4200.0 49.3462 2300.0 51.1805 2900.0 51.9398 13000.0 55.9342 59000.0 56.9369 33000.0 56.942 4200.0 62.8224 3100.0 67.9349 2300.0 72.9369 29000.0 73.6686 2400.0 74.9526 9300.0 79.2948 3600.0 85.6883 2400.0 85.9453 3000.0 86.9922 3500.0 90.9474 74000.0 96.9373 30000.0 98.4185 2400.0 98.9776 6400.0 100.8765 3200.0 102.948 12000.0 105.0032 5400.0 106.0318 3300.0 107.9502 9500.0 113.6128 3300.0 113.9634 23000.0 114.9479 85000.0 114.9712 2800.0 115.979 19000.0 116.9881 28000.0 118.9425 33000.0 121.2772 4000.0 126.9719 2900.0 128.9505 13000.0 129.9524 9700.0 130.9115 2700.0 131.9741 86000.0 132.9585 69000.0 134.9987 140000.0 135.9453 9500.0 136.9537 4100.0 137.0131 2500.0 137.964 40000.0 141.9592 5400.0 144.9832 44000.0 149.9845 7300.0 153.0094 38000.0 155.9747 46000.0 159.9455 7100.0 162.9783 5900.0 162.9938 190000.0 164.3964 3800.0 165.696 2300.0 172.9783 25000.0 173.525 13000.0 173.5383 18000.0 177.9564 15000.0 182.6409 2400.0 190.9889 98000.0 END IONS BEGIN IONS SCANS=17 PEPMASS=223.9894 CHARGE=1 COLLISION_ENERGY=0.0 42.0336 7400.0 42.3178 2000.0 42.4618 2000.0 44.9025 9100.0 46.6222 5300.0 47.0147 4000.0 49.2221 4600.0 49.3655 5000.0 50.8363 2900.0 51.3423 8800.0 51.9397 2900.0 53.7235 7300.0 57.4564 3500.0 58.3933 6700.0 58.6829 6000.0 61.3785 2900.0 63.1007 2100.0 64.3458 2500.0 67.6255 8000.0 68.9825 5400.0 73.1854 9300.0 78.6031 4800.0 78.9521 3800.0 83.305 4100.0 85.9455 6800.0 86.8608 5700.0 90.705 3200.0 92.7739 7700.0 92.8701 3700.0 93.1291 4400.0 94.2074 6900.0 95.2317 5700.0 96.9373 56000.0 98.9773 9500.0 100.0053 5100.0 100.3167 6500.0 102.2223 5900.0 102.948 45000.0 103.9682 7000.0 105.0027 3400.0 113.9634 41000.0 114.9479 190000.0 116.9881 200000.0 117.5337 6700.0 118.139 2500.0 118.9427 3400.0 119.1787 8300.0 121.1667 4600.0 124.5858 4900.0 126.9723 4800.0 131.7192 4800.0 132.9585 140000.0 134.9877 4700.0 134.9987 830000.0 135.2151 7300.0 137.9638 120000.0 138.5668 5000.0 141.959 4700.0 143.0904 2600.0 144.983 150000.0 149.0745 8500.0 153.0092 310000.0 154.967 9300.0 155.9745 330000.0 156.9825 4100.0 159.9455 52000.0 162.9937 1400000.0 171.8854 6900.0 172.9785 190000.0 173.5209 16000.0 173.5302 41000.0 173.5374 120000.0 177.9564 120000.0 181.0043 13000.0 182.9636 2600.0 190.9685 43000.0 190.9886 2000000.0 191.0084 18000.0 195.1494 6400.0 200.9729 71000.0 208.3358 3400.0 218.3919 3000.0 218.9309 6800.0 218.9838 700000.0 END IONS BEGIN IONS SCANS=18 PEPMASS=224.9906 CHARGE=1 COLLISION_ENERGY=0.0 55.6341 3200.0 77.5835 3300.0 78.4419 3600.0 79.4074 3300.0 79.8054 3200.0 83.667 3400.0 88.5534 3300.0 115.4137 3400.0 117.9888 18000.0 133.9588 4300.0 134.9985 18000.0 135.9993 75000.0 145.984 13000.0 153.0088 8700.0 153.4739 3400.0 154.0099 31000.0 162.9935 23000.0 163.9944 130000.0 170.8 3500.0 173.538 21000.0 173.9793 25000.0 190.9885 34000.0 191.9895 220000.0 192.0049 3500.0 192.0103 4900.0 201.9742 5600.0 218.9857 6000.0 219.9845 78000.0 END IONS BEGIN IONS SCANS=19 PEPMASS=241.9999 CHARGE=1 COLLISION_ENERGY=0.0 43.244 21000.0 43.2454 3500.0 45.6908 2600.0 46.8208 2900.0 47.7464 42000.0 47.7485 11000.0 49.7843 3900.0 49.9951 2000.0 50.2421 4100.0 50.2433 25000.0 51.0659 4000.0 51.0684 3400.0 52.6454 2400.0 54.7458 29000.0 54.7476 8900.0 58.0727 2200.0 59.9744 2400.0 60.7064 2800.0 68.9822 36000.0 70.334 2500.0 72.5081 2400.0 79.7936 2200.0 80.9677 14000.0 82.1644 2600.0 82.9827 30000.0 84.9596 78000.0 85.2779 2700.0 86.9926 97000.0 87.504 2400.0 90.8823 2400.0 94.8306 2800.0 95.4531 2400.0 96.9568 3400.0 98.9776 330000.0 102.9703 6200.0 105.0032 110000.0 108.357 2700.0 108.9633 73000.0 109.9714 9800.0 110.9789 2600.0 116.9883 960000.0 118.9928 2600.0 123.0133 3900.0 126.9727 240000.0 127.9813 2900.0 132.5779 3200.0 134.9988 3500000.0 135.0085 26000.0 135.0228 8500.0 136.0042 3600.0 137.0032 30000.0 137.9664 11000.0 138.4567 2600.0 138.9729 37000.0 141.8606 3100.0 144.9832 1800000.0 144.9939 16000.0 146.9881 9200.0 153.0093 550000.0 153.0234 5800.0 154.9526 11000.0 154.9676 750000.0 154.9821 6200.0 155.0148 3200.0 158.0148 17000.0 158.6784 2800.0 162.9617 17000.0 162.9938 4100000.0 163.006 21000.0 163.0187 8600.0 163.0263 13000.0 163.9982 3800.0 164.9985 33000.0 167.9982 3600.0 172.9433 24000.0 172.9504 9500.0 172.9782 6300000.0 173.0065 9200.0 173.0107 66000.0 173.0232 9500.0 173.5268 15000.0 173.5386 22000.0 173.9823 2500.0 174.9829 22000.0 177.0118 3100.0 180.0883 2900.0 180.7744 3200.0 181.0042 5300.0 182.9444 4800.0 182.9628 590000.0 182.9804 5000.0 186.0098 26000.0 186.9939 3800.0 188.9988 2400.0 190.9362 18000.0 190.9483 83000.0 190.9562 35000.0 190.9888 13000000.0 191.0034 60000.0 191.0208 68000.0 191.0295 85000.0 191.0414 31000.0 191.0525 9900.0 191.0756 5000.0 191.9925 21000.0 192.9933 70000.0 194.3332 2700.0 195.9943 24000.0 200.9288 12000.0 200.9732 6600000.0 201.0173 26000.0 202.9767 4500.0 205.0055 6900.0 208.9998 10000.0 213.9584 3800.0 214.0051 75000.0 214.9858 2700.0 218.9196 13000.0 218.9336 48000.0 218.944 22000.0 218.9839 9900000.0 219.0237 50000.0 219.0337 64000.0 219.0482 17000.0 219.062 6200.0 219.989 6700.0 220.9882 38000.0 223.9892 30000.0 231.9698 21000.0 232.9993 14000.0 241.9552 5700.0 241.9999 48000.0 251.8621 2400.0 END IONS BEGIN IONS SCANS=20 PEPMASS=268.9483 CHARGE=1 COLLISION_ENERGY=0.0 59.1 2200.0 59.4118 2500.0 68.7811 2200.0 76.5298 2700.0 84.6393 2400.0 102.9723 2800.0 109.9982 2200.0 118.3204 2700.0 120.9837 6500.0 126.4163 2400.0 130.1564 2400.0 130.4922 3000.0 136.9958 5900.0 137.9971 6200.0 138.9937 34000.0 147.9809 2600.0 148.9782 20000.0 157.004 2800.0 158.9628 15000.0 164.9906 8400.0 165.993 3800.0 166.9889 34000.0 173.524 18000.0 173.5418 16000.0 174.9759 5400.0 175.9769 12000.0 176.9333 16000.0 176.9736 98000.0 186.958 16000.0 190.9891 3300.0 192.9864 14000.0 193.9874 22000.0 194.946 7400.0 194.9843 150000.0 202.9728 4400.0 203.9723 27000.0 204.9285 11000.0 204.969 210000.0 205.0005 2600.0 212.9583 55000.0 217.892 2600.0 217.9371 6500.0 220.9828 8400.0 221.983 30000.0 222.9411 3300.0 222.9798 250000.0 223.0145 2800.0 230.9687 150000.0 230.9952 4900.0 235.9463 2500.0 240.9262 3500.0 240.9532 95000.0 246.9716 2500.0 248.9789 28000.0 258.9634 52000.0 END IONS BEGIN IONS SCANS=21 PEPMASS=286.9591 CHARGE=1 COLLISION_ENERGY=0.0 51.666 2000.0 55.1189 2500.0 64.5549 2400.0 79.7548 2200.0 82.9014 2500.0 87.5198 2300.0 94.3006 2200.0 103.2496 2300.0 129.4578 2400.0 135.0441 3900.0 135.9984 2500.0 136.047 4400.0 142.0597 2700.0 144.0525 4200.0 150.1429 2300.0 155.0739 2200.0 156.0587 2600.0 162.8864 2300.0 172.0482 2900.0 172.9778 8000.0 173.5231 15000.0 173.5322 35000.0 173.5418 14000.0 173.961 3000.0 174.0631 2800.0 176.9331 11000.0 178.4519 2400.0 178.9512 2600.0 187.9256 4500.0 190.9879 20000.0 192.9855 4300.0 194.9475 14000.0 195.0168 3000.0 197.2017 2200.0 201.055 8500.0 202.058 21000.0 202.9724 7300.0 204.9279 31000.0 204.9688 11000.0 205.9363 6100.0 212.9085 2800.0 212.9581 170000.0 217.9363 38000.0 218.9441 3000.0 220.9826 7800.0 221.9307 3400.0 221.9835 6800.0 222.8939 4000.0 222.9415 14000.0 222.98 14000.0 225.7995 2500.0 230.9405 3200.0 230.9687 490000.0 232.9231 2500.0 235.9467 60000.0 240.924 7600.0 240.953 910000.0 240.9816 5400.0 248.9791 110000.0 258.9634 520000.0 258.9949 5600.0 276.9742 14000.0 278.1335 2300.0 281.8661 2800.0 283.3996 2600.0 END IONS BEGIN IONS SCANS=22 PEPMASS=382.9291 CHARGE=1 COLLISION_ENERGY=0.0 59.1292 2200.0 69.5127 2500.0 92.9846 2100.0 94.3095 2300.0 97.3382 3100.0 136.5494 2300.0 149.682 10000.0 149.6929 10000.0 173.5335 11000.0 180.7524 2500.0 194.447 2600.0 202.9704 3400.0 212.9569 3800.0 218.9822 3100.0 220.9816 8000.0 221.983 2700.0 222.944 3100.0 222.9782 5000.0 230.969 8100.0 240.9529 150000.0 246.2632 2300.0 250.5887 2100.0 258.9634 110000.0 262.9159 2900.0 272.9036 7200.0 273.9049 6500.0 276.9742 3000.0 286.9193 2500.0 316.9537 6000.0 327.9662 2400.0 344.9468 4500.0 354.9332 12000.0 360.0296 3400.0 372.944 14000.0 END IONS BEGIN IONS SCANS=23 PEPMASS=400.9397 CHARGE=1 COLLISION_ENERGY=0.0 57.8472 2500.0 70.9126 2500.0 133.6789 2300.0 168.0534 2300.0 173.5296 17000.0 174.0152 2400.0 212.9576 6700.0 222.944 6900.0 230.9687 15000.0 240.9529 400000.0 244.9489 3300.0 248.9791 3800.0 258.9633 280000.0 276.9736 9900.0 298.9442 8800.0 312.1033 2400.0 316.9535 20000.0 326.9388 5300.0 336.9268 6200.0 344.95 10000.0 354.9334 89000.0 354.9835 3700.0 372.8896 5400.0 372.9438 130000.0 END IONS BEGIN IONS SCANS=24 PEPMASS=413.8713 CHARGE=1 COLLISION_ENERGY=0.0 62.0161 2200.0 149.4229 2100.0 173.533 10000.0 200.9722 3600.0 218.985 9800.0 219.9847 2900.0 240.9534 4400.0 272.9038 28000.0 272.933 2900.0 273.9128 8000.0 290.9152 11000.0 291.9236 3200.0 302.8613 2800.0 317.9022 15000.0 330.8948 8000.0 358.8885 6700.0 372.8991 3400.0 386.8842 8600.0 415.9439 2400.0 END IONS BEGIN IONS SCANS=25 PEPMASS=287.9601 CHARGE=1 COLLISION_ENERGY=0.0 52.0742 2600.0 63.609 2400.0 68.5033 2100.0 121.3142 2400.0 135.0439 9500.0 135.792 2200.0 151.4068 2600.0 173.5247 5600.0 173.5419 6100.0 174.2494 2700.0 208.8828 6900.0 213.9586 6800.0 226.8943 4100.0 231.9697 34000.0 236.9475 2900.0 241.9541 46000.0 248.9785 2500.0 249.9803 18000.0 259.9648 52000.0 277.9751 4800.0 END IONS BEGIN IONS SCANS=26 PEPMASS=337.9701 CHARGE=1 COLLISION_ENERGY=0.0 50.627 2200.0 56.2916 2300.0 108.2976 2500.0 118.6811 2300.0 157.4897 2800.0 162.9939 2800.0 172.978 7000.0 173.5321 18000.0 182.9627 4000.0 190.9888 14000.0 200.9731 57000.0 218.9837 74000.0 219.9853 3700.0 248.1794 2100.0 274.9025 3200.0 286.1201 2900.0 292.914 2600.0 299.9235 5600.0 END IONS BEGIN IONS SCANS=27 PEPMASS=232.9234 CHARGE=1 COLLISION_ENERGY=0.0 47.6269 2400.0 65.6772 2700.0 68.0142 2100.0 70.3493 2200.0 72.2663 2400.0 76.2091 2300.0 78.1546 2400.0 84.9596 3400.0 86.9921 2400.0 104.7952 2400.0 105.0034 3100.0 134.9989 8500.0 144.9834 3400.0 148.9378 2700.0 149.683 7500.0 149.6935 3900.0 149.7042 3100.0 156.9673 2400.0 158.9231 10000.0 162.9937 11000.0 166.8239 2500.0 172.9785 14000.0 173.5346 20000.0 176.9331 150000.0 176.9508 4600.0 177.0078 3800.0 178.7468 2300.0 181.9601 2800.0 189.0096 3200.0 190.9887 19000.0 194.9435 42000.0 200.973 6900.0 204.9289 4000.0 209.9565 3000.0 215.459 2300.0 217.8742 2900.0 218.9842 9200.0 232.9981 3400.0 238.7147 2600.0 END IONS BEGIN IONS SCANS=28 PEPMASS=255.9392 CHARGE=1 COLLISION_ENERGY=0.0 44.7156 2800.0 45.1169 2200.0 47.207 2200.0 47.8319 2600.0 48.035 2300.0 48.3423 2100.0 49.4703 2200.0 50.6951 2800.0 50.733 2300.0 50.9395 2200.0 52.7069 2300.0 53.7371 2300.0 54.0024 2600.0 54.9255 2500.0 57.07 10000.0 57.7954 2000.0 58.1122 2400.0 59.5149 2600.0 61.8092 2100.0 63.7898 2400.0 66.404 2300.0 68.1173 2300.0 68.5531 2300.0 68.9817 2700.0 71.8638 2800.0 72.4756 2800.0 73.0467 2200.0 74.9252 2100.0 76.2612 2400.0 76.7204 2300.0 77.3214 2500.0 79.3413 2400.0 79.3854 2800.0 81.1577 2300.0 82.0141 3000.0 85.5447 2600.0 86.9926 32000.0 87.6141 2400.0 89.4009 2500.0 89.4417 2300.0 90.4486 2200.0 91.1328 2400.0 91.2955 2700.0 91.5511 2400.0 92.0078 2600.0 94.9053 2300.0 96.283 2600.0 102.529 2200.0 105.0029 47000.0 107.2291 2500.0 113.4339 2200.0 113.557 2200.0 113.9158 2500.0 115.658 2600.0 127.5197 2500.0 134.9986 13000.0 140.9115 4400.0 144.9828 8100.0 148.3266 2600.0 148.5538 2300.0 148.938 40000.0 149.686 5300.0 151.3167 2500.0 156.8517 2500.0 158.9227 130000.0 160.0279 2500.0 162.9936 50000.0 163.5305 2800.0 165.9001 2300.0 166.8751 2600.0 166.9487 43000.0 166.9896 7500.0 167.8295 2400.0 171.5302 2500.0 172.9781 18000.0 173.5222 7300.0 173.5336 84000.0 173.5424 5200.0 176.9197 6500.0 176.9332 2200000.0 176.9502 8800.0 177.0095 11000.0 178.9376 3500.0 181.9606 5700.0 183.951 2700.0 186.9181 6300.0 186.9378 5500.0 186.9933 4200.0 189.0094 42000.0 189.4721 2400.0 190.9885 86000.0 191.006 3000.0 194.9436 1400000.0 194.9603 3400.0 196.9486 5400.0 199.9386 7600.0 200.9733 35000.0 201.4414 2400.0 204.928 260000.0 204.9485 23000.0 205.0042 44000.0 209.9554 33000.0 214.9335 11000.0 214.9889 31000.0 218.3925 2700.0 218.9837 100000.0 222.9389 130000.0 227.574 2500.0 232.9231 59000.0 232.9992 96000.0 244.5151 2600.0 250.9342 21000.0 251.3318 2500.0 256.2631 12000.0 END IONS BEGIN IONS SCANS=29 PEPMASS=320.8668 CHARGE=1 COLLISION_ENERGY=0.0 50.4709 2400.0 63.1042 2600.0 63.1247 3000.0 69.1382 2600.0 69.2773 2400.0 73.0307 2300.0 74.5823 2100.0 84.911 14000.0 86.0547 2400.0 89.1685 2100.0 103.0529 2400.0 122.9242 65000.0 123.4929 2600.0 130.4718 2800.0 130.7126 2000.0 143.1808 2300.0 143.9992 2500.0 156.1535 2600.0 163.5064 2400.0 173.5255 27000.0 173.5397 30000.0 183.2463 2500.0 186.4155 2400.0 209.3472 2600.0 216.8613 2300.0 256.1477 2600.0 256.1902 2500.0 271.4027 2600.0 312.8198 2600.0 END IONS BEGIN IONS SCANS=30 PEPMASS=352.8164 CHARGE=1 COLLISION_ENERGY=0.0 56.333 2500.0 62.8915 2400.0 66.122 2500.0 80.7956 2500.0 89.5988 2400.0 94.343 2300.0 99.8845 2200.0 103.0372 2700.0 113.968 2400.0 117.3787 2600.0 121.2038 2100.0 122.9241 90000.0 159.6263 2300.0 165.8527 2900.0 173.5232 5400.0 173.5342 48000.0 181.8199 2400.0 186.9726 2500.0 195.1283 2300.0 230.2904 2500.0 237.4402 2400.0 283.8911 2500.0 337.6373 2500.0 END IONS BEGIN IONS SCANS=31 PEPMASS=231.9889 CHARGE=1 COLLISION_ENERGY=0.0 43.7714 2400.0 48.1504 2200.0 55.547 2100.0 69.8936 2100.0 72.2129 2400.0 72.4896 2100.0 84.134 2300.0 84.7078 2500.0 86.5177 2600.0 87.3452 3100.0 92.2878 2500.0 96.1014 2300.0 97.1173 2400.0 121.0078 2400.0 169.7758 2700.0 173.5225 7900.0 173.5333 31000.0 173.5418 7500.0 183.1586 2300.0 188.9773 2200.0 196.5381 2400.0 211.5412 2100.0 END IONS BEGIN IONS SCANS=32 PEPMASS=526.758 CHARGE=1 COLLISION_ENERGY=0.0 65.0164 2600.0 122.9241 750000.0 122.933 11000.0 122.9403 7800.0 122.9443 5300.0 130.3848 2400.0 173.5227 8900.0 173.5417 8600.0 190.9118 47000.0 196.4842 2500.0 206.8859 160000.0 206.9085 5700.0 274.8734 8600.0 290.8484 3000.0 435.5496 2200.0 END IONS BEGIN IONS SCANS=33 PEPMASS=206.8862 CHARGE=1 COLLISION_ENERGY=0.0 49.2519 4000.0 59.2182 3700.0 60.0804 12000.0 72.2776 3000.0 73.2975 5100.0 74.0599 4100.0 94.5934 4400.0 99.091 3100.0 103.5103 4400.0 104.1066 280000.0 104.115 8600.0 107.7283 3900.0 111.6057 3000.0 122.9239 8900.0 173.5261 34000.0 173.5443 13000.0 211.6218 3400.0 END IONS BEGIN IONS SCANS=34 PEPMASS=290.8478 CHARGE=1 COLLISION_ENERGY=0.0 49.9037 7300.0 51.3589 6000.0 52.5731 5000.0 57.3114 6100.0 66.3692 6300.0 70.0648 5900.0 79.9639 5600.0 83.2782 5000.0 110.6243 5700.0 122.9241 3300000.0 122.9329 54000.0 122.945 24000.0 171.3706 7000.0 173.5217 28000.0 173.5392 62000.0 255.3135 7600.0 286.227 6900.0 END IONS BEGIN IONS SCANS=35 PEPMASS=292.8459 CHARGE=1 COLLISION_ENERGY=0.0 53.4614 2500.0 65.8662 2300.0 70.5944 2000.0 71.5144 2200.0 77.976 2300.0 86.5126 2200.0 92.3203 2200.0 94.5549 2200.0 95.1218 2200.0 122.9151 3600.0 122.924 57000.0 124.9125 3400.0 124.9222 52000.0 152.0474 2300.0 163.8323 2400.0 173.5282 8300.0 181.1534 2200.0 190.9615 5500.0 191.9456 13000.0 195.2946 2400.0 208.9722 32000.0 236.0148 2700.0 END IONS BEGIN IONS SCANS=36 PEPMASS=208.8843 CHARGE=1 COLLISION_ENERGY=0.0 48.9552 2500.0 65.5327 2300.0 71.8696 2300.0 94.9295 7000.0 102.294 2500.0 118.2385 2200.0 127.4034 2300.0 149.6839 4800.0 149.6941 4500.0 173.5344 6700.0 185.9216 3800.0 196.2629 2700.0 END IONS BEGIN IONS SCANS=37 PEPMASS=381.08 CHARGE=1 COLLISION_ENERGY=0.0 58.0699 3100.0 59.6669 2400.0 60.7059 3300.0 62.5679 2400.0 65.523 2900.0 69.1319 2500.0 72.9659 2300.0 82.0182 2300.0 98.9379 4600.0 98.9837 2800.0 111.3894 2400.0 115.055 2700.0 128.9867 15000.0 135.0868 2200.0 141.507 3300.0 143.1401 2300.0 156.7794 2300.0 160.8656 2300.0 171.922 3600.0 172.9769 4200.0 173.5292 47000.0 173.5454 3200.0 182.9982 3000.0 192.9166 2900.0 197.0129 3100.0 212.6304 3500.0 214.988 6200.0 218.9831 3900.0 249.9041 3700.0 251.8901 3200.0 267.8828 10000.0 268.8909 3500.0 272.0125 2400.0 279.2061 2300.0 285.8889 3000.0 291.0396 2700.0 293.8969 9800.0 312.057 2400.0 355.508 3000.0 364.807 2300.0 END IONS BEGIN IONS SCANS=38 PEPMASS=705.1858 CHARGE=1 COLLISION_ENERGY=0.0 68.5479 4100.0 78.3512 6200.0 78.3556 9200.0 80.9041 4400.0 89.8706 4200.0 99.7816 4100.0 102.1244 5000.0 128.4084 4400.0 132.2776 4500.0 134.7683 4400.0 144.0109 5400.0 173.5298 49000.0 173.5405 21000.0 198.1193 4500.0 217.8153 5400.0 238.0772 4600.0 276.3061 4700.0 379.038 4900.0 437.0384 5000.0 493.473 4500.0 525.1178 20000.0 543.0364 11000.0 543.1315 1600000.0 543.3257 5500.0 701.1425 4800.0 705.1836 470000.0 END IONS BEGIN IONS SCANS=39 PEPMASS=304.1508 CHARGE=1 COLLISION_ENERGY=0.0 54.1881 2400.0 56.0494 280000.0 56.2099 2600.0 58.0651 280000.0 68.0494 45000.0 70.0651 390000.0 72.0806 36000.0 74.0235 20000.0 74.0599 43000.0 82.065 47000.0 84.0443 19000.0 84.0806 58000.0 85.0284 14000.0 85.076 160000.0 85.6689 2200.0 86.0599 320000.0 86.096 2400.0 88.0393 26000.0 88.0601 2400.0 94.0651 7000.0 96.0445 12000.0 96.0807 29000.0 97.076 7400.0 98.0599 13000.0 98.0963 71000.0 99.0915 18000.0 99.9262 2300.0 100.0392 69000.0 100.0756 16000.0 101.0708 8300.0 102.0549 320000.0 110.06 2700.0 111.0915 48000.0 112.0758 7900.0 113.071 26000.0 113.1074 18000.0 114.0549 2400000.0 114.0629 9100.0 114.0708 8200.0 114.0911 25000.0 124.0656 2800.0 124.0756 180000.0 125.0709 5800.0 127.0866 35000.0 128.0607 3300.0 128.0705 140000.0 129.0658 130000.0 130.0498 55000.0 131.0816 7400.0 139.0866 94000.0 140.0705 24000.0 140.1182 7100.0 141.0661 15000.0 141.1022 570000.0 142.0732 4900.0 142.0862 410000.0 145.0972 97000.0 150.0551 15000.0 151.0866 83000.0 152.2414 3500.0 153.1022 21000.0 157.061 22000.0 157.0972 290000.0 157.1193 3000.0 158.0445 17000.0 158.0813 26000.0 159.1128 69000.0 168.0656 23000.0 168.1132 170000.0 169.0973 74000.0 170.1288 44000.0 171.113 14000.0 173.5255 34000.0 173.5411 26000.0 175.029 3900.0 179.0796 3300.0 179.4686 3000.0 183.0765 15000.0 184.0741 3800.0 184.1082 8000.0 185.043 4200.0 185.0531 21000.0 185.0626 9400.0 185.0778 29000.0 185.0922 4300000.0 185.1306 28000.0 185.1422 8400.0 186.057 3900.0 186.0762 330000.0 196.1082 75000.0 196.1431 11000.0 197.0922 22000.0 203.1028 230000.0 208.8829 3600.0 214.1188 70000.0 215.1028 48000.0 222.124 16000.0 233.484 2600.0 240.1344 89000.0 258.1443 11000.0 259.1286 2800.0 262.9821 2500.0 268.1287 13000.0 286.1404 62000.0 END IONS BEGIN IONS SCANS=40 PEPMASS=242.1026 CHARGE=1 COLLISION_ENERGY=0.0 45.0334 25000.0 48.7359 2500.0 49.6066 2100.0 52.7876 2600.0 53.0384 43000.0 53.0409 3500.0 55.0176 24000.0 57.0333 49000.0 59.0489 4000.0 61.025 4000.0 61.0281 110000.0 63.0357 2300.0 64.7745 2200.0 66.4671 2300.0 69.0332 150000.0 71.0488 18000.0 73.0281 40000.0 80.0434 8900.0 80.0492 4500000.0 80.0543 22000.0 80.0583 110000.0 80.06 20000.0 80.0666 4300.0 81.0332 71000.0 81.0445 6200.0 81.5906 2600.0 83.0124 3300.0 85.0281 390000.0 85.0339 2700.0 87.0437 21000.0 91.0386 14000.0 96.0447 2200.0 97.0281 110000.0 99.0437 18000.0 107.4457 2300.0 109.0282 42000.0 110.0711 10000.0 127.0386 39000.0 134.2751 2900.0 156.8615 2600.0 170.9149 9400.0 173.5317 50000.0 173.5454 7500.0 180.0596 2400.0 187.9191 2600.0 188.9258 3800.0 195.641 2200.0 205.3279 2500.0 216.4029 2700.0 218.6451 2600.0 END IONS BEGIN IONS SCANS=41 PEPMASS=203.1505 CHARGE=1 COLLISION_ENERGY=0.0 41.0386 4900.0 42.0337 3800.0 42.5625 2300.0 43.0289 7900.0 43.0541 6700.0 44.0493 76000.0 46.0651 3500000.0 46.0675 43000.0 46.0686 36000.0 46.0698 16000.0 46.0713 3700.0 46.0727 4000.0 47.7927 2600.0 51.0522 2200.0 55.029 6600.0 55.0541 4700.0 55.9342 140000.0 56.0366 3800.0 56.0493 100000.0 57.0334 2600.0 57.0445 65000.0 58.0647 3300.0 64.4256 2600.0 68.0492 26000.0 70.0597 20000.0 70.0649 12000000.0 70.0716 84000.0 70.0737 46000.0 70.0739 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141.0655 15000.0 142.05 3400.0 143.0529 6400.0 144.0658 3700.0 147.3542 2600.0 148.9774 27000.0 150.4143 3800.0 156.9747 120000.0 157.0973 7800.0 158.0925 100000.0 158.1288 1600000.0 160.0611 2700.0 161.0638 10000.0 161.9809 3600.0 163.4969 5400.0 172.1082 120000.0 173.5238 63000.0 173.5407 72000.0 173.7237 4100.0 174.9858 25000.0 179.9906 50000.0 186.1239 4900.0 191.2231 2500.0 203.0858 9100.0 203.1507 170000.0 END IONS BEGIN IONS SCANS=42 PEPMASS=684.2564 CHARGE=1 COLLISION_ENERGY=0.0 68.7167 2300.0 69.0331 160000.0 71.0488 15000.0 71.0756 2200.0 73.0281 210000.0 73.2037 2500.0 73.4729 2300.0 76.1077 2200.0 79.9383 2500.0 81.0332 37000.0 82.0885 2200.0 83.8124 2200.0 85.0281 3000000.0 85.0336 13000.0 85.0374 22000.0 87.0438 28000.0 87.8495 2100.0 90.2567 2300.0 90.9476 2200.0 91.0387 1600000.0 91.0447 7500.0 93.4812 2200.0 95.0638 3300.0 97.0281 1300000.0 97.0347 6500.0 98.9289 2300.0 99.0437 150000.0 101.0229 3800.0 101.4097 2500.0 102.4825 2400.0 103.0387 120000.0 104.068 2800.0 108.203 2400.0 109.0205 3500.0 109.028 160000.0 112.2835 2300.0 115.0387 120000.0 117.0544 49000.0 123.4915 2200.0 127.0387 2000000.0 127.0475 40000.0 130.0498 5500.0 133.1836 2400.0 138.4641 2300.0 139.0388 2500.0 142.0021 2100.0 145.0493 2600000.0 145.0596 40000.0 148.06 6500.0 149.6902 5300.0 157.2183 2700.0 163.0437 7600.0 163.0601 1600000.0 167.9391 2300.0 169.0496 4400.0 173.5191 2800.0 173.5345 110000.0 173.5486 2500.0 174.235 2400.0 182.2655 3300.0 211.0605 2700.0 229.0708 9900.0 241.0703 19000.0 247.1091 2400.0 248.6729 2800.0 249.2995 2400.0 251.7856 3000.0 256.7496 2500.0 259.4573 2300.0 271.0811 20000.0 289.0938 2300.0 289.9689 2600.0 292.956 2100.0 296.4577 2600.0 298.963 2400.0 302.7986 2300.0 325.1133 21000.0 342.2433 2500.0 361.3881 2400.0 402.7353 2500.0 470.6229 2400.0 508.5574 2600.0 510.1204 2800.0 603.5557 3500.0 END IONS BEGIN IONS SCANS=43 PEPMASS=543.1328 CHARGE=1 COLLISION_ENERGY=0.0 63.6624 2200.0 66.7671 2300.0 66.8164 2000.0 70.2643 2400.0 78.9006 2400.0 104.9882 2600.0 105.106 2500.0 111.4681 2500.0 124.2568 2100.0 146.7687 2300.0 149.6686 3000.0 149.6878 11000.0 149.6966 3700.0 162.9424 2400.0 173.5354 25000.0 184.0735 3400.0 196.1144 2400.0 196.4873 2600.0 197.9621 2700.0 210.0505 2600.0 212.1544 2300.0 236.8719 2300.0 259.0003 3000.0 260.9927 2400.0 261.9883 3000.0 272.1903 2500.0 291.0392 13000.0 294.0061 3500.0 334.6439 2400.0 381.0799 100000.0 389.4751 2900.0 474.2448 2600.0 496.651 2700.0 499.1695 3000.0 543.1325 91000.0 END IONS BEGIN IONS SCANS=44 PEPMASS=487.1663 CHARGE=1 COLLISION_ENERGY=0.0 61.0281 63000.0 62.8221 2500.0 69.0331 13000.0 72.8888 2800.0 73.0281 21000.0 84.0442 5400.0 85.0226 3900.0 85.0279 180000.0 88.2228 2400.0 89.0442 2400.0 91.0386 100000.0 97.0278 67000.0 99.0437 4700.0 101.5377 2800.0 109.0281 12000.0 115.0388 3600.0 116.4145 2200.0 116.6616 2400.0 117.3942 2400.0 127.0386 65000.0 129.0653 2400.0 130.0497 4600.0 138.364 2200.0 142.2638 2400.0 145.0493 57000.0 150.0538 2600.0 153.2968 2200.0 162.0019 2300.0 163.0601 13000.0 173.5275 31000.0 173.9597 2700.0 182.0268 21000.0 190.0309 2400.0 191.0165 9800.0 201.193 2700.0 208.0427 16000.0 208.9537 21000.0 215.9717 3000.0 216.9752 6700.0 228.9755 3600.0 250.6823 2400.0 275.9924 21000.0 276.9962 42000.0 279.9542 2600.0 294.0433 3400.0 384.1469 3200.0 END IONS BEGIN IONS SCANS=45 PEPMASS=505.1767 CHARGE=1 COLLISION_ENERGY=0.0 60.5755 2600.0 61.0281 120000.0 64.9057 2200.0 66.988 2200.0 69.0332 23000.0 73.0281 39000.0 76.7513 2400.0 82.0982 2900.0 83.5284 2300.0 85.028 370000.0 88.2153 2700.0 88.2334 2100.0 90.1782 2500.0 91.0326 3900.0 91.0386 230000.0 94.4126 2700.0 95.8801 2300.0 97.028 140000.0 99.0439 16000.0 102.3631 2600.0 109.028 19000.0 111.2539 2300.0 115.0389 12000.0 115.746 2300.0 117.0548 2800.0 118.816 2900.0 127.0386 140000.0 130.0497 8700.0 130.464 2400.0 133.0607 6600.0 134.6072 2800.0 141.9599 2500.0 145.0492 160000.0 145.2476 2800.0 147.136 2400.0 148.06 3400.0 149.6783 2700.0 149.6884 4800.0 157.0602 5600.0 163.0597 57000.0 173.5356 61000.0 199.0706 3000.0 203.9034 8500.0 208.8821 3200.0 322.091 2400.0 325.3924 2400.0 335.5798 2500.0 342.9617 2700.0 349.6082 2900.0 384.1264 2300.0 421.7951 2400.0 END IONS BEGIN IONS SCANS=46 PEPMASS=258.1102 CHARGE=1 COLLISION_ENERGY=0.0 45.0333 170000.0 55.7994 2800.0 56.0494 7800.0 57.0333 40000.0 58.0651 71000.0 59.073 10000.0 60.0806 1400000.0 60.084 12000.0 62.9021 2300.0 64.4529 2900.0 67.7674 2400.0 70.0651 2400.0 71.0726 220000.0 75.0438 17000.0 77.8912 2300.0 79.5246 3400.0 83.723 2900.0 85.0283 2700.0 86.0961 3100000.0 86.1021 15000.0 86.1054 38000.0 91.2532 2700.0 93.173 2600.0 97.028 11000.0 98.9838 260000.0 100.9227 2500.0 104.0975 42000.0 104.1067 14000000.0 104.1207 71000.0 104.1209 300000.0 104.1229 41000.0 104.1325 33000.0 124.9995 4300000.0 125.0083 76000.0 125.0206 22000.0 130.1949 2500.0 141.9003 5900.0 143.01 3300.0 158.0322 2400.0 158.0952 2400.0 169.0496 3200.0 173.5243 83000.0 173.5319 32000.0 173.5428 64000.0 181.0263 32000.0 184.0734 2400000.0 199.0356 2700.0 221.2243 5100.0 223.1987 3100.0 240.0991 15000.0 243.2221 5700.0 258.1105 44000.0 265.1429 6600.0 END IONS BEGIN IONS SCANS=47 PEPMASS=558.0887 CHARGE=1 COLLISION_ENERGY=0.0 61.0282 2800.0 64.6569 2400.0 65.9038 2500.0 66.047 2000.0 66.693 2200.0 67.3241 2200.0 67.8335 2700.0 70.6678 2400.0 71.4911 2000.0 74.0502 2200.0 75.9925 2200.0 77.5982 2100.0 85.0284 12000.0 87.2961 2100.0 91.0387 5800.0 92.4288 2300.0 95.1028 2500.0 96.9852 2600.0 97.0283 6700.0 103.3957 2400.0 103.8177 2700.0 112.5367 2400.0 113.1591 2700.0 113.3861 2700.0 113.9413 4400.0 116.3593 2300.0 117.8623 2600.0 120.4019 2400.0 130.4902 2500.0 131.0637 2500.0 131.3353 2400.0 131.9503 63000.0 143.9506 7500.0 144.9583 30000.0 145.966 27000.0 149.6766 2900.0 149.6854 17000.0 149.6954 11000.0 149.7073 3000.0 149.9607 6200.0 156.9797 2300.0 157.9661 35000.0 161.9615 30000.0 163.9769 9600.0 169.9668 15000.0 171.9216 3100.0 173.5264 79000.0 173.5399 60000.0 173.944 3500.0 173.9612 300000.0 174.9689 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275.993 880000.0 276.0278 12000.0 276.9638 3200.0 277.0007 750000.0 277.0351 3800.0 277.4905 3000.0 278.0096 2500.0 279.0931 14000.0 280.0968 20000.0 284.6137 2600.0 287.993 38000.0 289.001 180000.0 290.0074 3500.0 294.0036 54000.0 295.0108 7700.0 301.0006 5500.0 302.0088 52000.0 306.0034 42000.0 307.0113 130000.0 312.2621 2600.0 319.0111 15000.0 320.019 83000.0 323.0068 4700.0 325.9925 8900.0 336.0137 160000.0 337.0219 280000.0 338.03 21000.0 343.9586 3500.0 349.021 15000.0 366.1698 2400.0 378.0261 12000.0 378.977 8200.0 379.0324 620000.0 396.0349 250000.0 397.0433 97000.0 427.9508 2700.0 439.0531 77000.0 440.9495 2800.0 486.2583 2600.0 506.6147 2400.0 531.4609 2600.0 END IONS BEGIN IONS SCANS=48 PEPMASS=527.1586 CHARGE=1 COLLISION_ENERGY=0.0 71.6231 2500.0 79.5252 2100.0 86.2059 2200.0 107.6391 2300.0 139.0715 2300.0 141.6462 2500.0 149.6828 3900.0 149.6937 5600.0 173.5263 3800.0 185.0415 7000.0 203.0522 12000.0 210.6463 2300.0 347.0948 12000.0 365.1047 470000.0 527.1572 63000.0 END IONS BEGIN IONS SCANS=49 PEPMASS=522.2034 CHARGE=1 COLLISION_ENERGY=0.0 61.0281 590000.0 62.9801 2200.0 65.1656 2400.0 65.5097 2500.0 69.0332 280000.0 69.5968 2500.0 70.3159 2300.0 71.0489 26000.0 73.0281 250000.0 73.3892 2500.0 81.0332 44000.0 82.1732 2400.0 85.0281 3400000.0 85.0342 13000.0 85.0374 30000.0 85.04 12000.0 87.0437 22000.0 91.0387 1400000.0 91.0449 4900.0 92.8474 2600.0 97.0281 1300000.0 97.0348 6000.0 98.0074 2100.0 99.0438 150000.0 101.0233 17000.0 103.0387 84000.0 104.0706 2800.0 107.6199 2300.0 109.0206 3700.0 109.0281 210000.0 115.0387 110000.0 117.0544 38000.0 117.7202 2600.0 127.028 5500.0 127.0387 2100000.0 127.0474 39000.0 127.0602 4700.0 130.2876 2900.0 134.344 2500.0 145.0494 2300000.0 145.0596 42000.0 145.0756 5100.0 160.8831 2300.0 163.0601 1100000.0 163.7284 2300.0 166.1016 2500.0 173.5253 100000.0 173.5435 41000.0 176.213 2500.0 179.2782 2300.0 184.6613 2200.0 206.8352 2800.0 211.5701 3200.0 222.3943 2400.0 231.4136 2400.0 232.5923 3000.0 237.8654 2300.0 241.0714 14000.0 246.8499 2100.0 253.0725 2400.0 271.082 2700.0 278.2887 2300.0 298.3737 2700.0 325.1149 2300.0 457.4796 2300.0 463.0646 3100.0 466.6128 2600.0 470.9329 2700.0 474.9734 2600.0 END IONS BEGIN IONS SCANS=50 PEPMASS=490.177 CHARGE=1 COLLISION_ENERGY=0.0 58.9969 2400.0 65.9915 2700.0 66.1955 2300.0 68.2927 2100.0 69.0329 2300.0 72.0804 28000.0 72.7995 2200.0 73.397 2200.0 76.0019 2300.0 76.7716 2100.0 79.4446 2300.0 84.0441 1500000.0 84.0527 24000.0 84.0532 8200.0 85.0282 40000.0 88.1339 2200.0 91.3003 2100.0 93.4608 2200.0 95.8387 2500.0 102.0546 920000.0 102.0618 4600.0 102.0906 6700.0 105.6548 2700.0 111.7617 2200.0 112.0343 2400.0 116.6058 2500.0 127.0388 3800.0 130.0336 3200.0 130.0495 1900000.0 130.0591 23000.0 130.8713 2600.0 131.0338 22000.0 136.24 2300.0 137.8505 2400.0 137.9807 2300.0 139.5491 2500.0 148.0601 3400000.0 148.0712 62000.0 148.0888 7600.0 148.0946 33000.0 155.9381 2500.0 156.1931 2100.0 169.9293 6100.0 173.5322 96000.0 178.2268 2100.0 183.7029 2600.0 203.9831 8000.0 212.9361 14000.0 230.9466 6000.0 246.4849 2500.0 247.9835 12000.0 271.9844 6000.0 275.1957 2500.0 283.9857 2900.0 305.8323 2300.0 314.3346 2600.0 345.8247 3600.0 377.6254 2500.0 404.9819 2300.0 407.4335 2300.0 417.067 2600.0 495.6085 2700.0 495.9007 2900.0 END IONS BEGIN IONS SCANS=51 PEPMASS=261.0371 CHARGE=1 COLLISION_ENERGY=0.0 45.0334 9600.0 53.0385 11000.0 55.0177 7900.0 55.9342 2300.0 56.7413 2300.0 57.0333 30000.0 57.3165 2300.0 59.5699 2700.0 60.7272 2800.0 61.0281 44000.0 65.7232 2200.0 67.0085 2000.0 69.0331 78000.0 69.4195 2500.0 71.0489 9400.0 71.3299 3100.0 73.0281 12000.0 75.367 2300.0 76.5573 2300.0 81.0292 2300.0 81.0331 41000.0 84.044 9200.0 85.028 360000.0 85.0342 2400.0 85.9191 2900.0 87.044 9100.0 91.039 8400.0 97.0213 3500.0 97.0279 120000.0 98.9839 890000.0 98.9927 14000.0 99.0436 17000.0 105.7278 2300.0 109.0281 39000.0 127.0387 41000.0 134.1994 2300.0 145.0495 3600.0 157.0468 11000.0 165.358 2500.0 170.9138 5100.0 171.9217 4400.0 173.5307 38000.0 178.9231 2400.0 196.9769 12000.0 200.0464 2400.0 249.9807 2100.0 END IONS BEGIN IONS SCANS=52 PEPMASS=343.1239 CHARGE=1 COLLISION_ENERGY=0.0 50.4143 2500.0 51.1651 2100.0 51.473 2800.0 51.5205 2100.0 53.5112 2100.0 53.7342 2200.0 53.7943 2200.0 55.0177 31000.0 57.0332 33000.0 61.0281 140000.0 61.8155 2400.0 63.0266 2300.0 67.1742 2900.0 69.0331 140000.0 69.9013 2400.0 70.8352 2100.0 71.0488 8200.0 72.0559 2900.0 73.0281 56000.0 78.2266 2200.0 80.0498 2700.0 81.0332 30000.0 82.1571 2400.0 85.0279 560000.0 86.0315 4200.0 86.2455 2400.0 87.0436 2500.0 89.3726 2500.0 89.6925 2100.0 89.7088 2300.0 91.0386 110000.0 96.9791 2200.0 97.0214 3100.0 97.0281 160000.0 97.096 2300.0 97.8688 2300.0 98.9126 2600.0 99.0438 38000.0 101.023 11000.0 102.2965 2500.0 108.1261 2700.0 109.0281 55000.0 115.0388 15000.0 120.3658 2300.0 124.9997 2800.0 127.0386 220000.0 128.042 5600.0 130.4353 2800.0 140.1935 3000.0 142.3426 2500.0 145.0491 50000.0 149.672 3200.0 149.6821 8000.0 149.6927 10000.0 149.7039 3000.0 151.4154 2300.0 173.5287 70000.0 173.5432 15000.0 182.7668 2500.0 188.5412 2300.0 190.2748 2300.0 199.4857 2700.0 199.4977 2500.0 303.5098 2800.0 313.433 2400.0 313.7907 2400.0 326.7228 2700.0 END IONS BEGIN IONS SCANS=53 PEPMASS=325.1135 CHARGE=1 COLLISION_ENERGY=0.0 49.6054 2300.0 50.1282 2500.0 50.5862 2300.0 50.5959 2200.0 53.0384 23000.0 55.0176 94000.0 55.9343 10000.0 57.0333 140000.0 57.2996 2200.0 57.8988 2300.0 58.7266 2600.0 60.8404 2700.0 61.0281 720000.0 65.7981 2500.0 69.0332 400000.0 70.9611 2400.0 71.0126 2600.0 71.0488 21000.0 73.0281 260000.0 77.3991 2300.0 80.8212 2400.0 81.0332 74000.0 83.8827 2200.0 84.4645 2400.0 85.028 1400000.0 85.036 7000.0 86.0314 2500.0 87.0437 20000.0 90.5097 2300.0 90.5182 2500.0 90.9473 12000.0 91.0386 370000.0 91.1724 2200.0 92.4834 2500.0 93.4094 2200.0 94.4748 2200.0 96.2306 2400.0 97.0215 2900.0 97.028 510000.0 97.3674 2600.0 97.7035 2200.0 97.7679 2300.0 99.0437 110000.0 101.023 44000.0 103.0387 9100.0 107.109 2500.0 107.9505 2500.0 109.028 110000.0 112.4598 2400.0 115.0387 36000.0 117.7027 3300.0 122.9936 2400.0 124.7723 2400.0 125.021 2800.0 127.0285 8100.0 127.0386 410000.0 131.9504 13000.0 132.9583 11000.0 138.0543 6200.0 142.2259 2300.0 142.7735 2200.0 143.951 2200.0 144.045 2500.0 144.9577 24000.0 145.0072 11000.0 145.0492 81000.0 145.9611 7900.0 147.7819 2300.0 149.472 2500.0 149.6829 4500.0 149.6931 4000.0 154.6547 2400.0 157.9659 17000.0 158.9688 21000.0 161.9616 3300.0 162.9642 6500.0 166.9625 2300.0 167.3524 2300.0 169.679 2200.0 171.9226 2900.0 173.521 17000.0 173.5312 140000.0 173.5414 43000.0 173.9359 2300.0 173.9608 12000.0 174.9643 3100.0 175.9717 3500.0 176.106 2500.0 176.7 2600.0 178.5184 2300.0 180.5246 2300.0 181.1691 2300.0 181.2053 2400.0 185.9609 14000.0 186.966 49000.0 187.9719 12000.0 188.6366 2600.0 188.978 2700.0 192.9936 2900.0 195.2649 2300.0 198.9638 4800.0 202.3826 3000.0 204.5361 2500.0 204.9734 2600.0 206.8874 6800.0 207.6599 2500.0 211.5447 2300.0 214.9947 2500.0 216.9753 8000.0 220.9355 2300.0 222.9302 5700.0 224.8978 2600.0 233.076 3100.0 234.9878 14000.0 237.4854 3000.0 244.8742 20000.0 249.2081 2400.0 252.9968 5900.0 260.8547 2600.0 299.714 2500.0 306.7525 2300.0 316.385 2300.0 END IONS BEGIN IONS SCANS=54 PEPMASS=233.9826 CHARGE=1 COLLISION_ENERGY=0.0 46.1378 2100.0 55.9342 14000.0 67.0316 2300.0 67.5583 2400.0 71.9293 2700.0 72.937 3600.0 73.0281 10000.0 73.9452 2900.0 81.0336 2200.0 90.9476 8000.0 101.0094 2400.0 102.6025 2400.0 107.9505 3400.0 131.9502 33000.0 132.9579 5200.0 133.9657 4400.0 144.9578 19000.0 145.9657 6800.0 149.9606 7200.0 152.0703 4200.0 173.5359 21000.0 180.9359 2700.0 192.9377 4400.0 196.9332 4800.0 210.9481 3500.0 END IONS BEGIN IONS SCANS=55 PEPMASS=204.087 CHARGE=1 COLLISION_ENERGY=0.0 41.0385 4600.0 42.0337 13000.0 43.0177 21000.0 44.0494 8500.0 45.0334 7200.0 46.8886 2400.0 49.9228 2100.0 53.0383 4900.0 55.0177 6900.0 55.0541 3900.0 55.9341 83000.0 56.0493 9100.0 56.9346 23000.0 57.0333 10000.0 59.597 2200.0 60.0441 22000.0 61.0281 30000.0 68.0492 110000.0 69.0332 22000.0 70.0648 24000.0 71.0489 7400.0 71.929 18000.0 72.044 13000.0 72.9297 3900.0 72.9361 30000.0 73.0281 9200.0 73.5913 2200.0 76.05 2200.0 76.5386 2200.0 80.0492 12000.0 81.0332 13000.0 84.0441 130000.0 85.0281 15000.0 89.9395 20000.0 90.9465 27000.0 94.0646 3900.0 96.038 4100.0 96.044 120000.0 97.0279 130000.0 98.0597 32000.0 99.0434 3700.0 100.0388 3300.0 103.0389 4100.0 107.9502 26000.0 108.0442 3300.0 108.9508 9500.0 109.0281 12000.0 110.0598 26000.0 112.0755 12000.0 113.9635 14000.0 114.0476 3000.0 114.0547 47000.0 114.9713 6700.0 122.0599 4400.0 123.1784 2300.0 124.0395 5700.0 124.0752 24000.0 125.9609 10000.0 126.0455 3200.0 126.0544 76000.0 127.039 3900.0 128.9504 16000.0 129.9526 15000.0 130.9663 10000.0 131.9503 13000.0 131.9672 13000.0 138.0547 74000.0 140.0703 2900.0 144.0653 55000.0 144.9581 4800.0 149.9599 3100.0 149.979 2300.0 156.065 6000.0 158.0814 13000.0 168.0654 12000.0 173.5276 26000.0 173.5455 3700.0 175.6997 2300.0 180.8881 13000.0 186.0763 2900.0 204.0878 4300.0 204.1384 9900.0 END IONS BEGIN IONS SCANS=56 PEPMASS=353.952 CHARGE=1 COLLISION_ENERGY=0.0 55.4746 2200.0 55.9342 49000.0 56.8948 2500.0 56.942 2900.0 59.9813 2200.0 69.9497 3500.0 71.0125 3300.0 71.9291 8100.0 72.9368 24000.0 73.0284 2700.0 73.9447 17000.0 87.9604 7600.0 89.9396 8600.0 90.9473 56000.0 91.9551 12000.0 93.6787 2300.0 99.9593 2200.0 102.9475 19000.0 105.9345 15000.0 106.9422 8000.0 107.9501 25000.0 108.9581 6500.0 112.7161 2200.0 113.9395 12000.0 115.9553 14000.0 116.9632 3700.0 117.9707 3500.0 118.9423 6900.0 120.9581 5800.0 125.9607 12000.0 126.9475 3900.0 127.9552 92000.0 128.963 21000.0 129.9709 3800.0 130.9423 7300.0 131.9501 170000.0 132.9579 27000.0 133.9657 42000.0 142.9425 5100.0 143.9501 30000.0 144.9579 130000.0 145.9539 3600.0 145.9658 110000.0 149.9607 28000.0 151.9763 21000.0 155.9503 15000.0 157.5339 2500.0 157.9658 65000.0 159.945 12000.0 160.9528 9500.0 161.9606 40000.0 162.9684 15000.0 163.9768 5800.0 171.9451 55000.0 172.9532 5300.0 173.5246 9200.0 173.5361 16000.0 173.9609 100000.0 177.9562 13000.0 183.9452 50000.0 187.9401 18000.0 188.9479 18000.0 189.9557 120000.0 190.9637 17000.0 191.9714 5800.0 199.9413 4100.0 201.956 9300.0 203.9354 23000.0 204.9433 2500.0 217.951 23000.0 263.9573 3200.0 END IONS BEGIN IONS SCANS=57 PEPMASS=305.9676 CHARGE=1 COLLISION_ENERGY=0.0 48.2816 2900.0 50.2798 2100.0 51.459 2200.0 55.0176 16000.0 55.9342 160000.0 56.0255 4300.0 57.0333 22000.0 60.0443 3700.0 61.0283 27000.0 68.0255 13000.0 68.0912 2500.0 69.0334 16000.0 69.9498 16000.0 70.1212 2200.0 71.929 36000.0 72.9369 69000.0 73.0281 11000.0 73.9446 28000.0 74.9527 4300.0 81.0331 10000.0 81.9497 3000.0 84.0203 34000.0 84.0442 16000.0 85.0232 3800.0 85.0281 120000.0 87.9604 23000.0 89.9396 25000.0 90.9379 3000.0 90.9474 200000.0 91.9554 18000.0 97.028 6800.0 98.0598 9600.0 99.9603 13000.0 102.031 3400.0 102.9474 48000.0 105.9344 26000.0 106.0496 21000.0 107.9502 41000.0 108.958 18000.0 113.94 10000.0 115.9552 11000.0 116.9635 7300.0 117.9709 6500.0 118.2689 2200.0 118.9424 25000.0 120.9584 12000.0 123.9451 12000.0 124.3906 2200.0 125.9606 17000.0 126.9476 14000.0 127.9553 57000.0 128.9631 52000.0 129.9707 7900.0 130.05 3800.0 130.9424 3900.0 131.9391 4900.0 131.9502 200000.0 131.9875 2900.0 132.958 74000.0 133.9659 38000.0 135.9455 6400.0 136.953 11000.0 139.9556 9200.0 141.9707 11000.0 142.9425 8500.0 143.9503 32000.0 144.0413 19000.0 144.9449 3700.0 144.9581 320000.0 144.9718 5500.0 145.9659 75000.0 146.9735 11000.0 148.9532 19000.0 149.9609 84000.0 150.9687 19000.0 151.9764 28000.0 155.0808 3700.0 155.9502 62000.0 156.9581 49000.0 157.9659 280000.0 157.9783 2500.0 158.9738 9100.0 159.9452 40000.0 160.9531 18000.0 161.9607 77000.0 162.9688 40000.0 163.9765 3000.0 168.9583 25000.0 169.9661 65000.0 170.9748 2300.0 171.9453 34000.0 172.9532 4900.0 173.5244 19000.0 173.539 20000.0 173.961 210000.0 174.9688 34000.0 175.9767 96000.0 177.9559 25000.0 180.8589 2600.0 185.961 140000.0 186.2222 2400.0 186.9689 76000.0 187.9767 41000.0 191.9716 54000.0 193.9878 7600.0 197.961 37000.0 203.9718 41000.0 209.9607 8600.0 210.9323 9800.0 211.9772 7400.0 215.9719 75000.0 220.0366 20000.0 220.3303 2400.0 221.0809 13000.0 227.9718 18000.0 233.9823 28000.0 235.0601 27000.0 259.8308 2200.0 275.2459 2800.0 289.1467 2500.0 293.3437 2300.0 301.868 2200.0 END IONS BEGIN IONS SCANS=58 PEPMASS=323.9782 CHARGE=1 COLLISION_ENERGY=0.0 53.1308 2100.0 55.0177 3000.0 55.3832 2200.0 55.9342 57000.0 57.0334 2800.0 59.3204 2400.0 63.3699 2500.0 63.6756 2600.0 63.8586 2100.0 67.8879 2300.0 68.0254 13000.0 69.0333 5600.0 69.9499 4800.0 71.9291 13000.0 72.7821 2700.0 72.9369 25000.0 73.9447 6400.0 75.4104 2200.0 81.0331 3500.0 82.2139 2800.0 84.882 2300.0 85.0282 23000.0 85.1393 2300.0 87.9603 8100.0 89.9397 13000.0 90.9474 52000.0 91.9555 3400.0 97.0283 7100.0 100.8327 2600.0 102.9475 13000.0 103.9556 2800.0 104.9286 2600.0 105.9343 8200.0 107.9502 23000.0 108.9577 3200.0 113.9405 3500.0 114.9476 3200.0 115.9549 5600.0 116.9639 8800.0 118.9423 5300.0 125.9608 5100.0 126.948 3400.0 127.9554 17000.0 128.9631 16000.0 129.1199 2300.0 129.9715 2200.0 131.9502 100000.0 131.9862 2700.0 132.958 49000.0 133.9658 19000.0 135.9438 2700.0 136.9538 4800.0 139.9553 14000.0 141.3861 2500.0 141.9702 3600.0 142.9427 3700.0 143.9505 26000.0 144.0414 3400.0 144.9581 120000.0 145.9659 41000.0 147.7284 2500.0 149.961 38000.0 150.9685 2500.0 151.9763 5200.0 153.075 2400.0 155.9501 36000.0 156.9584 20000.0 157.9659 250000.0 159.9449 18000.0 160.9537 9200.0 161.961 58000.0 162.9689 10000.0 168.9584 6900.0 169.966 42000.0 171.9453 18000.0 173.5246 9700.0 173.5314 27000.0 173.5431 4800.0 173.961 110000.0 173.9772 4600.0 174.969 69000.0 175.9768 36000.0 177.9564 5500.0 181.9655 3300.0 183.9445 2500.0 185.9417 4400.0 185.9611 230000.0 186.9689 83000.0 187.9768 53000.0 191.9718 23000.0 192.9793 4000.0 193.9869 3000.0 197.9611 41000.0 203.9717 42000.0 209.9631 3700.0 211.9769 3400.0 215.9718 59000.0 227.9361 6400.0 227.9715 7900.0 229.9524 4000.0 233.9825 43000.0 241.775 2400.0 245.9451 2600.0 251.9929 25000.0 256.6271 2400.0 END IONS BEGIN IONS SCANS=59 PEPMASS=360.1504 CHARGE=1 COLLISION_ENERGY=0.0 53.0022 5500.0 53.0385 65000.0 54.5414 2400.0 54.7234 2300.0 55.0176 830000.0 57.0333 760000.0 57.0368 2300.0 57.6014 2600.0 59.049 2400.0 60.044 2400.0 60.456 2600.0 61.0282 460000.0 61.5144 2600.0 63.0712 2300.0 64.0223 2200.0 67.2843 2400.0 68.9776 2300.0 69.0333 3400000.0 69.0375 14000.0 69.0399 11000.0 69.0421 3700.0 70.9351 2500.0 71.0125 39000.0 71.0488 200000.0 72.0805 9300.0 73.028 530000.0 73.0331 4200.0 73.757 2400.0 74.2837 2500.0 75.2345 2300.0 79.6508 2100.0 80.6186 2700.0 80.8618 2300.0 81.0332 300000.0 81.6274 2200.0 83.0125 31000.0 83.071 2300.0 85.0217 7400.0 85.0281 9900000.0 85.034 17000.0 85.0378 220000.0 85.04 18000.0 85.0434 7800.0 85.0473 3800.0 85.7327 2500.0 87.0438 120000.0 88.4446 2900.0 91.0326 4300.0 91.0387 270000.0 94.3549 2200.0 94.642 2400.0 94.7766 2500.0 96.0072 2200.0 96.3305 2500.0 97.0281 3000000.0 97.0352 11000.0 98.4282 2400.0 99.0437 1000000.0 99.0507 4100.0 101.023 400000.0 103.0387 69000.0 103.3252 2500.0 108.5366 2300.0 109.0281 650000.0 109.0371 5400.0 111.0433 4900.0 115.0303 11000.0 115.0386 450000.0 115.0483 4100.0 117.0546 32000.0 119.1571 2500.0 122.7512 2300.0 122.8987 2700.0 123.0433 2700.0 127.0267 2000.0 127.0386 8600000.0 127.0478 130000.0 127.0582 35000.0 127.0607 15000.0 130.7706 2400.0 133.0493 67000.0 135.0437 3200.0 136.0744 2300.0 142.8199 2700.0 145.0365 8700.0 145.0493 1900000.0 145.0608 20000.0 145.0636 3900.0 149.6832 4900.0 149.6936 4500.0 151.0386 2900.0 154.5882 2300.0 157.5684 2500.0 159.1232 2400.0 162.075 3700.0 162.341 2300.0 163.0599 150000.0 168.3094 2500.0 169.0482 5500.0 169.5158 2200.0 169.9258 3400.0 171.9217 36000.0 173.5244 63000.0 173.5408 70000.0 175.0715 3100.0 175.325 2400.0 180.0863 34000.0 181.6697 2500.0 181.741 2500.0 185.9011 15000.0 187.9166 4700.0 195.9973 2400.0 199.9536 13000.0 203.9119 7000.0 204.4745 2300.0 208.3769 2400.0 211.9158 4700.0 231.3655 2300.0 238.7022 2800.0 243.3811 2400.0 245.1101 2500.0 246.0314 2400.0 269.6776 2400.0 279.8033 2300.0 291.0742 2800.0 293.3068 2700.0 302.4362 2700.0 315.3656 2200.0 319.5566 2300.0 330.2376 2900.0 338.028 2500.0 346.7327 2500.0 353.3468 3400.0 END IONS BEGIN IONS SCANS=60 PEPMASS=396.0357 CHARGE=1 COLLISION_ENERGY=0.0 54.2803 2300.0 55.0179 6600.0 55.9343 33000.0 56.1382 2200.0 60.3227 2300.0 61.0284 8800.0 61.5814 2200.0 63.5156 2300.0 65.0286 2300.0 65.1765 2300.0 66.4871 2200.0 67.1389 2100.0 69.0334 5000.0 69.0433 2400.0 69.1826 2400.0 69.8885 2300.0 71.6432 2300.0 71.9293 3100.0 72.0804 15000.0 72.9372 7800.0 73.0282 4800.0 75.0347 2600.0 75.7552 2900.0 76.9872 2300.0 77.6595 2400.0 78.1188 2700.0 79.3071 2500.0 81.0333 14000.0 84.4562 2200.0 85.0282 16000.0 86.4229 2600.0 87.2942 2600.0 90.9477 25000.0 91.0388 6800.0 91.1394 2400.0 92.6698 2100.0 94.391 2500.0 97.0283 42000.0 97.0854 2400.0 98.6971 2400.0 99.0435 6500.0 99.0708 2500.0 99.7163 2300.0 102.5296 2700.0 102.7065 2200.0 102.9476 6300.0 103.3815 2200.0 105.9345 2700.0 107.9502 2600.0 108.6726 2300.0 109.0283 19000.0 113.5429 2400.0 113.9408 14000.0 115.6151 2400.0 115.9559 2600.0 117.1949 2500.0 121.0235 2200.0 126.9494 3300.0 127.0387 25000.0 127.5956 2700.0 127.9144 2300.0 128.9643 2700.0 131.9502 210000.0 132.9581 19000.0 133.9662 13000.0 138.8849 2400.0 141.9712 12000.0 143.9395 2700.0 143.9504 61000.0 144.9581 150000.0 145.9658 38000.0 149.6687 3500.0 149.6895 5600.0 149.9609 60000.0 151.9768 3600.0 152.7973 2400.0 153.9711 14000.0 156.9584 28000.0 157.966 110000.0 157.9798 2500.0 158.9739 28000.0 159.9436 2400.0 159.9807 3700.0 161.392 2300.0 161.9608 210000.0 162.9687 13000.0 163.9767 12000.0 165.6132 2500.0 165.9534 2500.0 166.6507 2400.0 168.9585 4500.0 169.9508 3400.0 169.966 410000.0 169.9816 3600.0 169.9897 2600.0 170.9737 21000.0 171.9455 22000.0 171.9823 15000.0 173.5222 21000.0 173.5339 110000.0 173.5437 6600.0 173.9436 5100.0 173.9609 760000.0 174.9688 56000.0 175.9767 32000.0 177.1972 2600.0 179.9721 8700.0 181.966 84000.0 183.9451 20000.0 184.3781 2400.0 185.961 340000.0 186.9688 140000.0 187.9765 130000.0 189.9555 8400.0 191.9712 22000.0 195.9816 11000.0 197.961 130000.0 198.9689 110000.0 199.0917 2900.0 199.9766 320000.0 201.9563 6900.0 203.9716 160000.0 204.9905 3000.0 205.8978 2600.0 209.8571 2300.0 209.9612 230000.0 210.9688 47000.0 211.9767 110000.0 213.9557 3300.0 214.0667 2500.0 214.9624 3000.0 215.9717 280000.0 216.9795 83000.0 217.9872 63000.0 218.9576 2400.0 222.9686 12000.0 223.9762 13000.0 227.9716 410000.0 227.9978 3400.0 228.9141 2600.0 228.9791 6200.0 233.9821 100000.0 234.9898 120000.0 235.9979 7900.0 237.9519 2600.0 239.6389 2500.0 239.9716 69000.0 239.9969 2500.0 240.9787 5400.0 245.9822 18000.0 251.9944 4100.0 257.982 93000.0 269.9829 12000.0 275.9577 11000.0 275.9928 1300000.0 276.0278 16000.0 277.0008 100000.0 282.031 3000.0 283.8485 6300.0 287.9929 36000.0 288.3668 2400.0 288.9996 17000.0 306.0031 38000.0 317.3123 2600.0 322.2912 3300.0 342.5825 2600.0 344.6064 2600.0 391.015 2900.0 392.565 3000.0 END IONS BEGIN IONS SCANS=61 PEPMASS=331.8869 CHARGE=1 COLLISION_ENERGY=0.0 49.7363 2400.0 52.2542 2200.0 55.9343 140000.0 57.4261 2300.0 58.4167 2600.0 66.7369 2600.0 67.4251 2100.0 69.0333 11000.0 72.0806 2700.0 78.6509 2000.0 78.701 2600.0 90.9475 3100.0 104.5142 2700.0 107.7344 2500.0 113.9633 8500.0 117.0545 5000.0 126.3702 2900.0 131.95 7500.0 135.9009 7700.0 144.9588 2900.0 149.68 3700.0 149.6904 5200.0 153.9113 62000.0 157.966 4400.0 163.915 2300.0 164.0711 4100.0 169.9063 8800.0 170.9143 27000.0 171.9082 3000.0 171.9219 710000.0 172.8619 3200.0 173.5371 27000.0 173.9617 3300.0 180.8885 6700.0 181.9172 11000.0 183.9217 4300.0 184.8476 2400.0 185.4046 2500.0 185.9013 390000.0 185.9608 5700.0 186.9702 3100.0 187.9164 97000.0 188.9249 28000.0 190.8724 25000.0 196.8828 3200.0 203.9115 120000.0 205.9274 18000.0 208.8596 4800.0 208.8833 180000.0 211.9168 31000.0 215.9715 4500.0 218.8686 7100.0 223.9175 6600.0 224.9253 11000.0 225.2711 2300.0 226.8939 56000.0 229.928 12000.0 231.8993 41000.0 236.8783 6800.0 237.9323 2700.0 240.1646 2500.0 241.8836 6600.0 241.9285 2900.0 242.1564 2700.0 248.9251 3100.0 249.9096 6200.0 259.9021 6700.0 266.9354 11000.0 267.8846 6800.0 268.4376 2500.0 280.3827 2400.0 296.0828 2700.0 339.4205 2700.0 END IONS BEGIN IONS SCANS=62 PEPMASS=259.9017 CHARGE=1 COLLISION_ENERGY=0.0 47.7445 2400.0 49.4472 2400.0 50.097 2400.0 50.5832 2300.0 55.9342 85000.0 59.344 2500.0 59.6207 2100.0 65.782 2600.0 70.447 2200.0 71.0648 2100.0 83.9527 2200.0 86.0535 2500.0 86.0963 4200.0 88.2091 2600.0 101.531 2400.0 104.1065 5400.0 129.9329 2800.0 131.0496 5100.0 144.3818 2500.0 145.028 10000.0 149.6712 6900.0 149.6818 9700.0 149.6929 10000.0 153.9112 16000.0 163.0385 3600.0 170.9144 3100.0 171.9217 82000.0 173.5287 3800.0 173.5378 10000.0 175.039 40000.0 185.901 43000.0 187.9166 21000.0 188.9242 2600.0 189.4841 2600.0 203.9115 12000.0 236.9409 8300.0 260.1264 3000.0 END IONS BEGIN IONS SCANS=63 PEPMASS=210.9331 CHARGE=1 COLLISION_ENERGY=0.0 43.0175 3400.0 55.9341 8000.0 56.9645 9300.0 64.7324 2200.0 67.6013 2200.0 71.5691 2100.0 71.929 12000.0 72.9368 2500.0 78.3455 2100.0 89.9396 5500.0 100.9236 2400.0 107.9501 12000.0 124.1645 2500.0 125.9605 3500.0 128.5462 2700.0 130.2889 2400.0 130.9816 3100.0 151.075 4000.0 162.9269 9900.0 165.5062 2400.0 169.9061 23000.0 170.9136 3900.0 172.0138 2900.0 173.528 19000.0 173.5424 4800.0 178.9231 3400.0 180.9373 20000.0 187.9166 330000.0 188.9224 2800.0 192.9373 7700.0 196.9325 21000.0 205.9273 75000.0 210.948 28000.0 END IONS BEGIN IONS SCANS=64 PEPMASS=365.1057 CHARGE=1 COLLISION_ENERGY=0.0 51.9534 2600.0 54.2804 2500.0 55.0061 2200.0 55.0997 2500.0 55.7975 2300.0 57.3258 2200.0 58.7249 2800.0 61.2599 2400.0 61.8519 2500.0 62.5361 2500.0 66.0763 2200.0 66.6093 2300.0 66.968 2500.0 67.0722 2100.0 69.2571 2500.0 69.8223 2600.0 72.9369 2100.0 73.9954 2100.0 75.9804 2300.0 76.2764 2400.0 76.5379 2200.0 78.528 2300.0 79.8268 2400.0 80.3636 2600.0 81.577 2500.0 82.3638 2100.0 89.963 2600.0 96.8581 2600.0 97.2926 2600.0 99.843 2300.0 106.2056 2300.0 113.3472 2400.0 121.2627 2600.0 125.4686 2400.0 132.9692 5200.0 133.9764 2800.0 135.572 3100.0 139.164 2500.0 143.9765 2300.0 148.9637 3300.0 150.6254 3100.0 150.6463 2500.0 158.1618 2600.0 163.2906 2500.0 173.1577 2400.0 173.5276 110000.0 173.5442 22000.0 183.2253 2500.0 183.399 2800.0 185.0148 3300.0 185.042 800000.0 185.0587 10000.0 187.3024 2400.0 194.3857 2800.0 194.3938 2800.0 194.957 27000.0 196.933 3200.0 203.0294 2700.0 203.0527 2700000.0 203.0973 5200.0 208.6414 2700.0 208.8024 3300.0 210.3048 2700.0 212.9703 2700.0 213.9067 2500.0 236.0307 3400.0 256.765 2500.0 267.8829 8600.0 272.5621 2200.0 277.2651 2400.0 277.9981 2800.0 281.4192 2400.0 297.7086 2400.0 306.0945 2300.0 323.5245 2600.0 365.1058 350000.0 END IONS BEGIN IONS SCANS=65 PEPMASS=205.1186 CHARGE=1 COLLISION_ENERGY=0.0 42.0338 10000.0 42.3089 2400.0 43.0177 85000.0 44.0494 14000.0 46.5122 2200.0 47.8795 2200.0 50.7855 2400.0 51.2862 2300.0 53.0384 10000.0 53.3658 2600.0 53.8095 2300.0 54.7141 2400.0 55.054 680000.0 55.0572 9600.0 55.0587 7200.0 55.9342 46000.0 56.0492 290000.0 56.0524 4000.0 57.0333 8100.0 57.0556 2400.0 58.9522 2700.0 60.0441 150000.0 60.5654 2500.0 61.1665 2200.0 63.3154 2300.0 63.8468 2400.0 64.5478 2400.0 65.0383 12000.0 67.0414 23000.0 67.054 24000.0 70.0648 69000.0 70.2633 2200.0 70.428 2200.0 71.9043 2400.0 71.9612 2100.0 72.044 19000.0 72.0804 7300.0 72.937 6500.0 73.0642 2800.0 74.0233 710000.0 74.028 5500.0 74.0597 23000.0 76.5562 2300.0 80.0492 50000.0 82.0648 3600000.0 82.0735 21000.0 82.0744 88000.0 82.0761 16000.0 82.0799 4100.0 83.0488 51000.0 84.0441 16000.0 84.0805 77000.0 85.0473 5300.0 86.9173 2900.0 86.9923 3100.0 89.5014 2200.0 90.9474 11000.0 93.2181 2300.0 95.012 2700.0 96.0803 7200.0 97.0479 2700.0 98.0598 20000.0 99.0915 540000.0 99.0983 4400.0 100.0393 12000.0 100.0753 560000.0 100.0823 3100.0 101.0592 5200.0 103.0228 2800.0 107.0637 2200.0 107.9502 6900.0 110.0597 23000.0 111.0436 3200.0 113.0789 3400.0 113.1069 8100.0 113.9636 12000.0 114.0911 21000.0 114.9711 10000.0 115.0237 2400.0 116.0704 43000.0 123.0079 6400.0 123.0914 430000.0 123.1002 2800.0 124.0754 180000.0 124.0853 2500.0 127.0864 7900.0 128.0593 5500.0 128.0703 1200000.0 128.0795 8200.0 128.0921 3800.0 128.9506 16000.0 135.9446 4200.0 139.0584 4200.0 141.0894 4700.0 141.102 690000.0 141.1129 2600.0 141.1153 3900.0 142.0733 8800.0 142.086 390000.0 142.0993 4300.0 145.097 60000.0 146.0808 25000.0 170.0812 250000.0 173.5284 23000.0 173.5428 5100.0 177.8413 2500.0 187.1078 34000.0 210.1382 2400.0 END IONS BEGIN IONS SCANS=66 PEPMASS=316.1397 CHARGE=1 COLLISION_ENERGY=0.0 49.8645 2400.0 55.0179 16000.0 55.3117 2300.0 57.0334 61000.0 61.0283 110000.0 63.3203 2200.0 67.4811 2300.0 69.0334 31000.0 71.3434 2100.0 72.0806 10000.0 73.0245 2300.0 73.0283 49000.0 75.1735 2100.0 81.0334 30000.0 81.6805 2300.0 82.1708 2700.0 83.0493 2700.0 85.0283 240000.0 91.0388 21000.0 91.0541 21000.0 96.0447 3600.0 97.0283 67000.0 99.044 8300.0 99.0728 2400.0 103.0388 110000.0 103.0547 6800.0 105.0699 26000.0 106.7849 2100.0 108.018 2200.0 115.0543 21000.0 117.07 13000.0 118.065 4300.0 119.0347 3000.0 119.0491 15000.0 121.0646 14000.0 123.044 34000.0 127.0388 41000.0 128.9507 6100.0 129.0698 24000.0 130.9668 2900.0 131.0491 54000.0 132.0809 4200.0 133.0647 60000.0 137.0597 550000.0 143.0491 74000.0 144.066 9400.0 145.0648 44000.0 146.0602 26000.0 147.0442 18000.0 147.0803 8800.0 149.0457 5700.0 149.0597 370000.0 149.0738 6500.0 150.0911 5900.0 151.0753 530000.0 151.0892 4800.0 153.0697 5800.0 154.0863 28000.0 157.0647 68000.0 157.0774 3400.0 160.0524 7300.0 160.0755 26000.0 161.0441 7200.0 161.0597 390000.0 161.0754 10000.0 162.0549 11000.0 163.0394 8400.0 163.0754 56000.0 164.0481 2900.0 164.0706 310000.0 165.0549 32000.0 166.0864 59000.0 167.0506 3000.0 167.0705 17000.0 169.0651 13000.0 171.0803 13000.0 173.0598 61000.0 173.5228 12000.0 173.5346 32000.0 173.5424 4800.0 175.0393 3400.0 175.0596 7800.0 175.0755 170000.0 176.0709 22000.0 177.0548 56000.0 177.0785 27000.0 178.0864 790000.0 179.0441 3200.0 179.0704 610000.0 181.065 32000.0 184.0755 5500.0 185.0598 95000.0 187.0756 32000.0 187.0929 2800.0 188.0706 18000.0 189.0543 24000.0 189.0914 25000.0 190.0864 64000.0 191.0703 120000.0 192.0655 3100.0 192.1023 23000.0 193.0866 14000.0 194.0815 15000.0 195.0656 7300.0 196.0087 2300.0 196.0969 140000.0 197.0592 12000.0 197.9887 5800.0 198.5319 3300.0 199.0757 65000.0 201.0554 8300.0 202.0865 66000.0 203.0704 140000.0 203.0917 3100.0 203.883 6600.0 204.1017 8300.0 205.0859 17000.0 207.0659 10000.0 208.0971 53000.0 209.0608 7500.0 209.0809 18000.0 212.9277 4500.0 214.0862 15000.0 215.0705 34000.0 216.1023 41000.0 217.0863 51000.0 218.0814 92000.0 219.0661 14000.0 219.0895 39000.0 220.0971 180000.0 221.0812 65000.0 225.0523 2600.0 226.0864 3000.0 227.0705 46000.0 232.0969 32000.0 233.0811 20000.0 234.0768 22000.0 234.1126 49000.0 243.8786 5300.0 244.097 56000.0 245.0809 56000.0 250.1074 41000.0 251.8329 2300.0 258.8885 15000.0 262.1075 76000.0 263.091 36000.0 276.8987 6700.0 280.1184 130000.0 292.8959 4900.0 294.8744 2900.0 298.1291 82000.0 316.0966 10000.0 316.1393 340000.0 322.4838 2600.0 END IONS BEGIN IONS SCANS=67 PEPMASS=507.8386 CHARGE=1 COLLISION_ENERGY=0.0 62.8567 2200.0 62.9682 2400.0 64.499 2100.0 68.0754 3000.0 69.9884 2200.0 90.0503 2700.0 90.9473 7000.0 93.1724 2400.0 94.9614 2400.0 103.5829 2600.0 113.9635 14000.0 118.2782 2300.0 131.0645 2900.0 132.8412 2600.0 143.0314 22000.0 149.6891 19000.0 162.8777 19000.0 168.209 3100.0 170.8556 2700.0 173.5231 5500.0 173.5354 16000.0 180.888 170000.0 185.042 3300.0 185.8936 22000.0 195.9428 16000.0 198.8987 5700.0 203.9042 500000.0 213.0005 3000.0 216.9065 2800.0 218.6366 2500.0 219.8979 4100.0 220.4959 2600.0 221.9158 3900.0 225.9164 5000.0 226.9252 4900.0 231.355 2400.0 234.8628 17000.0 237.9108 6800.0 249.9187 4600.0 252.873 29000.0 256.8141 2700.0 257.8502 4300.0 257.8782 84000.0 267.9277 28000.0 275.8895 33000.0 302.8576 2700.0 321.6351 2700.0 324.8954 2600.0 341.4314 2300.0 342.7529 2600.0 377.1262 2600.0 END IONS BEGIN IONS SCANS=68 PEPMASS=274.9364 CHARGE=1 COLLISION_ENERGY=0.0 47.2129 2000.0 47.5967 2700.0 47.9414 2500.0 51.5947 2200.0 53.4577 2400.0 54.4515 2200.0 55.9342 470000.0 56.2256 2600.0 57.1356 2200.0 57.1677 2200.0 66.351 2200.0 70.9576 5800.0 71.929 37000.0 72.9369 46000.0 73.7576 2500.0 73.9447 61000.0 84.0287 2300.0 84.7706 2400.0 87.3127 2200.0 88.9682 34000.0 89.9396 120000.0 90.9474 47000.0 91.9553 26000.0 92.4929 2400.0 96.9607 55000.0 100.0753 2300.0 105.3704 2300.0 105.9346 36000.0 107.9501 200000.0 112.9555 13000.0 113.9634 97000.0 114.9712 200000.0 118.086 41000.0 123.945 6400.0 125.9607 72000.0 128.9383 12000.0 128.9505 500000.0 128.9619 10000.0 130.9556 3500.0 130.9662 500000.0 130.9776 5200.0 131.9504 24000.0 131.9739 17000.0 138.0547 26000.0 143.9743 2500.0 144.958 22000.0 145.9659 3900.0 146.9611 89000.0 148.9635 4600.0 148.9767 240000.0 149.6837 5400.0 149.6942 4100.0 154.3228 2500.0 157.966 33000.0 159.5883 2300.0 159.9455 2400.0 167.9184 2300.0 171.1208 2300.0 173.521 5300.0 173.5324 44000.0 173.5406 16000.0 182.2921 2400.0 185.9611 14000.0 186.9691 7100.0 192.8134 2400.0 203.1913 2500.0 211.6517 2500.0 212.6013 2600.0 216.7854 2300.0 222.441 2500.0 223.9964 2700.0 244.1376 2800.0 244.2275 2400.0 253.7108 2700.0 256.8972 3100.0 265.2171 2400.0 END IONS BEGIN IONS SCANS=69 PEPMASS=240.0717 CHARGE=1 COLLISION_ENERGY=0.0 43.0177 14000.0 45.0333 5400.0 45.6393 2200.0 46.065 37000.0 47.4611 2100.0 47.8486 2900.0 48.2942 2400.0 48.8041 2400.0 49.6114 2200.0 50.3935 2500.0 53.4101 2100.0 54.4782 2400.0 54.5401 2400.0 55.9342 8000.0 55.9431 2200.0 56.6787 2700.0 56.8837 2400.0 56.9843 2200.0 57.4339 2100.0 58.8417 2900.0 60.0442 7200.0 60.5487 2300.0 61.7009 2300.0 62.4537 2200.0 63.8649 2200.0 65.158 2700.0 65.6776 2500.0 67.7079 2400.0 67.722 2100.0 69.0332 18000.0 70.3815 2300.0 71.0126 18000.0 71.0242 2200.0 72.0437 5500.0 72.2038 2600.0 72.4978 2500.0 72.8947 2300.0 73.0281 2600.0 73.4209 2600.0 73.4573 2300.0 73.6569 2300.0 74.185 2200.0 75.4506 2200.0 75.9434 2500.0 80.5211 2300.0 80.7201 2300.0 81.019 2200.0 81.0444 12000.0 81.185 2600.0 81.3423 2200.0 82.9554 2400.0 83.4316 2200.0 84.6665 2300.0 85.0281 28000.0 87.7135 2600.0 88.0391 9700.0 89.0231 4700.0 90.9473 2700.0 93.0453 2300.0 94.7061 2200.0 95.0125 150000.0 97.0282 14000.0 99.0072 16000.0 104.9805 8800.0 106.7515 2700.0 107.3012 2500.0 109.5129 2500.0 113.014 8200.0 113.023 910000.0 113.0323 2000.0 113.7525 2200.0 113.8758 2500.0 114.995 2300.0 115.0023 120000.0 116.9658 11000.0 119.8739 2300.0 121.6358 2500.0 122.8652 2600.0 122.9987 2700.0 123.0074 430000.0 124.9043 2200.0 125.6126 2500.0 129.3778 2900.0 130.9817 14000.0 131.0337 48000.0 132.0661 5500.0 134.9201 7000.0 140.9659 11000.0 141.0035 6100.0 141.0181 460000.0 141.0294 3700.0 144.9968 2500.0 145.9324 2500.0 149.6816 3100.0 149.6921 5700.0 151.0614 34000.0 151.0735 2400.0 151.1813 2700.0 164.0918 2500.0 164.367 2200.0 168.9965 7300.0 169.0132 1500000.0 169.0301 28000.0 170.9144 32000.0 171.9215 3000.0 173.5316 76000.0 173.538 9100.0 173.5462 2600.0 177.0402 31000.0 182.4298 2300.0 184.6277 2500.0 186.6575 2400.0 187.9169 8600.0 188.9241 22000.0 193.9303 2800.0 194.0675 78000.0 194.4558 2600.0 194.4796 2900.0 195.0511 2700.0 196.2924 2600.0 197.4452 2300.0 202.6908 2400.0 220.6354 2700.0 236.754 2100.0 238.3508 2500.0 246.7675 2300.0 END IONS BEGIN IONS SCANS=70 PEPMASS=202.9515 CHARGE=1 COLLISION_ENERGY=0.0 41.6382 2100.0 43.0177 3500.0 43.3103 2300.0 45.1655 2100.0 46.065 51000.0 49.5124 2500.0 49.5335 2500.0 49.7554 2300.0 50.6031 2700.0 50.9942 2100.0 52.3806 2300.0 52.7286 2300.0 54.1008 2200.0 55.9343 3200000.0 55.9373 18000.0 55.939 14000.0 55.9406 7400.0 56.0493 4800.0 57.8231 2900.0 66.8123 2500.0 67.0747 2500.0 70.0648 240000.0 70.393 2400.0 70.9575 40000.0 71.0489 11000.0 71.0601 74000.0 71.786 2300.0 71.9194 3400.0 71.929 830000.0 72.0802 8700.0 72.9368 530000.0 73.1637 2200.0 73.9447 79000.0 74.0233 6400.0 74.0601 3400.0 74.525 2500.0 78.6584 2600.0 82.0136 3100.0 82.7963 2100.0 83.5659 2500.0 84.0441 2800.0 88.0866 43000.0 88.9681 78000.0 89.9303 3200.0 89.9396 1000000.0 89.9478 11000.0 90.3894 2400.0 90.7394 2300.0 90.9474 350000.0 91.0779 2300.0 91.9551 29000.0 96.9606 130000.0 98.0598 43000.0 100.024 11000.0 102.0548 2900.0 105.9345 40000.0 107.9502 1500000.0 107.9603 14000.0 108.9581 23000.0 109.1865 2200.0 111.2256 2500.0 112.9555 71000.0 113.9634 250000.0 114.0544 3300.0 114.963 13000.0 114.9712 460000.0 114.9807 2800.0 115.9539 4000.0 116.0702 43000.0 119.0852 2500.0 121.0767 2400.0 124.967 4100.0 125.9501 2700.0 125.9606 550000.0 125.9715 3700.0 128.9396 2900.0 128.9504 1200000.0 128.96 3500.0 128.9614 32000.0 130.9661 1200000.0 130.9804 18000.0 131.974 32000.0 133.9641 3200.0 135.0143 2100.0 140.0712 6600.0 142.0498 2700.0 143.0529 4200.0 144.0648 11000.0 145.7249 2500.0 146.9611 200000.0 148.9635 4700.0 148.9767 600000.0 150.0623 2600.0 152.7845 2300.0 156.9743 42000.0 158.1286 24000.0 171.9914 3100.0 173.5227 6400.0 173.5323 61000.0 173.5423 15000.0 174.9855 7000.0 175.8926 2400.0 179.9907 12000.0 202.0769 3300.0 203.0857 40000.0 END IONS BEGIN IONS SCANS=71 PEPMASS=238.0924 CHARGE=1 COLLISION_ENERGY=0.0 43.0177 65000.0 44.0494 22000.0 55.0176 58000.0 55.9344 2900.0 56.0493 9700.0 57.0333 37000.0 57.2571 2600.0 58.0285 13000.0 58.9948 37000.0 59.0489 2800.0 60.0441 350000.0 61.0281 18000.0 68.0458 3000.0 68.0492 98000.0 69.0332 70000.0 70.0285 21000.0 70.0647 5500.0 71.0127 5900.0 72.0441 250000.0 73.0281 110000.0 74.0056 29000.0 74.0233 130000.0 74.9897 12000.0 76.0214 3700.0 80.0493 17000.0 81.0331 7200.0 84.044 60000.0 85.0103 19000.0 85.0281 110000.0 86.0055 20000.0 86.0597 43000.0 86.9896 38000.0 87.0437 12000.0 88.039 28000.0 94.4431 2300.0 95.0126 15000.0 96.0441 150000.0 96.0513 4200.0 97.0281 91000.0 98.0597 45000.0 99.0074 19000.0 100.0216 3100.0 100.053 2200.0 102.0547 3200.0 102.9845 200000.0 104.0341 12000.0 105.0001 25000.0 107.8243 2400.0 112.039 78000.0 113.023 64000.0 113.463 2600.0 114.0005 51000.0 114.0547 380000.0 114.0634 9100.0 115.0318 2400.0 115.0387 62000.0 116.0703 12000.0 120.9951 160000.0 124.039 60000.0 125.0231 38000.0 126.0551 7500.0 128.0161 20000.0 131.0154 5700.0 132.011 62000.0 132.0653 580000.0 132.0786 6700.0 132.9949 24000.0 133.0493 44000.0 135.9891 2900.0 138.0006 35000.0 138.0552 2900.0 140.4556 3000.0 142.0497 88000.0 143.033 6700.0 148.9901 35000.0 150.0759 73000.0 156.0111 47000.0 156.0658 4200.0 160.0604 38000.0 173.5349 31000.0 174.0219 51000.0 178.0711 47000.0 184.0063 77000.0 196.0816 110000.0 196.9304 4100.0 199.7475 2700.0 202.0174 16000.0 END IONS BEGIN IONS SCANS=72 PEPMASS=206.1026 CHARGE=1 COLLISION_ENERGY=0.0 41.0386 4800.0 45.0333 13000.0 45.9334 2600.0 53.0902 2200.0 54.4564 2300.0 55.0541 8100.0 55.9342 3100.0 56.0469 2200.0 56.0493 49000.0 57.5261 2900.0 58.0649 83000.0 59.0489 6100.0 59.9578 2200.0 60.044 2500.0 68.0492 29000.0 68.3053 2900.0 69.0696 14000.0 70.0648 10000.0 71.0682 2600.0 73.0279 97000.0 74.0232 8800.0 75.0268 3500.0 76.0755 6900.0 78.5796 2400.0 81.0695 2700.0 82.0648 26000.0 83.0625 3000.0 83.0681 37000.0 84.0165 2400.0 84.044 270000.0 85.0234 2200.0 85.0281 45000.0 88.0755 12000.0 94.0649 2500.0 96.0805 380000.0 96.0875 4200.0 102.0546 10000.0 114.0914 6600.0 124.0753 190000.0 124.0922 2800.0 125.0789 3700.0 129.074 4200.0 131.9507 2800.0 142.0859 120000.0 142.105 5300.0 160.0964 52000.0 170.0812 24000.0 173.5329 29000.0 187.9174 3100.0 198.1349 2400.0 END IONS BEGIN IONS SCANS=73 PEPMASS=337.0942 CHARGE=1 COLLISION_ENERGY=0.0 69.3936 2400.0 70.0284 13000.0 71.2045 2200.0 73.389 2400.0 74.0055 25000.0 76.0211 58000.0 76.2526 2300.0 84.044 900000.0 84.0509 11000.0 84.0527 4300.0 85.0476 7500.0 88.0389 74000.0 88.4823 2300.0 88.8594 2400.0 92.0163 22000.0 96.0446 3100.0 98.0597 15000.0 102.0547 22000.0 103.3134 2200.0 106.0419 4700.0 106.0494 410000.0 107.993 18000.0 109.0517 2900.0 109.0761 3100.0 112.0214 6000.0 114.0552 2900.0 114.1284 2500.0 116.0338 35000.0 126.0546 33000.0 129.0654 16000.0 130.0387 4400.0 130.0495 470000.0 131.0535 2200.0 131.5446 2200.0 131.9932 31000.0 135.0439 6100.0 136.0398 6500.0 140.0161 45000.0 142.0315 4300.0 142.0495 61000.0 143.0447 5000.0 145.1256 2400.0 146.0268 10000.0 153.0658 20000.0 154.0487 2700.0 155.0808 33000.0 157.0605 66000.0 160.0602 45000.0 161.0392 4800.0 161.055 16000.0 172.0602 8600.0 173.5212 5900.0 173.5339 53000.0 174.022 14000.0 175.0718 2400.0 177.9988 8500.0 181.0606 24000.0 185.0378 65000.0 185.0561 6800.0 187.0551 2700.0 189.033 12000.0 190.0166 27000.0 191.0481 21000.0 192.0321 52000.0 193.0374 3000.0 199.0713 63000.0 203.2344 2600.0 207.0435 110000.0 209.0592 140000.0 212.9624 2400.0 213.869 2400.0 219.0256 13000.0 223.0714 35000.0 231.0435 540000.0 231.0706 4100.0 232.0476 19000.0 233.0591 85000.0 239.0189 3500.0 241.031 22000.0 241.0812 8800.0 247.0206 40000.0 255.0439 3200.0 256.9089 6700.0 257.0584 36000.0 264.0198 2600.0 265.0311 170000.0 267.0658 3500.0 267.8838 35000.0 268.0923 10000.0 273.055 20000.0 274.2019 2600.0 275.0699 4000.0 277.1391 2800.0 285.8928 6400.0 287.0874 41000.0 289.0869 6900.0 318.077 6100.0 320.0886 3000.0 321.0753 21000.0 328.0637 11000.0 338.1027 59000.0 353.0477 2400.0 582.3258 3100.0 664.4089 2500.0 666.348 2900.0 END IONS BEGIN IONS SCANS=74 PEPMASS=300.1448 CHARGE=1 COLLISION_ENERGY=0.0 51.1375 2200.0 54.3237 2000.0 55.0177 3000.0 57.0333 100000.0 57.0363 3500.0 60.1055 2400.0 61.0281 56000.0 61.0428 2200.0 64.4522 2300.0 66.2416 2100.0 66.6463 2100.0 67.6425 2400.0 69.0331 42000.0 71.0125 7000.0 71.0489 9800.0 71.6794 2700.0 73.028 22000.0 75.0437 38000.0 76.0288 2300.0 77.0385 2600.0 81.0332 3800.0 82.1958 2500.0 85.0281 150000.0 85.5938 3000.0 87.0437 18000.0 88.0964 2200.0 91.0386 24000.0 91.054 35000.0 93.0543 23000.0 93.0695 100000.0 94.024 2100.0 95.0491 9800.0 96.0439 3100.0 97.0281 69000.0 99.0074 7600.0 99.0439 16000.0 103.0385 74000.0 103.0539 43000.0 103.3822 2400.0 106.2869 2700.0 108.691 2600.0 113.023 9700.0 116.312 2400.0 117.2483 2200.0 120.9336 2600.0 121.0645 3100000.0 121.0732 49000.0 121.0814 19000.0 121.0845 8900.0 121.9757 2500.0 124.8792 2200.0 127.0386 21000.0 131.0342 3200.0 137.0594 30000.0 138.0909 30000.0 141.7133 2400.0 141.7592 2400.0 148.1389 2300.0 149.0594 25000.0 151.0749 30000.0 161.0594 25000.0 163.0754 9400.0 164.0704 9500.0 169.0485 2700.0 171.4586 2400.0 171.9218 3000.0 173.0607 5600.0 173.5247 3600.0 173.5329 44000.0 173.5418 5500.0 175.0753 5100.0 177.0554 6400.0 178.0864 32000.0 179.0701 23000.0 185.0601 3000.0 187.9165 8100.0 188.9255 2900.0 191.0702 2900.0 192.5296 2400.0 196.9322 17000.0 199.0744 2300.0 199.7322 2500.0 201.053 2400.0 201.0924 2300.0 204.9055 2400.0 205.9268 2800.0 209.8248 2400.0 218.0811 6400.0 219.0655 7800.0 220.0968 7700.0 222.8015 2200.0 229.9275 5100.0 239.9116 11000.0 257.9211 5300.0 258.8879 26000.0 276.8974 3400.0 300.1031 2200.0 300.1451 6900.0 END IONS BEGIN IONS SCANS=75 PEPMASS=303.1346 CHARGE=1 COLLISION_ENERGY=0.0 48.4663 2400.0 48.917 2100.0 71.5782 2600.0 90.9477 2500.0 91.054 2900.0 93.0065 2600.0 99.0328 2400.0 106.9829 2500.0 109.4212 2400.0 110.0598 33000.0 119.0497 3100.0 123.0441 3600.0 130.8545 2600.0 134.0599 14000.0 135.044 3100.0 136.0762 3000.0 137.0596 26000.0 140.0704 1000000.0 149.0711 16000.0 150.0549 35000.0 152.0575 3300.0 152.0705 92000.0 161.072 3300.0 162.0789 10000.0 163.0636 4000.0 163.0869 7300.0 164.0706 580000.0 173.5307 30000.0 173.5448 2300.0 186.9244 4300.0 196.6083 2400.0 210.0919 3900.0 213.0784 2700.0 219.7345 2200.0 238.0869 3300.0 240.1016 4400.0 242.0809 10000.0 256.0974 85000.0 257.0807 5100.0 267.1131 7800.0 268.097 28000.0 285.1245 35000.0 286.1085 52000.0 303.1353 24000.0 END IONS BEGIN IONS SCANS=76 PEPMASS=316.1397 CHARGE=1 COLLISION_ENERGY=0.0 49.7642 2800.0 53.0385 7700.0 55.054 25000.0 55.4827 2500.0 57.0335 9000.0 59.049 8600.0 59.2969 2300.0 61.0252 4300.0 61.028 120000.0 61.0822 2200.0 62.8942 2100.0 64.4356 2200.0 65.0387 2500.0 65.9079 2400.0 69.0332 21000.0 71.0489 30000.0 71.492 2700.0 72.9128 2600.0 73.0282 33000.0 81.0333 3800.0 83.0488 55000.0 85.0233 3100.0 85.0281 110000.0 87.0435 2300.0 87.5242 2200.0 87.6829 3000.0 90.8527 2400.0 91.0387 62000.0 91.0538 130000.0 97.0225 2300.0 97.0281 52000.0 99.0437 5900.0 100.605 2400.0 101.0594 240000.0 106.7491 2500.0 109.0282 3800.0 109.0645 12000.0 114.8267 2300.0 115.0385 3300.0 119.0404 4100.0 119.0489 100000.0 123.1123 2400.0 127.0387 23000.0 137.0594 2200000.0 137.0695 33000.0 137.0837 18000.0 145.049 7100.0 154.0861 53000.0 160.723 2600.0 166.0862 16000.0 167.0897 17000.0 173.5226 5300.0 173.54 15000.0 203.8833 26000.0 205.8986 12000.0 221.8942 7500.0 231.8778 6100.0 233.8943 3200.0 243.8775 17000.0 249.8892 8400.0 257.0021 3200.0 289.5569 3000.0 313.3922 2500.0 END IONS BEGIN IONS SCANS=77 PEPMASS=277.9362 CHARGE=1 COLLISION_ENERGY=0.0 49.045 2100.0 50.6048 2100.0 51.44 4500.0 53.7089 2400.0 55.9341 290000.0 59.4542 2100.0 59.7045 2200.0 60.7851 2400.0 61.0437 2200.0 61.5503 2600.0 63.6088 2500.0 64.3625 2500.0 68.0091 2500.0 68.2967 2300.0 68.5317 2600.0 69.2747 2200.0 69.9497 63000.0 70.0649 3300.0 71.929 54000.0 72.0491 2200.0 72.0772 6300.0 72.9369 120000.0 73.9447 68000.0 74.0105 2200.0 74.9525 12000.0 77.7121 2200.0 81.4947 2500.0 81.8025 2300.0 83.0757 2700.0 84.1305 2400.0 85.0282 11000.0 87.9602 120000.0 89.9396 180000.0 90.6391 2800.0 90.9474 390000.0 91.1059 2700.0 91.9552 44000.0 95.6782 2600.0 98.0597 43000.0 99.9604 3500.0 101.0987 2200.0 102.8187 2600.0 102.9473 15000.0 105.9346 45000.0 105.9707 9600.0 107.9423 4700.0 107.9501 880000.0 108.9581 29000.0 110.723 2600.0 112.9298 2400.0 115.9552 220000.0 115.9637 4700.0 116.0702 130000.0 116.9632 37000.0 117.9712 5300.0 118.5384 2300.0 118.9422 14000.0 120.1721 2900.0 120.7993 2600.0 121.1254 2400.0 125.707 2200.0 125.9514 4000.0 125.9606 400000.0 128.9847 2400.0 129.7433 2500.0 131.9504 21000.0 131.9867 8300.0 133.9658 820000.0 133.9758 5900.0 134.9733 3000.0 135.9451 13000.0 136.9532 2800.0 141.9345 2700.0 143.9502 66000.0 144.8935 2500.0 144.9581 25000.0 146.217 2300.0 147.9452 2800.0 151.6139 2600.0 151.9763 610000.0 153.3494 2300.0 156.8022 2200.0 159.9451 700000.0 159.9582 2400.0 159.9677 3400.0 160.9531 35000.0 161.9609 110000.0 162.9682 12000.0 164.0703 8100.0 167.3544 2400.0 173.5254 39000.0 173.5399 42000.0 175.0387 4000.0 175.1203 2900.0 175.9401 23000.0 177.1412 2400.0 177.4502 2400.0 177.9559 2800000.0 179.0717 3100.0 180.886 2800.0 187.9765 15000.0 190.0264 20000.0 192.4793 2600.0 195.9666 17000.0 200.9731 11000.0 203.9718 32000.0 204.0087 2300.0 205.0499 38000.0 205.9499 3000.0 208.8838 12000.0 226.8929 5700.0 251.8793 2500.0 253.8641 2500.0 263.7711 2800.0 271.7873 2400.0 277.8486 2500.0 END IONS BEGIN IONS SCANS=78 PEPMASS=205.9512 CHARGE=1 COLLISION_ENERGY=0.0 41.2572 2300.0 41.6607 2300.0 45.0333 19000.0 45.7113 2300.0 45.764 2400.0 47.0983 2900.0 52.919 2000.0 53.6139 2300.0 55.2604 2500.0 55.9341 140000.0 56.1094 2500.0 56.3679 2200.0 61.8503 2600.0 64.6278 2600.0 65.5218 2200.0 66.1034 2200.0 69.9498 28000.0 70.0664 7800.0 71.929 28000.0 72.9368 68000.0 73.0281 150000.0 73.9447 39000.0 74.0185 2500.0 75.1173 2600.0 77.3932 2400.0 78.5967 3000.0 80.5046 2400.0 87.5312 2200.0 87.8617 2100.0 87.9602 48000.0 88.0754 17000.0 89.9395 51000.0 90.9473 130000.0 91.9553 22000.0 96.7857 2400.0 103.2347 2400.0 105.9344 28000.0 105.9711 2200.0 106.6772 2300.0 107.9425 3900.0 107.9501 200000.0 108.9581 3700.0 112.8424 2200.0 114.037 3500.0 114.0904 2500.0 114.6381 2200.0 115.9552 23000.0 115.9638 2600.0 125.9606 74000.0 126.5752 2500.0 128.9866 2200.0 133.9658 65000.0 136.8154 2200.0 146.7609 2500.0 148.0103 2700.0 151.9764 39000.0 159.945 51000.0 160.0954 2800.0 173.5236 11000.0 173.535 52000.0 173.6291 2400.0 177.9558 110000.0 177.9709 3000.0 189.5422 2400.0 189.7609 2300.0 END IONS BEGIN IONS SCANS=79 PEPMASS=222.0612 CHARGE=1 COLLISION_ENERGY=0.0 42.5716 2600.0 43.8096 4200.0 43.8558 4600.0 44.5721 3000.0 44.6944 3800.0 44.8427 2800.0 44.9321 6200.0 47.0292 3700.0 47.7754 3300.0 48.3051 3700.0 48.7414 3700.0 51.9394 2600.0 52.0877 4300.0 52.1411 3100.0 52.6626 6900.0 53.2483 3400.0 53.2717 3600.0 54.0906 3600.0 54.2601 5300.0 55.0177 17000.0 56.0494 3200.0 56.6377 6600.0 57.0333 74000.0 58.0059 4700.0 58.0649 100000.0 58.4841 2700.0 59.3088 2600.0 59.3884 4100.0 63.9294 6200.0 65.2311 4000.0 65.634 4800.0 66.1461 2700.0 68.6636 4900.0 69.0295 5800.0 69.0331 460000.0 70.0649 8800.0 73.2255 5400.0 75.3585 3400.0 76.0971 4300.0 83.1289 2800.0 83.139 3600.0 83.5692 6100.0 85.0281 340000.0 87.3825 5200.0 89.5096 4400.0 91.0539 93000.0 95.0124 690000.0 95.1723 6900.0 97.0281 1600000.0 97.0349 4200.0 99.0075 7000.0 101.266 4400.0 103.3914 4300.0 103.5198 4300.0 104.4799 6000.0 107.0487 4700.0 108.1999 7200.0 111.7108 5200.0 113.0048 3100.0 113.023 750000.0 113.1269 3200.0 118.0414 7000.0 119.0488 84000.0 122.9972 13000.0 123.0073 1400000.0 123.016 4400.0 123.0182 23000.0 125.023 270000.0 131.4856 4900.0 131.8929 4100.0 135.0439 100000.0 141.0179 1100000.0 141.0303 16000.0 141.7221 3000.0 143.0217 3800.0 143.0336 220000.0 144.0653 13000.0 144.2459 2700.0 149.9802 3800.0 153.5885 6500.0 156.7622 3200.0 159.0285 7300.0 163.038 8800.0 168.9982 7700.0 169.013 530000.0 173.5248 19000.0 173.5373 130000.0 176.3185 3700.0 179.5215 6200.0 187.0235 93000.0 188.8426 5700.0 195.0504 16000.0 196.3829 3000.0 200.9212 4600.0 205.0688 10000.0 229.4987 5000.0 END IONS BEGIN IONS SCANS=80 PEPMASS=227.0166 CHARGE=1 COLLISION_ENERGY=0.0 47.4478 2600.0 47.7035 2200.0 48.2739 2500.0 48.5883 2200.0 53.6793 2500.0 54.0181 2200.0 54.8091 2400.0 55.9343 2900.0 56.7126 2500.0 59.3088 2100.0 59.4921 2200.0 60.4458 2200.0 61.3487 2000.0 61.6544 2600.0 62.3732 2100.0 63.2787 2400.0 64.6907 4600.0 64.7721 2500.0 65.6102 2300.0 66.3747 2300.0 70.052 2300.0 72.9368 110000.0 74.0898 2100.0 74.3079 2300.0 78.1563 2400.0 80.7704 2600.0 82.7183 2600.0 83.7449 2100.0 85.7166 2300.0 90.9474 68000.0 93.2516 2500.0 101.5617 2400.0 102.0317 2400.0 103.4525 2300.0 103.8515 2300.0 109.3915 2200.0 109.9056 2400.0 112.5057 2200.0 113.008 2500.0 113.9634 180000.0 115.2744 2300.0 123.9433 2700.0 125.7509 2300.0 126.0536 3300.0 128.113 2300.0 131.6383 2200.0 131.9734 5900.0 135.8453 2500.0 137.2073 2600.0 139.4766 2400.0 148.1718 2600.0 154.6762 2400.0 157.9923 2600.0 167.0703 12000.0 168.5906 2500.0 173.5284 87000.0 173.5414 11000.0 174.3059 2700.0 185.9278 29000.0 191.7124 2200.0 198.0076 2600.0 199.64 2300.0 200.139 2400.0 203.938 5300.0 212.2258 2800.0 227.018 2800.0 227.1175 2600.0 233.5006 3100.0 END IONS BEGIN IONS SCANS=81 PEPMASS=316.1396 CHARGE=1 COLLISION_ENERGY=0.0 50.5909 2600.0 50.8515 2400.0 51.0875 2200.0 55.0543 3400.0 55.5225 2500.0 57.654 2300.0 59.0489 2300.0 59.8715 2500.0 60.9703 2300.0 61.0282 3300.0 62.332 2200.0 65.1656 2300.0 67.5065 2300.0 69.0332 14000.0 71.0489 4600.0 73.0278 5000.0 81.8502 2500.0 83.0488 9800.0 84.1005 2400.0 85.028 49000.0 87.969 2200.0 91.0539 40000.0 96.0441 10000.0 97.0282 20000.0 98.6343 2600.0 99.0443 2300.0 101.0593 39000.0 103.934 2300.0 119.0489 32000.0 127.0387 13000.0 131.0482 2900.0 133.1609 2300.0 133.6475 2300.0 135.0441 2600.0 136.0614 3700.0 137.0594 650000.0 137.0698 5900.0 140.0714 3000.0 143.9694 2300.0 144.0653 23000.0 149.0593 12000.0 151.0745 2900.0 152.391 2700.0 153.0537 3700.0 154.086 13000.0 161.0587 3100.0 162.075 21000.0 164.0705 20000.0 164.9998 9400.0 166.0862 41000.0 167.0895 21000.0 168.2882 2400.0 173.5243 10000.0 173.5339 26000.0 173.5428 4800.0 176.9999 2700.0 177.0549 6700.0 178.0861 46000.0 179.0155 8600.0 179.0705 5800.0 188.0834 2400.0 194.0025 5000.0 197.0268 4400.0 202.0877 3200.0 203.0707 3600.0 203.8834 8400.0 205.8987 4400.0 208.0961 3000.0 209.0267 98000.0 209.0491 2800.0 218.0817 4400.0 220.0969 15000.0 232.098 4300.0 243.8782 2900.0 253.067 2800.0 262.9922 2300.0 280.1184 21000.0 281.0654 2900.0 298.129 36000.0 302.0815 2500.0 316.14 5100.0 END IONS BEGIN IONS SCANS=82 PEPMASS=358.1135 CHARGE=1 COLLISION_ENERGY=0.0 52.6621 2200.0 53.4544 2300.0 54.7126 2900.0 58.7192 2800.0 59.3171 2100.0 59.6779 3000.0 61.5689 2400.0 64.785 2600.0 65.0385 72000.0 66.0238 2500.0 71.2 2800.0 72.0406 2200.0 74.0623 2700.0 74.0914 3100.0 75.3361 2200.0 78.8112 2100.0 81.0697 29000.0 84.9156 2300.0 85.2142 2600.0 85.8614 2400.0 91.0541 1800000.0 91.0614 11000.0 92.2812 2200.0 93.1714 2900.0 93.7509 2300.0 93.8149 2200.0 97.8172 2400.0 100.2304 2400.0 109.0646 110000.0 109.252 2800.0 113.0237 5400.0 119.0391 19000.0 119.049 1000000.0 119.0584 8900.0 128.2177 2100.0 132.8016 3700.0 136.9996 3900.0 137.0205 4100.0 137.0596 28000000.0 137.0692 81000.0 137.0791 38000.0 137.0844 290000.0 137.0943 33000.0 137.1004 14000.0 154.0653 3300.0 154.0862 2300000.0 161.0602 8800.0 169.0125 2800.0 169.8739 2400.0 173.5316 110000.0 173.5453 4000.0 178.0864 38000.0 182.0275 2600.0 192.978 25000.0 196.0997 2300.0 201.0783 2400.0 203.0716 3400.0 205.9861 2800.0 206.9948 29000.0 208.0421 5600.0 208.0613 16000.0 208.7292 3300.0 219.0897 9700.0 222.9927 6200.0 224.0934 3100.0 225.0032 3000.0 236.0922 46000.0 236.9724 11000.0 258.0778 2600.0 266.1022 16000.0 294.0981 37000.0 300.2876 3200.0 308.8163 2600.0 311.0216 240000.0 312.0088 13000.0 312.1086 330000.0 312.1496 4100.0 324.0291 92000.0 328.0476 22000.0 339.0376 3000.0 340.108 2600.0 341.0353 22000.0 358.1131 13000.0 366.7817 2400.0 END IONS BEGIN IONS SCANS=83 PEPMASS=248.0245 CHARGE=1 COLLISION_ENERGY=0.0 44.0494 7300.0 44.4877 2400.0 47.676 2300.0 48.9885 2500.0 49.1804 2500.0 49.7524 2100.0 52.359 2300.0 53.2407 2100.0 55.9342 64000.0 58.3446 2400.0 58.6538 2300.0 60.0932 2300.0 61.7984 2900.0 62.0599 19000.0 68.0263 2200.0 70.0094 2200.0 70.0649 2500.0 70.727 2200.0 71.1049 2500.0 72.9369 2700.0 73.0281 85000.0 73.038 2100.0 74.3856 2300.0 84.044 11000.0 85.0281 5500.0 86.0964 6600.0 86.5997 2900.0 87.0551 12000.0 87.0993 6600.0 90.9473 6100.0 91.7931 2300.0 92.1756 2100.0 96.5194 2400.0 97.6849 2400.0 104.7894 2600.0 106.3894 2400.0 108.5487 2300.0 111.3559 2400.0 113.0701 8400.0 123.4077 2300.0 123.5555 2700.0 128.9518 2400.0 128.9632 5400.0 130.0493 3300.0 133.2921 2900.0 138.0546 12000.0 138.9837 15000.0 139.927 2100.0 149.9769 2400.0 151.5276 2400.0 153.9711 22000.0 155.6058 2200.0 157.2041 2200.0 166.9792 3400.0 167.987 14000.0 171.2622 2800.0 173.5252 62000.0 173.5392 39000.0 175.0394 4400.0 176.9639 100000.0 177.9714 56000.0 179.9874 8800.0 181.3136 2600.0 181.9664 3400.0 194.9326 3600.0 194.9738 4200000.0 194.9893 13000.0 195.9621 9300.0 195.9817 330000.0 203.9815 2700.0 204.9694 37000.0 205.9899 160000.0 206.9973 17000.0 208.9532 2700.0 209.9613 54000.0 212.9846 520000.0 213.0082 4600.0 213.8195 2600.0 213.9921 63000.0 215.9921 2600.0 216.7696 2500.0 216.9976 30000.0 217.99 340000.0 224.927 2500.0 228.9019 2800.0 231.0131 6400.0 234.772 2600.0 236.0003 3400.0 241.9579 2300.0 248.0909 6800.0 253.5217 2700.0 258.0361 2700.0 END IONS BEGIN IONS SCANS=84 PEPMASS=303.1345 CHARGE=1 COLLISION_ENERGY=0.0 50.9957 2200.0 63.1976 2200.0 64.2545 2700.0 75.8193 2400.0 76.388 2300.0 86.0596 9500.0 91.0538 15000.0 91.1779 2300.0 94.0647 8500.0 119.0488 9800.0 121.0645 32000.0 122.0598 37000.0 124.7588 2300.0 137.0595 100000.0 138.0547 25000.0 140.0704 61000.0 146.0596 7200.0 149.6843 5600.0 149.6958 4600.0 150.0548 190000.0 152.0708 6900.0 152.504 3100.0 152.6157 2400.0 154.086 2700.0 164.0706 51000.0 166.0496 18000.0 173.5291 21000.0 173.5386 5300.0 185.5884 2300.0 221.9658 2900.0 230.0812 4400.0 256.0978 3100.0 263.2882 2800.0 267.0771 18000.0 274.1078 3800.0 285.0883 3800.0 298.8957 2300.0 303.0984 3600.0 END IONS BEGIN IONS SCANS=85 PEPMASS=245.0864 CHARGE=1 COLLISION_ENERGY=0.0 44.0495 6000.0 55.0178 6600.0 56.0494 11000.0 58.065 11000.0 60.0442 370000.0 66.6221 2400.0 68.0493 10000.0 69.0333 3500.0 70.0286 35000.0 70.065 56000.0 71.0487 3300.0 71.414 2500.0 72.0447 2600.0 73.0734 2600.0 74.0058 19000.0 74.0234 81000.0 76.0214 9500.0 77.1229 2400.0 79.0543 3100.0 80.0493 15000.0 81.0332 2700.0 82.0652 2600.0 83.0602 30000.0 83.5522 5600.0 83.8748 2600.0 83.9643 2900.0 84.0442 1600000.0 84.0507 13000.0 84.0531 3100.0 84.0805 6300.0 85.0282 24000.0 85.0474 10000.0 86.0965 3800.0 87.294 2500.0 88.039 110000.0 88.0754 96000.0 90.9473 5700.0 92.0163 2300.0 96.0442 26000.0 97.5496 32000.0 98.0599 46000.0 99.0437 6900.0 99.055 2800.0 100.0392 2600.0 102.0547 69000.0 105.1285 2500.0 106.0496 120000.0 106.555 23000.0 107.0489 27000.0 107.0604 16000.0 108.0442 47000.0 109.0522 4800.0 109.0756 6600.0 110.0599 26000.0 111.0552 16000.0 112.0391 19000.0 112.8666 2100.0 113.0341 19000.0 113.5362 2800.0 114.0547 69000.0 115.0085 2600.0 115.0856 2900.0 116.0339 18000.0 116.0703 300000.0 118.8548 2100.0 120.5523 19000.0 121.0105 2400.0 122.0182 4100.0 122.5408 32000.0 123.0261 90000.0 123.0431 3700.0 123.3368 2500.0 123.9938 2100.0 124.0393 3600.0 124.0753 25000.0 124.5402 16000.0 125.0708 20000.0 126.0547 45000.0 129.0656 79000.0 130.0496 510000.0 130.0588 4300.0 131.0493 10000.0 132.0655 5900.0 135.0438 40000.0 135.0547 11000.0 136.0391 120000.0 136.0517 130000.0 136.0758 12000.0 136.5383 12000.0 137.0593 12000.0 137.8487 2600.0 138.0456 2700.0 138.5379 55000.0 139.0205 8800.0 142.0497 92000.0 146.0451 5900.0 147.026 66000.0 147.051 31000.0 147.0629 2800.0 148.0515 2700.0 149.0053 30000.0 149.0594 3000.0 149.071 21000.0 149.6923 4300.0 149.9615 2700.0 150.013 9400.0 151.021 270000.0 151.0351 5400.0 151.0624 6300.0 153.0656 71000.0 154.0495 40000.0 154.0861 19000.0 155.0158 60000.0 155.0815 15000.0 156.0656 18000.0 157.0607 37000.0 158.0444 20000.0 160.0603 79000.0 161.0489 5800.0 163.0206 12000.0 165.0372 7200.0 167.0161 93000.0 167.0815 6700.0 168.0239 210000.0 168.0556 6300.0 169.0316 510000.0 169.0448 4500.0 170.0346 2800.0 171.0764 24000.0 172.0599 11000.0 173.0925 8000.0 173.5279 19000.0 173.536 15000.0 173.544 3600.0 174.3162 2800.0 175.0213 120000.0 175.0716 7100.0 177.0658 40000.0 178.0628 7300.0 178.9096 2600.0 179.1138 2900.0 181.0318 28000.0 181.0605 33000.0 182.0532 13000.0 182.0811 140000.0 190.0168 18000.0 192.0476 11000.0 193.0318 530000.0 193.052 5300.0 194.0348 19000.0 195.0764 57000.0 199.0711 39000.0 203.0158 2900.0 205.7985 2500.0 210.058 61000.0 210.0768 39000.0 216.9795 2800.0 216.9975 81000.0 218.0594 2400.0 220.0431 4200.0 221.0266 11000.0 222.0881 7400.0 223.0713 82000.0 228.0867 35000.0 235.0082 12000.0 239.0371 15000.0 241.0818 20000.0 245.1124 3200.0 246.0602 3100.0 268.0926 18000.0 276.0691 26000.0 280.0615 2500.0 303.0816 2800.0 326.069 21000.0 364.6182 2200.0 417.9692 2500.0 439.8545 2600.0 465.1558 2400.0 END IONS BEGIN IONS SCANS=86 PEPMASS=215.0167 CHARGE=1 COLLISION_ENERGY=0.0 44.0492 2100.0 47.0316 2000.0 51.3939 2400.0 53.5638 2100.0 55.9342 7200.0 56.0494 2700.0 57.4785 2200.0 58.0647 2300.0 59.6762 2100.0 61.5765 2500.0 63.377 2900.0 66.3082 2500.0 67.3769 2200.0 69.1618 2200.0 70.0649 12000.0 72.0221 2200.0 72.0805 690000.0 90.9475 19000.0 96.8205 2300.0 106.8511 2400.0 111.2464 2700.0 115.1003 2200.0 118.3394 2400.0 127.4809 2300.0 132.9586 2700.0 142.364 2300.0 173.5212 7100.0 173.5295 23000.0 173.5399 18000.0 185.6008 2700.0 195.5532 2300.0 201.3015 2600.0 215.1396 12000.0 END IONS BEGIN IONS SCANS=87 PEPMASS=438.9798 CHARGE=1 COLLISION_ENERGY=0.0 55.9345 27000.0 56.935 2600.0 66.4708 2400.0 69.95 7600.0 70.958 23000.0 71.9293 15000.0 72.9373 53000.0 73.9375 3800.0 73.9452 10000.0 79.424 2800.0 87.9606 15000.0 88.963 2200.0 88.9685 19000.0 89.94 28000.0 90.9412 4600.0 90.9477 170000.0 90.9544 3400.0 91.9483 6100.0 91.9538 14000.0 95.8642 2300.0 98.2336 2300.0 101.9763 9600.0 102.9477 20000.0 105.9347 17000.0 106.9427 3600.0 107.9505 33000.0 108.9575 21000.0 112.9689 3600.0 114.4248 2400.0 114.9487 12000.0 114.9839 7200.0 115.9554 9900.0 116.9633 25000.0 117.9347 3100.0 123.9451 6600.0 125.961 10000.0 126.9477 2200.0 126.9846 3500.0 127.9555 13000.0 128.9637 16000.0 128.9999 76000.0 129.9714 4100.0 130.9791 370000.0 130.9922 8300.0 131.9505 54000.0 132.9583 190000.0 133.9659 12000.0 137.0595 12000.0 140.964 13000.0 143.9504 33000.0 143.9868 29000.0 144.9529 14000.0 144.9893 19000.0 145.9662 150000.0 146.9683 64000.0 147.9449 3900.0 147.9819 45000.0 148.989 62000.0 149.9611 74000.0 150.9683 66000.0 151.9775 3400.0 154.9788 8300.0 156.9583 34000.0 156.995 30000.0 157.9649 8900.0 158.9581 9200.0 158.974 500000.0 158.9893 4700.0 160.9533 120000.0 161.9612 67000.0 161.997 2300.0 162.9634 28000.0 163.9377 2500.0 163.9769 18000.0 164.9787 8400.0 165.9927 24000.0 166.9948 15000.0 167.9717 7600.0 170.0024 4800.0 171.0077 5300.0 171.9454 3000.0 172.4899 2400.0 172.9898 96000.0 173.5285 22000.0 173.5449 4200.0 173.9613 58000.0 174.9681 110000.0 176.9847 62000.0 178.964 23000.0 182.9741 19000.0 183.0106 3200.0 184.9533 83000.0 184.9893 9100.0 186.9323 7900.0 187.0017 3100.0 187.9406 53000.0 188.9431 40000.0 189.021 30000.0 189.9559 2900.0 190.9588 3500.0 191.0006 17000.0 191.9718 63000.0 192.9769 67000.0 196.9888 11000.0 198.9695 16000.0 199.0054 240000.0 200.9848 89000.0 201.9562 87000.0 202.9625 230000.0 204.9432 3500.0 205.9514 25000.0 206.9533 19000.0 213.9929 7800.0 214.5464 3000.0 214.9993 69000.0 216.9785 8700.0 217.016 20000.0 218.9951 10000.0 219.9668 160000.0 220.9701 170000.0 224.9847 56000.0 226.9642 49000.0 227.0004 76000.0 228.9431 16000.0 228.9795 23000.0 230.9586 7400.0 240.9785 7600.0 242.9946 31000.0 244.9741 26000.0 245.0083 4800.0 246.9536 110000.0 252.9793 54000.0 254.9588 16000.0 263.9565 2700.0 264.9641 87000.0 268.974 15000.0 270.9542 3400.0 270.9893 12000.0 279.4735 2900.0 286.9839 3600.0 334.9722 3700.0 404.0551 2500.0 END IONS BEGIN IONS SCANS=88 PEPMASS=282.0978 CHARGE=1 COLLISION_ENERGY=0.0 48.2292 2200.0 54.5216 2400.0 55.0538 2500.0 55.9345 3200.0 57.0698 7600.0 59.0212 2400.0 60.1997 2300.0 60.6639 2500.0 62.3817 2400.0 62.7028 2400.0 63.5489 2900.0 64.4875 2700.0 67.1773 2200.0 68.6118 2300.0 69.0697 10000.0 73.0281 6500.0 73.3337 2200.0 74.492 2600.0 75.4466 2600.0 76.8384 2300.0 80.6672 2600.0 81.0691 3000.0 83.0852 9500.0 84.1391 2700.0 85.0281 18000.0 86.2987 2400.0 91.054 91000.0 91.2994 2500.0 95.596 2600.0 102.7231 2600.0 104.0074 2700.0 109.0649 6700.0 115.9439 2300.0 117.4694 2300.0 119.0489 71000.0 121.0645 10000.0 122.0607 3900.0 134.0963 47000.0 134.8005 2300.0 136.0624 13000.0 137.0595 1300000.0 137.0694 10000.0 144.9101 2400.0 146.0443 8800.0 146.6448 2300.0 150.0547 46000.0 151.075 11000.0 157.0649 2700.0 161.0456 2500.0 161.0597 34000.0 162.0549 26000.0 163.0628 2900.0 164.0706 39000.0 168.2791 2200.0 170.0719 2800.0 172.0756 3200.0 172.8346 2600.0 173.0598 78000.0 173.5231 22000.0 173.5372 47000.0 175.0753 18000.0 176.0705 52000.0 183.8555 2500.0 184.3159 2500.0 189.0545 65000.0 190.0863 86000.0 191.0706 40000.0 192.0656 61000.0 193.0318 8000.0 196.4578 2600.0 200.0707 24000.0 201.0549 55000.0 201.074 3000.0 202.0849 3200.0 203.0691 3000.0 206.0814 3400.0 209.3841 2700.0 211.1355 14000.0 218.0318 4700.0 218.0812 3700000.0 219.0296 12000.0 219.0653 140000.0 219.0887 3900.0 220.0969 33000.0 222.0759 40000.0 223.0796 2600.0 226.5713 2400.0 236.0364 3500.0 236.0918 3200000.0 236.149 5000.0 237.0757 16000.0 246.0757 13000.0 251.327 2500.0 255.7474 2700.0 264.0866 210000.0 264.1165 3000.0 266.5247 2500.0 268.6202 2500.0 273.7513 3100.0 276.6951 2800.0 281.7846 2400.0 282.0975 120000.0 282.2219 130000.0 291.4858 2300.0 END IONS BEGIN IONS SCANS=89 PEPMASS=287.9808 CHARGE=1 COLLISION_ENERGY=0.0 49.049 2400.0 55.934 2700.0 58.9047 2300.0 58.9132 2400.0 64.0712 2200.0 70.9576 54000.0 72.9369 110000.0 86.0964 7200.0 88.9681 45000.0 90.0069 2300.0 90.9411 3600.0 90.9473 270000.0 97.4168 2700.0 102.9475 3800.0 107.8185 2400.0 108.958 28000.0 109.9685 25000.0 110.4356 2400.0 111.9841 56000.0 112.9682 36000.0 113.9549 3900.0 113.9634 840000.0 113.9715 8100.0 114.9474 9700.0 116.9633 7100.0 121.0645 17000.0 122.0594 3400.0 122.0681 6500.0 123.0634 3400.0 128.9631 3800.0 130.9788 140000.0 131.9739 89000.0 132.4171 2400.0 132.958 330000.0 132.9685 2700.0 135.0439 20000.0 140.9638 3800.0 142.9421 3000.0 148.9894 19000.0 149.6878 12000.0 149.6985 4000.0 150.0547 19000.0 150.9687 120000.0 151.0581 20000.0 155.9742 33000.0 156.9582 66000.0 158.9737 200000.0 160.3156 2500.0 160.9531 59000.0 167.034 3300.0 172.0056 24000.0 173.5309 22000.0 173.5426 4900.0 174.9689 70000.0 176.9844 24000.0 178.9648 6300.0 181.9901 30000.0 183.9691 11000.0 184.9533 18000.0 186.9326 7200.0 189.9821 2600.0 191.0696 6400.0 192.9794 19000.0 197.985 39000.0 202.9636 22000.0 203.0602 2800.0 204.944 6900.0 208.8829 17000.0 226.8942 2500.0 266.9602 2300.0 END IONS BEGIN IONS SCANS=90 PEPMASS=312.1083 CHARGE=1 COLLISION_ENERGY=0.0 48.3874 2000.0 49.5658 2900.0 53.0384 9000.0 55.0176 8500.0 57.0333 16000.0 59.049 2400.0 61.0251 2700.0 61.0281 52000.0 62.9044 2700.0 65.271 2300.0 69.0332 64000.0 70.8145 2200.0 71.0489 8600.0 72.1964 2500.0 73.0281 18000.0 73.6469 2300.0 75.2388 2100.0 81.0331 29000.0 82.8148 2400.0 84.673 2700.0 85.0281 180000.0 87.0437 17000.0 91.0387 11000.0 94.0652 5600.0 97.0282 62000.0 99.0438 9100.0 103.0388 12000.0 104.0492 3200.0 109.0282 23000.0 122.0598 79000.0 123.0434 2700.0 126.5524 2400.0 127.0388 29000.0 132.0442 60000.0 136.0754 6300.0 137.0597 4700.0 139.6684 2900.0 145.0498 3800.0 150.0268 8400.0 150.0548 1300000.0 150.0912 35000.0 161.0599 3900.0 163.0624 3300.0 164.0706 99000.0 167.0341 8000.0 173.5251 10000.0 173.5382 21000.0 177.0783 9300.0 178.0863 100000.0 180.9801 4200.0 190.0321 15000.0 190.086 19000.0 201.0781 9000.0 202.0859 12000.0 203.0711 3800.0 204.0657 3800.0 204.1021 6800.0 206.0814 37000.0 208.0426 17000.0 214.0844 2700.0 218.0809 10000.0 219.0894 24000.0 220.0967 9100.0 222.0763 8700.0 224.7175 2500.0 230.0806 8700.0 232.0979 4600.0 236.0647 5300.0 236.0919 110000.0 248.0918 7900.0 250.1074 13000.0 257.0885 2800.0 258.0766 5500.0 266.1024 36000.0 267.9897 2900.0 294.0976 29000.0 294.4809 2600.0 294.9759 11000.0 295.4422 2700.0 312.1082 130000.0 312.1489 3500.0 END IONS BEGIN IONS SCANS=91 PEPMASS=229.155 CHARGE=1 COLLISION_ENERGY=0.0 43.9377 2200.0 44.0493 29000.0 44.4252 2400.0 49.6355 2200.0 52.7414 2200.0 53.275 2100.0 55.0177 35000.0 57.0333 18000.0 57.8181 2100.0 58.0648 690000.0 58.0699 4500.0 59.0726 150000.0 60.0805 960000.0 60.084 8700.0 62.0833 2200.0 65.0281 2200.0 66.4169 2600.0 68.0491 72000.0 69.0581 3100.0 70.0649 3700000.0 70.0706 42000.0 70.0715 24000.0 70.0737 9400.0 70.0766 3800.0 71.6704 2500.0 72.0805 26000.0 73.0282 8500.0 77.8232 2500.0 79.1737 2300.0 79.9768 2500.0 80.9448 5200.0 83.3419 2400.0 84.0806 9300.0 85.0841 3000.0 87.8738 2700.0 96.0804 76000.0 98.0596 70000.0 98.9554 2500.0 101.325 2300.0 107.6665 2500.0 108.2066 2300.0 108.2835 2200.0 111.0204 2500.0 114.0545 450000.0 114.0639 5400.0 114.0909 140000.0 115.8305 2300.0 115.9637 15000.0 116.0702 88000.0 116.9658 67000.0 124.0655 4800.0 124.0753 460000.0 124.2049 2400.0 125.1157 5200.0 126.0909 90000.0 129.4479 2400.0 132.1014 5100.0 142.0735 5600.0 142.0859 3800000.0 142.0967 57000.0 143.4738 2300.0 143.5369 2600.0 149.6762 2900.0 149.6869 6200.0 149.7079 4200.0 150.9163 2800.0 156.9976 21000.0 157.6922 2600.0 170.0812 120000.0 173.5235 12000.0 173.5372 52000.0 182.9773 11000.0 187.9159 6100.0 229.1012 6400.0 229.1546 2900000.0 229.1809 4600.0 229.2084 6900.0 END IONS BEGIN IONS SCANS=92 PEPMASS=331.0931 CHARGE=1 COLLISION_ENERGY=0.0 52.2543 2200.0 53.5698 2200.0 55.6356 2500.0 57.0699 2500.0 63.0444 2500.0 96.7498 2600.0 123.0441 11000.0 144.3038 2100.0 163.2307 2300.0 173.5217 4200.0 173.5375 20000.0 178.2903 2400.0 212.0707 74000.0 213.0547 28000.0 214.8889 2700.0 222.0555 16000.0 225.0532 5400.0 230.0815 18000.0 240.0655 190000.0 241.0498 44000.0 243.0645 3400.0 250.0498 110000.0 258.0759 140000.0 266.0451 3800.0 267.0774 8000.0 268.0273 4700.0 268.0604 190000.0 277.0626 11000.0 278.045 72000.0 284.0572 4900.0 285.0875 8400.0 286.0713 74000.0 295.0715 39000.0 296.0556 130000.0 313.0823 27000.0 314.0659 28000.0 END IONS BEGIN IONS SCANS=93 PEPMASS=437.9734 CHARGE=1 COLLISION_ENERGY=0.0 55.9344 74000.0 56.9423 4400.0 69.95 25000.0 71.9292 55000.0 72.9324 3800.0 72.9371 110000.0 73.945 44000.0 74.6489 2200.0 74.9527 7400.0 77.5614 2200.0 85.9452 5300.0 87.9548 4300.0 87.9606 58000.0 88.9324 2600.0 89.9332 2900.0 89.9398 100000.0 89.9463 4900.0 90.9411 5600.0 90.9476 180000.0 90.9528 3600.0 91.9554 42000.0 99.9607 5500.0 101.9762 29000.0 102.9476 26000.0 103.9555 8300.0 105.9347 63000.0 105.9427 3500.0 105.9711 10000.0 106.9426 21000.0 107.9504 92000.0 108.9582 20000.0 111.9605 8100.0 113.9398 4300.0 113.9635 3400.0 113.977 2400.0 114.9484 5600.0 115.9555 38000.0 116.9274 2300.0 116.9633 14000.0 117.9348 14000.0 117.9709 8300.0 118.9425 15000.0 120.9581 3300.0 121.0646 3500.0 121.5089 2600.0 123.9453 21000.0 124.9527 5700.0 125.961 37000.0 127.9556 45000.0 127.9914 3800.0 128.9631 2700.0 129.9712 31000.0 130.9792 22000.0 131.9504 160000.0 131.9868 17000.0 132.9583 120000.0 133.966 52000.0 134.9733 3200.0 135.9452 6400.0 136.9529 5600.0 137.0598 11000.0 140.0467 3100.0 142.0071 6100.0 142.9426 3600.0 143.9504 140000.0 143.9634 5100.0 143.9868 150000.0 144.9582 3300.0 145.9661 610000.0 146.0015 4000.0 146.9378 5300.0 147.9453 16000.0 147.9817 150000.0 147.9955 3900.0 148.9893 6700.0 149.9466 3900.0 149.961 290000.0 150.9688 51000.0 151.9646 3700.0 151.9767 32000.0 153.0404 5100.0 154.0055 2800.0 154.0876 3500.0 154.9786 3200.0 155.9504 12000.0 157.966 33000.0 157.9784 4200.0 158.0025 7700.0 158.938 3800.0 158.974 9300.0 159.9455 22000.0 160.0186 3300.0 160.9533 6200.0 161.961 320000.0 161.9973 20000.0 163.9413 4600.0 163.961 5200.0 163.9767 100000.0 164.9479 7300.0 165.9568 5700.0 165.9924 150000.0 167.9717 42000.0 169.9661 8600.0 170.0025 50000.0 171.9455 18000.0 171.982 8700.0 173.5326 25000.0 173.9611 210000.0 175.977 25000.0 177.956 14000.0 179.9716 10000.0 183.9819 3300.0 185.9976 23000.0 187.9404 250000.0 187.9603 4700.0 187.9706 4300.0 187.979 3300.0 188.0127 4500.0 189.956 36000.0 189.993 4000.0 191.9716 350000.0 195.9821 10000.0 197.9977 8200.0 200.9854 7000.0 201.9562 160000.0 201.9903 4600.0 202.9626 3000.0 204.0084 5400.0 205.951 160000.0 206.0235 20000.0 207.9661 3800.0 209.9823 19000.0 213.9926 78000.0 215.9357 6800.0 215.9717 5500.0 216.0087 4800.0 217.9508 4900.0 217.9878 4000.0 219.9666 940000.0 221.9702 3200.0 223.9779 7300.0 229.9866 4800.0 232.0028 7000.0 233.9816 4400.0 235.961 3100.0 237.9402 3100.0 239.9719 11000.0 241.9876 7200.0 242.9833 8000.0 243.9661 3900.0 245.9459 15000.0 257.9819 14000.0 263.9568 8500.0 264.9654 3400.0 267.9662 9000.0 269.9448 2800.0 283.9589 3000.0 285.9768 5100.0 301.9716 6000.0 303.989 3800.0 329.968 12000.0 352.1554 2700.0 END IONS BEGIN IONS SCANS=94 PEPMASS=462.2128 CHARGE=1 COLLISION_ENERGY=0.0 58.065 920000.0 58.0683 9200.0 58.0699 6700.0 72.0805 8300.0 73.0287 2300.0 82.9064 2200.0 85.0281 24000.0 87.5083 2300.0 91.8152 2600.0 93.8284 2300.0 97.0277 5300.0 99.0441 2600.0 107.0489 88000.0 116.0636 2000.0 116.3218 2600.0 116.6603 2200.0 119.0493 2600.0 121.0645 51000.0 123.0438 19000.0 127.0389 5900.0 131.0652 2400.0 135.0442 2500.0 137.0594 35000.0 143.0484 3400.0 145.0645 19000.0 147.0804 11000.0 149.4366 2400.0 152.8922 2300.0 154.086 6100.0 161.0595 41000.0 161.8863 2300.0 163.0753 6900.0 173.5228 14000.0 173.5383 36000.0 209.0965 2500.0 237.0907 3800.0 239.1058 6200.0 250.4778 2400.0 255.1013 230000.0 255.1327 4000.0 257.1171 84000.0 278.1894 2600.0 300.1024 3800.0 300.1596 450000.0 300.1915 2200.0 306.8652 2600.0 309.2583 2900.0 406.1834 2300.0 462.2119 830000.0 END IONS BEGIN IONS SCANS=95 PEPMASS=254.1614 CHARGE=1 COLLISION_ENERGY=0.0 48.7765 7400.0 48.7785 38000.0 49.6994 2300.0 56.6969 2500.0 58.3817 2400.0 60.0554 32000.0 61.4624 2300.0 64.6683 2400.0 65.138 2700.0 69.0335 10000.0 69.2378 2500.0 70.065 770000.0 70.0689 3000.0 70.0714 3700.0 70.7498 2500.0 71.0492 16000.0 75.7881 2900.0 82.065 17000.0 82.55 2600.0 87.044 17000.0 87.0635 3200.0 88.0756 22000.0 91.0542 10000.0 92.0768 2700.0 97.0759 88000.0 98.0599 630000.0 98.0706 4500.0 99.0677 2800.0 100.0757 3100.0 105.8544 3000.0 112.0868 69000.0 115.0867 7200.0 116.0704 6600.0 122.0963 65000.0 125.0708 1000000.0 125.0796 5200.0 125.9648 2700.0 130.148 2800.0 137.0597 36000.0 140.0815 12000.0 149.1074 6400.0 150.0911 13000.0 153.0657 22000.0 154.0734 28000.0 156.4306 3200.0 157.5716 2700.0 164.1189 6900.0 166.134 170000.0 166.9792 14000.0 167.1179 1900000.0 173.533 35000.0 177.1027 13000.0 178.9791 9200.0 185.1036 31000.0 192.1139 2800.0 193.0971 23000.0 194.1289 770000.0 194.9738 28000.0 195.0583 8000.0 195.0704 75000.0 195.0801 51000.0 195.1128 11000000.0 195.1463 45000.0 195.1548 73000.0 195.1675 21000.0 195.1782 11000.0 196.9894 13000.0 205.9894 6900.0 206.0809 4100.0 208.0974 2800.0 208.9897 69000.0 209.1198 2800.0 209.1402 32000.0 212.1394 34000.0 212.9835 3500.0 217.5218 2600.0 220.1083 55000.0 224.0009 25000.0 226.0161 81000.0 226.9999 17000.0 237.1348 110000.0 247.141 2700.0 254.1164 4000.0 254.1612 520000.0 END IONS BEGIN IONS SCANS=96 PEPMASS=241.1549 CHARGE=1 COLLISION_ENERGY=0.0 43.0177 6300.0 43.5438 2100.0 45.248 2300.0 47.0687 2100.0 48.3308 2400.0 49.2312 2500.0 49.8285 2500.0 50.1119 2200.0 50.2211 2200.0 53.9387 27000.0 55.9342 5300.0 56.2748 2200.0 58.0648 200000.0 58.8158 2300.0 62.1238 2200.0 62.4405 2200.0 67.9544 5400.0 69.9336 12000.0 70.0648 22000.0 70.9413 27000.0 71.9492 3500.0 72.8355 2200.0 73.8687 2400.0 76.4263 2600.0 78.801 2600.0 78.9362 2400.0 81.0332 2600.0 81.0445 2500.0 84.0803 88000.0 85.9647 8200.0 87.9441 14000.0 88.9128 2700.0 88.9519 41000.0 89.9597 2600.0 98.0959 12000.0 100.1111 3000.0 103.9393 8700.0 105.9546 15000.0 110.071 2700.0 116.9474 2500.0 123.6785 2400.0 123.9658 3000.0 126.0911 2500.0 126.9233 2300.0 128.1066 67000.0 128.8087 2200.0 129.9547 20000.0 130.9628 9200.0 136.0744 2600.0 143.9701 18000.0 144.1019 18000.0 145.0778 2700.0 145.9868 6600.0 147.9652 32000.0 148.9747 2700.0 149.0953 2800.0 149.6871 16000.0 149.708 3200.0 156.1729 2600.0 161.0702 6200.0 165.9767 3000.0 166.9109 2300.0 168.1008 6700.0 171.966 8100.0 173.5296 17000.0 173.5381 3800.0 189.9762 11000.0 194.9429 13000.0 196.0965 93000.0 197.9973 13000.0 200.5061 2200.0 203.4803 2600.0 203.8833 6800.0 205.4919 2400.0 239.1345 2300.0 241.1545 720000.0 243.8376 2700.0 END IONS BEGIN IONS SCANS=97 PEPMASS=210.0612 CHARGE=1 COLLISION_ENERGY=0.0 43.0177 25000.0 44.5128 2400.0 52.5352 2500.0 55.162 2300.0 56.63 2200.0 57.978 2100.0 58.1545 2300.0 58.7639 2500.0 59.6194 2600.0 66.0408 2700.0 68.9968 23000.0 79.173 2500.0 83.8544 2200.0 84.1977 2300.0 87.0072 4300.0 91.0535 3000.0 96.067 2200.0 103.3024 2200.0 111.0072 27000.0 115.6297 2000.0 116.966 6000.0 117.9664 2600.0 129.0179 75000.0 137.0594 18000.0 139.0023 55000.0 139.0126 2500.0 149.6714 6500.0 149.6866 17000.0 149.6932 4500.0 157.0127 4100.0 173.5247 3000.0 173.5337 14000.0 174.0549 2900.0 184.6501 2500.0 192.0656 23000.0 END IONS BEGIN IONS SCANS=98 PEPMASS=393.9837 CHARGE=1 COLLISION_ENERGY=0.0 55.9342 47000.0 62.3632 2000.0 69.9499 14000.0 71.929 29000.0 72.552 2200.0 72.9368 52000.0 73.9446 20000.0 74.3905 2200.0 85.0281 11000.0 85.3851 2400.0 85.6291 3100.0 87.9603 28000.0 89.9395 49000.0 90.9474 91000.0 91.9554 15000.0 101.976 24000.0 103.955 2600.0 105.9344 36000.0 107.9501 61000.0 108.9582 2500.0 109.3602 2900.0 115.9553 20000.0 116.5575 2500.0 116.9628 3600.0 117.9345 9800.0 118.9421 6900.0 119.0487 18000.0 121.0645 8000.0 123.9454 2600.0 125.961 20000.0 127.9549 7200.0 129.9707 19000.0 130.9789 10000.0 131.9501 90000.0 132.958 64000.0 133.9658 29000.0 137.0481 3600.0 137.0594 140000.0 141.0005 6300.0 142.0053 3500.0 142.9959 12000.0 143.9502 42000.0 143.9865 73000.0 145.9537 4600.0 145.9658 290000.0 145.9793 8500.0 147.0314 2500.0 147.0437 89000.0 147.9813 99000.0 149.6648 3400.0 149.6855 6400.0 149.6964 3800.0 149.9607 170000.0 150.9687 24000.0 151.9763 18000.0 155.9507 9600.0 157.9662 13000.0 159.9458 3200.0 161.9609 78000.0 161.9969 5800.0 163.9765 40000.0 165.9921 61000.0 167.9715 13000.0 170.0024 23000.0 171.9468 3600.0 173.5313 41000.0 173.961 130000.0 175.9761 2900.0 176.1505 2400.0 179.0702 47000.0 185.9971 3600.0 187.9401 70000.0 189.956 6600.0 191.9714 140000.0 201.9559 140000.0 205.9508 36000.0 213.9926 18000.0 219.9422 3200.0 219.9666 210000.0 223.9783 2500.0 262.1714 2800.0 320.6375 2300.0 394.3459 9900.0 END IONS BEGIN IONS SCANS=99 PEPMASS=236.0921 CHARGE=1 COLLISION_ENERGY=0.0 43.4275 2100.0 43.9024 2800.0 47.807 2300.0 48.0619 2500.0 48.0945 2100.0 48.3284 2400.0 48.4554 2300.0 50.9638 2200.0 51.3509 2200.0 54.52 29000.0 54.5216 4900.0 55.0179 9600.0 55.9342 2500.0 60.1418 2100.0 60.2839 2600.0 61.7243 2100.0 62.2495 2700.0 66.1159 2600.0 66.3361 2000.0 69.0698 2400.0 71.0492 2300.0 73.0454 2100.0 74.1914 2100.0 75.862 2500.0 76.0731 2500.0 76.5983 2100.0 78.1114 2200.0 83.3433 2600.0 84.3505 2400.0 86.0966 2600.0 88.5016 2600.0 89.0386 3100.0 91.0542 12000.0 91.7544 2200.0 93.2829 2200.0 96.2139 2700.0 98.0598 3300.0 99.879 2200.0 106.0647 10000.0 106.8391 2400.0 109.8932 2100.0 115.0541 7700.0 116.0495 26000.0 117.0699 6100.0 117.1149 2400.0 119.0487 6700.0 129.0696 20000.0 131.0493 15000.0 132.6688 2300.0 134.06 82000.0 135.0441 60000.0 137.0596 130000.0 137.4177 2800.0 141.2733 2500.0 143.0493 6600.0 144.0807 91000.0 145.0648 29000.0 146.0594 5900.0 147.0439 28000.0 149.0598 27000.0 149.6818 5400.0 149.6928 4000.0 149.7034 3200.0 151.9046 2600.0 157.0652 7400.0 161.06 8900.0 162.055 770000.0 162.0912 41000.0 163.0628 96000.0 164.0706 6700.0 172.0758 120000.0 173.0604 18000.0 173.5282 51000.0 173.5429 21000.0 175.062 17000.0 175.0764 16000.0 176.0712 15000.0 177.0547 13000.0 189.0775 5500.0 190.0679 5000.0 190.0864 1100000.0 194.9737 3000.0 200.0705 56000.0 201.0792 15000.0 203.0582 9700.0 216.0649 2200.0 218.0038 8200.0 218.0178 18000.0 218.0316 71000.0 218.0416 49000.0 218.0812 12000000.0 218.1208 48000.0 218.1312 70000.0 218.1454 20000.0 218.9935 7700.0 219.0151 6200.0 223.7893 2800.0 236.0649 3400.0 236.0918 1500000.0 236.1213 5800.0 243.9864 2500.0 END IONS BEGIN IONS SCANS=100 PEPMASS=267.0979 CHARGE=1 COLLISION_ENERGY=0.0 55.1962 2100.0 64.8927 2300.0 66.4617 2400.0 67.054 11000.0 83.2674 2200.0 94.0585 3200.0 94.0649 66000.0 100.039 18000.0 101.0232 2700.0 103.1215 2700.0 106.0648 26000.0 122.0598 77000.0 140.2413 2500.0 149.67 3700.0 149.6824 9500.0 149.6918 15000.0 149.7028 6500.0 150.0267 5100.0 150.0548 1300000.0 162.055 23000.0 162.392 2500.0 168.0655 44000.0 173.5317 17000.0 178.6542 2400.0 180.0652 2900.0 192.3783 2300.0 195.9773 2600.0 208.0606 23000.0 END IONS BEGIN IONS SCANS=101 PEPMASS=300.1447 CHARGE=1 COLLISION_ENERGY=0.0 50.8989 2400.0 57.0333 130000.0 65.0385 2900.0 66.6101 2200.0 71.0489 4900.0 73.028 81000.0 75.0438 630000.0 75.0487 4400.0 75.0513 5700.0 83.049 9000.0 83.6183 2600.0 85.0281 54000.0 86.5131 2500.0 90.9479 6800.0 91.0483 4200.0 91.0539 130000.0 98.4725 2300.0 100.3406 2200.0 104.799 2800.0 109.0646 15000.0 111.044 5300.0 119.0405 3300.0 119.0488 96000.0 121.0648 8700.0 124.9678 2500.0 137.0594 1900000.0 137.0695 27000.0 137.0837 16000.0 144.9578 2500.0 148.825 2500.0 153.7004 2300.0 154.086 32000.0 156.2834 2400.0 158.7841 2500.0 167.267 2700.0 168.9579 2400.0 173.5214 13000.0 173.5397 29000.0 180.842 2900.0 187.7868 2400.0 193.0325 4300.0 197.8891 2700.0 200.0654 2500.0 END IONS BEGIN IONS SCANS=102 PEPMASS=242.9828 CHARGE=1 COLLISION_ENERGY=0.0 44.4431 2100.0 46.4163 2200.0 48.724 2700.0 51.0463 2100.0 51.4622 2200.0 51.6609 2400.0 52.9244 2300.0 55.0177 28000.0 55.4904 2200.0 55.9342 820000.0 55.9371 2400.0 56.942 41000.0 57.7797 2500.0 59.0736 2100.0 59.5853 3200.0 60.0931 2200.0 62.4588 2300.0 62.4817 2500.0 66.9674 2100.0 68.8185 2300.0 69.9497 280000.0 70.9577 11000.0 71.929 380000.0 71.9336 2400.0 72.9369 870000.0 72.9411 3300.0 73.2138 2400.0 73.9404 3200.0 73.9447 180000.0 74.9526 19000.0 76.7853 2500.0 78.3255 2500.0 81.95 5000.0 81.9762 2400.0 83.9655 44000.0 85.9448 20000.0 87.9603 420000.0 87.9668 5600.0 88.9685 2600.0 89.9396 460000.0 89.9455 2800.0 90.9475 1100000.0 90.9533 3700.0 90.9545 5100.0 91.9443 2400.0 91.9552 120000.0 95.0318 2600.0 99.9604 42000.0 100.1219 2200.0 100.9315 3000.0 101.9759 120000.0 102.9474 22000.0 102.9552 2200.0 103.9553 50000.0 105.9343 250000.0 105.9709 24000.0 107.9501 460000.0 107.9583 7400.0 108.9579 75000.0 111.9603 110000.0 113.9397 7200.0 113.9635 7800.0 114.8711 2400.0 114.9479 10000.0 115.9552 100000.0 116.9636 30000.0 117.9344 61000.0 117.9709 45000.0 118.9425 44000.0 121.966 2600.0 123.9451 75000.0 125.9607 150000.0 128.9505 27000.0 129.0178 16000.0 129.971 88000.0 130.9811 15000.0 131.9502 610000.0 131.9604 2800.0 132.1223 2700.0 132.958 350000.0 133.9549 3300.0 133.9659 150000.0 135.9451 23000.0 136.953 7500.0 141.7192 2400.0 143.9502 17000.0 145.952 3500.0 145.9658 540000.0 145.9808 9900.0 147.9679 3200.0 147.9814 250000.0 147.9943 2400.0 149.6856 5100.0 149.6957 3400.0 149.9467 5200.0 149.9608 1100000.0 149.9708 2500.0 149.9748 4900.0 150.9686 130000.0 151.9764 87000.0 154.485 2100.0 155.9501 54000.0 156.1101 3000.0 157.9661 13000.0 160.8403 2700.0 161.9605 33000.0 163.9765 70000.0 165.9921 180000.0 167.9715 120000.0 173.5331 42000.0 173.9437 5100.0 173.9609 310000.0 173.9754 2100.0 178.6438 2500.0 178.9217 14000.0 180.887 2400.0 187.9406 18000.0 191.9714 380000.0 191.9911 4900.0 196.9326 29000.0 197.8915 12000.0 201.956 37000.0 202.0077 2400.0 205.952 3100.0 209.9817 5600.0 212.2846 2700.0 218.0975 2300.0 219.9664 57000.0 230.405 2300.0 237.3806 2500.0 243.1599 4700.0 250.9589 2600.0 END IONS BEGIN IONS SCANS=103 PEPMASS=322.0776 CHARGE=1 COLLISION_ENERGY=0.0 49.4322 2100.0 50.3921 2300.0 52.6012 2200.0 53.4733 2500.0 54.5212 2700.0 55.3666 2700.0 55.8387 2100.0 56.0492 120000.0 57.0452 2600.0 61.4665 2300.0 62.091 2500.0 62.8946 2200.0 63.2738 2200.0 64.2634 2300.0 65.7157 2200.0 70.8952 2200.0 72.0806 12000.0 72.7155 2200.0 73.044 2200.0 77.9611 2800.0 78.6619 2300.0 78.9927 2000.0 79.1694 2300.0 79.4507 2600.0 80.9179 2300.0 83.52 2200.0 84.0441 760000.0 85.028 130000.0 87.7521 2600.0 88.3165 2500.0 93.3249 2800.0 96.035 2500.0 97.6726 2300.0 98.3347 2200.0 101.0227 2600.0 102.0546 220000.0 106.072 2500.0 111.0073 7500.0 115.8113 2000.0 128.0339 48000.0 129.018 88000.0 130.0496 330000.0 136.4759 2300.0 136.9599 2900.0 138.0183 81000.0 139.0023 19000.0 145.0285 7500.0 148.0601 7000.0 149.6924 2800.0 150.0546 3000.0 152.034 67000.0 152.0747 2700.0 156.0288 86000.0 158.8372 2200.0 161.5686 2300.0 166.0497 220000.0 170.5309 2800.0 170.9204 2800.0 173.5202 4900.0 173.5288 58000.0 173.5389 39000.0 174.0396 110000.0 174.6813 2500.0 175.0268 5500.0 176.0344 100000.0 177.0547 39000.0 180.0292 42000.0 183.2516 2500.0 183.4448 2400.0 184.0603 68000.0 193.6653 2500.0 194.0147 3200.0 194.0243 10000.0 194.0448 690000.0 194.0604 2300.0 194.0663 2300.0 196.6492 2400.0 198.0394 2800.0 204.0289 3100.0 212.0554 550000.0 212.0727 2300.0 216.9955 2500.0 222.04 71000.0 234.1117 11000.0 240.0506 44000.0 258.0596 3000.0 266.7544 2600.0 271.9769 2700.0 272.0714 3000.0 END IONS BEGIN IONS SCANS=104 PEPMASS=335.9418 CHARGE=1 COLLISION_ENERGY=0.0 50.7611 2500.0 51.5173 2100.0 51.7829 2400.0 53.9778 2400.0 55.9341 120000.0 56.0706 2400.0 58.2478 2400.0 59.9827 3200.0 65.2891 2400.0 69.9497 27000.0 71.5915 2600.0 71.929 59000.0 72.8747 2200.0 72.9368 150000.0 73.9447 47000.0 74.9125 2400.0 79.4275 2500.0 81.1788 2200.0 81.9497 2200.0 84.1278 2500.0 85.4755 2500.0 87.5721 2800.0 87.9601 52000.0 89.9395 110000.0 90.9412 2500.0 90.9473 200000.0 91.9552 33000.0 99.9602 16000.0 101.976 29000.0 103.9554 8400.0 105.9344 68000.0 107.9501 140000.0 108.1287 2400.0 108.9582 6300.0 110.6313 2200.0 111.9603 58000.0 114.3733 2500.0 115.6618 2300.0 115.9552 26000.0 116.9637 3800.0 117.9344 17000.0 118.9421 3700.0 123.9446 23000.0 125.9607 61000.0 129.9708 74000.0 131.9502 60000.0 132.9578 35000.0 133.9658 53000.0 137.0592 3500.0 145.9657 57000.0 147.9699 9800.0 147.9814 240000.0 147.9953 3500.0 148.446 2700.0 149.6825 5700.0 149.6931 4100.0 149.9608 97000.0 150.9687 9200.0 151.9764 33000.0 155.9503 28000.0 157.9659 64000.0 159.9447 6400.0 161.9605 8200.0 163.9763 2900.0 164.7773 2300.0 165.9922 180000.0 167.9718 8500.0 173.5348 60000.0 173.9609 230000.0 175.9775 5300.0 177.956 2800.0 183.9456 29000.0 185.925 6200.0 188.5371 2700.0 191.9714 620000.0 199.9401 43000.0 201.9558 31000.0 203.9352 170000.0 205.8995 4100.0 210.8537 2900.0 213.0181 2800.0 217.951 250000.0 219.9663 29000.0 221.945 4000.0 222.9927 6100.0 227.9354 58000.0 235.9618 39000.0 245.9458 140000.0 251.8321 2500.0 259.9705 2400.0 261.1246 2300.0 263.9556 10000.0 285.928 2300.0 END IONS BEGIN IONS SCANS=105 PEPMASS=254.1615 CHARGE=1 COLLISION_ENERGY=0.0 44.6134 2200.0 45.8878 2100.0 45.8969 2600.0 46.3508 2300.0 47.0146 2300.0 48.6111 2100.0 48.7777 29000.0 48.7793 5400.0 49.5702 2200.0 49.6558 2200.0 51.3546 2700.0 53.8371 2600.0 54.4726 2300.0 55.0191 2900.0 55.566 2200.0 57.713 2500.0 60.0555 23000.0 61.2521 2200.0 67.0777 2300.0 68.0495 2800.0 70.065 590000.0 70.0687 2600.0 71.0489 8900.0 74.37 2100.0 80.3625 2600.0 80.41 2400.0 82.0651 13000.0 88.0754 14000.0 89.7237 2400.0 97.076 58000.0 98.0599 490000.0 98.0674 5800.0 100.0755 4300.0 100.456 2100.0 103.9294 2500.0 107.0946 2100.0 112.0868 52000.0 120.5247 2500.0 122.0964 48000.0 124.2998 2400.0 125.0708 800000.0 125.0796 2600.0 140.0818 3600.0 143.0823 6000.0 149.1071 3800.0 150.091 8100.0 153.0656 21000.0 154.0738 17000.0 164.1185 6300.0 166.1338 120000.0 167.1178 1600000.0 173.5208 4800.0 173.53 47000.0 173.5392 8900.0 177.1028 14000.0 185.1034 16000.0 191.0468 2800.0 193.0973 18000.0 194.1288 640000.0 194.1452 2400.0 195.0704 50000.0 195.0804 26000.0 195.1128 9100000.0 195.1548 62000.0 195.1661 6200.0 195.1781 4300.0 204.8599 2700.0 209.1402 18000.0 212.1396 20000.0 214.3137 2400.0 220.108 45000.0 225.8973 2600.0 237.1347 97000.0 252.7655 2600.0 254.1612 440000.0 254.2077 2700.0 END IONS BEGIN IONS SCANS=106 PEPMASS=236.0922 CHARGE=1 COLLISION_ENERGY=0.0 44.4686 2700.0 45.8229 2500.0 46.2312 2300.0 46.2538 2300.0 46.7292 2400.0 47.5159 2200.0 48.4268 2200.0 48.6533 2200.0 49.1258 2500.0 49.2641 2300.0 49.5505 2500.0 50.0547 2200.0 50.1755 2200.0 50.3392 2200.0 50.5563 2400.0 50.6834 2200.0 51.2559 2200.0 51.499 2100.0 51.5666 2400.0 51.5863 2300.0 51.9651 2300.0 52.1052 2300.0 52.9581 2600.0 54.2603 2500.0 54.7672 2500.0 55.9342 12000.0 56.6135 2000.0 57.2419 2300.0 58.1489 2300.0 62.8777 2200.0 63.0197 2300.0 64.4555 2500.0 64.9477 2200.0 65.062 2700.0 65.5454 2600.0 65.6232 2100.0 66.2954 2100.0 67.1146 2300.0 70.0433 2100.0 70.4476 2200.0 70.8106 2600.0 70.9619 2300.0 71.0864 2600.0 71.3718 2300.0 71.5819 2600.0 72.7842 2600.0 73.1312 2600.0 74.9437 2500.0 75.0338 2200.0 76.2535 2400.0 77.4503 2200.0 78.099 2700.0 78.2361 2500.0 79.0467 2800.0 80.1444 2400.0 81.3244 2500.0 82.3071 2500.0 84.2717 2600.0 86.3787 2200.0 86.6861 2000.0 89.0099 2500.0 91.1087 2100.0 93.8861 2400.0 95.1676 2200.0 96.0596 2400.0 96.4917 2300.0 98.5591 2600.0 99.6687 2900.0 103.6728 2300.0 104.2693 2400.0 105.8849 2500.0 106.0643 3300.0 106.8476 2300.0 107.3581 2400.0 108.3716 2500.0 109.8878 2600.0 112.6172 2300.0 116.1279 2900.0 118.7166 2400.0 120.6768 2100.0 125.2968 2400.0 127.682 2300.0 127.8999 2300.0 128.1659 2400.0 132.7713 2500.0 134.0597 18000.0 135.0436 5300.0 137.0594 30000.0 140.3918 2300.0 141.5704 2300.0 142.476 2700.0 142.9509 2500.0 143.9078 2500.0 144.0809 17000.0 145.0643 2600.0 147.0443 3300.0 147.9089 2300.0 148.5612 2700.0 148.9478 2400.0 149.0593 3000.0 151.9261 2300.0 152.8678 2700.0 153.9522 2100.0 154.9212 2500.0 156.2955 2500.0 157.3939 2300.0 159.8256 2800.0 162.0548 270000.0 162.0909 2900.0 162.5342 2300.0 163.0624 12000.0 169.2432 2600.0 171.6146 2600.0 172.0756 29000.0 173.5253 110000.0 173.5398 81000.0 174.9569 2600.0 178.1599 2600.0 182.7554 2700.0 184.9414 19000.0 185.4211 2600.0 185.7648 2500.0 187.8861 2500.0 190.0862 370000.0 190.1059 3700.0 194.4625 2200.0 194.9437 22000.0 196.7 2300.0 198.7287 2500.0 200.0696 4900.0 202.9521 18000.0 204.1858 2200.0 213.839 2300.0 217.96 13000.0 218.0568 36000.0 218.0814 3800000.0 218.1064 19000.0 219.0134 21000.0 219.8723 2700.0 228.7002 2500.0 236.0648 4400.0 236.0919 530000.0 236.1174 4500.0 END IONS BEGIN IONS SCANS=107 PEPMASS=321.0852 CHARGE=1 COLLISION_ENERGY=0.0 49.0644 2500.0 49.9864 2300.0 51.2895 2400.0 52.5062 2300.0 53.3951 2400.0 55.9033 2200.0 60.5483 2600.0 60.6307 2400.0 61.0915 2500.0 61.7466 2200.0 62.9141 2600.0 64.1945 2600.0 64.4949 2300.0 64.8327 2300.0 66.1259 2300.0 66.6945 2200.0 67.107 2000.0 70.8383 2300.0 72.6841 2300.0 72.8408 2000.0 82.5688 2500.0 93.7182 2500.0 95.6617 2300.0 97.4101 2100.0 98.9638 2600.0 104.7906 2500.0 105.3221 2100.0 107.407 2400.0 107.8674 2500.0 108.7716 2800.0 110.6615 2400.0 115.7491 2600.0 116.9825 2500.0 126.1059 2300.0 131.049 5800.0 133.5513 2400.0 135.0435 3000.0 140.9063 2900.0 146.6924 2300.0 147.6235 2300.0 148.3833 2400.0 149.0598 30000.0 150.3327 2300.0 161.0596 22000.0 164.66 2500.0 165.488 2100.0 168.1406 3000.0 172.0022 10000.0 172.0195 6200.0 172.0368 5800000.0 172.0542 12000.0 172.0645 7400.0 172.0716 33000.0 173.0582 2700.0 173.5246 38000.0 173.5394 70000.0 173.6947 2400.0 173.9748 2000.0 175.2106 2300.0 194.0474 2500.0 195.0466 2400.0 196.0092 2800.0 198.3139 2400.0 198.4237 2600.0 203.2641 2700.0 212.0553 4800.0 212.8361 2300.0 218.586 2400.0 279.7158 2700.0 284.5151 2200.0 316.1362 2700.0 320.2665 2800.0 329.5608 2700.0 END IONS BEGIN IONS SCANS=108 PEPMASS=462.213 CHARGE=1 COLLISION_ENERGY=0.0 58.0648 270000.0 58.0683 3800.0 80.8918 2700.0 83.475 2200.0 85.0278 3100.0 91.8101 2200.0 100.2082 2600.0 107.0487 21000.0 121.0642 7200.0 123.0438 5000.0 131.0469 2300.0 137.0589 6500.0 145.0627 2600.0 147.0796 3100.0 148.8835 2200.0 161.0591 12000.0 173.5343 31000.0 177.7283 2700.0 224.7393 2600.0 234.9684 6600.0 243.0571 2500.0 251.9705 3100.0 255.101 71000.0 257.1167 23000.0 275.9705 8700.0 300.1593 130000.0 452.7038 2600.0 462.212 230000.0 466.1926 2600.0 END IONS BEGIN IONS SCANS=109 PEPMASS=284.1498 CHARGE=1 COLLISION_ENERGY=0.0 47.9821 2300.0 50.1538 2300.0 54.5484 2200.0 55.303 2400.0 55.607 2200.0 57.0332 36000.0 57.3363 2800.0 63.3368 2600.0 64.3273 2200.0 73.0281 19000.0 73.0547 2100.0 75.0437 160000.0 80.5652 2200.0 85.0282 5900.0 85.2184 2500.0 91.0539 25000.0 93.0695 59000.0 95.0489 17000.0 103.0538 28000.0 107.4551 2500.0 121.0644 1500000.0 121.0733 32000.0 151.4367 2200.0 173.5285 25000.0 173.5373 13000.0 198.6369 3000.0 200.5549 2300.0 231.1898 3300.0 284.295 15000.0 END IONS BEGIN IONS SCANS=110 PEPMASS=300.1449 CHARGE=1 COLLISION_ENERGY=0.0 47.57 2300.0 47.8905 2400.0 51.1296 2500.0 52.8392 2600.0 54.1116 2300.0 57.0332 210000.0 57.1592 2400.0 58.391 2100.0 64.8114 2200.0 66.369 2200.0 67.1147 2200.0 67.2187 2200.0 69.9804 2700.0 72.0806 3200.0 73.0281 130000.0 74.8762 2400.0 75.0438 1000000.0 75.0486 3300.0 79.1534 2500.0 83.049 5600.0 85.0281 71000.0 85.1082 2400.0 87.15 2400.0 91.0483 3000.0 91.0539 210000.0 92.5038 2900.0 92.5836 2200.0 98.0599 7300.0 98.4377 2200.0 106.4505 2500.0 109.0644 21000.0 111.0442 5400.0 117.1105 2500.0 119.0488 160000.0 121.8851 2200.0 127.6615 2400.0 129.21 2200.0 131.0488 2500.0 135.0438 25000.0 136.1827 3000.0 137.0594 3100000.0 137.0696 41000.0 138.0629 3000.0 143.888 2500.0 145.3701 2600.0 148.209 2700.0 151.4252 2200.0 152.7405 2600.0 154.086 51000.0 154.7116 2500.0 158.2307 2400.0 173.5283 75000.0 173.5405 25000.0 173.9238 2500.0 174.8284 2500.0 181.4727 2500.0 182.4376 2800.0 196.9346 2600.0 197.8903 22000.0 201.7589 2600.0 204.8919 2400.0 206.7183 2400.0 208.8863 3100.0 226.8992 2500.0 242.1752 2400.0 248.8819 3100.0 263.6756 2800.0 298.4416 2300.0 304.4622 2500.0 END IONS BEGIN IONS SCANS=111 PEPMASS=476.2286 CHARGE=1 COLLISION_ENERGY=0.0 57.0611 2200.0 57.1469 2400.0 58.065 1900000.0 58.0682 6100.0 60.0632 2000.0 62.1288 2400.0 62.2391 2400.0 63.7863 2800.0 65.1219 2600.0 65.2901 2500.0 66.1994 2400.0 66.3614 2400.0 67.2298 2600.0 69.0334 9400.0 70.2423 2100.0 70.951 2000.0 71.4147 2200.0 73.7031 2300.0 75.6312 2100.0 79.6327 2200.0 80.3783 2400.0 81.3204 2200.0 82.1988 2100.0 84.5571 2100.0 84.8006 2200.0 85.0282 31000.0 87.6228 2100.0 87.8283 2500.0 89.8753 2200.0 91.1024 2400.0 91.5647 2700.0 91.6498 2100.0 93.2016 2100.0 94.371 2600.0 95.6208 2400.0 96.6212 2100.0 98.1822 2100.0 98.2809 2500.0 102.6806 2300.0 104.7349 2500.0 105.3834 2600.0 105.7384 2300.0 106.0568 2400.0 106.8082 2600.0 107.0488 210000.0 107.3943 2800.0 109.0737 2500.0 109.656 2500.0 121.0645 73000.0 123.4296 2400.0 125.6312 2700.0 125.9122 2400.0 127.0384 2500.0 128.2295 2200.0 128.3814 2100.0 134.752 2500.0 137.0597 37000.0 142.3803 2300.0 145.0648 44000.0 147.08 21000.0 151.075 26000.0 153.7722 2300.0 157.5156 2300.0 159.2332 2300.0 162.0883 2400.0 173.5228 11000.0 173.5329 220000.0 173.5426 9900.0 175.0751 91000.0 177.0913 14000.0 182.7444 2600.0 183.0342 2200.0 190.2927 2300.0 194.8149 2300.0 198.369 2900.0 199.3685 2400.0 199.6036 2300.0 207.4219 2300.0 209.0956 5300.0 211.0736 2700.0 212.5123 2500.0 214.2957 2300.0 232.0537 2500.0 234.2265 2400.0 237.0908 71000.0 239.1067 19000.0 248.3815 2700.0 249.2491 2400.0 266.9042 2300.0 269.085 5200.0 269.117 760000.0 269.9685 2800.0 270.1053 2700.0 270.551 2700.0 271.1329 150000.0 282.7407 2400.0 301.9409 2900.0 303.4472 2300.0 311.8617 2300.0 314.1333 7600.0 314.1751 770000.0 320.7054 2400.0 327.7605 2600.0 328.1054 2500.0 336.3939 2700.0 350.1326 2300.0 353.5902 2400.0 358.1818 2500.0 369.7838 2400.0 379.5793 2300.0 382.4526 2300.0 388.0038 2400.0 393.7761 2300.0 405.7729 2600.0 425.1706 3300.0 456.6952 2400.0 469.6065 2400.0 476.2276 1400000.0 476.3406 3200.0 484.7595 2800.0 END IONS BEGIN IONS SCANS=112 PEPMASS=514.1385 CHARGE=1 COLLISION_ENERGY=0.0 59.4041 2500.0 63.9756 2400.0 64.1328 2200.0 65.7265 2200.0 66.3855 2300.0 68.668 2200.0 68.8571 2300.0 69.0332 7800.0 70.8251 2500.0 72.3793 2800.0 75.8677 2400.0 78.9846 3000.0 80.3275 2300.0 83.4437 2500.0 84.1407 2500.0 84.2268 2600.0 84.6291 2300.0 85.0282 63000.0 86.3059 2500.0 86.3514 2500.0 87.0436 6100.0 88.6844 2400.0 90.7024 2400.0 90.7172 2700.0 90.9195 2200.0 92.516 2400.0 93.1064 2400.0 94.3591 2700.0 97.0281 14000.0 98.5343 2200.0 98.6813 2200.0 102.6397 2500.0 104.1835 2600.0 106.7225 2500.0 107.0489 310000.0 107.0574 2600.0 107.3665 2200.0 108.3515 2600.0 109.5305 2200.0 114.7291 2200.0 116.2461 2300.0 118.2193 2600.0 120.2727 2400.0 120.8011 2300.0 123.0439 60000.0 127.0385 17000.0 128.4145 2500.0 135.5871 2300.0 137.2753 2200.0 141.1191 2600.0 143.049 17000.0 145.0499 3500.0 145.0645 43000.0 147.0443 2900.0 149.0586 2700.0 150.2321 2400.0 161.0594 160000.0 164.0705 77000.0 170.7755 2800.0 170.8949 2800.0 173.5265 120000.0 173.5402 68000.0 175.1635 2300.0 180.9707 2200.0 183.8235 2400.0 185.0636 2300.0 190.0253 2300.0 190.4391 2500.0 204.8162 2500.0 205.9256 2200.0 208.1477 2600.0 209.0962 2900.0 220.7204 2900.0 231.2102 2700.0 237.0909 9400.0 242.4989 2700.0 242.5405 2400.0 246.7422 2300.0 247.0078 2200.0 250.419 2200.0 255.0699 10000.0 255.0786 4300.0 255.1013 1100000.0 255.132 14000.0 256.5428 3100.0 268.9097 2500.0 270.8559 2400.0 272.1281 1200000.0 275.1496 2500.0 280.5091 2500.0 293.0682 2300.0 298.1156 2400.0 299.3896 2400.0 302.6125 2600.0 307.4678 2400.0 320.7115 2400.0 340.2664 2600.0 353.1187 2400.0 354.1335 2300.0 377.6311 2600.0 385.7667 2500.0 408.1603 2800.0 417.1604 2900.0 430.7695 2300.0 431.5673 2300.0 434.1115 4600.0 434.1807 1700000.0 434.251 4100.0 454.7706 2400.0 466.8594 2800.0 470.5595 2500.0 483.2468 2900.0 513.901 2400.0 END IONS BEGIN IONS SCANS=113 PEPMASS=379.0642 CHARGE=1 COLLISION_ENERGY=0.0 52.8068 2200.0 54.0381 2100.0 54.5907 2100.0 55.4361 2300.0 55.5977 2200.0 58.4361 2300.0 60.3292 2300.0 61.1467 2700.0 61.2807 2600.0 62.3638 2300.0 66.3836 2300.0 68.078 2300.0 68.7474 2200.0 68.9245 2600.0 71.2128 2300.0 73.7011 2200.0 74.539 2200.0 75.3483 2200.0 75.6097 2300.0 82.7795 2300.0 87.2338 2300.0 89.0616 2700.0 90.7077 2600.0 91.0539 3100.0 92.0495 2600.0 93.2767 2500.0 98.8562 2500.0 98.9206 2200.0 100.2854 2300.0 101.0304 2300.0 101.9649 2400.0 103.3486 2300.0 103.8037 2400.0 104.4729 2400.0 105.2743 2400.0 110.654 2600.0 113.2696 2500.0 119.0488 60000.0 127.12 2200.0 147.0437 810000.0 147.0549 2300.0 158.0568 2600.0 164.4783 2300.0 165.9894 2600.0 169.0258 170000.0 172.7929 2800.0 173.5326 140000.0 173.5447 5600.0 176.0829 2300.0 188.3801 2700.0 190.7406 2700.0 196.3984 2300.0 201.6423 2400.0 201.9554 2300.0 212.3073 2500.0 215.0146 7200.0 233.0267 580000.0 233.0516 4500.0 240.7657 2300.0 243.996 2900.0 265.6335 2600.0 269.4393 2500.0 277.6136 2300.0 280.9063 2600.0 287.3417 3200.0 294.008 2400.0 328.113 2400.0 372.0388 2600.0 385.326 2800.0 END IONS BEGIN IONS SCANS=114 PEPMASS=455.9992 CHARGE=1 COLLISION_ENERGY=0.0 59.2929 2500.0 61.7288 2300.0 65.5049 2500.0 66.6363 2200.0 66.9306 2000.0 71.2395 2400.0 73.6842 2300.0 74.0951 2400.0 82.8514 2100.0 84.0031 2200.0 91.0539 60000.0 95.0737 2600.0 97.2366 2500.0 98.1085 2500.0 99.4948 2500.0 99.754 2800.0 101.2168 2200.0 102.3462 2600.0 107.3143 2400.0 111.5436 2200.0 113.6893 3200.0 114.2993 2600.0 119.0488 180000.0 131.9496 2900.0 144.9578 12000.0 145.7516 2500.0 147.0437 1900000.0 147.0549 26000.0 152.9509 2700.0 157.9656 45000.0 158.1081 2800.0 163.7219 2100.0 167.906 2700.0 173.5203 5000.0 173.5336 110000.0 173.5449 3700.0 173.8401 2600.0 173.9624 2600.0 175.8048 2100.0 181.7727 2700.0 188.9397 2400.0 191.9865 25000.0 201.9725 3300.0 211.6345 2800.0 217.9659 20000.0 218.9741 57000.0 219.9816 79000.0 233.9609 27000.0 234.9682 6800.0 235.9766 36000.0 241.2513 2400.0 245.997 42000.0 253.9865 3400.0 259.977 81000.0 271.6462 2500.0 272.9844 33000.0 275.9722 58000.0 277.9881 2600.0 285.9925 48000.0 309.8249 2500.0 317.9177 2500.0 389.2852 2700.0 401.6758 2700.0 426.265 2600.0 END IONS BEGIN IONS SCANS=115 PEPMASS=220.1184 CHARGE=1 COLLISION_ENERGY=0.0 42.6139 2200.0 42.7965 2500.0 43.0177 450000.0 43.0261 2400.0 43.0687 2200.0 45.0333 130000.0 45.5663 2100.0 46.2977 2200.0 46.7814 2400.0 48.3415 2500.0 49.1896 2200.0 50.8689 2400.0 51.4459 2300.0 52.2773 2400.0 52.3577 2400.0 52.7825 2300.0 53.1982 2200.0 54.3848 2800.0 54.4416 2300.0 55.0177 41000.0 55.054 25000.0 55.3762 2000.0 55.7403 2500.0 55.9342 22000.0 56.013 3200.0 56.0782 2400.0 56.1428 2400.0 56.4542 2300.0 56.5513 2900.0 57.0696 350000.0 57.6857 2500.0 58.1396 2700.0 58.2801 2600.0 58.4781 2100.0 59.0489 240000.0 60.2851 2400.0 61.0283 2600.0 61.9385 2900.0 62.096 2300.0 65.2799 2100.0 65.8072 2500.0 66.0051 2600.0 66.3929 2000.0 66.6575 2200.0 67.0539 260000.0 68.08 2400.0 69.0696 170000.0 69.3282 2600.0 70.0284 330000.0 71.6823 2400.0 72.0041 3000.0 72.044 370000.0 72.9369 3200.0 73.0281 150000.0 74.0234 55000.0 75.6128 2400.0 76.0309 2200.0 79.0538 2500.0 79.671 2400.0 79.9346 2500.0 80.7651 2200.0 81.0691 2300.0 83.0488 40000.0 84.3369 2400.0 85.0645 390000.0 86.0961 58000.0 87.0801 11000.0 89.3533 2500.0 90.0546 1900000.0 91.2067 2200.0 91.4662 2100.0 91.9832 2500.0 92.2462 2400.0 92.9905 2300.0 94.5696 2300.0 95.0488 240000.0 95.7613 2300.0 96.0804 73000.0 96.3525 2200.0 97.6722 2700.0 98.0233 460000.0 98.0306 3300.0 99.883 2400.0 100.021 3300.0 100.039 34000.0 100.1293 2200.0 103.0751 110000.0 108.8239 2700.0 112.0745 4700.0 112.5418 2400.0 113.0593 60000.0 113.4349 2500.0 116.0339 260000.0 122.3342 2400.0 124.0659 12000.0 124.0753 700000.0 125.3129 2500.0 126.255 2400.0 129.2084 2400.0 130.0853 3500.0 130.9326 2300.0 131.0081 2800.0 131.0704 8600.0 133.8045 2700.0 138.3274 2500.0 138.9535 2500.0 139.3533 2600.0 142.086 200000.0 143.0831 2300.0 144.5236 2400.0 146.4959 2400.0 152.7723 2300.0 154.7325 2200.0 160.0968 19000.0 161.3271 2300.0 166.0857 15000.0 167.9486 2500.0 170.1884 3000.0 173.5254 63000.0 173.5371 130000.0 174.3849 2600.0 176.977 2300.0 178.9283 2600.0 179.263 2200.0 184.0968 110000.0 189.0088 2500.0 196.9042 40000.0 196.9365 170000.0 198.5285 2600.0 202.1074 90000.0 207.0372 2300.0 END IONS BEGIN IONS SCANS=116 PEPMASS=318.1553 CHARGE=1 COLLISION_ENERGY=0.0 49.7607 2500.0 50.3415 2200.0 50.619 2500.0 52.1038 2600.0 52.7783 2400.0 53.0384 35000.0 53.2283 2400.0 53.3443 3800.0 54.5538 2400.0 54.9369 2400.0 55.0176 55000.0 57.0332 86000.0 58.97 2400.0 60.9849 2200.0 61.0281 210000.0 67.8083 2500.0 69.0331 290000.0 69.4635 2500.0 71.0488 54000.0 72.065 2200.0 73.028 70000.0 78.8692 2200.0 78.9656 2200.0 81.0332 120000.0 83.0123 6300.0 85.0281 1900000.0 85.0352 10000.0 87.0437 50000.0 88.6712 2300.0 90.7238 2600.0 91.0386 95000.0 91.0536 9400.0 93.0697 21000.0 97.0213 3200.0 97.028 470000.0 98.0596 2900.0 99.0437 97000.0 102.5949 2400.0 103.0382 6100.0 103.0538 7000.0 109.028 150000.0 110.5374 2500.0 110.6428 2500.0 115.0387 18000.0 121.0645 940000.0 121.0735 15000.0 126.4669 2200.0 127.0386 320000.0 133.0632 2400.0 137.3173 2500.0 144.0651 3300.0 145.0492 150000.0 145.0631 28000.0 151.0755 6200.0 152.1154 2500.0 157.0644 9400.0 159.0802 54000.0 162.067 22000.0 163.0384 2500.0 163.0761 2500.0 169.0639 6500.0 171.0803 2600.0 173.5241 7900.0 173.5334 84000.0 173.8421 2400.0 174.0098 2700.0 175.0372 2400.0 175.0753 13000.0 177.6588 2600.0 178.0623 13000.0 179.0706 2900.0 183.0814 3400.0 184.1635 2500.0 187.0753 110000.0 189.0561 2400.0 190.0623 120000.0 191.0342 26000.0 191.0709 3300.0 193.0859 85000.0 205.086 26000.0 206.0572 38000.0 215.4327 2600.0 217.0862 2900.0 221.0568 3000.0 221.0809 270000.0 228.5034 3000.0 232.5453 2400.0 249.4901 2300.0 252.2563 2800.0 293.3369 2900.0 298.0812 2500.0 314.7082 2600.0 END IONS BEGIN IONS SCANS=117 PEPMASS=332.1347 CHARGE=1 COLLISION_ENERGY=0.0 53.0386 3700.0 53.2987 2600.0 55.0177 9900.0 56.9611 2600.0 57.0333 22000.0 58.065 3600.0 61.0282 49000.0 62.1347 2600.0 67.5939 3100.0 69.0332 68000.0 71.0489 11000.0 72.2208 2300.0 73.0282 14000.0 81.0332 27000.0 85.0226 4200.0 85.028 460000.0 85.0373 3400.0 87.0437 13000.0 87.1937 2300.0 91.0386 22000.0 96.8356 2200.0 97.028 120000.0 99.0438 30000.0 99.3575 2400.0 100.8398 2500.0 107.0487 140000.0 109.0281 35000.0 113.6302 2200.0 127.0387 89000.0 134.7345 3100.0 142.9828 2600.0 145.0493 40000.0 153.055 7900.0 173.0602 6300.0 173.5228 12000.0 173.5362 55000.0 187.5746 2500.0 191.7807 2300.0 204.8888 3000.0 204.9828 7400.0 205.9846 12000.0 207.7166 2400.0 208.8814 3200.0 214.8735 2800.0 218.8691 3500.0 222.9921 3400.0 226.8936 2700.0 257.4684 2600.0 285.853 5600.0 308.9003 23000.0 END IONS BEGIN IONS SCANS=118 PEPMASS=289.999 CHARGE=1 COLLISION_ENERGY=0.0 47.2764 2300.0 51.2268 2300.0 54.6686 4300.0 55.5013 2100.0 55.9342 16000.0 56.4266 4700.0 56.7709 2400.0 65.4772 2800.0 70.5472 2300.0 73.317 2400.0 77.6606 2400.0 79.9382 2800.0 85.1678 2600.0 85.5865 2400.0 86.7885 2500.0 107.8252 2200.0 113.9735 3100.0 117.0968 2300.0 125.5887 2400.0 137.3151 2200.0 138.609 2300.0 138.9319 2200.0 143.6419 2100.0 147.5096 2300.0 156.7626 2400.0 164.9867 3000.0 168.0778 3100.0 173.5241 26000.0 173.5412 30000.0 176.9866 3700.0 183.731 2700.0 197.5738 2600.0 204.9819 100000.0 214.5766 2400.0 221.9848 39000.0 222.9926 24000.0 230.545 2500.0 232.0084 3400.0 253.0202 2400.0 254.1427 2400.0 257.9881 2400.0 END IONS BEGIN IONS SCANS=119 PEPMASS=388.0882 CHARGE=1 COLLISION_ENERGY=0.0 53.7739 2300.0 55.0176 8400.0 59.5773 2300.0 61.9399 2200.0 67.789 2500.0 69.0332 32000.0 70.9946 2800.0 73.0281 90000.0 76.0108 2900.0 77.0385 24000.0 77.4187 2500.0 79.0543 2600.0 82.8957 2500.0 83.0124 50000.0 84.527 2500.0 85.0282 26000.0 85.1164 2500.0 85.4682 2600.0 86.0959 2400.0 92.1037 2100.0 93.9881 2300.0 95.0124 5800.0 95.0488 26000.0 95.9213 2300.0 99.466 2300.0 101.0174 2600.0 101.023 170000.0 104.7981 2600.0 105.0332 100000.0 106.8192 2800.0 106.8376 2700.0 107.0488 100000.0 111.0074 63000.0 111.0446 2400.0 113.0231 21000.0 115.5873 2300.0 117.9883 2600.0 119.0337 2500.0 121.5265 2700.0 123.0337 24000.0 123.0438 870000.0 123.0525 2500.0 123.054 9400.0 129.018 62000.0 133.0166 3000.0 133.0282 870000.0 133.0397 12000.0 133.1313 2400.0 135.044 50000.0 135.6367 2900.0 144.6921 2500.0 147.0278 3300.0 149.0612 3300.0 150.055 9100.0 151.0388 150000.0 153.0524 3600.0 155.0336 3100.0 157.0133 2800.0 161.0232 290000.0 163.0389 27000.0 165.0547 3400.0 173.0603 2700.0 173.5289 67000.0 173.5389 28000.0 175.0391 3000.0 179.0079 3600.0 179.034 1100000.0 183.2426 2500.0 184.0031 2300.0 187.0388 9200.0 189.0545 27000.0 199.0388 2800.0 203.4542 2800.0 205.0488 2800.0 208.4712 2500.0 215.0338 3200.0 222.8016 2300.0 233.0444 6600.0 244.8303 2400.0 270.7755 2600.0 279.0511 2800.0 280.3824 2300.0 367.9058 2400.0 375.797 2500.0 END IONS BEGIN IONS SCANS=120 PEPMASS=432.9889 CHARGE=1 COLLISION_ENERGY=0.0 57.6082 2300.0 63.0544 2200.0 72.2661 2600.0 73.6137 2700.0 75.7783 2100.0 77.0384 17000.0 78.2393 2400.0 80.531 2200.0 86.572 2600.0 90.9476 2200.0 94.9811 2600.0 100.3523 2300.0 105.0332 41000.0 116.9658 63000.0 120.831 2400.0 123.0438 15000.0 126.6104 2600.0 132.5314 2400.0 133.0281 320000.0 134.7337 2600.0 152.9657 24000.0 154.9818 12000.0 163.0391 17000.0 164.0425 5300.0 164.9662 2600.0 173.5289 72000.0 173.5443 5200.0 177.1738 2600.0 180.9602 8500.0 182.9767 31000.0 208.9559 16000.0 211.2744 2400.0 214.9819 92000.0 220.0873 2600.0 226.9821 24000.0 228.9978 15000.0 230.9774 2700.0 234.9685 13000.0 235.9732 31000.0 236.979 10000.0 238.9821 53000.0 240.9974 21000.0 242.9767 78000.0 244.9921 7400.0 247.6881 2400.0 248.9876 32000.0 252.9752 7300.0 253.9832 3600.0 254.9771 6300.0 256.2274 2800.0 256.9925 93000.0 258.9719 2500.0 260.9859 25000.0 266.9771 100000.0 268.9929 39000.0 272.6606 2900.0 272.9873 64000.0 275.0032 5100.0 275.9724 4000.0 276.9772 11000.0 278.9775 2900.0 282.9722 4800.0 284.988 98000.0 287.0036 37000.0 296.9874 34000.0 299.003 2900.0 300.9828 100000.0 312.9825 23000.0 314.9979 21000.0 318.2919 2500.0 318.9931 3500.0 324.8443 2500.0 328.9781 8000.0 340.1812 2600.0 END IONS BEGIN IONS SCANS=121 PEPMASS=474.1739 CHARGE=1 COLLISION_ENERGY=0.0 57.793 2200.0 58.2833 2100.0 59.353 2300.0 60.9748 2200.0 63.214 2300.0 63.2442 2200.0 64.2753 2300.0 68.1266 2400.0 73.3182 2600.0 76.0154 2100.0 77.0382 3000.0 79.8332 2500.0 79.8827 2300.0 88.3338 2300.0 89.7207 2300.0 91.965 2200.0 93.4423 2400.0 99.0919 2200.0 103.2436 2100.0 105.0331 20000.0 108.9374 2300.0 116.7961 2400.0 116.9658 42000.0 124.7476 2700.0 129.5165 2500.0 132.0439 79000.0 133.018 7600.0 133.0279 280000.0 134.0597 3400.0 136.1497 2300.0 145.086 2500.0 146.9638 2400.0 152.9657 11000.0 158.3633 2300.0 160.0496 2500.0 163.038 2600.0 164.9662 3200.0 173.5232 9900.0 173.5289 87000.0 173.5423 17000.0 174.4346 2300.0 181.9939 2400.0 182.9763 38000.0 187.0103 2800.0 189.1806 2700.0 190.9471 2600.0 193.0218 2500.0 193.2861 2500.0 194.0673 3500.0 196.2442 2600.0 199.8794 2400.0 203.9166 2200.0 208.9554 15000.0 210.5106 2600.0 214.9815 77000.0 224.5572 2800.0 226.983 2700.0 228.9985 7600.0 230.9766 2500.0 236.5009 2300.0 238.9816 44000.0 240.9972 12000.0 242.0921 23000.0 242.9764 75000.0 248.9856 22000.0 251.306 2300.0 252.9962 3100.0 254.9751 3600.0 256.9918 85000.0 259.009 2500.0 259.1182 120000.0 260.9869 21000.0 266.9761 92000.0 268.9921 48000.0 272.9869 48000.0 275.0021 2800.0 275.7156 2400.0 278.9758 2800.0 279.0004 3700.0 280.9919 3500.0 282.9725 4800.0 284.1142 89000.0 284.9873 130000.0 286.968 2700.0 287.0027 29000.0 296.987 50000.0 299.0033 18000.0 300.9823 220000.0 302.1248 110000.0 302.9976 4300.0 304.8932 2600.0 310.9661 2800.0 312.9822 27000.0 314.9984 42000.0 318.9934 19000.0 320.2482 2700.0 320.7362 2600.0 324.9829 3000.0 327.1205 170000.0 328.976 10000.0 330.065 2600.0 340.9775 8400.0 342.9934 9200.0 345.1302 3000000.0 358.9891 11000.0 386.9874 2400.0 END IONS BEGIN IONS SCANS=122 PEPMASS=371.0614 CHARGE=1 COLLISION_ENERGY=0.0 54.38 2100.0 54.557 2400.0 55.0177 17000.0 55.0543 2300.0 56.0647 2300.0 56.8438 2200.0 57.0334 2700.0 57.0696 3000.0 58.4002 2500.0 59.2818 2100.0 61.0282 2700.0 65.6817 2500.0 68.3454 2300.0 68.9967 2100.0 69.0332 57000.0 71.0121 4500.0 71.0851 3500.0 73.0281 39000.0 75.3824 2300.0 77.4692 2400.0 81.845 2200.0 83.0124 46000.0 85.0281 24000.0 85.2584 2300.0 89.1625 2400.0 92.287 2200.0 92.4858 2300.0 92.6813 2500.0 95.0125 18000.0 95.0489 18000.0 101.023 60000.0 101.0594 37000.0 105.0331 7100.0 107.0487 40000.0 111.0074 39000.0 111.0437 38000.0 113.023 29000.0 118.9356 2400.0 122.102 2400.0 122.3186 2300.0 123.0336 4300.0 123.0437 360000.0 124.1198 2300.0 129.0179 24000.0 129.0543 18000.0 133.0281 150000.0 135.0438 64000.0 137.6404 2400.0 138.6 2400.0 143.0486 3000.0 147.0437 18000.0 149.0231 19000.0 149.0599 5900.0 149.2999 2300.0 150.0311 26000.0 151.0387 130000.0 153.0543 13000.0 159.0436 2500.0 159.3945 2600.0 161.0231 300000.0 161.0596 33000.0 162.0298 3100.0 162.4431 2400.0 163.0388 33000.0 173.0599 16000.0 173.5226 22000.0 173.5356 74000.0 173.5426 8100.0 175.0385 15000.0 177.0184 24000.0 177.0548 19000.0 179.0078 4100.0 179.0339 1000000.0 183.7551 2600.0 187.0389 26000.0 189.0184 3400.0 189.0548 57000.0 191.0345 3800.0 193.0489 7400.0 194.2065 2200.0 197.0441 2600.0 199.0392 11000.0 205.0499 14000.0 205.9101 2200.0 207.0286 4000.0 215.0341 22000.0 217.0493 13000.0 219.0291 4000.0 221.0449 18000.0 233.0443 30000.0 245.0446 21000.0 261.0394 11000.0 273.9449 2500.0 279.0497 3100.0 297.111 2600.0 318.5153 2500.0 325.3133 2900.0 333.7463 2300.0 347.7396 2400.0 371.1681 3500.0 END IONS BEGIN IONS SCANS=123 PEPMASS=300.16 CHARGE=1 COLLISION_ENERGY=0.0 47.2133 22000.0 47.5508 22000.0 47.808 23000.0 50.0161 22000.0 50.7396 24000.0 55.0179 24000.0 56.0494 420000.0 56.375 24000.0 57.0572 150000.0 58.0582 210000.0 58.0652 130000000.0 58.0704 340000.0 58.0718 270000.0 58.0739 110000.0 58.074 990000.0 58.0757 60000.0 71.0027 24000.0 71.0728 860000.0 72.0807 1000000.0 74.9082 14000.0 79.0543 40000.0 86.0602 19000.0 86.1535 12000.0 91.0541 340000.0 93.0697 180000.0 95.0491 280000.0 103.0542 90000.0 104.5431 23000.0 105.0449 18000.0 105.0697 43000.0 107.0319 33000.0 107.0491 33000000.0 107.0661 180000.0 108.3089 13000.0 115.0542 530000.0 116.8881 14000.0 117.0698 370000.0 119.0489 1100000.0 119.0857 81000.0 121.0647 5200000.0 121.0733 26000.0 123.0337 48000.0 123.0439 3900000.0 124.6929 14000.0 131.0492 220000.0 133.0646 490000.0 135.044 630000.0 135.0806 68000.0 137.0596 2600000.0 138.2385 12000.0 143.0362 20000.0 143.0491 3000000.0 145.0515 21000.0 145.0647 4200000.0 145.0746 23000.0 145.0769 45000.0 146.073 16000.0 146.2313 25000.0 147.0445 14000.0 147.0803 1900000.0 148.0518 160000.0 149.0596 1000000.0 150.3153 13000.0 151.0753 120000.0 155.0598 57000.0 157.0645 41000.0 161.0439 58000.0 161.0596 11000000.0 161.0755 130000.0 162.0674 16000.0 163.0753 1800000.0 163.091 20000.0 173.0598 13000.0 173.5224 210000.0 173.5385 340000.0 175.0755 56000.0 178.0862 360000.0 179.094 710000.0 179.7273 13000.0 180.102 700000.0 181.0641 68000.0 181.1019 130000.0 183.0797 47000.0 186.7968 12000.0 191.0857 150000.0 191.5103 26000.0 192.1015 51000.0 193.1094 600000.0 194.0726 60000.0 201.3298 14000.0 206.1175 68000.0 209.0962 1100000.0 210.0666 17000.0 211.0762 63000.0 211.112 870000.0 219.0809 240000.0 221.0957 140000.0 222.0675 13000.0 226.062 320000.0 227.0449 13000.0 227.0704 130000.0 227.1074 41000.0 227.5192 15000.0 228.078 190000.0 229.1238 40000.0 237.091 2100000.0 239.1067 850000.0 240.0779 220000.0 255.0698 100000.0 255.1015 9000000.0 255.1323 29000.0 257.117 3000000.0 257.1481 24000.0 274.5282 23000.0 282.1491 120000.0 285.1392 50000.0 300.1595 22000000.0 300.1898 92000.0 END IONS BEGIN IONS SCANS=124 PEPMASS=301.1628 CHARGE=1 COLLISION_ENERGY=0.0 55.0178 8100.0 56.0494 48000.0 57.0574 8000.0 58.0333 5400.0 58.0651 17000000.0 58.0696 160000.0 58.0703 69000.0 58.0718 54000.0 58.0737 22000.0 59.0592 9900.0 59.0621 120000.0 59.0681 3700000.0 59.0714 49000.0 67.6929 3800.0 71.0728 120000.0 72.0765 10000.0 72.0801 150000.0 73.084 41000.0 83.0342 5600.0 91.0541 37000.0 92.0574 20000.0 93.0698 5500.0 93.7173 3800.0 94.3194 3600.0 95.049 31000.0 104.2979 3300.0 107.049 3300000.0 108.0524 2000000.0 108.3199 6800.0 115.0543 46000.0 116.0576 32000.0 117.0698 32000.0 118.0553 5200.0 118.0731 33000.0 119.049 97000.0 120.0524 75000.0 120.0874 6500.0 121.0552 13000.0 121.0646 500000.0 122.068 380000.0 123.0338 5800.0 123.0439 410000.0 124.0473 250000.0 125.813 4700.0 126.4077 4100.0 132.0526 16000.0 133.0647 39000.0 134.068 39000.0 135.0439 47000.0 135.0804 6400.0 136.0474 33000.0 137.0596 270000.0 138.063 180000.0 141.2455 5900.0 143.049 220000.0 144.0524 270000.0 145.0646 310000.0 146.0546 5500.0 146.0681 390000.0 147.0801 140000.0 148.0514 7500.0 148.0837 180000.0 149.0593 94000.0 149.4054 6400.0 150.0628 76000.0 151.0744 6000.0 158.066 6500.0 160.4071 6200.0 161.044 10000.0 161.0596 820000.0 161.0751 7500.0 161.8606 5800.0 162.0469 6700.0 162.0631 1000000.0 162.0789 15000.0 163.0751 140000.0 164.0788 170000.0 165.4117 3800.0 173.5211 12000.0 173.5323 69000.0 173.5397 29000.0 176.0786 9200.0 176.1063 7000.0 178.0869 19000.0 179.0926 66000.0 180.0996 89000.0 181.1052 68000.0 191.0863 6800.0 192.0884 11000.0 193.1092 46000.0 194.113 62000.0 195.0772 11000.0 207.0844 6000.0 209.0963 38000.0 210.0997 140000.0 211.0714 9200.0 211.1116 14000.0 212.079 14000.0 212.1154 120000.0 220.0839 41000.0 221.0926 6800.0 222.1001 9000.0 226.0625 6300.0 227.0668 44000.0 228.075 27000.0 229.0814 32000.0 237.091 46000.0 238.0944 300000.0 239.107 7700.0 240.0839 7700.0 240.1101 110000.0 241.0812 36000.0 243.0995 7500.0 255.1014 180000.0 256.0738 23000.0 256.1048 1300000.0 256.1273 4700.0 256.137 26000.0 257.1173 65000.0 258.1205 430000.0 270.1214 9400.0 270.7256 4600.0 280.1153 4200.0 282.5012 6600.0 283.1553 13000.0 301.1628 3400000.0 END IONS BEGIN IONS SCANS=125 PEPMASS=298.1446 CHARGE=1 COLLISION_ENERGY=0.0 48.2608 2700.0 48.282 2200.0 50.0408 2500.0 52.0995 2400.0 55.239 3200.0 56.508 2200.0 56.9469 2400.0 58.0652 2700000.0 58.0683 13000.0 58.07 12000.0 58.9005 2100.0 58.9388 2300.0 61.0104 8100.0 61.3529 2600.0 62.8808 2100.0 63.757 2600.0 65.9844 2700.0 67.2448 2600.0 71.1364 2400.0 72.0442 29000.0 72.0808 2500.0 72.4379 2600.0 72.6113 3000.0 72.9583 2100.0 73.1977 2300.0 75.026 5400.0 76.2543 2600.0 77.6819 2500.0 83.4556 2400.0 83.9648 2400.0 90.097 2200.0 90.6216 2000.0 97.4576 2900.0 99.8238 2400.0 103.0213 2400.0 107.0488 160000.0 108.911 2300.0 110.8113 2200.0 111.3669 2300.0 117.3148 2500.0 120.0801 2100.0 121.0639 2900.0 122.0956 3300.0 128.4593 2800.0 131.0484 2800.0 136.0615 180000.0 136.0714 2300.0 136.0741 3800.0 146.0955 3100.0 148.0757 26000.0 149.0594 24000.0 149.3642 2500.0 150.0912 3300.0 151.1598 2300.0 152.8129 2200.0 153.9549 2200.0 162.0917 9800.0 163.099 34000.0 164.1067 36000.0 166.0496 4500.0 170.6225 2300.0 172.2174 2600.0 173.5312 53000.0 173.5391 21000.0 174.6423 2200.0 176.0715 2800.0 177.0783 140000.0 178.0859 2500.0 181.0647 6500.0 190.8975 2600.0 191.094 74000.0 192.1017 73000.0 194.2608 2500.0 197.0954 7100.0 202.8964 6900.0 203.0052 2600.0 207.0795 6200.0 208.9053 2900.0 218.8892 17000.0 225.0906 7800.0 233.629 2600.0 238.2515 2200.0 246.8847 13000.0 270.1492 44000.0 271.713 2500.0 280.5306 3300.0 282.3848 2400.0 283.1207 25000.0 298.1438 44000.0 300.5406 2800.0 END IONS BEGIN IONS SCANS=126 PEPMASS=330.1705 CHARGE=1 COLLISION_ENERGY=0.0 49.8453 2100.0 49.9345 2300.0 52.2671 2600.0 53.4833 2300.0 54.3826 2400.0 54.4477 2100.0 56.7281 2500.0 58.0612 2400.0 58.0651 1500000.0 58.0683 9400.0 58.0699 7000.0 58.1775 2200.0 62.002 2300.0 62.6134 2400.0 65.5732 2300.0 65.7285 2300.0 77.1816 2400.0 77.5294 2200.0 78.1929 3100.0 79.5152 2100.0 80.1913 2600.0 81.086 2700.0 84.1419 2500.0 91.0541 2700.0 91.4948 2600.0 105.1628 2600.0 106.5564 2600.0 107.0489 35000.0 115.0539 3900.0 121.0646 2700.0 123.0437 180000.0 137.0594 100000.0 138.3257 2600.0 143.0488 77000.0 145.0645 2700.0 151.075 20000.0 157.3334 2600.0 161.0593 25000.0 163.0754 26000.0 164.0542 2900.0 173.5293 62000.0 173.5418 6300.0 175.0753 120000.0 177.0908 9500.0 191.0702 7300.0 192.1015 9100.0 193.1096 17000.0 194.1164 3300.0 205.1095 33000.0 206.1169 2700.0 207.0809 6100.0 209.0958 2500.0 218.9568 2400.0 221.1965 2300.0 225.091 17000.0 233.0886 2800.0 233.2538 2600.0 235.0753 24000.0 253.0853 41000.0 255.1023 3500.0 257.1177 3300.0 267.1018 18000.0 269.1161 2700.0 285.1124 130000.0 285.1443 3600.0 287.1286 20000.0 298.1454 3300.0 320.0464 2500.0 330.1703 210000.0 END IONS BEGIN IONS SCANS=127 PEPMASS=298.0978 CHARGE=1 COLLISION_ENERGY=0.0 54.3891 2100.0 56.2246 2500.0 58.0649 150000.0 60.1044 2300.0 60.2785 2200.0 61.0104 80000.0 69.0332 2500.0 75.026 32000.0 76.2648 2400.0 81.2564 2300.0 88.7948 2400.0 89.1903 2200.0 95.9871 2200.0 97.0282 24000.0 100.0146 2500.0 100.6127 2200.0 107.0488 7200.0 117.1221 2400.0 118.4566 2200.0 125.7218 2400.0 128.5045 2400.0 131.6581 2300.0 136.0615 1300000.0 136.0713 21000.0 145.0318 8400.0 149.059 3300.0 167.6104 2300.0 171.9438 2500.0 173.5337 36000.0 177.0785 5500.0 190.8973 5300.0 203.905 2500.0 218.8896 8200.0 224.9014 6600.0 246.8855 9300.0 280.7253 2200.0 END IONS BEGIN IONS SCANS=128 PEPMASS=374.1087 CHARGE=1 COLLISION_ENERGY=0.0 52.9719 2400.0 55.6992 2100.0 55.8772 2300.0 57.0491 2100.0 58.1135 2400.0 58.2171 2400.0 58.8506 2200.0 61.0735 2300.0 61.151 2500.0 65.0385 7700.0 65.7879 2800.0 67.2398 2500.0 67.2748 2300.0 68.0884 2300.0 74.9998 2400.0 87.0438 2800.0 89.8725 2400.0 91.0539 110000.0 106.5331 2100.0 108.5842 2300.0 109.5944 2100.0 115.2151 2600.0 119.0396 10000.0 119.0488 380000.0 121.128 2300.0 128.0582 2900.0 140.6 2700.0 147.0437 4200000.0 147.0548 56000.0 147.0709 25000.0 150.4952 2200.0 167.6767 2700.0 173.529 57000.0 173.5408 14000.0 189.4784 2400.0 200.7619 2400.0 227.0948 7800.0 229.6645 2200.0 241.2841 2200.0 251.7835 2800.0 292.2429 2700.0 347.8947 2400.0 357.5909 2600.0 END IONS BEGIN IONS SCANS=129 PEPMASS=446.218 CHARGE=1 COLLISION_ENERGY=0.0 56.4549 2300.0 58.0648 330000.0 58.0683 5200.0 67.5211 2800.0 72.3408 2600.0 75.0436 11000.0 87.2454 2400.0 91.8197 2300.0 92.4206 2300.0 107.0487 25000.0 116.6708 2500.0 121.064 6700.0 123.0441 3700.0 123.2575 2600.0 125.5892 2300.0 142.5015 2400.0 161.0597 6100.0 165.8627 2700.0 173.5254 6600.0 173.5351 40000.0 193.0182 2500.0 206.6638 3600.0 251.4383 2400.0 255.1014 71000.0 257.1173 22000.0 286.9715 2800.0 300.1596 490000.0 314.1737 8900.0 323.213 2900.0 388.9652 2600.0 411.0041 2700.0 428.5437 2500.0 446.2179 130000.0 END IONS BEGIN IONS SCANS=130 PEPMASS=272.1285 CHARGE=1 COLLISION_ENERGY=0.0 52.5676 2400.0 53.0387 2200.0 53.5439 2200.0 54.4205 2200.0 54.9866 2400.0 55.0178 12000.0 61.3444 2300.0 62.8792 2600.0 64.3096 2300.0 64.8024 2200.0 65.412 2500.0 76.4942 2500.0 79.054 14000.0 91.0541 37000.0 94.6357 2700.0 95.049 26000.0 96.5633 2100.0 98.1319 2400.0 103.0542 3100.0 105.0332 3200.0 105.045 2900.0 105.07 10000.0 107.0318 8400.0 107.049 4700000.0 107.0557 31000.0 107.0622 14000.0 107.066 53000.0 107.0703 4100.0 115.0541 140000.0 117.0697 35000.0 119.0492 15000.0 121.0646 75000.0 123.0337 8000.0 123.0439 400000.0 126.4756 3000.0 131.0491 35000.0 131.8128 2700.0 133.0646 66000.0 135.0444 3300.0 136.0755 16000.0 137.0597 49000.0 143.0362 4900.0 143.049 490000.0 143.0587 2500.0 144.0565 2600.0 145.0515 8400.0 145.0647 400000.0 145.0748 2700.0 146.0727 11000.0 146.5916 2200.0 147.0436 3000.0 149.0596 81000.0 155.0605 13000.0 161.0596 1100000.0 161.0726 14000.0 162.0679 8500.0 164.0707 54000.0 173.5254 13000.0 173.534 26000.0 173.5427 4900.0 181.0645 19000.0 181.1011 20000.0 191.0854 44000.0 194.0728 38000.0 195.081 10000.0 195.8375 2800.0 203.7991 2500.0 203.8833 49000.0 205.8991 7300.0 209.0962 170000.0 216.8916 6800.0 219.0804 45000.0 221.8947 6800.0 222.0674 8000.0 225.0895 3000.0 226.0628 43000.0 227.0697 14000.0 227.1057 4300.0 229.3236 2800.0 237.0493 3600.0 237.091 260000.0 240.0779 43000.0 255.1015 370000.0 255.1327 4300.0 272.0967 7000.0 272.128 40000.0 END IONS BEGIN IONS SCANS=131 PEPMASS=318.1553 CHARGE=1 COLLISION_ENERGY=0.0 53.0385 15000.0 53.2748 2300.0 55.0176 26000.0 57.0332 40000.0 61.0281 91000.0 69.0332 120000.0 71.0488 18000.0 71.0808 2400.0 73.0281 34000.0 76.6648 2400.0 80.0175 2100.0 81.0331 49000.0 85.0281 850000.0 85.0338 4900.0 87.0438 27000.0 91.0386 40000.0 91.0541 13000.0 93.0695 14000.0 95.0492 2700.0 96.0974 2600.0 97.0281 200000.0 99.0437 37000.0 99.1149 2500.0 103.0387 6800.0 103.0541 10000.0 109.028 76000.0 113.3654 2400.0 115.0387 3300.0 121.0645 500000.0 121.0736 5500.0 127.0386 140000.0 131.0853 7400.0 142.9237 2400.0 145.0493 60000.0 145.0642 19000.0 147.0428 3000.0 151.0751 8000.0 155.0857 2400.0 157.0647 14000.0 159.0801 45000.0 162.0671 9300.0 163.0378 3300.0 163.075 4500.0 169.0652 7000.0 169.237 2600.0 171.0806 5300.0 173.5213 11000.0 173.5391 32000.0 175.0752 20000.0 178.0625 5800.0 179.0703 2900.0 183.0805 2900.0 185.0598 4000.0 187.0753 92000.0 190.0622 44000.0 191.0338 11000.0 191.0701 2700.0 193.0855 37000.0 201.0922 6200.0 205.086 18000.0 206.0568 17000.0 210.7606 2800.0 217.087 10000.0 221.0808 120000.0 229.0856 5600.0 296.0244 2700.0 END IONS BEGIN IONS SCANS=132 PEPMASS=205.0975 CHARGE=1 COLLISION_ENERGY=0.0 42.8472 2400.0 43.0179 11000.0 44.3326 2100.0 46.243 2100.0 46.7507 2200.0 51.0235 2600.0 51.1528 2400.0 51.4106 2800.0 53.0022 2300.0 53.28 2200.0 54.2785 2400.0 54.3391 2400.0 55.0031 2200.0 55.0177 8900.0 55.1412 2700.0 55.9343 180000.0 58.5695 2400.0 60.7027 2300.0 60.7537 2300.0 61.012 2000.0 62.0974 2500.0 64.8414 2600.0 65.0388 3700.0 69.2637 2300.0 70.0849 2500.0 70.4781 2400.0 71.6282 2400.0 72.8557 2700.0 72.9369 18000.0 73.9448 2600.0 74.0235 440000.0 74.9526 2900.0 75.5549 2200.0 89.0393 9700.0 90.9476 51000.0 91.0541 230000.0 95.0477 2500.0 103.0543 25000.0 105.0701 19000.0 105.9347 3900.0 105.9886 2200.0 107.9502 4100.0 109.0775 2400.0 113.9639 9200.0 114.971 23000.0 115.0452 4700.0 115.0541 460000.0 116.0493 13000.0 116.0624 6200.0 116.7927 2500.0 116.9659 19000.0 117.0573 240000.0 117.0697 670000.0 117.9658 3100.0 118.0456 17000.0 118.0486 22000.0 118.065 11000000.0 118.0735 65000.0 118.0817 120000.0 118.0843 23000.0 118.0922 13000.0 118.9424 23000.0 119.1152 2400.0 127.0538 13000.0 128.0495 17000.0 128.0616 12000.0 128.9506 66000.0 130.065 770000.0 130.0755 6300.0 131.0729 30000.0 132.0439 15000.0 132.0806 2500000.0 132.0902 17000.0 135.945 26000.0 142.0539 8000.0 142.065 1100000.0 142.0759 2300.0 143.06 9800.0 143.0728 1400000.0 143.0837 3800.0 143.0853 18000.0 143.2509 2900.0 144.0446 170000.0 144.0806 5100000.0 144.0917 31000.0 144.1069 11000.0 145.0526 3500.0 145.0647 140000.0 146.01 3900.0 146.0247 11000.0 146.0329 92000.0 146.0404 48000.0 146.0598 19000000.0 146.0705 190000.0 146.0847 220000.0 146.0869 36000.0 146.0948 14000.0 146.0988 38000.0 146.9614 2900.0 147.5636 2900.0 155.0602 130000.0 158.9771 5900.0 159.0765 9300.0 159.0916 1700000.0 159.1038 4600.0 159.1056 9100.0 160.0611 4700.0 160.0756 410000.0 160.0906 5000.0 170.0433 9700.0 170.06 1900000.0 170.073 20000.0 173.5232 4600.0 173.5311 47000.0 173.5415 18000.0 188.051 7000.0 188.0706 1700000.0 188.0903 3400.0 194.9444 9700.0 205.7604 2900.0 END IONS BEGIN IONS SCANS=133 PEPMASS=286.1444 CHARGE=1 COLLISION_ENERGY=0.0 48.9276 2400.0 53.3122 2300.0 57.4892 2300.0 58.0649 6500.0 61.7438 2700.0 62.1258 2600.0 84.1629 2200.0 91.0539 11000.0 97.5042 2700.0 104.9792 2900.0 105.0698 5500.0 107.0489 820000.0 107.0566 4800.0 107.0762 3000.0 114.8333 2200.0 115.0541 17000.0 117.0688 2600.0 119.049 26000.0 121.0646 58000.0 121.6981 2400.0 123.0438 110000.0 131.0495 8000.0 133.0646 27000.0 135.0439 11000.0 137.0596 19000.0 143.049 87000.0 145.0646 83000.0 147.0808 2700.0 148.0682 2600.0 149.0595 32000.0 161.0444 2300.0 161.0597 240000.0 163.0752 6200.0 166.0865 6300.0 173.5295 11000.0 173.5393 18000.0 175.0767 2300.0 178.0867 21000.0 181.1023 3400.0 184.8441 2600.0 197.0964 25000.0 201.0541 7900.0 203.8842 3100.0 209.0967 28000.0 216.8914 3100.0 219.0819 3600.0 225.0916 10000.0 226.0638 3100.0 227.0711 3500.0 237.0916 49000.0 239.0728 3300.0 243.1019 30000.0 255.102 150000.0 257.1178 4000.0 280.643 2800.0 286.1447 110000.0 END IONS BEGIN IONS SCANS=134 PEPMASS=330.1706 CHARGE=1 COLLISION_ENERGY=0.0 51.1767 2500.0 56.0494 74000.0 57.0782 8100.0 58.0353 3100.0 58.054 15000.0 58.0652 27000000.0 58.0705 90000.0 58.0719 89000.0 58.0741 38000.0 58.0741 190000.0 58.0757 25000.0 66.8059 2500.0 70.065 9300.0 71.0728 46000.0 71.3091 5700.0 72.0808 46000.0 72.9875 2900.0 76.817 5400.0 84.3129 8100.0 84.4385 5900.0 85.3945 5500.0 86.0598 15000.0 87.0286 2600.0 87.2591 5800.0 88.3992 5900.0 88.4773 2400.0 91.0542 80000.0 93.5271 3100.0 95.0488 25000.0 100.3957 5900.0 101.7052 2400.0 107.0491 36000.0 109.0646 30000.0 111.0439 23000.0 115.0542 190000.0 115.9383 3000.0 116.9204 2600.0 117.07 69000.0 119.0491 89000.0 121.0647 20000.0 121.5705 3400.0 123.044 6000000.0 123.0547 3500.0 123.4464 6400.0 125.0599 34000.0 125.476 2200.0 131.0492 130000.0 133.0648 38000.0 133.5042 2900.0 135.044 180000.0 137.0424 8600.0 137.0596 2400000.0 143.049 2500000.0 143.0588 13000.0 144.0569 9100.0 144.403 3100.0 145.0646 250000.0 147.0438 30000.0 147.0805 51000.0 149.0596 240000.0 149.0959 4700.0 150.0676 32000.0 151.0752 890000.0 153.0911 3900.0 157.0658 12000.0 160.0518 160000.0 160.0757 9400.0 161.0596 740000.0 161.0828 37000.0 162.0678 50000.0 162.0909 15000.0 162.8171 2900.0 163.0754 630000.0 165.0912 69000.0 173.5257 33000.0 173.5374 88000.0 174.0917 48000.0 175.0396 5000.0 175.0576 4300.0 175.0754 4400000.0 175.101 46000.0 175.103 19000.0 176.0831 180000.0 176.1071 170000.0 177.0911 230000.0 178.0849 3400.0 179.0857 57000.0 181.0648 12000.0 181.1022 28000.0 183.0816 3600.0 188.1061 4000.0 192.0817 6700.0 192.1019 650000.0 193.1097 620000.0 194.1176 310000.0 195.0796 3400.0 197.0941 3100.0 199.0745 8800.0 201.2339 2800.0 205.1094 3900.0 206.1178 75000.0 207.0807 300000.0 207.1257 110000.0 208.1333 6800.0 209.0598 30000.0 209.0962 150000.0 211.0745 7900.0 213.0547 3600.0 213.0913 13000.0 219.0809 6900.0 225.0911 550000.0 226.062 17000.0 227.0702 89000.0 227.1069 320000.0 235.0753 270000.0 237.0911 210000.0 237.7826 2700.0 239.1069 65000.0 240.0789 3300.0 241.0858 19000.0 241.1225 120000.0 251.1062 26000.0 252.0726 7800.0 253.0561 17000.0 253.0857 930000.0 254.0937 43000.0 255.1015 400000.0 256.0734 32000.0 257.084 4200.0 257.1156 28000.0 258.0887 60000.0 259.1311 11000.0 267.1019 67000.0 269.117 150000.0 270.0884 180000.0 270.1489 26000.0 272.1047 11000.0 285.0741 6300.0 285.0849 15000.0 285.1122 2600000.0 287.128 840000.0 287.1646 17000.0 291.0028 6500.0 298.1439 310000.0 299.1501 13000.0 315.1471 97000.0 330.17 5100000.0 END IONS BEGIN IONS SCANS=135 PEPMASS=328.1552 CHARGE=1 COLLISION_ENERGY=0.0 50.502 2900.0 56.4347 2300.0 57.03 2300.0 57.7432 2300.0 58.065 1500000.0 58.0682 21000.0 58.07 15000.0 58.0716 10000.0 62.1567 2700.0 62.87 2500.0 64.183 2100.0 64.4472 2300.0 67.7519 2200.0 74.6924 2300.0 92.9117 2500.0 93.0994 2700.0 99.2369 2400.0 103.1457 2200.0 121.8644 2900.0 122.144 2400.0 124.1363 2300.0 127.6635 2400.0 130.3235 2100.0 131.0491 3900.0 145.3741 2300.0 146.0963 20000.0 155.4042 2300.0 161.0597 3000.0 163.0752 60000.0 173.5242 8500.0 173.538 32000.0 174.0914 54000.0 175.0993 25000.0 184.6503 2800.0 190.0866 3700.0 191.0941 27000.0 192.1023 8600.0 204.1016 6400.0 206.1176 120000.0 223.0757 6400.0 225.0924 4500.0 233.0602 4500.0 249.4511 2400.0 251.0705 64000.0 255.1008 3800.0 274.8135 2400.0 276.2813 2400.0 283.0969 40000.0 300.1604 4900.0 328.1551 8000.0 END IONS BEGIN IONS SCANS=136 PEPMASS=247.0604 CHARGE=1 COLLISION_ENERGY=0.0 45.0329 2500.0 47.3639 2300.0 54.106 2300.0 55.0177 8400.0 61.8512 2600.0 64.2838 2500.0 65.0384 5400.0 65.9296 2200.0 67.0176 12000.0 69.0334 5400.0 71.0127 6000.0 76.7266 2500.0 88.2459 2500.0 92.9818 3000.0 93.1829 2500.0 95.8409 2400.0 104.0116 2600.0 111.0439 6000.0 117.0182 2300.0 117.4246 2900.0 121.0181 12000.0 121.0282 450000.0 121.0386 23000.0 129.0182 3200.0 140.4652 2200.0 152.9971 3400.0 153.0181 800000.0 171.0289 3400.0 173.528 23000.0 173.5407 4300.0 209.7004 2900.0 216.9195 2200.0 219.6589 2700.0 225.0783 2400.0 END IONS BEGIN IONS SCANS=137 PEPMASS=350.0696 CHARGE=1 COLLISION_ENERGY=0.0 52.2576 2200.0 54.1941 2300.0 56.8027 2400.0 57.8327 2500.0 59.6511 2300.0 61.5609 2600.0 67.0584 2300.0 70.0645 2300.0 70.8683 2300.0 71.6915 2400.0 74.0421 2700.0 74.5263 2400.0 74.7578 2100.0 77.2691 2400.0 78.5898 2500.0 81.9539 2400.0 87.7533 2300.0 97.8177 2300.0 98.5643 2700.0 99.7236 2500.0 103.0541 2500.0 104.0436 2500.0 105.0697 2900.0 105.7177 2300.0 107.0488 1400000.0 107.0572 28000.0 119.0489 24000.0 120.0801 2500.0 120.2718 2900.0 121.0294 2500.0 121.064 12000.0 122.0598 53000.0 126.8781 2500.0 127.4651 2400.0 130.0651 32000.0 131.0491 16000.0 132.0442 2800.0 134.0597 51000.0 135.0337 3600.0 135.0437 29000.0 135.0678 42000.0 136.0757 39000.0 143.727 2400.0 146.0598 120000.0 147.044 15000.0 148.0757 30000.0 157.0647 5800.0 158.0598 35000.0 162.0549 31000.0 163.0497 2400.0 163.0627 110000.0 164.0548 8700.0 164.0705 1900000.0 164.0935 3200.0 167.0857 7600.0 168.2476 3000.0 173.5222 3400.0 173.5357 73000.0 173.5406 7400.0 176.0703 2700.0 179.0853 32000.0 181.0649 6000.0 182.0727 2400.0 185.0959 5400.0 187.006 150000.0 187.3931 2300.0 188.0323 6700.0 188.4687 2400.0 193.934 2400.0 194.0738 2400.0 195.0809 26000.0 197.0964 74000.0 199.0763 2700.0 199.1118 2600.0 200.1077 11000.0 207.0807 41000.0 209.0963 3800.0 213.0915 62000.0 214.1227 3000.0 221.5927 2600.0 223.0771 2500.0 224.1075 35000.0 225.0913 47000.0 234.0911 3000.0 235.0759 5900.0 235.1213 2900.0 241.0863 8400.0 242.118 91000.0 244.0033 2800.0 244.0285 21000.0 252.1023 82000.0 253.0872 6900.0 267.3625 2600.0 270.1131 80000.0 275.9124 2600.0 END IONS BEGIN IONS SCANS=138 PEPMASS=298.1444 CHARGE=1 COLLISION_ENERGY=0.0 50.8187 2300.0 52.8336 2200.0 53.6397 3100.0 57.455 2100.0 58.0648 67000.0 60.1614 3200.0 65.5489 2500.0 89.4847 2600.0 91.0927 3000.0 93.0697 4100.0 107.0488 130000.0 110.7834 2400.0 121.0645 130000.0 121.3872 2200.0 123.4372 2400.0 130.5219 2200.0 145.0888 3100.0 146.036 8300.0 146.0961 17000.0 148.0518 2900.0 149.0611 2900.0 153.739 2800.0 160.0753 3300.0 161.06 13000.0 173.0834 14000.0 173.5253 31000.0 173.5403 37000.0 174.0762 2100.0 174.0914 81000.0 176.0707 140000.0 176.6713 2100.0 177.0785 100000.0 178.0863 58000.0 184.2398 2700.0 189.0785 11000.0 190.0864 56000.0 191.0533 7800.0 191.0739 6600.0 191.0941 2700000.0 192.102 190000.0 202.0881 2500.0 204.1022 11000.0 206.891 3100.0 207.0802 12000.0 217.5037 2600.0 218.8901 9700.0 224.9026 3000.0 235.0761 10000.0 246.8856 6900.0 253.0842 4400.0 262.025 2600.0 263.0873 2500.0 270.0934 3700.0 296.1287 4700.0 296.662 2700.0 298.1439 27000.0 301.3236 2900.0 END IONS BEGIN IONS SCANS=139 PEPMASS=460.2335 CHARGE=1 COLLISION_ENERGY=0.0 58.065 600000.0 58.0683 5900.0 58.2563 2400.0 58.3131 2600.0 59.1586 2300.0 62.6259 2500.0 75.0439 22000.0 82.3494 2400.0 83.3245 2300.0 91.054 3200.0 92.7165 2300.0 93.6953 2300.0 107.0488 61000.0 109.0702 2400.0 119.0488 18000.0 121.0644 23000.0 127.4205 2200.0 134.7741 2500.0 137.0595 17000.0 139.5308 2500.0 143.049 7500.0 145.0643 6800.0 147.0437 330000.0 148.0478 7100.0 173.5284 59000.0 173.5449 5200.0 175.0754 25000.0 175.6354 2500.0 177.0919 3100.0 191.1406 2400.0 237.0915 19000.0 239.1071 14000.0 244.993 6700.0 247.1284 2500.0 265.0092 2500.0 268.9923 7000.0 269.1171 240000.0 269.1496 4900.0 271.1328 51000.0 286.4923 2600.0 287.0031 24000.0 290.4689 2300.0 295.0073 2900.0 314.1751 980000.0 320.9091 2400.0 327.0429 3000.0 344.4362 2400.0 346.2252 2700.0 388.8398 2500.0 415.1795 3100.0 460.2329 250000.0 END IONS BEGIN IONS SCANS=140 PEPMASS=247.0604 CHARGE=1 COLLISION_ENERGY=0.0 49.9011 2100.0 49.9553 2000.0 50.2612 2200.0 52.1954 2600.0 52.9391 2400.0 55.0177 11000.0 58.4649 2300.0 58.8902 2400.0 63.9749 2700.0 65.0357 2300.0 65.0383 74000.0 67.0175 88000.0 68.9969 44000.0 69.0332 43000.0 71.9196 2500.0 72.55 3000.0 73.0282 8100.0 81.0335 2800.0 83.0126 12000.0 93.0333 13000.0 97.0281 35000.0 97.0633 2600.0 111.0072 6700.0 111.0438 100000.0 121.0077 24000.0 121.0282 4500000.0 121.0389 250000.0 121.045 9500.0 121.049 39000.0 122.5356 2700.0 125.0239 4400.0 135.1947 2800.0 149.9378 2400.0 152.9889 50000.0 153.0181 8100000.0 153.0406 12000.0 153.0458 82000.0 153.0559 16000.0 171.029 52000.0 173.0596 2600.0 173.5275 38000.0 173.5421 13000.0 205.0501 7700.0 212.6734 2600.0 218.5984 3200.0 229.05 24000.0 240.3851 2500.0 247.0337 3300.0 247.0607 68000.0 END IONS BEGIN IONS SCANS=141 PEPMASS=409.1136 CHARGE=1 COLLISION_ENERGY=0.0 58.6885 2100.0 60.103 2600.0 61.0285 2100.0 64.4554 2700.0 66.5476 2100.0 69.0336 7100.0 85.0283 41000.0 97.0282 14000.0 99.2551 2100.0 121.0283 160000.0 127.0383 6100.0 147.044 14000.0 150.8861 2400.0 153.0181 240000.0 165.018 14000.0 168.2879 2100.0 171.0288 5700.0 173.5301 23000.0 177.0181 9300.0 177.0545 7500.0 183.0291 8100.0 191.034 7900.0 195.0287 52000.0 201.7989 2600.0 218.9709 2700.0 219.0289 26000.0 231.0289 32000.0 233.0246 3800.0 247.0599 240000.0 249.0384 3000.0 259.0594 4300.0 261.0395 9700.0 271.0605 7200.0 303.8534 2500.0 313.0708 8600.0 325.0741 3700.0 329.8231 2900.0 END IONS BEGIN IONS SCANS=142 PEPMASS=409.9937 CHARGE=1 COLLISION_ENERGY=0.0 54.2007 2300.0 54.9968 2300.0 55.313 2200.0 55.6421 2100.0 55.9342 17000.0 61.1968 2400.0 66.9844 2300.0 68.7011 2200.0 70.4178 2100.0 83.8696 2100.0 85.7303 2600.0 87.3365 2200.0 91.0543 5200.0 102.585 2700.0 112.7082 2700.0 119.0489 23000.0 121.0283 3700.0 139.9025 2700.0 142.7917 2400.0 144.9578 14000.0 145.7456 2400.0 147.0311 3700.0 147.0438 200000.0 153.018 10000.0 154.0208 2800.0 157.9658 18000.0 173.5285 47000.0 173.537 15000.0 173.5455 7900.0 183.245 2700.0 191.9865 33000.0 195.0294 3100.0 205.9662 3200.0 217.966 25000.0 218.974 99000.0 219.9819 85000.0 233.9611 31000.0 233.9948 2300.0 235.9767 21000.0 236.9845 7600.0 238.3704 2500.0 245.9967 6800.0 248.0632 11000.0 253.9875 8100.0 259.9774 3400.0 260.4922 2400.0 272.9838 9500.0 275.3158 2200.0 275.9712 5900.0 277.4247 2400.0 280.3449 2800.0 300.4684 2800.0 387.9157 2600.0 END IONS BEGIN IONS SCANS=143 PEPMASS=419.0095 CHARGE=1 COLLISION_ENERGY=0.0 57.0697 7400.0 59.321 2400.0 65.0383 10000.0 66.8657 2300.0 69.058 2600.0 71.0852 21000.0 79.8206 2500.0 80.278 2200.0 85.1008 8200.0 91.0539 62000.0 92.4205 2400.0 97.8815 2400.0 116.9658 14000.0 117.4883 2200.0 119.0392 3300.0 119.0488 210000.0 120.7906 2400.0 138.2088 2200.0 140.992 2200.0 147.0437 2200000.0 147.0547 30000.0 147.0709 10000.0 148.0471 24000.0 149.023 37000.0 173.5279 29000.0 173.5404 20000.0 219.0127 17000.0 244.9923 60000.0 263.0027 7000.0 268.9927 63000.0 276.9979 3000.0 280.9929 2500.0 287.0034 100000.0 295.0086 27000.0 301.0217 7000.0 310.3882 2300.0 363.0409 2600.0 365.7575 2800.0 END IONS BEGIN IONS SCANS=144 PEPMASS=455.999 CHARGE=1 COLLISION_ENERGY=0.0 57.0023 2200.0 58.4594 2200.0 59.5752 2700.0 65.0385 6400.0 70.8279 2400.0 71.7365 2800.0 79.0255 2500.0 88.9674 2100.0 91.0539 55000.0 92.9269 2100.0 107.2258 2400.0 113.0487 2200.0 116.3643 2400.0 118.4306 2300.0 119.0488 180000.0 121.6823 3200.0 123.2154 2400.0 125.754 2400.0 126.5184 2500.0 131.9499 3300.0 138.2978 2300.0 144.958 17000.0 146.0345 2500.0 147.0437 1800000.0 147.0549 26000.0 147.071 3500.0 157.9659 48000.0 165.9696 2800.0 166.8077 2500.0 173.5225 4700.0 173.5291 48000.0 173.5436 15000.0 173.9605 6300.0 190.0522 2700.0 191.9866 34000.0 196.9908 8700.0 197.1947 2400.0 205.9672 5500.0 209.9972 2800.0 217.966 35000.0 218.9741 66000.0 219.9818 80000.0 223.005 2800.0 223.9781 7700.0 233.9609 34000.0 234.968 12000.0 235.9767 43000.0 236.9842 3000.0 245.9968 25000.0 253.9872 9900.0 256.1036 2600.0 259.9766 77000.0 263.0544 15000.0 272.9845 35000.0 275.9715 65000.0 277.9872 5300.0 285.9925 54000.0 300.0637 2500.0 320.5389 2800.0 362.7065 2600.0 379.3559 2200.0 454.9697 2200.0 456.1576 16000.0 END IONS BEGIN IONS SCANS=145 PEPMASS=757.0732 CHARGE=1 COLLISION_ENERGY=0.0 76.4324 2500.0 76.9254 2300.0 81.5516 2200.0 81.5862 2300.0 89.6715 2400.0 91.0539 29000.0 92.667 2200.0 93.7016 2300.0 108.9948 2300.0 118.9713 14000.0 119.0488 71000.0 123.6739 2300.0 125.0155 2200.0 141.1255 2400.0 147.0437 910000.0 147.055 14000.0 147.0635 3900.0 148.0471 13000.0 166.9838 2300.0 173.5243 11000.0 173.5348 60000.0 173.5431 4700.0 176.0181 2900.0 193.3879 3100.0 194.711 3000.0 202.1222 2300.0 209.0187 12000.0 221.6067 2200.0 224.9895 3300.0 231.1089 2500.0 234.972 3700.0 236.7049 2500.0 244.993 3000.0 259.8249 2700.0 263.002 3400.0 268.9767 15000.0 287.003 36000.0 291.0224 2800.0 296.9727 9800.0 307.4218 2400.0 311.0044 6500.0 314.9809 5900.0 328.8299 2500.0 329.0129 3400.0 336.3464 3000.0 373.0042 9600.0 397.0037 6400.0 415.0159 4600.0 425.0004 2800.0 443.0093 15000.0 444.95 2400.0 465.9662 2400.0 544.9235 2600.0 624.1885 3400.0 708.6534 2600.0 758.9238 3000.0 END IONS BEGIN IONS SCANS=146 PEPMASS=339.0714 CHARGE=1 COLLISION_ENERGY=0.0 51.7273 2600.0 54.9461 2500.0 58.703 2500.0 58.7851 2500.0 60.4448 2600.0 64.3486 2300.0 65.0384 7800.0 67.879 2300.0 68.6594 2200.0 70.1907 2200.0 71.9698 2300.0 77.0277 2200.0 77.1608 2500.0 83.0125 5500.0 90.2458 2100.0 91.0539 110000.0 111.0067 2400.0 119.0393 14000.0 119.0488 420000.0 119.0572 2300.0 119.0591 5600.0 127.0919 2300.0 131.6525 2600.0 138.9929 2300.0 145.2647 2600.0 147.0437 2600000.0 147.0547 39000.0 147.0708 20000.0 149.688 6000.0 162.4716 2400.0 165.5731 2500.0 168.9438 2300.0 173.5204 2600.0 173.5287 47000.0 173.5464 7200.0 175.4473 2200.0 190.0921 2600.0 256.2758 2400.0 260.6013 2600.0 266.6696 2600.0 278.8934 2500.0 303.395 2600.0 344.827 2300.0 END IONS BEGIN IONS SCANS=147 PEPMASS=379.064 CHARGE=1 COLLISION_ENERGY=0.0 63.6985 2500.0 66.289 2800.0 72.2081 2300.0 82.9731 2500.0 91.0542 12000.0 99.3719 2500.0 119.0489 69000.0 136.3909 2300.0 147.0439 1100000.0 149.2044 2500.0 164.4899 2800.0 169.0116 3000.0 169.026 180000.0 169.0424 4400.0 173.5296 17000.0 173.5397 10000.0 175.6143 2500.0 178.5082 2200.0 179.5828 2400.0 187.0208 8600.0 190.4418 2100.0 215.0161 16000.0 222.3203 2300.0 224.9386 2700.0 233.0267 790000.0 233.6636 2800.0 247.6314 2700.0 336.4727 2400.0 END IONS BEGIN IONS SCANS=148 PEPMASS=735.1381 CHARGE=1 COLLISION_ENERGY=0.0 70.9072 2600.0 101.9177 2100.0 107.1544 2300.0 108.7593 2300.0 114.3647 2400.0 116.0261 2200.0 119.0489 4200.0 119.8148 2300.0 141.0531 2200.0 147.031 8800.0 147.0437 220000.0 149.6807 4100.0 149.6909 4000.0 169.0104 7600.0 169.0258 170000.0 173.5254 46000.0 173.5419 27000.0 215.0164 26000.0 227.2467 2400.0 233.0267 740000.0 233.0544 9100.0 247.046 6400.0 259.0466 2500.0 265.0558 11000.0 280.57 2500.0 304.6193 2900.0 351.0688 6700.0 361.05 12000.0 379.0641 150000.0 396.026 2600.0 461.163 2700.0 487.7682 2800.0 519.9175 2400.0 END IONS BEGIN IONS SCANS=149 PEPMASS=766.068 CHARGE=1 COLLISION_ENERGY=0.0 74.1167 2600.0 78.8428 2100.0 90.9472 2600.0 91.0539 22000.0 95.0244 2400.0 95.9446 2600.0 98.0821 2500.0 108.3395 2400.0 109.9575 2600.0 111.4339 2200.0 119.0488 52000.0 127.9549 4700.0 131.9504 16000.0 138.5656 2700.0 139.9569 2400.0 144.9581 21000.0 145.9658 4500.0 147.0437 890000.0 147.0549 7700.0 149.6817 3500.0 149.692 5400.0 157.9532 2400.0 157.9658 39000.0 172.5994 2700.0 173.5286 49000.0 173.5367 7300.0 173.5459 4300.0 173.9611 19000.0 174.9692 3000.0 175.5166 2700.0 179.3316 2800.0 187.9393 3000.0 189.9558 23000.0 191.9867 23000.0 197.9616 5700.0 201.955 8600.0 217.9504 8600.0 218.9741 35000.0 219.9818 41000.0 222.9292 2600.0 233.961 18000.0 234.9686 19000.0 235.9761 15000.0 245.997 36000.0 253.9875 9300.0 259.9764 150000.0 260.9845 44000.0 261.9934 5800.0 263.9559 7500.0 272.9845 110000.0 273.9929 3400.0 275.9717 89000.0 277.987 45000.0 278.9951 17000.0 285.9926 130000.0 287.4592 2400.0 287.8995 2400.0 288.9788 7000.0 290.9967 3200.0 295.9964 3900.0 300.0316 2400.0 301.9851 3200.0 305.9691 16000.0 320.0021 2500.0 323.9794 2600.0 327.5147 2700.0 339.9642 2300.0 346.7404 2400.0 364.0036 3900.0 365.0104 10000.0 372.6197 2500.0 374.9796 17000.0 382.0119 9300.0 392.9902 15000.0 411.0014 14000.0 452.9138 2500.0 529.9904 2400.0 573.0873 2500.0 769.1277 2700.0 END IONS BEGIN IONS SCANS=150 PEPMASS=357.0819 CHARGE=1 COLLISION_ENERGY=0.0 53.8413 2500.0 54.0694 2300.0 54.2185 2300.0 57.7908 2600.0 65.0382 24000.0 71.5396 2600.0 73.5526 2300.0 73.8249 2300.0 76.8088 2500.0 79.5113 2100.0 81.4052 2500.0 91.0539 200000.0 98.071 2300.0 98.4463 2300.0 119.0392 3600.0 119.0488 350000.0 119.0591 5800.0 131.4403 2700.0 134.5612 2400.0 147.0437 1500000.0 147.0548 20000.0 148.0471 5900.0 149.2217 2200.0 158.5787 2700.0 158.9215 2500.0 173.528 37000.0 173.5424 5600.0 175.0169 2200.0 185.0201 2200.0 185.0337 2300.0 208.3489 2300.0 224.6458 2800.0 231.876 2500.0 268.0177 2500.0 284.8706 2600.0 307.5044 2500.0 331.7935 2600.0 END IONS BEGIN IONS SCANS=151 PEPMASS=450.1978 CHARGE=1 COLLISION_ENERGY=0.0 57.0333 48000.0 59.0491 13000.0 60.0441 8000.0 61.0282 6700.0 61.3166 2300.0 68.0204 2200.0 69.0332 340000.0 72.0662 2300.0 73.0276 2900.0 74.5459 2500.0 75.0437 3000.0 81.0333 12000.0 85.0225 3400.0 85.028 320000.0 87.0437 410000.0 91.0389 8300.0 97.0281 480000.0 99.0437 15000.0 101.2126 2400.0 103.0385 3300.0 107.0487 3400.0 109.0282 14000.0 111.0446 3000.0 112.5754 2600.0 114.8633 2300.0 115.0306 3200.0 115.0386 540000.0 115.0495 13000.0 115.0529 3600.0 117.0696 7200.0 117.3617 2300.0 121.0645 150000.0 122.0665 2300.0 124.5725 2200.0 125.2111 3000.0 127.0385 60000.0 132.0596 2300.0 133.0492 240000.0 135.0806 7000.0 139.0388 3300.0 141.2839 2400.0 145.0494 67000.0 145.0645 180000.0 145.8905 2800.0 147.044 14000.0 149.6808 3300.0 149.6912 4300.0 150.0758 55000.0 153.8347 2800.0 156.7647 2700.0 159.08 18000.0 163.0752 120000.0 169.0496 8200.0 171.0823 2700.0 173.526 53000.0 173.5362 5100.0 173.5443 10000.0 175.0604 2900.0 175.0753 100000.0 177.0545 3700.0 182.8376 2200.0 187.0753 65000.0 187.5555 3100.0 200.138 2700.0 201.0922 2900.0 205.0863 31000.0 205.7985 3100.0 217.0862 130000.0 222.1994 2300.0 229.0854 3100.0 229.2977 2600.0 235.0963 3300.0 237.9204 2500.0 246.3482 2500.0 258.9294 2400.0 258.9884 5700.0 271.0973 17000.0 277.0886 5500.0 288.1234 20000.0 361.715 2500.0 386.8173 2300.0 421.9012 3000.0 433.2141 2600.0 END IONS BEGIN IONS SCANS=152 PEPMASS=265.1549 CHARGE=1 COLLISION_ENERGY=0.0 48.7784 4200.0 49.1123 2500.0 49.6232 5200.0 51.4317 3800.0 53.8498 3300.0 55.0541 44000.0 55.0871 4300.0 55.1018 2700.0 60.1038 3600.0 60.1913 4600.0 60.812 2100.0 62.0159 4300.0 63.0235 35000.0 63.5681 4400.0 68.5801 3100.0 69.3965 2400.0 70.0653 5200.0 72.0806 1800000.0 72.0851 13000.0 72.0873 7500.0 73.8397 2400.0 78.0463 14000.0 78.7731 5200.0 78.7939 5300.0 87.1961 3600.0 89.0326 9900.0 89.0384 390000.0 89.107 420000.0 91.0542 15000.0 95.049 3800.0 98.0598 170000.0 100.4994 5300.0 101.3165 5000.0 103.0546 7000.0 103.5708 4800.0 106.0408 18000.0 114.0913 27000.0 115.0864 62000.0 117.0238 4500.0 117.0333 2000000.0 117.0417 7000.0 117.0426 17000.0 119.0491 21000.0 120.1591 4900.0 124.0522 5500.0 129.0446 12000.0 134.0363 96000.0 135.0439 120000.0 145.0282 18000000.0 145.0389 240000.0 145.0551 140000.0 145.063 48000.0 147.0439 33000.0 149.046 23000.0 149.0596 1000000.0 149.0706 6300.0 149.0739 16000.0 152.0703 20000.0 154.4987 6400.0 162.0312 35000.0 163.039 160000.0 173.5251 28000.0 173.5374 45000.0 177.0075 16000.0 177.018 150000.0 177.0263 99000.0 177.0547 25000000.0 177.0836 53000.0 177.091 220000.0 177.1018 64000.0 177.1109 9300.0 186.055 110000.0 206.1173 30000.0 214.2516 6000.0 248.1287 250000.0 END IONS BEGIN IONS SCANS=153 PEPMASS=300.1599 CHARGE=1 COLLISION_ENERGY=0.0 55.0179 18000.0 56.0495 28000.0 57.0573 13000.0 57.1189 4200.0 58.0652 7200000.0 58.0679 52000.0 58.0718 27000.0 58.0739 7100.0 65.2691 2500.0 68.3006 5400.0 70.0654 9200.0 70.7689 5800.0 71.0728 160000.0 72.0807 140000.0 75.0374 9400.0 75.0417 5100.0 77.0386 11000.0 79.0541 25000.0 80.5819 4800.0 82.1859 4500.0 85.4854 3900.0 89.0595 14000.0 91.0541 58000.0 93.0697 29000.0 95.0491 72000.0 103.0542 7100.0 105.0439 2900.0 105.0698 24000.0 107.0319 55000.0 107.049 8600000.0 107.0576 110000.0 107.0626 27000.0 107.066 83000.0 115.0542 330000.0 117.0698 70000.0 119.049 200000.0 121.0283 31000.0 121.0647 860000.0 121.0757 8800.0 123.0439 1100000.0 123.0533 17000.0 123.0806 5200.0 131.0489 68000.0 131.8578 2600.0 133.0647 140000.0 135.044 170000.0 135.0808 13000.0 136.0515 24000.0 137.0596 350000.0 138.9093 2500.0 140.5527 5400.0 143.049 1800000.0 145.0647 1100000.0 145.0744 8100.0 145.0784 20000.0 146.0725 33000.0 147.0439 39000.0 147.0803 220000.0 148.0515 29000.0 149.0595 160000.0 149.0834 47000.0 151.0754 46000.0 155.0604 5000.0 157.0646 37000.0 161.0596 1800000.0 162.0674 15000.0 163.0753 360000.0 166.0784 5100.0 171.0808 5800.0 173.5259 40000.0 173.5409 24000.0 175.0753 25000.0 176.1069 38000.0 178.0861 110000.0 179.0941 160000.0 180.1019 210000.0 181.0646 25000.0 181.1015 37000.0 182.3112 2700.0 183.0806 19000.0 191.0858 54000.0 192.1016 10000.0 193.1096 190000.0 194.0728 48000.0 194.1179 5200.0 195.0804 24000.0 199.0755 7700.0 199.1128 6100.0 202.9053 5800.0 206.1177 53000.0 209.06 35000.0 209.0962 340000.0 210.0679 11000.0 211.0756 23000.0 211.1119 130000.0 219.0802 75000.0 221.0951 19000.0 226.0624 86000.0 227.0704 30000.0 227.1068 56000.0 228.0779 15000.0 229.1223 6100.0 237.0695 4300.0 237.0909 590000.0 239.1066 110000.0 240.078 74000.0 251.1051 12000.0 253.084 9600.0 253.1223 6100.0 255.1014 3200000.0 257.117 510000.0 257.1477 10000.0 267.4334 4400.0 269.1166 37000.0 271.1328 15000.0 282.15 28000.0 285.1362 18000.0 300.1594 5300000.0 300.238 23000.0 END IONS BEGIN IONS SCANS=154 PEPMASS=298.1444 CHARGE=1 COLLISION_ENERGY=0.0 48.4474 2700.0 51.9305 2400.0 56.0495 2800.0 58.0611 4800.0 58.065 2200000.0 58.0683 24000.0 58.07 19000.0 58.0716 10000.0 62.6779 2500.0 65.2786 2500.0 80.3027 2200.0 88.8632 2300.0 92.5283 2200.0 99.5976 2300.0 101.3016 2700.0 107.0488 20000.0 110.3571 2300.0 121.2076 2700.0 132.0998 2300.0 160.8352 3200.0 166.8 2400.0 173.5305 37000.0 174.9025 3100.0 191.0937 25000.0 192.1028 3200.0 218.8908 2600.0 229.3101 3000.0 241.9635 3000.0 243.0233 2600.0 246.7669 2400.0 246.8861 3600.0 253.0867 2600.0 260.0946 2400.0 271.9649 2600.0 282.4151 2400.0 298.1443 2900.0 END IONS BEGIN IONS SCANS=155 PEPMASS=290.1028 CHARGE=1 COLLISION_ENERGY=0.0 47.0323 2600.0 52.238 2500.0 55.1975 2200.0 56.43 2200.0 60.2955 2800.0 61.1839 2200.0 67.4965 2200.0 68.0821 2500.0 73.3916 2700.0 74.2333 2400.0 81.0333 22000.0 91.0539 93000.0 109.0285 9700.0 109.0645 8800.0 116.4243 2700.0 119.042 2400.0 119.0488 68000.0 127.0386 20000.0 131.7611 3100.0 134.8543 2400.0 137.0231 1100000.0 137.0335 19000.0 137.0594 1100000.0 137.0696 16000.0 138.0259 2400.0 149.1252 2300.0 154.0497 16000.0 154.0859 55000.0 173.5247 8800.0 173.5384 25000.0 184.1827 2500.0 190.0264 3800.0 193.2626 2300.0 197.0521 2500.0 205.05 5100.0 215.9494 2200.0 219.5845 2100.0 229.0266 2400.0 230.5338 2400.0 281.6719 2300.0 294.1178 2700.0 END IONS BEGIN IONS SCANS=156 PEPMASS=355.1024 CHARGE=1 COLLISION_ENERGY=0.0 58.7283 2200.0 58.764 2600.0 67.0539 4600.0 67.3909 2500.0 78.3452 2500.0 79.0539 16000.0 80.763 2400.0 81.348 2300.0 83.0489 19000.0 85.0281 2600.0 89.0382 120000.0 93.0334 2900.0 95.0489 12000.0 98.6424 2600.0 104.7165 2300.0 107.0488 37000.0 111.0437 21000.0 115.8552 2900.0 116.2621 2300.0 117.0332 120000.0 117.8352 2300.0 129.0432 3100.0 131.8802 2500.0 134.035 2800.0 135.0439 350000.0 135.0558 6900.0 145.0282 480000.0 145.0388 3000.0 150.5358 2800.0 163.0071 30000.0 163.0388 4600000.0 163.0634 7400.0 163.0696 44000.0 173.5233 8200.0 173.5333 31000.0 173.5417 9500.0 175.965 2700.0 181.05 9300.0 219.6584 2300.0 258.8632 3200.0 308.9009 15000.0 336.325 3100.0 351.9253 2700.0 362.1186 2600.0 END IONS BEGIN IONS SCANS=157 PEPMASS=613.1765 CHARGE=1 COLLISION_ENERGY=0.0 70.1609 2100.0 76.5092 2600.0 79.0791 2300.0 79.3535 2200.0 81.5201 2700.0 82.3366 2100.0 83.3419 2600.0 85.028 7300.0 85.5958 2400.0 86.1233 2200.0 86.358 2300.0 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279.0502 9300.0 283.0608 13000.0 285.0399 61000.0 285.0717 5800.0 291.0502 67000.0 295.06 30000.0 297.0379 4100.0 301.0705 31000.0 303.05 47000.0 307.0603 22000.0 309.0615 13000.0 313.0712 41000.0 315.0505 30000.0 319.0804 2700.0 321.0608 35000.0 325.0706 67000.0 327.0504 61000.0 331.0814 11000.0 337.0706 64000.0 339.0697 46000.0 343.0811 9800.0 345.0606 61000.0 349.072 40000.0 355.0814 29000.0 357.0613 19000.0 361.0706 14000.0 363.0728 30000.0 367.0803 10000.0 369.0617 6900.0 375.0734 36000.0 379.0822 66000.0 385.5396 2600.0 387.0714 17000.0 391.0821 44000.0 393.0827 27000.0 403.0821 21000.0 405.0832 35000.0 409.0916 38000.0 421.0928 17000.0 423.0918 23000.0 427.1014 9300.0 433.0918 8800.0 437.8033 2400.0 439.1016 12000.0 441.1034 3900.0 445.0936 8200.0 457.1072 17000.0 460.6629 2600.0 463.1004 7400.0 481.1116 3200.0 493.3654 2600.0 512.2781 2400.0 517.6235 2500.0 541.7327 2800.0 END IONS BEGIN IONS SCANS=158 PEPMASS=326.1396 CHARGE=1 COLLISION_ENERGY=0.0 51.985 2500.0 53.0657 2700.0 56.0493 30000.0 57.4488 2600.0 58.0611 20000.0 58.0652 12000000.0 58.0701 72000.0 58.0717 35000.0 58.0736 130000.0 58.0737 19000.0 58.0757 8100.0 58.0816 4000.0 58.5126 2600.0 63.5846 2300.0 70.1742 2200.0 75.1392 2600.0 75.507 2500.0 78.9271 2600.0 81.5284 2400.0 89.2209 2800.0 90.8023 2300.0 101.2247 2500.0 106.074 2600.0 109.3327 2300.0 110.9441 2500.0 139.7337 2400.0 141.94 2400.0 147.7599 3400.0 156.0029 2100.0 173.5277 60000.0 173.5424 11000.0 174.6651 2400.0 176.1559 2400.0 179.6946 2500.0 183.0811 3200.0 195.0805 3300.0 209.073 2100.0 216.9817 2600.0 223.076 19000.0 224.0818 2600.0 224.5067 2100.0 225.091 14000.0 226.0636 12000.0 227.1068 18000.0 240.079 9300.0 253.086 65000.0 255.1015 260000.0 255.1299 6800.0 266.1171 3200.0 274.8801 5200.0 283.0968 74000.0 298.1053 10000.0 298.1441 380000.0 311.116 30000.0 311.9157 2500.0 326.1389 220000.0 326.1762 3000.0 END IONS BEGIN IONS SCANS=159 PEPMASS=327.1434 CHARGE=1 COLLISION_ENERGY=0.0 49.8031 2400.0 54.3538 2400.0 56.0494 2600.0 58.065 2600000.0 58.0683 22000.0 58.0701 17000.0 58.0718 7200.0 59.0619 15000.0 59.068 460000.0 59.0716 4400.0 62.1013 2500.0 63.9267 2300.0 64.4848 2200.0 66.7707 2300.0 67.2163 2100.0 67.2387 2300.0 76.2363 2300.0 78.0897 2500.0 85.9901 2700.0 89.5487 2300.0 94.6932 2200.0 97.0286 2800.0 99.8364 2400.0 105.5844 2500.0 108.9413 2500.0 133.8522 3100.0 134.5565 2900.0 137.6632 2600.0 141.7628 2500.0 156.8802 2700.0 164.0332 4600.0 168.5974 2400.0 172.2004 2200.0 173.5238 7900.0 173.5354 56000.0 175.8678 2400.0 176.9032 2400.0 190.2055 2300.0 211.7594 2600.0 219.8968 2800.0 221.6019 2700.0 223.075 3000.0 231.8956 2400.0 233.3861 2600.0 239.0702 20000.0 250.0622 2700.0 251.0702 32000.0 253.0604 5500.0 254.0921 26000.0 255.1007 6600.0 256.1053 53000.0 265.4041 2600.0 281.0561 7600.0 282.0864 2800.0 283.0969 15000.0 284.1009 11000.0 299.0635 3100.0 299.1474 77000.0 312.1185 5900.0 322.1544 2700.0 327.1426 51000.0 END IONS BEGIN IONS SCANS=160 PEPMASS=328.1549 CHARGE=1 COLLISION_ENERGY=0.0 51.0831 9900.0 56.0496 4500.0 57.6337 4400.0 58.0651 4600000.0 58.0681 33000.0 58.0719 14000.0 58.46 7700.0 59.0684 39000.0 62.7661 120000.0 62.7694 28000.0 63.8544 9600.0 64.1672 3700.0 68.1292 9800.0 70.6242 11000.0 70.7717 19000.0 70.7752 83000.0 72.0805 62000.0 80.1993 3900.0 83.5799 8500.0 89.0218 5500.0 126.3834 3900.0 129.106 11000.0 136.5359 4200.0 146.3607 10000.0 154.2297 8200.0 157.5332 10000.0 167.0854 67000.0 168.4172 4900.0 173.526 42000.0 173.5358 69000.0 176.0637 54000.0 177.0702 88000.0 181.0651 43000.0 191.0849 14000.0 195.0807 130000.0 197.0599 17000.0 205.065 1100000.0 205.0857 18000.0 207.0804 23000.0 209.0605 38000.0 209.0959 37000.0 212.0834 25000.0 219.081 43000.0 222.0681 4000.0 223.0497 24000.0 223.0756 3300000.0 225.0562 6400.0 225.0917 48000.0 226.0628 260000.0 227.0704 190000.0 227.1066 6100.0 232.0127 10000.0 233.0598 2400000.0 233.0983 16000.0 235.075 62000.0 237.0912 150000.0 239.0682 17000.0 240.0781 130000.0 250.0629 36000.0 250.9905 37000.0 251.0084 230000.0 251.0223 170000.0 251.0702 38000000.0 251.1189 140000.0 251.132 260000.0 251.1484 50000.0 252.0776 23000.0 253.0858 400000.0 255.1017 220000.0 261.065 36000.0 265.0858 140000.0 267.1024 22000.0 268.0731 1700000.0 270.0887 16000.0 282.0885 19000.0 283.0016 36000.0 283.0232 160000.0 283.0389 130000.0 283.0968 23000000.0 283.1555 120000.0 283.1705 170000.0 283.1903 36000.0 285.1125 160000.0 326.5881 10000.0 328.1546 760000.0 328.2 6800.0 END IONS BEGIN IONS SCANS=161 PEPMASS=314.1757 CHARGE=1 COLLISION_ENERGY=0.0 49.5032 90000.0 51.049 62000.0 51.8247 37000.0 52.7599 21000.0 56.0495 1400000.0 56.6914 9800.0 58.043 27000.0 58.0565 33000.0 58.0653 510000000.0 58.0704 1600000.0 58.0718 1100000.0 58.0737 400000.0 58.0745 3500000.0 58.0757 230000.0 59.9036 59000.0 61.1504 100000.0 62.157 36000.0 66.7051 40000.0 67.8759 64000.0 68.1447 61000.0 68.5942 24000.0 68.8578 8800.0 69.2896 38000.0 71.0727 170000.0 72.0808 750000.0 73.9382 40000.0 74.3865 90000.0 74.7939 100000.0 75.519 59000.0 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2400000.0 256.1089 75000.0 267.1018 32000.0 269.1171 52000000.0 271.1329 10000000.0 282.1488 1200000.0 282.2046 27000.0 283.1328 890000.0 285.1496 9900.0 298.1108 42000.0 299.1518 660000.0 314.1751 91000000.0 314.207 440000.0 314.2186 160000.0 END IONS BEGIN IONS SCANS=162 PEPMASS=317.1841 CHARGE=1 COLLISION_ENERGY=0.0 58.0649 940000.0 58.0683 7100.0 58.07 6100.0 59.0619 11000.0 59.0679 370000.0 59.0714 4100.0 60.0653 3600.0 60.071 40000.0 71.2032 2300.0 80.5403 2300.0 82.8749 2200.0 84.5855 2200.0 85.2886 2500.0 91.5895 2300.0 107.0488 120000.0 108.0521 120000.0 109.0543 54000.0 110.0571 18000.0 119.0496 2600.0 121.0647 23000.0 122.068 21000.0 123.0702 5600.0 126.8266 2200.0 134.8084 2500.0 137.0597 7000.0 138.0631 16000.0 139.0647 18000.0 140.0685 2900.0 143.0492 2900.0 144.0526 9600.0 145.0545 3000.0 145.0653 11000.0 146.0683 17000.0 147.0704 10000.0 152.0791 2600.0 154.6682 2300.0 157.1781 2900.0 170.3198 2800.0 172.0077 2800.0 173.5212 5300.0 173.5338 70000.0 175.0758 5600.0 176.0789 19000.0 176.9381 2600.0 177.0809 32000.0 178.0836 21000.0 179.0963 6300.0 179.1752 2300.0 194.1068 3500.0 210.1003 5600.0 212.1063 2400.0 214.1211 3500.0 224.8991 15000.0 226.5516 2500.0 237.0632 2300.0 238.095 8600.0 239.097 19000.0 240.101 49000.0 241.114 2800.0 242.1172 5500.0 265.5967 2900.0 271.1236 26000.0 272.126 110000.0 273.1399 3000.0 274.1414 20000.0 281.8608 9400.0 293.3658 2400.0 317.1844 220000.0 317.2252 4300.0 END IONS BEGIN IONS SCANS=163 PEPMASS=330.1704 CHARGE=1 COLLISION_ENERGY=0.0 49.4243 2200.0 49.6569 2300.0 49.7778 2600.0 50.2309 2200.0 51.2373 2400.0 51.5075 2300.0 51.6207 2400.0 52.7177 2400.0 52.8776 2200.0 53.1196 2100.0 53.4007 2200.0 53.5527 2300.0 54.5182 2400.0 55.0177 3800.0 57.1018 2400.0 58.0611 5100.0 58.0651 4000000.0 58.069 24000.0 58.0699 16000.0 59.0683 19000.0 66.2423 2800.0 68.8229 2100.0 70.5213 2200.0 74.8382 2200.0 75.5004 2500.0 77.4392 2200.0 78.7965 2300.0 79.7486 2300.0 79.8518 2500.0 80.0675 2500.0 80.6628 2400.0 82.9793 2100.0 85.536 2500.0 94.2144 2500.0 97.5598 2300.0 98.9752 2500.0 100.5305 2800.0 101.9517 2400.0 102.402 2500.0 105.0923 2600.0 107.0487 1000000.0 107.0575 15000.0 109.0728 2300.0 112.2979 2600.0 113.8382 2300.0 115.4843 2200.0 115.5765 2400.0 115.8223 2500.0 116.1738 2300.0 120.1278 2200.0 120.8967 2400.0 121.0644 260000.0 123.0437 74000.0 124.2776 2400.0 131.0485 40000.0 133.0647 5700.0 136.1786 2200.0 136.8936 3000.0 137.0595 13000.0 139.1839 2600.0 139.2862 2100.0 140.4529 2600.0 141.6768 2300.0 143.0489 22000.0 145.0643 130000.0 147.044 36000.0 147.0804 21000.0 148.7617 2500.0 148.837 2700.0 150.38 2300.0 151.6714 2400.0 152.0284 2600.0 153.042 3300.0 153.0541 160000.0 159.0437 260000.0 160.2892 2200.0 161.0596 19000.0 163.0755 2700.0 163.0991 28000.0 164.0352 2600.0 167.0699 54000.0 171.2661 2500.0 172.9448 2400.0 173.0592 14000.0 173.5226 22000.0 173.538 110000.0 175.0601 3000.0 175.0754 42000.0 179.0701 54000.0 181.0857 14000.0 183.0806 3000.0 184.1826 2600.0 190.5871 2400.0 191.0701 170000.0 192.0778 2200.0 192.1011 10000.0 193.0857 100000.0 194.0799 2700.0 197.0613 2500.0 205.0851 6200.0 207.0801 17000.0 208.0965 150000.0 209.1044 13000.0 210.1126 87000.0 223.0764 6100.0 223.1178 2700.0 224.0786 11000.0 225.0907 100000.0 225.2125 2600.0 227.1066 13000.0 233.0616 4500.0 234.0636 10000.0 235.0694 24000.0 235.0761 3100.0 237.0911 5700.0 242.9948 2400.0 250.9891 2600.0 251.0707 54000.0 251.1945 2500.0 252.044 5800.0 252.0739 140000.0 253.0853 670000.0 254.0944 6000.0 255.1011 17000.0 263.8626 2500.0 266.0649 2700.0 267.1014 34000.0 269.0779 4800.0 270.0878 39000.0 284.1009 51000.0 285.1121 620000.0 287.1279 130000.0 290.9858 2400.0 293.3386 2600.0 298.1428 9000.0 299.1281 25000.0 300.8491 3200.0 315.1467 27000.0 320.3501 2700.0 330.17 1000000.0 END IONS BEGIN IONS SCANS=164 PEPMASS=399.1656 CHARGE=1 COLLISION_ENERGY=0.0 53.0385 3000.0 55.3501 2400.0 57.0333 29000.0 61.0281 12000.0 69.0331 47000.0 71.0855 3000.0 73.028 2300.0 75.8154 2600.0 78.1792 2300.0 78.5051 2700.0 78.7987 2600.0 81.0332 24000.0 82.7931 2100.0 84.4969 2700.0 85.028 140000.0 86.931 2800.0 87.0437 7000.0 91.0384 4600.0 97.0281 36000.0 99.0439 13000.0 102.9278 2400.0 103.0386 5700.0 103.0539 80000.0 109.0281 24000.0 109.7573 2500.0 114.9335 2400.0 117.0541 2700.0 117.1664 2600.0 120.0244 2600.0 127.0387 29000.0 129.0555 2500.0 131.0377 4000.0 131.0488 680000.0 131.0586 3300.0 131.0593 7900.0 133.0633 2600.0 148.0516 86000.0 161.0595 24000.0 162.0666 3300.0 163.0752 140000.0 173.5314 50000.0 173.5462 5500.0 188.9108 2400.0 201.0899 2400.0 202.8297 2700.0 206.1194 4800.0 220.3445 2300.0 253.2318 2500.0 269.9477 2500.0 289.9211 5500.0 301.9229 15000.0 303.9381 5900.0 317.9177 7000.0 319.9321 20000.0 329.9171 22000.0 333.9092 2600.0 347.9288 28000.0 376.0162 12000.0 END IONS BEGIN IONS SCANS=165 PEPMASS=439.1581 CHARGE=1 COLLISION_ENERGY=0.0 76.5821 2500.0 80.7098 2300.0 84.0174 3600.0 95.0099 9400.0 96.017 3200.0 103.0662 2300.0 104.8521 2400.0 109.5514 2300.0 110.2338 2400.0 112.0127 3000.0 113.0203 16000.0 113.192 2500.0 117.7126 2600.0 126.028 2800.0 139.3145 2600.0 157.0464 3000.0 166.0497 3800.0 173.5237 22000.0 173.5428 17000.0 181.3581 2800.0 185.0415 28000.0 201.0361 11000.0 202.0422 2500.0 202.0596 33000.0 203.0517 5700.0 220.8099 2500.0 259.0782 18000.0 273.9823 24000.0 277.104 9900.0 291.9957 3300.0 315.2928 2600.0 343.8292 2900.0 356.9949 2700.0 375.0088 25000.0 393.0202 27000.0 411.0859 3900.0 439.0869 11000.0 439.1569 270000.0 END IONS BEGIN IONS SCANS=166 PEPMASS=210.0401 CHARGE=1 COLLISION_ENERGY=0.0 41.6801 2200.0 44.22 2400.0 45.2849 2300.0 52.579 2000.0 52.6199 2200.0 52.9265 2300.0 53.0384 64000.0 54.7187 2400.0 55.054 13000.0 57.2327 2100.0 57.3792 2300.0 58.7652 2500.0 60.3057 2400.0 60.4402 2000.0 60.6704 2400.0 62.5672 2400.0 65.0384 3000.0 65.4314 2400.0 66.1391 2400.0 67.0176 82000.0 68.0128 220000.0 70.0648 28000.0 70.3164 3300.0 70.9864 2300.0 73.5344 2400.0 73.6703 2300.0 76.1171 2100.0 77.3605 2300.0 78.0115 2700.0 80.0491 260000.0 81.0331 260000.0 83.3133 2400.0 84.0441 4800.0 86.0838 2100.0 87.6836 2300.0 90.2385 2500.0 93.0337 2200.0 95.0124 83000.0 96.044 12000.0 97.052 22000.0 97.8431 2600.0 98.0533 3100.0 98.0597 160000.0 106.8606 2300.0 108.0316 3300.0 108.0441 900000.0 108.0527 5300.0 109.0281 140000.0 116.966 14000.0 117.3317 2500.0 120.0433 2400.0 120.3148 2300.0 121.028 3000.0 122.0234 10000.0 122.247 2500.0 124.0391 73000.0 125.0468 59000.0 126.0442 16000.0 126.0546 1200000.0 126.0648 25000.0 127.0383 3800.0 136.0216 3500.0 136.0391 2100000.0 136.0491 33000.0 137.0238 2900.0 137.4308 2400.0 145.9247 2500.0 147.2382 3100.0 148.0388 2900.0 153.0417 68000.0 154.0496 410000.0 154.0644 4100.0 155.6231 2800.0 158.99 10000.0 164.0342 1300000.0 164.05 21000.0 168.9776 2900.0 170.4162 2600.0 173.524 7200.0 173.5348 72000.0 176.2814 2300.0 182.0446 22000.0 183.0281 2700.0 192.0289 30000.0 193.321 2300.0 206.4986 2400.0 209.8192 2600.0 210.0395 2600.0 211.0711 2500.0 END IONS BEGIN IONS SCANS=167 PEPMASS=243.9932 CHARGE=1 COLLISION_ENERGY=0.0 44.7527 2100.0 45.7706 2200.0 46.505 2000.0 48.4698 2300.0 48.6141 2300.0 49.4854 2200.0 50.7485 2200.0 52.7155 2300.0 55.4373 2700.0 55.9342 470000.0 56.4252 2300.0 62.5816 2100.0 63.1999 2300.0 63.4341 2300.0 63.6837 2500.0 64.9522 2300.0 65.5679 2400.0 66.7686 2400.0 67.0415 38000.0 69.9475 2100.0 70.9446 2200.0 71.9291 13000.0 72.9369 3000.0 72.956 2500.0 73.6824 2700.0 73.945 2800.0 76.0167 2400.0 83.6613 2800.0 85.6754 2500.0 89.94 2600.0 90.9479 3200.0 91.9905 3100.0 92.2023 2300.0 94.0286 21000.0 94.1191 2400.0 99.8747 2500.0 99.9482 2900.0 107.2196 2400.0 111.9814 2200.0 113.6099 2700.0 113.9634 4000.0 119.0367 9500.0 126.2976 2900.0 126.3085 2400.0 128.9503 2600.0 132.9617 2800.0 138.9719 2900.0 139.5139 2300.0 140.9873 20000.0 146.9765 91000.0 147.139 2400.0 148.9758 3000.0 149.9636 10000.0 156.9805 2500.0 164.987 290000.0 167.9742 96000.0 173.5296 63000.0 175.9727 7400.0 180.8536 2400.0 182.4002 2600.0 182.9976 77000.0 183.3483 2500.0 185.985 7700.0 191.57 2500.0 192.982 47000.0 202.9673 32000.0 220.9584 7400.0 220.9771 1500000.0 224.908 2300.0 230.9722 3800.0 234.9285 7100.0 234.9563 450000.0 234.9833 8500.0 238.9875 450000.0 239.0305 2600.0 241.1121 2600.0 243.9701 4000.0 243.9935 23000.0 END IONS BEGIN IONS SCANS=168 PEPMASS=267.0767 CHARGE=1 COLLISION_ENERGY=0.0 47.057 2000.0 47.2496 2500.0 49.6003 2100.0 50.7872 2100.0 53.8435 2100.0 54.604 2300.0 58.0049 2300.0 59.8647 2200.0 62.2592 2300.0 62.4616 2300.0 65.7653 2400.0 79.911 2700.0 86.0964 9400.0 104.1736 2400.0 110.6914 2600.0 113.8588 2500.0 129.3498 2500.0 142.1858 2400.0 151.7939 2700.0 152.4113 2500.0 156.0798 3400.0 173.5225 13000.0 173.5409 18000.0 183.0914 16000.0 184.0756 13000.0 193.0762 57000.0 194.0597 5700.0 210.0788 3100.0 211.0868 60000.0 215.8958 11000.0 220.9764 2800.0 221.0713 31000.0 222.0554 4500.0 222.0792 11000.0 224.0582 3700.0 225.0656 8700.0 226.0297 12000.0 228.9857 22000.0 237.0666 6900.0 238.0742 35000.0 239.0816 150000.0 244.0152 2500.0 244.0403 30000.0 249.0657 18000.0 252.0531 7200.0 254.4692 2400.0 267.0766 57000.0 END IONS BEGIN IONS SCANS=169 PEPMASS=329.0774 CHARGE=1 COLLISION_ENERGY=0.0 53.2835 2300.0 54.6014 2600.0 55.7614 2400.0 57.5344 2400.0 61.134 2100.0 63.5822 2300.0 72.8346 2500.0 91.2609 2600.0 95.0492 2300.0 95.2324 2600.0 96.062 2200.0 105.6637 2200.0 120.0448 2300.0 124.0396 3100.0 125.0469 13000.0 138.0548 11000.0 139.0407 2700.0 148.0391 36000.0 149.0475 9600.0 149.0698 3400.0 149.6813 4700.0 149.6919 4700.0 150.0545 3100.0 154.0861 2700.0 161.0715 8300.0 162.0782 7500.0 163.0877 3300.0 164.0343 310000.0 165.0419 34000.0 166.0499 96000.0 170.1191 2500.0 172.8621 13000.0 173.5301 39000.0 173.5441 4900.0 174.0553 5900.0 176.0344 4800.0 176.0947 3400.0 176.7175 2700.0 180.8882 17000.0 181.0488 2300.0 190.8726 75000.0 197.8909 4300.0 200.0521 2600.0 201.8649 4100.0 202.871 2600.0 208.8601 4300.0 208.8831 500000.0 209.0697 5400.0 210.0558 2900.0 212.0711 2900.0 218.8675 36000.0 226.8939 170000.0 227.0824 11000.0 228.0653 8000.0 231.8989 2800.0 234.6297 2100.0 236.7122 2700.0 236.8782 160000.0 237.0662 69000.0 238.0496 13000.0 238.0742 9300.0 240.0656 14000.0 245.7179 2300.0 246.8625 22000.0 254.0688 3100.0 254.8887 43000.0 255.0764 61000.0 255.1083 3500.0 256.0604 130000.0 256.0888 3800.0 264.8728 54000.0 265.0608 85000.0 265.0926 3000.0 266.0449 12000.0 267.0784 3000.0 267.11 2500.0 268.061 14000.0 282.0648 5700.0 282.8842 8900.0 283.0718 77000.0 283.1084 8200.0 284.0552 34000.0 293.0558 63000.0 301.0807 6700.0 311.0663 35000.0 312.147 15000.0 317.7556 2600.0 329.0784 4600.0 329.1498 160000.0 END IONS BEGIN IONS SCANS=170 PEPMASS=589.1359 CHARGE=1 COLLISION_ENERGY=0.0 63.457 22000.0 63.4601 11000.0 63.5656 6700.0 63.6779 6500.0 63.6809 4400.0 65.4579 24000.0 65.4615 13000.0 65.8502 2300.0 75.3094 2300.0 82.1021 2400.0 85.3258 2700.0 140.7519 2500.0 147.8905 2600.0 162.0542 4300.0 173.2854 3600.0 173.5229 21000.0 173.5384 40000.0 232.6655 4200.0 282.5862 2700.0 283.069 4000.0 293.0549 13000.0 295.0705 5400.0 307.0706 13000.0 354.4048 2400.0 394.0832 6000.0 396.0962 5100.0 412.0922 29000.0 413.0787 11000.0 422.0825 7200.0 423.0878 4300.0 424.0974 5600.0 428.084 6900.0 436.0928 29000.0 439.0787 7100.0 440.015 7200.0 440.0872 450000.0 440.1579 3700.0 441.0952 68000.0 446.0729 4500.0 452.0887 18000.0 454.1048 4700.0 454.9034 4600.0 464.0871 1000000.0 465.0945 18000.0 467.11 7400.0 470.1117 9900.0 478.1022 4700.0 488.1243 6500.0 491.1094 12000.0 492.1138 7900.0 497.122 15000.0 498.1085 40000.0 502.0967 4900.0 503.1085 4200.0 506.0969 11000.0 515.1212 22000.0 516.117 31000.0 517.1175 8300.0 518.1042 9000.0 519.126 6000.0 525.1158 54000.0 526.1044 96000.0 527.1109 16000.0 530.0984 11000.0 533.143 27000.0 535.1055 6600.0 542.1183 5500.0 543.1289 610000.0 544.1142 120000.0 545.1331 5200.0 546.1141 5500.0 553.1137 78000.0 554.106 140000.0 555.107 21000.0 559.124 95000.0 560.115 13000.0 561.1383 73000.0 570.1149 8900.0 571.1244 790000.0 572.1184 350000.0 573.1165 300000.0 588.1275 16000.0 589.1345 1100000.0 END IONS BEGIN IONS SCANS=171 PEPMASS=442.104 CHARGE=1 COLLISION_ENERGY=0.0 57.4803 2300.0 59.0163 2100.0 70.7642 2500.0 70.7685 2400.0 73.2618 2600.0 73.2656 4100.0 74.3466 2100.0 75.1951 2400.0 76.7562 2300.0 82.0822 2200.0 105.8015 2100.0 112.0199 2400.0 123.1492 2400.0 132.0442 12000.0 135.9131 2500.0 148.0387 8300.0 149.047 5500.0 149.671 3100.0 149.6917 4500.0 150.0547 29000.0 173.5245 15000.0 173.5414 13000.0 229.3094 2100.0 233.8645 2300.0 237.0656 34000.0 238.0752 3700.0 247.0497 2400.0 265.0605 180000.0 266.0683 11000.0 267.0791 3100.0 268.0616 5000.0 275.0442 8600.0 288.9393 2300.0 292.9784 10000.0 293.0555 2400000.0 293.1172 5500.0 293.133 9900.0 294.0625 11000.0 295.072 27000.0 299.825 2300.0 307.0705 4300.0 323.0624 2400.0 335.0649 8500.0 340.1075 6400.0 350.0899 3100.0 358.1182 7900.0 368.1021 37000.0 369.0876 11000.0 378.0852 7300.0 385.1011 4700.0 386.1133 75000.0 395.0901 4000.0 396.0368 4200.0 396.0976 160000.0 397.085 35000.0 398.0914 13000.0 399.0787 2800.0 406.0821 14000.0 407.0902 16000.0 408.0966 2700.0 413.0984 8800.0 414.1081 310000.0 415.0871 2700.0 424.0926 140000.0 425.0067 3500.0 425.0261 3300.0 425.0991 220000.0 426.0842 65000.0 427.0818 3400.0 441.0949 9600.0 442.1029 790000.0 442.177 3200.0 END IONS BEGIN IONS SCANS=172 PEPMASS=297.0875 CHARGE=1 COLLISION_ENERGY=0.0 53.2907 2400.0 54.876 2500.0 65.0385 4400.0 74.269 2400.0 79.0539 2300.0 92.0492 9800.0 105.0331 13000.0 120.0441 370000.0 132.044 25000.0 134.0601 4700.0 136.0393 5600.0 147.9958 3200.0 148.0113 13000.0 148.0389 3500000.0 148.0504 17000.0 148.0606 11000.0 148.0646 37000.0 148.0749 8000.0 149.0468 600000.0 149.0581 3500.0 150.0546 86000.0 162.0544 11000.0 164.034 21000.0 173.5346 39000.0 187.0501 14000.0 194.944 2900.0 195.0915 8900.0 196.0755 3200.0 199.0628 8000.0 202.051 2500.0 205.0763 8400.0 206.0596 4500.0 217.8917 6900.0 220.9773 2900.0 222.0762 3200.0 223.0862 34000.0 224.0704 21000.0 227.9504 13000.0 232.9895 3300.0 233.0708 32000.0 234.0557 5200.0 237.9347 3600.0 240.0856 6500.0 241.0954 20000.0 250.0727 3200.0 251.0811 900000.0 252.0652 47000.0 255.9469 7900.0 261.0656 45000.0 262.074 18000.0 267.075 5200.0 268.0797 9900.0 269.0854 57000.0 270.076 290000.0 273.9563 21000.0 279.0763 830000.0 280.0528 4000.0 280.0844 93000.0 281.0685 37000.0 296.0789 76000.0 297.0078 3700.0 297.0864 1100000.0 END IONS BEGIN IONS SCANS=173 PEPMASS=313.0825 CHARGE=1 COLLISION_ENERGY=0.0 51.0369 2300.0 53.8954 2700.0 54.585 2200.0 57.0463 2200.0 80.0494 11000.0 80.07 2200.0 80.0899 2100.0 82.8822 2300.0 86.3019 2700.0 89.9692 2500.0 90.7609 2800.0 96.0446 2300.0 104.0494 19000.0 108.0441 8900.0 111.0914 2200.0 112.4247 2800.0 120.0443 34000.0 122.0236 30000.0 124.0391 10000.0 128.8527 2200.0 132.0443 170000.0 136.0392 120000.0 138.0548 7600.0 148.0392 210000.0 149.0471 100000.0 150.0386 8200.0 150.0548 500000.0 156.5001 2900.0 162.0552 33000.0 164.0017 11000.0 164.0085 7300.0 164.0224 9600.0 164.0342 3800000.0 164.0601 7800.0 164.0666 19000.0 164.0752 4400.0 165.0419 70000.0 166.0497 10000.0 172.962 2500.0 173.5249 16000.0 173.5314 47000.0 173.5439 10000.0 174.0554 3100.0 176.0342 5300.0 179.2009 2400.0 184.076 9300.0 186.0543 2600.0 193.0762 6400.0 194.0602 13000.0 196.0754 18000.0 200.0691 3100.0 202.0501 18000.0 211.0867 54000.0 212.0708 50000.0 221.0709 58000.0 222.0553 63000.0 222.0782 13000.0 223.0631 32000.0 223.0859 12000.0 224.0707 69000.0 225.0662 3000.0 229.097 27000.0 231.8763 2500.0 237.0673 3700.0 238.0734 47000.0 239.06 3600.0 239.0815 320000.0 239.1094 4400.0 239.1895 2200.0 240.0653 130000.0 240.0897 29000.0 241.0974 32000.0 243.8757 2300.0 249.0659 200000.0 250.0498 69000.0 250.0734 2500.0 251.0569 12000.0 251.0828 7700.0 252.0654 55000.0 253.0604 3100.0 257.0918 56000.0 262.0038 8600.0 266.0682 32000.0 267.0763 740000.0 268.0603 260000.0 268.0854 3200.0 269.0679 51000.0 270.0635 2400.0 271.9867 19000.0 274.206 2500.0 275.8904 2700.0 277.061 320000.0 278.04 8700.0 278.0691 63000.0 280.8533 2500.0 283.0713 8400.0 284.0785 16000.0 285.0871 550000.0 293.0569 2700.0 294.063 12000.0 295.0715 330000.0 296.0538 11000.0 313.0811 110000.0 END IONS BEGIN IONS SCANS=174 PEPMASS=259.988 CHARGE=1 COLLISION_ENERGY=0.0 45.2152 2300.0 47.6315 2200.0 48.6712 2000.0 50.8257 3200.0 53.5839 2000.0 53.8192 2000.0 55.5576 2000.0 55.9341 27000.0 56.4222 2500.0 56.7825 2300.0 57.0578 2100.0 58.1221 2400.0 58.3336 2100.0 60.2289 2800.0 62.0749 2300.0 62.2261 3000.0 66.4587 2500.0 69.0698 2700.0 79.3958 2200.0 81.5981 2200.0 81.6495 2100.0 85.4647 2300.0 92.3983 2800.0 95.668 2100.0 103.3598 2100.0 109.8869 2400.0 110.105 2600.0 110.8915 2500.0 112.0752 2600.0 119.8712 2400.0 124.64 2400.0 125.553 2400.0 129.7665 2700.0 131.0493 3000.0 135.614 2200.0 138.1881 2800.0 144.1554 2700.0 145.0284 19000.0 148.0391 3000.0 153.825 2300.0 161.907 2300.0 162.9715 3400.0 163.0387 8600.0 173.531 50000.0 173.5394 7600.0 175.0392 57000.0 180.9818 11000.0 187.6966 2300.0 190.8732 2800.0 190.9652 3100.0 196.968 3000.0 207.9695 31000.0 208.8842 8000.0 208.9771 140000.0 218.9602 2600.0 218.9814 3700.0 222.9565 84000.0 222.9771 3200.0 226.9874 16000.0 229.478 2500.0 231.9894 2600.0 235.9638 13000.0 236.9716 400000.0 236.9996 3500.0 244.9804 4100.0 250.9512 170000.0 254.982 93000.0 255.0087 3500.0 260.1284 3700.0 END IONS BEGIN IONS SCANS=175 PEPMASS=311.0669 CHARGE=1 COLLISION_ENERGY=0.0 49.4745 2400.0 50.6025 2100.0 54.4188 2300.0 56.6849 2300.0 58.1245 2300.0 60.1313 2500.0 60.959 2100.0 64.3304 2500.0 65.5853 3000.0 71.6217 2300.0 73.3059 2700.0 74.154 2200.0 74.8484 2600.0 75.6579 2300.0 75.8553 2700.0 76.2613 2300.0 79.5012 2600.0 82.0535 2900.0 86.1777 2600.0 91.0538 20000.0 91.116 2400.0 91.2359 2700.0 93.7194 2400.0 96.0441 8100.0 98.847 2600.0 100.2042 2100.0 102.8224 2400.0 110.8191 2600.0 114.0214 2300.0 114.7684 2300.0 117.0831 2800.0 121.2278 2900.0 121.4258 2600.0 125.2859 2400.0 131.837 2500.0 136.8033 2300.0 146.0267 11000.0 147.0291 4000.0 148.039 41000.0 149.0471 6200.0 149.6646 5800.0 149.6862 13000.0 149.6935 3900.0 155.7438 2500.0 156.3903 2600.0 156.822 2600.0 164.5408 2300.0 170.7159 2300.0 171.3499 2200.0 173.5218 17000.0 173.5349 84000.0 175.6819 2500.0 176.9773 2600.0 179.9891 2400.0 182.3404 2600.0 199.0872 3800.0 209.071 52000.0 210.0551 30000.0 212.0695 6100.0 213.0669 3000.0 227.0814 76000.0 231.177 2200.0 237.0659 290000.0 238.0496 92000.0 238.0735 8400.0 239.0564 3300.0 240.0647 13000.0 241.0604 20000.0 243.3523 2400.0 247.0497 17000.0 254.0683 16000.0 255.0761 180000.0 265.0605 500000.0 265.086 2500.0 266.0449 38000.0 266.0728 2600.0 267.0525 52000.0 267.9745 2600.0 268.0605 19000.0 269.0561 18000.0 273.6149 2800.0 275.0445 14000.0 276.0536 3000.0 282.0643 27000.0 283.0379 4600.0 283.0714 270000.0 284.0567 3100.0 288.7283 2600.0 293.0557 170000.0 294.0657 6400.0 311.0662 470000.0 312.2047 2600.0 END IONS BEGIN IONS SCANS=176 PEPMASS=260.9958 CHARGE=1 COLLISION_ENERGY=0.0 56.1382 2400.0 72.9372 5300.0 90.9475 3300.0 103.1401 2500.0 132.0442 14000.0 136.0391 19000.0 148.0392 5600.0 148.0626 7100.0 149.6686 2700.0 149.6896 5200.0 151.9793 2900.0 152.9638 3300.0 155.9748 4100.0 163.9791 23000.0 164.0334 2600.0 166.9783 3300.0 168.9582 3700.0 170.0596 2700.0 171.0548 5800.0 173.5313 7100.0 173.9638 4300.0 176.0285 5400.0 179.9743 9500.0 181.9897 9300.0 182.9739 45000.0 183.9693 11000.0 187.0866 22000.0 191.9742 68000.0 192.0238 9800.0 194.0391 31000.0 195.9689 5100.0 200.9843 6800.0 207.9692 20000.0 208.953 15000.0 208.9741 3800.0 209.9848 210000.0 210.0341 30000.0 215.0814 75000.0 219.9692 46000.0 220.0185 7500.0 220.862 2800.0 220.9783 3200.0 223.9633 7900.0 225.9793 5700.0 227.9943 4500.0 236.9706 3300.0 237.9794 220000.0 238.0279 9700.0 247.9735 2600.0 251.9582 28000.0 255.9881 11000.0 END IONS BEGIN IONS SCANS=177 PEPMASS=295.0719 CHARGE=1 COLLISION_ENERGY=0.0 49.4126 2500.0 52.2099 2600.0 60.7256 2500.0 65.4934 2700.0 66.7671 2900.0 66.7695 9900.0 73.7699 2400.0 75.2093 2300.0 77.5564 2600.0 80.9108 2400.0 98.3531 2400.0 101.7468 3000.0 105.2208 2200.0 105.5145 2400.0 106.0495 2400.0 121.2927 2400.0 148.0392 15000.0 149.0466 8000.0 159.0097 2500.0 166.0647 2800.0 167.3279 2400.0 173.5347 63000.0 175.0382 3700.0 183.0914 22000.0 184.0754 11000.0 185.4618 2500.0 187.9002 2300.0 193.076 100000.0 194.0598 9100.0 197.0697 2700.0 198.056 6100.0 199.0625 13000.0 207.066 3800.0 211.0864 120000.0 212.0708 20000.0 215.8953 18000.0 216.7008 2100.0 221.0708 150000.0 222.055 25000.0 222.0781 17000.0 223.0855 4300.0 225.066 24000.0 226.0495 11000.0 227.0565 5700.0 229.9927 17000.0 230.9948 35000.0 238.0736 75000.0 239.0541 7600.0 239.0814 500000.0 240.0652 26000.0 244.9735 16000.0 249.0657 220000.0 250.0489 11000.0 250.0751 16000.0 253.061 7600.0 253.9305 11000.0 254.0242 4300.0 266.0687 13000.0 267.0083 8900.0 267.0243 6600.0 267.0763 3300000.0 267.1428 15000.0 268.0598 11000.0 271.5656 2400.0 272.0359 2300.0 272.065 2300.0 277.061 100000.0 278.0686 110000.0 294.0643 12000.0 295.0307 3600.0 295.0409 6200.0 295.0716 1800000.0 END IONS BEGIN IONS SCANS=178 PEPMASS=258.9802 CHARGE=1 COLLISION_ENERGY=0.0 50.6535 2100.0 52.2459 2600.0 52.4044 2600.0 55.6725 2500.0 55.9343 2900.0 59.2729 2100.0 60.4539 2300.0 63.869 2300.0 72.9367 3600.0 73.0602 2300.0 74.0331 2600.0 89.0181 2200.0 90.9473 3000.0 94.9003 2400.0 98.4902 2100.0 132.856 2700.0 136.9678 7700.0 151.9788 49000.0 154.9792 2800.0 164.0058 2200.0 170.5992 2800.0 173.527 10000.0 173.5329 26000.0 179.9736 10000.0 183.5189 2300.0 193.5318 2800.0 207.8754 4600.0 207.9691 21000.0 207.9894 23000.0 225.9793 5400.0 228.726 2600.0 235.9636 340000.0 235.986 8400.0 245.709 2800.0 253.9744 81000.0 END IONS BEGIN IONS SCANS=179 PEPMASS=307.0018 CHARGE=1 COLLISION_ENERGY=0.0 48.9343 2400.0 50.2707 2200.0 55.9343 13000.0 56.9422 5000.0 60.1329 2600.0 67.0175 2700.0 72.9372 13000.0 76.5002 2800.0 80.2201 2300.0 90.0107 2300.0 90.9476 16000.0 94.8822 2400.0 99.8131 3000.0 100.0838 2300.0 105.8619 2600.0 107.4852 2500.0 112.0546 2700.0 113.9634 6100.0 114.1784 2100.0 120.0076 4000.0 125.2953 2200.0 128.9629 3300.0 132.0426 2300.0 137.686 2500.0 138.0547 37000.0 140.0336 14000.0 148.039 100000.0 149.6886 4300.0 150.0546 3100.0 151.9791 21000.0 163.9791 6600.0 164.034 51000.0 165.0419 33000.0 166.0493 20000.0 167.9734 8000.0 173.5265 19000.0 173.5404 14000.0 175.9791 40000.0 177.9586 4700.0 179.9742 65000.0 181.9897 5900.0 182.015 2400.0 182.9742 4700.0 184.2664 3000.0 191.9743 54000.0 193.9895 12000.0 195.9691 68000.0 197.3075 2400.0 197.9847 35000.0 203.9741 30000.0 207.9691 120000.0 208.8845 6600.0 209.9501 4400.0 209.9849 360000.0 212.0009 5200.0 213.9799 22000.0 219.9692 380000.0 220.9773 19000.0 221.9848 1400000.0 223.9641 57000.0 225.9794 48000.0 227.8952 3200.0 227.9954 17000.0 234.0405 3000.0 235.9637 87000.0 236.9697 2700.0 237.9395 3400.0 237.9797 970000.0 238.9866 3600.0 239.9952 1200000.0 241.9744 29000.0 251.9587 150000.0 253.9742 43000.0 255.9901 590000.0 258.0013 2900.0 260.9472 2800.0 260.996 3300.0 263.0111 18000.0 265.9748 34000.0 269.9697 30000.0 273.9994 8100.0 279.0064 7700.0 283.9855 41000.0 301.5184 2800.0 305.7437 2700.0 END IONS BEGIN IONS SCANS=180 PEPMASS=265.9749 CHARGE=1 COLLISION_ENERGY=0.0 46.8109 2500.0 47.3872 2300.0 55.9342 3300.0 58.1402 2200.0 60.431 2400.0 65.1848 2100.0 68.7114 2500.0 73.5588 2400.0 79.0454 2100.0 84.4574 2900.0 85.8264 2600.0 110.3119 2600.0 113.5017 2400.0 113.7665 2500.0 122.9355 2600.0 141.9475 2500.0 148.6243 2500.0 149.6873 5800.0 161.7122 2100.0 163.1416 2700.0 173.5222 3400.0 173.5357 26000.0 175.9798 6600.0 177.0547 22000.0 178.058 45000.0 184.6347 3000.0 186.9011 14000.0 197.3179 2700.0 209.9845 4000.0 214.8956 44000.0 219.9687 8000.0 221.9812 14000.0 237.9787 12000.0 244.2488 2700.0 247.292 2300.0 264.071 2400.0 269.5096 2600.0 END IONS BEGIN IONS SCANS=181 PEPMASS=314.1393 CHARGE=1 COLLISION_ENERGY=0.0 48.0593 2600.0 48.7916 2400.0 48.9361 2200.0 52.7648 2200.0 53.2806 2400.0 53.5809 2300.0 55.5376 2400.0 58.0652 6600.0 63.6761 2400.0 64.3517 2400.0 74.5244 2800.0 74.7766 4300.0 74.7808 7000.0 76.1561 2600.0 77.7027 2200.0 78.5323 4900.0 78.5354 13000.0 90.5078 2100.0 91.0541 2900.0 93.9821 2400.0 95.0491 6500.0 102.1065 2500.0 105.0699 14000.0 107.0489 3200.0 109.0647 11000.0 118.4219 2400.0 131.0494 9300.0 133.0647 8900.0 136.0521 7700.0 137.0596 75000.0 138.0549 26000.0 139.3475 2300.0 140.0707 2800.0 143.0491 4100.0 145.0647 3100.0 146.0603 6600.0 150.0545 9000.0 150.0674 14000.0 151.0753 710000.0 151.0881 9300.0 152.0705 210000.0 160.0525 2400.0 162.0551 60000.0 163.0624 30000.0 163.0759 11000.0 164.0342 57000.0 164.0706 28000.0 165.0377 55000.0 165.091 150000.0 168.8068 2500.0 173.5274 9100.0 173.5354 23000.0 175.0753 33000.0 176.0706 55000.0 178.0864 3100.0 190.0858 7300.0 195.0811 2500.0 223.4086 2700.0 236.1073 23000.0 238.087 3200.0 243.1256 2600.0 244.9908 2600.0 253.0736 7100.0 254.1178 14000.0 256.096 8100.0 263.002 3800.0 264.1022 34000.0 267.0869 2600.0 268.0799 15000.0 268.1331 76000.0 269.0636 3000.0 270.0764 20000.0 270.6395 2500.0 271.086 3800.0 272.9874 11000.0 273.1117 13000.0 280.0958 4500.0 281.1046 20000.0 282.1127 54000.0 283.0849 13000.0 283.1195 6300.0 284.0918 110000.0 285.0994 100000.0 286.0885 7700.0 286.1076 3500.0 296.0746 3900.0 296.0929 4000.0 296.1284 110000.0 298.0793 6600.0 298.1076 1900000.0 298.1864 6400.0 298.2095 3300.0 299.0355 11000.0 299.0508 7200.0 299.1152 3500000.0 299.1784 7600.0 299.1947 23000.0 299.2172 4100.0 314.0515 9200.0 314.1386 4100000.0 314.205 11000.0 314.2251 24000.0 END IONS BEGIN IONS SCANS=182 PEPMASS=342.1762 CHARGE=1 COLLISION_ENERGY=0.0 50.5844 2300.0 57.0332 57000.0 59.049 10000.0 61.0281 16000.0 64.2098 2600.0 67.237 2300.0 68.5091 2600.0 69.0332 20000.0 69.2644 2300.0 71.0489 13000.0 71.0852 61000.0 73.0281 6600.0 78.5426 2700.0 79.054 12000.0 81.0333 3100.0 81.0695 80000.0 83.0488 2800.0 85.028 120000.0 85.0646 16000.0 88.5544 2300.0 91.0387 2900.0 97.0281 32000.0 97.0341 2700.0 99.0442 2700.0 99.0733 4300.0 99.0801 310000.0 107.1106 2700.0 108.503 2500.0 109.028 2900.0 109.0644 190000.0 117.0811 5300.0 117.0906 760000.0 117.0991 17000.0 119.0486 8300.0 120.2056 2300.0 121.4191 2300.0 127.0387 21000.0 127.075 510000.0 127.0873 8400.0 138.0569 2200.0 145.0492 2400.0 147.0437 69000.0 173.5208 5400.0 173.537 39000.0 195.0875 2700.0 195.1104 2400.0 195.597 2400.0 196.0968 16000.0 226.6119 2400.0 227.2518 2800.0 231.1171 2800.0 256.5139 2900.0 271.8047 2400.0 END IONS BEGIN IONS SCANS=183 PEPMASS=476.2283 CHARGE=1 COLLISION_ENERGY=0.0 58.0649 140000.0 69.0335 3800.0 71.5452 2400.0 72.4267 2300.0 73.1909 2200.0 81.6172 2300.0 81.7027 2200.0 85.028 8700.0 89.4805 2400.0 89.5442 2200.0 107.0487 140000.0 114.4211 2300.0 121.0645 27000.0 127.0386 3800.0 137.0594 39000.0 140.9826 2200.0 143.0488 43000.0 145.0283 2900.0 145.0644 24000.0 147.0802 10000.0 151.0751 3300.0 157.509 2500.0 163.0745 2900.0 167.018 2200.0 173.5242 9000.0 173.5335 31000.0 173.5427 3900.0 175.0752 25000.0 179.929 2500.0 194.1189 2500.0 211.1114 6300.0 219.2159 2400.0 237.0909 26000.0 239.1056 11000.0 269.117 180000.0 271.1325 53000.0 314.1749 420000.0 314.2069 2500.0 414.6381 2800.0 454.7393 2300.0 476.227 560000.0 476.3406 3500.0 END IONS BEGIN IONS SCANS=184 PEPMASS=227.0918 CHARGE=1 COLLISION_ENERGY=0.0 43.0176 30000.0 45.0333 92000.0 45.0567 2400.0 46.8447 2500.0 49.4304 2200.0 49.8644 2300.0 51.6401 2100.0 52.5592 2600.0 54.4516 2200.0 55.0176 37000.0 56.488 2400.0 60.9114 2200.0 65.0383 23000.0 67.054 12000.0 67.2086 2400.0 69.0697 2400.0 70.8165 2100.0 72.9369 2200.0 73.0243 3900.0 73.0279 130000.0 73.0419 2600.0 75.5859 2100.0 79.0539 6500.0 81.1363 2300.0 81.1842 2200.0 82.0412 4200.0 85.0281 12000.0 90.9473 3500.0 91.0539 4200.0 92.0528 3300.0 95.0488 35000.0 97.0646 8500.0 100.1113 6300.0 100.7244 2600.0 107.0491 2400.0 110.036 13000.0 111.0439 6900.0 113.9634 8100.0 121.0645 14000.0 123.0438 27000.0 125.023 7900.0 125.0593 8600.0 126.5868 2700.0 127.8661 2600.0 138.0305 3400.0 139.982 6400.0 140.0341 4000.0 140.0465 240000.0 142.0264 3000.0 149.0592 2500.0 153.0542 25000.0 155.0696 24000.0 157.9927 21000.0 165.0541 4200.0 167.07 4200.0 167.9774 3100.0 171.0653 67000.0 173.5262 31000.0 173.5426 12000.0 179.0702 17000.0 180.8807 3500.0 181.0495 490000.0 181.0663 2500.0 181.0856 9900.0 185.928 3400.0 203.9397 4000.0 209.0793 2500.0 230.7062 2700.0 END IONS BEGIN IONS SCANS=185 PEPMASS=286.1442 CHARGE=1 COLLISION_ENERGY=0.0 49.3771 2100.0 54.3126 2300.0 56.62 2600.0 57.7286 2500.0 58.065 2700.0 60.3168 2400.0 67.1082 2400.0 67.3846 2200.0 76.8553 2600.0 82.4014 2600.0 85.5691 2300.0 86.7131 2400.0 91.054 8500.0 95.049 6300.0 104.2238 2200.0 105.0695 2300.0 107.032 3700.0 107.0406 3900.0 107.0487 1200000.0 107.0573 13000.0 108.0302 2500.0 108.1302 2200.0 115.0538 60000.0 117.0695 8400.0 119.0488 17000.0 121.0644 90000.0 123.0436 140000.0 131.0486 5300.0 133.0646 22000.0 135.0439 20000.0 137.0595 19000.0 140.8038 2800.0 143.0363 3700.0 143.0488 240000.0 145.0644 140000.0 147.0438 5200.0 147.0802 2400.0 149.0593 19000.0 151.075 8200.0 154.6457 2300.0 157.0642 2600.0 161.0593 230000.0 163.0751 15000.0 166.0863 11000.0 173.5227 23000.0 173.5322 15000.0 173.5397 45000.0 175.0761 5800.0 177.6405 2700.0 178.086 160000.0 179.5853 2500.0 183.0796 2500.0 191.0856 6800.0 192.1019 8300.0 194.0725 3900.0 201.0547 3100.0 203.8827 2800.0 204.8822 2700.0 209.0963 59000.0 216.8907 2800.0 219.0801 8500.0 226.0615 13000.0 227.0687 3800.0 227.1065 9500.0 235.1362 2500.0 237.0905 84000.0 237.484 2600.0 240.0779 15000.0 241.1515 2200.0 255.0697 3400.0 255.1014 340000.0 255.1319 3600.0 257.1182 6300.0 257.6361 2500.0 269.1169 3200.0 277.5266 2400.0 286.1098 8500.0 286.144 240000.0 286.1802 5100.0 END IONS BEGIN IONS SCANS=186 PEPMASS=314.1755 CHARGE=1 COLLISION_ENERGY=0.0 49.208 22000.0 51.6509 6200.0 52.6881 5500.0 53.1287 6000.0 55.0177 9100.0 56.0494 220000.0 58.0652 79000000.0 58.071 230000.0 58.0719 200000.0 58.0744 530000.0 58.0757 40000.0 58.7007 18000.0 60.781 3700.0 61.1798 5200.0 63.5112 18000.0 63.7723 8000.0 65.3444 7500.0 65.6133 7300.0 67.6784 5100.0 68.4974 12000.0 69.9181 19000.0 71.0728 47000.0 72.0807 130000.0 72.8228 9200.0 73.458 12000.0 73.8288 6500.0 78.6842 8000.0 79.0543 8300.0 84.9787 3900.0 86.4787 16000.0 91.0542 220000.0 93.0698 67000.0 95.049 290000.0 95.3983 11000.0 99.1743 12000.0 99.5485 5100.0 103.0545 19000.0 105.1202 7200.0 106.9072 7000.0 107.0319 69000.0 107.0491 26000000.0 107.066 160000.0 109.0647 58000.0 109.8283 19000.0 114.2881 7700.0 115.0542 440000.0 117.0698 290000.0 119.049 520000.0 119.0855 76000.0 121.0646 3100000.0 121.0738 20000.0 124.1503 13000.0 125.0596 120000.0 128.6977 9000.0 129.0703 7700.0 131.0491 430000.0 133.0646 190000.0 133.1078 4200.0 135.0807 16000.0 137.0596 3400000.0 137.0695 38000.0 143.0361 54000.0 143.049 2700000.0 143.0613 32000.0 144.0572 76000.0 145.0514 49000.0 145.0646 3500000.0 145.0748 43000.0 147.0444 42000.0 147.0676 20000.0 147.0802 1700000.0 148.0561 6000.0 149.0595 470000.0 149.0961 110000.0 149.3551 5000.0 151.0617 7800.0 151.0752 2200000.0 151.0891 24000.0 152.0159 21000.0 153.0908 32000.0 155.06 41000.0 157.0647 59000.0 160.0517 440000.0 160.0751 19000.0 161.06 73000.0 162.0675 250000.0 163.0611 20000.0 163.0753 1200000.0 165.0698 39000.0 165.0912 120000.0 173.5102 22000.0 173.5243 240000.0 173.5394 390000.0 175.0576 44000.0 175.0753 7400000.0 175.1011 42000.0 176.0838 130000.0 176.107 140000.0 176.7823 8100.0 177.091 600000.0 178.0861 10000.0 181.0647 170000.0 181.1013 210000.0 183.0804 190000.0 188.4375 5800.0 189.8318 6700.0 191.0856 270000.0 191.7231 4200.0 192.0836 13000.0 192.1018 1400000.0 193.1094 740000.0 194.0727 240000.0 194.1175 540000.0 195.0805 120000.0 196.0871 9700.0 197.0605 63000.0 197.0962 72000.0 200.0739 8100.0 207.1252 270000.0 208.134 12000.0 209.0619 50000.0 209.096 3000000.0 210.068 81000.0 211.0752 330000.0 211.1117 1500000.0 211.1347 9000.0 212.0837 94000.0 213.0909 84000.0 219.0806 450000.0 220.0882 15000.0 221.0963 200000.0 223.0748 16000.0 224.0826 8200.0 225.1271 58000.0 237.0908 5200000.0 237.1131 24000.0 238.0987 160000.0 239.1065 1600000.0 240.0783 160000.0 241.0855 120000.0 241.1217 91000.0 242.094 200000.0 246.9994 8100.0 247.3427 7700.0 249.4624 9100.0 251.1067 68000.0 253.1221 120000.0 254.0935 630000.0 256.109 110000.0 262.8536 8600.0 267.1007 18000.0 269.1169 9100000.0 269.1441 13000.0 271.1326 2700000.0 282.1488 420000.0 295.7681 20000.0 299.1158 45000.0 299.1516 170000.0 314.09 18000.0 314.1748 12000000.0 314.2074 120000.0 END IONS BEGIN IONS SCANS=187 PEPMASS=463.0843 CHARGE=1 COLLISION_ENERGY=0.0 58.2436 2600.0 58.3518 2500.0 61.9142 2300.0 63.1569 2400.0 71.737 2200.0 76.5545 2000.0 77.4715 2400.0 79.7907 2100.0 82.897 3000.0 84.557 2400.0 86.022 2700.0 97.495 2300.0 101.0198 2400.0 102.1988 2100.0 105.5533 2700.0 107.0489 160000.0 115.3991 2500.0 135.6958 2900.0 137.0595 36000.0 139.1784 2500.0 143.049 11000.0 145.0645 24000.0 151.0618 4100.0 151.0752 130000.0 163.0752 11000.0 173.5215 8400.0 173.5359 47000.0 175.0752 66000.0 177.0544 14000.0 178.086 2900.0 187.0061 26000.0 199.423 2200.0 209.0963 13000.0 237.0909 71000.0 249.7388 2600.0 269.1171 990000.0 286.1439 600000.0 292.0454 2800.0 317.049 19000.0 337.0768 3400.0 349.0739 370000.0 354.6861 2400.0 365.6221 2400.0 366.1004 760000.0 END IONS BEGIN IONS SCANS=188 PEPMASS=579.1504 CHARGE=1 COLLISION_ENERGY=0.0 64.069 2200.0 67.9748 3400.0 68.9972 36000.0 74.5896 4400.0 77.76 4700.0 80.4093 3200.0 81.0334 38000.0 91.8649 3100.0 93.0326 2900.0 94.7594 3400.0 95.049 20000.0 95.0661 3600.0 97.5877 3300.0 99.0433 5000.0 104.5003 3400.0 107.049 14000.0 109.0282 39000.0 110.9796 3000.0 111.0075 65000.0 111.044 44000.0 112.9825 3900.0 119.0491 12000.0 119.197 4300.0 119.7994 4700.0 123.0439 2000000.0 123.0525 18000.0 127.0388 6200000.0 127.047 63000.0 131.0486 3600.0 135.0439 750000.0 135.0559 31000.0 137.0231 58000.0 138.4362 2300.0 139.0388 3600000.0 141.8822 2300.0 147.0439 240000.0 147.3388 3700.0 149.0232 85000.0 149.0597 4900.0 151.0388 490000.0 155.0342 4200.0 159.0439 66000.0 161.0596 140000.0 163.0388 2500000.0 163.052 22000.0 163.0718 3700.0 165.0545 430000.0 167.0338 410000.0 167.05 5600.0 169.0493 47000.0 173.0598 34000.0 173.2678 2500.0 173.5293 140000.0 173.5346 33000.0 173.545 21000.0 175.039 31000.0 176.3088 3300.0 177.0546 86000.0 179.0337 190000.0 179.0702 2800.0 179.8385 5200.0 181.0495 55000.0 185.0598 7700.0 187.0389 280000.0 189.0548 34000.0 191.0338 290000.0 193.0496 41000.0 197.0591 42000.0 201.0546 170000.0 203.0339 180000.0 203.0701 130000.0 205.0495 240000.0 205.0852 2800.0 207.0652 120000.0 213.0549 9700.0 215.0337 17000.0 215.0702 90000.0 217.0492 32000.0 219.0649 8500.0 221.0445 6800.0 225.0546 59000.0 227.0683 4900.0 229.0244 4400.0 229.0495 320000.0 231.0651 68000.0 233.0443 750000.0 241.0493 56000.0 243.0648 460000.0 245.0442 390000.0 247.0302 5100.0 247.0597 1200000.0 247.0819 4100.0 247.0902 15000.0 249.0754 30000.0 251.0546 230000.0 253.0492 70000.0 255.065 88000.0 257.044 760000.0 257.0761 6900.0 258.0515 13000.0 259.0283 11000.0 259.0596 770000.0 259.0846 7400.0 261.0747 70000.0 265.0488 7100.0 269.0444 270000.0 271.025 16000.0 271.0345 4500.0 271.06 1600000.0 273.0756 160000.0 274.886 2500.0 275.0201 39000.0 275.0299 4600.0 275.0549 1400000.0 275.0898 34000.0 283.024 17000.0 283.06 800000.0 283.0964 9400.0 285.0421 6800.0 285.0759 49000.0 287.0265 8300.0 287.055 3000000.0 289.0707 150000.0 291.0863 180000.0 295.0587 13000.0 297.075 24000.0 299.055 520000.0 299.0936 6500.0 299.2197 2500.0 301.0705 350000.0 303.0864 75000.0 311.0549 80000.0 325.07 53000.0 341.1029 9700.0 343.0807 3100.0 367.081 43000.0 379.08 38000.0 391.0801 81000.0 409.0912 950000.0 411.1068 130000.0 421.094 25000.0 427.1003 7800.0 433.1005 2600.0 435.1052 31000.0 490.9424 5200.0 520.234 3300.0 END IONS BEGIN IONS SCANS=189 PEPMASS=298.1442 CHARGE=1 COLLISION_ENERGY=0.0 47.4435 2600.0 47.773 78000.0 47.7747 8600.0 47.9493 3400.0 48.0251 21000.0 48.0264 4600.0 48.0803 2300.0 51.4611 2500.0 51.5625 3700.0 52.2511 2100.0 53.7113 4100.0 56.0495 15000.0 58.0651 2100000.0 61.1351 2200.0 62.8938 2700.0 63.5368 2300.0 63.6242 2400.0 70.8794 2700.0 71.0728 23000.0 74.4666 3600.0 77.1997 4500.0 77.5542 2400.0 77.7269 3500.0 79.0543 20000.0 79.3579 2000.0 84.0439 2400.0 86.9749 2400.0 90.7011 2200.0 91.0542 31000.0 93.0697 94000.0 95.0325 2400.0 95.049 36000.0 95.6126 2300.0 102.0464 7200.0 103.0541 45000.0 103.1627 2800.0 105.045 4100.0 107.0362 7600.0 107.049 5500000.0 107.0576 3100.0 107.0641 55000.0 115.0541 49000.0 117.0698 5600.0 118.0414 28000.0 119.0487 5000.0 120.0809 4700.0 121.0279 4200.0 121.0646 1100000.0 121.0739 8200.0 123.0439 150000.0 125.3087 2200.0 131.049 23000.0 132.0805 21000.0 133.0646 4800.0 135.0448 21000.0 135.1032 3800.0 140.3013 4500.0 141.8761 2500.0 143.049 230000.0 145.0646 100000.0 145.0885 91000.0 146.0222 4100.0 146.0361 1200000.0 146.0494 3800.0 146.0963 500000.0 146.1083 4000.0 147.044 93000.0 148.052 42000.0 148.0759 9000.0 149.0596 98000.0 150.0913 97000.0 151.0748 21000.0 154.5531 3300.0 158.0964 62000.0 158.9786 3900.0 159.044 4000.0 159.0672 4700.0 159.3471 2800.0 159.8066 2500.0 160.0756 63000.0 161.0596 180000.0 162.0914 31000.0 163.0754 56000.0 163.099 35000.0 164.1071 58000.0 170.5391 2500.0 170.8956 2400.0 173.0594 29000.0 173.0837 150000.0 173.5232 58000.0 173.5356 110000.0 173.5432 30000.0 174.0775 2900.0 174.0914 870000.0 174.1051 3400.0 175.0992 24000.0 176.0708 1200000.0 176.0845 5300.0 176.1069 9500.0 177.0608 3800.0 177.0785 1500000.0 177.0919 5700.0 178.0862 380000.0 179.0859 28000.0 181.0653 4900.0 182.4985 3100.0 182.7744 2300.0 183.3216 2700.0 185.0709 6500.0 186.0436 2800.0 186.0912 76000.0 188.0704 17000.0 189.0782 120000.0 189.9556 4100.0 190.0863 500000.0 190.8955 3300.0 191.0188 6500.0 191.0416 16000.0 191.0532 150000.0 191.0616 70000.0 191.0941 23000000.0 191.1265 130000.0 191.1345 170000.0 191.1461 49000.0 191.1576 30000.0 192.0606 24000.0 192.1019 7700000.0 192.1224 8500.0 192.1424 14000.0 194.9701 3600.0 195.9587 3500.0 197.0963 20000.0 199.076 22000.0 202.0862 39000.0 204.102 210000.0 207.0576 9600.0 207.0807 610000.0 208.2188 2600.0 209.0607 4000.0 209.0965 9700.0 210.0676 4000.0 213.0663 11000.0 218.8884 23000.0 221.096 10000.0 225.0269 4300.0 225.0909 76000.0 227.0703 4600.0 234.4553 2600.0 235.0484 21000.0 235.0754 680000.0 235.1004 4500.0 236.0832 4100.0 236.9021 3000.0 237.091 15000.0 243.3736 3700.0 246.8859 10000.0 251.0813 3300.0 251.8541 3900.0 252.1386 27000.0 253.0859 410000.0 255.1017 84000.0 265.1097 14000.0 280.1333 87000.0 282.112 17000.0 283.1201 54000.0 296.1284 110000.0 296.9865 2300.0 298.1441 470000.0 END IONS BEGIN IONS SCANS=190 PEPMASS=272.1283 CHARGE=1 COLLISION_ENERGY=0.0 51.6276 2200.0 52.1304 2100.0 53.137 2100.0 55.0178 5400.0 59.1029 2200.0 63.6707 2500.0 77.0385 3000.0 79.0542 14000.0 86.7522 2900.0 91.0542 21000.0 95.049 20000.0 97.317 2300.0 103.0545 6800.0 104.7614 2100.0 105.0444 3100.0 105.0698 18000.0 107.0319 6000.0 107.049 2800000.0 107.0658 12000.0 115.0451 3700.0 115.0541 170000.0 115.9801 2300.0 117.0697 16000.0 119.049 35000.0 121.0283 20000.0 121.0646 87000.0 123.0335 4500.0 123.0439 260000.0 127.0538 3100.0 130.4469 2400.0 131.0491 28000.0 133.0647 49000.0 133.8714 2400.0 134.2493 2400.0 135.044 52000.0 136.0752 4700.0 137.0594 24000.0 143.0361 4200.0 143.049 490000.0 143.0606 4400.0 144.2052 2300.0 145.0518 2900.0 145.0646 270000.0 147.0441 8700.0 148.6515 2300.0 149.0595 29000.0 155.0602 2400.0 161.044 8500.0 161.0596 460000.0 161.0754 13000.0 162.0672 7100.0 164.0706 160000.0 166.079 2600.0 171.082 2900.0 173.5186 8400.0 173.534 78000.0 178.086 9300.0 181.0643 14000.0 181.1012 25000.0 191.0853 39000.0 194.0724 33000.0 195.0808 7300.0 199.0747 6000.0 203.883 26000.0 205.8987 3300.0 209.0607 7900.0 209.0961 160000.0 216.8911 3500.0 219.0804 33000.0 220.0887 2600.0 222.0671 2600.0 226.0623 34000.0 227.07 2700.0 227.107 16000.0 237.0909 170000.0 240.0779 35000.0 255.07 5600.0 255.1013 490000.0 255.1324 10000.0 272.1278 55000.0 END IONS BEGIN IONS SCANS=191 PEPMASS=344.1861 CHARGE=1 COLLISION_ENERGY=0.0 50.4313 2400.0 50.9239 2300.0 54.2824 2400.0 58.0651 960000.0 58.068 6400.0 58.1151 2300.0 59.7034 2500.0 85.8804 2400.0 86.4003 2400.0 88.6502 2200.0 89.0593 170000.0 91.0535 2800.0 123.0336 4500.0 123.0437 250000.0 125.0795 2700.0 133.0857 41000.0 136.0518 2600.0 136.9394 2600.0 137.0594 58000.0 140.4634 2300.0 143.049 15000.0 149.0585 3000.0 151.0752 54000.0 158.0728 11000.0 161.0596 40000.0 163.0751 33000.0 164.0832 2700.0 165.0907 29000.0 173.5298 48000.0 173.5422 6300.0 174.0673 27000.0 174.6175 2400.0 175.0759 6800.0 177.091 15000.0 189.0909 200000.0 190.0988 4200.0 190.123 4800.0 191.1062 2700.0 206.1174 27000.0 207.1253 21000.0 208.1336 5800.0 241.1185 2500.0 251.1058 2500.0 268.1091 29000.0 281.1165 2700.0 284.1047 28000.0 286.1205 3800.0 289.1201 2600.0 299.128 120000.0 301.1435 24000.0 329.1635 3300.0 344.1855 180000.0 END IONS BEGIN IONS SCANS=192 PEPMASS=279.1708 CHARGE=1 COLLISION_ENERGY=0.0 49.7305 2600.0 64.9107 2200.0 72.6184 2500.0 74.7688 2300.0 86.0963 34000.0 89.0384 11000.0 94.2644 2300.0 103.1233 8300.0 117.0334 62000.0 118.3118 2300.0 120.9509 2300.0 134.0369 2500.0 145.0282 600000.0 149.0231 9000.0 149.0594 34000.0 163.0389 4400.0 172.6423 2600.0 173.0508 5200.0 173.5335 24000.0 177.0546 1000000.0 186.0551 2800.0 201.0465 31000.0 219.057 220000.0 219.0817 3500.0 279.0932 160000.0 END IONS BEGIN IONS SCANS=193 PEPMASS=285.1239 CHARGE=1 COLLISION_ENERGY=0.0 49.8395 2400.0 50.7039 2300.0 52.1777 2100.0 67.6796 2400.0 91.0542 51000.0 95.0493 4300.0 99.9891 2600.0 107.0492 4300.0 111.3175 2400.0 118.0651 17000.0 119.0491 68000.0 120.0445 2500.0 123.044 1100000.0 123.0527 3200.0 123.0547 6200.0 123.0652 6800.0 129.5985 2700.0 130.0653 5500.0 133.0519 3700.0 136.9816 2800.0 137.0596 14000.0 146.06 970000.0 146.0738 3300.0 148.0392 54000.0 149.0471 75000.0 158.0601 8800.0 159.0675 2300.0 170.381 2300.0 173.5329 23000.0 180.0805 2500.0 185.6814 2700.0 194.0965 32000.0 195.082 3300.0 198.0914 25000.0 201.3662 2500.0 203.8832 17000.0 204.0809 6600.0 205.8986 4100.0 206.8524 2600.0 207.0683 15000.0 212.1071 12000.0 220.9784 2900.0 221.0825 4500.0 221.895 2900.0 222.0655 3500.0 222.0917 200000.0 222.117 4800.0 224.2107 2700.0 225.079 16000.0 226.214 2400.0 232.0745 3900.0 233.0834 22000.0 235.0618 4400.0 236.0694 3300.0 238.0878 3400.0 240.1021 130000.0 249.0782 5700.0 250.0863 460000.0 250.1158 4400.0 251.0942 4700.0 252.0663 3300.0 253.0732 10000.0 256.0958 5600.0 267.0883 6700.0 268.0969 550000.0 285.0884 4800.0 END IONS BEGIN IONS SCANS=194 PEPMASS=328.1548 CHARGE=1 COLLISION_ENERGY=0.0 49.7222 2200.0 50.7822 2400.0 53.4818 2400.0 55.2758 14000.0 55.2772 3700.0 56.4647 2700.0 57.7077 2400.0 58.0649 62000.0 61.4037 2500.0 62.1018 2300.0 63.5819 2300.0 68.2005 2600.0 68.6325 2500.0 72.0443 2500.0 77.6448 2400.0 81.3436 2300.0 85.9045 3000.0 86.1764 2400.0 93.0695 5600.0 98.282 2300.0 102.9273 2400.0 107.0489 320000.0 107.0575 4100.0 111.444 2200.0 114.5152 2400.0 115.6307 2400.0 119.7623 2800.0 121.0645 100000.0 131.0488 14000.0 136.0755 9100.0 140.5822 2600.0 141.3195 2400.0 147.0439 29000.0 148.0517 52000.0 150.0908 5200.0 153.0544 6800.0 156.5313 2300.0 159.0441 16000.0 161.0596 6300.0 162.0912 44000.0 163.039 4700.0 166.1225 46000.0 173.5286 30000.0 173.5413 15000.0 175.0987 2600.0 176.0468 88000.0 176.7163 2300.0 177.0545 41000.0 178.0622 33000.0 178.0865 6100.0 179.0699 25000.0 183.2207 2800.0 189.055 5600.0 189.0776 3100.0 190.0862 120000.0 191.0703 45000.0 191.094 37000.0 192.0651 6900.0 192.1039 3400.0 194.1172 4200.0 195.0805 32000.0 196.824 2400.0 203.094 51000.0 206.0811 800000.0 206.0988 3300.0 207.0889 210000.0 208.0965 17000.0 220.0967 32000.0 221.1046 4000000.0 221.1555 26000.0 222.1124 910000.0 222.1378 5800.0 223.0755 80000.0 229.5221 2800.0 233.0589 3300.0 251.0699 85000.0 253.0868 10000.0 255.1016 44000.0 273.4193 2600.0 283.0972 27000.0 302.0762 2500.0 304.4926 2400.0 309.7039 2200.0 311.8787 2500.0 313.129 2500.0 328.154 36000.0 END IONS BEGIN IONS SCANS=195 PEPMASS=716.2221 CHARGE=1 COLLISION_ENERGY=0.0 68.9969 3600.0 74.2791 2200.0 75.0441 12000.0 85.0283 8200.0 89.0593 7800.0 91.054 30000.0 93.0332 78000.0 93.0697 13000.0 95.049 12000.0 95.0668 2500.0 95.0743 2300.0 97.0645 2600.0 98.8162 2300.0 103.0542 6600.0 106.0411 48000.0 107.049 11000.0 111.0434 2800.0 120.108 2700.0 121.0284 5200.0 121.0556 2200.0 121.0645 100000.0 125.0595 56000.0 126.9521 2600.0 127.2786 2400.0 131.0485 12000.0 134.0359 9700.0 135.0438 7600.0 137.0596 2800.0 139.0754 8300.0 145.0278 12000.0 145.0642 4400.0 147.0436 2500.0 149.0459 3300.0 149.0595 290000.0 151.0754 18000.0 153.0541 12000.0 153.0908 100000.0 155.0679 2600.0 156.6028 2400.0 160.0518 2500.0 163.0388 48000.0 163.0754 9000.0 167.0701 53000.0 173.0597 14000.0 173.5283 15000.0 173.5377 30000.0 177.0546 270000.0 177.4534 2900.0 179.0703 32000.0 180.0421 16000.0 181.0488 9900.0 181.0677 3700.0 181.0859 210000.0 182.094 19000.0 191.0703 52000.0 192.0781 30000.0 195.0651 41000.0 205.0858 7000.0 207.0652 27000.0 207.0872 6200.0 209.081 310000.0 210.0886 24000.0 217.0495 5800.0 217.0855 26000.0 223.0603 860000.0 223.0865 4700.0 242.4029 2600.0 261.0754 2500.0 300.4503 2300.0 301.6497 2300.0 334.9418 2300.0 355.9355 2500.0 383.1138 17000.0 595.9135 2600.0 630.4851 2400.0 646.2646 2900.0 720.3608 2900.0 END IONS BEGIN IONS SCANS=196 PEPMASS=300.1599 CHARGE=1 COLLISION_ENERGY=0.0 48.455 6500.0 53.0387 8500.0 55.0178 33000.0 58.0651 130000.0 60.3291 6600.0 60.7633 7000.0 64.436 7100.0 64.8503 8100.0 67.7597 5300.0 77.0388 27000.0 79.0542 45000.0 81.0335 9400.0 88.4188 5300.0 91.0541 140000.0 93.07 76000.0 94.4816 6400.0 95.049 150000.0 103.0542 63000.0 105.0697 76000.0 107.032 130000.0 107.049 18000000.0 107.0557 130000.0 107.062 59000.0 107.0665 220000.0 107.0708 27000.0 107.0812 14000.0 107.1617 8500.0 109.0647 84000.0 111.0435 42000.0 115.0542 460000.0 117.0698 170000.0 119.049 450000.0 119.0846 9000.0 120.5591 6400.0 121.0278 23000.0 121.0647 1600000.0 121.0792 10000.0 123.0439 42000.0 125.0595 38000.0 127.3353 7300.0 129.07 12000.0 130.2343 8700.0 131.049 470000.0 133.0289 17000.0 133.054 17000.0 133.0647 530000.0 135.0432 7900.0 135.0805 63000.0 137.0596 2300000.0 137.0694 12000.0 137.0771 24000.0 139.0751 47000.0 143.049 2000000.0 143.0587 11000.0 143.0627 9000.0 144.0569 110000.0 145.0647 2300000.0 145.0748 15000.0 145.0783 33000.0 147.0437 39000.0 147.0804 300000.0 149.0596 170000.0 149.9697 7700.0 151.0753 440000.0 155.0602 54000.0 155.0845 10000.0 157.0648 90000.0 160.0519 370000.0 161.0594 75000.0 162.0675 130000.0 162.0913 87000.0 163.0638 5600.0 163.0754 830000.0 163.0911 8900.0 164.0707 8400.0 165.0692 12000.0 165.0912 20000.0 166.0779 41000.0 167.0853 40000.0 169.0651 9000.0 169.1017 23000.0 173.526 110000.0 173.5425 59000.0 174.0916 41000.0 175.0755 4200000.0 176.0834 86000.0 177.0911 230000.0 178.0861 130000.0 179.0861 170000.0 180.1019 340000.0 181.0648 130000.0 181.1013 150000.0 182.0726 130000.0 183.0804 75000.0 189.0909 43000.0 191.086 210000.0 192.1019 320000.0 193.1091 52000.0 194.0727 180000.0 194.118 15000.0 195.0803 110000.0 196.089 7000.0 197.0621 51000.0 197.075 8100.0 197.0962 2200000.0 197.1172 21000.0 206.1178 48000.0 207.0807 140000.0 208.089 9100.0 209.0601 27000.0 209.0962 1700000.0 209.1148 7200.0 210.0678 97000.0 211.0755 66000.0 211.1119 240000.0 219.0806 310000.0 220.0875 8700.0 221.0965 74000.0 222.0673 45000.0 223.1112 53000.0 225.0652 8100.0 225.0911 1400000.0 225.1096 9600.0 225.1173 29000.0 226.0991 34000.0 227.1079 6300.0 235.075 10000.0 236.0838 37000.0 237.091 4800000.0 238.0988 160000.0 239.0707 13000.0 239.0721 49000.0 239.1067 240000.0 240.078 150000.0 241.0863 65000.0 241.1229 12000.0 242.094 55000.0 243.1015 49000.0 251.1065 170000.0 254.0936 360000.0 257.1171 1100000.0 257.1433 7400.0 261.2114 7300.0 267.1022 9400.0 268.1331 49000.0 269.1172 4600000.0 271.1328 180000.0 283.1325 60000.0 292.8751 8400.0 293.1692 6900.0 300.1596 2400000.0 300.1898 10000.0 END IONS BEGIN IONS SCANS=197 PEPMASS=434.1815 CHARGE=1 COLLISION_ENERGY=0.0 55.0178 18000.0 56.0744 4100.0 57.0334 45000.0 60.7733 2300.0 61.0283 92000.0 63.7746 29000.0 63.7766 4600.0 63.919 3000.0 67.0544 2600.0 68.0314 31000.0 68.034 7400.0 69.0334 280000.0 71.049 38000.0 73.0283 63000.0 74.7757 3300.0 78.3886 3400.0 79.0542 4000.0 81.0334 87000.0 82.6762 3600.0 85.0283 780000.0 85.033 3800.0 85.7832 3300.0 87.0439 150000.0 87.3215 3200.0 91.0389 65000.0 93.9614 3000.0 95.0491 23000.0 97.0283 280000.0 98.7216 3600.0 99.044 79000.0 101.023 15000.0 103.0385 9700.0 107.032 8800.0 107.049 4400000.0 107.0661 37000.0 109.0283 110000.0 115.0389 23000.0 115.0543 94000.0 117.0703 8500.0 119.0492 28000.0 121.0286 9800.0 121.0647 180000.0 122.1854 3900.0 123.044 840000.0 127.0389 260000.0 127.0499 2300.0 131.0491 12000.0 133.0648 50000.0 135.0439 21000.0 135.0679 31000.0 136.0757 25000.0 137.0596 83000.0 143.0491 1100000.0 145.0498 92000.0 145.0647 620000.0 146.0724 11000.0 147.0442 28000.0 147.595 3100.0 148.0755 9100.0 149.0596 85000.0 152.0709 14000.0 161.0597 1200000.0 164.0707 720000.0 164.0938 9000.0 165.078 18000.0 173.0602 13000.0 173.5245 26000.0 173.5406 31000.0 174.7803 3300.0 175.0748 4400.0 176.0711 17000.0 177.9647 3900.0 178.0865 68000.0 185.0611 3800.0 191.0857 5000.0 194.0731 5900.0 209.0608 4000.0 209.0963 110000.0 219.0805 29000.0 226.0631 33000.0 227.0701 29000.0 227.1069 55000.0 237.0912 290000.0 237.1178 5300.0 239.1067 7000.0 240.078 19000.0 243.1017 10000.0 253.0861 28000.0 254.0918 10000.0 255.0202 6900.0 255.0385 53000.0 255.0516 35000.0 255.1016 7300000.0 255.1519 26000.0 255.164 47000.0 255.182 6600.0 257.1173 11000.0 267.1018 83000.0 270.1127 96000.0 271.1208 42000.0 272.0582 64000.0 272.1282 10000000.0 272.2782 4500.0 279.1016 16000.0 296.1287 8300.0 297.1135 12000.0 314.1385 35000.0 326.1249 8500.0 334.3707 2800.0 398.1612 7400.0 416.1717 20000.0 434.1809 1500000.0 END IONS BEGIN IONS SCANS=198 PEPMASS=274.1078 CHARGE=1 COLLISION_ENERGY=0.0 48.7781 2200.0 49.3094 2300.0 53.1359 2200.0 54.2743 2200.0 55.4401 2500.0 57.3588 2300.0 58.5965 2700.0 61.4115 2800.0 66.5356 2400.0 67.7422 2400.0 77.0383 2800.0 80.4639 2400.0 81.0333 19000.0 81.6762 2600.0 91.0539 42000.0 93.0638 2700.0 93.0696 100000.0 95.0489 20000.0 99.4969 2500.0 103.0539 56000.0 105.0449 3100.0 109.0282 7400.0 109.6413 2400.0 115.8174 2500.0 117.7123 2400.0 121.0645 1600000.0 121.0734 25000.0 127.0387 14000.0 130.2968 2400.0 131.049 6200.0 137.0231 960000.0 137.0334 18000.0 138.091 35000.0 154.0496 34000.0 173.5314 70000.0 174.2057 2700.0 180.0647 4000.0 214.9274 2300.0 222.905 6900.0 246.672 2700.0 254.2483 2400.0 279.7553 2700.0 281.631 2500.0 END IONS BEGIN IONS SCANS=199 PEPMASS=595.1662 CHARGE=1 COLLISION_ENERGY=0.0 68.1561 2400.0 68.2891 2600.0 78.5007 2500.0 83.3368 2900.0 85.0281 16000.0 90.3078 2500.0 102.431 2500.0 103.0386 11000.0 103.3645 2100.0 105.4384 2500.0 108.3999 2300.0 111.3319 2900.0 120.7525 2500.0 121.0281 11000.0 152.584 2300.0 157.1058 2700.0 163.5297 2500.0 172.412 2500.0 173.5197 5100.0 173.5298 57000.0 173.5386 21000.0 223.4535 2500.0 225.7215 2300.0 256.1513 2400.0 281.0765 2800.0 283.0592 15000.0 283.2873 2700.0 287.0192 2500.0 294.0522 20000.0 295.0601 280000.0 301.1614 3400.0 307.0598 240000.0 308.0675 14000.0 309.0761 15000.0 313.07 37000.0 315.5274 2700.0 319.0602 6900.0 321.0749 26000.0 322.0848 6700.0 323.0547 27000.0 325.0704 780000.0 327.0509 2400.0 333.0762 17000.0 335.0915 38000.0 336.063 5300.0 337.0702 480000.0 347.0911 45000.0 349.0702 300000.0 349.1202 7100.0 351.0502 7100.0 351.0862 73000.0 353.0646 4900.0 355.0807 240000.0 355.1288 4800.0 357.0746 3800.0 361.0212 4600.0 361.0701 140000.0 361.1152 4500.0 363.0858 46000.0 365.0605 3300.0 365.1018 92000.0 367.0805 40000.0 373.0701 36000.0 375.0865 78000.0 375.5627 2800.0 377.0626 8300.0 379.0808 650000.0 379.1399 3100.0 385.0708 31000.0 389.1038 26000.0 391.081 340000.0 393.0972 36000.0 397.0915 9000.0 401.1027 9300.0 403.0814 340000.0 405.0975 2700.0 409.0294 4300.0 409.0916 380000.0 409.1573 3000.0 413.0988 7400.0 415.0842 36000.0 417.0975 31000.0 421.0916 290000.0 421.1525 4400.0 427.1004 210000.0 429.0981 16000.0 431.1136 21000.0 433.0924 46000.0 435.1082 11000.0 439.1022 210000.0 441.0982 15000.0 445.0917 80000.0 449.1236 16000.0 451.1003 8800.0 457.1084 160000.0 459.1043 8100.0 463.1018 110000.0 469.0951 29000.0 475.1031 54000.0 477.1138 4000.0 481.1127 110000.0 487.1023 56000.0 493.1129 28000.0 499.1226 14000.0 505.1129 56000.0 511.1224 12000.0 523.122 68000.0 541.1334 41000.0 559.1455 4300.0 589.3495 2300.0 597.1478 2400.0 END IONS BEGIN IONS SCANS=200 PEPMASS=366.1007 CHARGE=1 COLLISION_ENERGY=0.0 52.1582 2700.0 56.1261 2200.0 60.0442 3800.0 60.6836 2400.0 64.2324 2300.0 73.4578 2300.0 84.543 2800.0 88.6851 2700.0 96.2281 2700.0 107.0406 4800.0 107.0487 790000.0 107.0568 11000.0 110.9392 2400.0 112.4905 2400.0 115.0543 11000.0 115.7301 2600.0 119.0488 3400.0 121.0643 14000.0 131.0487 8300.0 137.048 3500.0 137.0593 110000.0 143.0488 74000.0 145.0643 110000.0 151.0749 43000.0 156.5767 2500.0 160.0516 5400.0 161.0601 3000.0 162.0676 8100.0 163.0751 32000.0 165.2919 2400.0 165.3075 2700.0 172.63 2400.0 173.5337 78000.0 173.5447 4400.0 175.0577 3700.0 175.075 250000.0 175.0931 2700.0 178.0861 11000.0 178.7078 2300.0 181.1008 2600.0 187.0058 34000.0 189.0412 2700.0 194.074 3800.0 209.0959 79000.0 219.0803 13000.0 237.0908 310000.0 238.7372 3000.0 254.0931 17000.0 258.1452 2900.0 269.117 890000.0 269.1437 4700.0 286.144 89000.0 317.0457 2900.0 349.0737 28000.0 356.542 2400.0 366.0999 10000.0 END IONS BEGIN IONS SCANS=201 PEPMASS=269.1174 CHARGE=1 COLLISION_ENERGY=0.0 46.0173 2100.0 48.7115 2500.0 53.7501 2300.0 54.0128 2500.0 55.7762 2200.0 55.8205 2300.0 57.3779 2100.0 62.5745 2400.0 62.8376 2300.0 62.8808 2400.0 62.9607 2400.0 63.6892 2200.0 77.0376 2600.0 79.054 6500.0 86.3018 2600.0 86.9051 2300.0 89.091 2200.0 91.0538 5300.0 95.0488 5100.0 107.0487 850000.0 107.0571 6800.0 115.0538 53000.0 117.0694 13000.0 125.5347 2300.0 131.0484 21000.0 137.0593 65000.0 143.0488 96000.0 144.0567 11000.0 145.0644 78000.0 147.08 2900.0 149.8514 2500.0 155.0604 5000.0 157.5365 2300.0 160.0514 32000.0 162.0677 3000.0 163.075 13000.0 166.0778 4000.0 169.1316 2900.0 173.521 6900.0 173.5296 13000.0 173.5396 12000.0 175.0751 98000.0 175.1015 2400.0 176.0827 3500.0 181.0642 5100.0 181.1012 7400.0 183.5016 2900.0 191.085 32000.0 194.0724 24000.0 195.0806 3400.0 197.056 2800.0 209.096 86000.0 217.2418 2300.0 219.0805 23000.0 222.0678 3500.0 237.0907 120000.0 238.0989 3800.0 239.0702 7000.0 254.0931 20000.0 266.9699 2400.0 269.1173 23000.0 END IONS BEGIN IONS SCANS=202 PEPMASS=286.1443 CHARGE=1 COLLISION_ENERGY=0.0 53.5936 19000.0 55.0178 100000.0 58.5336 17000.0 72.1167 16000.0 76.4468 16000.0 77.0385 75000.0 79.0541 160000.0 82.2612 22000.0 91.0541 290000.0 93.0699 68000.0 95.049 370000.0 103.0542 98000.0 105.0447 71000.0 107.0126 28000.0 107.0318 270000.0 107.049 52000000.0 107.0568 770000.0 107.0624 220000.0 107.0667 500000.0 107.072 140000.0 107.0775 74000.0 109.0646 110000.0 115.0541 1900000.0 116.2974 16000.0 117.0697 490000.0 119.049 330000.0 121.0281 46000.0 121.0647 990000.0 125.059 39000.0 129.0694 70000.0 131.049 1200000.0 133.0642 91000.0 137.0595 4500000.0 137.0693 24000.0 143.049 6100000.0 143.0597 150000.0 144.0568 350000.0 145.0646 4700000.0 145.0765 64000.0 147.0434 24000.0 147.08 190000.0 148.0755 81000.0 149.06 37000.0 151.0752 1000000.0 155.0601 210000.0 160.0517 1300000.0 160.075 77000.0 161.0598 160000.0 162.0675 290000.0 163.0594 18000.0 163.0753 1300000.0 165.0694 74000.0 166.0779 140000.0 167.0846 60000.0 173.5244 120000.0 173.5425 86000.0 175.0753 8800000.0 176.0832 250000.0 178.0862 440000.0 179.0841 31000.0 181.0645 430000.0 181.1011 530000.0 190.0783 63000.0 191.0854 1100000.0 194.0725 800000.0 195.0803 220000.0 197.0595 89000.0 197.096 160000.0 204.3862 17000.0 207.0797 89000.0 208.0888 32000.0 209.0596 46000.0 209.0961 4900000.0 209.1139 26000.0 211.0753 29000.0 211.6944 25000.0 212.0832 76000.0 218.0723 28000.0 219.0804 1100000.0 220.0878 79000.0 222.0678 180000.0 223.0757 20000.0 225.0913 41000.0 226.1009 20000.0 226.5099 17000.0 229.0749 54000.0 235.0745 80000.0 236.0827 84000.0 237.0908 11000000.0 237.1131 59000.0 238.0986 450000.0 239.0703 250000.0 240.0778 390000.0 241.0859 150000.0 254.0933 1200000.0 254.1155 10000.0 267.1009 59000.0 269.1169 5900000.0 286.1437 370000.0 END IONS BEGIN IONS SCANS=203 PEPMASS=239.0918 CHARGE=1 COLLISION_ENERGY=0.0 45.0333 20000.0 46.7545 2100.0 49.3816 2300.0 55.2685 2100.0 55.9343 6500.0 65.8606 2300.0 66.4161 2700.0 73.7033 2100.0 76.1465 2600.0 76.1813 2700.0 78.1351 2200.0 79.6533 2700.0 83.6646 2500.0 89.059 12000.0 91.0544 3800.0 95.7985 2200.0 109.065 3300.0 121.0646 8000.0 123.0437 3900.0 125.0587 2600.0 125.7148 3000.0 138.0673 160000.0 139.0389 2600.0 139.0753 25000.0 149.0594 20000.0 154.0622 130000.0 162.0661 3000.0 163.0392 9700.0 164.0831 20000.0 165.0553 4500.0 169.0693 7400.0 169.0859 300000.0 173.5345 36000.0 178.0622 5000.0 179.0704 14000.0 180.0773 4100.0 182.9088 2600.0 189.1554 2400.0 190.0622 9900.0 191.0342 11000.0 193.0861 13000.0 197.0808 17000.0 204.5563 2100.0 240.7866 2500.0 END IONS BEGIN IONS SCANS=204 PEPMASS=300.16 CHARGE=1 COLLISION_ENERGY=0.0 51.3136 2500.0 51.7415 2400.0 55.0009 2400.0 57.2105 2500.0 58.0649 140000.0 59.8523 2400.0 64.6631 2500.0 70.2385 2300.0 72.0439 2200.0 75.4605 2200.0 75.6734 2400.0 78.1739 2400.0 79.4854 2300.0 81.9497 2500.0 85.1561 2200.0 91.054 14000.0 93.5369 2600.0 94.622 2300.0 95.0491 8500.0 96.4099 2600.0 107.0406 4700.0 107.0489 1800000.0 107.0575 5000.0 107.0656 3300.0 109.0643 2800.0 115.0539 36000.0 117.0698 12000.0 118.0123 2300.0 118.2423 2700.0 119.0488 33000.0 121.0645 120000.0 125.8203 2800.0 131.049 41000.0 133.0644 32000.0 136.3253 2300.0 137.048 4400.0 137.0593 200000.0 138.1542 2600.0 143.0488 190000.0 145.0644 210000.0 145.9738 2500.0 147.0803 30000.0 149.0599 12000.0 151.0751 51000.0 159.8517 3100.0 160.0516 33000.0 160.725 2600.0 161.0592 15000.0 162.0677 8000.0 163.0752 69000.0 167.1274 2300.0 173.5285 67000.0 173.5423 24000.0 174.091 2600.0 175.0575 3300.0 175.0752 440000.0 175.0933 9900.0 176.0837 3500.0 177.0764 2700.0 177.091 3400.0 177.3412 2200.0 177.8664 2600.0 178.0863 20000.0 179.0928 2300.0 180.1016 27000.0 180.8885 2900.0 181.0643 12000.0 181.1009 16000.0 182.0058 2800.0 183.08 5000.0 185.9177 2500.0 191.0853 30000.0 192.1019 46000.0 193.109 2900.0 193.3759 2400.0 194.0722 24000.0 195.0804 7200.0 195.875 3100.0 197.0617 2400.0 197.096 120000.0 197.1148 4100.0 197.8907 20000.0 198.0833 2300.0 209.0962 210000.0 210.0671 3000.0 211.0754 9700.0 211.1115 23000.0 217.4424 2800.0 219.0809 30000.0 225.0907 78000.0 227.359 2800.0 237.0909 320000.0 238.0987 8100.0 239.0718 3300.0 239.1065 22000.0 240.0788 4400.0 241.0853 4000.0 243.101 7200.0 246.9629 2200.0 253.8802 8700.0 254.0935 51000.0 255.1012 7000.0 257.1169 50000.0 268.1338 13000.0 269.1171 390000.0 271.1327 18000.0 282.7471 2400.0 300.1211 8300.0 300.1596 220000.0 300.1966 4600.0 308.4383 2400.0 END IONS BEGIN IONS SCANS=205 PEPMASS=426.0515 CHARGE=1 COLLISION_ENERGY=0.0 56.8888 2300.0 57.4982 2400.0 63.0556 2300.0 63.23 2400.0 71.5476 2300.0 71.918 2200.0 73.1507 2200.0 79.9587 2200.0 80.4619 2300.0 84.8456 2200.0 87.0706 2100.0 87.6863 2600.0 91.2345 2500.0 93.6229 2600.0 94.1228 2800.0 98.5128 2700.0 101.2826 2500.0 101.4207 2200.0 104.3014 2100.0 132.4156 2500.0 135.3777 2500.0 137.5507 2400.0 149.6855 9400.0 151.0389 17000.0 151.9654 2700.0 173.5258 37000.0 173.5391 38000.0 173.8673 2200.0 176.9653 3500.0 185.3577 2700.0 194.9739 100000.0 195.9814 6200.0 197.5782 2500.0 205.9675 43000.0 207.9815 4200.0 209.9612 2900.0 210.9684 10000.0 211.9768 12000.0 212.9846 10000.0 217.9678 3200.0 217.9898 79000.0 221.9614 48000.0 222.054 2200.0 222.9692 27000.0 223.9767 920000.0 224.0133 6500.0 230.7996 2800.0 235.9764 3200.0 236.9839 2900.0 237.9291 4300.0 237.9559 330000.0 237.9824 5200.0 239.9717 17000.0 241.9871 170000.0 242.0122 2500.0 245.9847 25000.0 246.9925 1500000.0 260.0119 6600.0 265.0031 75000.0 269.997 6500.0 273.9914 8000.0 285.9901 2400.0 287.9734 10000.0 288.0089 23000.0 297.992 45000.0 301.9877 37000.0 314.9951 280000.0 315.0352 4700.0 316.0032 180000.0 318.9317 2500.0 325.9874 28000.0 334.0134 64000.0 342.9929 2400.0 343.9976 1300000.0 353.0127 3000.0 362.0068 14000.0 381.3143 2600.0 427.5162 2400.0 END IONS BEGIN IONS SCANS=206 PEPMASS=291.0868 CHARGE=1 COLLISION_ENERGY=0.0 47.5347 2500.0 50.2892 3100.0 50.361 2600.0 50.6609 2200.0 51.0233 15000.0 51.2154 2000.0 53.0386 24000.0 54.0335 3000.0 55.0178 220000.0 55.0542 17000.0 58.6885 2200.0 59.0484 2400.0 59.118 2500.0 59.6644 2300.0 61.2477 2300.0 61.7242 2200.0 61.7602 2100.0 63.0949 2300.0 65.0386 93000.0 66.7214 2400.0 67.0179 6200.0 67.0541 210000.0 68.2214 2500.0 68.997 230000.0 69.0336 17000.0 70.5023 2100.0 71.0127 2600.0 71.0485 2500.0 71.6693 2500.0 77.0387 34000.0 78.1814 2500.0 79.0546 6100.0 81.0333 39000.0 83.0491 190000.0 85.0283 62000.0 91.0542 120000.0 92.7875 2400.0 93.0334 120000.0 95.049 640000.0 97.0282 55000.0 99.0439 43000.0 101.9428 2600.0 104.2666 2900.0 104.5693 2600.0 105.0335 34000.0 105.0444 2500.0 105.0697 17000.0 107.0491 68000.0 109.0282 27000.0 109.6215 2400.0 111.0076 73000.0 111.0439 300000.0 115.0542 70000.0 117.0701 2800.0 118.9399 2500.0 119.0392 16000.0 119.0491 930000.0 119.0592 11000.0 120.425 2600.0 121.0283 42000.0 121.0387 2500.0 122.0732 2200.0 123.0231 30000.0 123.0439 9700000.0 123.0617 150000.0 123.0665 18000.0 123.077 3400.0 124.0478 8500.0 125.0492 3500.0 126.6608 2800.0 127.0389 230000.0 131.0492 18000.0 133.0273 5400.0 133.0647 110000.0 135.0337 3000.0 135.044 160000.0 137.0232 140000.0 137.0597 180000.0 138.9989 3700.0 139.0144 99000.0 139.0188 7700.0 139.0389 17000000.0 139.0494 43000.0 139.0644 210000.0 139.0784 25000.0 140.0423 42000.0 143.0491 450000.0 145.0647 29000.0 145.7135 2500.0 147.0296 3600.0 147.044 4300000.0 147.055 16000.0 147.0711 4300.0 147.0802 3000.0 147.2643 2600.0 149.0596 49000.0 151.026 4100.0 151.0389 350000.0 151.0753 120000.0 152.1774 2500.0 153.0545 170000.0 159.044 80000.0 161.0596 2100000.0 161.0736 8100.0 163.0389 260000.0 163.0754 52000.0 165.0546 1000000.0 167.1873 2600.0 169.0496 100000.0 169.0634 2800.0 171.0437 22000.0 171.4445 2700.0 173.5255 68000.0 173.5425 36000.0 175.0756 17000.0 177.0547 280000.0 179.0338 32000.0 179.0703 1000000.0 179.3562 2400.0 181.0494 110000.0 181.0653 3200.0 182.7948 2700.0 185.0598 39000.0 187.0749 11000.0 189.0348 2700.0 189.0546 510000.0 189.0747 3100.0 196.631 2800.0 199.0749 12000.0 203.0705 75000.0 205.0861 62000.0 207.0443 9700.0 207.0653 1500000.0 213.0549 22000.0 217.0087 2300.0 226.8349 2800.0 227.0698 19000.0 231.0656 29000.0 245.0794 3000.0 249.0749 18000.0 255.0653 4600.0 262.9138 2700.0 270.5971 2500.0 273.0759 16000.0 END IONS BEGIN IONS SCANS=207 PEPMASS=385.025 CHARGE=1 COLLISION_ENERGY=0.0 53.6614 2600.0 56.7729 2200.0 58.3914 2700.0 62.5662 2500.0 63.6533 2300.0 63.7132 2500.0 71.6229 2400.0 71.7026 2500.0 73.4078 2500.0 81.5348 2300.0 82.7345 2600.0 84.3869 2400.0 90.5079 2400.0 92.6161 2200.0 103.6471 2200.0 107.1021 2900.0 113.9875 2500.0 117.2198 2300.0 118.8524 2400.0 120.4868 2900.0 123.0437 92000.0 127.2261 2600.0 138.8567 2300.0 139.0393 2600.0 149.0704 2400.0 153.3175 2900.0 157.6213 2400.0 160.3694 2700.0 163.3241 2500.0 173.5268 58000.0 173.5397 47000.0 176.3317 2300.0 189.938 2400.0 194.9737 7600.0 201.632 2600.0 202.5726 2400.0 202.9814 3600.0 218.2424 2300.0 223.9766 69000.0 228.8432 2400.0 233.5033 2200.0 235.4508 2400.0 237.9555 26000.0 238.4175 2300.0 241.9873 6400.0 246.9927 31000.0 252.3996 2500.0 263.0041 5500.0 292.4665 2400.0 306.1412 2200.0 308.4171 2800.0 312.9257 2600.0 314.9946 25000.0 316.002 5200.0 335.0028 48000.0 343.997 27000.0 353.0134 45000.0 358.8004 2400.0 362.0284 22000.0 385.7621 2600.0 387.5173 2500.0 END IONS BEGIN IONS SCANS=208 PEPMASS=388.2548 CHARGE=1 COLLISION_ENERGY=0.0 58.896 2500.0 59.6866 2300.0 62.7935 2500.0 65.7602 2600.0 68.7174 2400.0 70.227 2400.0 70.944 2100.0 71.4924 2300.0 73.0648 4900.0 76.6731 2500.0 87.0437 23000.0 89.0593 540000.0 89.0652 3500.0 92.5778 2300.0 93.3622 2200.0 107.0702 2800.0 107.7068 2400.0 109.9695 2200.0 120.4007 2600.0 130.9768 2200.0 131.0699 2300.0 133.074 3100.0 133.0856 170000.0 140.8167 2500.0 163.1346 2600.0 173.5222 12000.0 173.5395 34000.0 177.1121 19000.0 191.4129 2800.0 247.0368 2400.0 255.369 2400.0 266.1881 2400.0 296.8708 2600.0 329.0723 2500.0 END IONS BEGIN IONS SCANS=209 PEPMASS=289.0712 CHARGE=1 COLLISION_ENERGY=0.0 48.4517 2200.0 51.0228 19000.0 51.4438 2200.0 51.6792 2200.0 53.0384 3100.0 54.9987 2500.0 55.0177 31000.0 59.0053 2200.0 62.431 2200.0 63.242 2100.0 64.6097 2200.0 64.9921 2100.0 65.0383 3400.0 66.0721 2500.0 67.0539 62000.0 67.1827 2300.0 68.2388 2300.0 68.9968 44000.0 69.5692 2300.0 70.7449 3100.0 71.0487 2600.0 75.2385 2300.0 76.0694 2600.0 77.0383 37000.0 79.054 5300.0 79.5418 2100.0 81.9822 2200.0 83.0123 37000.0 83.0489 7900.0 86.1646 2200.0 89.0384 15000.0 95.0489 150000.0 96.4482 2200.0 97.0278 2500.0 101.5114 2100.0 105.0333 47000.0 105.0447 5500.0 107.0488 43000.0 109.3923 2700.0 111.0075 22000.0 111.044 31000.0 114.3825 2500.0 114.9271 2400.0 117.0332 42000.0 119.0494 4700.0 121.0282 3200.0 123.023 3200.0 123.0438 2800000.0 123.0523 49000.0 123.1823 3000.0 127.0379 2400.0 129.0178 6000.0 131.0491 35000.0 135.0439 170000.0 137.0595 5300.0 139.0388 690000.0 139.0512 10000.0 141.0699 3500.0 143.0488 2800.0 145.0282 140000.0 147.901 2400.0 149.0234 14000.0 149.0595 22000.0 151.0388 95000.0 153.018 3100.0 153.0699 3500.0 159.044 72000.0 161.0596 3100.0 163.0214 12000.0 163.0389 690000.0 163.0519 2800.0 169.0646 25000.0 173.06 13000.0 173.5209 14000.0 173.537 68000.0 177.0547 22000.0 178.9791 64000.0 185.0604 21000.0 187.0391 140000.0 197.0597 72000.0 199.0396 3500.0 201.0551 2900.0 205.0498 110000.0 206.9739 16000.0 215.0706 31000.0 217.0494 11000.0 224.8986 7500.0 224.985 37000.0 225.055 47000.0 225.6077 3500.0 229.05 11000.0 243.0651 31000.0 245.0446 23000.0 253.0503 9500.0 271.0612 20000.0 278.4674 3000.0 278.5203 2700.0 287.4371 2300.0 END IONS BEGIN IONS SCANS=210 PEPMASS=311.0532 CHARGE=1 COLLISION_ENERGY=0.0 50.1099 2300.0 52.5368 2100.0 54.556 2300.0 55.9042 2500.0 57.2256 2500.0 61.1374 2500.0 63.8011 2900.0 65.9653 2800.0 70.2551 2300.0 80.0501 2500.0 102.6415 2300.0 103.6712 2400.0 132.4076 2400.0 147.1877 2200.0 149.6831 4900.0 149.6933 4500.0 173.5206 4800.0 173.5339 32000.0 182.3035 2400.0 193.1017 2400.0 212.2459 2400.0 237.0657 7000.0 265.0607 12000.0 265.5989 2500.0 272.8821 2300.0 309.9309 2700.0 311.1001 4500.0 314.0717 2600.0 END IONS BEGIN IONS SCANS=211 PEPMASS=326.1393 CHARGE=1 COLLISION_ENERGY=0.0 49.245 2400.0 51.1202 2200.0 55.4603 2300.0 57.0697 3100.0 57.5429 2300.0 58.0648 63000.0 58.9014 2500.0 58.9541 2300.0 65.0216 2500.0 66.9198 2200.0 70.1403 2400.0 71.2751 2400.0 72.0259 2700.0 73.0831 2500.0 76.8513 2600.0 77.5046 2200.0 77.7792 11000.0 78.3624 2500.0 79.4045 2400.0 94.5952 2200.0 96.1022 2400.0 96.4095 2200.0 97.7013 2400.0 111.1677 2300.0 111.957 2500.0 112.3459 2400.0 115.2151 2500.0 121.5505 2800.0 126.2612 2400.0 143.1908 2600.0 147.581 2500.0 155.5812 2300.0 173.5225 44000.0 173.5397 59000.0 173.5417 13000.0 203.0932 2600.0 213.4578 2500.0 219.1523 2800.0 221.0208 2400.0 268.0965 2800.0 278.0952 2600.0 280.2112 2200.0 281.0685 9400.0 289.0244 2500.0 289.509 2500.0 292.8447 2600.0 295.8972 2600.0 296.0917 260000.0 307.5641 2900.0 310.1059 3200.0 311.0303 17000.0 311.0477 6400.0 311.1153 4200000.0 311.1992 19000.0 326.1387 490000.0 END IONS BEGIN IONS SCANS=212 PEPMASS=867.2131 CHARGE=1 COLLISION_ENERGY=0.0 78.5866 2200.0 92.2319 2400.0 92.4491 2600.0 94.7561 2500.0 95.4359 2700.0 96.7271 2400.0 110.4608 2500.0 111.0076 7200.0 111.0437 17000.0 123.0335 5200.0 123.0437 260000.0 127.028 9300.0 127.0386 610000.0 127.0499 5900.0 135.0438 160000.0 137.0237 2600.0 139.0387 360000.0 139.2665 2100.0 147.0439 15000.0 149.0232 9800.0 151.0387 79000.0 161.0599 9000.0 163.0389 340000.0 165.0547 43000.0 167.0339 37000.0 169.0492 20000.0 173.5286 68000.0 173.5375 9400.0 177.0546 9100.0 177.2917 2800.0 179.0338 35000.0 186.5614 2500.0 187.0387 21000.0 191.0337 16000.0 201.0546 14000.0 203.0338 20000.0 203.0697 4400.0 203.4857 2400.0 205.0498 20000.0 207.0639 3100.0 215.0711 4300.0 219.0635 6000.0 225.0548 3200.0 229.0494 30000.0 231.0286 2900.0 231.0655 6800.0 233.0447 31000.0 241.0497 2600.0 243.0651 41000.0 245.0444 360000.0 247.0316 8400.0 247.0599 330000.0 251.0549 8200.0 253.0493 5600.0 255.0645 6800.0 257.0441 65000.0 258.0448 2700.0 259.0597 98000.0 261.0442 5900.0 261.0758 24000.0 263.0545 13000.0 269.0445 14000.0 271.0348 2600.0 271.0602 220000.0 273.0754 18000.0 274.047 26000.0 275.0552 270000.0 283.0604 98000.0 285.0404 7900.0 285.0746 4500.0 287.0553 260000.0 288.0612 2800.0 289.0705 60000.0 291.0866 47000.0 295.0614 4000.0 299.0554 64000.0 301.0711 62000.0 303.0488 5500.0 303.0856 5500.0 307.8041 2500.0 311.0553 5800.0 313.0702 8500.0 315.0489 3000.0 323.0561 16000.0 325.0704 2900.0 327.0492 2800.0 338.4818 2600.0 342.5019 2400.0 349.0697 3400.0 361.0707 2800.0 363.0864 4500.0 365.0656 20000.0 377.069 5900.0 379.0814 26000.0 381.0959 4200.0 383.0775 5000.0 389.066 26000.0 391.081 24000.0 393.0606 67000.0 395.0754 25000.0 397.091 3000.0 405.0599 33000.0 407.0769 110000.0 407.1324 4300.0 409.0924 150000.0 409.1447 2200.0 411.1067 22000.0 417.0613 4000.0 419.0764 55000.0 421.0899 16000.0 427.0964 4200.0 431.0754 7100.0 433.0911 5400.0 437.0886 3200.0 449.0848 2900.0 450.6503 2700.0 451.1012 5200.0 517.1148 7400.0 527.0967 53000.0 537.1182 2900.0 545.1055 17000.0 557.1078 8300.0 END IONS BEGIN IONS SCANS=213 PEPMASS=373.1839 CHARGE=1 COLLISION_ENERGY=0.0 57.9779 2400.0 62.8743 2300.0 62.9692 2600.0 74.7334 2400.0 113.0154 2100.0 132.7736 2500.0 137.0591 9300.0 173.5254 12000.0 173.5341 35000.0 183.297 2700.0 183.417 2800.0 201.0543 21000.0 211.1301 29000.0 256.2083 2300.0 340.8226 2500.0 357.8689 3300.0 373.0733 6400.0 373.1832 2000000.0 END IONS BEGIN IONS SCANS=214 PEPMASS=328.1549 CHARGE=1 COLLISION_ENERGY=0.0 49.6561 2600.0 49.6677 2500.0 53.3833 2400.0 53.8384 2200.0 56.7885 2200.0 57.3758 2900.0 58.0649 110000.0 62.3342 2700.0 63.9887 2200.0 66.273 2700.0 66.6989 2100.0 73.0282 7400.0 74.2758 2400.0 77.0423 2200.0 79.5038 2800.0 81.5713 2100.0 89.0595 8900.0 112.2057 2600.0 117.3248 2300.0 126.6386 2400.0 152.7191 2700.0 154.3344 3000.0 165.071 5800.0 166.0778 3800.0 167.5988 2300.0 172.7303 2500.0 173.5288 51000.0 173.5382 20000.0 173.5472 4300.0 179.0853 20000.0 181.1015 27000.0 189.0712 3400.0 191.0856 180000.0 193.0652 8100.0 194.0727 24000.0 195.0804 12000.0 202.87 2300.0 203.0865 4600.0 205.0651 61000.0 207.0805 130000.0 208.0883 14000.0 209.0618 3400.0 209.0962 170000.0 209.4716 2800.0 217.0652 9800.0 217.3307 2300.0 218.0736 7500.0 219.0805 280000.0 220.087 5600.0 221.0599 76000.0 221.0965 5200.0 222.0677 200000.0 223.0755 62000.0 223.1116 5700.0 225.0912 57000.0 233.0599 140000.0 235.0755 69000.0 236.0833 45000.0 236.3084 2700.0 237.0911 770000.0 239.0698 13000.0 247.0754 130000.0 248.0832 12000.0 250.0624 75000.0 251.0702 370000.0 251.1061 28000.0 252.0779 5100.0 253.0858 96000.0 254.0938 6300.0 255.1016 97000.0 263.0708 4100.0 263.9054 2600.0 264.078 24000.0 265.0192 8300.0 265.0527 16000.0 265.0859 2500000.0 265.1193 5000.0 265.1516 4100.0 266.0937 56000.0 267.0653 51000.0 267.1012 26000.0 268.0735 12000.0 268.1338 3500.0 269.1175 10000.0 279.1018 87000.0 282.0889 950000.0 282.1234 3700.0 283.0969 260000.0 283.1327 3300.0 284.1045 5100.0 285.1126 22000.0 296.1286 3700.0 297.1125 1500000.0 298.1044 4200.0 299.1286 9300.0 311.1293 7500.0 312.1203 4600.0 313.1228 59000.0 320.5806 3000.0 322.9946 2700.0 326.7262 2600.0 328.1539 87000.0 END IONS BEGIN IONS SCANS=215 PEPMASS=460.2183 CHARGE=1 COLLISION_ENERGY=0.0 57.4055 2300.0 58.3144 2300.0 61.0281 36000.0 62.3457 2300.0 66.7362 2300.0 67.0542 7700.0 67.8761 2200.0 69.0333 55000.0 70.576 2000.0 71.0489 12000.0 73.0283 3800.0 73.9026 2100.0 74.0193 2100.0 76.4151 2300.0 77.5579 2400.0 79.0551 3600.0 81.0333 17000.0 81.0696 2900.0 83.0489 9400.0 85.0281 340000.0 87.6939 2800.0 91.0388 22000.0 91.7948 2200.0 94.1534 2500.0 94.8036 3200.0 95.0489 25000.0 95.0854 52000.0 96.07 2400.0 96.1758 2500.0 97.0282 100000.0 97.0582 3800.0 97.0645 200000.0 99.0439 55000.0 102.1811 2400.0 103.5498 2300.0 105.0703 5600.0 107.0853 5100.0 108.0811 2800.0 109.0283 26000.0 109.0648 9700.0 111.0439 36000.0 119.085 18000.0 120.0122 2300.0 120.9903 2200.0 121.065 12000.0 121.1016 2800.0 123.0443 5400.0 123.0802 2500000.0 123.0889 4100.0 123.09 21000.0 125.0597 6800.0 127.0388 79000.0 131.0854 7300.0 133.1009 6900.0 135.0803 24000.0 137.0597 35000.0 137.096 11000.0 139.0753 64000.0 145.0496 70000.0 145.0623 4800.0 147.0802 63000.0 147.1176 3100.0 149.0596 8700.0 150.0205 2500.0 151.0774 2600.0 153.8847 2300.0 156.0953 2600.0 157.1014 21000.0 159.0805 35000.0 159.1172 20000.0 161.096 47000.0 161.1308 2700.0 163.0755 53000.0 165.0581 23000.0 165.0909 11000000.0 165.1241 47000.0 165.1328 9000.0 165.8526 2700.0 166.0785 2600.0 167.0702 88000.0 168.0934 2300.0 171.1171 31000.0 173.0964 35000.0 173.1329 23000.0 173.5295 100000.0 173.542 5400.0 174.7885 2500.0 175.074 3100.0 175.1118 77000.0 177.0912 38000.0 179.0692 2900.0 183.1162 3000.0 185.0961 53000.0 185.3349 2500.0 187.0754 20000.0 187.1118 71000.0 189.1272 42000.0 199.1118 230000.0 201.1269 17000.0 203.1068 160000.0 205.0862 150000.0 205.1219 8000.0 212.0834 25000.0 215.1068 150000.0 215.8089 2400.0 217.1226 75000.0 221.1175 20000.0 227.1069 160000.0 233.1175 430000.0 233.3111 2500.0 234.9672 2800.0 235.1334 25000.0 245.1175 210000.0 263.1281 440000.0 263.1515 2800.0 263.1785 2600.0 266.2491 2400.0 295.5838 2400.0 347.5094 2700.0 367.8394 2400.0 392.3002 2500.0 403.3942 2100.0 416.4888 2400.0 END IONS BEGIN IONS SCANS=216 PEPMASS=263.128 CHARGE=1 COLLISION_ENERGY=0.0 46.0558 2200.0 46.2576 2400.0 46.9884 2100.0 50.4986 2100.0 51.3033 2200.0 55.0541 5900.0 56.3084 2200.0 56.6018 2600.0 67.0541 8400.0 68.911 2200.0 69.0333 6500.0 72.7042 2200.0 72.9726 2700.0 77.553 2600.0 81.0697 6800.0 91.054 7200.0 91.4202 2700.0 93.0695 4100.0 95.0488 24000.0 95.0852 48000.0 97.0646 30000.0 98.0595 12000.0 99.8236 2400.0 105.0697 7100.0 114.89 2400.0 118.2688 2200.0 119.0853 18000.0 121.0276 3200.0 121.0647 19000.0 123.0439 13000.0 123.0702 4600.0 123.08 420000.0 128.0634 2800.0 131.085 8900.0 133.1006 6700.0 135.0804 16000.0 137.0595 8100.0 139.0751 6900.0 143.0851 6600.0 147.08 6300.0 154.6294 2300.0 156.093 2900.0 157.101 13000.0 159.08 14000.0 159.1166 17000.0 160.0886 3300.0 161.0954 11000.0 162.3208 2200.0 163.0756 2800.0 165.0908 37000.0 167.9414 2300.0 171.1168 8800.0 173.096 8900.0 173.5288 54000.0 173.5424 11000.0 175.1111 9800.0 184.0895 2900.0 186.1021 2400.0 187.1116 16000.0 199.0724 2500.0 199.1117 17000.0 205.0876 3400.0 212.0837 5300.0 215.1071 3400.0 242.4541 2400.0 265.6884 2800.0 END IONS BEGIN IONS SCANS=217 PEPMASS=465.1736 CHARGE=1 COLLISION_ENERGY=0.0 57.04 2600.0 58.7099 4700.0 61.6592 2600.0 62.5263 2300.0 62.6176 2300.0 65.2957 2400.0 67.5061 2300.0 73.9429 2400.0 74.0314 2600.0 75.7776 3400.0 75.7816 3400.0 78.1472 2400.0 80.8142 2300.0 92.4472 2400.0 94.4208 2400.0 99.9155 2200.0 103.6511 2400.0 106.081 2300.0 115.4181 2400.0 117.7114 2500.0 128.0217 2500.0 133.1926 2500.0 135.5626 2700.0 145.4061 2400.0 162.524 2600.0 173.5197 15000.0 173.5278 28000.0 173.5353 71000.0 173.5469 5300.0 177.4581 2500.0 185.0418 150000.0 249.7749 2300.0 250.2183 2600.0 285.1093 28000.0 303.0387 9700.0 303.0577 4800.0 303.0797 6500.0 303.1204 4200000.0 303.2013 17000.0 339.8971 2300.0 340.0121 2600.0 442.0187 3400.0 450.5223 2500.0 465.0973 11000.0 465.1728 510000.0 465.2428 4500.0 END IONS BEGIN IONS SCANS=218 PEPMASS=234.1491 CHARGE=1 COLLISION_ENERGY=0.0 45.0334 3100.0 51.8579 2300.0 53.0385 2600.0 55.0177 11000.0 55.0541 120000.0 57.0698 29000.0 58.065 42000.0 62.5756 2200.0 67.054 9300.0 69.0697 250000.0 69.6192 2200.0 72.0806 33000.0 73.0282 62000.0 73.5091 2500.0 79.0542 17000.0 79.5662 2100.0 81.0697 39000.0 91.0541 42000.0 93.0698 4900.0 98.0961 7900.0 103.0541 31000.0 105.0697 32000.0 107.0489 8000.0 107.0854 7900.0 108.1546 2600.0 109.2052 2300.0 115.054 59000.0 116.0619 8400.0 117.0696 27000.0 118.0649 14000.0 119.049 10000.0 119.0854 9600.0 121.0635 2300.0 122.4484 2600.0 123.0438 150000.0 128.062 24000.0 129.059 4600.0 129.0697 200000.0 130.0408 15000.0 131.0377 4800.0 131.049 160000.0 131.0857 2500.0 133.0646 31000.0 134.4973 2500.0 135.1587 2600.0 137.0595 71000.0 141.0696 2600.0 142.0775 12000.0 143.049 98000.0 143.0854 87000.0 144.0567 21000.0 145.0647 55000.0 146.0598 33000.0 147.031 3900.0 147.0438 170000.0 147.0803 37000.0 147.6503 2400.0 148.0517 120000.0 149.0459 5400.0 149.0595 360000.0 149.0738 2900.0 151.0753 24000.0 156.0932 15000.0 157.0521 2000.0 157.0646 220000.0 157.1006 2200.0 158.0725 10000.0 159.0802 3200.0 160.0518 57000.0 161.0595 640000.0 161.0756 5700.0 162.0538 6600.0 162.0674 150000.0 163.0753 31000.0 164.0705 720000.0 165.0698 2800.0 166.0769 2700.0 170.0728 38000.0 171.0804 85000.0 171.1168 110000.0 173.0598 25000.0 173.5208 3800.0 173.5347 60000.0 174.0676 28000.0 175.0575 3400.0 175.0754 860000.0 176.0833 16000.0 177.0576 2400.0 181.1012 13000.0 184.0882 32000.0 188.0832 76000.0 189.0911 45000.0 197.9157 2800.0 199.1118 67000.0 202.0993 3900.0 217.1225 120000.0 221.5599 2600.0 234.1492 14000.0 244.4298 2600.0 END IONS BEGIN IONS SCANS=219 PEPMASS=344.1859 CHARGE=1 COLLISION_ENERGY=0.0 50.4445 4000.0 55.8147 4200.0 56.0494 45000.0 58.0652 14000000.0 58.0692 160000.0 58.0703 120000.0 58.0718 74000.0 58.0739 25000.0 58.0757 22000.0 58.0898 8000.0 59.0684 49000.0 62.0078 3700.0 62.1155 3900.0 62.9675 3300.0 65.4269 3800.0 69.2089 4300.0 70.2809 3800.0 70.527 6900.0 71.0727 25000.0 72.0807 32000.0 83.2993 6900.0 83.3045 8500.0 86.0598 12000.0 89.0447 3900.0 91.0541 52000.0 94.1668 4000.0 95.049 40000.0 101.7929 7000.0 107.0489 15000.0 109.0648 37000.0 115.0542 120000.0 117.0697 46000.0 119.0491 87000.0 121.0649 25000.0 122.036 18000.0 123.0438 40000.0 125.0596 70000.0 131.0492 7000.0 137.0596 4400000.0 137.0693 47000.0 143.0491 2000000.0 143.0589 9000.0 143.0625 9300.0 144.0568 14000.0 145.0648 170000.0 147.0801 24000.0 149.0596 170000.0 151.0753 1600000.0 154.803 2500.0 157.0645 3800.0 157.8574 4200.0 160.0519 120000.0 160.0761 9000.0 160.8177 3700.0 161.0596 43000.0 162.0675 38000.0 163.0753 62000.0 165.0908 23000.0 173.5335 120000.0 174.0674 5000.0 174.0917 67000.0 175.0755 4100000.0 175.0951 19000.0 175.1031 50000.0 175.1114 13000.0 176.0836 34000.0 176.1075 27000.0 177.0912 330000.0 179.0859 30000.0 179.1078 19000.0 181.0648 7400.0 181.1015 27000.0 187.0752 5400.0 188.0461 2600.0 188.1067 21000.0 189.0915 8300.0 192.0816 4200.0 192.1021 380000.0 193.0666 8200.0 193.0906 7500.0 193.1099 320000.0 194.1176 100000.0 195.081 8300.0 206.1177 85000.0 207.0808 220000.0 207.1021 4300.0 207.1258 110000.0 208.0873 3500.0 209.0604 23000.0 209.0962 110000.0 211.0755 5200.0 213.0919 12000.0 219.0807 26000.0 220.1341 17000.0 221.0876 2900.0 223.1116 8500.0 224.0824 10000.0 235.0755 250000.0 236.0834 14000.0 237.0911 140000.0 238.0949 8800.0 239.0713 25000.0 239.1065 360000.0 240.0779 4500.0 241.0864 82000.0 241.1224 300000.0 241.1497 14000.0 249.0908 21000.0 251.1061 37000.0 252.0778 26000.0 253.1247 7800.0 254.093 5400.0 255.1374 8100.0 265.0861 10000.0 266.0893 46000.0 267.1006 670000.0 268.1094 33000.0 269.1175 390000.0 270.0893 24000.0 271.0983 18000.0 271.1318 4300.0 272.1047 36000.0 281.1141 4100.0 283.0969 8600.0 283.1327 26000.0 284.1027 110000.0 286.1179 25000.0 298.1155 24000.0 299.0742 3000.0 299.1276 1500000.0 301.1437 430000.0 312.1596 210000.0 313.1697 18000.0 314.646 4900.0 329.1619 74000.0 344.1858 3100000.0 END IONS BEGIN IONS SCANS=220 PEPMASS=202.0503 CHARGE=1 COLLISION_ENERGY=0.0 46.7408 2100.0 49.634 2100.0 50.0107 2400.0 50.2845 2300.0 50.8429 2200.0 51.4333 2400.0 52.5522 2700.0 54.0199 2400.0 55.9342 15000.0 65.6533 2400.0 66.48 2300.0 70.1186 2700.0 72.6935 2200.0 77.4783 2500.0 78.9493 3400.0 99.7978 2100.0 105.317 2800.0 110.2066 2500.0 114.4768 2600.0 114.9709 10000.0 116.975 5800.0 118.0649 26000.0 119.1459 2600.0 128.0495 9700.0 130.8556 2400.0 130.9491 2700.0 131.0489 8200.0 131.9742 2900.0 132.9693 20000.0 140.0993 2300.0 146.0598 54000.0 147.044 2800.0 148.0112 2500.0 156.0442 92000.0 173.5253 19000.0 173.5418 9900.0 174.0551 58000.0 184.0394 230000.0 184.0584 4000.0 202.0501 100000.0 204.9049 2300.0 END IONS BEGIN IONS SCANS=221 PEPMASS=342.0824 CHARGE=1 COLLISION_ENERGY=0.0 51.223 2300.0 56.9972 2300.0 57.0334 4800.0 57.3532 2400.0 58.0649 58000.0 59.3584 2500.0 61.3742 2400.0 62.6344 2000.0 64.5056 2100.0 67.1136 2200.0 69.0331 43000.0 69.2228 2400.0 75.1058 2300.0 75.2716 2700.0 85.028 34000.0 95.0124 58000.0 95.0426 2700.0 95.0488 150000.0 97.0215 4100.0 97.028 260000.0 101.1556 2400.0 110.7792 2300.0 111.9872 2500.0 113.023 160000.0 121.0281 110000.0 122.9984 3800.0 123.0073 150000.0 125.023 52000.0 139.0387 620000.0 141.0069 4000.0 141.0179 220000.0 143.0336 99000.0 148.8771 2500.0 157.0643 2300.0 169.013 180000.0 169.409 2300.0 173.5246 9100.0 173.5364 35000.0 177.4884 2200.0 187.0236 38000.0 189.1143 2600.0 207.2635 2600.0 225.9769 3000.0 237.0901 3200.0 250.2778 2400.0 265.0861 27000.0 266.0859 2400.0 277.1837 3000.0 284.0533 2500.0 289.6482 2600.0 297.1121 21000.0 306.492 2500.0 340.7537 2300.0 END IONS BEGIN IONS SCANS=222 PEPMASS=207.1383 CHARGE=1 COLLISION_ENERGY=0.0 41.0385 17000.0 43.0177 380000.0 43.0542 5900.0 45.0333 17000.0 51.9949 2500.0 53.0384 12000.0 54.6433 2400.0 55.0176 17000.0 55.054 140000.0 55.5163 2100.0 57.0333 9600.0 57.0696 100000.0 58.4369 2500.0 59.0489 21000.0 63.6897 2200.0 64.1489 2200.0 65.0383 22000.0 67.0539 560000.0 67.0582 5800.0 69.0332 44000.0 69.0695 40000.0 71.0458 2100.0 71.0488 29000.0 75.8965 2400.0 77.0386 2500.0 79.0539 71000.0 80.0618 3700.0 80.9117 2800.0 81.0333 6500.0 81.0696 81000.0 83.0446 2200.0 83.0488 37000.0 83.0852 5100.0 85.0645 56000.0 87.9068 2200.0 89.9767 2300.0 91.0539 110000.0 93.0631 4000.0 93.0696 220000.0 95.0488 61000.0 95.0852 1600000.0 95.0919 16000.0 95.096 13000.0 95.0993 11000.0 97.0643 11000.0 103.0539 6200.0 105.0447 2800.0 105.0615 3500.0 105.0695 200000.0 105.0782 3700.0 106.0781 3100.0 107.0488 11000.0 107.0773 5100.0 107.0852 210000.0 108.0569 4600.0 109.0645 57000.0 109.0935 2900.0 109.1009 31000.0 111.0803 14000.0 112.7459 2200.0 113.0598 11000.0 114.9711 5600.0 115.0538 2700.0 115.9639 22000.0 116.0619 11000.0 116.9725 3100.0 117.0695 16000.0 119.0489 4200.0 119.0852 260000.0 119.0938 2900.0 119.0955 5200.0 120.0931 16000.0 121.0644 46000.0 121.0911 4200.0 121.1009 180000.0 123.0801 250000.0 123.1165 57000.0 125.0958 9100.0 129.0698 9700.0 130.0778 8000.0 131.0853 53000.0 132.6166 2500.0 133.0645 16000.0 133.0749 2500.0 133.0903 3500.0 133.1009 65000.0 135.0801 16000.0 135.1165 19000.0 137.0957 26000.0 137.1322 9600.0 139.075 11000.0 141.0681 2600.0 143.0854 13000.0 145.0643 3200.0 145.1011 22000.0 146.1088 6500.0 147.0801 38000.0 147.1165 75000.0 149.0958 400000.0 149.1072 3600.0 151.0748 11000.0 155.9972 11000.0 156.0931 31000.0 157.0861 3600.0 159.0803 25000.0 159.1172 7900.0 160.0882 13000.0 161.0961 10000.0 161.1322 56000.0 162.692 2600.0 163.1123 9900.0 165.0915 3300.0 165.1272 47000.0 171.1167 19000.0 173.5228 6100.0 173.5325 16000.0 173.5407 11000.0 174.1039 50000.0 189.1274 36000.0 207.138 13000.0 END IONS BEGIN IONS SCANS=223 PEPMASS=409.1839 CHARGE=1 COLLISION_ENERGY=0.0 55.7479 2200.0 58.7915 2100.0 63.3881 2400.0 66.431 2500.0 68.6395 2400.0 71.1403 2500.0 75.4346 2100.0 88.7205 2300.0 100.4245 2400.0 107.5457 2200.0 165.6822 2400.0 173.5262 26000.0 173.544 9000.0 200.2019 2300.0 203.0522 4000.0 208.9636 2700.0 221.4194 2500.0 228.5702 2500.0 259.7844 2700.0 297.3979 2600.0 369.1518 2500.0 372.785 2600.0 384.8168 2400.0 409.1831 430000.0 409.2462 3300.0 END IONS BEGIN IONS SCANS=224 PEPMASS=285.1239 CHARGE=1 COLLISION_ENERGY=0.0 52.8727 2200.0 56.3385 2400.0 60.349 2100.0 67.0222 3600.0 67.0256 2600.0 91.0542 23000.0 95.3482 2400.0 101.7537 2700.0 107.049 2800.0 119.0493 9200.0 120.0443 17000.0 123.0439 67000.0 124.0394 5400.0 127.1979 2400.0 130.065 10000.0 131.0734 5300.0 135.47 2300.0 137.0594 6200.0 146.0598 66000.0 148.0391 210000.0 149.047 440000.0 158.0601 17000.0 159.0676 6700.0 162.0549 15000.0 164.0342 4200.0 167.0854 15000.0 173.5221 4100.0 173.5404 9700.0 174.0556 4100.0 175.063 9200.0 180.0813 3300.0 181.0651 3500.0 184.0761 2900.0 184.1129 2700.0 193.0888 5100.0 194.0964 200000.0 195.0804 27000.0 197.0836 3200.0 198.0911 6300.0 199.0623 11000.0 203.8827 4300.0 204.0809 10000.0 205.0651 6000.0 207.0682 12000.0 208.0759 7600.0 211.0995 5900.0 212.0704 11000.0 212.1073 17000.0 213.0909 5800.0 220.0754 5400.0 221.0827 6100.0 222.0914 440000.0 223.0751 20000.0 223.0985 4100.0 224.071 4700.0 225.0784 160000.0 226.0868 7500.0 232.0756 6800.0 233.0846 6300.0 235.0615 7200.0 236.07 5600.0 238.0861 9800.0 239.0932 7600.0 240.1018 940000.0 241.0843 12000.0 241.1102 2600.0 249.0786 5500.0 250.0861 350000.0 251.0935 22000.0 252.0656 7900.0 253.0732 20000.0 256.093 8200.0 267.0561 2500.0 267.0887 79000.0 268.0965 1100000.0 268.1631 5800.0 END IONS BEGIN IONS SCANS=225 PEPMASS=342.1706 CHARGE=1 COLLISION_ENERGY=0.0 54.095 13000.0 56.0495 100000.0 56.7445 12000.0 58.0652 34000000.0 58.069 300000.0 58.0705 130000.0 58.072 100000.0 58.074 57000.0 58.0799 23000.0 59.2742 11000.0 60.9135 17000.0 61.7315 7100.0 65.3543 10000.0 66.2708 96000.0 66.2733 33000.0 66.905 16000.0 72.0807 99000.0 72.7036 18000.0 74.2758 67000.0 74.2799 29000.0 77.9631 14000.0 94.9409 17000.0 118.7675 6100.0 152.065 11000.0 156.6744 16000.0 161.2009 11000.0 165.0719 63000.0 166.0788 31000.0 169.4895 6100.0 173.5208 13000.0 173.5352 190000.0 178.0793 7300.0 179.0859 110000.0 181.065 15000.0 181.1009 120000.0 181.7488 11000.0 182.2738 17000.0 189.0704 36000.0 190.0782 34000.0 191.0858 830000.0 194.0727 110000.0 195.0808 100000.0 201.0719 23000.0 202.8713 20000.0 203.0853 13000.0 205.0652 260000.0 205.1015 38000.0 205.1407 7000.0 206.0725 34000.0 207.0807 640000.0 208.0874 80000.0 209.0964 880000.0 217.0643 17000.0 218.0721 32000.0 218.2931 20000.0 219.0808 1600000.0 219.1058 31000.0 219.4655 19000.0 220.0879 61000.0 221.0605 74000.0 221.0968 95000.0 222.0679 890000.0 223.0757 160000.0 223.1112 30000.0 224.0834 25000.0 225.0923 32000.0 233.0341 10000.0 233.06 740000.0 233.088 27000.0 233.0976 39000.0 234.0679 50000.0 235.0488 15000.0 235.0756 880000.0 236.0834 300000.0 237.0913 5400000.0 239.0703 93000.0 239.1067 170000.0 240.0768 7600.0 241.0835 14000.0 247.0756 920000.0 248.0828 79000.0 249.0912 87000.0 250.0627 410000.0 251.0745 71000.0 251.1068 410000.0 252.078 74000.0 253.0859 210000.0 253.1187 24000.0 254.0936 98000.0 255.1017 490000.0 261.0907 9300.0 263.0711 45000.0 264.0781 180000.0 265.0193 190000.0 265.034 130000.0 265.0861 26000000.0 265.1389 24000.0 265.1521 170000.0 266.0938 480000.0 267.0655 230000.0 267.1017 690000.0 269.1175 670000.0 270.0897 26000.0 271.0968 96000.0 271.2453 21000.0 279.102 1300000.0 279.1361 25000.0 281.0857 9300.0 281.1178 230000.0 282.0891 7000000.0 283.0973 110000.0 284.1046 1000000.0 285.1123 81000.0 296.1046 40000.0 297.0344 92000.0 297.1126 22000000.0 298.1224 21000.0 299.0979 16000.0 299.1282 3000000.0 310.1441 120000.0 311.1283 450000.0 313.1434 150000.0 324.1161 12000.0 327.1475 100000.0 342.1702 4400000.0 344.1417 13000.0 END IONS BEGIN IONS SCANS=226 PEPMASS=347.1451 CHARGE=1 COLLISION_ENERGY=0.0 52.2093 2100.0 55.0176 3400.0 57.0332 12000.0 61.0281 34000.0 69.0331 45000.0 69.9263 2200.0 71.0488 8000.0 73.0281 12000.0 80.2609 2300.0 81.0331 15000.0 85.0198 3200.0 85.028 300000.0 85.0372 3800.0 87.0437 8400.0 91.0385 19000.0 97.0214 3500.0 97.0281 81000.0 99.0438 17000.0 109.028 19000.0 127.0386 57000.0 128.8468 2400.0 133.2368 2200.0 145.0492 32000.0 163.3025 2500.0 173.5217 11000.0 173.5397 23000.0 220.5695 2300.0 221.3443 2400.0 239.3727 2600.0 249.8888 2400.0 251.4438 2400.0 257.1306 2900.0 291.9836 2700.0 296.3102 3100.0 296.6739 2900.0 END IONS BEGIN IONS SCANS=227 PEPMASS=328.1913 CHARGE=1 COLLISION_ENERGY=0.0 49.2916 20000.0 56.0495 320000.0 56.207 19000.0 58.0582 210000.0 58.0653 100000000.0 58.0704 340000.0 58.0719 330000.0 58.0739 860000.0 58.074 120000.0 58.0758 63000.0 66.8265 31000.0 69.4244 29000.0 69.6123 36000.0 71.0727 34000.0 72.0808 140000.0 75.9669 31000.0 79.0541 36000.0 85.527 36000.0 87.0901 24000.0 91.0544 170000.0 93.0699 120000.0 95.0492 190000.0 103.0542 81000.0 105.0698 24000.0 107.0319 160000.0 107.0491 39000000.0 107.0661 370000.0 113.7746 30000.0 117.0699 350000.0 118.1883 39000.0 119.0491 300000.0 119.0856 130000.0 121.0647 5300000.0 121.0732 40000.0 124.0521 120000.0 125.06 97000.0 128.4906 28000.0 129.0701 94000.0 131.049 160000.0 133.0649 490000.0 135.0803 300000.0 136.0518 340000.0 137.0596 220000.0 139.0753 440000.0 145.0493 120000.0 145.0647 6800000.0 145.0784 57000.0 146.072 89000.0 147.0804 1800000.0 149.0962 100000.0 150.0675 130000.0 151.0753 6200000.0 155.0601 91000.0 158.0727 940000.0 159.0452 41000.0 159.0806 440000.0 160.0881 92000.0 161.0596 130000.0 161.0962 290000.0 162.067 32000.0 163.0616 24000.0 163.0755 2600000.0 164.0831 46000.0 164.225 22000.0 165.0911 2400000.0 173.0972 72000.0 173.5303 620000.0 173.5448 48000.0 174.0519 60000.0 174.0677 2300000.0 174.084 54000.0 175.0754 180000.0 176.0834 1100000.0 177.0911 2500000.0 179.1067 270000.0 183.08 43000.0 189.0911 13000000.0 190.0992 340000.0 190.1226 500000.0 191.1068 850000.0 192.102 250000.0 193.8979 40000.0 195.0806 38000.0 196.089 44000.0 197.0961 200000.0 203.1068 140000.0 206.1177 2000000.0 207.1255 1100000.0 208.1335 670000.0 209.0971 62000.0 211.077 34000.0 221.097 74000.0 221.1409 350000.0 222.1498 44000.0 223.1115 110000.0 224.0828 140000.0 225.0912 210000.0 225.1276 610000.0 226.1002 49000.0 236.0836 47000.0 237.0908 330000.0 238.0993 240000.0 251.1064 550000.0 252.0831 41000.0 252.1146 6000000.0 252.1449 200000.0 253.0892 90000.0 253.1222 660000.0 254.0938 330000.0 254.1296 360000.0 255.1021 270000.0 256.1091 700000.0 257.1186 43000.0 266.1304 160000.0 267.1368 40000.0 268.1095 3800000.0 268.1416 160000.0 270.1251 1000000.0 277.7158 21000.0 281.1169 70000.0 283.0955 72000.0 283.1331 18000000.0 285.1109 29000.0 285.1488 3700000.0 285.1848 62000.0 296.1641 24000.0 297.1738 280000.0 313.1675 480000.0 328.1908 17000000.0 END IONS BEGIN IONS SCANS=228 PEPMASS=432.2809 CHARGE=1 COLLISION_ENERGY=0.0 58.8652 2500.0 60.0002 2600.0 60.9089 2200.0 61.3197 2400.0 62.0799 2300.0 62.7728 2200.0 66.0665 2200.0 67.933 2400.0 73.0646 6200.0 75.1113 2400.0 84.4744 2300.0 87.0435 44000.0 87.4063 2300.0 89.0593 860000.0 89.0653 4800.0 97.5125 2400.0 99.2004 2600.0 102.9092 2300.0 110.4718 2400.0 123.6005 2400.0 126.9491 2500.0 131.0699 2300.0 133.0754 4200.0 133.0855 320000.0 148.0595 2900.0 148.1998 2700.0 151.6281 2800.0 153.5 2500.0 155.9037 2300.0 166.158 2700.0 173.5182 4900.0 173.5289 92000.0 173.5443 25000.0 173.7885 2500.0 173.8409 2800.0 177.1119 31000.0 188.6293 3100.0 189.2424 2400.0 190.124 2300.0 197.8543 2300.0 200.827 2200.0 200.931 2400.0 205.1424 2600.0 211.0938 2500.0 211.3869 2100.0 230.5586 3400.0 241.6428 2300.0 284.0428 2600.0 317.6653 2600.0 330.5451 2500.0 382.7034 3300.0 400.649 2600.0 421.4684 2400.0 END IONS BEGIN IONS SCANS=229 PEPMASS=342.1703 CHARGE=1 COLLISION_ENERGY=0.0 55.9851 2200.0 56.0494 7100.0 58.065 2000000.0 58.0678 17000.0 58.0704 11000.0 58.0718 10000.0 58.08 2700.0 59.0626 2200.0 62.9726 2200.0 79.7196 2200.0 80.2353 3000.0 80.5062 2400.0 82.5646 2300.0 83.3129 2500.0 86.0599 15000.0 95.7343 2200.0 97.0283 7500.0 101.9623 2600.0 104.2201 2200.0 104.879 2300.0 113.0231 5300.0 121.0276 2600.0 123.0066 2400.0 123.0436 2500.0 135.0439 4100.0 137.2683 2400.0 137.4394 2300.0 139.0388 25000.0 141.0184 4900.0 143.0335 2500.0 164.0831 28000.0 169.0125 3700.0 173.528 27000.0 173.5386 12000.0 174.0911 16000.0 175.1003 2500.0 188.1071 150000.0 189.0978 3200.0 189.1148 400000.0 190.1017 2900.0 190.1224 7300.0 203.0939 4200.0 204.102 58000.0 205.1097 63000.0 206.1176 56000.0 206.1385 4100.0 208.1341 3900.0 218.1179 23000.0 220.1334 350000.0 243.1027 3600.0 265.0854 3100.0 266.0927 9300.0 269.119 2800.0 271.0972 9000.0 285.1138 3000.0 297.112 12000.0 306.2882 3100.0 310.4841 2400.0 342.1717 2700.0 END IONS BEGIN IONS SCANS=230 PEPMASS=330.0976 CHARGE=1 COLLISION_ENERGY=0.0 58.0651 1600000.0 58.0683 10000.0 58.0699 9500.0 59.0618 10000.0 59.0683 500000.0 59.0715 5300.0 59.2711 2400.0 60.0653 3500.0 60.0717 32000.0 60.7485 2200.0 61.9738 2100.0 65.0386 16000.0 68.9941 2100.0 69.1113 2200.0 72.0803 3000.0 86.096 2500.0 87.6017 2300.0 88.0354 2700.0 91.054 45000.0 93.0695 2700.0 107.049 370000.0 107.0577 3900.0 108.0524 290000.0 109.0547 92000.0 109.5948 2900.0 111.9159 2700.0 114.4717 2700.0 119.0392 3400.0 119.0489 180000.0 121.0282 100000.0 121.0646 97000.0 121.0736 4800.0 122.0594 9600.0 122.068 45000.0 123.0703 12000.0 123.2599 2800.0 126.6379 2500.0 134.0685 3000.0 138.0546 7500.0 145.0646 47000.0 146.068 57000.0 147.0439 1300000.0 147.0708 28000.0 147.0809 7900.0 148.0838 12000.0 149.0856 5900.0 149.6859 5000.0 149.6964 3800.0 151.0753 41000.0 152.0786 55000.0 152.4736 2500.0 153.0809 33000.0 159.0766 6500.0 160.0807 3100.0 163.0753 14000.0 164.0706 250000.0 165.0795 3000.0 165.0919 3600.0 166.0941 18000.0 166.5828 2400.0 167.0168 3500.0 167.0339 900000.0 167.0963 17000.0 173.5291 22000.0 173.5398 9100.0 174.0679 8800.0 175.0715 20000.0 176.0716 20000.0 177.0894 12000.0 178.0932 17000.0 179.0972 5700.0 182.237 2400.0 189.091 48000.0 190.0945 100000.0 191.0971 97000.0 192.1091 8400.0 193.1113 5600.0 206.118 7300.0 207.1216 16000.0 208.1259 21000.0 209.1326 12000.0 225.3615 2300.0 227.1335 3400.0 252.1132 10000.0 253.117 31000.0 254.1209 84000.0 255.1277 11000.0 256.102 6900.0 256.1372 2900.0 257.1099 5400.0 258.115 9800.0 269.1121 17000.0 270.1157 57000.0 272.1311 19000.0 284.1359 62000.0 285.1393 300000.0 286.1521 14000.0 287.1549 54000.0 330.1971 300000.0 330.2398 4400.0 END IONS BEGIN IONS SCANS=231 PEPMASS=743.2035 CHARGE=1 COLLISION_ENERGY=0.0 69.0331 29000.0 71.0488 61000.0 73.4958 2200.0 75.0438 2400.0 75.7649 2500.0 81.0329 2800.0 83.0486 11000.0 85.028 120000.0 87.0436 21000.0 87.7363 2600.0 90.0216 2400.0 97.0279 45000.0 99.0437 8500.0 99.2796 2300.0 111.0438 10000.0 115.0384 24000.0 115.3123 2700.0 127.0385 11000.0 129.0541 23000.0 133.0495 4400.0 139.0394 2600.0 145.0493 11000.0 147.8224 2300.0 151.0262 2500.0 169.2172 2300.0 171.0645 3200.0 173.5212 7100.0 173.5398 28000.0 183.4869 2300.0 242.7465 2400.0 243.9078 2400.0 258.1874 2300.0 261.0963 4000.0 302.9688 3700.0 303.0498 1400000.0 308.7199 2900.0 345.0597 9500.0 474.8039 2500.0 553.6123 3200.0 585.7518 3000.0 641.3464 2500.0 END IONS BEGIN IONS SCANS=232 PEPMASS=316.1913 CHARGE=1 COLLISION_ENERGY=0.0 48.4184 2600.0 52.5586 2300.0 53.6888 2300.0 54.1576 2500.0 57.0699 2100.0 58.0648 7200.0 58.5018 2300.0 58.5863 2300.0 59.2105 2400.0 60.0805 640000.0 60.0839 3400.0 61.599 2200.0 62.5327 2500.0 62.7882 2300.0 63.485 2200.0 66.4934 2200.0 69.4311 2200.0 74.0761 2200.0 77.8506 2200.0 81.338 2500.0 81.3558 2300.0 83.1553 2600.0 87.1542 2300.0 87.1833 2300.0 89.3242 2500.0 89.9045 2400.0 91.0539 56000.0 93.0695 27000.0 93.1154 2200.0 95.0489 26000.0 101.8471 2400.0 103.0537 2800.0 107.0488 130000.0 109.0645 8300.0 112.4294 2500.0 117.0695 63000.0 117.0777 2700.0 118.6135 2500.0 119.0402 4000.0 119.0488 200000.0 119.0854 26000.0 120.0431 2600.0 121.0645 870000.0 121.0733 15000.0 123.0437 65000.0 123.7171 2500.0 133.0645 16000.0 135.0438 110000.0 135.0804 25000.0 137.048 4700.0 137.0594 470000.0 137.0715 5300.0 139.5712 2700.0 145.0556 2300.0 145.0644 140000.0 147.0698 2100.0 147.0801 360000.0 149.04 2700.0 149.0595 32000.0 151.075 3000.0 163.0751 370000.0 163.091 2700.0 173.5295 44000.0 173.5402 21000.0 176.0805 2300.0 178.0809 2200.0 180.236 2300.0 182.0727 6300.0 182.0893 2600.0 183.0803 32000.0 193.1009 8300.0 210.067 19000.0 211.0755 27000.0 211.1118 160000.0 218.3007 2300.0 221.0961 29000.0 223.9055 3400.0 228.0776 47000.0 229.1227 7100.0 239.1066 120000.0 250.1542 2500.0 257.088 4000.0 257.1171 300000.0 257.1471 6300.0 271.5126 3100.0 272.783 2800.0 308.7747 2200.0 311.2586 2300.0 316.1901 33000.0 318.8927 2800.0 END IONS BEGIN IONS SCANS=233 PEPMASS=330.1707 CHARGE=1 COLLISION_ENERGY=0.0 58.0652 3600.0 76.4742 2600.0 85.623 2200.0 87.5945 2600.0 91.0541 17000.0 95.217 2300.0 95.8377 2500.0 95.9193 2200.0 96.7901 2700.0 97.6303 2300.0 102.628 3000.0 104.9453 2500.0 105.0339 2400.0 109.0647 3400.0 115.0543 35000.0 118.8269 2600.0 119.0492 17000.0 122.0363 5500.0 125.0597 3600.0 133.1439 2400.0 135.0436 3600.0 137.0597 1000000.0 140.8288 2400.0 143.036 3100.0 143.0491 500000.0 143.0626 3400.0 145.0646 13000.0 147.0441 2500.0 147.0806 5400.0 149.0597 20000.0 151.062 5100.0 151.0754 160000.0 157.0647 3100.0 160.0519 24000.0 160.0768 6800.0 161.0597 5500.0 163.0756 33000.0 165.0903 5700.0 173.533 37000.0 174.0918 2900.0 175.0575 4400.0 175.0756 730000.0 175.0934 5500.0 176.0837 3500.0 177.0787 69000.0 177.0926 10000.0 178.0864 30000.0 179.0878 9700.0 180.1025 11000.0 192.0607 17000.0 192.0872 17000.0 192.102 3000000.0 192.1426 14000.0 192.1544 3200.0 192.7312 2900.0 193.108 6000.0 195.0808 12000.0 207.0807 61000.0 209.0959 2800.0 223.0759 12000.0 227.1069 54000.0 235.0753 60000.0 237.0907 8600.0 239.0674 3300.0 239.1068 80000.0 241.0872 6800.0 241.1224 13000.0 252.0781 3000.0 255.1016 48000.0 267.1016 150000.0 268.11 9500.0 269.1166 14000.0 284.1044 27000.0 287.1278 25000.0 289.8487 2300.0 298.1438 12000.0 299.1282 150000.0 301.1447 12000.0 327.7255 2900.0 330.1702 110000.0 END IONS BEGIN IONS SCANS=234 PEPMASS=360.2172 CHARGE=1 COLLISION_ENERGY=0.0 51.1381 2200.0 51.2454 2300.0 55.0177 3800.0 57.3563 2700.0 58.0651 3700.0 69.2409 2200.0 69.245 2800.0 71.3543 2700.0 81.0696 14000.0 91.0541 25000.0 91.557 2800.0 93.1679 2400.0 102.6752 2800.0 103.0543 2900.0 105.0699 8700.0 106.028 2900.0 107.0488 33000.0 109.0282 6200.0 109.0646 24000.0 114.2605 2200.0 115.0547 3200.0 117.0696 25000.0 119.0488 3400.0 121.0646 45000.0 123.0441 3500.0 126.9182 2200.0 131.0854 17000.0 135.0333 3300.0 135.0439 98000.0 135.0803 32000.0 137.0594 310000.0 137.0715 5200.0 139.0746 13000.0 144.057 2800.0 145.0644 17000.0 146.0724 58000.0 146.0848 3500.0 147.0801 23000.0 149.0594 22000.0 149.096 26000.0 150.0672 13000.0 151.0753 27000.0 152.0828 51000.0 152.0955 2200.0 159.0801 25000.0 160.0881 130000.0 161.0599 14000.0 161.096 27000.0 162.0674 170000.0 163.0751 180000.0 163.1118 8800.0 164.083 7000.0 165.091 68000.0 166.0985 10000.0 167.1065 54000.0 173.5245 15000.0 173.5391 22000.0 174.1628 3300.0 175.0752 12000.0 176.0832 460000.0 177.0548 25000.0 177.0909 4300000.0 177.1047 24000.0 177.1191 16000.0 177.1275 22000.0 178.0987 54000.0 179.1068 47000.0 189.0918 2700.0 190.0989 67000.0 191.1065 1400000.0 192.1143 790000.0 193.1223 29000.0 195.1015 22000.0 208.5788 2700.0 212.0853 2500.0 213.0919 2800.0 215.107 18000.0 223.1114 7100.0 224.119 7800.0 227.1066 4200.0 234.102 4800.0 236.165 8400.0 237.091 16000.0 240.5099 2500.0 241.0873 2500.0 241.1224 33000.0 242.0918 2500.0 250.1804 16000.0 251.1062 13000.0 252.1144 78000.0 253.0852 3400.0 254.0927 3100.0 255.1369 12000.0 259.988 2500.0 265.1213 11000.0 268.1096 37000.0 269.1177 21000.0 272.1049 11000.0 283.1332 42000.0 286.1202 41000.0 301.1439 69000.0 328.3864 2500.0 350.9016 2600.0 357.2488 2600.0 360.217 53000.0 END IONS BEGIN IONS SCANS=235 PEPMASS=344.186 CHARGE=1 COLLISION_ENERGY=0.0 52.9421 2300.0 56.0494 2900.0 56.7491 2200.0 58.0651 1100000.0 70.1704 2100.0 72.0807 8700.0 74.6322 2000.0 77.8242 2500.0 79.9677 2000.0 81.3662 2300.0 89.0599 3300.0 91.054 10000.0 93.7484 2200.0 95.0493 2400.0 97.5624 2700.0 100.4459 2600.0 107.0492 5400.0 115.0542 16000.0 121.0646 9500.0 123.023 7300.0 123.0439 1900000.0 123.0651 7000.0 124.3757 2500.0 129.0703 7100.0 131.0493 3700.0 131.0853 2900.0 133.0649 3900.0 136.0517 16000.0 137.0597 60000.0 139.0756 9800.0 143.0377 3800.0 143.0491 110000.0 144.0562 3400.0 145.065 8700.0 146.0728 8200.0 147.0439 3600.0 149.0598 2800.0 151.0645 2100.0 151.0753 320000.0 151.0892 5400.0 155.3005 2400.0 158.0726 130000.0 159.0805 29000.0 161.0441 6400.0 161.0597 260000.0 162.0674 13000.0 163.0753 54000.0 165.0912 33000.0 173.5298 39000.0 174.0676 230000.0 174.0849 5100.0 175.0754 16000.0 176.0834 18000.0 177.0911 90000.0 189.091 1400000.0 190.0987 95000.0 190.1218 17000.0 191.1069 6300.0 192.1018 6700.0 206.1175 45000.0 207.1255 35000.0 208.1332 15000.0 223.0756 2500.0 249.0914 13000.0 250.0985 6800.0 253.0858 15000.0 253.121 13000.0 267.1012 22000.0 268.1094 280000.0 269.0807 6700.0 270.0882 19000.0 271.0975 3700.0 279.4023 2700.0 281.1167 23000.0 284.0685 4800.0 284.1044 230000.0 299.1279 650000.0 299.1848 3300.0 301.1426 22000.0 313.168 10000.0 329.1634 2800.0 344.1372 4100.0 344.1852 250000.0 END IONS BEGIN IONS SCANS=236 PEPMASS=252.0869 CHARGE=1 COLLISION_ENERGY=0.0 44.0131 17000.0 44.4867 2300.0 44.5504 2000.0 46.0525 2200.0 49.0109 2500.0 49.3123 2500.0 49.8301 2300.0 50.4483 2400.0 50.4583 2400.0 53.3737 2500.0 55.0194 2300.0 55.7488 2200.0 60.4968 2600.0 60.8188 2600.0 62.9504 2200.0 63.5755 2300.0 68.6368 2200.0 69.4786 2400.0 71.7405 2600.0 74.3369 2200.0 74.8027 2200.0 74.8876 2200.0 75.9144 2400.0 77.0385 4800.0 77.2589 2200.0 79.0539 1100000.0 79.0592 5500.0 81.2372 2400.0 82.4025 2300.0 86.0233 82000.0 87.0073 100000.0 87.8894 2200.0 90.6419 2600.0 95.0488 20000.0 95.1051 2200.0 97.9137 2400.0 103.0539 210000.0 104.0339 1200000.0 104.0417 11000.0 104.1068 6400.0 105.0695 52000.0 106.0532 3000.0 106.0648 1900000.0 106.0729 16000.0 107.0395 5000.0 107.0489 5000000.0 107.0617 15000.0 107.0632 61000.0 107.0656 12000.0 111.0154 2500.0 113.0675 2300.0 121.0161 2400.0 131.0379 11000.0 131.0488 1200000.0 131.0588 4000.0 131.0603 19000.0 132.0441 150000.0 135.889 2400.0 139.2933 2600.0 145.6924 2500.0 148.8895 2300.0 149.0598 10000.0 161.7452 2200.0 164.0703 19000.0 164.9499 2200.0 173.5238 15000.0 173.5363 57000.0 174.0545 2500.0 182.2902 2400.0 191.3963 2300.0 192.0654 280000.0 192.0851 3400.0 215.6228 2500.0 243.8957 2400.0 END IONS BEGIN IONS SCANS=237 PEPMASS=476.3069 CHARGE=1 COLLISION_ENERGY=0.0 58.2395 2400.0 68.2345 2200.0 73.0647 3800.0 74.8131 2400.0 87.0436 29000.0 89.0593 420000.0 89.0654 2500.0 97.9959 2300.0 104.6811 3000.0 108.9618 2300.0 110.5698 2400.0 119.0388 2300.0 119.0487 2500.0 125.3477 2300.0 133.0855 160000.0 136.8069 2200.0 167.0894 2600.0 173.5338 66000.0 177.1122 14000.0 198.6416 2700.0 274.9514 2700.0 317.7368 2300.0 320.6321 2500.0 348.1523 2200.0 467.292 2900.0 END IONS BEGIN IONS SCANS=238 PEPMASS=482.185 CHARGE=1 COLLISION_ENERGY=0.0 61.2158 2500.0 86.5857 2400.0 88.0391 8300.0 88.3002 2300.0 95.4444 2300.0 96.2184 2600.0 98.393 2600.0 111.358 2000.0 113.8062 2700.0 131.0488 9300.0 132.754 2300.0 136.0254 2200.0 137.0594 340000.0 137.0693 2400.0 145.0651 2500.0 145.6681 2600.0 151.0202 2600.0 151.0751 33000.0 157.0649 3500.0 161.0595 61000.0 162.0676 5900.0 163.0213 17000.0 163.0753 42000.0 165.0367 20000.0 167.7229 2500.0 169.015 4200.0 169.0316 190000.0 171.0812 2600.0 173.5172 4500.0 173.5358 53000.0 175.0753 34000.0 177.0347 2600.0 177.0913 5400.0 177.7684 2500.0 181.0319 4200.0 183.0473 11000.0 183.6334 2500.0 185.0267 18000.0 187.0754 57000.0 188.083 26000.0 189.037 29000.0 189.0907 25000.0 190.0985 2600.0 190.3204 2400.0 193.0318 55000.0 195.0472 57000.0 201.0363 3600.0 201.0909 14000.0 203.1066 17000.0 207.0476 14000.0 207.1019 7300.0 209.0267 2900.0 209.0623 3900.0 213.0914 14000.0 215.052 3300.0 215.1065 2600.0 219.0477 6100.0 221.0631 41000.0 224.038 21000.0 229.0325 5600.0 233.0631 13000.0 239.074 5400.0 251.0732 25000.0 257.0631 4300.0 259.0431 3700.0 264.1108 3300.0 265.0677 4300.0 267.0488 3500.0 270.0882 3100.0 271.0449 3500.0 277.0874 3300.0 281.0655 3000.0 283.0774 5100.0 292.108 3200.0 293.0621 8900.0 297.0587 3100.0 297.0948 12000.0 299.3226 2400.0 309.1134 5000.0 310.0652 5100.0 311.0742 52000.0 315.1061 12000.0 319.0794 3300.0 324.1355 28000.0 325.0905 26000.0 329.0823 3000.0 342.1469 42000.0 343.1004 34000.0 350.1517 34000.0 351.1056 13000.0 357.1136 14000.0 360.1546 11000.0 361.1105 3600.0 375.1268 18000.0 383.1322 37000.0 393.1329 3400.0 401.141 9400.0 452.7366 2500.0 478.4809 2900.0 END IONS BEGIN IONS SCANS=239 PEPMASS=360.1081 CHARGE=1 COLLISION_ENERGY=0.0 51.4773 2500.0 51.9747 2400.0 52.4845 2100.0 55.054 2500.0 55.5334 2700.0 56.1436 2400.0 59.412 2500.0 59.6768 2200.0 60.6241 4400.0 61.7212 2300.0 63.0234 7400.0 64.5071 2500.0 65.0384 130000.0 67.054 23000.0 68.4157 2500.0 70.6715 2200.0 71.5403 2500.0 72.0805 15000.0 72.501 2200.0 73.7022 3200.0 75.2232 2100.0 82.0981 2400.0 82.4671 2600.0 82.9461 2300.0 84.1796 2400.0 84.761 2300.0 86.0598 9600.0 87.7609 2200.0 89.0385 180000.0 89.2541 2700.0 89.8175 2200.0 90.5512 2300.0 91.054 63000.0 91.4773 2300.0 92.115 2600.0 92.8882 2200.0 93.0332 41000.0 94.4247 2200.0 94.5082 2200.0 95.0491 2200.0 95.3042 2400.0 95.3904 2600.0 98.5013 2500.0 101.2002 2400.0 101.7833 2300.0 106.041 2900.0 110.0716 2900.0 110.1702 2300.0 110.7587 2400.0 111.9303 2400.0 113.1558 2800.0 114.0174 2200.0 115.7528 2200.0 117.0241 7900.0 117.0333 770000.0 119.0489 130000.0 120.0447 8300.0 121.0182 15000.0 121.0281 960000.0 121.0367 2400.0 121.0386 13000.0 121.0633 2200.0 123.0437 4400.0 124.4312 2300.0 127.9919 2400.0 130.9684 2500.0 134.0361 35000.0 135.0439 55000.0 136.0407 2700.0 136.0518 74000.0 137.0599 8600.0 137.1297 2600.0 138.0546 81000.0 138.0655 5400.0 140.3155 2700.0 142.0276 2200.0 144.9481 2600.0 145.0282 8400000.0 145.0392 75000.0 145.0548 50000.0 147.0437 3400.0 149.0595 390000.0 151.0752 310000.0 152.0705 120000.0 156.0301 2400.0 162.0305 25000.0 162.6054 2300.0 163.0387 140000.0 164.0341 62000.0 164.9258 3000.0 167.0338 12000000.0 167.0472 57000.0 167.0668 71000.0 167.0762 11000.0 170.1844 3000.0 173.5231 18000.0 173.5318 120000.0 173.5412 25000.0 177.0073 5500.0 177.0179 32000.0 177.0265 6300.0 177.0546 16000000.0 177.0691 36000.0 177.0907 150000.0 177.1021 8200.0 178.0565 2800.0 182.0454 12000.0 186.055 56000.0 188.8434 2900.0 194.0812 1300000.0 194.1004 6300.0 200.5937 3300.0 210.0399 140000.0 229.5228 2700.0 245.4935 2600.0 255.8139 2800.0 267.1973 2700.0 274.5637 2700.0 295.0061 2300.0 301.7283 2900.0 313.6378 3000.0 318.4731 2300.0 338.7488 2400.0 341.4839 2600.0 353.3285 2500.0 363.5977 2300.0 368.7456 2800.0 END IONS BEGIN IONS SCANS=240 PEPMASS=328.155 CHARGE=1 COLLISION_ENERGY=0.0 49.3004 2300.0 49.6912 2200.0 52.6112 2300.0 55.875 2200.0 58.0648 360000.0 60.1157 2300.0 62.0236 2400.0 62.4164 2400.0 63.9256 2400.0 64.886 2300.0 65.8452 2500.0 72.4967 2500.0 74.3368 2200.0 76.8394 2300.0 79.2131 2300.0 80.888 2600.0 86.0599 3100.0 86.0961 2600.0 90.1133 2300.0 95.1599 2500.0 121.0648 3200.0 123.0432 5700.0 123.7098 2500.0 125.7634 2400.0 127.897 2200.0 128.2487 2100.0 130.2247 2300.0 136.2888 2300.0 137.0229 60000.0 138.725 2500.0 141.6196 2300.0 143.4147 2300.0 143.7984 2500.0 146.0962 7600.0 147.7881 2500.0 154.0487 4800.0 158.1472 2500.0 160.2884 2700.0 160.9246 2600.0 173.2574 2700.0 173.5283 53000.0 173.5388 25000.0 174.0912 38000.0 175.0985 9000.0 183.199 2300.0 184.925 2500.0 189.1988 2500.0 190.0855 8200.0 191.0942 13000.0 192.1014 4900.0 195.079 2900.0 200.8878 2700.0 205.0647 50000.0 206.1173 66000.0 208.6325 2500.0 218.9716 2500.0 219.0807 4700.0 222.0671 5400.0 223.0761 7000.0 232.9291 2400.0 233.0597 150000.0 234.0677 2800.0 237.0908 180000.0 247.0759 2900.0 250.0625 31000.0 251.0701 170000.0 252.0779 11000.0 253.0491 2600.0 254.0941 3300.0 255.1015 51000.0 265.0857 1100000.0 266.0927 5000.0 267.5219 2800.0 268.0727 23000.0 269.1173 2300.0 282.0892 45000.0 283.0966 460000.0 283.1323 4700.0 285.1122 6500.0 297.1122 300000.0 302.602 2300.0 310.2665 2700.0 313.0823 2200.0 END IONS BEGIN IONS SCANS=241 PEPMASS=554.1695 CHARGE=1 COLLISION_ENERGY=0.0 62.1669 2400.0 63.7969 2100.0 65.0384 23000.0 66.8968 2200.0 67.0541 3800.0 68.9969 28000.0 69.5997 2200.0 70.9555 2400.0 71.0489 2400.0 72.3952 2300.0 75.0438 49000.0 75.6447 2500.0 77.0388 6200.0 78.0463 18000.0 79.0541 18000.0 83.8825 2300.0 85.0281 36000.0 87.6551 2300.0 89.0385 2700.0 89.0595 32000.0 91.054 120000.0 93.0333 370000.0 93.0402 6300.0 93.0696 55000.0 95.049 52000.0 97.0645 17000.0 97.3264 2100.0 100.6409 2200.0 103.054 46000.0 105.0447 2900.0 105.0698 18000.0 106.0411 190000.0 107.049 31000.0 109.0644 5100.0 111.0438 4600.0 117.0333 16000.0 117.6729 2400.0 118.0416 5300.0 119.0491 27000.0 121.0285 15000.0 121.0646 390000.0 121.0763 8500.0 121.4287 2600.0 122.037 2400.0 122.0725 5700.0 123.0438 15000.0 123.0802 9800.0 123.7527 2300.0 125.0595 230000.0 131.049 58000.0 132.0568 17000.0 133.0646 18000.0 134.0361 30000.0 135.044 36000.0 135.0802 6400.0 137.0596 33000.0 139.0753 48000.0 144.1401 2300.0 145.0285 35000.0 147.0435 14000.0 148.0518 28000.0 149.0596 1200000.0 151.0753 70000.0 152.7847 2600.0 153.0544 36000.0 153.091 460000.0 154.0624 14000.0 156.0316 2600.0 156.4267 2500.0 159.0439 12000.0 160.0517 22000.0 161.06 3200.0 162.1851 2500.0 163.025 3900.0 163.039 170000.0 163.0755 56000.0 165.0543 4200.0 166.0624 15000.0 167.0705 150000.0 167.0854 4700.0 173.0603 3000.0 173.5264 11000.0 173.5397 12000.0 176.0452 2800.0 177.0408 22000.0 177.0549 1300000.0 179.0161 6900.0 179.0706 55000.0 180.042 47000.0 180.0783 54000.0 181.0497 20000.0 181.056 4700.0 181.071 14000.0 181.0861 980000.0 181.7618 2600.0 182.094 93000.0 191.0705 280000.0 191.089 4200.0 192.0581 5600.0 192.0783 270000.0 194.0569 4000.0 195.0655 110000.0 205.0498 3200.0 207.0659 10000.0 207.0897 12000.0 207.1775 2500.0 208.0377 6200.0 209.0646 18000.0 209.0813 1500000.0 210.0891 120000.0 222.0524 2700.0 223.0427 23000.0 223.0608 1300000.0 267.0857 2600.0 270.6929 2500.0 299.3516 2400.0 307.056 2800.0 344.957 2600.0 383.1141 49000.0 417.808 2700.0 END IONS BEGIN IONS SCANS=242 PEPMASS=344.186 CHARGE=1 COLLISION_ENERGY=0.0 51.5295 2400.0 55.661 2200.0 57.149 2400.0 58.0648 620000.0 58.0698 8800.0 59.2803 2900.0 60.9789 2200.0 61.033 2500.0 64.8418 2400.0 70.0716 2600.0 70.8595 2200.0 81.052 2500.0 82.0171 2500.0 86.397 2100.0 91.8743 2100.0 101.9308 2600.0 102.4038 2600.0 104.5404 2500.0 107.0487 250000.0 114.5087 2600.0 121.0644 52000.0 135.0796 2300.0 141.7962 2400.0 145.0644 50000.0 147.0796 5800.0 161.0604 5500.0 167.0701 41000.0 173.0597 51000.0 173.5222 4000.0 173.5365 38000.0 175.0753 3500.0 179.0708 2900.0 181.086 11000.0 181.6573 2400.0 192.0776 2400.0 193.0859 17000.0 205.0861 34000.0 207.08 9600.0 207.1021 13000.0 222.1121 21000.0 224.1276 12000.0 235.0754 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276.1142 3900.0 277.0892 12000.0 277.1226 85000.0 278.0942 36000.0 279.1019 73000.0 280.1096 7800.0 282.0904 2600.0 284.0694 6600.0 284.1046 200000.0 285.1124 28000.0 287.1048 3100.0 289.0881 7000.0 289.124 2700.0 290.094 70000.0 290.8876 2800.0 291.1019 160000.0 293.1178 90000.0 294.1253 84000.0 295.0965 50000.0 297.1131 35000.0 304.11 3300.0 305.1175 180000.0 306.1254 170000.0 307.0968 100000.0 308.1062 2600.0 308.9008 33000.0 309.1136 12000.0 310.0793 3700.0 310.1203 200000.0 310.1583 3800.0 311.1275 12000.0 321.1127 9500.0 322.1207 70000.0 323.1271 3700.0 324.1367 5400.0 325.1433 40000.0 334.4759 2600.0 337.1438 86000.0 355.1582 5100.0 END IONS BEGIN IONS SCANS=245 PEPMASS=570.2547 CHARGE=1 COLLISION_ENERGY=0.0 63.7152 2500.0 74.6185 2200.0 75.8908 2200.0 76.9755 2100.0 80.7013 2400.0 82.3573 2300.0 82.3929 2100.0 82.9319 2600.0 83.049 9200.0 95.0491 3700.0 103.0541 3700.0 109.0651 2900.0 111.5792 2200.0 117.5548 2800.0 121.0646 2800.0 124.0522 3500.0 125.0595 4300.0 128.0624 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279.3701 2700.0 284.1042 44000.0 285.1122 21000.0 286.2793 2700.0 286.3068 2800.0 290.0928 6800.0 291.0991 6600.0 293.1169 32000.0 294.1241 18000.0 297.1126 19000.0 302.518 2300.0 305.117 68000.0 306.125 47000.0 307.0963 3300.0 310.12 32000.0 311.1277 7500.0 322.1197 23000.0 325.1429 130000.0 325.1882 4200.0 327.1588 2600.0 337.1431 120000.0 343.1552 3500.0 355.153 35000.0 362.8528 2500.0 578.8154 2600.0 END IONS BEGIN IONS SCANS=246 PEPMASS=373.1647 CHARGE=1 COLLISION_ENERGY=0.0 55.6569 2300.0 63.9695 2000.0 66.0062 2400.0 67.3674 2200.0 73.7411 2300.0 79.0175 2200.0 82.2403 2200.0 91.0544 2600.0 105.0335 3600.0 109.0644 6400.0 111.0436 2600.0 115.6396 2600.0 121.6692 2100.0 122.0362 3000.0 125.0592 3900.0 129.0696 4000.0 131.0485 14000.0 136.0518 8200.0 137.048 4600.0 137.0594 260000.0 147.0441 5300.0 149.059 6300.0 151.0384 11000.0 151.0751 100000.0 153.0537 5800.0 154.7753 3200.0 155.3067 2500.0 157.065 15000.0 158.0724 3100.0 163.0758 2800.0 165.0915 2800.0 167.2104 2700.0 172.0882 14000.0 173.5234 21000.0 173.5351 36000.0 173.5444 14000.0 174.0674 34000.0 175.0752 30000.0 177.0909 17000.0 179.0705 3600.0 187.0752 29000.0 188.083 45000.0 189.0909 150000.0 191.1071 2500.0 201.091 250000.0 201.1134 4600.0 203.1066 73000.0 205.3626 2600.0 213.0914 10000.0 217.0863 3200.0 224.4708 2300.0 231.1018 46000.0 233.0966 6700.0 241.084 2500.0 245.095 2800.0 246.1035 4600.0 247.075 2500.0 251.107 3600.0 253.087 3200.0 254.0945 4500.0 261.0907 28000.0 262.0989 24000.0 265.1209 4500.0 268.1442 2500.0 269.0809 14000.0 270.0882 5200.0 273.0903 2500.0 274.0992 23000.0 275.1045 3800.0 277.0912 3600.0 277.1226 26000.0 278.0938 13000.0 279.102 14000.0 284.1047 45000.0 285.1142 3900.0 287.9091 2500.0 290.0951 15000.0 291.1021 27000.0 293.1172 33000.0 294.1252 31000.0 295.0969 5400.0 297.114 18000.0 305.1175 58000.0 306.1258 39000.0 307.0974 18000.0 309.1124 5100.0 310.1204 57000.0 322.1205 22000.0 325.1443 28000.0 337.1442 34000.0 END IONS BEGIN IONS SCANS=247 PEPMASS=575.21 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140000.0 71.7616 2800.0 71.7643 11000.0 73.028 12000.0 75.0438 7000.0 76.4757 2500.0 81.0332 11000.0 83.0486 33000.0 85.0279 310000.0 85.0338 3800.0 87.0435 49000.0 91.0388 3800.0 95.0489 5700.0 95.1052 2300.0 97.0279 130000.0 99.0435 19000.0 101.023 3200.0 109.0279 12000.0 111.0435 22000.0 113.059 4500.0 115.0384 65000.0 117.0541 7300.0 123.044 2800.0 123.8962 2300.0 127.0384 32000.0 129.0541 61000.0 133.0491 22000.0 137.0594 3100.0 139.0379 2400.0 145.0491 27000.0 145.0615 3200.0 149.0441 4500.0 149.0578 2900.0 151.0402 2700.0 151.0756 3400.0 153.0182 6000.0 153.0539 8800.0 171.0645 15000.0 173.5216 24000.0 173.5408 41000.0 179.0691 2900.0 225.0753 8000.0 245.2788 2500.0 248.2799 2400.0 258.0529 2500.0 261.0962 9600.0 286.9793 22000.0 286.997 13000.0 287.0549 3300000.0 287.1296 24000.0 287.1505 5200.0 299.055 8700.0 329.0663 16000.0 353.062 4200.0 529.0477 2800.0 612.7719 2500.0 END IONS BEGIN IONS SCANS=250 PEPMASS=595.1658 CHARGE=1 COLLISION_ENERGY=0.0 69.3858 2100.0 71.0487 31000.0 77.3926 2600.0 78.1976 2100.0 80.4254 2500.0 82.0217 2200.0 85.028 46000.0 92.3404 2700.0 95.2094 2400.0 97.0281 4000.0 129.0541 2500.0 145.1802 2400.0 153.5209 2200.0 157.6064 2500.0 165.3761 2200.0 173.5236 8200.0 173.5323 39000.0 173.5435 3200.0 174.159 2800.0 194.0182 2400.0 223.0726 2300.0 241.9687 2400.0 287.0164 3600.0 287.0551 400000.0 287.0914 5800.0 291.8618 2400.0 312.9709 2600.0 371.6186 2500.0 409.0896 2300.0 428.5607 2300.0 481.5931 2500.0 END IONS BEGIN IONS SCANS=251 PEPMASS=311.0669 CHARGE=1 COLLISION_ENERGY=0.0 51.3582 2200.0 51.9028 2300.0 55.0079 2400.0 57.5655 2300.0 57.6156 2200.0 60.9288 2600.0 64.0592 2200.0 67.7854 2300.0 70.8391 2500.0 73.9189 2300.0 78.4112 2300.0 89.2111 2000.0 94.9361 2400.0 96.044 17000.0 105.0329 9900.0 113.5761 3000.0 120.0446 2300.0 121.587 2100.0 122.0234 4900.0 122.7671 2400.0 137.8557 2100.0 148.0389 51000.0 170.0591 2700.0 172.7013 2300.0 173.5225 23000.0 173.5408 37000.0 174.8948 2500.0 184.0758 3700.0 185.0709 6900.0 186.0557 4100.0 194.0605 4400.0 199.0865 17000.0 209.071 41000.0 210.0552 56000.0 211.0862 9600.0 212.0702 6400.0 213.0661 11000.0 221.0717 7500.0 222.0545 3800.0 226.0486 2500.0 227.0816 51000.0 237.0659 92000.0 238.0498 82000.0 238.074 8400.0 239.0819 11000.0 240.0668 3500.0 241.0606 23000.0 247.0501 8900.0 247.6087 2400.0 249.0658 4500.0 250.05 3000.0 252.0287 2800.0 254.0691 5000.0 255.0763 50000.0 264.0526 2700.0 265.0607 100000.0 266.0448 42000.0 269.0559 59000.0 282.063 2800.0 283.0715 64000.0 293.0561 110000.0 293.0937 3200.0 294.0643 2600.0 311.0055 2700.0 311.0662 240000.0 END IONS BEGIN IONS SCANS=252 PEPMASS=304.1912 CHARGE=1 COLLISION_ENERGY=0.0 49.109 2500.0 55.568 2500.0 66.9008 2400.0 67.6467 2100.0 68.0495 3200.0 70.7195 2200.0 75.3349 2300.0 75.8285 2300.0 82.8563 2200.0 83.1621 2600.0 86.9027 2300.0 86.9531 2100.0 107.0849 5800.0 107.6262 2100.0 110.0962 27000.0 119.049 3600.0 124.3232 2600.0 125.0959 3800.0 126.3388 2500.0 128.8492 2800.0 137.0595 120000.0 145.823 2500.0 147.0445 3200.0 148.062 2500.0 152.9186 2700.0 153.6396 2500.0 164.0705 220000.0 173.5248 7500.0 173.535 64000.0 175.0388 4400.0 180.8878 14000.0 185.8264 2600.0 190.8723 3600.0 191.4848 2500.0 202.0867 28000.0 203.094 10000.0 204.102 110000.0 206.891 2500.0 207.0649 3000.0 208.8831 58000.0 223.1222 3200.0 226.2115 3400.0 226.7482 2600.0 226.8936 28000.0 227.1302 2400.0 229.1223 4400.0 230.1245 2400.0 244.1342 14000.0 246.1487 2000000.0 251.9019 2500.0 252.2504 2600.0 265.946 2700.0 304.133 3000.0 304.1514 5300.0 304.1909 540000.0 304.2293 5400.0 END IONS BEGIN IONS SCANS=253 PEPMASS=382.7086 CHARGE=1 COLLISION_ENERGY=0.0 70.0284 13000.0 70.0648 290000.0 72.4092 2200.0 74.878 2300.0 75.5402 2100.0 77.5289 2400.0 84.0805 3000.0 86.0962 1900000.0 86.101 8200.0 87.055 27000.0 87.0788 18000.0 87.0994 31000.0 88.0391 24000.0 91.0539 19000.0 93.1626 2600.0 97.0764 3200.0 98.0598 30000.0 99.055 3300.0 100.0872 2500.0 100.8187 2400.0 105.5171 2200.0 106.2725 2600.0 112.0865 150000.0 113.0951 2900.0 113.5868 24000.0 114.6698 2400.0 115.0498 93000.0 115.0863 22000.0 118.0647 61000.0 119.0487 38000.0 119.0721 4300.0 120.0804 110000.0 121.3742 2100.0 123.0436 51000.0 124.0869 5100.0 125.0707 16000.0 126.0551 8100.0 129.1132 17000.0 131.0493 5700.0 132.0803 5200.0 135.0675 71000.0 136.0753 280000.0 136.0875 3400.0 138.1026 3000.0 140.0817 34000.0 144.0805 6500.0 146.0465 5300.0 146.0596 550000.0 146.0959 30000.0 147.0437 43000.0 147.0629 13000.0 151.1232 2500.0 157.0944 3400.0 157.1082 160000.0 157.1331 37000.0 161.107 4300.0 165.0544 280000.0 165.1003 2400.0 166.1335 3500.0 167.1172 21000.0 169.101 21000.0 171.4464 2400.0 173.5236 34000.0 173.5369 54000.0 177.1054 28000.0 178.1149 42000.0 178.4772 2400.0 182.0634 3000.0 182.081 180000.0 183.0852 2500.0 183.1122 41000.0 183.126 3900.0 186.1137 3200.0 189.1021 55000.0 191.1054 29000.0 192.1134 12000.0 193.1443 3100.0 194.1285 96000.0 195.1126 340000.0 195.1331 5200.0 195.7613 2300.0 196.115 13000.0 197.0962 3600.0 200.1103 81000.0 204.1384 59000.0 209.1395 41000.0 210.1489 4600.0 217.0972 83000.0 217.1337 44000.0 220.1052 2500.0 224.1072 17000.0 226.1662 20000.0 227.1742 24000.0 228.1013 19000.0 234.1241 40000.0 236.0754 2000.0 236.1072 6900.0 236.1504 19000.0 237.1345 160000.0 238.1398 3200.0 243.1129 24000.0 250.1435 140000.0 251.1473 2600.0 253.1763 24000.0 254.1608 870000.0 254.1849 3000.0 255.1632 28000.0 263.152 3200.0 267.6459 9500.0 270.1126 200000.0 271.1154 11000.0 271.1875 20000.0 272.644 2300.0 276.145 15000.0 279.1779 2700.0 280.1401 27000.0 282.1131 25000.0 286.1613 2800.0 290.4149 2300.0 293.1723 27000.0 294.1581 3500.0 296.176 38000.0 299.1391 5200.0 306.1582 2900.0 308.9036 2900.0 311.183 35000.0 312.1825 2700.0 314.1861 18000.0 321.1703 3300.0 322.1545 52000.0 322.1917 3300.0 324.6788 5100.0 336.2146 36000.0 337.1972 13000.0 338.1965 16000.0 339.1841 3200.0 340.1648 16000.0 340.659 2500.0 346.4861 2600.0 352.2083 2700.0 354.2244 130000.0 355.224 84000.0 356.2085 120000.0 360.0291 26000.0 364.2098 37000.0 365.2072 10000.0 368.7119 2600.0 372.2247 4700.0 373.2348 400000.0 373.2875 2800.0 374.2374 35000.0 381.2036 91000.0 382.1797 6700.0 382.2213 41000.0 383.2145 4000.0 390.2503 6600.0 396.1913 8300.0 398.23 14000.0 399.2143 300000.0 399.2664 4200.0 400.2173 24000.0 407.2251 3000.0 411.204 2600.0 420.6791 2800.0 424.2464 50000.0 425.2312 45000.0 426.2625 2800.0 442.2561 170000.0 443.2616 20000.0 448.6555 2900.0 449.2996 38000.0 452.2416 2500.0 467.2336 2600.0 469.2697 3200.0 470.2519 72000.0 471.2539 4600.0 487.2775 7600.0 513.1528 2700.0 521.2392 13000.0 529.4775 2600.0 534.2804 11000.0 535.266 16000.0 555.3393 9600.0 561.2832 4000.0 562.2755 3500.0 562.2938 2800.0 563.2618 6900.0 577.3236 12000.0 578.3096 52000.0 579.3113 26000.0 579.3307 3300.0 580.2881 84000.0 605.3172 20000.0 606.3039 70000.0 607.3149 3200.0 623.2127 8800.0 623.3295 460000.0 623.4186 2000.0 624.3324 60000.0 651.3256 45000.0 END IONS BEGIN IONS SCANS=254 PEPMASS=300.1599 CHARGE=1 COLLISION_ENERGY=0.0 50.016 3800.0 51.0233 6300.0 53.7117 4000.0 54.693 4100.0 58.065 15000.0 77.0388 26000.0 79.0541 42000.0 91.054 23000.0 92.2929 5200.0 93.07 17000.0 95.049 67000.0 103.0543 17000.0 105.0446 21000.0 105.0696 27000.0 105.1679 5300.0 107.0318 71000.0 107.0354 25000.0 107.049 13000000.0 107.0641 190000.0 107.0661 58000.0 107.0712 22000.0 107.0756 13000.0 115.0542 23000.0 117.0697 160000.0 119.0489 18000.0 121.0647 270000.0 124.0516 37000.0 125.1052 5000.0 128.0617 15000.0 129.0697 64000.0 130.0764 4700.0 131.049 43000.0 131.0856 13000.0 133.0646 41000.0 135.0805 7600.0 136.0518 130000.0 137.0594 27000.0 139.0751 38000.0 143.0493 21000.0 144.0568 45000.0 145.0646 1700000.0 145.0751 12000.0 145.0913 8500.0 146.0726 58000.0 147.0804 28000.0 150.0674 76000.0 151.0752 1300000.0 151.0867 9400.0 155.0601 70000.0 157.0643 17000.0 158.0725 510000.0 158.0874 9600.0 159.044 53000.0 159.0805 98000.0 160.0517 6200.0 161.0597 55000.0 161.0956 8100.0 161.2738 5300.0 162.0677 28000.0 163.0753 21000.0 164.0824 6500.0 165.091 390000.0 173.0604 5900.0 173.531 31000.0 173.5391 16000.0 174.0675 1000000.0 174.0932 15000.0 175.0755 55000.0 175.0988 11000.0 176.066 8200.0 176.0832 260000.0 177.0733 9500.0 177.091 500000.0 177.1049 3200.0 178.0868 18000.0 180.102 15000.0 189.0508 12000.0 189.0909 3000000.0 190.0817 5500.0 190.0987 96000.0 192.1018 120000.0 195.0789 4600.0 207.0801 17000.0 208.0876 5100.0 209.0956 22000.0 219.0806 28000.0 220.0879 22000.0 221.0959 52000.0 223.1122 24000.0 224.0836 31000.0 224.1201 5300.0 225.0914 24000.0 226.0978 9500.0 235.0735 7500.0 235.1125 6000.0 236.083 40000.0 237.0908 210000.0 239.0702 24000.0 239.1059 28000.0 240.1148 15000.0 246.7426 5000.0 251.1065 110000.0 252.1143 2000000.0 252.1758 14000.0 253.0854 110000.0 254.0933 110000.0 255.1015 44000.0 255.1337 5200.0 268.1092 1300000.0 271.1332 4900.0 281.1175 23000.0 283.1329 1500000.0 300.1589 52000.0 END IONS BEGIN IONS SCANS=255 PEPMASS=376.2123 CHARGE=1 COLLISION_ENERGY=0.0 55.5355 2200.0 58.0651 150000.0 59.073 10000.0 59.6842 2100.0 62.9386 2100.0 65.3128 2200.0 69.0828 2300.0 71.3375 2200.0 71.5228 2300.0 81.2259 2900.0 96.7174 2600.0 98.8909 2700.0 103.8979 2200.0 107.0493 2800.0 109.3048 2600.0 118.0849 2500.0 131.1086 2100.0 135.081 4100.0 142.603 2100.0 147.0805 14000.0 148.8088 2300.0 163.0755 83000.0 164.0833 630000.0 164.0994 4700.0 173.523 6100.0 173.5389 35000.0 176.084 4400.0 177.0912 140000.0 178.084 11000.0 178.099 1200000.0 191.1068 36000.0 191.8434 2200.0 192.1146 270000.0 197.0675 2400.0 209.1413 59000.0 222.13 7000.0 222.1491 1100000.0 229.9272 3000.0 236.1643 25000.0 237.1434 9300.0 237.1515 8400.0 237.1725 850000.0 272.449 2700.0 284.1412 13000.0 298.6677 2400.0 306.5042 2300.0 318.2376 2900.0 321.5779 2400.0 329.4851 3200.0 343.2145 24000.0 348.1642 2700.0 END IONS BEGIN IONS SCANS=256 PEPMASS=492.2597 CHARGE=1 COLLISION_ENERGY=0.0 58.062 4200.0 58.0648 160000.0 60.2525 2200.0 60.6283 2300.0 61.0283 7300.0 61.4871 2100.0 69.0332 37000.0 71.0489 5400.0 72.6657 2300.0 74.9794 2400.0 79.0463 2700.0 81.0334 4000.0 85.0281 120000.0 87.0439 16000.0 89.4731 2100.0 91.0389 3300.0 91.0539 3200.0 91.5527 2200.0 93.0699 3200.0 95.0482 3700.0 97.0282 30000.0 99.0436 12000.0 101.023 3200.0 103.0383 2600.0 107.0488 47000.0 108.8763 2300.0 109.028 16000.0 117.635 2400.0 119.0488 16000.0 119.0851 3200.0 121.0645 360000.0 121.0743 7700.0 123.0804 4100.0 124.0516 3500.0 125.0595 12000.0 127.0385 33000.0 128.5908 2300.0 129.0699 2600.0 133.0646 27000.0 135.0802 28000.0 137.0593 16000.0 139.075 28000.0 141.0906 7100.0 145.0504 13000.0 145.0644 46000.0 147.0801 220000.0 149.059 9100.0 149.0954 11000.0 150.0674 3000.0 150.8086 2300.0 151.0751 120000.0 152.0833 6300.0 159.0802 21000.0 161.0958 35000.0 163.0752 160000.0 165.0908 270000.0 167.1067 11000.0 171.0802 2400.0 173.0954 12000.0 173.5189 5600.0 173.5284 20000.0 173.5369 51000.0 176.0831 2600.0 177.0908 44000.0 179.0137 2500.0 179.1065 16000.0 183.0809 6800.0 189.0905 2800.0 191.1064 83000.0 197.0961 22000.0 225.0916 19000.0 225.1272 96000.0 235.1112 3000.0 238.0997 7800.0 253.1219 130000.0 254.1295 18000.0 256.1091 36000.0 257.1178 6900.0 257.1523 16000.0 267.1376 16000.0 270.1248 130000.0 271.1334 2500.0 283.1326 11000.0 285.1109 4500.0 285.1485 1200000.0 309.1484 20000.0 327.159 35000.0 330.2062 67000.0 330.2427 3100.0 378.9906 2400.0 492.2596 190000.0 END IONS BEGIN IONS SCANS=257 PEPMASS=506.2754 CHARGE=1 COLLISION_ENERGY=0.0 61.0284 2900.0 67.1473 2200.0 69.0334 41000.0 73.0285 3000.0 75.0439 3300.0 77.923 2300.0 81.0333 13000.0 85.0282 120000.0 87.0438 14000.0 89.7382 2400.0 91.0539 3900.0 95.0488 3900.0 95.8373 2600.0 97.0282 33000.0 99.044 10000.0 101.0602 3200.0 104.7293 2200.0 107.0491 52000.0 108.2462 2100.0 109.0283 20000.0 109.377 2700.0 111.0437 2400.0 117.0343 2500.0 119.0488 26000.0 119.0856 7700.0 121.0554 3300.0 121.0646 460000.0 121.0729 2000.0 123.0806 5600.0 125.0596 15000.0 127.0388 36000.0 131.048 3000.0 133.0646 46000.0 135.0439 2700.0 135.0803 33000.0 137.0598 12000.0 139.0753 38000.0 141.091 6300.0 145.0514 9800.0 145.0646 51000.0 147.0802 270000.0 149.0598 14000.0 149.0961 7800.0 151.0752 150000.0 152.0831 7700.0 159.0803 24000.0 160.088 3000.0 161.0959 46000.0 163.0609 3800.0 163.0753 170000.0 164.0853 2900.0 165.077 2000.0 165.0909 310000.0 167.1066 12000.0 171.08 3200.0 173.096 11000.0 173.5245 25000.0 173.5408 44000.0 177.0745 3900.0 177.091 50000.0 179.1066 13000.0 182.4962 2400.0 183.0798 8300.0 189.0906 10000.0 190.8822 2500.0 191.1065 100000.0 196.0877 2700.0 197.0957 18000.0 206.4604 2500.0 207.6468 2200.0 210.7933 2500.0 211.1134 3000.0 219.5987 2200.0 224.0823 3800.0 225.0905 14000.0 225.1273 120000.0 235.1121 8100.0 238.0985 12000.0 240.858 2600.0 243.1366 2500.0 244.7525 2500.0 253.1218 160000.0 254.1301 18000.0 256.1092 40000.0 257.1176 5600.0 257.1528 12000.0 267.1375 20000.0 270.1251 170000.0 271.1338 2600.0 277.1213 2400.0 283.1334 16000.0 285.1209 6900.0 285.1486 1700000.0 292.9128 2500.0 309.1488 24000.0 310.787 2700.0 327.1587 43000.0 342.4223 2400.0 344.218 2800.0 398.8828 2700.0 433.1512 2600.0 437.9278 2900.0 449.5094 2600.0 506.274 170000.0 511.6328 2200.0 END IONS BEGIN IONS SCANS=258 PEPMASS=757.2191 CHARGE=1 COLLISION_ENERGY=0.0 71.0487 52000.0 74.6841 2500.0 80.4236 2400.0 81.0333 6200.0 83.0487 17000.0 84.4645 2200.0 85.0279 120000.0 85.034 2500.0 85.2947 2300.0 87.0435 17000.0 90.2781 2300.0 96.0698 2200.0 97.0279 45000.0 99.0439 3200.0 102.8118 2500.0 103.1862 2400.0 107.8844 2300.0 111.0437 13000.0 115.0385 26000.0 115.0473 2300.0 126.7485 2400.0 127.0387 11000.0 129.0542 20000.0 133.0491 3700.0 134.6731 2400.0 145.0491 2800.0 151.0377 2300.0 152.1196 2300.0 173.5238 24000.0 173.533 24000.0 173.5428 13000.0 218.557 2500.0 221.7879 2800.0 227.548 2700.0 230.0829 2500.0 245.309 2300.0 280.778 2700.0 285.0399 2800.0 287.0553 32000.0 302.0432 17000.0 317.0654 1600000.0 359.0744 13000.0 538.5103 2500.0 650.4453 2800.0 END IONS BEGIN IONS SCANS=259 PEPMASS=579.1508 CHARGE=1 COLLISION_ENERGY=0.0 64.5334 2300.0 64.723 2200.0 68.927 2500.0 69.4317 2100.0 71.4262 2500.0 72.5012 2600.0 73.986 2300.0 76.7417 2500.0 78.4298 2300.0 81.7393 2900.0 84.9374 2500.0 88.2515 2500.0 88.9675 2500.0 89.1601 2700.0 90.443 2400.0 90.5051 2500.0 92.1054 2500.0 109.313 2300.0 117.3584 2400.0 119.0481 3000.0 119.2661 2200.0 123.0337 15000.0 123.0435 610000.0 123.0547 3400.0 127.0282 7600.0 127.0385 510000.0 127.0498 6500.0 128.1241 2100.0 128.6396 2400.0 135.0436 91000.0 139.0273 4200.0 139.0385 270000.0 139.051 3100.0 142.8467 2100.0 146.8519 2600.0 147.0436 70000.0 151.0385 39000.0 154.9769 2300.0 160.7628 2200.0 161.0594 16000.0 161.4562 2800.0 162.225 3900.0 163.0386 270000.0 163.3798 2600.0 165.0542 93000.0 167.0337 36000.0 169.0494 2500.0 169.5035 2500.0 169.8833 2500.0 173.5208 7200.0 173.5291 61000.0 173.5406 33000.0 177.054 14000.0 179.0335 22000.0 180.5844 2200.0 181.0196 2500.0 181.0495 17000.0 187.0386 27000.0 191.0336 31000.0 193.0491 11000.0 195.2999 3100.0 197.1178 2400.0 201.054 11000.0 203.0333 31000.0 203.0702 7500.0 205.0493 19000.0 207.065 22000.0 215.0691 2500.0 217.0492 2700.0 229.0492 32000.0 229.1847 3000.0 231.0663 2600.0 232.0892 2800.0 233.0443 27000.0 243.0651 43000.0 245.0442 110000.0 247.0597 150000.0 255.0648 20000.0 257.0441 100000.0 259.0598 41000.0 261.0759 3100.0 267.9466 2400.0 269.0444 21000.0 271.06 160000.0 273.0767 12000.0 275.0551 150000.0 283.0602 96000.0 285.0758 25000.0 287.0551 530000.0 291.0857 18000.0 295.0614 2700.0 299.0552 130000.0 301.0717 40000.0 303.0867 6400.0 311.0542 2700.0 363.2834 2900.0 391.0811 7200.0 391.3152 2800.0 400.7737 2900.0 409.0921 260000.0 411.1061 7800.0 421.0937 7200.0 433.0919 2800.0 435.1074 13000.0 451.3876 2400.0 END IONS BEGIN IONS SCANS=260 PEPMASS=346.2017 CHARGE=1 COLLISION_ENERGY=0.0 50.691 2400.0 52.0444 2700.0 52.0546 2300.0 54.3073 2000.0 56.0349 2300.0 57.8345 2500.0 60.0808 21000.0 64.4422 2200.0 69.7594 2300.0 80.9905 2400.0 81.0699 2500.0 81.2363 2300.0 91.0483 3200.0 91.0542 120000.0 95.0491 39000.0 101.0146 2500.0 101.2231 2500.0 107.0491 50000.0 107.2053 2300.0 109.0648 22000.0 111.044 25000.0 116.0313 2300.0 117.0698 150000.0 119.0491 120000.0 119.0863 2900.0 121.0648 38000.0 123.035 4300.0 123.0439 180000.0 124.129 2400.0 125.0597 32000.0 126.1409 2100.0 131.0491 39000.0 133.0648 51000.0 135.044 200000.0 135.0559 3400.0 135.0807 19000.0 136.0513 3700.0 137.0596 2500000.0 137.084 5600.0 138.0684 5800.0 139.0749 2500.0 143.0492 16000.0 145.0514 9100.0 145.0647 430000.0 145.0747 2600.0 146.0728 6100.0 147.0442 12000.0 147.0802 16000.0 149.0231 11000.0 149.0596 280000.0 149.0738 3100.0 149.0965 8200.0 150.0675 48000.0 151.0629 10000.0 151.0753 1100000.0 151.0957 2900.0 152.0831 16000.0 153.0552 12000.0 153.091 7100.0 157.0638 3800.0 159.0798 3700.0 160.4205 2600.0 161.0596 51000.0 162.0675 13000.0 163.059 3400.0 163.0754 620000.0 163.091 6400.0 164.0813 6600.0 165.0911 95000.0 173.0607 2800.0 173.5289 51000.0 173.5408 21000.0 175.0753 14000.0 177.0734 4900.0 177.0911 770000.0 178.0993 19000.0 181.0649 21000.0 181.1012 58000.0 187.0742 5500.0 190.1088 2500.0 191.0859 22000.0 194.0727 7100.0 195.0806 26000.0 198.0675 9700.0 199.0749 22000.0 199.1129 3100.0 209.0607 15000.0 209.0962 270000.0 209.118 5100.0 211.0708 2400.0 212.0847 4100.0 213.091 16000.0 219.0804 38000.0 222.0687 2900.0 223.112 24000.0 226.0623 40000.0 226.0983 3000.0 226.7343 2600.0 227.0692 35000.0 227.1068 500000.0 230.3 2500.0 237.091 310000.0 240.0781 35000.0 241.0905 3600.0 241.1223 180000.0 251.1065 28000.0 254.094 3200.0 255.0701 2800.0 255.1015 520000.0 255.1325 11000.0 258.0884 100000.0 259.0999 3100.0 259.1328 22000.0 269.1172 170000.0 287.0896 3400.0 287.1279 750000.0 302.7144 3100.0 346.2008 67000.0 END IONS BEGIN IONS SCANS=261 PEPMASS=404.1558 CHARGE=1 COLLISION_ENERGY=0.0 57.0332 59000.0 59.5287 2400.0 60.7301 2200.0 61.8211 2600.0 63.5819 2100.0 64.1598 2500.0 64.9778 2300.0 66.1941 2300.0 67.0247 2700.0 67.4449 2500.0 71.9586 2400.0 73.028 9100.0 73.4315 2400.0 75.0437 72000.0 75.4233 2500.0 76.7274 2400.0 85.028 66000.0 87.9058 2300.0 88.3413 2500.0 91.0539 2300000.0 91.0619 16000.0 91.0639 8200.0 94.7177 2300.0 95.0125 17000.0 96.5839 2700.0 101.0688 2600.0 103.0391 2800.0 113.0231 31000.0 118.0864 3700.0 119.0488 25000.0 121.9829 2500.0 122.5374 2500.0 122.9603 2400.0 129.1658 2300.0 131.0334 29000.0 137.0481 3500.0 137.0594 270000.0 137.0714 4100.0 141.0179 190000.0 144.9818 2700.0 145.0211 2200.0 159.0288 12000.0 162.5924 2500.0 165.0707 2300.0 169.6627 2300.0 173.5235 15000.0 173.5331 100000.0 173.5429 22000.0 174.8128 2600.0 181.0115 2700.0 188.6071 2700.0 193.0654 14000.0 193.0859 1300000.0 193.1066 16000.0 193.434 2300.0 202.544 2800.0 211.097 9800.0 252.1297 2400.0 255.4798 2500.0 261.524 2300.0 331.1441 2800.0 347.6565 2400.0 359.949 2300.0 380.4065 2400.0 386.5981 2500.0 409.9354 2300.0 END IONS BEGIN IONS SCANS=262 PEPMASS=684.2505 CHARGE=1 COLLISION_ENERGY=0.0 67.3394 2500.0 69.0331 37000.0 71.0254 2600.0 78.8587 2400.0 79.2661 2200.0 83.0484 2200.0 85.0281 30000.0 87.0386 2900.0 87.0436 46000.0 97.0225 3400.0 97.028 52000.0 114.4094 2500.0 115.0385 58000.0 119.7259 2500.0 127.0389 2600.0 131.2959 3100.0 133.049 26000.0 137.0479 4900.0 137.0593 220000.0 146.8815 2400.0 150.0758 7700.0 161.0602 3800.0 173.5273 50000.0 173.5447 9300.0 175.0755 8300.0 189.0541 2600.0 194.7145 2900.0 201.0546 16000.0 203.0712 3400.0 207.0651 26000.0 219.0647 13000.0 228.3723 2400.0 231.0639 9400.0 237.0896 3700.0 265.0856 25000.0 277.0855 4800.0 279.1017 3000.0 283.0961 5700.0 293.0809 40000.0 293.8405 2400.0 297.1123 23000.0 305.0795 13000.0 307.0968 60000.0 309.1122 8700.0 311.0887 4700.0 323.0908 5600.0 325.1073 150000.0 337.1066 26000.0 343.1176 36000.0 355.1169 5300.0 363.5962 2600.0 END IONS BEGIN IONS SCANS=263 PEPMASS=621.1796 CHARGE=1 COLLISION_ENERGY=0.0 65.2057 2500.0 67.0423 2400.0 68.6571 2200.0 71.1145 2400.0 71.3085 2300.0 76.2461 2300.0 84.5222 2300.0 84.7049 2200.0 92.7811 2200.0 93.109 2300.0 97.6644 2100.0 100.442 2400.0 115.3398 3100.0 115.6548 2300.0 122.6011 2500.0 126.4182 2400.0 131.5866 2400.0 141.1395 2300.0 143.0307 6000.0 149.6896 5200.0 173.5267 60000.0 173.5422 22000.0 181.6407 2700.0 217.2791 2500.0 221.0806 7500.0 253.7471 2500.0 275.5473 2500.0 293.2797 2300.0 361.0246 54000.0 375.078 2800.0 381.0954 16000.0 404.0193 3000.0 411.1065 17000.0 435.1054 9900.0 441.117 27000.0 446.6597 2600.0 453.1154 16000.0 459.1241 6100.0 465.1172 21000.0 471.1251 5500.0 477.1138 4100.0 483.1266 91000.0 495.1273 30000.0 501.1363 95000.0 507.1269 8000.0 513.1369 120000.0 519.126 3400.0 525.1372 12000.0 531.1469 57000.0 549.1383 29000.0 567.1479 71000.0 585.1584 130000.0 603.1687 160000.0 621.1791 60000.0 END IONS BEGIN IONS SCANS=264 PEPMASS=599.1978 CHARGE=1 COLLISION_ENERGY=0.0 68.1481 2300.0 69.0334 5800.0 70.4862 5900.0 75.813 5700.0 77.0385 6000.0 78.0627 6200.0 81.0333 32000.0 81.4632 6500.0 85.0282 270000.0 86.4127 7900.0 92.3029 2300.0 95.049 24000.0 97.0283 57000.0 98.4621 2400.0 99.4506 2700.0 99.8086 2200.0 101.2828 3400.0 103.0386 58000.0 103.3931 6200.0 107.049 6100000.0 107.0552 32000.0 107.066 18000.0 109.0281 38000.0 111.1629 2700.0 111.3515 3200.0 113.3262 3200.0 114.0319 3300.0 121.0281 33000.0 121.0647 48000.0 122.2125 5800.0 127.0393 6900.0 129.0539 2400.0 131.0492 47000.0 131.3712 3800.0 134.8061 3800.0 135.1676 2100.0 136.2624 3300.0 139.0385 45000.0 147.0436 27000.0 148.9082 5500.0 149.0595 95000.0 151.0078 5700.0 151.0388 83000.0 152.4178 2700.0 157.1159 2600.0 163.0388 160000.0 173.0593 49000.0 173.5212 7700.0 173.5348 220000.0 175.0389 160000.0 177.0553 3700.0 179.032 7500.0 181.0494 130000.0 181.3842 5800.0 183.7405 3100.0 187.0385 22000.0 189.0548 39000.0 189.8228 2300.0 191.0337 98000.0 193.0495 220000.0 199.039 2700.0 200.862 2900.0 201.0545 19000.0 201.2798 6000.0 203.0334 22000.0 205.0495 460000.0 205.0712 4500.0 207.0654 18000.0 211.0602 58000.0 213.0548 18000.0 215.0343 3300.0 215.0691 3500.0 217.0496 640000.0 219.0289 90000.0 219.0653 68000.0 221.0446 170000.0 223.0602 210000.0 229.0495 120000.0 231.0284 27000.0 231.0654 130000.0 233.0444 90000.0 235.033 3800.0 235.06 810000.0 235.088 4700.0 241.0497 87000.0 243.0656 76000.0 245.0452 50000.0 245.0804 45000.0 247.0303 4800.0 247.0599 720000.0 249.0404 18000.0 249.0745 24000.0 253.0467 7600.0 255.0651 68000.0 257.0444 59000.0 259.0284 18000.0 259.0598 1100000.0 261.0404 15000.0 261.0759 42000.0 263.0549 4600.0 264.1731 3000.0 265.0708 52000.0 267.0651 7000.0 269.0443 39000.0 269.0806 13000.0 271.0601 430000.0 273.043 16000.0 273.0756 230000.0 275.0561 51000.0 275.0887 27000.0 277.0708 670000.0 279.0649 4200.0 281.0814 12000.0 283.0601 260000.0 285.0762 120000.0 287.0551 100000.0 287.0916 330000.0 289.0707 570000.0 293.0806 32000.0 295.058 26000.0 295.657 6300.0 297.0753 110000.0 299.0551 64000.0 299.0917 380000.0 301.04 2000.0 301.0708 1100000.0 301.1034 2400.0 305.0721 32000.0 307.0127 2400.0 307.0819 98000.0 309.0762 25000.0 311.0551 51000.0 311.0916 410000.0 313.0707 560000.0 313.1101 3000.0 315.0866 82000.0 317.1025 110000.0 319.0816 220000.0 323.0911 170000.0 325.0707 420000.0 325.1079 27000.0 327.0864 320000.0 329.0602 18000.0 329.0684 5400.0 329.102 810000.0 329.1466 9800.0 329.2567 2500.0 331.0813 71000.0 335.089 75000.0 337.0695 54000.0 337.1058 21000.0 339.0864 62000.0 341.0597 26000.0 341.1017 570000.0 341.1494 3900.0 343.0813 350000.0 347.0897 85000.0 349.108 7500.0 353.0514 18000.0 353.1016 1700000.0 353.1378 3800.0 353.1525 30000.0 355.0809 250000.0 357.1011 8200.0 359.0905 40000.0 361.0939 120000.0 363.0874 9300.0 365.0481 16000.0 365.1015 1200000.0 365.1554 16000.0 367.0805 110000.0 367.1247 9100.0 371.0917 17000.0 371.1018 6900.0 373.0933 73000.0 376.1688 3700.0 377.051 4700.0 377.102 510000.0 379.1181 76000.0 381.0966 54000.0 383.1125 760000.0 383.1563 2500.0 385.0932 89000.0 389.1018 350000.0 391.1167 61000.0 393.0968 110000.0 393.1494 3000.0 395.1125 1700000.0 401.1037 86000.0 403.1133 88000.0 407.0497 7800.0 407.1126 980000.0 407.1752 13000.0 407.205 4000.0 411.1074 49000.0 413.1217 370000.0 415.117 14000.0 417.1353 3500.0 419.1125 1400000.0 419.1627 2400.0 421.127 26000.0 425.1224 150000.0 429.1179 77000.0 431.1166 980000.0 433.1287 50000.0 437.1212 29000.0 443.1149 170000.0 443.1994 2500.0 445.1279 40000.0 449.1225 330000.0 451.1466 7800.0 455.1147 23000.0 461.0519 4200.0 461.1225 660000.0 467.1336 64000.0 473.1221 230000.0 479.1329 500000.0 491.1323 170000.0 497.1433 170000.0 509.1437 57000.0 604.9941 6800.0 END IONS BEGIN IONS SCANS=265 PEPMASS=581.1872 CHARGE=1 COLLISION_ENERGY=0.0 71.7801 2600.0 72.0451 2400.0 73.2672 2300.0 73.8738 2300.0 74.0476 2400.0 81.7473 2600.0 83.7268 2400.0 85.0281 20000.0 87.3452 2200.0 92.7359 2300.0 96.7407 2200.0 102.261 2200.0 103.0605 2100.0 103.5769 2300.0 104.1714 2400.0 107.0406 5700.0 107.0488 430000.0 107.0575 3100.0 123.0447 2200.0 124.6011 2400.0 124.6993 2500.0 124.8311 2200.0 133.3443 2100.0 143.2304 2300.0 143.6573 2600.0 147.5483 2500.0 149.0584 2600.0 163.0385 7400.0 173.5216 31000.0 173.5379 110000.0 180.5816 2500.0 181.051 2700.0 182.7401 2900.0 193.0496 8900.0 205.0495 32000.0 217.0496 35000.0 217.0943 2200.0 221.0457 4200.0 229.4624 2300.0 231.0297 2300.0 231.0652 5400.0 235.0602 37000.0 238.3455 2500.0 240.3257 2200.0 243.0665 5200.0 247.0601 59000.0 259.0598 83000.0 267.302 2600.0 271.0603 30000.0 273.0765 7400.0 277.072 33000.0 283.0593 21000.0 285.0772 3100.0 287.0551 37000.0 287.0909 29000.0 289.0707 41000.0 299.0568 2700.0 299.0913 35000.0 301.071 90000.0 311.0919 19000.0 313.0713 45000.0 313.6718 2600.0 319.0798 6700.0 323.0916 3800.0 325.0708 38000.0 327.086 21000.0 329.1024 55000.0 331.0854 2500.0 341.1022 15000.0 343.0815 26000.0 351.9348 2500.0 353.102 190000.0 353.1517 2900.0 355.0807 19000.0 355.8544 2700.0 361.092 6500.0 365.1024 110000.0 367.0804 4500.0 377.1014 42000.0 378.0494 2400.0 383.1131 54000.0 389.1024 16000.0 393.0987 4000.0 395.113 150000.0 403.1172 3500.0 407.1134 85000.0 413.1228 37000.0 419.1131 140000.0 425.1252 9700.0 426.4299 2900.0 429.1169 3000.0 431.118 96000.0 434.1702 2900.0 443.1172 6600.0 449.1229 30000.0 451.1375 2600.0 455.1845 2700.0 461.1231 71000.0 467.1344 6500.0 473.1227 12000.0 479.1344 47000.0 491.1343 25000.0 492.4137 2900.0 497.1477 4400.0 END IONS BEGIN IONS SCANS=266 PEPMASS=300.1599 CHARGE=1 COLLISION_ENERGY=0.0 48.2553 2900.0 48.8147 6900.0 49.0589 2800.0 50.0221 2300.0 50.2226 2400.0 50.7781 2700.0 55.0179 11000.0 55.783 2700.0 58.0651 38000.0 58.9642 2200.0 65.7005 2300.0 67.2773 3200.0 69.1087 2500.0 70.9332 2200.0 77.0389 8300.0 79.0541 22000.0 82.6469 2300.0 91.0541 58000.0 93.0698 43000.0 95.049 61000.0 103.0541 25000.0 104.7223 2200.0 107.0319 43000.0 107.049 9000000.0 107.0575 88000.0 107.0659 24000.0 107.0661 86000.0 107.0723 15000.0 109.0648 17000.0 109.7845 2400.0 113.9178 4100.0 115.0452 3000.0 115.0541 390000.0 117.0698 73000.0 119.0489 79000.0 121.0282 86000.0 121.0646 820000.0 121.0735 11000.0 125.0593 13000.0 129.0699 17000.0 130.9489 2700.0 131.049 110000.0 133.0647 40000.0 135.0792 2600.0 137.0595 1000000.0 137.0696 2800.0 137.1509 2400.0 143.049 1800000.0 143.0604 19000.0 144.0567 24000.0 145.0646 1000000.0 145.0745 6000.0 145.0783 19000.0 146.0964 26000.0 147.0803 82000.0 148.075 3800.0 149.0597 62000.0 149.0836 3000.0 151.0752 160000.0 153.0703 3700.0 155.0602 19000.0 157.0646 45000.0 160.0518 53000.0 161.0596 51000.0 161.0832 2800.0 162.0676 34000.0 162.0912 84000.0 163.0752 160000.0 166.0775 12000.0 167.0851 7800.0 168.9931 4200.0 173.5252 35000.0 173.5426 38000.0 174.0915 34000.0 175.0575 16000.0 175.0753 1000000.0 175.099 14000.0 176.0834 24000.0 177.0768 12000.0 177.0911 95000.0 178.0862 120000.0 179.0937 32000.0 180.0839 3800.0 180.1019 260000.0 180.9287 2400.0 181.0645 49000.0 181.1011 64000.0 182.0738 2600.0 183.0801 12000.0 189.0907 22000.0 191.0862 93000.0 192.0812 17000.0 192.1018 980000.0 192.1221 3800.0 193.1091 24000.0 194.0726 85000.0 194.1178 14000.0 195.0805 44000.0 197.0611 9500.0 197.096 100000.0 197.8907 11000.0 206.1175 100000.0 207.0806 12000.0 208.0898 3900.0 209.0596 35000.0 209.0961 770000.0 210.0669 11000.0 211.0759 25000.0 211.1118 100000.0 213.0922 3500.0 213.8856 3700.0 219.0805 140000.0 220.088 19000.0 221.0961 9700.0 222.0677 19000.0 223.1111 27000.0 223.7331 3100.0 225.0544 6400.0 225.0911 66000.0 226.098 5100.0 227.1061 9500.0 235.0742 11000.0 236.0827 33000.0 237.0908 1200000.0 237.113 12000.0 238.0985 44000.0 239.0702 30000.0 239.1066 78000.0 239.6737 2600.0 240.078 68000.0 240.1382 18000.0 241.0861 24000.0 241.1216 22000.0 242.0927 7900.0 251.1062 110000.0 252.114 4800.0 254.0659 3500.0 254.0936 140000.0 257.1171 36000.0 267.1018 16000.0 268.1329 55000.0 269.1169 2500000.0 271.1327 110000.0 283.1315 22000.0 285.1366 5400.0 290.6642 2500.0 300.1594 1600000.0 300.1899 11000.0 300.2015 5900.0 END IONS BEGIN IONS SCANS=267 PEPMASS=354.8521 CHARGE=1 COLLISION_ENERGY=0.0 83.0606 5300.0 84.0816 150000.0 86.0972 48000.0 89.3659 2200.0 91.0549 25000.0 92.0239 2300.0 92.4592 2600.0 92.7013 2300.0 93.0455 3400.0 98.0609 7000.0 107.0501 17000.0 108.7351 2400.0 109.6145 2500.0 110.0725 430000.0 110.9281 2500.0 112.1869 2600.0 118.0664 100000.0 119.0741 50000.0 120.0821 84000.0 121.5738 2700.0 122.3823 2400.0 125.0721 11000.0 129.1037 190000.0 132.8498 2200.0 134.0605 3300.0 136.0521 11000.0 136.0666 2700.0 136.077 56000.0 137.0611 6700.0 145.008 2500.0 146.0479 6400.0 146.0618 330000.0 147.0653 7800.0 148.5741 2500.0 155.0937 4500.0 161.0617 4300.0 161.3838 2400.0 162.0569 8900.0 164.0472 12000.0 165.0565 11000.0 167.8907 2600.0 169.135 5800.0 172.1142 160000.0 173.5217 6600.0 173.5313 86000.0 173.5396 24000.0 180.397 2400.0 181.074 39000.0 187.1244 5800.0 190.329 2300.0 192.9479 2500.0 197.0165 2500.0 203.0549 46000.0 205.1365 8400.0 205.5963 5600.0 215.1546 2500.0 216.1278 23000.0 217.1348 18000.0 221.3595 2600.0 230.1204 12000.0 231.1265 31000.0 231.1518 43000.0 237.9483 2300.0 243.1154 7200.0 244.1114 25000.0 245.1318 2500.0 247.1465 2500.0 248.1531 29000.0 249.1598 2600.0 258.1159 3000.0 258.8658 3100.0 259.1476 22000.0 262.7838 2900.0 263.111 2500.0 266.1649 110000.0 271.1228 42000.0 272.106 9500.0 275.1429 33000.0 276.1415 8300.0 276.8823 2300.0 277.0891 4700.0 286.1138 2500.0 289.8583 2500.0 290.5486 2600.0 290.8925 17000.0 291.1382 2800.0 292.1451 300000.0 293.1265 2800.0 293.151 21000.0 299.1185 38000.0 305.085 8000.0 308.1774 2800.0 308.9046 130000.0 310.1812 39000.0 314.1241 2500.0 319.3119 2600.0 323.0939 4400.0 337.1099 2500.0 340.6679 2800.0 343.6016 2500.0 355.1777 330000.0 359.753 2600.0 361.1688 5100.0 370.1985 2700.0 381.7554 2600.0 389.1683 3300.0 391.9299 2300.0 394.1915 3400.0 410.1904 3600.0 412.2038 6400.0 414.2069 43000.0 420.1971 8200.0 427.2115 10000.0 428.1981 3100.0 434.9053 2300.0 447.2405 42000.0 455.2098 15000.0 473.2179 29000.0 482.5792 2900.0 488.4392 2600.0 498.0946 2300.0 529.2574 4200.0 551.2654 3100.0 642.0324 2800.0 749.0381 2700.0 825.7965 2700.0 856.5671 2900.0 882.0062 2600.0 994.0111 2500.0 1004.3564 2800.0 END IONS BEGIN IONS SCANS=268 PEPMASS=526.1921 CHARGE=1 COLLISION_ENERGY=0.0 64.881 2300.0 66.2488 2600.0 66.4775 2500.0 70.2348 2300.0 70.5786 2200.0 70.6696 2200.0 75.8256 2200.0 80.3341 2500.0 85.028 27000.0 101.3765 2200.0 121.0642 6800.0 123.4637 2500.0 127.0382 2400.0 131.3552 2100.0 135.0427 2300.0 137.0593 560000.0 137.0696 5600.0 147.2427 2500.0 148.34 2700.0 150.068 2400.0 161.023 8900.0 161.059 17000.0 162.067 11000.0 170.2244 2900.0 173.5165 2200.0 173.5302 75000.0 173.542 13000.0 175.0367 3000.0 179.0339 2800.0 181.0492 25000.0 191.0341 13000.0 193.0494 74000.0 195.6002 2800.0 202.7431 2400.0 205.0493 29000.0 225.0892 2500.0 237.055 7000.0 238.0628 5800.0 241.1671 2500.0 253.0488 8000.0 257.0802 5700.0 265.0492 78000.0 266.8317 2900.0 267.0653 8400.0 269.0809 23000.0 285.0374 6300.0 285.0758 710000.0 285.1122 5700.0 297.0368 4000.0 297.0757 440000.0 302.0803 12000.0 303.088 3200.0 315.0862 190000.0 317.1018 200000.0 317.1447 3000.0 329.1022 68000.0 347.1123 56000.0 355.8003 2800.0 456.9537 2800.0 474.9786 2900.0 END IONS BEGIN IONS SCANS=269 PEPMASS=347.1127 CHARGE=1 COLLISION_ENERGY=0.0 57.0195 2300.0 62.1486 2100.0 62.6821 2900.0 64.2671 2200.0 65.2381 2500.0 66.4982 2700.0 73.3279 2400.0 78.1848 2300.0 80.6331 2700.0 97.8602 2900.0 107.0491 6000.0 117.2782 2100.0 121.0648 12000.0 137.0594 140000.0 149.0233 4700.0 149.6695 3600.0 149.6901 4900.0 161.0235 7600.0 161.0596 6800.0 162.0665 3500.0 163.0385 10000.0 167.0859 3200.0 173.5344 24000.0 177.6734 2600.0 179.1477 3100.0 181.0489 9000.0 181.0649 10000.0 193.05 5100.0 195.473 2500.0 197.0603 6600.0 201.2701 2100.0 205.0492 2800.0 209.0591 4900.0 211.0749 11000.0 214.6672 2400.0 225.0542 7800.0 229.0854 3100.0 237.0544 27000.0 238.0625 10000.0 239.0698 5800.0 241.0844 2600.0 242.0567 2800.0 242.4033 2600.0 253.0503 11000.0 257.0811 6800.0 265.0495 54000.0 267.0645 12000.0 269.0809 17000.0 285.0761 110000.0 297.076 40000.0 312.8184 2900.0 322.334 2500.0 END IONS BEGIN IONS SCANS=270 PEPMASS=286.1442 CHARGE=1 COLLISION_ENERGY=0.0 48.1749 5300.0 48.2257 9200.0 51.0235 5300.0 53.0385 28000.0 54.5428 12000.0 55.0179 58000.0 69.517 8500.0 71.1717 7700.0 72.2604 5300.0 74.7889 8000.0 77.0387 54000.0 79.0542 120000.0 81.0694 13000.0 82.8637 5600.0 91.0543 210000.0 93.0698 100000.0 95.0491 260000.0 103.0544 110000.0 105.0449 51000.0 107.0128 15000.0 107.0326 310000.0 107.0355 62000.0 107.0491 32000000.0 107.0628 88000.0 107.0658 410000.0 107.071 35000.0 107.0778 32000.0 109.0649 60000.0 112.5575 8800.0 115.0543 1900000.0 115.0613 15000.0 117.0699 260000.0 119.0491 260000.0 121.0284 440000.0 121.0648 1200000.0 121.0747 19000.0 124.3652 5700.0 125.059 18000.0 127.0541 8800.0 131.0491 500000.0 132.058 25000.0 132.0806 63000.0 133.065 78000.0 137.045 24000.0 137.0597 3100000.0 139.0754 7800.0 141.9855 12000.0 143.0491 6200000.0 144.0569 110000.0 145.0648 3000000.0 147.0805 130000.0 148.0757 130000.0 149.0598 180000.0 151.0754 320000.0 155.0604 100000.0 157.0656 9300.0 160.052 220000.0 160.0758 90000.0 161.0598 140000.0 161.2429 5200.0 162.0678 93000.0 163.0625 56000.0 163.0756 380000.0 164.0709 15000.0 165.0697 64000.0 166.0778 97000.0 166.0882 19000.0 167.0856 31000.0 169.0655 6000.0 173.5237 35000.0 173.5328 160000.0 173.5429 39000.0 175.0586 51000.0 175.0756 3100000.0 176.0837 69000.0 177.0782 11000.0 178.0865 1700000.0 181.0649 270000.0 181.0846 18000.0 181.1015 300000.0 182.073 22000.0 183.0802 70000.0 183.3592 6200.0 189.0704 21000.0 190.078 46000.0 191.0858 570000.0 191.1043 13000.0 192.1019 150000.0 193.0657 14000.0 194.0728 480000.0 195.0807 190000.0 196.0886 6800.0 197.0602 52000.0 197.0953 12000.0 202.0796 6900.0 207.0806 45000.0 208.0883 29000.0 209.0597 140000.0 209.0964 3200000.0 210.0676 62000.0 211.0759 56000.0 211.112 260000.0 212.0839 26000.0 213.091 33000.0 218.0716 44000.0 219.0808 650000.0 219.1028 15000.0 220.0887 110000.0 221.0964 22000.0 222.0678 140000.0 223.0751 40000.0 223.1124 54000.0 225.055 66000.0 225.0912 16000.0 226.0984 54000.0 235.0758 64000.0 236.0833 150000.0 237.0913 3900000.0 238.099 190000.0 239.0706 210000.0 239.1063 100000.0 240.0783 270000.0 241.0866 76000.0 241.1223 59000.0 250.0326 12000.0 251.107 390000.0 254.066 8500.0 254.0939 570000.0 254.121 21000.0 267.1024 29000.0 269.0912 13000.0 269.1174 6900000.0 286.1441 600000.0 END IONS BEGIN IONS SCANS=271 PEPMASS=511.2552 CHARGE=1 COLLISION_ENERGY=0.0 61.2503 2200.0 69.0697 7600.0 75.3532 2300.0 79.1338 2200.0 86.0911 3700.0 86.0961 190000.0 89.6123 2200.0 90.1389 2400.0 91.0542 15000.0 91.9574 2200.0 93.8338 2400.0 102.5327 2300.0 103.0535 2600.0 107.5661 2200.0 108.1579 2400.0 115.0498 9100.0 115.6568 2500.0 118.0648 79000.0 120.0718 2400.0 120.0803 47000.0 129.5984 2400.0 131.0488 3800.0 136.0755 64000.0 146.0466 4500.0 146.0597 790000.0 146.0703 9100.0 146.0958 21000.0 155.9448 2600.0 157.1334 65000.0 165.0543 60000.0 173.5253 47000.0 173.5424 24000.0 182.0809 86000.0 183.1127 39000.0 185.1285 11000.0 187.7365 2700.0 189.102 84000.0 217.0972 190000.0 236.1065 7300.0 239.6937 2800.0 246.4436 2400.0 265.0888 2800.0 270.1119 8300.0 282.113 33000.0 282.4192 2600.0 299.1395 21000.0 321.9867 2800.0 333.4979 2500.0 345.5506 2300.0 383.1931 2800.0 383.2002 7200.0 387.3828 2900.0 END IONS BEGIN IONS SCANS=272 PEPMASS=764.4088 CHARGE=1 COLLISION_ENERGY=0.0 70.065 1100000.0 70.0691 6000.0 70.0716 3500.0 78.4773 2900.0 80.5676 2300.0 81.4423 2300.0 82.9309 6500.0 83.0415 56000.0 83.0457 6800.0 84.1986 2500.0 84.933 62000.0 84.9378 7200.0 86.0961 230000.0 86.2841 2400.0 90.1768 2400.0 94.7248 2300.0 96.4247 2500.0 97.0758 37000.0 98.0598 160000.0 105.0177 3000.0 110.9696 2400.0 111.0626 2500.0 112.0867 740000.0 112.0943 3200.0 113.0945 19000.0 115.0863 98000.0 117.6509 2300.0 118.0648 9800.0 120.0807 26000.0 122.7934 2200.0 124.0867 7000.0 125.0354 2400.0 125.0707 76000.0 126.0547 70000.0 129.1132 18000.0 136.0754 53000.0 140.0816 170000.0 141.1132 9100.0 143.0535 2600.0 146.0598 220000.0 150.0915 6200.0 151.1229 21000.0 155.6482 2400.0 157.1082 550000.0 157.1331 140000.0 158.092 32000.0 163.0676 2600.0 165.0545 32000.0 165.1022 10000.0 166.1336 50000.0 167.1178 98000.0 172.1121 3300.0 173.5239 31000.0 173.5352 110000.0 173.5451 4300.0 175.1191 12000.0 177.1021 38000.0 177.3962 2600.0 178.1103 6100.0 182.0811 180000.0 182.0992 3800.0 183.1126 34000.0 185.1284 77000.0 189.1021 37000.0 192.113 98000.0 193.0975 2600.0 193.1224 2800.0 193.1445 19000.0 194.1288 84000.0 195.1128 180000.0 209.1397 300000.0 209.1628 3200.0 210.1477 17000.0 211.1555 4800.0 211.6513 2600.0 212.1396 24000.0 215.1177 2700.0 216.1255 9000.0 217.0972 300000.0 217.1338 130000.0 220.1081 48000.0 220.1298 2600.0 222.6646 2900.0 227.0819 8400.0 227.118 7000.0 229.4501 2400.0 234.1238 28000.0 236.1073 4000.0 236.151 4500.0 237.095 3400.0 237.1119 2400.0 237.1346 1100000.0 237.1561 3000.0 243.1128 130000.0 245.0919 43000.0 245.1646 18000.0 248.6519 2800.0 254.161 190000.0 259.2785 2700.0 265.9244 2500.0 270.1133 15000.0 273.1593 2900.0 276.1453 8600.0 277.1298 5700.0 282.1135 53000.0 293.171 2600.0 294.1594 34000.0 295.1657 61000.0 296.1767 28000.0 299.1392 25000.0 312.0739 2900.0 312.1719 11000.0 314.1501 120000.0 314.1869 15000.0 321.1721 31000.0 322.155 170000.0 326.1971 5200.0 330.1809 39000.0 336.1823 41000.0 338.1976 4200.0 339.182 21000.0 340.1659 59000.0 347.1837 3600.0 347.197 2900.0 354.192 36000.0 355.2234 9900.0 356.2082 190000.0 358.1761 41000.0 364.1764 64000.0 365.1597 46000.0 365.2037 13000.0 373.2349 140000.0 374.174 2500.0 381.2037 65000.0 382.188 210000.0 383.2012 18000.0 390.1957 2700.0 392.1818 5800.0 393.1928 12000.0 395.1963 14000.0 396.194 17000.0 398.1708 13000.0 399.2159 56000.0 407.2198 19000.0 410.2206 2700.0 410.835 2800.0 411.203 38000.0 424.186 19000.0 425.2301 50000.0 427.235 17000.0 435.2145 43000.0 436.2016 3800.0 442.2554 12000.0 449.2919 2800.0 449.9312 2800.0 452.2396 4300.0 453.225 49000.0 454.2448 3200.0 466.2349 6100.0 470.2504 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764.2844 4500.0 764.4085 1400000.0 764.5691 3700.0 END IONS BEGIN IONS SCANS=273 PEPMASS=382.7086 CHARGE=1 COLLISION_ENERGY=0.0 70.0286 160000.0 70.065 2400000.0 71.06 100000.0 76.388 9000.0 79.2824 11000.0 81.1805 10000.0 86.0963 13000000.0 86.1031 97000.0 87.0551 280000.0 87.0789 150000.0 87.0997 200000.0 88.0391 290000.0 88.0866 12000.0 89.0706 47000.0 91.0541 280000.0 94.0641 17000.0 95.0492 27000.0 97.0759 73000.0 98.0599 270000.0 99.0552 150000.0 102.711 8900.0 103.0542 72000.0 107.0493 19000.0 109.8558 6400.0 111.4099 6000.0 112.0868 1200000.0 112.3787 8300.0 113.0945 30000.0 113.5867 180000.0 114.0917 18000.0 115.0501 1200000.0 115.0866 190000.0 117.4346 10000.0 118.065 910000.0 118.5793 11000.0 119.049 430000.0 120.0707 24000.0 120.0806 1400000.0 121.0647 55000.0 123.0439 690000.0 123.0533 9600.0 124.087 51000.0 125.0707 140000.0 126.0548 120000.0 129.1133 130000.0 130.1201 20000.0 132.0811 25000.0 135.0566 11000.0 135.0678 760000.0 136.0633 49000.0 136.0756 3500000.0 136.0879 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206.1294 51000.0 209.1399 320000.0 210.1479 39000.0 212.1397 160000.0 212.6266 12000.0 217.0974 1000000.0 217.1339 500000.0 220.1083 64000.0 223.0764 14000.0 224.1074 98000.0 225.1347 12000.0 226.1663 190000.0 227.174 200000.0 228.1022 100000.0 233.1396 97000.0 234.1239 480000.0 236.1076 110000.0 236.1504 150000.0 237.1347 1600000.0 237.1609 53000.0 238.1383 56000.0 238.1657 19000.0 243.113 230000.0 245.1637 13000.0 250.1139 9700.0 250.1438 1200000.0 250.1712 43000.0 251.1488 110000.0 253.177 250000.0 253.6479 73000.0 254.0995 22000.0 254.1366 38000.0 254.1612 12000000.0 254.2225 16000.0 255.1639 500000.0 260.1428 12000.0 265.0856 15000.0 267.6445 110000.0 270.1127 1000000.0 271.1157 78000.0 271.1876 180000.0 275.1601 8900.0 276.1459 230000.0 277.17 74000.0 280.1411 160000.0 282.1129 160000.0 286.1554 69000.0 289.1296 9500.0 293.1727 390000.0 294.1577 20000.0 296.1763 240000.0 299.1398 60000.0 302.1649 15000.0 306.1583 73000.0 310.1995 13000.0 310.6808 20000.0 311.1835 190000.0 312.1756 6900.0 314.1507 21000.0 314.1871 190000.0 319.1886 20000.0 321.1715 100000.0 322.155 410000.0 322.1885 100000.0 324.6795 7900.0 329.72 10000.0 336.2146 450000.0 337.2002 62000.0 338.1974 170000.0 339.1828 78000.0 340.1655 180000.0 346.2008 28000.0 347.1835 75000.0 348.1832 25000.0 352.2101 40000.0 354.1866 11000.0 354.2246 730000.0 355.2245 620000.0 356.2084 960000.0 357.2073 87000.0 360.0273 8000.0 363.2298 15000.0 364.2093 520000.0 365.1598 37000.0 365.2076 180000.0 368.7073 15000.0 368.7167 6800.0 371.217 23000.0 372.2273 55000.0 373.1929 16000.0 373.2349 3400000.0 374.2379 270000.0 380.2169 16000.0 381.2038 560000.0 382.1857 260000.0 382.2251 220000.0 383.2126 120000.0 390.2497 140000.0 391.2213 23000.0 396.1923 9400.0 398.2307 170000.0 399.2145 2000000.0 399.2648 20000.0 400.2182 180000.0 407.2172 56000.0 408.2524 15000.0 411.2051 8600.0 424.1898 46000.0 424.2461 410000.0 425.2316 310000.0 426.2556 11000.0 428.2531 7500.0 432.2744 73000.0 442.2563 1200000.0 443.2606 180000.0 449.2989 670000.0 450.2976 53000.0 452.2409 78000.0 453.2244 23000.0 469.2653 82000.0 470.2514 570000.0 471.2537 61000.0 478.2294 13000.0 487.2787 110000.0 504.8635 13000.0 521.2387 53000.0 534.2836 88000.0 535.2677 130000.0 537.3292 85000.0 538.3196 40000.0 552.2927 80000.0 555.3397 260000.0 561.285 28000.0 562.2827 11000.0 562.3079 53000.0 563.2631 70000.0 564.2808 31000.0 577.3247 78000.0 578.3087 410000.0 579.3188 220000.0 580.2886 510000.0 581.288 15000.0 605.3214 94000.0 606.3039 450000.0 607.3044 15000.0 622.3372 12000.0 623.3294 3100000.0 623.4207 27000.0 624.3321 400000.0 650.3318 12000.0 651.3265 250000.0 END IONS BEGIN IONS SCANS=274 PEPMASS=316.1911 CHARGE=1 COLLISION_ENERGY=0.0 55.0179 11000.0 58.062 4300.0 58.065 170000.0 58.176 2300.0 65.6284 2400.0 68.2582 2200.0 69.512 2200.0 72.0807 6300.0 78.1908 2700.0 78.4981 2500.0 79.0539 3000.0 83.1276 2400.0 91.0541 57000.0 93.0697 33000.0 94.3293 2400.0 95.049 65000.0 97.0644 3800.0 103.0541 13000.0 107.049 230000.0 107.1995 2700.0 109.0648 5500.0 117.0697 70000.0 119.049 150000.0 119.0853 36000.0 121.0646 780000.0 121.0729 4500.0 123.0443 2600.0 123.0798 7500.0 125.0593 17000.0 129.0696 6200.0 131.049 27000.0 133.0647 43000.0 135.0803 19000.0 137.048 3700.0 137.0596 170000.0 142.6035 2500.0 145.0515 3300.0 145.0646 220000.0 145.3498 2200.0 146.073 2900.0 147.0802 390000.0 149.0595 170000.0 149.096 51000.0 150.0677 8900.0 151.0646 4000.0 151.0752 500000.0 153.091 8300.0 157.0647 17000.0 160.3739 2400.0 161.0964 2700.0 163.0752 44000.0 165.0691 6200.0 165.0908 30000.0 167.0857 3500.0 169.0647 8800.0 173.5247 38000.0 173.5423 31000.0 173.5666 2600.0 173.6651 2300.0 177.091 150000.0 181.0652 7600.0 181.1017 2500.0 182.0728 35000.0 183.0804 85000.0 183.1161 3100.0 193.1012 39000.0 195.08 15000.0 196.0884 24000.0 197.0609 2700.0 197.0957 24000.0 203.0853 6800.0 209.0959 6500.0 210.0675 46000.0 211.0753 72000.0 211.1118 500000.0 211.1464 3100.0 212.0835 23000.0 213.0912 31000.0 221.0961 58000.0 221.5981 3300.0 224.0838 16000.0 225.0895 3800.0 225.1278 20000.0 229.1227 2500.0 235.1109 12000.0 237.0908 18000.0 238.9827 2300.0 239.1065 350000.0 241.1228 5900.0 242.0935 82000.0 246.7801 2300.0 253.1218 20000.0 254.5493 2400.0 256.1093 18000.0 271.1326 230000.0 271.166 4500.0 316.1893 8500.0 END IONS BEGIN IONS SCANS=275 PEPMASS=330.2069 CHARGE=1 COLLISION_ENERGY=0.0 50.2686 2700.0 51.1675 2400.0 51.6459 2400.0 53.2951 3200.0 59.1167 2300.0 60.0807 220000.0 60.2381 2400.0 61.9454 2400.0 62.1846 2400.0 62.6098 2000.0 64.0955 2200.0 67.4466 2300.0 68.576 2100.0 75.6209 4600.0 75.6294 2300.0 77.404 2200.0 82.634 2100.0 82.7332 2500.0 83.6498 2300.0 89.3516 2400.0 91.0541 64000.0 93.0699 27000.0 94.2661 2300.0 95.049 87000.0 98.6907 2300.0 103.0543 12000.0 107.049 270000.0 109.0647 2700.0 116.3353 2400.0 117.0698 74000.0 119.049 210000.0 119.0854 43000.0 121.0647 1100000.0 121.0793 3600.0 123.0435 2700.0 123.0804 8100.0 123.6452 2700.0 125.0597 23000.0 131.0491 26000.0 133.0648 65000.0 135.0446 2700.0 135.0801 25000.0 136.0521 2700.0 137.0481 3100.0 137.0597 200000.0 138.4524 2600.0 145.0646 310000.0 147.0672 5100.0 147.0803 660000.0 149.0596 230000.0 149.096 73000.0 151.0753 750000.0 151.089 7200.0 151.6311 2700.0 153.0909 17000.0 157.0648 23000.0 159.0798 3000.0 161.096 7300.0 163.0754 63000.0 163.1344 2500.0 165.0912 36000.0 173.5335 99000.0 175.1108 8200.0 177.0911 230000.0 181.0651 5900.0 181.1017 6100.0 182.0727 24000.0 183.0805 100000.0 187.8096 2400.0 188.1196 2300.0 193.1012 51000.0 193.6933 2400.0 195.0817 5700.0 196.0879 32000.0 197.0621 2700.0 197.0963 31000.0 203.0853 5700.0 203.9004 2500.0 207.4441 2600.0 209.0956 2600.0 210.0676 61000.0 211.0755 96000.0 211.1119 700000.0 211.1351 14000.0 212.0834 27000.0 213.0911 45000.0 216.595 2400.0 221.0962 79000.0 223.6743 2900.0 224.0829 15000.0 225.0906 4700.0 225.1276 30000.0 235.1115 9200.0 237.0916 22000.0 238.0973 2300.0 239.0792 5400.0 239.1067 600000.0 240.1128 2700.0 241.1219 13000.0 241.3721 2400.0 242.0938 95000.0 243.1379 3400.0 253.1221 41000.0 256.11 22000.0 271.1328 520000.0 271.1659 8800.0 299.485 2500.0 330.2059 2900.0 339.2608 2600.0 END IONS BEGIN IONS SCANS=276 PEPMASS=577.135 CHARGE=1 COLLISION_ENERGY=0.0 62.3694 2200.0 63.4845 2700.0 66.621 2000.0 67.6146 2200.0 69.5293 2900.0 71.7611 2600.0 71.7651 2400.0 72.6324 2100.0 73.7462 2300.0 74.7284 2400.0 75.9663 2400.0 76.2186 2500.0 77.7546 2500.0 78.2006 2300.0 83.0734 2400.0 86.8097 2300.0 88.9989 2300.0 91.4317 2300.0 101.1666 2300.0 104.0444 2300.0 105.8609 2300.0 113.0126 2400.0 117.7307 2700.0 120.348 2700.0 123.0351 2900.0 123.0435 160000.0 127.0384 25000.0 135.2378 2800.0 137.0237 7000.0 139.0383 39000.0 147.6132 2600.0 147.7454 2700.0 149.0233 13000.0 151.0387 21000.0 154.1019 2700.0 155.0354 2900.0 159.1384 2500.0 165.0544 3000.0 173.5313 100000.0 173.5454 4200.0 203.0333 6800.0 211.5318 2400.0 227.2312 2800.0 231.0646 23000.0 232.1991 2700.0 245.0439 42000.0 247.0599 26000.0 257.0457 3500.0 259.0601 56000.0 269.0441 24000.0 271.0602 61000.0 280.069 2700.0 283.0601 26000.0 287.017 6400.0 287.055 3900000.0 287.1292 16000.0 295.6332 2300.0 299.0552 140000.0 311.0572 15000.0 337.2232 2500.0 358.4574 2400.0 377.3345 2700.0 391.09 2400.0 396.4076 2300.0 397.0095 2400.0 407.0761 23000.0 419.0214 2700.0 419.0763 120000.0 425.0885 19000.0 429.2146 2900.0 437.0868 19000.0 525.192 2600.0 536.3975 3300.0 562.4755 2600.0 575.8272 2800.0 END IONS BEGIN IONS SCANS=277 PEPMASS=368.8595 CHARGE=1 COLLISION_ENERGY=0.0 82.8966 2600.0 86.0909 11000.0 86.0971 910000.0 87.1005 18000.0 87.5295 2300.0 89.9571 2600.0 91.0551 25000.0 95.7774 2300.0 97.0768 11000.0 97.2543 2400.0 98.0605 8200.0 101.7711 2400.0 106.0658 3800.0 110.0726 190000.0 112.0794 2100.0 112.0877 28000.0 115.0876 11000.0 118.0665 100000.0 119.0741 43000.0 120.0821 70000.0 122.0608 8200.0 125.0719 23000.0 134.0627 2300.0 136.0772 36000.0 140.083 7700.0 144.1794 2500.0 146.0456 8900.0 146.0618 350000.0 147.065 5300.0 152.8333 2700.0 155.093 2300.0 157.1093 2600.0 158.4409 2600.0 162.0568 9500.0 172.1144 170000.0 173.1162 3700.0 173.531 97000.0 173.544 17000.0 173.5995 2500.0 174.0569 6700.0 175.121 18000.0 180.0898 9100.0 181.0744 32000.0 187.1253 20000.0 188.1456 17000.0 198.0929 3300.0 199.233 2500.0 202.8212 2300.0 207.0651 2500.0 207.7465 2400.0 208.6071 2500.0 215.1209 6400.0 216.1283 40000.0 217.1363 13000.0 218.569 2400.0 228.1136 16000.0 230.1213 33000.0 231.1525 47000.0 235.1208 5500.0 238.1264 6200.0 241.8976 2700.0 243.1152 22000.0 245.1317 2500.0 251.1168 39000.0 252.1477 7800.0 257.4619 2900.0 258.1173 6300.0 259.1485 14000.0 271.1216 27000.0 275.1423 22000.0 277.1453 67000.0 278.1291 100000.0 278.4387 2800.0 279.1125 43000.0 290.139 6500.0 293.4615 2500.0 294.1712 33000.0 295.1546 6100.0 299.1176 30000.0 300.2434 2800.0 301.1208 7500.0 303.1236 41000.0 304.1321 5000.0 312.1813 27000.0 315.6384 2600.0 320.1508 6100.0 321.1613 31000.0 321.3162 2800.0 323.1633 25000.0 338.1568 8600.0 338.1903 24000.0 362.6685 3100.0 369.1681 4700.0 396.1694 3000.0 412.2038 3100.0 420.1971 3300.0 438.1915 17000.0 439.1799 3800.0 441.1931 25000.0 442.1826 12000.0 458.2224 68000.0 473.234 2900.0 475.2491 80000.0 476.2481 3900.0 484.2007 28000.0 501.2258 27000.0 540.3132 9100.0 562.2494 3000.0 583.7516 2800.0 586.3156 21000.0 593.2702 2700.0 598.8314 3500.0 614.7429 2700.0 619.2706 2500.0 636.2991 72000.0 637.2927 6300.0 662.2782 11000.0 731.3603 2600.0 732.3625 3600.0 736.3358 2600.0 749.3824 94000.0 750.3879 22000.0 753.3555 10000.0 775.3667 7100.0 866.441 26000.0 867.4352 2900.0 877.4128 8800.0 894.4386 81000.0 895.4388 31000.0 922.4383 32000.0 END IONS BEGIN IONS SCANS=278 PEPMASS=251.107 CHARGE=1 COLLISION_ENERGY=0.0 59.049 6000.0 59.256 2600.0 62.4649 2500.0 63.4825 2300.0 64.8819 2500.0 65.0528 2400.0 95.1656 2500.0 99.6923 2600.0 105.9946 2300.0 114.3723 2300.0 121.1591 2800.0 137.3916 2600.0 139.5992 2600.0 165.0707 10000.0 173.5205 2300.0 173.5383 26000.0 179.0859 14000.0 180.0932 27000.0 189.041 2600.0 189.07 20000.0 190.0778 79000.0 191.065 4400.0 191.0855 650000.0 191.1056 5100.0 195.3061 3000.0 203.0855 5600.0 205.0672 2900.0 205.1012 22000.0 207.0802 6200.0 208.0885 67000.0 218.0729 21000.0 219.0807 97000.0 220.0883 55000.0 230.5781 2700.0 235.9663 2300.0 236.0835 92000.0 251.1069 23000.0 252.6321 2300.0 END IONS BEGIN IONS SCANS=279 PEPMASS=268.1335 CHARGE=1 COLLISION_ENERGY=0.0 45.7533 2500.0 46.8314 2200.0 47.6496 2400.0 47.7701 4800.0 47.7714 17000.0 49.5121 2900.0 50.0929 2100.0 51.6283 2100.0 52.2992 2300.0 52.3308 2400.0 52.5009 2500.0 53.3841 2200.0 54.7694 9500.0 55.5164 2300.0 55.6021 2100.0 55.6662 2600.0 59.0229 2300.0 60.0236 2600.0 62.7783 2700.0 63.5261 2700.0 64.9776 2300.0 70.5595 2700.0 74.3066 2200.0 80.7409 2600.0 82.6956 2400.0 83.7809 2400.0 87.9443 2700.0 91.4118 2400.0 92.3325 2300.0 94.0015 2300.0 105.2071 2800.0 108.8299 2300.0 115.6245 2400.0 118.7246 2400.0 128.3779 2600.0 132.0806 2500.0 136.4158 2300.0 139.5635 2400.0 150.0089 2500.0 153.1085 2400.0 155.7847 2500.0 158.6247 2200.0 162.8953 2700.0 163.0543 2400.0 165.0704 40000.0 167.0853 2400.0 170.3027 2200.0 173.5298 48000.0 173.5422 5400.0 177.0689 3800.0 178.0785 2900.0 179.0859 25000.0 180.0934 64000.0 180.1106 2900.0 181.0648 5700.0 188.8967 16000.0 189.0706 68000.0 190.0779 200000.0 191.0331 10000.0 191.0449 16000.0 191.0534 13000.0 191.0857 6200000.0 191.1262 40000.0 191.1379 4800.0 191.1492 3400.0 192.0937 12000.0 193.1006 4300.0 194.0724 12000.0 195.081 14000.0 195.1171 2800.0 201.0703 23000.0 201.2925 2600.0 203.0867 12000.0 205.0673 6000.0 205.1014 190000.0 207.0806 28000.0 208.0887 240000.0 209.0966 5500.0 215.0858 5300.0 216.8914 57000.0 218.0728 92000.0 219.0308 9300.0 219.0806 3800000.0 219.0984 5400.0 219.1307 7400.0 220.0886 670000.0 220.108 2400.0 221.0978 6700.0 222.0685 18000.0 223.0764 5100.0 223.1119 34000.0 229.0773 3300.0 231.233 2500.0 233.0964 56000.0 234.9011 12000.0 235.0752 17000.0 235.1008 2300.0 236.0834 1100000.0 251.0468 4300.0 251.0766 4000.0 251.1066 2000000.0 251.1336 7000.0 END IONS BEGIN IONS SCANS=280 PEPMASS=670.2714 CHARGE=1 COLLISION_ENERGY=0.0 67.9206 2600.0 69.0295 2600.0 69.0331 140000.0 74.2216 2400.0 76.1128 2300.0 81.0332 10000.0 82.3239 2400.0 82.7284 2600.0 83.0494 2500.0 85.0233 2400.0 85.028 100000.0 87.0386 3800.0 87.0437 160000.0 89.728 2700.0 90.8658 2300.0 97.0214 3200.0 97.028 210000.0 101.5654 2400.0 102.9754 2600.0 105.6998 2300.0 112.5907 2300.0 115.0305 3300.0 115.0386 210000.0 115.0535 7100.0 122.9967 2300.0 127.0388 16000.0 129.0701 7100.0 131.049 6600.0 133.0492 97000.0 137.0594 510000.0 137.0696 2100.0 143.0489 70000.0 145.0493 18000.0 145.0639 2400.0 150.0759 36000.0 151.0388 3200.0 153.0543 24000.0 157.0644 22000.0 160.0516 33000.0 161.0594 12000.0 162.0757 3600.0 163.0754 25000.0 173.5256 40000.0 173.5426 19000.0 175.0574 13000.0 175.0754 910000.0 175.0934 3700.0 179.0711 5700.0 180.087 3600.0 185.0596 3200.0 187.0754 240000.0 187.8977 2200.0 189.091 81000.0 204.6225 2300.0 205.0861 49000.0 206.2587 2900.0 217.0863 37000.0 235.0965 26000.0 239.0703 14000.0 241.0713 2400.0 241.6585 2500.0 253.12 2300.0 259.0754 8200.0 263.1072 23000.0 264.7001 2500.0 270.09 9800.0 271.0969 32000.0 279.1028 18000.0 291.1026 76000.0 311.1286 27000.0 323.129 41000.0 323.3754 2600.0 341.1399 5000.0 401.5325 2800.0 440.393 2500.0 478.9891 2800.0 556.1188 2400.0 559.712 2800.0 618.0468 2400.0 END IONS BEGIN IONS SCANS=281 PEPMASS=415.2108 CHARGE=1 COLLISION_ENERGY=0.0 78.9988 2400.0 86.0961 1500000.0 86.1023 4100.0 87.0996 24000.0 88.8284 2500.0 91.0541 31000.0 91.2027 2500.0 91.2102 2200.0 95.0489 21000.0 95.2735 2100.0 96.147 2400.0 97.0758 24000.0 98.0596 65000.0 100.7073 2100.0 103.0546 2500.0 105.608 2200.0 106.0649 28000.0 107.0489 6300.0 107.2842 2400.0 109.4435 2700.0 114.5445 2700.0 115.0863 53000.0 115.7632 2500.0 118.0649 70000.0 119.0488 150000.0 119.0728 3000.0 120.0804 78000.0 121.0648 6000.0 123.0338 5800.0 123.0437 330000.0 123.8771 2900.0 123.9837 2400.0 124.0475 5700.0 125.0706 120000.0 126.0549 15000.0 127.5361 2200.0 130.064 2200.0 131.0486 4800.0 132.311 2400.0 134.0597 110000.0 135.0675 43000.0 136.0754 270000.0 137.517 2300.0 141.1023 4000.0 146.0466 8800.0 146.0597 800000.0 146.0704 2900.0 147.0437 200000.0 147.0632 24000.0 148.0466 2900.0 148.0754 21000.0 154.9991 2300.0 155.6521 2200.0 162.0549 27000.0 164.7121 2500.0 165.0545 530000.0 166.0578 9300.0 172.1119 110000.0 173.5224 17000.0 173.5307 41000.0 173.5393 44000.0 174.0554 8500.0 174.1275 12000.0 180.0648 2500.0 182.0647 2500.0 182.081 51000.0 182.5668 2600.0 183.1491 83000.0 187.123 53000.0 188.144 10000.0 203.0233 2800.0 203.1546 3200.0 204.138 30000.0 204.2529 2700.0 211.1445 55000.0 213.088 2700.0 214.1212 2100.0 215.1177 57000.0 216.1257 110000.0 217.1336 310000.0 218.1367 6500.0 224.1074 7800.0 230.1176 77000.0 231.1493 170000.0 236.1072 38000.0 240.1017 41000.0 243.1129 84000.0 245.1285 14000.0 247.1441 68000.0 249.1603 62000.0 253.0676 2600.0 253.1334 22000.0 258.1118 26000.0 259.144 270000.0 260.1463 6700.0 268.0939 3200.0 273.1227 11000.0 275.1395 190000.0 281.1295 13000.0 286.108 70000.0 287.1402 18000.0 292.7982 2900.0 293.15 71000.0 297.1232 15000.0 301.1191 91000.0 313.0395 2700.0 319.1291 20000.0 321.6693 20000.0 330.2166 15000.0 331.6454 3000.0 335.6661 120000.0 336.165 4100.0 336.52 2300.0 337.1919 50000.0 349.1917 26000.0 356.1964 23000.0 366.2181 47000.0 386.5891 2400.0 393.1846 6500.0 399.4518 2700.0 410.2083 34000.0 420.3491 2300.0 422.2077 28000.0 436.6751 2500.0 438.2066 9300.0 463.2692 2900.0 466.1956 20000.0 526.3287 3200.0 551.8563 2900.0 584.8535 2700.0 622.6456 2800.0 622.8093 3000.0 END IONS BEGIN IONS SCANS=282 PEPMASS=219.102 CHARGE=1 COLLISION_ENERGY=0.0 42.1203 2500.0 42.1403 2200.0 43.0178 11000.0 43.4445 2300.0 43.9227 2300.0 45.0333 2400.0 49.7784 2600.0 51.3306 2800.0 52.0476 2900.0 53.9318 2400.0 54.9422 2300.0 55.9343 9000.0 56.2739 2200.0 57.0334 12000.0 67.0541 6300.0 69.7909 2300.0 72.2122 2100.0 73.0287 2500.0 73.7407 2500.0 83.9399 2600.0 87.345 2500.0 91.054 71000.0 91.0602 3400.0 98.6116 2200.0 103.0541 20000.0 107.467 2400.0 115.0542 57000.0 116.0618 23000.0 117.0697 21000.0 128.062 61000.0 129.0589 4300.0 129.0697 350000.0 130.0775 21000.0 131.0489 57000.0 131.0854 310000.0 131.0967 5000.0 131.2455 2300.0 133.0643 3400.0 133.1011 3500.0 137.0597 29000.0 140.5814 2200.0 141.0571 11000.0 141.0697 330000.0 141.083 3500.0 142.0779 4100.0 142.354 2700.0 143.0492 17000.0 143.0855 22000.0 144.0568 47000.0 145.0646 50000.0 146.0725 46000.0 148.0519 9000.0 151.076 3100.0 155.0601 4500.0 156.0366 2500.0 156.0566 6000.0 157.0647 160000.0 158.0584 4000.0 158.0726 190000.0 159.0439 16000.0 159.0804 120000.0 160.0518 45000.0 161.0596 11000.0 161.096 33000.0 162.0675 2900.0 163.0756 15000.0 168.0571 12000.0 169.0647 99000.0 170.0727 63000.0 171.0803 10000.0 173.0598 37000.0 173.0965 11000.0 173.5192 4100.0 173.5351 55000.0 174.0676 710000.0 174.0851 6300.0 174.731 2500.0 175.0754 59000.0 183.0793 2400.0 185.059 10000.0 186.0676 170000.0 187.076 8400.0 188.0834 45000.0 189.0711 5300.0 189.091 320000.0 189.1109 8300.0 191.1065 7400.0 195.3443 2800.0 195.9433 9600.0 201.0715 3700.0 201.0912 150000.0 203.1433 7900.0 219.1014 23000.0 219.1748 11000.0 END IONS BEGIN IONS SCANS=283 PEPMASS=316.1912 CHARGE=1 COLLISION_ENERGY=0.0 49.4812 2300.0 53.0388 5300.0 55.0178 56000.0 55.121 4100.0 56.0499 4700.0 57.0334 4300.0 58.0651 3600000.0 58.068 18000.0 58.0703 16000.0 59.8851 2400.0 61.7118 4700.0 63.5107 2500.0 64.3147 2300.0 67.0542 23000.0 72.0807 64000.0 73.5831 2300.0 77.0389 5600.0 78.0657 2500.0 79.0541 23000.0 79.4075 2400.0 81.0333 6800.0 81.0698 17000.0 83.0492 7100.0 89.348 4500.0 91.0541 470000.0 91.0593 3000.0 91.0607 4700.0 93.0637 7700.0 93.0696 330000.0 95.0425 8700.0 95.049 370000.0 97.0647 32000.0 99.1756 5400.0 103.0541 120000.0 103.9797 4400.0 105.045 11000.0 105.0698 42000.0 107.0404 11000.0 107.049 1000000.0 107.0551 5000.0 107.0576 24000.0 108.779 2500.0 109.0646 39000.0 115.0542 41000.0 117.0607 4300.0 117.0697 730000.0 117.0778 2400.0 119.0392 15000.0 119.0489 940000.0 119.058 14000.0 119.0854 250000.0 121.0646 9800000.0 121.0729 79000.0 121.085 71000.0 121.097 7400.0 123.044 38000.0 123.0802 49000.0 125.0594 94000.0 129.0698 41000.0 131.049 160000.0 132.0569 18000.0 133.0282 27000.0 133.0541 4100.0 133.0646 330000.0 134.0361 3000.0 135.0439 11000.0 135.0802 110000.0 136.0515 26000.0 137.0595 990000.0 137.0694 4500.0 137.8884 4200.0 138.0672 32000.0 145.0646 1700000.0 145.0748 8400.0 145.0767 22000.0 146.0724 60000.0 147.0446 22000.0 147.0802 2500000.0 147.091 16000.0 149.046 11000.0 149.0595 530000.0 149.0959 96000.0 150.0677 26000.0 151.0752 3000000.0 153.0693 8200.0 153.0911 63000.0 155.0601 22000.0 155.0852 12000.0 157.0646 100000.0 157.2565 5100.0 158.0726 2900.0 159.0802 32000.0 161.06 42000.0 161.0961 39000.0 162.0673 62000.0 163.0752 350000.0 164.0833 24000.0 165.0698 45000.0 165.0909 160000.0 167.0853 13000.0 167.3284 4700.0 167.9103 6000.0 169.0645 47000.0 169.1027 3200.0 171.0803 11000.0 173.0964 24000.0 173.5233 7000.0 173.5327 91000.0 173.5443 14000.0 175.0754 8600.0 175.1117 36000.0 177.0909 3300000.0 177.1048 23000.0 178.0779 28000.0 179.0848 6600.0 181.0648 48000.0 181.101 36000.0 182.0726 150000.0 183.0622 2900.0 183.0803 490000.0 183.1166 34000.0 185.0964 7900.0 193.0665 14000.0 193.1012 240000.0 194.0724 4500.0 195.0805 59000.0 196.0881 130000.0 197.0599 39000.0 197.0961 130000.0 199.076 2900.0 201.0912 7500.0 202.0762 4600.0 203.0855 60000.0 206.0724 35000.0 208.4 2300.0 209.0646 4800.0 209.0962 51000.0 210.0676 240000.0 211.0753 340000.0 211.1117 2600000.0 213.0911 12000.0 215.1066 8200.0 217.1014 4700.0 219.0814 15000.0 221.0712 6900.0 221.0961 360000.0 224.0835 91000.0 225.0912 34000.0 225.1273 85000.0 227.0705 16000.0 227.1065 12000.0 229.1226 6500.0 231.0938 2200.0 235.1117 29000.0 237.0909 110000.0 238.0993 20000.0 239.1065 2100000.0 239.1284 11000.0 240.1142 18000.0 241.0835 9300.0 242.0936 460000.0 243.1015 39000.0 243.1382 47000.0 247.6753 2400.0 251.4592 2700.0 253.1217 130000.0 256.1092 53000.0 271.1326 1600000.0 286.5316 5000.0 316.1905 140000.0 END IONS BEGIN IONS SCANS=284 PEPMASS=346.2015 CHARGE=1 COLLISION_ENERGY=0.0 51.9436 2600.0 53.2266 2400.0 54.5931 2800.0 55.7587 2100.0 56.9 2200.0 58.0649 230000.0 63.1965 2600.0 72.12 2100.0 82.2531 2300.0 87.7533 2500.0 91.0539 35000.0 103.054 2700.0 105.0695 6400.0 107.0488 19000.0 109.0647 12000.0 117.0696 28000.0 117.2645 2200.0 119.0489 28000.0 119.0849 5400.0 119.6267 2400.0 121.0645 27000.0 123.0349 3900.0 123.0437 110000.0 123.0537 5300.0 123.0801 3000.0 125.0594 5600.0 131.049 22000.0 131.0853 3500.0 133.0646 9300.0 134.606 2600.0 135.0437 55000.0 135.0802 27000.0 136.052 3800.0 137.0594 690000.0 137.0697 6800.0 139.0749 18000.0 139.2561 2300.0 140.7567 2600.0 145.0645 84000.0 147.0433 2500.0 147.0802 8900.0 149.0594 62000.0 150.0671 40000.0 151.0751 260000.0 151.0892 4800.0 152.0833 11000.0 153.0906 2900.0 157.3542 2300.0 159.0803 27000.0 160.088 33000.0 161.0597 13000.0 163.0425 2900.0 163.0591 3300.0 163.0752 710000.0 163.0915 5100.0 163.098 3900.0 164.0829 66000.0 165.0908 470000.0 166.0982 16000.0 167.1076 3000.0 173.5232 6800.0 173.5324 27000.0 173.5409 9300.0 175.076 7800.0 176.0831 18000.0 177.0911 54000.0 178.0983 7000.0 179.1065 42000.0 189.0902 13000.0 190.1015 2600.0 191.1065 130000.0 192.1141 6900.0 195.081 9700.0 195.1165 18000.0 199.0747 2500.0 208.0897 2500.0 209.0966 6600.0 212.0833 3200.0 213.0917 2700.0 214.3467 2500.0 223.0752 4200.0 223.112 53000.0 224.388 2200.0 226.0983 3800.0 227.1059 3900.0 237.0914 7000.0 240.0779 12000.0 240.1154 3200.0 241.0856 3100.0 241.1224 58000.0 243.6799 2400.0 251.1068 41000.0 252.1143 17000.0 254.0936 32000.0 255.1062 12000.0 255.1379 54000.0 257.0817 7500.0 258.0896 6200.0 269.1174 56000.0 270.1253 58000.0 272.1045 140000.0 273.1124 2800.0 283.1333 59000.0 286.1202 79000.0 294.6582 2500.0 301.144 170000.0 341.8767 2500.0 346.1998 6100.0 END IONS BEGIN IONS SCANS=285 PEPMASS=330.2068 CHARGE=1 COLLISION_ENERGY=0.0 49.0782 3400.0 49.4218 4600.0 50.7393 5000.0 53.0386 11000.0 53.3624 4800.0 53.5301 8400.0 54.8592 2700.0 55.0179 140000.0 55.2412 5600.0 56.5673 2900.0 57.0335 17000.0 57.6435 8600.0 57.924 4800.0 58.0448 4800.0 59.6762 4900.0 60.0807 200000.0 61.0828 4900.0 62.5594 6100.0 63.6312 5600.0 64.0734 7700.0 64.2443 8200.0 64.3973 9700.0 67.0542 79000.0 67.7813 7000.0 69.0334 23000.0 71.0801 5300.0 75.5647 7600.0 77.0391 53000.0 79.0542 76000.0 81.0335 34000.0 81.0699 68000.0 83.0492 32000.0 83.7944 5700.0 83.8186 7800.0 87.4388 8800.0 88.0396 7700.0 91.0543 1100000.0 93.0637 14000.0 93.0698 750000.0 95.0491 1100000.0 95.4283 2900.0 96.7132 3100.0 97.0285 21000.0 97.0648 110000.0 103.0542 330000.0 105.0699 120000.0 107.0405 17000.0 107.0492 2700000.0 107.0576 69000.0 109.0648 120000.0 110.9841 7300.0 111.0438 51000.0 115.0546 110000.0 117.0699 1900000.0 119.0392 65000.0 119.0493 3000000.0 119.0591 36000.0 119.0856 700000.0 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213.055 5400.0 213.0912 460000.0 213.1274 120000.0 215.107 200000.0 216.1159 15000.0 217.0845 17000.0 218.0731 48000.0 219.0808 140000.0 220.089 54000.0 221.0953 54000.0 222.0671 110000.0 223.0743 210000.0 223.1119 3100000.0 223.137 39000.0 224.0833 53000.0 224.1196 280000.0 225.0919 130000.0 225.1289 28000.0 226.0988 300000.0 227.0696 95000.0 227.1069 420000.0 229.0857 15000.0 229.1213 7700.0 231.1401 27000.0 233.0961 190000.0 234.1039 87000.0 236.0831 320000.0 237.0911 360000.0 237.1278 77000.0 238.0987 65000.0 239.0699 130000.0 239.1069 150000.0 240.0782 640000.0 240.1144 240000.0 241.0865 470000.0 241.1223 3400000.0 241.1505 34000.0 242.0941 140000.0 243.1016 35000.0 245.1174 35000.0 245.1522 24000.0 250.0981 24000.0 251.0764 30000.0 251.1065 2400000.0 251.1291 4900.0 251.137 6200.0 252.1144 940000.0 253.0869 97000.0 253.1229 130000.0 254.0937 1800000.0 254.1248 8000.0 255.1022 650000.0 255.1378 3500000.0 257.0807 370000.0 257.1109 8800.0 258.0885 290000.0 259.0982 16000.0 259.1332 57000.0 265.1224 280000.0 267.1021 15000.0 268.1096 540000.0 269.1171 3400000.0 269.144 12000.0 270.125 2800000.0 270.1514 3600.0 271.0962 380000.0 271.1276 37000.0 272.1043 6000000.0 272.1318 8300.0 273.1121 390000.0 273.1485 390000.0 283.133 3900000.0 286.12 5400000.0 286.1587 5900.0 301.0636 23000.0 301.1435 15000000.0 301.2227 28000.0 360.2163 530000.0 END IONS BEGIN IONS SCANS=287 PEPMASS=358.2018 CHARGE=1 COLLISION_ENERGY=0.0 53.2053 2300.0 53.2745 2200.0 54.3296 2200.0 55.0178 22000.0 63.0243 2300.0 64.7733 2300.0 65.069 2700.0 65.2348 2600.0 66.0332 2200.0 66.5202 2700.0 67.8678 2400.0 69.0333 31000.0 72.9375 2700.0 77.6556 2200.0 78.1121 2500.0 79.8587 2800.0 80.1455 2300.0 81.0333 3600.0 83.0488 19000.0 85.7991 2500.0 86.0963 7400.0 91.0542 36000.0 91.9367 2400.0 95.0488 3600.0 95.4944 2300.0 95.5795 2100.0 98.4981 2900.0 100.3276 2500.0 103.0097 2400.0 103.055 3000.0 105.0697 13000.0 107.0488 11000.0 115.0542 16000.0 115.6635 2600.0 117.0697 86000.0 119.0853 7300.0 120.529 2300.0 121.0645 140000.0 122.9545 2900.0 126.5052 2600.0 131.0493 9800.0 133.0647 10000.0 134.0723 17000.0 134.3362 2500.0 135.0441 17000.0 135.0803 14000.0 136.8904 2600.0 137.6474 2600.0 139.2632 2300.0 139.9684 2700.0 142.6139 2300.0 145.0644 50000.0 146.0724 370000.0 147.045 3600.0 147.0803 66000.0 149.0595 45000.0 149.096 49000.0 150.0669 2700.0 151.0386 7200.0 151.0751 120000.0 161.0597 34000.0 161.3965 2600.0 162.0675 210000.0 163.0608 7500.0 163.0753 570000.0 163.0913 3700.0 164.0827 32000.0 165.0909 260000.0 165.1772 2300.0 167.5145 2500.0 173.5218 14000.0 173.534 110000.0 173.5415 9300.0 174.0672 5300.0 175.0753 42000.0 177.0345 3900.0 177.0548 71000.0 177.091 15000000.0 177.1048 40000.0 177.1191 50000.0 177.1276 68000.0 177.1378 7900.0 177.235 2500.0 177.5266 2400.0 178.0797 2400.0 178.0986 42000.0 179.0697 2700.0 179.0869 9700.0 179.1068 23000.0 181.6611 3000.0 187.076 2600.0 188.0831 36000.0 189.0912 94000.0 190.0988 150000.0 193.0857 17000.0 195.0813 3500.0 196.0878 6800.0 197.0962 27000.0 198.1038 16000.0 199.1117 2900.0 200.0829 12000.0 201.0912 110000.0 202.099 23000.0 203.1067 24000.0 205.0856 3000.0 207.0799 8000.0 208.3153 2500.0 209.0964 14000.0 211.0756 22000.0 211.1128 34000.0 212.0841 9600.0 212.1199 150000.0 213.0912 29000.0 214.0991 40000.0 214.6382 3100.0 215.1071 53000.0 221.0968 23000.0 222.1043 62000.0 222.1488 27000.0 223.0757 14000.0 224.0829 25000.0 225.0911 62000.0 226.0989 3200.0 227.0701 2600.0 227.1066 44000.0 228.1147 90000.0 228.8248 2500.0 229.1224 91000.0 234.5801 2600.0 235.0745 15000.0 238.0993 79000.0 239.1067 110000.0 240.1145 110000.0 241.0862 120000.0 241.1168 8200.0 242.0934 55000.0 243.1039 17000.0 243.1382 480000.0 249.0908 23000.0 250.0991 70000.0 251.0697 14000.0 252.0793 7900.0 253.0861 100000.0 253.1224 130000.0 255.1018 31000.0 256.0782 10000.0 256.1095 590000.0 256.1389 6600.0 266.0937 34000.0 267.1015 69000.0 268.1093 110000.0 269.0809 73000.0 270.0895 9800.0 271.1333 520000.0 281.1179 60000.0 284.1049 270000.0 299.1288 280000.0 330.2069 180000.0 335.9919 2400.0 338.9789 2700.0 349.7947 2500.0 355.5294 3000.0 358.2016 99000.0 END IONS BEGIN IONS SCANS=288 PEPMASS=359.2057 CHARGE=1 COLLISION_ENERGY=0.0 51.7463 2200.0 53.68 2300.0 54.5964 2200.0 58.7645 2300.0 59.8168 2700.0 60.0563 2300.0 66.1762 2100.0 69.9528 2300.0 78.4305 2200.0 83.8429 2500.0 90.2414 2800.0 103.5202 2200.0 107.049 2700.0 108.7204 2300.0 117.0696 6400.0 117.353 2600.0 117.5241 2400.0 118.4787 2800.0 121.0645 14000.0 121.5842 2300.0 123.0433 2700.0 126.7945 2400.0 133.5957 2800.0 135.0804 2500.0 136.867 2100.0 137.0595 38000.0 146.0721 33000.0 147.0767 24000.0 149.686 5100.0 151.0748 23000.0 152.0785 3400.0 154.2136 2300.0 154.9753 2700.0 155.6477 2300.0 162.0669 17000.0 163.0749 120000.0 164.0811 74000.0 165.0909 53000.0 166.0947 20000.0 173.5311 55000.0 173.5413 11000.0 177.0735 5000.0 177.091 1300000.0 178.0947 1400000.0 179.1043 4900.0 189.0895 6100.0 190.0985 12000.0 191.1047 13000.0 200.8581 2700.0 201.0905 9200.0 202.0954 11000.0 212.1197 3400.0 213.1238 17000.0 214.281 3000.0 215.1031 3000.0 216.1098 5100.0 221.73 2600.0 222.1492 100000.0 223.1112 2900.0 225.0904 5800.0 226.0974 2300.0 229.1203 13000.0 230.1256 5800.0 239.1039 11000.0 240.1109 17000.0 241.1186 13000.0 242.0904 18000.0 243.1382 18000.0 244.1416 55000.0 251.1039 13000.0 253.931 2300.0 254.0906 9600.0 254.1251 11000.0 256.1095 18000.0 257.1128 69000.0 267.0988 2800.0 268.1062 7800.0 269.0787 2900.0 269.1134 19000.0 269.3647 2500.0 270.0869 3200.0 271.0937 3600.0 271.1327 17000.0 272.105 7300.0 272.1369 70000.0 282.122 3400.0 284.1042 7300.0 285.1095 39000.0 300.1316 47000.0 301.1442 13000.0 327.6346 2300.0 331.2104 22000.0 359.2055 16000.0 END IONS BEGIN IONS SCANS=289 PEPMASS=303.0746 CHARGE=1 COLLISION_ENERGY=0.0 53.9307 2100.0 54.784 2600.0 55.0763 2200.0 55.318 2100.0 56.2132 2900.0 57.4545 2200.0 60.6842 2600.0 60.8891 2600.0 63.1142 2100.0 66.6551 2500.0 67.2028 2200.0 68.7786 2200.0 72.6801 2200.0 80.9999 2700.0 83.341 2300.0 83.8232 2500.0 86.6664 2400.0 88.6826 2500.0 89.1582 2600.0 96.0994 2300.0 102.1078 2300.0 125.0607 2200.0 150.1905 2400.0 151.8699 2200.0 165.7023 2700.0 173.5227 19000.0 173.5328 13000.0 173.5407 31000.0 180.924 2600.0 210.1628 3000.0 266.5216 2400.0 278.5314 2500.0 294.2906 2700.0 303.0742 200000.0 303.1116 4200.0 307.463 2200.0 312.0676 2300.0 END IONS BEGIN IONS SCANS=290 PEPMASS=281.0925 CHARGE=1 COLLISION_ENERGY=0.0 49.3715 2300.0 51.2417 2000.0 54.4645 2300.0 55.015 3300.0 55.0178 220000.0 55.7283 2100.0 56.8594 2400.0 57.7968 2200.0 58.0134 2400.0 59.528 2500.0 63.2727 2600.0 63.2742 13000.0 66.4625 2400.0 66.6341 2700.0 67.0542 17000.0 67.3609 2200.0 69.134 2200.0 70.2726 30000.0 70.2749 4700.0 70.876 2200.0 71.3171 2600.0 72.1629 2200.0 74.3562 2400.0 78.7379 2600.0 79.0542 2800.0 80.0494 40000.0 81.0334 15000.0 83.222 2500.0 85.2666 2600.0 87.2006 2300.0 94.0289 10000.0 94.0651 2800.0 94.4701 2500.0 95.0425 3300.0 95.049 250000.0 96.0444 13000.0 96.8866 2000.0 100.9975 2600.0 103.1777 2900.0 104.0494 50000.0 104.056 2700.0 106.532 2400.0 107.049 62000.0 108.9638 2300.0 117.6101 2600.0 118.0625 2300.0 119.0603 26000.0 120.0444 47000.0 121.0519 2300.0 122.06 37000.0 123.044 34000.0 124.012 2600.0 130.0652 5200.0 132.0444 410000.0 132.0557 4300.0 133.0522 47000.0 134.0602 11000.0 136.002 3000.0 142.8289 2500.0 143.0607 15000.0 146.0026 2300.0 146.06 51000.0 147.0552 110000.0 147.2693 3000.0 148.0392 51000.0 148.0624 3500.0 149.0475 6500.0 150.055 50000.0 156.0682 36000.0 156.0811 15000.0 157.0762 13000.0 158.06 38000.0 159.0553 410000.0 159.0691 3800.0 168.081 6400.0 169.8691 2600.0 170.0594 14000.0 171.0379 3600.0 171.0554 530000.0 171.0723 8600.0 172.0631 170000.0 173.5261 27000.0 173.5359 45000.0 174.0556 2500.0 175.0519 2900.0 180.0809 64000.0 182.0838 49000.0 183.0734 4200.0 183.0918 170000.0 184.0762 43000.0 185.0709 30000.0 186.0554 46000.0 186.141 2500.0 193.0755 3700.0 194.059 5800.0 195.0921 6200.0 196.0621 2700.0 197.0712 32000.0 197.1073 150000.0 198.0764 12000.0 198.0932 8700.0 199.0502 3500.0 199.0865 75000.0 206.0835 9900.0 207.0721 2600.0 207.0918 120000.0 208.076 280000.0 208.0984 11000.0 209.0712 130000.0 210.0607 6800.0 210.079 640000.0 210.1016 10000.0 211.0868 2300000.0 213.0664 14000.0 221.0674 2900.0 222.0778 6900.0 223.0867 50000.0 224.0723 22000.0 224.0944 75000.0 225.0645 42000.0 225.0735 3800.0 225.1025 1500000.0 225.1285 9100.0 226.0866 23000.0 235.0595 9300.0 235.0867 540000.0 235.1122 4700.0 236.0707 240000.0 236.094 35000.0 238.0737 310000.0 239.0815 38000.0 246.0787 4300.0 251.0816 33000.0 252.0645 20000.0 252.0907 32000.0 253.0343 17000.0 253.0746 29000.0 253.0972 5900000.0 253.1473 4400.0 253.1588 41000.0 254.0772 2800.0 263.0815 180000.0 264.0625 7200.0 264.0903 15000.0 266.0684 6200.0 280.9985 4200.0 281.0199 40000.0 281.0339 10000.0 281.0923 7900000.0 281.1504 6400.0 281.1643 31000.0 281.1858 7200.0 END IONS BEGIN IONS SCANS=291 PEPMASS=313.0824 CHARGE=1 COLLISION_ENERGY=0.0 48.6851 2300.0 51.0819 2200.0 53.9695 2100.0 54.4947 2100.0 54.7005 2300.0 56.6812 2200.0 57.3295 2600.0 63.2579 2900.0 64.4254 2200.0 66.0521 2500.0 69.4306 2500.0 77.5741 2300.0 80.0493 8400.0 84.4237 2200.0 89.3877 2300.0 92.9952 2500.0 104.0322 2600.0 114.658 2500.0 116.5589 2100.0 120.0439 27000.0 122.4889 2400.0 132.0442 6800.0 136.0393 16000.0 138.0547 130000.0 138.9747 2400.0 140.8524 2400.0 141.6575 2200.0 144.6192 2600.0 144.8528 2400.0 148.0389 280000.0 148.053 2400.0 148.8247 2200.0 149.0467 11000.0 150.0548 44000.0 151.0388 5200.0 160.863 2600.0 163.9288 2300.0 164.0341 220000.0 165.042 51000.0 165.0559 2900.0 166.05 8300.0 173.528 32000.0 173.5388 19000.0 186.4388 2400.0 190.0507 3400.0 198.0186 2500.0 203.8834 13000.0 205.7709 2700.0 205.8996 6200.0 211.0865 18000.0 212.0707 11000.0 219.8402 2300.0 221.0706 5400.0 222.0547 16000.0 223.8292 2500.0 224.071 12000.0 239.0815 180000.0 240.065 33000.0 249.066 42000.0 250.0491 12000.0 252.0658 24000.0 257.0914 4600.0 263.253 2400.0 267.0763 260000.0 268.0604 80000.0 268.1491 2700.0 268.2787 3100.0 277.0612 76000.0 278.0444 22000.0 285.0871 250000.0 285.1228 3700.0 295.0716 170000.0 313.0818 54000.0 END IONS BEGIN IONS SCANS=292 PEPMASS=640.262 CHARGE=1 COLLISION_ENERGY=0.0 68.1493 3000.0 69.4616 2100.0 70.0649 700000.0 70.0689 4100.0 70.7526 2400.0 72.5076 2400.0 74.009 2400.0 74.4105 2200.0 78.4245 2300.0 80.0798 2200.0 82.3174 2100.0 84.0442 54000.0 88.465 2400.0 91.054 17000.0 92.3472 2800.0 97.0759 2800.0 97.4677 2300.0 99.0718 2300.0 102.0548 13000.0 111.9903 2500.0 115.0862 32000.0 118.0649 80000.0 119.0729 7800.0 120.0807 72000.0 125.0707 22000.0 130.0655 2500.0 133.0289 2300.0 134.045 2600.0 136.0757 22000.0 137.0707 68000.0 139.0863 20000.0 146.0469 2900.0 146.0598 660000.0 153.0894 100000.0 155.0819 5700.0 157.0969 630000.0 157.1081 3900.0 157.1123 9900.0 163.2595 2400.0 164.0702 15000.0 164.0836 4100.0 165.0542 4300.0 165.0889 3000.0 165.1924 2900.0 166.0972 2400.0 167.082 4800.0 168.0892 20000.0 172.1122 33000.0 173.5257 43000.0 173.537 48000.0 180.8919 2400.0 181.7355 2600.0 182.0812 45000.0 183.1 8000.0 184.1082 10000.0 185.0922 120000.0 187.1229 3000.0 199.1245 4400.0 204.1026 9100.0 210.4073 2500.0 215.1178 11000.0 216.1258 54000.0 217.1337 60000.0 224.1039 19000.0 225.1015 4400.0 229.0971 9200.0 236.1071 38000.0 243.1127 47000.0 245.094 2700.0 245.8321 2700.0 247.1078 100000.0 254.128 11000.0 256.144 9500.0 258.1236 8900.0 264.1018 12000.0 265.0857 24000.0 266.1281 12000.0 268.1448 16000.0 270.1128 22000.0 273.0873 110000.0 275.1028 130000.0 282.1148 83000.0 284.1399 41000.0 286.1556 220000.0 291.0975 14000.0 293.1135 100000.0 294.124 48000.0 300.1348 120000.0 301.0825 13000.0 302.1155 6700.0 303.099 2900.0 312.1348 140000.0 319.0919 12000.0 330.1454 480000.0 331.1526 21000.0 347.1391 47000.0 356.5707 2500.0 357.1223 16000.0 381.1449 46000.0 393.0888 2600.0 393.1443 44000.0 399.1554 21000.0 410.1704 7600.0 424.3916 2800.0 435.2497 2900.0 438.1656 15000.0 456.1763 30000.0 484.1705 27000.0 507.2225 18000.0 511.218 13000.0 525.2303 6200.0 535.2188 4500.0 553.228 20000.0 577.5272 3000.0 579.2559 2500.0 622.2517 76000.0 END IONS BEGIN IONS SCANS=293 PEPMASS=489.2237 CHARGE=1 COLLISION_ENERGY=0.0 58.9348 2400.0 62.2615 2400.0 64.0988 2100.0 64.4226 2400.0 71.6751 2400.0 73.9159 2400.0 76.9449 2200.0 79.5489 2300.0 89.2628 2300.0 90.1172 2100.0 91.0543 4300.0 97.1915 2400.0 104.88 2200.0 111.5135 2300.0 116.0702 2800.0 119.0486 2700.0 129.7286 2100.0 137.048 4500.0 137.0595 160000.0 137.0715 5400.0 143.6977 2500.0 147.0443 3300.0 147.2504 2800.0 158.1307 2200.0 159.0761 8700.0 162.0675 25000.0 163.0388 4800.0 163.0743 3100.0 173.5216 15000.0 173.5381 41000.0 175.0382 3100.0 177.0553 2700.0 178.0626 20000.0 180.1024 5500.0 189.0549 17000.0 189.9072 2400.0 190.0624 190000.0 191.0337 34000.0 191.0698 13000.0 192.0811 3300.0 192.1018 510000.0 192.1222 4200.0 193.0859 170000.0 206.0573 67000.0 221.0303 14000.0 221.0808 3700000.0 221.1204 12000.0 221.132 12000.0 222.0847 8200.0 223.0867 4000.0 251.139 19000.0 252.1228 30000.0 269.1494 25000.0 290.1395 2600.0 295.1293 16000.0 297.316 2200.0 336.144 450000.0 336.1798 2300.0 353.171 3500.0 370.0054 2600.0 387.2316 2500.0 403.307 2200.0 404.2116 2300.0 413.1259 2600.0 472.1961 12000.0 489.2233 37000.0 END IONS BEGIN IONS SCANS=294 PEPMASS=490.2803 CHARGE=1 COLLISION_ENERGY=0.0 59.049 2300.0 59.6247 2300.0 59.6644 2400.0 60.9198 2400.0 61.8592 2300.0 70.4001 2300.0 71.0126 2600.0 71.0491 19000.0 73.0283 67000.0 74.7387 2500.0 75.0438 260000.0 83.0491 19000.0 85.0282 76000.0 87.0441 14000.0 87.2511 2400.0 95.0494 5900.0 99.0438 4000.0 101.0595 13000.0 103.238 2600.0 105.0696 2200.0 105.9946 2600.0 107.049 49000.0 111.044 22000.0 113.0599 3100.0 116.4025 2200.0 119.0492 17000.0 119.0853 8700.0 121.0646 370000.0 123.0801 6900.0 125.0596 15000.0 126.2751 2200.0 129.0543 21000.0 131.0499 2600.0 133.0646 30000.0 135.0803 32000.0 135.5839 2400.0 136.8827 2300.0 137.0597 31000.0 138.0634 4500.0 139.0752 43000.0 139.826 2900.0 140.9075 2500.0 141.0908 8200.0 145.0646 33000.0 147.0803 230000.0 149.0597 9000.0 149.0962 8500.0 150.0681 7700.0 151.0752 120000.0 152.0832 2800.0 159.0804 17000.0 161.096 44000.0 163.0753 140000.0 163.0892 4600.0 165.091 260000.0 167.1064 8500.0 173.0958 9700.0 173.5209 17000.0 173.5384 62000.0 177.0912 50000.0 179.1062 12000.0 180.3907 3000.0 183.081 8400.0 184.338 2300.0 190.0624 18000.0 191.0665 9300.0 191.1067 72000.0 192.1019 63000.0 193.0859 17000.0 193.1053 41000.0 194.0898 9000.0 196.0884 2900.0 197.0965 13000.0 206.0576 6400.0 207.0608 3600.0 208.7045 2900.0 221.0808 390000.0 222.0844 370000.0 222.1065 3500.0 224.083 9800.0 225.0907 9100.0 225.1028 3100.0 225.1274 100000.0 238.0996 11000.0 239.1064 3000.0 251.1389 2300.0 253.1221 150000.0 254.1303 13000.0 256.1093 32000.0 257.1176 7900.0 257.1532 8900.0 267.1383 17000.0 269.1472 2700.0 270.1251 150000.0 270.1572 4600.0 283.1327 14000.0 285.1487 1500000.0 309.1481 13000.0 313.1426 9500.0 327.1598 11000.0 336.1439 26000.0 337.1474 64000.0 342.0614 3000.0 344.2219 120000.0 365.6527 2400.0 369.1689 6600.0 377.1728 3400.0 402.2407 2400.0 431.2062 3800.0 490.2788 76000.0 END IONS BEGIN IONS SCANS=295 PEPMASS=449.1713 CHARGE=1 COLLISION_ENERGY=0.0 56.8865 2200.0 61.5913 2200.0 63.0213 2300.0 63.1722 2400.0 63.2375 2400.0 63.7944 2700.0 64.0086 2700.0 64.3667 2700.0 64.8398 2400.0 65.9281 2900.0 67.7377 2600.0 68.3698 2400.0 68.8276 2300.0 69.0293 2100.0 71.5907 2300.0 72.8398 3100.0 75.6297 2100.0 76.4784 2100.0 76.9358 2700.0 77.5969 2200.0 79.0628 2500.0 82.1275 2400.0 84.6071 2200.0 85.7695 2300.0 87.5895 2300.0 89.6842 2500.0 91.4467 2200.0 94.2329 2100.0 96.3736 2600.0 97.6466 2400.0 97.9765 2400.0 102.1087 2800.0 107.0488 660000.0 108.0442 17000.0 108.5198 2300.0 115.0543 2300.0 118.7922 2400.0 121.0649 17000.0 123.1134 2300.0 124.0252 2600.0 125.5591 2500.0 126.0547 48000.0 129.4279 2300.0 130.7923 2400.0 135.002 2300.0 135.1574 2500.0 136.5994 2300.0 137.0594 110000.0 141.0617 2600.0 142.0237 2300.0 142.4675 2200.0 142.5887 2300.0 143.049 65000.0 145.0646 110000.0 146.4007 2500.0 151.0752 60000.0 152.034 24000.0 154.0352 18000.0 154.0495 1000000.0 154.0621 7400.0 161.5772 2500.0 163.0752 38000.0 164.034 340000.0 165.042 24000.0 167.0126 2700.0 173.4472 2400.0 173.5256 70000.0 173.5374 100000.0 175.0596 3600.0 175.0752 250000.0 177.0902 2800.0 178.0861 880000.0 178.1029 6700.0 179.8894 2700.0 180.9076 2600.0 181.061 53000.0 184.3201 2600.0 187.6048 2300.0 188.7827 2500.0 189.6194 2700.0 190.0861 53000.0 191.0951 2200.0 195.051 2600.0 196.8514 2400.0 197.102 2700.0 209.0961 53000.0 215.4249 2200.0 219.0814 2500.0 222.9476 2400.0 226.3041 2500.0 237.0909 220000.0 241.0857 2900.0 250.5495 2600.0 256.8345 2400.0 269.0849 5000.0 269.1171 700000.0 277.6017 3400.0 286.1438 240000.0 294.7574 3000.0 297.2988 2200.0 298.1441 98000.0 299.1522 2600.0 303.3109 2600.0 307.0809 2400.0 321.8969 2600.0 324.4569 2400.0 337.0715 2400.0 338.818 2600.0 346.9269 2400.0 374.214 2500.0 376.6181 2400.0 379.4111 2200.0 386.7341 2600.0 426.4266 2500.0 431.1503 2700.0 449.1707 590000.0 449.2794 8400.0 END IONS BEGIN IONS SCANS=296 PEPMASS=303.108 CHARGE=1 COLLISION_ENERGY=0.0 52.4894 2200.0 55.0178 2900.0 55.0539 6600.0 57.0334 3700.0 58.6019 2400.0 60.9212 2400.0 64.9449 2200.0 66.3989 2600.0 67.054 8200.0 67.5835 2400.0 78.3871 2100.0 79.0539 41000.0 81.0696 13000.0 82.1676 2200.0 83.995 2300.0 89.9544 2700.0 91.0541 17000.0 91.9983 2300.0 93.0696 30000.0 94.3439 2500.0 97.1009 6100.0 100.8975 2200.0 107.049 15000.0 107.0851 55000.0 111.0801 15000.0 117.0695 31000.0 119.236 2500.0 119.5576 2500.0 121.0642 4100.0 123.502 2100.0 125.0958 30000.0 127.4313 2200.0 135.0802 130000.0 141.8241 2500.0 145.0647 6400.0 153.0907 110000.0 155.2177 2500.0 163.0751 26000.0 173.5221 4200.0 173.5361 35000.0 181.0859 110000.0 182.7056 2600.0 190.0052 2500.0 252.5941 2500.0 265.1013 2400.0 END IONS BEGIN IONS SCANS=297 PEPMASS=427.1802 CHARGE=1 COLLISION_ENERGY=0.0 81.0445 9800.0 82.0525 3700.0 83.06 52000.0 85.0394 3900.0 86.0961 1300000.0 86.1022 6500.0 86.1053 8600.0 87.0994 22000.0 88.039 82000.0 91.0538 27000.0 93.0444 17000.0 93.1521 2300.0 95.0601 30000.0 96.8882 2700.0 97.7586 2500.0 98.7541 2200.0 101.0596 5200.0 105.8668 2200.0 106.0647 3500.0 107.0487 24000.0 110.0709 830000.0 110.0793 5100.0 110.0838 4700.0 111.0439 19000.0 111.0746 14000.0 115.3928 2500.0 118.0649 20000.0 119.0163 2400.0 119.0489 30000.0 119.0728 6600.0 119.1306 2500.0 120.0546 3300.0 120.0805 37000.0 121.2741 2500.0 122.06 2700.0 122.0703 4700.0 123.044 13000.0 125.1066 3100.0 129.054 5300.0 130.0647 14000.0 131.0487 54000.0 134.0499 2900.0 134.0597 100000.0 135.0437 5900.0 135.0674 29000.0 135.0781 2900.0 136.0501 76000.0 136.0754 260000.0 136.975 2600.0 137.0785 2400.0 138.0658 13000.0 138.9815 2300.0 141.1008 6700.0 146.0595 67000.0 150.0651 6200.0 155.0926 41000.0 160.0385 4200.0 162.04 3800.0 162.0547 230000.0 162.4612 2400.0 163.0582 5200.0 164.0452 150000.0 164.0688 3100.0 165.0547 40000.0 165.077 29000.0 166.061 16000.0 166.5758 2500.0 167.0926 25000.0 172.0757 3700.0 173.0714 4000.0 173.5214 9200.0 173.5289 82000.0 173.5404 29000.0 174.0544 11000.0 174.071 2500.0 174.1277 10000.0 174.3013 2500.0 178.0607 61000.0 178.1352 2600.0 178.363 2500.0 179.0824 2600.0 181.0717 22000.0 182.0569 2800.0 182.0808 19000.0 183.0795 2600.0 184.6073 31000.0 184.6231 2300.0 186.1273 9100.0 186.5827 2400.0 188.0697 3800.0 188.143 33000.0 190.1226 17000.0 193.0718 46000.0 193.1685 2300.0 195.0875 130000.0 198.055 16000.0 198.1025 36000.0 201.6745 2500.0 202.2653 2400.0 205.0723 5300.0 205.0963 3100.0 206.0786 2300.0 210.1032 20000.0 211.0756 6500.0 212.118 87000.0 213.7658 3200.0 214.099 20000.0 214.1226 39000.0 216.0661 24000.0 216.9616 2700.0 217.0613 22000.0 219.0749 2600.0 221.067 40000.0 222.0962 3300.0 223.0773 2900.0 224.1072 9300.0 226.0967 5500.0 228.113 70000.0 231.1485 9500.0 232.1567 9700.0 235.0822 4300.0 236.6199 8500.0 237.1128 2700.0 238.097 66000.0 240.0583 2400.0 240.102 200000.0 241.1075 7300.0 242.1178 3000.0 243.1212 3300.0 244.0996 2600.0 248.868 2500.0 249.0871 26000.0 250.0867 8800.0 250.6183 5400.0 252.1025 2600.0 254.0912 10000.0 255.1237 230000.0 256.107 23000.0 259.071 94000.0 259.1439 78000.0 264.1086 27000.0 265.1063 7300.0 266.093 14000.0 267.0991 6300.0 268.098 12000.0 269.0922 8400.0 271.1182 29000.0 273.1352 46000.0 275.0678 4400.0 277.0823 110000.0 278.7834 2900.0 279.0763 5000.0 279.1133 35000.0 280.084 5800.0 282.0875 16000.0 283.1191 220000.0 284.1234 14000.0 286.1075 83000.0 288.0998 13000.0 289.1055 3000.0 291.1566 2400.0 293.104 3000.0 296.0912 2800.0 297.1004 31000.0 298.1079 5700.0 299.1141 280000.0 300.1162 9700.0 302.0954 8600.0 310.1148 22000.0 311.1112 30000.0 312.1458 2600.0 313.1301 2700.0 325.0935 47000.0 329.0381 2600.0 335.7658 2400.0 336.0936 34000.0 337.1914 11000.0 340.1402 21000.0 341.1123 27000.0 352.1398 5700.0 352.2126 5200.0 363.1696 3500.0 366.0951 4000.0 368.1323 6800.0 368.2075 4300.0 373.1644 6400.0 378.1934 27000.0 394.1429 7600.0 396.1319 13000.0 396.2027 20000.0 398.1496 4700.0 399.145 15000.0 400.1778 7100.0 401.1358 81000.0 402.1349 3100.0 414.1401 30000.0 415.1494 6200.0 416.1718 60000.0 418.1824 2700.0 427.1397 46000.0 440.123 7300.0 444.1674 45000.0 456.1418 3400.0 472.1595 8600.0 518.1951 3100.0 559.1927 6200.0 579.3061 3100.0 587.1882 3700.0 595.2131 17000.0 608.2667 2500.0 669.3976 2700.0 711.7042 2600.0 740.266 39000.0 741.2672 2800.0 800.6078 2600.0 808.6974 2300.0 END IONS BEGIN IONS SCANS=298 PEPMASS=282.1494 CHARGE=1 COLLISION_ENERGY=0.0 46.325 2100.0 51.3577 2400.0 51.8416 2200.0 52.5308 2400.0 57.0698 2700.0 57.6017 2400.0 58.1726 2300.0 59.8766 2300.0 62.7747 2500.0 63.0022 2600.0 64.5842 2500.0 67.0518 2600.0 67.8538 2000.0 70.319 2300.0 77.723 2900.0 77.9594 2300.0 83.0858 5600.0 84.7702 2900.0 88.2069 2400.0 89.4502 2400.0 93.5135 2300.0 95.9347 2200.0 96.6856 3000.0 96.7416 2200.0 100.0656 2700.0 107.7147 2200.0 118.6508 2400.0 118.82 2400.0 127.719 2400.0 129.937 2400.0 131.6122 2600.0 134.0963 88000.0 142.8487 2300.0 150.674 2500.0 152.5268 2300.0 165.0709 4200.0 167.085 5100.0 173.5235 39000.0 173.5373 75000.0 173.5435 3400.0 173.8466 2500.0 177.0689 2800.0 177.2141 2400.0 178.0775 6000.0 179.0842 3300.0 189.071 3100.0 190.078 35000.0 190.2023 2300.0 191.0651 9700.0 191.0856 800000.0 191.1058 11000.0 191.1154 3100.0 193.0644 3100.0 193.1009 6800.0 194.0726 48000.0 195.0803 91000.0 197.4783 2300.0 201.0693 11000.0 203.085 6800.0 204.5715 2400.0 205.1008 33000.0 207.0809 25000.0 208.0886 71000.0 211.1353 21000.0 218.0721 6500.0 219.0302 3100.0 219.056 9200.0 219.0806 2300000.0 219.1055 14000.0 221.0967 43000.0 223.1117 34000.0 229.0761 62000.0 236.0833 350000.0 249.1257 2300.0 249.6671 2300.0 251.0763 4700.0 251.1066 3000000.0 269.5633 2400.0 275.5179 2500.0 282.149 3100.0 282.2219 230000.0 289.5362 2300.0 END IONS BEGIN IONS SCANS=299 PEPMASS=610.2878 CHARGE=1 COLLISION_ENERGY=0.0 65.0523 4800.0 70.0651 4100000.0 70.0706 39000.0 70.074 14000.0 72.0806 570000.0 72.0876 7900.0 91.0543 34000.0 97.0758 50000.0 98.0599 240000.0 107.0489 14000.0 109.0769 9000.0 115.0865 590000.0 115.096 10000.0 118.065 160000.0 119.0733 23000.0 120.0806 160000.0 125.0708 270000.0 126.0548 120000.0 134.2791 5500.0 136.0757 79000.0 137.0708 160000.0 141.1384 15000.0 146.0599 1500000.0 151.1231 38000.0 152.0818 39000.0 153.0769 3700.0 153.0895 280000.0 153.1386 18000.0 155.0449 6200.0 158.9574 4800.0 160.076 24000.0 160.1121 9000.0 162.092 4800.0 164.0705 48000.0 165.055 40000.0 166.1336 6500.0 167.118 86000.0 169.1092 6400.0 169.1335 1100000.0 169.1504 11000.0 172.1121 350000.0 173.5221 14000.0 173.5349 120000.0 174.0553 29000.0 174.1277 66000.0 176.0708 3800.0 179.1179 54000.0 180.1124 48000.0 180.1261 88000.0 182.0813 220000.0 187.087 12000.0 187.123 44000.0 188.0707 72000.0 192.6137 3600.0 194.1288 14000.0 195.1145 27000.0 195.1367 81000.0 196.1445 47000.0 197.1075 3800.0 197.1284 370000.0 199.1229 83000.0 205.0971 97000.0 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50000.0 355.1301 35000.0 357.0938 5000.0 357.1442 310000.0 369.1443 310000.0 378.141 6600.0 386.1717 34000.0 396.1558 66000.0 397.1392 38000.0 398.1715 64000.0 414.1661 210000.0 424.1504 75000.0 438.198 15000.0 442.1606 760000.0 465.2135 14000.0 466.196 15000.0 477.2483 19000.0 483.2233 430000.0 493.2071 100000.0 511.2182 460000.0 523.253 30000.0 581.7455 4100.0 592.2734 24000.0 610.2857 220000.0 END IONS BEGIN IONS SCANS=300 PEPMASS=388.1609 CHARGE=1 COLLISION_ENERGY=0.0 53.0386 5600.0 55.0176 20000.0 57.0334 9700.0 61.0282 16000.0 69.0332 96000.0 69.5418 2100.0 70.1988 2100.0 71.0488 17000.0 73.0281 28000.0 73.0388 2200.0 80.6482 3000.0 81.0332 63000.0 85.028 410000.0 87.0021 3900.0 87.0073 130000.0 87.0441 2700.0 96.1107 2200.0 97.0281 120000.0 99.0437 72000.0 105.0179 170000.0 105.0695 24000.0 108.0443 8800.0 109.0281 120000.0 116.6524 2100.0 117.6007 2500.0 126.0545 9400.0 127.0386 260000.0 129.0182 16000.0 145.0492 46000.0 147.0285 11000.0 148.8159 2900.0 155.3797 2400.0 159.0285 77000.0 173.5253 12000.0 173.5372 32000.0 179.3307 2600.0 189.0391 3800.0 231.0499 20000.0 247.6759 2500.0 327.6671 3000.0 334.1415 2500.0 END IONS BEGIN IONS SCANS=301 PEPMASS=316.1912 CHARGE=1 COLLISION_ENERGY=0.0 49.1107 2300.0 49.7811 2200.0 50.1786 2200.0 51.7741 2700.0 56.3446 2400.0 58.065 3600.0 60.4808 2600.0 63.9823 2300.0 70.1951 2300.0 79.0541 2900.0 81.0701 2900.0 82.6084 2500.0 84.4261 2400.0 89.133 3000.0 91.054 32000.0 93.0696 22000.0 95.0489 6900.0 96.5466 2600.0 99.8739 2500.0 103.0539 7900.0 104.4215 2300.0 105.0696 17000.0 107.0489 150000.0 109.0649 2800.0 117.0696 7900.0 119.049 51000.0 119.0855 29000.0 121.0646 680000.0 121.0729 3800.0 123.08 2600.0 124.0524 3700.0 125.0595 8200.0 126.7158 2400.0 128.7556 2000.0 129.0703 3700.0 130.078 2500.0 131.0488 8300.0 131.0856 5400.0 133.0646 72000.0 134.0723 3000.0 135.0803 38000.0 137.0596 22000.0 139.0752 22000.0 145.0646 40000.0 147.0803 230000.0 147.3833 2600.0 149.0601 8800.0 149.096 17000.0 150.0673 44000.0 151.0752 210000.0 151.1122 3300.0 152.0829 5000.0 156.015 2500.0 157.064 3900.0 159.0803 22000.0 160.0881 33000.0 161.0599 2800.0 161.0959 28000.0 163.0592 8400.0 163.0753 590000.0 164.083 12000.0 165.091 280000.0 168.9863 2400.0 173.0964 7400.0 173.5353 55000.0 176.0834 20000.0 177.0912 45000.0 179.1068 27000.0 183.0804 16000.0 191.1066 120000.0 193.1008 3200.0 195.0807 2900.0 196.0886 16000.0 197.0961 41000.0 202.5575 2600.0 207.1166 6800.0 209.0967 2800.0 210.1047 4100.0 211.1118 9900.0 215.1053 2700.0 221.0976 6900.0 224.0837 14000.0 225.0916 16000.0 225.1277 61000.0 226.098 3700.0 238.0992 35000.0 239.1062 14000.0 241.0859 22000.0 242.0935 9300.0 251.4297 2400.0 253.1224 58000.0 254.1304 76000.0 255.101 15000.0 256.1094 170000.0 257.1171 15000.0 267.1371 3200.0 270.1253 87000.0 285.1489 120000.0 END IONS BEGIN IONS SCANS=302 PEPMASS=311.1107 CHARGE=1 COLLISION_ENERGY=0.0 53.4129 2200.0 54.5664 2500.0 57.0947 2500.0 64.4022 2200.0 75.7804 2300.0 86.0514 2300.0 86.4816 2700.0 112.4124 2400.0 115.532 2700.0 116.9314 2300.0 129.0992 2300.0 164.6703 3000.0 173.5206 8700.0 173.5301 13000.0 173.5389 20000.0 197.1024 3000.0 199.8403 2200.0 227.0818 3000.0 230.5485 2700.0 237.0667 7700.0 239.5149 2600.0 253.1735 3300.0 255.0768 8100.0 265.0605 11000.0 283.0716 13000.0 311.0661 11000.0 321.5013 2700.0 END IONS BEGIN IONS SCANS=303 PEPMASS=289.1287 CHARGE=1 COLLISION_ENERGY=0.0 47.3938 2400.0 52.9558 3000.0 53.0385 19000.0 53.8702 2200.0 54.3471 2400.0 55.0176 120000.0 55.054 230000.0 56.0827 2300.0 56.5942 2300.0 57.0332 55000.0 57.0697 30000.0 57.3442 2300.0 57.6024 2500.0 58.1967 2600.0 58.5807 2200.0 59.0488 5600.0 59.6836 2600.0 60.6997 2100.0 60.7616 2100.0 62.9813 2600.0 64.7648 2400.0 65.0385 14000.0 65.0518 2400.0 67.0539 480000.0 68.6918 2200.0 68.8209 2300.0 69.0332 100000.0 69.0658 4200.0 69.0696 270000.0 69.9724 3100.0 71.016 2300.0 71.0489 820000.0 71.2763 2400.0 73.0282 28000.0 76.969 2500.0 77.0383 13000.0 77.248 2200.0 79.0539 1200000.0 79.0593 4200.0 81.0331 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131.0852 360000.0 131.0966 3600.0 137.096 19000.0 139.0996 5200.0 139.1115 410000.0 149.0958 370000.0 157.122 150000.0 167.1067 65000.0 173.5246 24000.0 173.5395 47000.0 185.1186 3200.0 202.4617 2200.0 203.6203 2500.0 208.0164 2400.0 213.674 2500.0 216.0558 2600.0 222.9554 2900.0 240.9804 2700.0 243.5207 2600.0 274.5161 2500.0 291.4058 2400.0 END IONS BEGIN IONS SCANS=304 PEPMASS=518.1877 CHARGE=1 COLLISION_ENERGY=0.0 60.5572 2600.0 69.0332 30000.0 69.5248 2400.0 71.0488 6500.0 73.0282 12000.0 79.3494 2200.0 79.689 2200.0 81.0332 53000.0 83.0493 2500.0 85.0281 140000.0 87.0074 32000.0 91.0539 250000.0 97.0281 97000.0 99.0437 48000.0 103.0388 32000.0 105.0179 81000.0 109.0281 250000.0 115.7576 3000.0 127.028 6600.0 127.0387 330000.0 129.018 17000.0 132.4423 2600.0 145.0494 50000.0 145.0619 7700.0 146.0117 2300.0 147.0286 17000.0 158.5238 2200.0 159.0286 67000.0 163.6971 2100.0 166.0767 2600.0 169.0495 6900.0 171.0796 3000.0 173.5293 54000.0 173.5435 9400.0 181.0472 2700.0 181.1164 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IONS SCANS=306 PEPMASS=382.0354 CHARGE=1 COLLISION_ENERGY=0.0 53.2708 2200.0 53.5818 2500.0 55.8451 2700.0 56.4011 2500.0 58.4316 2500.0 64.951 2400.0 66.0878 3100.0 67.4934 2100.0 68.2116 2100.0 70.3309 2100.0 71.0225 2600.0 74.1177 2400.0 74.1954 2300.0 75.0535 2200.0 75.8828 2400.0 76.3702 2300.0 79.793 2400.0 88.6335 2300.0 89.3979 2500.0 90.3703 2300.0 92.879 2600.0 113.7491 3000.0 123.4695 2400.0 139.4204 2200.0 140.9889 2600.0 173.5288 69000.0 173.5445 5400.0 199.9283 2400.0 202.5392 2600.0 225.9926 17000.0 249.001 2800.0 254.9586 11000.0 269.9822 81000.0 272.9696 61000.0 273.677 2400.0 273.9797 2700.0 287.9929 12000.0 290.979 2500.0 312.6376 2600.0 341.0179 2500.0 345.3841 2400.0 359.0256 150000.0 366.6759 3100.0 END IONS BEGIN IONS SCANS=307 PEPMASS=447.2855 CHARGE=1 COLLISION_ENERGY=0.0 58.0649 250000.0 59.0699 3300.0 59.0727 120000.0 59.9165 2200.0 77.3177 2500.0 78.6347 2700.0 93.5006 2500.0 99.6311 2300.0 107.0491 3200.0 118.0661 20000.0 118.075 17000.0 118.0858 7300000.0 118.0961 180000.0 118.1055 76000.0 118.1071 30000.0 118.1113 9300.0 118.117 4100.0 121.0644 8700.0 130.9392 2200.0 147.0804 10000.0 163.0752 3100.0 165.0898 5700.0 167.0323 2300.0 173.5307 55000.0 173.5427 5100.0 196.6853 2300.0 209.2844 2400.0 239.3462 2600.0 249.2828 2200.0 276.1531 2700.0 285.1488 54000.0 287.7311 2400.0 296.1579 2400.0 330.2069 26000.0 424.2843 2700.0 END IONS BEGIN IONS SCANS=308 PEPMASS=333.2155 CHARGE=1 COLLISION_ENERGY=0.0 52.4246 2100.0 55.0087 2200.0 58.0648 92000.0 59.0682 32000.0 64.9856 2300.0 69.8018 2400.0 89.3837 2500.0 91.054 8100.0 92.0574 7100.0 93.0696 9300.0 94.0727 6500.0 96.4196 2000.0 104.0579 3300.0 107.0488 37000.0 108.0521 35000.0 109.0549 13000.0 109.2198 2600.0 109.6958 2700.0 114.6233 2300.0 119.0487 8800.0 119.0842 3200.0 120.052 12000.0 120.0883 2500.0 121.0554 14000.0 121.0645 150000.0 122.0579 3300.0 122.0678 160000.0 123.0703 93000.0 124.0727 34000.0 132.0513 2500.0 133.0646 7000.0 134.0674 14000.0 135.0704 14000.0 136.0838 8000.0 138.0882 2700.0 139.0657 2800.0 140.078 3700.0 146.0681 11000.0 147.0801 40000.0 148.0724 5600.0 148.0834 69000.0 149.0862 41000.0 150.089 18000.0 151.0744 24000.0 152.0782 42000.0 153.0804 41000.0 154.0831 23000.0 160.0848 6400.0 161.0901 3000.0 163.075 51000.0 163.0994 3400.0 164.0785 120000.0 165.0808 120000.0 166.0832 53000.0 166.0947 41000.0 167.0964 67000.0 168.0989 38000.0 173.5254 23000.0 173.5381 21000.0 173.545 4800.0 175.543 2400.0 175.8376 2500.0 178.092 10000.0 180.0997 2600.0 181.1131 3700.0 191.1067 6800.0 192.1098 25000.0 193.1124 26000.0 194.1152 25000.0 198.0977 5800.0 199.1022 6200.0 226.0907 2500.0 226.1306 18000.0 227.0951 3100.0 227.1339 13000.0 228.1002 6200.0 228.1368 16000.0 232.9579 2500.0 237.1154 2700.0 240.1052 6900.0 241.1082 14000.0 244.0942 3000.0 254.1269 2800.0 255.1295 12000.0 256.1329 33000.0 257.1111 11000.0 257.1392 29000.0 258.1148 44000.0 259.1178 67000.0 272.1307 18000.0 273.1337 48000.0 287.1549 26000.0 288.1577 95000.0 318.4601 2700.0 END IONS 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251.6148 14000.0 252.1467 2600.0 253.0971 91000.0 255.1126 100000.0 256.1146 3700.0 258.1122 2500.0 273.1243 6800.0 275.1393 12000.0 277.1414 32000.0 278.1252 85000.0 279.1092 29000.0 280.8891 2900.0 281.0925 200000.0 282.0948 14000.0 294.1668 25000.0 301.1195 29000.0 302.3738 2700.0 303.12 37000.0 312.1784 28000.0 320.1465 6100.0 321.1586 8500.0 323.6729 2500.0 336.2358 2400.0 338.1573 42000.0 353.6488 2600.0 395.1141 2700.0 396.1655 13000.0 410.1834 3300.0 410.2394 2600.0 423.2235 2700.0 438.1859 16000.0 441.1892 17000.0 442.1738 6700.0 449.2003 2600.0 458.2151 25000.0 473.2291 3100.0 475.2409 81000.0 476.2421 11000.0 484.1952 21000.0 501.2214 27000.0 508.3581 2600.0 520.7061 2600.0 533.2009 2600.0 586.3063 2700.0 612.2887 7800.0 636.2887 28000.0 646.2734 3300.0 672.4435 2500.0 749.3753 32000.0 750.3655 2600.0 750.3772 11000.0 758.0978 2700.0 775.352 43000.0 776.3574 3400.0 END IONS BEGIN IONS SCANS=319 PEPMASS=515.7342 CHARGE=2 COLLISION_ENERGY=0.0 84.1218 2700.0 109.7604 2500.0 110.071 8400.0 130.0649 12000.0 136.0755 3700.0 156.0443 5300.0 173.5264 13000.0 173.5451 3800.0 203.0068 2300.0 227.1178 9000.0 228.1133 4700.0 230.1176 2700.0 251.114 2800.0 253.0981 4200.0 255.1134 6200.0 278.1258 6400.0 281.093 11000.0 365.0658 2900.0 475.2414 4500.0 574.3746 2400.0 END IONS BEGIN IONS SCANS=320 PEPMASS=402.1398 CHARGE=1 COLLISION_ENERGY=0.0 57.5654 2000.0 62.1544 2100.0 62.2218 2400.0 69.0331 36000.0 69.4145 2500.0 71.7878 2300.0 75.6992 2400.0 79.0541 16000.0 81.0695 5500.0 82.9631 2600.0 84.7385 2400.0 85.0282 12000.0 86.2745 2400.0 87.2035 2700.0 90.0472 2100.0 90.6548 2300.0 91.054 16000.0 93.0694 3300.0 95.0124 37000.0 95.7503 2400.0 97.0281 190000.0 97.0646 6100.0 97.3724 2500.0 99.0437 3500.0 99.7957 2200.0 103.857 2400.0 103.9046 2500.0 105.0698 2800.0 105.7352 2400.0 107.0493 5500.0 107.0852 280000.0 109.0641 3000.0 109.1013 22000.0 113.023 140000.0 116.7134 2900.0 117.0697 25000.0 119.4967 2300.0 121.5194 2500.0 123.0073 99000.0 123.0438 2900.0 125.0231 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123.116 12000.0 123.4371 2500.0 130.5157 2200.0 133.1005 52000.0 137.132 10000.0 138.1271 14000.0 139.7482 2500.0 145.1004 3300.0 146.2184 2600.0 147.1163 73000.0 149.132 140000.0 151.1109 21000.0 159.1161 7400.0 159.9546 2400.0 161.1322 3400.0 163.1114 6400.0 163.1474 4100.0 173.1326 12000.0 173.5211 4400.0 173.5278 27000.0 173.5398 23000.0 187.1482 10000.0 189.1635 100000.0 191.1431 9300.0 203.1782 7000.0 204.175 6300.0 207.1745 15000.0 212.9392 3000.0 229.1949 25000.0 246.2214 21000.0 247.2044 3100.0 264.1039 3200.0 264.2319 730000.0 265.1938 2500.0 END IONS BEGIN IONS SCANS=323 PEPMASS=471.2132 CHARGE=1 COLLISION_ENERGY=0.0 61.3473 2900.0 69.1678 2400.0 69.8838 2500.0 73.5411 2600.0 74.4928 2400.0 81.319 2400.0 82.0649 2700.0 91.0542 34000.0 92.8976 2700.0 93.053 2400.0 93.439 2800.0 104.2593 2300.0 111.0647 2200.0 111.7653 2300.0 112.6352 2400.0 115.3149 2900.0 119.049 15000.0 119.4039 2600.0 120.6921 2400.0 127.903 2700.0 133.118 2400.0 135.044 2900.0 137.0596 690000.0 137.0692 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58.0652 9500.0 66.0734 2200.0 66.7098 2200.0 70.4197 2200.0 71.5952 2300.0 75.044 4100.0 81.0701 4600.0 91.0543 18000.0 93.0698 10000.0 95.0493 6400.0 103.0544 4500.0 105.07 10000.0 107.0492 100000.0 107.0575 2800.0 109.0648 4000.0 110.1821 2400.0 111.0803 2600.0 117.0703 6200.0 119.0491 31000.0 119.0854 22000.0 121.0284 3400.0 121.057 6600.0 121.0648 480000.0 122.0682 16000.0 122.4887 2500.0 123.071 4700.0 123.0806 7000.0 124.0518 6300.0 125.0597 7400.0 129.0694 3100.0 131.0492 7600.0 131.0852 3900.0 133.0649 50000.0 135.0804 29000.0 137.0601 15000.0 139.0754 21000.0 141.091 2900.0 145.0649 26000.0 147.0609 3600.0 147.0805 190000.0 148.0839 8000.0 149.0602 7900.0 149.0846 4200.0 149.0964 11000.0 150.0676 24000.0 151.0754 150000.0 152.0811 9700.0 157.0644 3900.0 159.0806 20000.0 160.0883 18000.0 161.06 4900.0 161.0963 21000.0 163.0634 7400.0 163.0755 390000.0 164.0808 16000.0 165.0912 220000.0 166.0948 9900.0 167.0952 3700.0 171.0823 3000.0 173.0964 7900.0 173.538 13000.0 176.0832 12000.0 177.0913 31000.0 178.0968 5600.0 179.0895 4500.0 179.1067 20000.0 183.0812 9000.0 185.0959 3500.0 191.1068 89000.0 192.1105 5000.0 195.0798 3900.0 196.0888 11000.0 197.0963 28000.0 207.118 2900.0 210.1045 4300.0 211.1127 5500.0 215.3264 2500.0 221.0965 8300.0 223.1118 2600.0 224.0834 16000.0 225.0911 14000.0 225.1276 57000.0 226.1004 3600.0 227.107 4200.0 229.0328 2600.0 229.1241 5100.0 235.1122 6600.0 238.0989 22000.0 239.1069 6400.0 241.0859 9000.0 242.0923 7000.0 253.1223 45000.0 254.13 47000.0 255.1016 6300.0 255.1307 5700.0 256.1094 110000.0 257.1153 11000.0 257.1525 5100.0 258.1156 6700.0 267.1373 5900.0 268.8536 3000.0 270.1253 86000.0 272.1314 5500.0 285.1489 140000.0 286.1528 3500.0 287.155 17000.0 END IONS BEGIN IONS SCANS=325 PEPMASS=427.1734 CHARGE=1 COLLISION_ENERGY=0.0 57.0697 6600.0 61.8594 2500.0 64.058 2300.0 70.386 2300.0 71.0852 11000.0 71.4235 2400.0 78.8243 2300.0 79.1027 2300.0 85.1011 13000.0 95.3305 2700.0 95.7113 2200.0 101.0598 7500.0 109.1109 2400.0 111.0436 11000.0 127.7613 2900.0 151.7661 2500.0 154.4808 2500.0 173.1705 2600.0 173.5233 7600.0 173.5316 69000.0 173.5425 14000.0 174.5852 2300.0 175.0363 4100.0 176.0442 3700.0 341.3344 2200.0 412.1486 3400.0 415.5769 2900.0 427.1732 410000.0 433.5286 2500.0 437.6942 2900.0 END IONS BEGIN IONS SCANS=326 PEPMASS=201.0913 CHARGE=1 COLLISION_ENERGY=0.0 41.9223 2100.0 42.78 2500.0 43.7122 2200.0 46.451 2700.0 49.014 2000.0 50.0859 2100.0 55.9314 2700.0 55.9342 200000.0 56.9346 73000.0 58.1666 2600.0 60.0441 2300.0 62.2826 2700.0 62.9016 2100.0 65.9291 2300.0 67.9114 2000.0 68.698 2500.0 71.9289 3200.0 72.9368 40000.0 73.9373 8700.0 74.8919 2300.0 85.0179 2100.0 87.1681 2800.0 87.4454 2200.0 89.9397 3100.0 90.9474 50000.0 91.9478 16000.0 92.3038 2300.0 93.8202 2600.0 94.4117 2700.0 96.9369 3500.0 96.9605 2800.0 102.9484 2400.0 107.9501 22000.0 108.0829 2500.0 108.9503 2600.0 108.9586 2600.0 110.4654 2400.0 110.6602 2500.0 113.9633 12000.0 114.9478 25000.0 114.9711 17000.0 115.0542 11000.0 115.7045 2500.0 115.9791 28000.0 118.9426 8200.0 125.9607 2700.0 128.0619 11000.0 128.9504 39000.0 129.0695 20000.0 129.9523 48000.0 130.0776 27000.0 131.9739 100000.0 132.9586 14000.0 135.9451 36000.0 136.9464 11000.0 137.9639 11000.0 140.0619 37000.0 141.0695 19000.0 142.0783 2700.0 149.6838 4000.0 149.6938 3200.0 149.9845 11000.0 152.275 2500.0 155.9743 7900.0 156.0568 15000.0 157.0502 3200.0 157.0646 420000.0 158.0724 240000.0 158.0873 4200.0 171.0426 2700.0 172.0509 3800.0 173.5306 38000.0 185.06 33000.0 186.0678 29000.0 198.0145 2800.0 201.091 230000.0 201.1126 2300.0 201.5223 2700.0 END IONS BEGIN IONS SCANS=327 PEPMASS=369.17 CHARGE=1 COLLISION_ENERGY=0.0 52.4887 2900.0 55.0177 4000.0 55.9581 2700.0 57.657 3000.0 61.381 2400.0 64.2234 2400.0 64.6476 2100.0 65.0392 5100.0 65.1384 2400.0 67.6801 2200.0 69.0698 8500.0 70.065 110000.0 71.0493 6000.0 71.0685 3000.0 71.4613 2100.0 71.7219 2700.0 74.868 2300.0 75.0439 31000.0 79.0539 4000.0 79.4964 2300.0 80.0618 3600.0 85.0164 2600.0 86.0963 48000.0 87.0997 4200.0 87.1325 2500.0 90.0464 8600.0 91.0541 43000.0 91.2405 2100.0 93.0698 3700.0 95.049 67000.0 97.3883 2500.0 103.9659 2100.0 106.0413 2500.0 106.4561 2700.0 107.0491 79000.0 108.0568 44000.0 109.0648 3000.0 110.0712 15000.0 118.0653 6800.0 119.0486 2400.0 120.5707 2600.0 121.0647 75000.0 123.0803 15000.0 124.052 11000.0 128.0618 17000.0 129.0696 7900.0 135.044 43000.0 136.0517 570000.0 136.0638 15000.0 137.0596 36000.0 138.0674 3800.0 139.0647 3200.0 139.0751 78000.0 140.653 2400.0 143.0852 27000.0 144.0566 2400.0 145.0646 25000.0 146.0601 12000.0 146.0727 10000.0 148.0519 2900.0 149.0598 33000.0 150.0675 20000.0 151.0752 4400000.0 151.1034 19000.0 151.1119 4300.0 153.0906 6200.0 156.0573 5100.0 157.0648 45000.0 158.0726 61000.0 159.0807 24000.0 160.088 4600.0 161.0597 25000.0 162.0677 13000.0 163.0754 41000.0 165.0549 51000.0 165.091 140000.0 166.9808 2200.0 167.0704 25000.0 167.2668 2700.0 169.0642 2700.0 170.0716 4100.0 171.0802 59000.0 172.0882 300000.0 172.1097 9500.0 173.0597 67000.0 173.096 11000.0 173.522 28000.0 173.5398 53000.0 174.0677 78000.0 174.3368 2600.0 175.0752 71000.0 177.091 94000.0 179.0702 77000.0 181.0714 3700.0 181.0853 3100.0 182.0726 7200.0 183.0805 16000.0 185.059 4300.0 186.0675 27000.0 187.0753 33000.0 188.0831 800000.0 189.0909 290000.0 189.1106 3400.0 190.0983 3200.0 191.0701 52000.0 191.1063 27000.0 193.0857 37000.0 193.1085 2900.0 198.0668 8500.0 199.0752 13000.0 200.0835 27000.0 201.0692 13000.0 201.0909 1400000.0 201.113 9800.0 202.0986 10000.0 203.0892 3200.0 203.1066 920000.0 203.138 3600.0 205.0857 28000.0 207.3678 2600.0 213.0737 2300.0 213.0911 220000.0 215.1066 94000.0 216.078 38000.0 217.0869 3900.0 221.0974 5700.0 223.485 2300.0 224.0834 17000.0 225.0907 11000.0 227.1059 3700.0 231.1015 810000.0 231.1401 3700.0 233.0959 29000.0 234.1048 3600.0 238.0985 3100.0 240.0778 8900.0 241.0857 3400.0 245.0958 45000.0 246.1028 20000.0 247.076 3400.0 247.1109 12000.0 248.6856 2800.0 249.0904 31000.0 249.1293 2500.0 251.1044 3100.0 253.0859 34000.0 254.0946 6100.0 255.1014 200000.0 257.0953 3100.0 258.1043 11000.0 259.1114 25000.0 260.0855 2900.0 260.1179 6700.0 261.0907 120000.0 262.0986 77000.0 263.1066 28000.0 264.1134 6600.0 264.7245 2700.0 265.1222 30000.0 267.1004 12000.0 268.0745 3200.0 268.1092 240000.0 269.0808 53000.0 269.1116 3500.0 272.0831 3100.0 273.0909 55000.0 274.0991 24000.0 275.1066 130000.0 276.08 4100.0 276.1143 200000.0 277.0861 67000.0 277.1222 210000.0 278.0935 34000.0 278.1262 8600.0 279.1021 36000.0 281.1169 47000.0 282.1234 3500.0 283.0598 2600.0 283.0966 420000.0 284.0694 3000.0 284.1042 150000.0 286.0409 2400.0 286.1018 2600.0 287.107 34000.0 288.1146 110000.0 289.0859 63000.0 289.1224 420000.0 289.1596 5800.0 290.0939 33000.0 290.1279 8000.0 291.1019 48000.0 291.1337 5800.0 292.1093 95000.0 293.1172 440000.0 294.0895 5000.0 294.1253 67000.0 295.0971 8900.0 295.132 16000.0 296.1045 28000.0 297.1137 7000.0 298.1199 1100000.0 298.1528 3300.0 299.1279 95000.0 303.101 26000.0 304.1095 120000.0 305.0767 9600.0 305.117 950000.0 305.147 2800.0 305.1586 15000.0 306.0885 13000.0 306.1255 36000.0 307.096 13000.0 307.1327 220000.0 308.1032 21000.0 308.1405 460000.0 308.1802 4500.0 309.112 280000.0 309.1515 10000.0 310.12 28000.0 310.1558 3600.0 311.1277 170000.0 311.5631 2900.0 312.1354 12000.0 318.1252 20000.0 319.1327 330000.0 320.0982 5600.0 320.1405 1000000.0 320.1736 2100.0 321.1119 540000.0 321.1547 11000.0 322.12 13000.0 323.1278 92000.0 324.1354 810000.0 325.1433 56000.0 326.1528 4200.0 335.1278 80000.0 336.1352 240000.0 338.1513 72000.0 339.1224 3300.0 339.1585 180000.0 351.1082 3900.0 351.1587 450000.0 366.4273 2800.0 369.1691 31000.0 370.8504 2800.0 END IONS BEGIN IONS SCANS=328 PEPMASS=422.218 CHARGE=1 COLLISION_ENERGY=0.0 55.0178 7300.0 55.0542 5900.0 55.4056 2600.0 60.8776 2700.0 62.4748 2200.0 67.2502 2400.0 67.4929 2200.0 67.4969 2700.0 69.0317 2200.0 69.0401 2300.0 71.5736 2300.0 75.0437 4300.0 75.3804 2400.0 76.7021 2200.0 79.0544 3100.0 80.7699 2600.0 83.0489 39000.0 85.9625 2200.0 87.2294 2200.0 87.4144 2000.0 87.7045 2200.0 91.0542 6000.0 94.6434 2600.0 95.0489 39000.0 104.2933 2300.0 104.394 2300.0 107.0492 10000.0 114.7487 2400.0 115.2988 2600.0 116.3541 2400.0 117.0688 5500.0 121.0646 40000.0 124.0518 11000.0 126.857 2500.0 128.0621 2400.0 129.0699 3500.0 130.6715 2500.0 135.0443 5100.0 136.0411 3400.0 136.0517 160000.0 136.0636 2600.0 137.0595 33000.0 138.0673 15000.0 139.075 100000.0 139.4783 2400.0 143.0853 26000.0 145.0417 2400.0 145.0645 5900.0 146.0724 30000.0 147.0797 9800.0 147.8478 2600.0 149.0595 7100.0 149.6661 2900.0 149.6862 11000.0 151.0751 2000000.0 151.087 2900.0 151.1036 11000.0 155.9653 2300.0 156.0563 2700.0 157.0649 11000.0 158.0721 17000.0 159.0802 8100.0 160.088 7100.0 161.0596 56000.0 162.0675 9700.0 163.0757 17000.0 165.0545 16000.0 165.0908 26000.0 167.0702 88000.0 171.0807 19000.0 172.0881 240000.0 172.114 3200.0 173.0596 28000.0 173.0958 12000.0 173.5279 5500.0 173.5304 32000.0 174.0675 120000.0 175.0752 130000.0 175.1121 2900.0 177.0909 620000.0 179.0705 15000.0 181.0864 5600.0 188.083 420000.0 189.0709 8300.0 189.0908 830000.0 189.1106 2800.0 189.4069 2600.0 191.0705 8500.0 191.1064 77000.0 193.0862 8100.0 193.1216 12000.0 198.3534 2400.0 199.0738 2900.0 200.0831 5000.0 201.0693 5900.0 201.0909 850000.0 202.0989 6700.0 203.1065 1100000.0 203.1236 9100.0 205.0848 3200.0 205.1133 2300.0 213.0909 43000.0 215.106 15000.0 216.0782 17000.0 219.1017 20000.0 221.1171 17000.0 231.1015 280000.0 234.7764 2400.0 243.8389 2500.0 249.1119 3200.0 252.6229 2700.0 268.1098 29000.0 275.1045 4100.0 276.1138 23000.0 277.123 16000.0 283.0958 24000.0 284.1034 18000.0 288.1142 13000.0 288.866 2600.0 289.122 32000.0 292.1084 13000.0 293.117 28000.0 294.1265 3800.0 298.1198 160000.0 299.1274 38000.0 304.1085 14000.0 305.0805 4200.0 305.1171 76000.0 307.1331 47000.0 308.1409 110000.0 309.1121 16000.0 311.1279 65000.0 319.1328 73000.0 320.1406 210000.0 321.1124 35000.0 323.1298 3200.0 324.136 160000.0 325.1435 12000.0 335.1269 3200.0 336.1351 60000.0 338.1505 7900.0 339.1589 220000.0 351.1589 210000.0 369.1719 15000.0 398.4547 2500.0 END IONS BEGIN IONS SCANS=329 PEPMASS=387.1808 CHARGE=1 COLLISION_ENERGY=0.0 54.2725 2200.0 55.0178 29000.0 55.0542 6200.0 55.2505 2300.0 58.282 2200.0 59.302 2200.0 60.879 3300.0 62.2828 2600.0 65.657 2400.0 66.1039 2800.0 66.8358 2200.0 67.0539 2400.0 70.8556 2300.0 71.1097 2500.0 73.2466 2600.0 75.044 17000.0 79.0542 3600.0 83.0492 13000.0 86.0779 2400.0 90.7856 2100.0 91.0542 25000.0 95.0491 8700.0 98.9939 2300.0 107.0491 41000.0 108.0569 26000.0 109.0646 4400.0 111.3214 2800.0 115.0547 9000.0 117.0701 8200.0 117.6163 3000.0 118.6395 2500.0 119.6913 2300.0 121.0647 78000.0 123.0803 6200.0 124.0515 31000.0 128.0625 14000.0 129.0697 21000.0 131.049 8300.0 132.0565 3200.0 135.0439 17000.0 136.0518 400000.0 136.064 3700.0 137.0595 38000.0 138.0673 14000.0 139.0752 130000.0 140.0625 4100.0 141.0693 4300.0 143.0853 26000.0 145.0648 19000.0 146.0725 54000.0 147.081 8100.0 149.0595 21000.0 149.6872 4800.0 149.7076 2700.0 150.0675 6400.0 151.0645 4900.0 151.0752 3100000.0 151.1034 9300.0 153.674 2400.0 156.0569 5000.0 157.0647 90000.0 158.0726 130000.0 159.0437 15000.0 159.0802 21000.0 160.0513 7400.0 160.088 14000.0 161.0597 33000.0 162.0673 14000.0 162.9537 2700.0 163.0753 52000.0 165.0547 67000.0 165.0909 92000.0 167.07 54000.0 171.0807 35000.0 172.0883 280000.0 172.1054 4500.0 173.0598 61000.0 173.0953 7900.0 173.5275 51000.0 173.5385 20000.0 173.5474 3700.0 174.0502 4400.0 174.0676 370000.0 175.0755 89000.0 176.0831 7400.0 177.091 310000.0 179.0702 49000.0 186.0676 31000.0 187.076 9100.0 188.0831 610000.0 189.0711 8300.0 189.091 1700000.0 189.111 5000.0 189.4647 2400.0 191.0704 34000.0 191.1066 79000.0 193.0859 41000.0 199.076 6100.0 200.0832 10000.0 201.047 5600.0 201.091 2600000.0 201.1347 7500.0 202.097 6100.0 203.1067 970000.0 205.0857 18000.0 213.0911 130000.0 215.0858 3400.0 215.1067 62000.0 216.0779 17000.0 218.8784 2600.0 219.1016 12000.0 222.7876 2600.0 224.0832 9600.0 229.2517 3200.0 231.1016 580000.0 231.1269 3800.0 233.0963 8900.0 233.8132 2800.0 245.0962 15000.0 246.1037 2800.0 249.0909 9900.0 250.0978 3200.0 253.0832 3300.0 254.0923 2700.0 255.1014 110000.0 259.1113 9400.0 260.1194 3100.0 261.0906 55000.0 262.0988 35000.0 263.107 7700.0 263.5247 2400.0 265.0885 3200.0 265.1228 12000.0 268.1094 140000.0 269.0806 17000.0 273.092 23000.0 274.099 9400.0 275.1068 68000.0 276.1146 120000.0 277.0871 34000.0 277.1223 110000.0 277.1543 3800.0 278.0938 14000.0 278.1287 9900.0 279.101 9700.0 281.1175 20000.0 283.0966 210000.0 283.132 3100.0 284.1043 100000.0 287.1066 12000.0 288.1144 66000.0 289.087 35000.0 289.1226 210000.0 290.1268 3300.0 291.1006 18000.0 291.1358 4400.0 292.1095 60000.0 293.1171 250000.0 294.1252 40000.0 295.0966 4700.0 295.1317 5000.0 296.1045 9000.0 298.12 710000.0 298.1756 3700.0 299.1279 77000.0 303.1014 10000.0 304.1095 67000.0 305.0767 4300.0 305.117 470000.0 306.0898 2400.0 306.1255 17000.0 307.0936 5500.0 307.1329 140000.0 308.1407 380000.0 308.3329 2700.0 309.1121 140000.0 309.1503 2500.0 310.1215 15000.0 311.1278 200000.0 312.1353 8600.0 318.1252 9600.0 319.1328 200000.0 320.1406 570000.0 321.112 270000.0 321.1544 3500.0 322.1195 8800.0 323.1277 56000.0 324.1355 540000.0 325.1433 36000.0 335.1271 40000.0 336.1355 150000.0 337.1411 3600.0 338.1513 38000.0 339.1587 220000.0 351.1075 3300.0 351.1587 350000.0 351.2089 3800.0 368.4077 2600.0 END IONS BEGIN IONS SCANS=330 PEPMASS=450.2492 CHARGE=1 COLLISION_ENERGY=0.0 56.9954 2400.0 58.569 2400.0 59.8616 3000.0 59.9399 2100.0 60.0862 2400.0 63.9167 2300.0 71.2909 2300.0 73.2656 2600.0 82.5887 2700.0 83.0491 6900.0 89.8796 2400.0 91.7031 2600.0 95.0491 9700.0 100.866 2300.0 106.879 2900.0 121.0645 12000.0 125.1759 2400.0 136.0518 48000.0 137.06 3700.0 139.0751 27000.0 146.0721 3000.0 151.0646 5300.0 151.0753 760000.0 153.5924 2300.0 160.6594 2700.0 161.06 6700.0 165.0543 5300.0 165.0914 9500.0 167.0701 32000.0 172.0885 58000.0 173.5242 11000.0 173.5323 70000.0 173.5434 9000.0 174.0678 38000.0 175.0751 26000.0 177.0911 140000.0 178.0868 7100.0 179.0711 2900.0 188.0834 110000.0 188.7335 2800.0 189.0912 300000.0 189.1107 4700.0 191.1066 15000.0 201.0694 3000.0 201.0914 290000.0 203.0889 2400.0 203.107 360000.0 203.1273 4900.0 211.9285 2600.0 213.0919 12000.0 215.1062 3600.0 216.0775 2600.0 219.103 6000.0 221.1179 5100.0 231.1019 120000.0 239.8538 2500.0 260.1827 2800.0 268.1099 7800.0 276.1146 4300.0 283.0965 6600.0 284.1046 4800.0 289.1215 4700.0 293.1183 3700.0 298.1205 74000.0 299.1287 15000.0 305.1186 17000.0 306.7919 2500.0 307.1333 15000.0 308.1419 34000.0 309.1155 3300.0 311.1281 22000.0 319.1335 20000.0 320.1418 77000.0 321.1135 7300.0 324.1367 49000.0 336.1358 20000.0 338.1495 2500.0 339.1602 77000.0 351.1601 84000.0 369.1665 2500.0 382.1143 2500.0 412.4333 2500.0 436.338 3400.0 END IONS BEGIN IONS SCANS=331 PEPMASS=236.1679 CHARGE=1 COLLISION_ENERGY=0.0 43.1644 2500.0 43.4094 2500.0 43.6706 4300.0 43.9774 2100.0 44.73 2100.0 45.2636 2600.0 45.4377 2600.0 45.7026 2600.0 45.7859 2200.0 46.1938 2100.0 46.3857 2100.0 46.7263 2500.0 46.7958 2400.0 47.6304 2200.0 47.8471 2400.0 47.9953 2300.0 48.1232 2300.0 48.4383 2100.0 48.7522 2300.0 48.9593 2500.0 49.9886 2300.0 50.6017 2200.0 51.3817 2700.0 52.6704 2300.0 52.9529 2000.0 53.0742 2300.0 53.5283 2400.0 53.9055 2300.0 54.1218 2300.0 54.2131 2000.0 54.9509 2200.0 54.9892 2300.0 56.0492 1400000.0 56.1432 2300.0 56.2128 2300.0 56.3378 2400.0 56.5761 2700.0 57.0333 150000.0 57.1004 2000.0 57.4984 2300.0 58.6534 2600.0 58.8569 2200.0 58.9555 2700.0 59.2313 2400.0 59.3372 2200.0 59.6921 2200.0 59.8836 2200.0 61.029 2100.0 61.8858 2600.0 61.9034 2400.0 62.1698 2700.0 62.4223 2500.0 63.0102 2900.0 63.509 2300.0 63.5573 2200.0 63.6311 2100.0 64.4649 2300.0 65.7253 2400.0 66.5248 2600.0 66.8533 2600.0 67.3755 2400.0 67.8137 2800.0 68.7983 2400.0 68.9873 2300.0 69.0491 2600.0 69.571 2200.0 71.2672 2300.0 71.9501 2300.0 71.9998 2400.0 72.2347 2400.0 72.667 2300.0 73.0755 2100.0 73.3492 2200.0 73.927 2700.0 74.0597 61000.0 74.1545 2500.0 74.7435 2400.0 75.0255 3100.0 75.6546 2100.0 77.0414 41000.0 77.6437 2700.0 78.2028 2200.0 78.6642 2100.0 79.1844 2500.0 79.668 2700.0 79.7546 2500.0 81.033 2200.0 81.197 2100.0 81.3737 2400.0 82.0035 2700.0 82.8345 2100.0 83.9338 2100.0 84.3057 2300.0 84.4702 2800.0 86.0597 2800.0 86.2231 2200.0 87.0622 94000.0 87.8494 2200.0 88.1257 2200.0 88.5606 2400.0 89.0045 2100.0 89.1233 2200.0 89.613 2300.0 92.0501 2400.0 92.3005 2400.0 92.3737 2700.0 93.0364 50000.0 95.0155 2400.0 96.1742 2500.0 98.75 2500.0 100.0833 2300.0 100.3017 2400.0 103.0572 2200.0 103.9396 2500.0 104.0702 410000.0 105.0726 720000.0 107.0519 280000.0 108.9142 3200.0 109.0313 34000.0 109.341 2500.0 109.6103 2800.0 110.5277 2300.0 111.6376 5100.0 112.5138 2400.0 115.0934 130000.0 115.6824 2500.0 116.2611 2300.0 117.0722 3400.0 118.5095 2300.0 119.1773 2400.0 121.0678 18000.0 121.9461 2400.0 122.407 2400.0 123.0473 2700.0 124.0951 2500.0 124.4011 2200.0 124.5177 2500.0 125.6031 2300.0 125.754 2300.0 127.0753 2300.0 128.9499 3200.0 129.8266 2700.0 129.8891 2700.0 130.7371 2400.0 131.0699 2400.0 133.1039 450000.0 133.2449 2200.0 133.6056 2400.0 135.0832 250000.0 135.9264 2500.0 136.2713 2500.0 136.9323 2400.0 137.347 2900.0 138.3242 2500.0 142.7601 2100.0 143.0886 11000.0 143.3631 2100.0 144.2471 2500.0 146.1685 2700.0 146.3558 2500.0 147.2009 2500.0 148.9767 41000.0 149.2888 2900.0 149.3839 2400.0 149.6855 4300.0 149.8212 2500.0 151.7059 2600.0 152.3472 2300.0 152.9464 2200.0 157.9789 2400.0 158.8627 2300.0 160.2235 2400.0 166.4773 2300.0 166.8292 2600.0 166.9874 11000.0 167.4987 2300.0 171.7861 2600.0 172.5343 2700.0 173.5259 110000.0 173.5381 190000.0 173.6306 2400.0 174.739 2200.0 176.389 2600.0 177.1539 2300.0 180.5618 2600.0 184.2247 2900.0 186.095 2400.0 187.7124 2200.0 188.3746 2300.0 190.0037 2500.0 190.7835 2400.0 191.5855 2900.0 194.9433 21000.0 201.8977 2500.0 202.6203 2300.0 204.0042 2300.0 208.0158 2400.0 210.6066 2400.0 213.4124 2600.0 214.1142 2100.0 214.1919 2500.0 217.9596 11000.0 224.0444 3500.0 226.155 3000.0 231.9755 2300.0 233.2214 2500.0 233.3086 2400.0 END IONS BEGIN IONS SCANS=332 PEPMASS=455.2183 CHARGE=1 COLLISION_ENERGY=0.0 56.0494 77000.0 59.939 2300.0 62.682 2500.0 63.3425 2300.0 63.8137 2600.0 69.5993 2600.0 73.7249 2400.0 74.4988 2200.0 74.9473 2200.0 75.3149 2600.0 75.5746 2300.0 79.0541 3800.0 81.674 2600.0 82.065 6700.0 83.2632 2300.0 91.0542 31000.0 93.0698 44000.0 95.0489 16000.0 98.0601 13000.0 102.0464 5000.0 102.6551 2200.0 103.0542 32000.0 103.7707 2500.0 105.045 4500.0 107.0492 24000.0 116.7945 2300.0 119.049 12000.0 121.0647 2900000.0 121.0729 20000.0 121.0849 8500.0 121.7253 2700.0 129.7672 2600.0 130.0414 18000.0 131.0489 3500.0 131.0851 7000.0 132.057 5300.0 133.0649 18000.0 135.044 26000.0 142.2152 2600.0 143.1023 2400.0 145.0585 2400.0 147.0441 68000.0 147.0801 15000.0 147.5736 2500.0 148.0516 2700.0 149.0594 11000.0 150.0682 7100.0 159.0803 23000.0 160.0523 11000.0 161.0447 2300.0 161.0595 37000.0 162.0676 210000.0 162.0818 2300.0 162.6276 2400.0 163.039 71000.0 163.0754 35000.0 165.0914 5900.0 165.1663 2800.0 167.07 10000.0 173.5186 4900.0 173.536 100000.0 174.0315 20000.0 174.0912 11000.0 175.0391 51000.0 176.0472 43000.0 176.0891 11000.0 176.1071 2600000.0 176.1249 5400.0 176.1429 7700.0 177.0549 48000.0 178.0626 180000.0 188.047 9300.0 189.0547 150000.0 190.0426 10000.0 190.0624 1500000.0 191.0139 3700.0 191.0339 270000.0 191.0703 120000.0 192.0415 8300.0 193.0653 12000.0 193.086 1200000.0 193.1064 3800.0 200.341 2200.0 205.0508 6900.0 206.0348 5700.0 206.0576 570000.0 206.0777 4400.0 221.0304 60000.0 221.0405 22000.0 221.0809 10000000.0 221.1204 31000.0 221.1319 42000.0 221.1465 11000.0 235.1451 3600.0 236.1275 3000.0 239.6074 2200.0 248.9868 2300.0 260.948 2700.0 261.1121 2600.0 262.7369 2400.0 276.1261 2600.0 290.9231 2600.0 353.2533 2600.0 END IONS BEGIN IONS SCANS=333 PEPMASS=265.1226 CHARGE=1 COLLISION_ENERGY=0.0 45.9905 2200.0 48.1054 2300.0 49.7407 2100.0 49.7497 2300.0 50.2539 2300.0 58.6101 2600.0 59.6169 2300.0 62.4212 2300.0 64.901 2700.0 67.3231 2300.0 68.6055 2300.0 68.7902 2700.0 69.2881 2600.0 69.4766 2200.0 70.8793 2200.0 73.4113 2300.0 77.1229 2300.0 88.9035 2200.0 90.834 2300.0 93.2585 2200.0 96.6292 2200.0 97.2296 2100.0 99.9703 2400.0 104.9388 2200.0 105.2511 2400.0 108.4139 2700.0 114.0498 2100.0 117.8444 2500.0 121.8812 2400.0 129.8827 2200.0 130.92 2700.0 138.0014 2200.0 151.0707 2700.0 152.877 2500.0 164.3467 2400.0 173.5258 50000.0 173.5382 57000.0 178.0774 5200.0 179.0851 43000.0 189.0701 4100.0 190.0777 35000.0 191.0853 64000.0 193.0647 2400.0 194.1098 3100.0 202.0776 13000.0 203.0854 72000.0 204.0934 15000.0 205.0649 8600.0 205.1011 52000.0 206.0726 5800.0 207.0804 91000.0 212.9158 2500.0 215.0858 6500.0 217.0647 27000.0 218.0725 100000.0 219.0804 190000.0 220.0881 8600.0 221.0598 69000.0 221.0962 98000.0 222.0668 7400.0 222.1039 39000.0 226.2679 2300.0 227.2912 2500.0 229.4215 2400.0 232.0889 3600.0 233.0961 70000.0 234.1039 480000.0 234.129 5700.0 235.0481 10000.0 235.0754 660000.0 235.1025 10000.0 236.0827 58000.0 236.1798 2500.0 237.3697 2300.0 239.535 2300.0 249.0913 54000.0 250.0988 390000.0 250.1285 8400.0 261.3658 2600.0 265.0146 2700.0 265.1222 140000.0 265.2324 2600.0 END IONS BEGIN IONS SCANS=334 PEPMASS=282.1494 CHARGE=1 COLLISION_ENERGY=0.0 46.3843 2300.0 47.6509 2100.0 48.2831 2500.0 49.1566 2600.0 49.2149 2400.0 49.2525 2300.0 49.7564 2600.0 50.4411 2500.0 51.0905 2200.0 51.211 2500.0 51.3321 2300.0 51.4877 2300.0 54.5965 2400.0 54.9411 2300.0 55.6961 2100.0 56.5533 2400.0 57.0699 6600.0 57.4012 2200.0 58.4241 2300.0 62.5228 3800.0 62.526 3100.0 66.2796 5300.0 66.838 2600.0 68.5619 2000.0 69.0696 6300.0 74.441 2600.0 75.044 7700.0 75.8798 2500.0 76.4002 2400.0 76.8567 2500.0 80.8667 2400.0 81.3843 2600.0 83.0854 6100.0 83.2365 2000.0 86.4726 2300.0 86.5046 2300.0 89.4716 2600.0 91.8584 2300.0 92.3032 2300.0 96.8017 2400.0 97.1009 3000.0 97.3805 2700.0 103.752 2400.0 106.8051 2300.0 107.1266 2400.0 107.9347 2200.0 118.4563 2800.0 118.5407 3000.0 123.0097 2200.0 123.6411 2500.0 124.4149 2400.0 128.0619 3100.0 128.4394 2500.0 130.7869 2700.0 133.0967 2500.0 134.0962 130000.0 136.0322 2200.0 137.2152 2500.0 146.339 2600.0 148.8792 3100.0 165.0705 5900.0 171.216 2600.0 173.5226 35000.0 173.5371 130000.0 173.5448 4800.0 178.0788 39000.0 179.0854 89000.0 179.3588 2400.0 184.0918 2400.0 187.1943 2400.0 188.2539 2500.0 189.0707 45000.0 190.0776 140000.0 191.0855 160000.0 191.104 2300.0 192.0934 13000.0 192.3711 2700.0 193.0648 12000.0 193.1014 8800.0 194.072 2500.0 194.1088 3900.0 197.0141 2700.0 202.0779 79000.0 203.0855 250000.0 204.0932 68000.0 204.4242 2500.0 205.0651 51000.0 205.1012 360000.0 206.0727 140000.0 206.109 7600.0 207.06 4300.0 207.0805 250000.0 208.088 22000.0 210.1276 6100.0 211.135 38000.0 213.2336 2700.0 215.0858 27000.0 217.065 70000.0 218.0727 530000.0 219.0805 550000.0 220.0884 83000.0 221.0598 280000.0 221.0962 450000.0 222.0674 93000.0 222.104 200000.0 231.0806 14000.0 231.3803 2500.0 232.0884 69000.0 233.0686 6300.0 233.0962 670000.0 233.1233 7400.0 234.0487 5500.0 234.1038 4900000.0 234.1316 3500.0 234.159 7200.0 235.0353 2800.0 235.0479 16000.0 235.0752 3300000.0 235.11 130000.0 235.1328 3000.0 236.0831 950000.0 237.0908 140000.0 237.4168 2500.0 238.8124 2600.0 243.0908 3600.0 245.1411 2900.0 247.9914 2500.0 249.0909 220000.0 250.0369 6200.0 250.068 17000.0 250.0988 6800000.0 250.1591 22000.0 254.7762 2400.0 260.0371 2400.0 263.9795 2500.0 265.0559 18000.0 265.1221 6000000.0 265.1902 2900.0 268.3228 2500.0 268.8039 2500.0 272.5194 2400.0 279.1075 2500.0 281.8549 2400.0 282.2218 330000.0 292.3907 2600.0 END IONS BEGIN IONS SCANS=335 PEPMASS=532.2033 CHARGE=1 COLLISION_ENERGY=0.0 61.0281 2600.0 62.7556 2200.0 69.0332 88000.0 71.0489 14000.0 73.0281 35000.0 76.9292 2300.0 80.4632 2800.0 81.0331 180000.0 83.049 11000.0 85.0281 450000.0 87.0022 2800.0 87.0073 120000.0 91.5745 2200.0 93.8297 2600.0 97.0279 310000.0 99.0437 150000.0 103.0386 89000.0 104.2056 2300.0 105.0098 3200.0 105.0179 250000.0 105.0696 46000.0 109.0281 800000.0 109.0354 5600.0 121.8897 2300.0 122.9816 2500.0 125.1565 2400.0 127.0386 1000000.0 127.0475 17000.0 127.3729 2500.0 128.8108 2700.0 129.018 51000.0 145.0492 170000.0 147.0286 61000.0 159.0286 190000.0 163.0602 12000.0 168.0531 2500.0 169.0493 26000.0 173.5216 8400.0 173.5357 18000.0 173.5425 8200.0 176.3115 2200.0 177.0392 4300.0 180.1788 2200.0 183.029 2300.0 183.7771 2600.0 187.0603 34000.0 195.2111 2400.0 213.0396 74000.0 227.1435 2500.0 231.0502 160000.0 231.1005 2600.0 233.4278 2600.0 248.8988 2400.0 249.0611 3200.0 255.0506 4200.0 271.0822 3000.0 273.0602 26000.0 288.3718 2600.0 291.0713 23000.0 305.0522 2200.0 339.073 5600.0 351.6642 2300.0 357.0824 22000.0 375.0911 6900.0 508.2067 2400.0 530.8592 2800.0 END IONS BEGIN IONS SCANS=336 PEPMASS=344.1497 CHARGE=1 COLLISION_ENERGY=0.0 51.7647 6600.0 52.4071 2200.0 54.9874 2300.0 55.6592 2200.0 57.089 2600.0 70.2925 2900.0 72.556 2300.0 77.0386 5200.0 82.1906 2200.0 83.9707 2400.0 91.0541 210000.0 93.0165 2300.0 93.0698 150000.0 95.0491 30000.0 100.7096 2600.0 101.9001 2300.0 103.0541 75000.0 103.4007 2300.0 105.0447 5900.0 109.9799 2200.0 119.0492 720000.0 119.0591 4500.0 120.0568 5000.0 121.0647 1700000.0 121.0728 8100.0 125.2814 2200.0 131.0491 9000.0 132.8004 2300.0 135.0449 3300.0 145.0285 6100.0 146.9754 2600.0 147.0333 7100.0 147.044 1100000.0 157.0397 79000.0 160.2927 2700.0 164.0471 9500.0 166.0627 19000.0 173.5341 44000.0 175.0042 5600.0 175.0252 16000.0 175.0391 3400000.0 175.0739 8700.0 176.0461 3100.0 177.0549 7900.0 179.0704 41000.0 179.0865 3300.0 181.0858 9600.0 192.0418 67000.0 197.0047 2200.0 202.963 2400.0 205.5237 2400.0 207.0478 9700.0 207.0653 2300000.0 207.1089 3800.0 226.595 3100.0 250.1066 4000.0 END IONS BEGIN IONS SCANS=337 PEPMASS=314.1392 CHARGE=1 COLLISION_ENERGY=0.0 49.4027 2200.0 49.9349 2300.0 51.023 2600.0 51.4363 2500.0 53.0385 15000.0 53.1692 2300.0 53.5433 2400.0 53.7884 2400.0 54.414 2200.0 55.0177 12000.0 56.0715 2300.0 58.0648 37000.0 58.8106 2500.0 59.225 2300.0 60.2706 2100.0 61.8502 2900.0 62.1213 2500.0 62.6362 2500.0 63.0234 19000.0 65.7431 2400.0 66.2989 2400.0 69.3803 2300.0 77.0385 52000.0 79.0536 4300.0 82.23 2200.0 84.0495 2400.0 89.0384 150000.0 91.0539 400000.0 93.0696 950000.0 93.0763 3500.0 95.0488 180000.0 95.6511 2400.0 103.0539 430000.0 105.0444 57000.0 106.0413 3200.0 107.0489 21000.0 117.0332 900000.0 117.0418 2200.0 117.043 8500.0 119.0489 59000.0 121.0645 9800000.0 121.0739 220000.0 121.085 99000.0 121.0863 32000.0 121.0907 4400.0 123.4548 2500.0 125.3912 2400.0 131.0477 2600.0 133.9725 2800.0 134.0359 28000.0 135.0439 73000.0 136.0518 49000.0 137.0599 5400.0 140.659 3100.0 144.0442 7100.0 144.9088 2800.0 145.0282 9300000.0 145.0389 140000.0 145.056 75000.0 147.044 110000.0 149.046 3400.0 149.0595 400000.0 149.0703 5100.0 151.0754 65000.0 153.7067 2200.0 162.0308 32000.0 163.039 120000.0 163.1255 2400.0 164.0708 9800.0 173.5252 27000.0 173.5371 56000.0 173.5471 2400.0 176.0705 17000.0 177.018 37000.0 177.0264 28000.0 177.0547 12000000.0 177.0836 18000.0 177.0911 84000.0 177.1009 5900.0 177.111 4300.0 183.0815 3000.0 186.0552 100000.0 191.6388 2900.0 194.0814 170000.0 203.7983 2500.0 204.0657 3000.0 220.0972 57000.0 238.5526 2500.0 258.2895 2900.0 314.1394 37000.0 314.1756 6300.0 END IONS BEGIN IONS SCANS=338 PEPMASS=801.346 CHARGE=1 COLLISION_ENERGY=0.0 74.0599 220000.0 74.3103 2500.0 74.5976 2400.0 74.7771 2200.0 75.7207 2500.0 76.3874 2300.0 76.7317 2400.0 78.461 2200.0 79.3411 2600.0 79.4907 2700.0 82.597 2300.0 84.0443 250000.0 85.1183 2200.0 89.4489 2500.0 89.8022 2400.0 91.0542 220000.0 93.269 2500.0 95.0165 2300.0 95.049 5900.0 97.0758 110000.0 98.0599 270000.0 98.4421 2400.0 100.9202 2400.0 101.3614 2400.0 102.0548 170000.0 102.3379 2200.0 103.0541 61000.0 107.6725 2800.0 108.6544 2400.0 109.0758 13000.0 112.3003 2500.0 114.6352 2200.0 115.0864 120000.0 117.0574 8900.0 118.0554 7100.0 118.065 690000.0 118.5594 2400.0 119.0493 22000.0 119.0729 4800.0 120.0708 4200.0 120.0806 3300000.0 120.0896 28000.0 120.7834 2400.0 120.9261 2400.0 122.6108 2500.0 123.0438 24000.0 124.087 9800.0 125.0708 490000.0 126.0547 130000.0 130.0498 40000.0 130.0651 2800.0 131.0491 22000.0 132.0808 3100.0 136.0642 14000.0 136.0755 980000.0 136.0876 5600.0 137.0708 190000.0 137.7579 2500.0 137.7706 2400.0 138.0499 2500.0 139.0864 24000.0 140.0704 150000.0 146.0329 3500.0 146.0598 6400000.0 146.0709 52000.0 146.0869 3100.0 146.9659 2700.0 147.0437 13000.0 148.0755 23000.0 150.9807 2500.0 152.0816 160000.0 155.0814 3100.0 158.081 57000.0 158.6437 2600.0 162.0911 6300.0 163.0867 3300.0 163.5177 2600.0 164.0705 150000.0 165.0546 530000.0 165.0699 3400.0 167.0815 42000.0 168.0652 2800.0 168.7979 2500.0 169.0974 2400.0 172.1122 120000.0 173.5215 6000.0 173.5256 110000.0 173.5389 140000.0 174.0551 120000.0 175.1891 2400.0 176.107 32000.0 176.6319 2700.0 182.0812 2100000.0 182.5566 2200.0 182.9357 2200.0 184.0749 18000.0 185.0921 240000.0 185.9821 2900.0 186.0729 2700.0 186.0916 46000.0 187.1231 49000.0 189.1395 2700.0 190.0859 3400.0 192.0656 2400.0 193.0615 15000.0 195.0763 120000.0 197.0122 2700.0 197.0561 3600.0 197.1056 3200.0 198.091 6900.0 199.123 97000.0 200.1061 3300.0 201.1385 35000.0 202.0868 14000.0 202.1247 2400.0 203.1028 160000.0 204.102 100000.0 208.1129 23000.0 211.0508 4200.0 211.0714 380000.0 212.0705 12000.0 213.0871 270000.0 214.134 2800.0 215.0817 43000.0 215.118 200000.0 216.1259 110000.0 217.1094 8900.0 217.1336 3200000.0 217.1585 27000.0 217.3048 2400.0 217.9077 2300.0 219.1129 23000.0 220.096 3300.0 220.1146 3400.0 221.0553 2300.0 222.1283 2400.0 223.0762 6500.0 223.6275 2700.0 225.1025 77000.0 227.1181 130000.0 228.101 3900.0 228.1259 23000.0 229.0979 55000.0 230.0812 50000.0 231.0977 200000.0 236.107 150000.0 236.1311 5000.0 236.4693 2500.0 237.1236 79000.0 238.082 31000.0 239.0663 96000.0 242.1282 13000.0 243.1127 1100000.0 243.1381 44000.0 244.1436 8900.0 245.1283 470000.0 247.1076 420000.0 248.0904 38000.0 248.5899 2500.0 249.0859 13000.0 249.1186 2500.0 253.0972 6200.0 254.1285 10000.0 256.0932 4500.0 257.0763 84000.0 257.0951 25000.0 257.6672 2500.0 259.1093 3000.0 265.0855 110000.0 265.1184 160000.0 267.1123 9800.0 270.1121 100000.0 272.0811 2800.0 273.1235 33000.0 275.0527 3700.0 275.0685 4700.0 275.1027 1800000.0 275.1382 6300.0 275.7393 2500.0 277.1215 2600.0 282.1128 320000.0 283.1291 730000.0 284.1395 36000.0 285.0883 32000.0 285.1231 3200.0 291.1345 80000.0 293.114 48000.0 297.7827 2400.0 299.1402 13000.0 300.1346 53000.0 301.1558 31000.0 302.1502 3800.0 303.098 280000.0 303.1302 3600.0 305.1651 18000.0 313.12 4400.0 319.1297 48000.0 321.1232 41000.0 330.1453 100000.0 331.1282 13000.0 332.1207 3100.0 332.1637 2500.0 333.1089 17000.0 337.1502 2900.0 339.9026 2900.0 340.1287 16000.0 341.9665 2600.0 344.1182 3800.0 344.1728 120000.0 345.157 2800.0 345.5655 2700.0 346.1914 510000.0 346.2391 4400.0 348.1554 65000.0 349.1421 5200.0 351.7133 2700.0 352.5437 2600.0 355.1271 2900.0 358.0956 2800.0 358.1394 130000.0 364.2015 46000.0 365.1507 11000.0 371.1603 140000.0 371.2063 3200.0 372.1663 500000.0 373.1564 2700.0 374.1339 35000.0 375.834 2600.0 376.1503 350000.0 377.9148 2600.0 383.1608 79000.0 386.1351 69000.0 390.123 3200.0 390.1814 1000000.0 392.1472 8200.0 393.7055 2900.0 394.1617 110000.0 396.1945 10000.0 402.1297 12000.0 402.1387 2800.0 404.1461 100000.0 412.1711 18000.0 420.142 18000.0 422.1621 16000.0 424.1882 3000.0 438.1482 6600.0 438.1598 5000.0 455.1943 3700.0 456.1772 9800.0 473.208 45000.0 490.921 2800.0 491.2288 9900.0 500.2017 29000.0 502.5123 2600.0 519.2228 74000.0 521.202 21000.0 524.2579 2700.0 525.2387 6100.0 539.2133 56000.0 541.4777 2700.0 549.2004 13000.0 557.227 38000.0 559.3414 2700.0 564.6324 2400.0 567.2077 58000.0 568.3361 2300.0 571.2538 36000.0 572.8826 2700.0 585.2181 54000.0 585.2338 3300.0 586.0209 2700.0 586.2251 2600.0 587.9152 2800.0 592.8614 3200.0 608.2719 6000.0 626.2758 2600.0 636.2652 35000.0 647.2521 3100.0 647.8156 2900.0 654.2756 80000.0 672.2886 2600.0 700.7612 3000.0 783.3318 45000.0 END IONS BEGIN IONS SCANS=339 PEPMASS=344.1497 CHARGE=1 COLLISION_ENERGY=0.0 51.8632 2000.0 56.2421 2400.0 56.7859 2500.0 59.7495 2500.0 60.2508 2200.0 63.0235 8000.0 66.2427 2200.0 66.6907 2100.0 73.1231 2200.0 75.3669 2200.0 89.0386 85000.0 91.0484 4600.0 91.054 180000.0 93.1358 2200.0 94.0917 2400.0 95.049 55000.0 96.4517 2700.0 117.024 15000.0 117.0334 420000.0 117.0418 2100.0 117.0436 3100.0 119.049 210000.0 121.0646 6400.0 123.0795 2700.0 132.75 2600.0 134.0363 20000.0 135.044 32000.0 136.0518 23000.0 137.0597 20000.0 145.0009 8100.0 145.0074 8800.0 145.0142 6400.0 145.0283 5000000.0 145.0395 24000.0 145.0552 27000.0 145.0634 7400.0 147.0439 4800.0 149.0462 2500.0 149.0596 200000.0 151.0602 2700.0 151.0645 2800.0 151.0752 870000.0 151.087 4700.0 151.3109 2600.0 154.977 2400.0 162.0307 3800.0 163.0389 36000.0 173.5286 52000.0 173.545 14000.0 177.0072 5500.0 177.0182 14000.0 177.0267 12000.0 177.0412 31000.0 177.0546 7400000.0 177.069 47000.0 177.0911 52000.0 177.1014 14000.0 186.055 61000.0 188.5959 2600.0 194.0822 5300.0 195.0635 2300.0 213.7522 3000.0 220.0977 3000.0 END IONS BEGIN IONS SCANS=340 PEPMASS=362.179 CHARGE=1 COLLISION_ENERGY=0.0 70.065 1200000.0 70.0693 9300.0 70.0715 6000.0 70.6026 2500.0 71.0683 19000.0 74.6259 2400.0 75.7002 2300.0 76.2106 2100.0 81.3489 2700.0 82.7349 2600.0 86.0904 3100.0 86.0961 180000.0 91.0542 12000.0 93.0842 2600.0 95.0493 2800.0 95.9034 2900.0 97.0757 18000.0 115.0537 2600.0 115.0863 30000.0 118.0649 35000.0 119.0491 12000.0 119.0728 7300.0 120.0804 58000.0 123.0439 17000.0 125.0707 43000.0 129.1025 6700.0 130.065 650000.0 131.049 15000.0 131.0687 20000.0 131.1172 6800.0 132.0806 81000.0 133.757 2400.0 135.0566 4200.0 135.0677 140000.0 136.0754 94000.0 137.3301 2500.0 138.8796 2300.0 141.1015 2200.0 142.065 19000.0 144.0805 39000.0 145.8874 2100.0 146.0599 220000.0 146.0703 2200.0 146.1504 2200.0 147.0437 12000.0 148.0754 26000.0 157.0975 3600.0 158.061 2900.0 158.0838 53000.0 159.0916 510000.0 160.076 14000.0 160.0949 17000.0 162.9259 2600.0 165.0547 51000.0 167.3476 2400.0 169.0761 53000.0 170.06 180000.0 171.0638 6700.0 172.1122 40000.0 172.3485 3100.0 173.522 4500.0 173.5369 41000.0 174.0553 28000.0 174.1288 6700.0 182.0814 30000.0 185.0713 25000.0 187.0868 54000.0 187.1237 12000.0 188.0705 6700.0 188.1428 3400.0 198.0902 2700.0 203.1544 4600.0 213.1014 7900.0 215.1183 20000.0 216.1263 32000.0 217.1339 86000.0 224.1075 6100.0 231.1498 49000.0 231.1693 2200.0 236.1076 20000.0 236.621 2800.0 237.1394 21000.0 241.0971 3600.0 243.1132 170000.0 244.1157 3900.0 247.1241 3500.0 253.136 3100.0 254.1651 5100.0 259.1447 53000.0 265.0861 3600.0 270.0016 2500.0 270.113 30000.0 272.1768 8200.0 277.1328 3200.0 281.131 2900.0 282.1135 27000.0 292.2198 2600.0 298.1561 130000.0 298.1908 3000.0 299.1623 2800.0 323.1402 51000.0 359.8248 2300.0 396.1953 7100.0 425.2836 2700.0 445.2284 3500.0 572.1758 2800.0 679.8937 2500.0 705.3685 3200.0 END IONS BEGIN IONS SCANS=341 PEPMASS=723.3506 CHARGE=1 COLLISION_ENERGY=0.0 70.0651 1600000.0 70.0687 10000.0 70.0741 4000.0 82.0653 3000.0 83.5653 2600.0 85.0395 2900.0 86.0904 5500.0 86.0963 420000.0 86.1011 2000.0 86.1037 7300.0 87.3997 2200.0 88.4491 2700.0 90.5328 2400.0 91.0542 20000.0 97.0759 100000.0 106.065 2800.0 109.0758 24000.0 113.1069 15000.0 115.0865 78000.0 117.0575 2800.0 118.065 41000.0 119.0488 8900.0 120.0807 79000.0 123.044 4800.0 125.0608 5100.0 125.0708 290000.0 130.0483 3100.0 130.0651 310000.0 130.0763 13000.0 131.0489 16000.0 132.0807 120000.0 136.0647 5300.0 136.0756 210000.0 137.0705 9500.0 141.0869 7800.0 141.1021 330000.0 144.0806 130000.0 146.0599 550000.0 146.0742 6500.0 147.044 3800.0 148.0755 48000.0 155.0811 5400.0 158.0603 6400.0 158.0837 16000.0 159.0916 1500000.0 159.1031 7200.0 160.076 3700.0 161.6826 2800.0 162.0548 9200.0 163.0867 7100.0 164.0703 7200.0 165.0546 130000.0 169.0761 31000.0 170.0601 82000.0 170.0964 6100.0 171.0909 3300.0 172.1121 170000.0 173.523 5800.0 173.5378 32000.0 174.055 65000.0 174.1278 76000.0 181.0972 12000.0 182.0812 240000.0 185.071 37000.0 186.1283 3900.0 187.0866 120000.0 187.1226 19000.0 188.0712 11000.0 188.1432 21000.0 188.5212 2800.0 191.0808 7500.0 197.0711 16000.0 197.1077 4400.0 198.0914 33000.0 199.1227 16000.0 200.1433 18000.0 203.154 20000.0 204.1381 25000.0 208.0604 14000.0 211.1213 3400.0 214.1223 4200.0 215.1178 77000.0 216.1258 120000.0 216.1463 4500.0 217.1335 290000.0 220.1123 50000.0 227.1543 42000.0 231.1493 170000.0 232.1117 13000.0 232.1338 3400.0 236.1072 20000.0 237.0876 4300.0 237.1388 26000.0 238.1213 3200.0 239.1543 12000.0 241.133 19000.0 243.1126 1000000.0 243.153 17000.0 247.1227 130000.0 250.1518 2800.0 253.1344 3200.0 254.1655 19000.0 255.1489 18000.0 259.1132 6100.0 259.1438 370000.0 260.1401 4400.0 265.0865 4300.0 269.1283 17000.0 270.1123 65000.0 272.1756 180000.0 280.1443 13000.0 281.1287 21000.0 282.1128 50000.0 282.1599 40000.0 287.1389 57000.0 298.0988 3300.0 298.155 620000.0 299.1397 20000.0 300.1708 89000.0 300.2063 11000.0 305.1298 3300.0 308.1381 2700.0 309.1222 8900.0 310.1549 20000.0 310.1906 3100.0 322.1531 3300.0 323.1398 37000.0 326.1496 110000.0 327.1363 3400.0 328.2015 40000.0 332.1403 5900.0 337.1148 3000.0 339.4539 2500.0 351.1334 550000.0 356.1965 100000.0 360.2064 71000.0 368.1598 61000.0 378.1452 16000.0 378.5025 2600.0 388.201 14000.0 396.1916 44000.0 400.2017 17000.0 401.2372 3300.0 408.37 2700.0 417.2244 4200.0 419.1946 8000.0 424.186 24000.0 428.1955 12000.0 429.5744 2700.0 439.166 11000.0 445.2219 16000.0 451.1667 12000.0 463.2322 21000.0 468.1955 31000.0 473.2195 14000.0 480.1894 2600.0 491.2267 11000.0 507.2244 2900.0 541.2057 34000.0 582.2696 16000.0 654.2899 10000.0 END IONS BEGIN IONS SCANS=342 PEPMASS=419.201 CHARGE=1 COLLISION_ENERGY=0.0 81.07 2700.0 85.1008 10000.0 85.7487 2800.0 86.0911 3900.0 86.0961 140000.0 87.055 130000.0 91.054 7900.0 99.0074 12000.0 103.0537 3100.0 107.049 5400.0 107.3786 2600.0 108.8945 2400.0 115.054 2200.0 115.0862 11000.0 118.0647 38000.0 118.9132 2600.0 119.049 13000.0 119.0728 6500.0 120.0805 42000.0 123.0437 17000.0 123.7689 2500.0 125.0707 59000.0 125.5091 2300.0 128.612 2700.0 130.0649 530000.0 130.0758 13000.0 131.0685 20000.0 131.1177 3100.0 132.0805 78000.0 135.0677 120000.0 135.1164 11000.0 136.0755 120000.0 136.6065 2900.0 138.9358 2900.0 141.1018 30000.0 142.0648 8000.0 143.0727 3200.0 144.0807 39000.0 146.0598 230000.0 147.0443 11000.0 147.0631 8700.0 148.0759 9300.0 149.0232 51000.0 152.5501 2600.0 156.0447 7100.0 157.0971 11000.0 158.0837 62000.0 159.0916 580000.0 160.0762 7000.0 160.0947 20000.0 162.0554 2700.0 165.0546 84000.0 167.0812 5600.0 169.0759 43000.0 170.06 170000.0 171.0648 5000.0 172.1117 3000.0 173.5225 10000.0 173.5333 39000.0 173.5414 20000.0 174.055 15000.0 174.2761 2300.0 181.0994 2600.0 182.0813 68000.0 184.1083 24000.0 185.0713 22000.0 187.0867 84000.0 188.0699 5900.0 188.144 6000.0 195.0765 140000.0 195.7641 2400.0 196.0789 2700.0 200.0703 4100.0 210.1129 3100.0 212.1028 17000.0 216.1251 3500.0 217.1339 59000.0 225.1017 3400.0 227.1183 38000.0 231.1499 54000.0 234.0875 27000.0 236.1082 12000.0 241.0988 3300.0 243.1131 95000.0 244.1165 4300.0 248.1067 16000.0 251.1142 23000.0 252.1136 9300.0 253.0976 24000.0 253.133 6300.0 254.1296 6500.0 255.1128 32000.0 259.1445 63000.0 260.1063 4500.0 260.1488 2400.0 262.636 10000.0 270.112 19000.0 272.1392 8400.0 272.1766 21000.0 272.635 3000.0 276.1426 5300.0 277.1319 3000.0 277.4025 2700.0 279.1125 2700.0 280.1089 23000.0 280.1421 3100.0 281.0931 130000.0 282.1138 17000.0 287.1389 2500.0 292.0983 13000.0 296.1402 8700.0 297.1242 34000.0 297.6402 4700.0 298.1196 32000.0 298.156 91000.0 299.1386 7800.0 300.1717 15000.0 309.1219 3300.0 311.4349 2800.0 313.1669 2800.0 322.12 35000.0 323.103 33000.0 323.14 110000.0 324.1419 5900.0 326.15 10000.0 339.1462 75000.0 340.1301 77000.0 348.1839 3700.0 351.1352 32000.0 356.1985 7300.0 357.1567 76000.0 366.1833 3200.0 388.1671 2500.0 396.1937 3000.0 405.9441 2600.0 408.1949 3000.0 424.9548 2600.0 440.2258 3500.0 514.342 2600.0 521.1957 2300.0 524.2685 3200.0 593.9263 2700.0 701.7225 2800.0 750.0775 2600.0 789.0916 2600.0 END IONS BEGIN IONS SCANS=343 PEPMASS=837.3937 CHARGE=1 COLLISION_ENERGY=0.0 81.7676 2500.0 85.4557 2400.0 86.0963 250000.0 87.0553 20000.0 88.0033 2500.0 91.0543 41000.0 97.0763 5800.0 98.5048 2400.0 107.2653 2300.0 113.1072 8000.0 115.0864 16000.0 116.9983 2400.0 118.065 190000.0 120.0806 120000.0 123.0439 5700.0 123.4197 2300.0 125.0708 95000.0 126.9326 2300.0 127.2324 2500.0 130.065 220000.0 130.0762 3500.0 131.0495 4100.0 131.7617 2300.0 132.0807 77000.0 136.0755 180000.0 137.0708 29000.0 141.0896 6600.0 141.1021 280000.0 141.868 2600.0 142.9967 2500.0 144.0806 64000.0 146.0329 3100.0 146.0598 2000000.0 146.0705 2300.0 146.3199 2400.0 147.0442 2300.0 148.1894 2300.0 149.0713 2900.0 152.0831 2600.0 153.0656 10000.0 154.0969 6600.0 158.0603 3100.0 158.0843 7100.0 159.0915 520000.0 159.1033 3200.0 160.0756 2200.0 163.0868 9600.0 165.0546 110000.0 165.0906 6800.0 167.0671 2400.0 167.0814 33000.0 169.0762 25000.0 170.06 48000.0 173.5115 2500.0 173.5171 3200.0 173.5258 25000.0 173.5394 39000.0 174.1277 19000.0 177.0658 15000.0 182.0812 210000.0 184.108 200000.0 185.0713 28000.0 186.1281 3500.0 187.0866 98000.0 188.1433 42000.0 192.0769 16000.0 193.084 13000.0 194.0921 16000.0 195.0763 290000.0 197.0703 4000.0 200.0707 2600.0 200.1443 3800.0 203.1538 4700.0 206.0927 13000.0 212.103 87000.0 214.1235 3500.0 215.0767 2300.0 215.1186 2700.0 216.0752 2300.0 216.1247 3300.0 217.1335 110000.0 220.1122 18000.0 225.1028 13000.0 227.1179 28000.0 227.1545 23000.0 231.1492 350000.0 231.1759 3300.0 232.1125 6400.0 234.0873 440000.0 234.1085 2600.0 236.1077 8800.0 237.1384 24000.0 238.1486 2400.0 239.0839 2500.0 239.1536 7300.0 243.1127 170000.0 247.1226 52000.0 251.1136 420000.0 252.1126 70000.0 253.097 2700.0 254.1284 120000.0 254.1615 11000.0 255.1124 11000.0 255.1475 7100.0 259.1437 470000.0 269.1288 14000.0 270.1143 31000.0 272.1393 46000.0 272.1757 180000.0 276.1145 2700.0 278.1281 11000.0 280.108 160000.0 280.1431 13000.0 281.0922 26000.0 281.127 13000.0 282.1132 27000.0 282.1599 15000.0 282.6591 2300.0 284.1013 3100.0 287.141 11000.0 294.1236 43000.0 296.1397 110000.0 297.1236 110000.0 298.1183 200000.0 298.1552 490000.0 299.1393 28000.0 300.1708 130000.0 308.1386 6400.0 312.1339 25000.0 313.1661 81000.0 314.1496 24000.0 316.1664 3000.0 319.1786 7400.0 322.1183 330000.0 322.1505 2400.0 323.1022 95000.0 323.1404 17000.0 326.1495 86000.0 339.1449 470000.0 339.1831 4300.0 339.192 5500.0 340.1287 480000.0 340.1641 3500.0 347.1702 18000.0 351.0855 5600.0 351.1334 320000.0 356.1966 42000.0 357.1552 470000.0 358.1427 4100.0 360.2055 24000.0 364.1982 18000.0 365.1937 4400.0 366.1799 12000.0 368.1601 78000.0 372.2078 3300.0 378.1519 5300.0 381.1605 2800.0 383.2075 10000.0 388.1994 2800.0 393.1919 2800.0 396.1901 8700.0 400.2007 11000.0 407.2071 15000.0 408.1925 23000.0 411.2001 4100.0 411.2063 8800.0 419.1978 3700.0 424.2342 42000.0 425.218 31000.0 428.1941 3600.0 435.2023 15000.0 445.2212 4200.0 451.1662 12000.0 452.2276 42000.0 453.2129 33000.0 463.2346 17000.0 468.1923 16000.0 470.2392 8000.0 475.2009 2700.0 477.2123 3600.0 503.1898 9700.0 521.2031 47000.0 538.2284 17000.0 617.1343 3000.0 636.2852 4100.0 639.2844 2900.0 639.2972 4400.0 654.2805 2900.0 695.3405 2700.0 707.2795 19000.0 802.3569 3300.0 803.3373 2700.0 END IONS BEGIN IONS SCANS=344 PEPMASS=501.26 CHARGE=1 COLLISION_ENERGY=0.0 64.0834 2100.0 69.9028 2300.0 75.8037 2200.0 91.0544 5900.0 92.3771 2800.0 93.0701 4800.0 93.1228 2400.0 93.6564 2600.0 98.0602 2400.0 99.0441 5800.0 107.0986 2500.0 117.0545 14000.0 121.0647 460000.0 123.5608 2300.0 126.0911 4700.0 144.1025 4500.0 145.086 43000.0 147.0446 7000.0 150.0689 2800.0 150.0918 11000.0 160.0526 2800.0 162.0676 33000.0 163.0396 7600.0 163.0757 5600.0 164.1072 9700.0 173.5345 52000.0 175.0393 6200.0 176.0934 7500.0 176.1072 1100000.0 176.143 6300.0 177.0558 2700.0 178.0628 30000.0 178.0927 2900.0 187.1077 15000.0 189.0549 20000.0 190.0625 250000.0 190.0811 4200.0 191.034 35000.0 191.0705 23000.0 193.0651 3900.0 193.0862 220000.0 206.0576 97000.0 217.1329 4500.0 219.1132 20000.0 221.0307 37000.0 221.081 5700000.0 221.1206 14000.0 221.1322 27000.0 236.1284 11000.0 238.1076 22000.0 263.1753 40000.0 264.1595 38000.0 266.3561 3000.0 281.1867 39000.0 290.1401 3700.0 290.3269 2300.0 305.4653 2500.0 307.1654 25000.0 329.6103 2500.0 336.1449 14000.0 350.9579 2300.0 364.1216 4300.0 364.1374 13000.0 364.1757 920000.0 381.2024 21000.0 386.4982 2600.0 444.0071 2700.0 484.2335 30000.0 501.2597 110000.0 END IONS BEGIN IONS SCANS=345 PEPMASS=287.1259 CHARGE=1 COLLISION_ENERGY=0.0 48.2464 2300.0 49.1959 2200.0 49.9667 2400.0 52.0937 2100.0 52.692 2600.0 55.0539 2600.0 62.2561 2200.0 62.5577 2300.0 64.5791 2100.0 68.2457 2300.0 69.0697 6500.0 70.3609 2700.0 79.7791 2100.0 81.0696 14000.0 85.1547 2300.0 86.5262 2700.0 86.9564 2300.0 93.0601 2600.0 95.05 2700.0 95.0853 11000.0 97.3842 2300.0 105.0696 18000.0 107.085 3200.0 119.0854 33000.0 121.1006 5300.0 133.1004 4000.0 133.6786 2400.0 136.8241 2200.0 142.0605 2400.0 145.1008 11000.0 147.1169 2500.0 157.101 4300.0 159.1164 13000.0 173.1319 3500.0 173.5253 25000.0 173.5383 28000.0 193.6845 2300.0 193.7917 2400.0 201.1637 12000.0 286.6232 2400.0 287.126 15000.0 END IONS BEGIN IONS SCANS=346 PEPMASS=247.1331 CHARGE=1 COLLISION_ENERGY=0.0 44.6272 2300.0 46.1934 2700.0 46.8654 2600.0 47.378 2500.0 48.9178 2000.0 49.0937 2400.0 51.1957 2400.0 53.0385 130000.0 53.4515 2300.0 54.1326 2500.0 55.0178 34000.0 55.0542 110000.0 56.2518 2400.0 57.0334 3100.0 57.0698 30000.0 58.6393 2200.0 59.0491 12000.0 63.7787 2100.0 65.0384 110000.0 67.0541 110000.0 68.9969 4800.0 69.0333 480000.0 69.0377 5500.0 69.0698 33000.0 70.3297 2200.0 71.2955 2300.0 74.3108 2400.0 75.0806 2200.0 75.6532 2300.0 77.0385 19000.0 79.0541 170000.0 81.0333 3500.0 81.0697 240000.0 83.0489 470000.0 83.0854 5000.0 85.028 2400.0 85.0647 3500.0 91.0541 280000.0 93.0334 120000.0 93.0428 2500.0 93.0697 340000.0 95.049 150000.0 95.0854 40000.0 97.0283 120000.0 97.0647 25000.0 98.351 2400.0 100.8158 2400.0 103.0541 5800.0 105.0447 16000.0 105.0697 280000.0 105.0781 2700.0 106.0777 2200.0 107.049 35000.0 107.0854 440000.0 108.0569 6600.0 108.0927 2100.0 109.0283 440000.0 109.0647 290000.0 109.1011 52000.0 110.0727 6400.0 111.0439 110000.0 111.0803 35000.0 112.6637 2400.0 113.5002 2300.0 115.0544 37000.0 116.0621 6800.0 117.0697 190000.0 119.049 15000.0 119.0768 4800.0 119.0854 470000.0 119.0941 2100.0 120.0928 2400.0 121.0282 93000.0 121.0552 8300.0 121.0647 480000.0 121.101 190000.0 122.0724 17000.0 122.1644 3000.0 123.0437 7300.0 123.0802 51000.0 125.0236 3000.0 125.0592 11000.0 125.0956 2800.0 128.062 46000.0 129.0698 94000.0 130.0778 30000.0 131.0854 530000.0 131.1436 2400.0 132.0568 43000.0 133.0649 18000.0 133.0903 4500.0 133.1011 310000.0 135.0437 9000.0 135.0685 4700.0 135.0803 730000.0 135.1176 2700.0 136.0891 5500.0 137.0596 58000.0 137.096 79000.0 139.0394 9200.0 141.07 43000.0 142.0776 66000.0 143.0854 200000.0 144.056 3300.0 144.0933 260000.0 145.0646 250000.0 145.0888 4200.0 145.1011 380000.0 146.0725 21000.0 147.0803 92000.0 149.0595 25000.0 149.0829 4900.0 149.096 480000.0 149.1165 3800.0 150.1037 59000.0 151.075 13000.0 151.1117 78000.0 153.0697 36000.0 153.0908 24000.0 154.0777 17000.0 155.0854 130000.0 156.0936 26000.0 157.064 12000.0 157.101 100000.0 157.8274 2600.0 158.0726 52000.0 158.1089 450000.0 158.1238 5000.0 159.0804 300000.0 159.1167 900000.0 160.0882 110000.0 160.7195 2700.0 161.096 96000.0 161.1319 5600.0 163.0753 350000.0 163.1115 50000.0 165.0914 32000.0 166.0784 2600.0 167.0851 7900.0 168.0934 140000.0 169.1013 71000.0 170.109 130000.0 170.6821 2400.0 171.0805 120000.0 171.1169 42000.0 172.0739 9200.0 172.0883 420000.0 173.0601 34000.0 173.0962 720000.0 173.1326 1000000.0 173.1501 5000.0 173.5264 13000.0 173.5342 43000.0 174.0678 3500.0 175.0752 27000.0 175.1118 5600.0 177.0912 16000.0 177.1282 4100.0 178.0779 5700.0 179.7822 2600.0 181.0649 45000.0 181.1026 2900.0 183.1169 220000.0 184.124 2600.0 185.0962 36000.0 185.133 8000.0 186.0845 19000.0 186.1039 810000.0 186.1234 19000.0 187.0747 50000.0 187.1117 2000000.0 188.1199 5200.0 189.0909 38000.0 189.1289 2200.0 191.0509 3000.0 191.0702 570000.0 193.1011 41000.0 195.08 6400.0 196.0882 170000.0 199.0754 45000.0 199.813 2400.0 201.0941 11000.0 201.1064 3600.0 201.1274 570000.0 201.1496 3600.0 203.1417 3600.0 205.1227 32000.0 211.1119 130000.0 214.099 98000.0 219.1386 9200.0 229.1224 150000.0 231.4461 2400.0 247.1328 75000.0 252.5036 2400.0 END IONS BEGIN IONS SCANS=347 PEPMASS=229.1227 CHARGE=1 COLLISION_ENERGY=0.0 43.0177 31000.0 44.0663 2300.0 44.3565 2200.0 44.8417 2100.0 46.7723 3000.0 50.2294 2400.0 51.4071 2600.0 51.779 2500.0 53.0384 43000.0 54.8022 2100.0 55.0542 5600.0 55.9343 22000.0 57.162 2200.0 58.8598 2400.0 59.2016 2200.0 59.406 2200.0 59.5264 2300.0 67.0537 3400.0 67.3477 2600.0 68.3763 2300.0 69.0332 110000.0 71.7085 2400.0 73.5437 2400.0 79.861 2600.0 81.0694 3000.0 83.0489 10000.0 83.1692 2600.0 84.2997 2200.0 90.9478 6100.0 91.054 30000.0 91.7231 2600.0 92.1012 2400.0 93.0696 37000.0 95.5067 2600.0 97.8593 2600.0 103.3496 2800.0 103.6052 2500.0 105.0695 33000.0 105.8606 2700.0 109.028 86000.0 109.0644 3000.0 109.368 2200.0 115.9639 2400.0 116.7131 2300.0 117.0697 7600.0 119.0852 48000.0 121.0645 34000.0 123.4089 2400.0 123.4883 2500.0 128.062 2500.0 129.0696 15000.0 129.3423 2400.0 130.9187 2600.0 131.0853 99000.0 133.1009 65000.0 133.1109 3000.0 141.0697 5300.0 143.0854 55000.0 144.0293 2500.0 144.0931 33000.0 145.0648 7000.0 145.101 72000.0 147.1358 2700.0 154.0781 2600.0 154.1783 2400.0 155.0851 28000.0 157.1008 3200.0 158.1088 130000.0 159.0803 43000.0 159.1165 71000.0 164.9518 3200.0 168.0936 29000.0 169.1001 5500.0 170.1089 35000.0 171.0802 20000.0 172.0883 51000.0 173.096 180000.0 173.1122 3400.0 173.1158 4000.0 173.1325 240000.0 173.5239 7100.0 173.5326 50000.0 173.5416 6100.0 181.0654 3000.0 183.1169 41000.0 185.131 2500.0 186.1038 160000.0 187.1116 280000.0 196.0884 38000.0 199.0767 5200.0 201.092 2900.0 201.1273 90000.0 211.112 23000.0 214.0982 18000.0 214.7946 2800.0 229.1219 31000.0 234.8754 2600.0 END IONS BEGIN IONS SCANS=348 PEPMASS=353.1388 CHARGE=1 COLLISION_ENERGY=0.0 52.2154 2200.0 52.3228 2100.0 52.7565 2500.0 56.145 2100.0 56.8318 2100.0 56.9681 2500.0 57.7743 2300.0 58.5089 2600.0 61.0286 2300.0 61.2034 2300.0 61.9453 2900.0 64.3054 2400.0 66.1501 2300.0 67.2121 2300.0 67.7341 3000.0 71.6192 2300.0 79.0543 2700.0 79.7822 2300.0 80.322 2100.0 84.0686 2200.0 84.6098 2000.0 86.4109 2300.0 86.5414 2400.0 87.0985 2400.0 87.9134 2900.0 95.0488 3900.0 107.0491 9100.0 117.2921 2600.0 117.4121 2500.0 121.0651 2300.0 127.9657 2600.0 129.0696 79000.0 135.033 4200.0 135.0439 570000.0 136.0517 73000.0 139.0754 7300.0 142.9782 2600.0 144.3843 2500.0 145.0654 3300.0 147.0434 3000.0 149.0596 17000.0 151.0752 500000.0 155.8832 2900.0 157.0646 100000.0 160.7364 2200.0 161.06 10000.0 165.0546 5100.0 165.0912 14000.0 170.9245 2300.0 171.0811 5800.0 172.051 2900.0 172.0884 19000.0 173.0596 45000.0 173.5216 32000.0 173.5309 16000.0 173.5404 58000.0 174.0671 3300.0 175.0754 6700.0 177.092 2800.0 179.0714 8400.0 181.0643 2400.0 185.0597 230000.0 185.0789 4900.0 186.0681 3100.0 187.0753 110000.0 188.0834 59000.0 189.0909 21000.0 197.0596 33000.0 199.0751 36000.0 201.091 120000.0 203.1067 71000.0 208.8849 2600.0 213.0909 15000.0 215.0703 95000.0 217.1016 4300.0 218.0767 2700.0 231.0794 6200.0 231.1019 60000.0 233.0964 16000.0 239.0702 38000.0 245.096 27000.0 246.0758 2700.0 246.1036 48000.0 247.0759 20000.0 247.1101 3000.0 249.0906 8100.0 251.1067 7100.0 252.0777 46000.0 253.0857 3500.0 258.0674 2500.0 259.0736 7200.0 260.0821 18000.0 261.0907 52000.0 262.0985 61000.0 263.0701 6100.0 265.0894 5200.0 265.1219 30000.0 267.0649 64000.0 268.0729 42000.0 272.0827 6500.0 273.091 59000.0 274.099 69000.0 275.0701 12000.0 275.1073 3300.0 276.0788 13000.0 277.0862 46000.0 277.1225 85000.0 278.0936 34000.0 279.1019 7200.0 282.0888 380000.0 283.0963 46000.0 288.0783 22000.0 289.0863 130000.0 290.0942 53000.0 291.1018 43000.0 292.0762 3600.0 292.1095 100000.0 293.081 30000.0 293.1179 37000.0 295.0968 48000.0 303.1017 96000.0 304.1097 260000.0 305.0804 70000.0 305.1177 120000.0 306.0881 13000.0 307.0965 7100.0 308.1047 190000.0 309.1122 14000.0 319.0969 18000.0 320.1045 71000.0 322.1205 13000.0 323.1275 37000.0 335.1279 100000.0 353.1385 9600.0 END IONS BEGIN IONS SCANS=349 PEPMASS=718.3243 CHARGE=1 COLLISION_ENERGY=0.0 68.0496 12000.0 70.065 4000000.0 70.0703 34000.0 70.0719 18000.0 70.0739 19000.0 70.9643 4200.0 72.186 3600.0 86.1571 2700.0 87.568 3100.0 91.0541 180000.0 93.0696 5300.0 95.0491 10000.0 97.0759 51000.0 98.06 120000.0 103.0541 54000.0 107.0499 3400.0 109.0769 3100.0 110.7038 4200.0 115.0864 240000.0 117.0574 5800.0 118.065 230000.0 119.0728 41000.0 120.0806 3600000.0 120.0888 23000.0 120.1005 4200.0 124.0867 52000.0 125.0708 280000.0 126.0547 62000.0 130.0651 33000.0 131.049 24000.0 132.0805 25000.0 133.8563 4900.0 135.6938 4200.0 136.0757 160000.0 136.9508 5800.0 137.0708 420000.0 137.0831 3200.0 144.6035 4000.0 146.0599 2200000.0 146.0702 12000.0 146.0738 12000.0 148.0751 8800.0 151.0739 21000.0 152.0817 420000.0 162.055 16000.0 164.0706 76000.0 165.0546 48000.0 172.0966 9100.0 172.1122 300000.0 173.0713 6100.0 173.527 45000.0 174.0549 28000.0 182.0813 180000.0 185.1097 5500.0 187.1231 46000.0 189.1398 2900.0 191.0819 8200.0 192.0661 5000.0 199.123 170000.0 200.1069 6500.0 201.1391 33000.0 208.1123 95000.0 214.1337 14000.0 215.0815 30000.0 215.1179 190000.0 216.1258 460000.0 217.1336 1200000.0 217.1517 7700.0 217.1588 9800.0 220.1124 30000.0 221.55 2600.0 222.128 100000.0 223.0752 14000.0 225.1021 98000.0 227.1179 200000.0 228.1024 22000.0 228.1259 69000.0 236.1071 130000.0 237.1385 17000.0 238.1228 46000.0 242.1283 18000.0 243.1126 430000.0 243.1371 65000.0 244.1444 54000.0 245.1284 190000.0 248.1069 52000.0 253.134 3900.0 254.1285 68000.0 256.1437 20000.0 262.1545 4000.0 264.1017 20000.0 265.0856 79000.0 265.1335 280000.0 266.1179 12000.0 270.1125 85000.0 272.1395 55000.0 277.1337 97000.0 281.1278 33000.0 282.1128 310000.0 283.1447 20000.0 284.1393 32000.0 293.1287 330000.0 293.166 3800.0 299.1381 47000.0 299.3519 2900.0 300.1347 160000.0 301.1698 25000.0 302.1518 3500.0 305.1649 28000.0 309.1235 550000.0 311.1378 4600.0 312.1233 6100.0 318.1949 16000.0 321.1232 63000.0 327.1361 20000.0 329.1501 220000.0 339.1338 49000.0 344.1756 210000.0 346.1406 4200.0 346.1536 4500.0 346.1914 1000000.0 355.1287 200000.0 362.1865 29000.0 372.1707 280000.0 383.1754 23000.0 390.1811 2200000.0 391.1859 11000.0 391.1954 5700.0 396.1471 3600.0 396.1975 21000.0 400.1543 22000.0 406.1771 11000.0 415.1398 5700.0 417.1811 250000.0 424.1896 11000.0 429.1807 130000.0 446.2059 21000.0 456.1913 28000.0 458.2069 76000.0 474.202 99000.0 484.182 4400.0 498.2371 16000.0 502.1967 650000.0 502.2817 16000.0 525.2488 29000.0 526.2322 20000.0 543.1831 3900.0 543.2592 140000.0 553.2433 69000.0 571.2541 160000.0 578.4147 2900.0 718.322 33000.0 END IONS BEGIN IONS SCANS=350 PEPMASS=685.2768 CHARGE=1 COLLISION_ENERGY=0.0 79.4136 2800.0 81.016 2400.0 81.1545 2200.0 93.7566 2300.0 96.3507 2500.0 103.054 2400.0 114.1704 2600.0 115.1549 2200.0 121.0551 9600.0 121.0646 240000.0 124.774 2400.0 138.17 2700.0 138.7051 2500.0 155.0701 2400.0 155.5782 2600.0 162.6816 2800.0 164.07 3700.0 168.8496 2200.0 173.5254 28000.0 173.5412 36000.0 182.2631 2400.0 219.0816 5000.0 231.0388 10000.0 231.0651 380000.0 233.0601 7000.0 235.0746 2800.0 235.3224 2400.0 237.0905 21000.0 247.074 2800.0 250.0629 2900.0 250.5087 2500.0 262.1345 2800.0 263.0701 81000.0 265.0855 80000.0 274.0708 20000.0 291.0655 13000.0 293.0809 110000.0 297.1119 53000.0 298.8282 2700.0 305.0809 2900.0 307.4566 2300.0 308.0672 20000.0 318.0488 2700.0 321.0765 2900.0 323.0913 75000.0 325.1072 95000.0 342.1095 89000.0 351.0857 1200000.0 351.1233 6900.0 352.0948 6700.0 355.1129 3000.0 355.4034 2500.0 357.1328 92000.0 368.0908 3000.0 383.0565 5300.0 383.1124 370000.0 390.3831 2700.0 394.1287 47000.0 401.2897 2600.0 406.4375 2400.0 411.1084 27000.0 429.1188 18000.0 509.937 2700.0 520.1957 77000.0 548.1907 6300.0 611.9456 2700.0 END IONS BEGIN IONS SCANS=351 PEPMASS=221.0812 CHARGE=1 COLLISION_ENERGY=0.0 42.6381 4600.0 43.4796 2400.0 44.3123 2100.0 45.3966 2500.0 48.89 2400.0 48.945 2200.0 50.7338 2300.0 51.6834 2700.0 52.482 2400.0 52.6724 2100.0 53.085 2400.0 53.5937 2400.0 55.1248 2400.0 55.1543 2500.0 56.2748 2200.0 56.6497 2200.0 56.6815 4300.0 58.8682 2200.0 59.3874 3000.0 60.8214 2400.0 63.6555 2300.0 65.2295 2300.0 67.2312 2200.0 69.6635 2400.0 70.0399 2100.0 72.8697 2300.0 74.2084 2300.0 75.4155 2100.0 78.0462 27000.0 79.054 56000.0 79.1635 2600.0 85.3479 2300.0 85.5059 2600.0 85.8306 2200.0 88.1002 2300.0 90.0465 3500.0 91.054 91000.0 93.4984 2800.0 95.0489 13000.0 95.1051 2600.0 102.0095 2400.0 102.0463 110000.0 103.054 52000.0 104.0618 45000.0 104.7275 2600.0 105.0335 6200.0 105.0699 38000.0 107.0489 100000.0 109.8305 2800.0 114.634 2700.0 115.0547 3500.0 116.062 2600.0 117.0338 2900.0 117.8939 2400.0 118.0411 65000.0 119.0489 190000.0 120.0566 15000.0 121.0646 41000.0 121.4312 2400.0 122.0725 14000.0 122.5399 2700.0 130.0412 180000.0 131.049 79000.0 132.0205 3500.0 132.0466 2700.0 132.0568 140000.0 132.3839 2300.0 133.0284 35000.0 133.0646 51000.0 134.037 3500.0 134.0726 8600.0 135.033 4500.0 135.0439 240000.0 135.3654 2200.0 136.0256 2700.0 136.6818 2400.0 137.7898 2300.0 140.8732 2400.0 141.069 2500.0 144.0568 2600.0 145.0282 22000.0 145.113 2400.0 146.036 30000.0 147.0439 600000.0 147.0571 4400.0 148.0517 93000.0 149.0596 130000.0 150.0674 47000.0 150.1903 2500.0 152.6988 2300.0 156.9736 8100.0 157.0396 14000.0 158.0361 2700.0 159.0438 26000.0 160.0518 160000.0 161.023 28000.0 161.0597 120000.0 162.0531 4800.0 162.0675 410000.0 162.0829 3800.0 163.0388 740000.0 163.0751 68000.0 173.5255 33000.0 173.5362 55000.0 174.0314 38000.0 174.985 37000.0 175.039 400000.0 176.0468 110000.0 176.0739 6800.0 177.0547 110000.0 177.7835 2600.0 178.0625 380000.0 178.0805 3300.0 187.0396 3600.0 188.0468 55000.0 188.1798 2400.0 189.0546 23000.0 190.0427 9300.0 190.0625 520000.0 190.0808 4500.0 191.0338 230000.0 191.0705 14000.0 191.6745 2500.0 193.0861 240000.0 205.0499 6900.0 206.0576 120000.0 217.724 2600.0 221.081 35000.0 221.1899 5200.0 223.5993 2300.0 227.6747 2300.0 END IONS BEGIN IONS SCANS=352 PEPMASS=334.1291 CHARGE=1 COLLISION_ENERGY=0.0 50.2103 2800.0 51.4262 2100.0 53.105 2400.0 54.6978 2300.0 55.2697 41000.0 55.2714 4800.0 55.2914 2400.0 55.6588 2700.0 57.5358 2500.0 62.0729 2200.0 63.6303 2100.0 63.6873 2200.0 63.8988 2300.0 64.9927 2300.0 68.9858 2600.0 70.7663 2600.0 71.076 2300.0 71.2149 2200.0 72.6389 2100.0 73.0831 2600.0 74.2426 2300.0 79.0541 6200.0 80.6623 2200.0 88.7573 2500.0 91.0541 18000.0 95.3024 2200.0 98.3747 2300.0 100.3336 2500.0 102.0465 14000.0 103.054 8600.0 103.338 2700.0 104.0622 6900.0 105.0699 9900.0 107.0492 5400.0 107.1606 2500.0 108.2694 2400.0 114.0543 2600.0 115.4316 2700.0 118.0411 25000.0 119.0492 44000.0 120.0577 2800.0 122.072 2900.0 130.0413 64000.0 131.0491 22000.0 132.0571 35000.0 133.0286 2800.0 133.0647 57000.0 135.0442 60000.0 144.0099 2400.0 146.0359 9900.0 147.044 270000.0 148.0521 32000.0 149.0597 46000.0 150.0675 41000.0 158.036 3500.0 159.0438 16000.0 160.0519 75000.0 161.0598 140000.0 162.0676 790000.0 162.0831 19000.0 163.039 260000.0 163.0753 140000.0 165.0912 31000.0 167.0703 28000.0 167.6844 2300.0 170.651 2200.0 173.5266 27000.0 173.5368 48000.0 173.5463 4200.0 174.0167 2400.0 174.0314 80000.0 175.0392 190000.0 176.047 190000.0 177.0549 140000.0 178.0484 2500.0 178.0626 720000.0 178.0806 14000.0 178.4034 2500.0 181.6827 2400.0 188.0468 66000.0 189.0547 370000.0 189.0724 4700.0 190.0221 7900.0 190.0426 11000.0 190.0624 4000000.0 190.6677 2300.0 191.0138 21000.0 191.0338 820000.0 191.0701 310000.0 192.0416 40000.0 193.086 3000000.0 193.1066 6400.0 202.0693 2600.0 202.7986 2400.0 205.0494 24000.0 206.0346 15000.0 206.0413 3800.0 206.0575 1500000.0 206.0801 18000.0 207.531 2400.0 220.8655 2400.0 221.0305 63000.0 221.0809 10000000.0 221.1199 9100.0 221.1323 46000.0 222.0847 20000.0 267.0266 2400.0 270.2938 2800.0 291.1017 2700.0 298.3531 2600.0 318.0905 2400.0 343.1904 2600.0 END IONS BEGIN IONS SCANS=353 PEPMASS=356.1108 CHARGE=1 COLLISION_ENERGY=0.0 52.049 2300.0 52.1674 2600.0 53.1675 2100.0 53.9535 2500.0 54.392 2400.0 75.4029 2600.0 79.5402 2100.0 86.0625 2200.0 87.0532 2200.0 96.067 2500.0 106.1401 2300.0 108.1613 2700.0 173.521 11000.0 173.5323 49000.0 173.5401 23000.0 184.0157 2700.0 200.5066 2200.0 201.9275 2200.0 210.0161 3100.0 237.1799 2800.0 255.558 2400.0 286.7584 2600.0 307.5224 2400.0 309.9 9000.0 313.6196 2600.0 END IONS BEGIN IONS SCANS=354 PEPMASS=245.0136 CHARGE=1 COLLISION_ENERGY=0.0 47.0586 2200.0 50.0403 2300.0 53.0572 2300.0 55.9342 23000.0 65.3099 2300.0 66.9751 2200.0 75.46 2300.0 82.7495 2100.0 88.2843 2400.0 88.5484 2400.0 92.1079 2300.0 96.7269 2700.0 102.7498 2400.0 113.1016 2300.0 114.7087 2400.0 115.7152 2400.0 117.1599 2500.0 137.3131 2200.0 137.7341 2700.0 167.0 3100.0 173.5224 4700.0 173.5363 40000.0 175.9916 9000.0 184.9966 3100.0 203.9866 7600.0 219.5722 2600.0 220.9896 18000.0 221.9303 2800.0 221.9967 16000.0 222.7486 2600.0 240.0078 7700.0 END IONS BEGIN IONS SCANS=355 PEPMASS=219.102 CHARGE=1 COLLISION_ENERGY=0.0 42.5982 2000.0 43.0177 16000.0 44.8793 2300.0 45.0334 6400.0 47.6885 2500.0 50.6115 2700.0 53.3773 2300.0 55.0173 2500.0 55.9343 6500.0 56.2341 2200.0 57.0333 20000.0 58.544 2300.0 61.9156 2400.0 63.9235 2200.0 66.1915 2500.0 67.0127 2100.0 67.0542 12000.0 81.2674 2700.0 82.3532 2500.0 85.0283 2900.0 90.9475 3000.0 91.0539 120000.0 103.0539 29000.0 104.113 2400.0 105.0697 11000.0 107.0852 2300.0 107.4827 2300.0 109.0642 2400.0 112.8421 2700.0 115.054 92000.0 116.0617 33000.0 117.0696 37000.0 119.0861 2500.0 123.0787 2600.0 128.0618 95000.0 129.0589 4900.0 129.0695 580000.0 129.0795 3800.0 129.9507 2700.0 130.0775 34000.0 131.0488 90000.0 131.0852 500000.0 131.0946 2600.0 131.0987 6100.0 133.1013 11000.0 137.0594 60000.0 141.0696 510000.0 141.0807 2600.0 141.0829 4100.0 141.8279 2500.0 142.0773 3500.0 143.0488 26000.0 143.085 31000.0 144.0568 73000.0 145.0644 77000.0 146.0725 72000.0 147.0438 8000.0 148.0518 19000.0 151.0766 3600.0 152.1979 2300.0 153.0703 2500.0 154.7886 2300.0 155.0607 5200.0 156.0564 6700.0 157.0507 8300.0 157.0645 250000.0 158.0724 310000.0 158.0874 9600.0 159.0438 31000.0 159.0802 200000.0 160.0516 79000.0 161.0595 16000.0 161.096 51000.0 162.0673 13000.0 163.0753 24000.0 168.057 17000.0 169.0646 160000.0 170.0726 100000.0 171.0442 4100.0 171.0802 16000.0 172.0885 2800.0 173.0597 60000.0 173.0961 7600.0 173.5249 13000.0 173.5384 30000.0 174.0502 4300.0 174.0674 1100000.0 175.0752 110000.0 183.0815 6100.0 184.0347 2900.0 185.0596 8800.0 186.0674 260000.0 187.0756 13000.0 188.0833 74000.0 189.0909 480000.0 189.1111 9200.0 191.0699 3500.0 191.1073 3300.0 196.2653 2300.0 201.091 250000.0 203.1432 9800.0 217.9115 2600.0 219.1017 38000.0 219.1745 15000.0 221.2251 2400.0 END IONS BEGIN IONS SCANS=356 PEPMASS=467.1819 CHARGE=1 COLLISION_ENERGY=0.0 57.5665 2500.0 66.1873 2300.0 68.6225 2300.0 71.6511 2300.0 72.7022 2200.0 73.2864 2300.0 74.8404 2200.0 75.1911 2200.0 78.5216 2200.0 98.0598 26000.0 101.9975 2500.0 120.1961 2300.0 121.5909 2900.0 122.0589 3500.0 125.745 2400.0 132.0445 3100.0 135.0452 3100.0 147.044 21000.0 150.0546 150000.0 161.0594 7100.0 162.0537 2500.0 162.0673 76000.0 163.0384 17000.0 163.0751 8600.0 163.4233 2400.0 173.5374 29000.0 174.0312 4100.0 175.039 14000.0 176.0467 15000.0 177.0553 16000.0 178.0624 47000.0 189.0544 52000.0 190.0622 520000.0 190.0773 7800.0 191.0337 94000.0 191.0702 46000.0 193.0655 3600.0 193.0857 440000.0 193.1004 4400.0 193.1063 9800.0 206.041 2300.0 206.0572 190000.0 211.3005 2500.0 219.1131 2900.0 221.0297 19000.0 221.0807 4900000.0 221.1001 23000.0 221.12 10000.0 221.1316 25000.0 230.0817 24000.0 247.1075 390000.0 247.1368 4600.0 355.6633 2500.0 412.6211 2500.0 470.4674 2500.0 END IONS BEGIN IONS SCANS=357 PEPMASS=326.1005 CHARGE=1 COLLISION_ENERGY=0.0 49.932 2100.0 55.2694 2300.0 57.0418 2400.0 58.0648 3100.0 59.0103 2200.0 60.6661 2500.0 62.3907 2200.0 63.6597 2300.0 63.7292 2400.0 68.243 2300.0 69.8033 2800.0 70.9844 2200.0 76.1463 2300.0 76.3557 2200.0 77.1628 2100.0 81.743 2400.0 83.5551 2400.0 90.1629 2400.0 91.008 2200.0 100.4659 2200.0 116.9707 2700.0 117.4213 2600.0 120.0416 28000.0 122.9545 2200.0 147.0438 2700.0 153.8955 2600.0 157.9082 2600.0 163.706 2300.0 173.5252 15000.0 173.535 58000.0 173.5452 5000.0 175.0392 11000.0 205.6184 2500.0 207.0644 11000.0 207.829 2300.0 212.8014 2500.0 221.457 2600.0 229.0447 2600.0 233.8999 3100.0 249.016 2400.0 250.265 2400.0 262.0706 2400.0 288.3494 2300.0 297.9064 2400.0 311.1159 5400.0 326.1005 70000.0 END IONS BEGIN IONS SCANS=358 PEPMASS=303.1108 CHARGE=1 COLLISION_ENERGY=0.0 48.1599 2100.0 49.6031 2200.0 50.5534 2200.0 53.8455 2400.0 57.8911 2600.0 59.1999 2600.0 64.8517 2200.0 71.8515 2600.0 73.9428 2500.0 81.0333 6300.0 82.065 17000.0 83.353 2300.0 84.6237 2400.0 86.1373 2200.0 91.0541 100000.0 93.3271 2600.0 96.0446 6400.0 98.0599 30000.0 102.0462 4000.0 104.5537 2300.0 114.7555 2500.0 119.0392 6400.0 119.049 420000.0 119.0592 3700.0 119.0636 3000.0 122.0594 3000.0 124.16 2300.0 126.415 2200.0 129.0332 10000.0 130.0412 82000.0 130.5675 2600.0 132.0567 23000.0 133.0282 4800.0 146.0609 2600.0 147.0244 3300.0 147.044 580000.0 147.0546 3400.0 148.0512 5800.0 149.0233 2800.0 149.0589 2300.0 150.6854 2300.0 157.0397 45000.0 158.4852 2300.0 160.052 7200.0 160.4484 2300.0 161.0232 4800.0 163.0388 27000.0 164.069 2300.0 165.0545 26000.0 173.5261 57000.0 173.5413 40000.0 175.0203 3100.0 175.0391 1600000.0 176.047 74000.0 176.071 15000.0 177.0553 20000.0 178.0625 210000.0 179.0704 30000.0 180.0783 150000.0 181.0496 38000.0 188.0472 8800.0 191.0343 3200.0 194.1441 2700.0 195.0889 5900.0 203.5169 2300.0 204.1403 3300.0 205.0494 14000.0 206.0541 31000.0 207.0448 6900.0 207.0654 1100000.0 207.0849 21000.0 222.0511 2900.0 225.0776 2900.0 232.0974 11000.0 241.8602 2400.0 243.0899 7400.0 244.3784 2700.0 258.1122 29000.0 260.0911 29000.0 274.1078 27000.0 275.1154 130000.0 301.1961 2600.0 303.1068 14000.0 END IONS BEGIN IONS SCANS=359 PEPMASS=207.0655 CHARGE=1 COLLISION_ENERGY=0.0 43.0178 15000.0 43.626 2200.0 45.0334 8100.0 45.7621 2300.0 47.1602 3600.0 48.2659 2200.0 48.5217 2100.0 51.0228 30000.0 51.52 2200.0 52.7145 2600.0 53.002 26000.0 53.0384 2600.0 53.1113 2200.0 54.8576 2300.0 55.0177 25000.0 55.8927 2600.0 57.9346 5600.0 60.0992 3500.0 60.474 2100.0 61.3368 2200.0 62.3013 3800.0 63.023 7500.0 64.0306 6500.0 65.0383 420000.0 65.099 3900.0 66.0461 11000.0 66.6843 2400.0 67.0539 5000.0 68.2229 2600.0 75.4374 2300.0 76.0305 63000.0 77.0383 80000.0 77.9646 2800.0 78.0462 21000.0 79.0539 65000.0 80.0617 74000.0 80.7219 2700.0 83.8379 2300.0 84.9154 2300.0 84.9454 2700.0 85.1585 2400.0 86.8438 4000.0 88.6888 2200.0 89.0327 5300.0 89.0383 290000.0 90.0461 88000.0 91.0466 9000.0 91.054 7300000.0 91.0642 31000.0 91.0651 160000.0 91.0671 22000.0 91.0712 10000.0 93.0333 38000.0 93.0698 4900.0 94.0412 17000.0 95.0488 79000.0 95.0852 6800.0 97.9531 14000.0 98.9611 39000.0 101.0384 140000.0 102.9563 14000.0 103.0539 120000.0 104.0188 3500.0 104.0254 120000.0 105.0333 47000.0 105.0444 18000.0 105.0695 6500.0 106.041 27000.0 106.6398 2600.0 107.0488 130000.0 108.0567 110000.0 108.1304 3400.0 109.0653 2900.0 109.4606 2400.0 110.2562 2400.0 110.9721 2300.0 112.7176 2100.0 115.0173 2500.0 115.955 7900.0 115.9638 370000.0 116.6454 2200.0 116.9716 120000.0 117.0333 140000.0 118.0411 240000.0 119.0381 2700.0 119.0488 4800000.0 119.0572 72000.0 119.7441 2400.0 121.0281 94000.0 121.0372 3400.0 121.0643 9200.0 122.0361 53000.0 122.0473 3800.0 123.0803 9100.0 126.9674 2600.0 129.0227 3900.0 129.0333 240000.0 129.0445 59000.0 129.6956 4100.0 129.9777 2300.0 130.0413 19000.0 131.0489 26000.0 132.0092 15000.0 132.0203 650000.0 133.0282 71000.0 133.0642 2600.0 133.9745 9000.0 134.036 57000.0 135.0438 320000.0 136.0517 210000.0 137.06 7200.0 137.9868 4100.0 145.0282 200000.0 146.0361 220000.0 147.0438 2800000.0 147.0548 10000.0 148.0516 28000.0 149.0106 8300.0 149.0232 590000.0 149.06 9500.0 150.031 58000.0 151.0748 5000.0 155.9965 7000.0 157.0264 11000.0 157.0395 380000.0 157.0529 2100.0 159.8195 2700.0 160.0153 50000.0 162.0311 99000.0 163.0388 78000.0 164.0467 280000.0 173.5274 43000.0 173.5405 11000.0 174.0312 150000.0 175.039 530000.0 175.0551 9400.0 176.0467 19000.0 177.0181 16000.0 178.0264 17000.0 179.0703 390000.0 192.0419 96000.0 192.4723 2900.0 207.0662 34000.0 208.891 2600.0 END IONS BEGIN IONS SCANS=360 PEPMASS=304.1184 CHARGE=1 COLLISION_ENERGY=0.0 48.4502 2200.0 50.0159 2500.0 51.0233 3000.0 51.7657 53000.0 52.7576 5000.0 52.9206 3100.0 53.3639 2600.0 55.018 12000.0 55.9199 2100.0 60.2277 2400.0 60.4778 2400.0 60.5609 2300.0 60.9109 2700.0 64.228 2600.0 65.0385 110000.0 71.1446 2500.0 71.5701 3700.0 71.9835 2200.0 75.0232 2500.0 75.1849 3200.0 76.0314 38000.0 76.5775 4700.0 77.0385 49000.0 77.6285 2300.0 80.062 8200.0 82.2669 2600.0 87.8484 2800.0 87.943 2300.0 88.3873 3300.0 88.4913 2600.0 89.0387 72000.0 90.3075 2100.0 91.0321 2600.0 91.0542 3400000.0 91.0651 10000.0 92.4382 2400.0 95.0489 22000.0 98.0599 400000.0 99.7293 2400.0 101.0387 30000.0 101.8845 2400.0 103.054 150000.0 103.9829 5000.0 104.0257 17000.0 105.0336 45000.0 105.0445 3100.0 107.0124 2700.0 107.0493 25000.0 108.0568 23000.0 108.7783 6100.0 109.065 5700.0 111.6175 2500.0 117.0333 37000.0 118.0414 49000.0 119.0292 43000.0 119.0351 21000.0 119.0492 11000000.0 119.0575 66000.0 119.0675 130000.0 119.0804 3600.0 120.0524 30000.0 121.0286 27000.0 129.0334 100000.0 129.0438 17000.0 129.7225 2200.0 131.049 130000.0 132.0205 170000.0 133.0283 99000.0 135.044 66000.0 136.0521 74000.0 137.0596 3500.0 142.3279 2300.0 145.0283 130000.0 146.0362 47000.0 147.0169 30000.0 147.0438 14000000.0 147.055 79000.0 147.0716 97000.0 148.0477 57000.0 148.229 2700.0 149.0232 120000.0 149.0598 23000.0 149.1314 2400.0 151.0749 4600.0 155.334 2400.0 156.6008 3300.0 157.0293 11000.0 157.0395 1300000.0 157.052 2400.0 157.0552 3100.0 160.0156 53000.0 161.0589 7800.0 162.0308 47000.0 163.0391 31000.0 164.0467 230000.0 171.6096 2600.0 172.5596 3900.0 173.0227 5900.0 173.5257 14000.0 173.5362 66000.0 174.0314 55000.0 175.0027 140000.0 175.0389 31000000.0 175.0531 140000.0 175.0673 30000.0 175.0746 210000.0 175.0851 32000.0 175.0944 18000.0 176.0434 170000.0 177.0546 69000.0 178.0264 8900.0 178.0625 9700.0 179.0527 10000.0 179.0703 910000.0 180.8885 16000.0 189.0549 7000.0 190.8732 3300.0 191.0339 9500.0 192.0417 200000.0 193.0493 17000.0 203.6704 2500.0 207.0191 55000.0 207.0652 15000000.0 207.1108 75000.0 207.1237 8900.0 208.0687 110000.0 208.8831 140000.0 226.8938 110000.0 236.191 2500.0 239.3767 3600.0 244.149 2300.0 276.1185 15000.0 281.15 2500.0 305.3842 2700.0 311.155 2500.0 END IONS BEGIN IONS SCANS=361 PEPMASS=325.1441 CHARGE=1 COLLISION_ENERGY=0.0 49.6554 2600.0 49.9412 2400.0 50.075 2000.0 51.2698 2200.0 51.7231 2400.0 54.3679 2200.0 56.1825 3200.0 58.6506 2200.0 59.0006 2200.0 59.9179 2200.0 67.0361 2500.0 67.9456 2300.0 67.9844 2400.0 72.3683 2900.0 72.8744 2700.0 74.8398 2400.0 77.4731 2300.0 81.0441 2900.0 81.1113 2200.0 86.2786 2500.0 86.4911 2400.0 89.0701 2200.0 90.8117 2100.0 91.0539 2700.0 94.2389 2100.0 95.2583 2100.0 98.3006 2400.0 98.9417 2200.0 100.3262 2400.0 104.9412 2300.0 105.0695 25000.0 108.0577 2500.0 109.3844 2700.0 114.6588 2400.0 125.4742 2300.0 127.9121 2500.0 127.9819 2800.0 129.0694 52000.0 129.6219 2400.0 133.0646 32000.0 135.0438 8400.0 136.0516 58000.0 137.0594 15000.0 145.4498 2700.0 147.6365 2700.0 148.4645 2500.0 149.6872 4400.0 149.6971 3300.0 149.7074 3000.0 151.0751 380000.0 151.0888 2700.0 155.0489 33000.0 156.057 2800.0 158.2028 2400.0 159.0803 64000.0 161.0596 32000.0 163.0754 10000.0 167.4079 2300.0 173.5291 100000.0 173.5413 18000.0 175.0746 2500.0 187.0753 120000.0 188.4244 2600.0 203.0858 7100.0 204.6281 2300.0 218.0737 18000.0 219.0805 22000.0 221.0957 8100.0 231.0803 3500.0 232.0915 3000.0 233.0961 50000.0 234.104 130000.0 235.0758 14000.0 238.2869 2200.0 242.9659 2500.0 246.0652 2400.0 247.0757 13000.0 249.091 11000.0 250.0986 42000.0 251.1066 6500.0 256.0941 2700.0 260.0826 2700.0 261.0916 42000.0 262.0989 99000.0 263.0695 6100.0 263.106 5700.0 263.681 2600.0 265.0894 3900.0 265.1224 320000.0 265.1516 4400.0 267.1023 9400.0 272.1324 2400.0 278.0948 41000.0 279.1019 91000.0 293.118 63000.0 294.1258 78000.0 295.0973 44000.0 296.904 2600.0 303.9229 2300.0 308.9879 2700.0 309.111 7300.0 310.1201 36000.0 311.5187 2200.0 312.3401 2400.0 312.3866 2700.0 318.6327 2400.0 325.1438 22000.0 333.1533 2300.0 END IONS BEGIN IONS SCANS=362 PEPMASS=355.1545 CHARGE=1 COLLISION_ENERGY=0.0 54.0528 2300.0 55.0177 4500.0 55.3256 2900.0 57.1246 2400.0 59.2563 2200.0 59.5005 2300.0 60.7846 2300.0 70.0648 3500.0 72.0805 2800.0 75.0439 3600.0 76.258 2800.0 79.0541 13000.0 80.9572 2300.0 82.1307 2200.0 82.9382 2300.0 83.564 2500.0 90.046 2600.0 90.7316 2400.0 91.054 64000.0 92.999 2500.0 93.0697 4600.0 95.0491 2300.0 103.0542 9200.0 104.062 5100.0 105.0336 2400.0 105.0697 130000.0 106.0414 2800.0 107.0489 78000.0 108.0567 28000.0 109.0643 4400.0 110.7226 2200.0 114.0775 2300.0 115.0541 50000.0 117.0697 22000.0 118.0412 4600.0 119.0853 65000.0 121.0645 27000.0 123.0803 8300.0 124.0519 6300.0 125.0602 2900.0 125.1643 2400.0 126.2872 2400.0 127.5179 2100.0 128.0621 14000.0 129.0696 96000.0 131.0489 32000.0 131.0856 8000.0 132.0567 35000.0 132.9091 2400.0 133.0646 170000.0 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203.0854 19000.0 205.101 18000.0 207.081 6500.0 214.874 8400.0 215.0857 18000.0 218.0728 27000.0 218.8684 5600.0 219.0799 31000.0 220.0883 2600.0 221.0958 8200.0 230.0723 5700.0 231.08 41000.0 232.0877 13000.0 233.0959 99000.0 234.1038 140000.0 235.0757 21000.0 235.1108 9500.0 243.0791 3600.0 244.0884 6600.0 245.0957 35000.0 246.0685 17000.0 246.1035 69000.0 247.0472 2800.0 247.0752 38000.0 247.1127 6500.0 248.0821 2900.0 249.091 23000.0 250.0986 62000.0 251.1066 12000.0 256.0886 2700.0 257.0915 2500.0 259.0746 24000.0 260.0837 12000.0 261.0908 100000.0 262.0984 180000.0 263.0717 16000.0 263.1064 59000.0 264.1133 3600.0 265.0891 3500.0 265.1219 550000.0 265.1558 12000.0 267.1018 14000.0 273.0912 33000.0 274.0987 69000.0 275.0715 14000.0 275.1066 75000.0 276.0767 3100.0 276.1154 3300.0 277.0891 18000.0 277.1222 78000.0 278.0937 70000.0 278.1293 17000.0 279.1015 93000.0 281.1174 16000.0 282.0909 6300.0 289.0866 13000.0 290.0941 40000.0 290.8928 2800.0 291.1016 180000.0 292.1077 7200.0 293.1172 130000.0 294.1249 140000.0 295.0964 59000.0 296.1028 2700.0 305.117 71000.0 306.1248 130000.0 307.0963 36000.0 308.9004 42000.0 309.1114 16000.0 309.1485 11000.0 310.1197 66000.0 314.1125 2600.0 317.3673 3000.0 321.1113 2600.0 322.1191 23000.0 323.1318 3100.0 324.1355 4900.0 325.1434 51000.0 328.0218 2800.0 364.2522 2600.0 END IONS BEGIN IONS SCANS=363 PEPMASS=271.0604 CHARGE=1 COLLISION_ENERGY=0.0 49.4632 2500.0 51.3722 2500.0 67.0174 7000.0 68.9971 6200.0 71.1266 2100.0 82.6472 2600.0 84.8868 2400.0 85.6994 2200.0 87.2548 2400.0 94.0591 2400.0 100.6661 2200.0 119.0487 38000.0 121.028 10000.0 126.9676 2400.0 134.4333 2300.0 145.0283 7400.0 153.0058 3400.0 153.0177 92000.0 160.082 2400.0 163.0388 4600.0 171.0285 19000.0 173.5236 12000.0 173.5405 22000.0 187.0388 2600.0 200.119 3100.0 224.9051 2600.0 225.0544 5800.0 243.0645 3100.0 269.7808 2500.0 271.0252 4600.0 271.06 1600000.0 271.1286 7100.0 END IONS BEGIN IONS SCANS=364 PEPMASS=292.155 CHARGE=1 COLLISION_ENERGY=0.0 49.4264 2200.0 50.5584 2500.0 51.6664 2300.0 51.7672 2700.0 54.2156 2300.0 56.3775 2100.0 56.7684 2300.0 58.805 2500.0 59.6924 2300.0 60.1001 2100.0 60.7323 2500.0 61.1228 2700.0 66.1976 2700.0 67.0541 2400.0 67.8543 2400.0 69.0697 210000.0 70.065 5400.0 74.5719 2500.0 79.8014 2200.0 84.0806 52000.0 85.0619 2100.0 85.3982 2400.0 86.0903 3500.0 86.0962 540000.0 86.1026 3800.0 88.1818 2300.0 91.0541 170000.0 103.0537 6900.0 105.2605 2200.0 105.3254 2100.0 112.0755 180000.0 112.6572 2300.0 114.1111 2600.0 119.039 4900.0 119.0491 720000.0 119.0563 3100.0 119.0592 7500.0 125.24 2900.0 131.0486 4200.0 132.0208 2700.0 133.0292 2600.0 136.0066 2500.0 140.196 2500.0 141.7226 2300.0 147.0439 960000.0 149.0591 2600.0 151.5681 2700.0 153.1555 2400.0 154.5279 2500.0 157.0397 83000.0 164.0467 7100.0 167.0699 6900.0 173.5254 13000.0 173.536 54000.0 175.039 3000000.0 175.0742 9400.0 176.0478 2800.0 179.0701 40000.0 180.1549 2300.0 192.042 62000.0 204.028 2700.0 207.0197 3100.0 207.0653 2500000.0 207.1106 3700.0 222.1037 2500.0 251.2592 2400.0 280.4131 2400.0 282.5216 2500.0 292.0713 8000.0 292.1542 10000.0 END IONS BEGIN IONS SCANS=365 PEPMASS=262.1441 CHARGE=1 COLLISION_ENERGY=0.0 45.1596 2200.0 47.8606 2200.0 49.6561 2400.0 55.0433 2200.0 56.6231 2200.0 56.9639 2300.0 58.3066 2400.0 59.6155 2300.0 61.304 2800.0 61.3382 2600.0 61.9591 2300.0 67.888 2100.0 69.0696 110000.0 69.7788 2400.0 70.0649 4400.0 72.9954 2500.0 84.0805 30000.0 86.0961 150000.0 89.0384 14000.0 100.8866 2600.0 106.2384 2300.0 112.0754 110000.0 114.3535 2400.0 117.0333 74000.0 119.5998 2200.0 135.0441 5700.0 138.4687 2300.0 145.0282 700000.0 145.0393 7600.0 149.0596 36000.0 149.223 2400.0 150.285 2500.0 153.4618 2400.0 163.0388 9500.0 173.5266 29000.0 173.5426 9000.0 174.7217 2800.0 177.0548 1100000.0 178.4462 2300.0 186.0553 5300.0 186.6136 2400.0 189.8034 2700.0 191.1036 2300.0 262.1442 63000.0 END IONS BEGIN IONS SCANS=366 PEPMASS=341.1389 CHARGE=1 COLLISION_ENERGY=0.0 55.0537 2500.0 56.2096 2100.0 62.406 2200.0 65.7784 2600.0 71.0489 32000.0 72.5176 2400.0 77.593 2300.0 79.0545 2300.0 81.0701 3100.0 82.5559 2200.0 91.0539 3800.0 94.0413 2900.0 94.3678 2300.0 99.6931 2400.0 107.0496 2900.0 109.0647 14000.0 119.7133 2600.0 122.0362 14000.0 122.6928 2400.0 123.0432 2900.0 125.059 8800.0 129.0697 30000.0 131.0491 13000.0 131.0856 2600.0 131.8613 2600.0 133.0282 46000.0 137.0595 650000.0 137.0695 2800.0 143.0491 12000.0 143.086 4100.0 144.0571 7200.0 145.0651 5600.0 149.0595 26000.0 151.0385 13000.0 151.0752 52000.0 157.0645 43000.0 160.0519 18000.0 161.0598 17000.0 161.0958 2900.0 163.0757 18000.0 165.0546 30000.0 169.3563 2700.0 172.0523 7100.0 173.5314 73000.0 174.0676 53000.0 175.0754 110000.0 176.0831 6400.0 177.0547 39000.0 177.0912 16000.0 178.1992 2400.0 179.0703 24000.0 183.2585 2700.0 187.0753 320000.0 187.095 4300.0 188.0831 11000.0 189.0909 97000.0 191.0687 3100.0 196.0529 3500.0 199.0753 32000.0 203.0856 57000.0 205.0859 8500.0 211.0753 120000.0 211.0961 3600.0 212.0828 3700.0 213.0896 2600.0 217.086 74000.0 219.0805 41000.0 220.0888 8800.0 221.0964 3900.0 225.0915 7600.0 227.0702 24000.0 228.0781 8100.0 231.0804 130000.0 232.0885 20000.0 233.0956 8600.0 237.0905 5900.0 239.0701 130000.0 239.2848 2300.0 240.078 94000.0 241.0862 30000.0 243.1026 13000.0 245.098 3800.0 247.0756 47000.0 248.083 120000.0 249.0906 17000.0 251.1062 44000.0 253.0876 3000.0 253.1236 6900.0 254.0936 3800.0 255.0648 120000.0 256.0727 95000.0 259.0752 54000.0 260.083 33000.0 261.0899 26000.0 262.0976 6500.0 263.0749 2400.0 263.1064 190000.0 263.9187 2500.0 264.0778 27000.0 265.0858 31000.0 268.0734 16000.0 269.0814 4300.0 270.0549 4400.0 270.0885 400000.0 270.123 3100.0 271.0636 3300.0 271.0964 190000.0 276.0783 140000.0 277.0861 55000.0 279.1019 110000.0 280.11 23000.0 281.0818 15000.0 281.1168 8900.0 282.0888 3500.0 283.0966 110000.0 283.1285 4100.0 290.0931 9100.0 291.1017 360000.0 292.1092 53000.0 293.0811 65000.0 294.0886 12000.0 295.0976 8700.0 296.1047 80000.0 297.112 22000.0 305.1161 22000.0 307.097 7100.0 308.1041 76000.0 311.1282 16000.0 323.1275 46000.0 342.3858 2400.0 END IONS BEGIN IONS SCANS=367 PEPMASS=326.1006 CHARGE=1 COLLISION_ENERGY=0.0 49.6342 2900.0 52.5462 2300.0 52.5946 2500.0 53.3046 2100.0 53.7681 2500.0 54.8921 2400.0 56.3631 3000.0 57.2522 2100.0 58.8825 2200.0 59.3613 2200.0 60.024 2400.0 60.6071 2500.0 63.7603 2400.0 66.1048 2600.0 67.3697 2300.0 67.8808 2100.0 70.4414 2400.0 76.3572 2300.0 86.0962 4100.0 90.374 2500.0 91.0542 3600.0 96.3688 2900.0 118.2078 2400.0 120.1182 2300.0 120.8873 2600.0 122.8808 2200.0 125.221 2400.0 126.8323 2600.0 131.0492 3800.0 132.0515 6200.0 133.0636 2700.0 134.0686 6800.0 135.0442 16000.0 136.0478 4700.0 137.0596 6300.0 138.0624 3000.0 138.0821 2700.0 148.5722 2400.0 149.688 8900.0 164.9702 2200.0 173.5237 25000.0 173.538 58000.0 174.8524 2400.0 178.7276 2500.0 198.7485 3000.0 233.8984 6500.0 236.6215 2200.0 238.876 2600.0 262.0975 2500.0 263.6006 3200.0 310.7369 2900.0 313.5652 2500.0 326.1016 2900.0 END IONS BEGIN IONS SCANS=368 PEPMASS=207.0656 CHARGE=1 COLLISION_ENERGY=0.0 41.0834 2600.0 41.607 2200.0 42.7031 2200.0 42.8012 2300.0 43.0178 5300.0 43.402 2700.0 44.4629 2400.0 44.9298 2400.0 45.0334 12000.0 45.4263 2500.0 45.5921 2100.0 46.8451 2600.0 47.1693 2500.0 48.9755 2300.0 52.2439 2400.0 52.7167 2400.0 54.9151 2300.0 55.0177 2500.0 55.0543 2100.0 57.9347 15000.0 58.0443 2200.0 58.354 2600.0 60.8936 2800.0 62.3356 2400.0 63.548 2300.0 65.0383 89000.0 69.8656 2700.0 72.1792 2100.0 73.0277 3400.0 74.9377 5600.0 76.0306 35000.0 77.0385 2400.0 78.0459 5100.0 79.0541 16000.0 80.0618 18000.0 83.0348 2300.0 83.0648 2200.0 83.3936 2700.0 84.9454 21000.0 87.1358 2600.0 89.0384 58000.0 89.0474 2300.0 90.0462 40000.0 91.054 990000.0 91.0608 5700.0 91.0638 3300.0 93.0332 5500.0 94.0415 7300.0 94.3595 2500.0 95.0487 18000.0 95.0851 5800.0 95.5979 2500.0 97.1903 2200.0 97.2974 2200.0 97.9539 3700.0 98.8623 2300.0 98.9613 36000.0 101.0376 2700.0 102.201 2700.0 102.956 39000.0 103.0539 13000.0 104.0253 110000.0 105.033 10000.0 106.0416 2400.0 107.0125 5500.0 107.0489 24000.0 108.0567 35000.0 108.8164 2200.0 114.9702 9100.0 115.1858 2400.0 115.9551 17000.0 115.9638 670000.0 116.8122 2400.0 116.9646 2800.0 116.9715 270000.0 117.0333 31000.0 118.041 120000.0 119.0393 12000.0 119.0489 710000.0 119.0591 6600.0 121.0281 86000.0 121.0645 18000.0 122.036 58000.0 126.9673 6100.0 129.0335 20000.0 129.9253 2500.0 130.0414 3500.0 131.7376 2400.0 132.0203 220000.0 133.0282 34000.0 133.9746 58000.0 134.0359 31000.0 135.0439 95000.0 136.0516 89000.0 137.9872 2500.0 145.0281 48000.0 146.036 140000.0 146.3251 2400.0 147.0438 590000.0 147.057 4700.0 148.0516 35000.0 149.0231 190000.0 150.0309 57000.0 150.6754 2300.0 151.0751 28000.0 155.9968 17000.0 157.0396 26000.0 158.4371 2800.0 160.0153 240000.0 162.031 110000.0 163.0388 66000.0 164.0466 190000.0 173.5287 67000.0 173.5415 22000.0 174.0312 51000.0 174.0483 2700.0 175.039 130000.0 176.0473 6400.0 177.0182 7800.0 178.0259 72000.0 179.0702 110000.0 182.0338 2400.0 185.39 2600.0 192.0416 45000.0 207.0652 6300.0 207.1392 2600.0 213.8795 2400.0 216.4771 2500.0 END IONS BEGIN IONS SCANS=369 PEPMASS=304.1186 CHARGE=1 COLLISION_ENERGY=0.0 48.633 2300.0 48.9736 2200.0 51.0326 2300.0 52.9779 2500.0 53.2022 2500.0 53.8098 2300.0 54.2511 2000.0 54.7943 2300.0 55.0705 2300.0 55.5773 2300.0 57.1463 2100.0 57.4336 2400.0 60.2156 2600.0 65.0388 2600.0 65.373 2900.0 65.5393 2200.0 65.792 2200.0 67.8124 2500.0 69.4741 2200.0 70.0338 2400.0 70.6001 2700.0 70.8153 2100.0 70.8819 2700.0 73.2773 2100.0 74.4616 2300.0 76.7121 2800.0 77.0388 2600.0 77.372 2300.0 79.5244 2300.0 80.4773 2700.0 80.8556 2800.0 85.6346 2300.0 85.7099 2500.0 88.2795 2500.0 88.4876 2500.0 90.0462 2200.0 90.7078 2500.0 91.0072 2400.0 91.054 360000.0 92.7396 2500.0 94.0407 2900.0 95.0493 2500.0 97.9611 2300.0 98.0598 180000.0 101.6927 2300.0 101.7305 2300.0 103.0542 18000.0 103.8009 2300.0 104.0253 9900.0 105.5568 2200.0 106.4819 2400.0 107.0126 2700.0 108.7093 2400.0 117.0334 5700.0 118.0411 5900.0 118.081 2600.0 119.0393 9600.0 119.0489 980000.0 119.0563 3700.0 119.0592 23000.0 121.0283 17000.0 122.0363 2500.0 124.8759 2300.0 129.0335 16000.0 132.0205 50000.0 132.7117 2100.0 133.0284 42000.0 133.065 3200.0 134.0365 5700.0 135.0442 4300.0 136.0521 6000.0 140.1956 2400.0 144.5055 2600.0 145.0283 68000.0 145.5869 2500.0 146.0361 27000.0 147.0438 1500000.0 147.0547 2400.0 148.0517 22000.0 149.0236 24000.0 149.0593 7000.0 150.0311 3600.0 151.0752 44000.0 157.0395 72000.0 157.7851 2400.0 160.0153 320000.0 161.0233 18000.0 162.0309 69000.0 163.0394 10000.0 164.0465 110000.0 164.8164 2800.0 173.5205 13000.0 173.5352 100000.0 174.0311 13000.0 175.0389 4200000.0 175.053 16000.0 175.0741 13000.0 176.0464 42000.0 177.0547 7600.0 178.0259 100000.0 179.0526 3500.0 179.0702 460000.0 180.8882 42000.0 181.1928 2300.0 184.0505 2900.0 190.8729 6700.0 192.0415 210000.0 193.0494 150000.0 201.2515 2400.0 202.1462 2600.0 204.2671 2500.0 207.0651 2700000.0 208.8828 190000.0 223.9633 2400.0 226.8935 140000.0 236.1299 2400.0 239.4833 2300.0 244.9993 2300.0 250.6964 2600.0 295.0185 2700.0 END IONS BEGIN IONS SCANS=370 PEPMASS=817.3925 CHARGE=1 COLLISION_ENERGY=0.0 72.0805 85000.0 72.3169 2600.0 78.2532 2400.0 78.8165 2000.0 78.8444 2800.0 83.7567 2500.0 87.5835 2600.0 91.9558 2400.0 94.7487 2300.0 94.906 2300.0 96.6049 2100.0 96.6998 2100.0 97.0757 23000.0 100.8767 2200.0 103.2123 2500.0 107.6285 2400.0 115.0862 130000.0 118.0644 9400.0 118.4597 2300.0 120.0062 2400.0 120.0804 650000.0 120.0908 5700.0 125.0706 99000.0 127.1812 2600.0 132.6114 2400.0 136.0755 22000.0 141.1074 2200.0 146.0597 160000.0 157.9588 2500.0 164.0705 38000.0 165.0539 2500.0 166.2442 2400.0 172.1119 140000.0 173.5188 5500.0 173.5262 120000.0 173.5397 100000.0 173.5595 2900.0 174.0547 3400.0 176.575 2500.0 178.9335 2200.0 181.7436 2300.0 182.0812 45000.0 183.7961 2400.0 187.1227 4600.0 210.4335 2600.0 213.7599 3000.0 215.1182 27000.0 215.5921 2300.0 216.1257 220000.0 217.1335 130000.0 218.3157 2500.0 219.1492 210000.0 222.4129 2300.0 230.9083 2500.0 234.6483 2500.0 236.1071 34000.0 238.1231 3200.0 240.8219 2300.0 243.1127 160000.0 245.1279 2600.0 247.1441 66000.0 248.2709 2500.0 249.3286 2100.0 249.7784 2400.0 258.9864 2600.0 261.4822 2500.0 265.086 9700.0 265.1333 44000.0 270.1129 5800.0 277.1336 39000.0 281.4485 2400.0 282.113 95000.0 288.7039 2500.0 293.1283 100000.0 300.7679 2400.0 309.1236 120000.0 321.1249 7200.0 329.15 64000.0 339.1355 5300.0 355.1292 66000.0 372.1725 4100.0 377.6888 2800.0 389.5153 2800.0 390.1815 68000.0 391.8868 2600.0 396.1969 5700.0 417.182 91000.0 429.181 52000.0 433.4802 2400.0 446.2092 4200.0 450.0389 2400.0 458.2078 29000.0 465.4306 2500.0 469.0143 2500.0 474.2012 28000.0 489.6938 2400.0 496.4499 2800.0 497.6633 2600.0 502.1977 290000.0 502.3789 2600.0 543.2617 62000.0 553.2457 21000.0 571.2565 27000.0 591.4986 3700.0 670.5769 2700.0 740.2322 2600.0 754.6219 2800.0 766.4645 2600.0 END IONS BEGIN IONS SCANS=371 PEPMASS=288.1236 CHARGE=1 COLLISION_ENERGY=0.0 47.7667 96000.0 47.7688 17000.0 48.5363 2200.0 53.0023 2700.0 55.0179 14000.0 55.7566 2600.0 56.6864 2100.0 57.7544 2900.0 59.2382 2100.0 59.9195 2100.0 65.0387 3100.0 68.8068 2500.0 69.2916 2100.0 72.8175 2200.0 77.0392 9000.0 78.6623 2900.0 79.0541 100000.0 79.3186 2300.0 79.5113 2400.0 89.039 14000.0 90.0465 12000.0 91.0542 110000.0 92.062 20000.0 93.2894 2500.0 94.1978 3700.0 95.0491 25000.0 95.6789 2500.0 98.06 77000.0 98.8762 3000.0 100.3736 2500.0 101.3351 2800.0 102.047 24000.0 102.6104 2700.0 103.0541 220000.0 103.0615 2300.0 105.0335 61000.0 105.0698 320000.0 107.0492 9100.0 107.3987 2900.0 110.0218 2100.0 115.0542 37000.0 117.0334 16000.0 117.0701 4400.0 118.0413 55000.0 119.049 190000.0 120.0569 150000.0 121.0649 6600.0 127.4061 3400.0 130.041 23000.0 131.0492 39000.0 132.0455 3300.0 132.0569 360000.0 132.0685 8500.0 133.0283 140000.0 133.0647 350000.0 135.0803 120000.0 137.0599 7200.0 143.0606 10000.0 146.0363 87000.0 147.0441 150000.0 148.0518 1300000.0 148.0652 4900.0 158.0365 6900.0 159.0441 18000.0 160.0398 2200.0 160.0519 690000.0 160.0667 4500.0 161.0597 200000.0 163.0433 47000.0 163.0504 11000.0 163.0753 6000000.0 163.1073 26000.0 173.0594 10000.0 173.525 14000.0 173.5309 47000.0 173.5423 15000.0 173.9314 2500.0 176.0289 4400.0 176.047 800000.0 176.0647 3800.0 178.0876 3600.0 190.915 3800.0 191.0178 15000.0 191.0293 160000.0 191.0379 73000.0 191.0702 27000000.0 191.1019 100000.0 191.1114 180000.0 191.123 63000.0 191.1345 33000.0 191.1455 8900.0 192.0733 27000.0 226.5506 2400.0 246.1135 13000.0 256.3578 3400.0 287.9934 2900.0 294.3731 2700.0 END IONS BEGIN IONS SCANS=372 PEPMASS=333.1814 CHARGE=1 COLLISION_ENERGY=0.0 54.1663 2100.0 56.345 2500.0 65.4677 2300.0 69.4984 2300.0 78.9769 2300.0 87.9058 2600.0 90.494 2700.0 97.1174 2600.0 98.06 9200.0 100.9936 2500.0 101.8991 2200.0 103.054 3300.0 105.0696 14000.0 108.4807 2300.0 111.0092 2400.0 119.0487 2600.0 120.0567 3400.0 129.6854 2700.0 132.0567 6500.0 133.0646 17000.0 135.0806 5800.0 135.4077 2700.0 147.0431 4000.0 147.5118 2500.0 148.0514 62000.0 153.5185 2400.0 155.3859 2800.0 156.6935 2300.0 159.985 2600.0 160.0516 47000.0 161.0597 11000.0 163.0752 380000.0 163.0898 5200.0 173.5239 58000.0 173.5342 41000.0 173.5437 36000.0 176.0467 65000.0 191.0289 10000.0 191.0701 6900000.0 191.0857 23000.0 191.1017 11000.0 191.1111 36000.0 194.3326 2400.0 199.2266 2400.0 228.8761 12000.0 230.1275 2500.0 234.0649 2400.0 264.8114 2500.0 268.6578 2400.0 273.23 3300.0 286.8587 2700.0 298.4527 2200.0 330.6624 2900.0 END IONS BEGIN IONS SCANS=373 PEPMASS=310.1056 CHARGE=1 COLLISION_ENERGY=0.0 49.4338 2000.0 54.9309 2200.0 58.4139 2300.0 73.0282 2900.0 74.5549 2100.0 75.753 3000.0 77.8686 2900.0 79.8749 2500.0 88.2425 2300.0 88.7537 2600.0 92.556 2400.0 93.0702 2900.0 95.6981 2400.0 101.3768 2900.0 109.4398 2500.0 112.5432 2400.0 120.0337 2900.0 120.0417 130000.0 125.1018 3000.0 144.3583 2700.0 148.0505 2800.0 168.8233 2500.0 173.526 20000.0 173.5358 27000.0 173.544 7000.0 190.5068 2500.0 191.0701 61000.0 199.3271 3000.0 217.6597 2400.0 219.8335 2200.0 222.6232 2200.0 228.9855 2300.0 231.9217 2300.0 241.1103 4500.0 250.7983 2300.0 250.8741 2700.0 252.1733 2600.0 254.2963 2400.0 280.7161 2600.0 302.3255 2400.0 310.1055 93000.0 END IONS BEGIN IONS SCANS=374 PEPMASS=597.2217 CHARGE=1 COLLISION_ENERGY=0.0 75.3085 2600.0 80.3049 2600.0 99.1469 2400.0 101.0954 2700.0 101.1445 2700.0 105.6455 2700.0 114.9495 2200.0 120.0415 20000.0 134.4387 2400.0 137.1543 2500.0 145.6323 2600.0 149.6844 5700.0 173.5236 2700.0 173.534 58000.0 187.9825 2800.0 191.0987 2300.0 252.6109 2300.0 310.0628 5400.0 310.105 870000.0 314.4269 3000.0 462.7966 2600.0 510.0106 2400.0 END IONS BEGIN IONS SCANS=375 PEPMASS=403.1759 CHARGE=1 COLLISION_ENERGY=0.0 55.0178 3000.0 55.0538 2800.0 55.3637 2800.0 55.591 2200.0 57.1593 2200.0 57.6603 2400.0 63.4999 2400.0 65.0389 2100.0 66.8657 2200.0 68.2745 2200.0 70.0778 2500.0 72.2075 2300.0 72.9382 2300.0 74.7943 2600.0 79.0542 19000.0 79.8733 2100.0 80.0614 2400.0 81.0334 2000000.0 81.038 9300.0 81.0701 2600.0 81.8281 2300.0 82.2027 2200.0 84.0786 3300.0 87.9496 2700.0 88.6377 2600.0 90.21 2200.0 91.0544 14000.0 95.0491 10000.0 96.1769 2300.0 97.727 2500.0 103.002 2500.0 104.5387 2200.0 105.0443 2900.0 106.7701 3100.0 107.0489 13000.0 109.0644 6800.0 117.0701 2500.0 119.0141 2600.0 121.0648 36000.0 121.6321 2700.0 122.0359 12000.0 123.5267 2200.0 123.8202 2800.0 125.8659 2200.0 126.1567 2700.0 127.0393 3100.0 129.07 4000.0 135.0434 2600.0 136.0518 170000.0 137.0596 35000.0 138.0673 6500.0 139.0751 83000.0 140.2473 2200.0 140.4349 2300.0 143.0851 13000.0 145.0649 17000.0 146.0726 13000.0 147.0803 17000.0 147.9903 2400.0 148.8617 2800.0 149.06 19000.0 151.0604 3900.0 151.0646 3500.0 151.0752 1700000.0 151.0892 11000.0 155.07 68000.0 157.0644 2900.0 158.0725 22000.0 159.0802 28000.0 160.0889 8400.0 161.0595 37000.0 161.096 250000.0 163.0754 3000.0 164.0465 2700.0 165.0223 4100.0 165.0546 3700000.0 165.067 3900.0 165.0882 18000.0 167.0704 59000.0 167.1341 2300.0 168.1918 2400.0 171.0805 6100.0 172.0883 200000.0 173.0597 19000.0 173.5259 15000.0 173.5344 110000.0 173.5444 6000.0 174.0678 49000.0 175.0755 68000.0 175.1121 2800.0 175.3183 2500.0 176.0817 3300.0 177.091 37000.0 177.3208 2300.0 179.0702 130000.0 181.0859 3100.0 186.0676 39000.0 188.083 200000.0 189.0909 240000.0 189.1108 4500.0 190.0621 35000.0 191.0702 16000.0 191.1065 96000.0 195.0646 3400.0 198.0661 3900.0 201.091 87000.0 202.062 34000.0 202.0988 18000.0 203.0724 17000.0 203.1066 390000.0 204.0779 13000.0 205.086 240000.0 214.0628 8700.0 217.0613 6700.0 217.0858 940000.0 217.1105 14000.0 219.1016 92000.0 224.9516 2300.0 229.0859 120000.0 231.9662 2800.0 235.0975 7000.0 243.6152 2400.0 247.0963 94000.0 271.0965 19000.0 274.7761 2600.0 275.1068 4000.0 277.0859 2600.0 283.0965 13000.0 284.1025 2500.0 291.1014 15000.0 292.1095 28000.0 293.1175 33000.0 294.1267 2600.0 299.0915 91000.0 303.1012 17000.0 304.1104 8400.0 305.1177 42000.0 306.1247 33000.0 307.0952 3000.0 307.1336 2600.0 308.1053 5500.0 308.1413 55000.0 309.1125 18000.0 310.1199 16000.0 312.1357 14000.0 312.2518 2500.0 313.1069 85000.0 313.1432 3900.0 314.1149 540000.0 315.1194 2900.0 318.1244 48000.0 319.0957 15000.0 320.1041 3400.0 321.1127 42000.0 322.1191 6900.0 323.1267 21000.0 324.1356 180000.0 325.1051 3200.0 325.144 16000.0 327.1601 7700.0 334.1202 20000.0 335.1275 36000.0 336.1354 72000.0 337.1041 10000.0 337.1436 59000.0 337.6057 3100.0 339.1597 17000.0 340.1301 84000.0 349.1431 64000.0 352.1295 23000.0 354.147 22000.0 355.1533 47000.0 367.153 18000.0 END IONS BEGIN IONS SCANS=376 PEPMASS=448.2337 CHARGE=1 COLLISION_ENERGY=0.0 62.2914 2100.0 68.1861 2300.0 81.0331 250000.0 81.0389 4300.0 97.4606 2600.0 107.5782 2600.0 107.9335 2300.0 125.2783 2400.0 136.0518 8300.0 137.5106 2100.0 138.9126 2300.0 139.0759 3200.0 151.0751 250000.0 157.781 2600.0 161.0959 33000.0 165.0545 370000.0 165.0701 5500.0 167.0702 5100.0 172.0882 14000.0 173.5215 9400.0 173.5347 66000.0 175.0758 3800.0 179.0709 21000.0 188.0833 16000.0 189.0909 21000.0 191.1068 8300.0 201.0899 7800.0 203.1068 79000.0 205.086 28000.0 217.086 120000.0 217.1077 3700.0 219.1015 37000.0 229.0856 18000.0 231.1733 2400.0 235.0963 3500.0 247.0964 31000.0 251.3038 3300.0 312.1368 2900.0 313.1076 2900.0 314.1146 57000.0 324.1354 16000.0 335.1293 3700.0 336.1356 2500.0 337.144 4800.0 339.1591 5300.0 340.134 2500.0 349.1424 13000.0 355.1538 22000.0 367.1517 4600.0 END IONS BEGIN IONS SCANS=377 PEPMASS=219.102 CHARGE=1 COLLISION_ENERGY=0.0 43.0178 12000.0 43.2266 2300.0 44.306 2500.0 45.0335 5400.0 45.768 2200.0 45.823 2100.0 47.91 2200.0 47.9522 2900.0 48.0309 2200.0 48.2129 2400.0 48.7421 2500.0 49.3627 2100.0 51.0479 2400.0 51.559 2700.0 52.3898 2500.0 55.1382 2300.0 55.9341 30000.0 56.6835 2500.0 56.9348 2400.0 57.0334 20000.0 59.7176 2900.0 61.5548 2300.0 61.8399 2300.0 65.1483 2200.0 65.4644 2400.0 67.0541 15000.0 71.5316 2400.0 72.7044 2800.0 74.0248 2400.0 74.4648 2400.0 80.1208 2300.0 81.0332 12000.0 83.2669 2700.0 84.6706 2200.0 85.1419 2300.0 86.454 2600.0 86.6676 2600.0 91.0539 160000.0 92.1245 2400.0 92.3536 2400.0 93.0697 3300.0 93.0942 2300.0 94.3477 2500.0 95.669 2300.0 101.2464 2300.0 103.0544 26000.0 105.0695 16000.0 115.0541 120000.0 116.0619 42000.0 117.0696 44000.0 119.0855 6800.0 120.2918 2500.0 121.1008 2700.0 123.4537 2500.0 124.0336 2900.0 127.8521 2500.0 128.0619 130000.0 128.9506 11000.0 129.0697 750000.0 129.0816 3200.0 130.0777 43000.0 131.049 110000.0 131.0585 2200.0 131.0747 7400.0 131.0853 650000.0 131.0966 4300.0 133.1008 7100.0 135.6893 3000.0 135.9447 2900.0 136.0849 2300.0 137.0596 73000.0 140.0625 3000.0 141.0571 3900.0 141.0697 660000.0 142.0774 6800.0 143.0492 23000.0 143.0854 39000.0 144.0569 100000.0 145.0646 96000.0 146.0725 83000.0 148.0518 11000.0 149.5484 2700.0 149.6879 11000.0 151.0757 6400.0 153.0689 3400.0 155.0612 3500.0 155.085 2500.0 156.0564 7400.0 157.0646 310000.0 157.0789 5200.0 158.0726 390000.0 158.0873 4500.0 159.0439 37000.0 159.0804 250000.0 159.0958 4400.0 159.3424 2900.0 160.0519 88000.0 161.0596 22000.0 161.096 58000.0 163.0754 24000.0 163.9802 2400.0 164.7654 2800.0 168.0571 13000.0 169.0647 200000.0 170.0728 130000.0 170.5052 2600.0 171.0449 2900.0 171.0806 11000.0 173.0599 79000.0 173.0963 10000.0 173.5233 5600.0 173.5311 110000.0 173.5413 15000.0 174.0498 14000.0 174.0676 1400000.0 174.0852 13000.0 175.0194 2300.0 175.0756 130000.0 181.6154 2300.0 183.0809 5200.0 185.0588 8500.0 186.0676 350000.0 187.0748 7000.0 188.0833 82000.0 189.0911 620000.0 189.1108 11000.0 191.0706 9500.0 191.1064 5400.0 192.5181 2200.0 195.9437 2700.0 201.091 310000.0 202.219 3100.0 203.1434 29000.0 206.1606 2300.0 206.8612 3000.0 211.9441 2800.0 219.102 35000.0 219.1742 37000.0 END IONS BEGIN IONS SCANS=378 PEPMASS=363.1917 CHARGE=1 COLLISION_ENERGY=0.0 51.8203 2200.0 52.3305 2400.0 52.8298 2100.0 53.9746 2100.0 55.2682 9300.0 55.2703 160000.0 55.3962 2300.0 55.5456 2300.0 56.3397 2100.0 56.9465 2000.0 57.3988 2400.0 58.7806 2800.0 59.3167 2400.0 59.4822 2100.0 60.6534 2300.0 61.9387 2200.0 63.5308 2200.0 63.5479 2700.0 65.0849 2400.0 66.8534 2100.0 68.1353 3000.0 71.5048 2600.0 71.9737 2000.0 75.3476 2700.0 76.8605 2500.0 77.5116 2600.0 81.2918 2500.0 82.4992 2400.0 84.6129 2700.0 85.8376 2500.0 86.2876 2400.0 86.4746 2700.0 88.1579 2200.0 88.4618 2400.0 91.0549 2400.0 92.1261 2300.0 94.82 2500.0 95.7111 2100.0 95.8549 2200.0 96.8323 2200.0 98.0543 3200.0 98.0599 250000.0 98.2282 2300.0 100.6527 2300.0 103.054 2600.0 105.07 4500.0 109.0824 2300.0 109.4553 2200.0 111.0495 3500.0 115.0528 2600.0 115.5218 2900.0 118.0413 3100.0 118.8621 2300.0 119.0487 13000.0 119.6706 2800.0 120.446 3000.0 122.0493 2500.0 127.4205 2300.0 127.5669 2300.0 127.7535 3000.0 130.0412 19000.0 130.2559 2500.0 131.0493 8300.0 132.0571 6300.0 133.0305 2200.0 133.0649 53000.0 133.6557 2800.0 134.8226 2400.0 135.0444 24000.0 138.0623 2400.0 138.9653 2700.0 143.8658 2500.0 144.2828 2800.0 145.776 2300.0 147.0441 160000.0 148.0516 2700.0 149.0598 11000.0 150.0675 23000.0 155.4127 2200.0 160.0519 38000.0 161.0596 100000.0 162.0675 770000.0 162.0832 8600.0 163.039 140000.0 163.0752 110000.0 165.0917 34000.0 165.192 2300.0 167.0701 22000.0 168.3163 2200.0 169.7234 3200.0 172.2128 2300.0 173.5235 8500.0 173.5328 120000.0 173.5415 18000.0 174.0312 67000.0 175.0391 110000.0 176.047 140000.0 177.0548 140000.0 177.071 2400.0 178.0626 570000.0 178.3077 2700.0 178.5753 2900.0 178.5848 2600.0 179.1389 2700.0 181.5943 2600.0 188.0468 57000.0 189.0369 8000.0 189.0547 580000.0 189.0721 2900.0 190.022 3900.0 190.0426 4500.0 190.0624 5400000.0 190.0795 42000.0 191.014 17000.0 191.0339 940000.0 191.0702 480000.0 192.0413 44000.0 193.0649 7300.0 193.086 4600000.0 204.9375 2600.0 205.0497 19000.0 206.0344 27000.0 206.0575 2200000.0 206.0802 21000.0 214.1625 2700.0 215.1209 3000.0 216.546 2400.0 220.9741 3700.0 220.9877 4200.0 221.0021 3800.0 221.0155 32000.0 221.0301 270000.0 221.0406 160000.0 221.0809 44000000.0 221.0999 290000.0 221.1201 210000.0 221.1319 300000.0 221.1464 110000.0 221.1605 15000.0 221.1742 5400.0 221.2185 3000.0 226.6671 2300.0 232.5295 2500.0 247.1748 2200.0 255.4262 2700.0 270.127 3300.0 276.1206 4200.0 289.6578 2500.0 291.0976 2300.0 296.6392 2700.0 317.5465 2800.0 330.8629 2500.0 332.3331 2600.0 332.9954 2600.0 349.9943 2800.0 END IONS BEGIN IONS SCANS=379 PEPMASS=356.0898 CHARGE=1 COLLISION_ENERGY=0.0 58.8133 2300.0 60.7576 2200.0 62.3498 2400.0 64.3278 2300.0 70.205 2700.0 73.7983 2200.0 81.1371 2300.0 81.6448 2200.0 81.6874 2400.0 90.8777 2100.0 121.7889 2300.0 123.1827 2400.0 136.8218 2700.0 142.4376 2300.0 149.6846 4800.0 149.6948 3400.0 153.0936 2500.0 158.4981 2400.0 164.0692 2400.0 173.5256 37000.0 173.54 25000.0 195.4477 2500.0 220.8724 2300.0 280.2412 2500.0 309.901 3900.0 312.8931 2700.0 322.5323 2600.0 325.575 2900.0 328.6613 2400.0 END IONS BEGIN IONS SCANS=380 PEPMASS=206.0577 CHARGE=1 COLLISION_ENERGY=0.0 43.5453 2500.0 43.7969 2200.0 45.0334 8300.0 49.5665 2200.0 51.9975 2600.0 52.8893 2400.0 55.9342 3000.0 60.3137 2000.0 62.1796 2100.0 63.164 2700.0 63.6538 2100.0 73.0282 59000.0 75.3369 2100.0 77.037 2100.0 78.046 4100.0 79.054 9300.0 88.0752 2500.0 91.0538 9400.0 98.5197 2400.0 102.0462 7700.0 103.054 4200.0 104.062 6200.0 107.0489 42000.0 108.2958 2200.0 110.1237 2300.0 117.0329 3200.0 118.0411 5200.0 118.9624 2700.0 119.0491 5200.0 120.0206 3700.0 120.0569 4900.0 121.0646 13000.0 124.9601 2400.0 130.0412 16000.0 131.049 15000.0 132.0566 5000.0 133.028 15000.0 135.0224 2600.0 135.0438 49000.0 141.5249 2800.0 141.9778 2400.0 145.029 5300.0 147.0441 7700.0 149.0594 16000.0 149.6801 3100.0 149.6907 5300.0 152.8878 2300.0 161.2869 2700.0 163.0388 120000.0 173.5337 42000.0 175.0385 2600.0 176.0469 2700.0 177.0544 5100.0 178.0626 26000.0 179.9739 2300.0 191.0338 32000.0 206.0564 3900.0 206.1904 13000.0 END IONS BEGIN IONS SCANS=381 PEPMASS=321.142 CHARGE=1 COLLISION_ENERGY=0.0 52.5793 2200.0 56.2694 2100.0 58.5989 2100.0 58.8263 2200.0 60.3393 2700.0 60.4973 2700.0 62.6963 2500.0 75.6257 2400.0 76.8995 2300.0 77.8962 2500.0 88.35 2500.0 90.7642 2500.0 98.965 2600.0 101.1733 2400.0 103.691 2300.0 112.2681 2300.0 162.0667 4800.0 163.0705 15000.0 163.4186 2300.0 164.0417 2300.0 165.0754 7800.0 173.5246 17000.0 173.5353 13000.0 173.5435 7800.0 178.0629 3100.0 179.0654 8400.0 180.067 13000.0 181.0706 10000.0 181.1276 2300.0 190.0613 22000.0 191.065 57000.0 192.0373 5100.0 192.0677 67000.0 193.0391 12000.0 193.0704 62000.0 193.0865 6900.0 194.0416 13000.0 194.0891 40000.0 195.0914 42000.0 195.2741 2300.0 196.0939 51000.0 207.0606 13000.0 208.0625 30000.0 209.0656 36000.0 221.081 27000.0 222.0842 83000.0 223.0864 160000.0 224.089 240000.0 244.169 2600.0 END IONS BEGIN IONS SCANS=382 PEPMASS=426.0667 CHARGE=1 COLLISION_ENERGY=0.0 55.0238 2600.0 58.4174 2300.0 62.3204 2100.0 66.7496 2300.0 67.7599 2400.0 69.5474 2200.0 88.3796 2400.0 145.3866 2900.0 161.0599 2700.0 161.3634 2300.0 162.067 14000.0 173.5254 24000.0 173.5415 13000.0 177.0546 2600.0 178.0624 15000.0 189.0547 11000.0 190.0622 140000.0 191.0337 27000.0 191.0697 12000.0 193.0858 100000.0 205.0859 11000.0 206.0574 47000.0 221.0808 650000.0 222.0836 12000.0 249.8274 2400.0 283.7291 2300.0 325.1529 2500.0 367.7258 2600.0 END IONS BEGIN IONS SCANS=383 PEPMASS=435.0615 CHARGE=1 COLLISION_ENERGY=0.0 57.1918 2400.0 73.2208 2500.0 76.8119 2100.0 81.0336 3900.0 84.0649 2500.0 94.3244 2400.0 98.8773 2400.0 129.2353 2300.0 145.5167 2300.0 151.2013 2400.0 162.0673 13000.0 173.5239 14000.0 173.5365 25000.0 173.5424 5400.0 175.0389 2700.0 177.0549 12000.0 178.0627 6100.0 179.0706 7400.0 189.0546 6400.0 190.0625 84000.0 191.0339 16000.0 191.069 20000.0 192.0782 18000.0 193.086 61000.0 194.0935 30000.0 201.8911 2400.0 205.0497 93000.0 206.0578 29000.0 207.0641 2800.0 220.0739 25000.0 221.081 1400000.0 222.0856 87000.0 234.0756 13000.0 234.9964 2200.0 236.0681 32000.0 246.1118 6500.0 246.5889 2500.0 250.9998 7400.0 253.432 2300.0 258.1121 2700.0 260.1287 9300.0 261.136 3700.0 272.1283 76000.0 274.0726 2300.0 274.1075 370000.0 274.1424 3200.0 278.9955 17000.0 286.1079 11000.0 288.1227 2800.0 289.0937 10000.0 289.131 350000.0 302.1025 180000.0 315.0192 2800.0 317.0823 14000.0 317.1259 420000.0 317.1577 3100.0 330.0425 18000.0 333.0322 3100.0 369.5236 2800.0 396.4172 2700.0 END IONS BEGIN IONS SCANS=384 PEPMASS=657.2424 CHARGE=1 COLLISION_ENERGY=0.0 66.523 4900.0 66.5434 2900.0 68.3956 2900.0 68.7513 2700.0 82.1912 2600.0 83.68 2400.0 85.0254 9900.0 85.0294 45000.0 86.6715 2400.0 87.8326 2500.0 92.4336 2300.0 93.0154 2400.0 93.654 2400.0 95.3612 2300.0 96.2362 5800.0 108.8827 2800.0 117.9991 2500.0 120.0325 5400.0 120.0414 310000.0 120.6659 2400.0 121.3445 2900.0 147.3396 5000.0 151.0733 3100.0 158.8676 2800.0 173.517 5100.0 173.5346 150000.0 173.548 12000.0 192.3146 2300.0 216.2906 3300.0 219.4858 2600.0 221.0813 50000.0 232.403 2700.0 236.4835 2700.0 240.4857 4900.0 242.0778 4500.0 243.063 42000.0 244.8969 3500.0 306.69 2300.0 318.4491 2300.0 325.0921 110000.0 327.8982 3300.0 335.0405 2300.0 339.9919 10000.0 340.0187 100000.0 340.0382 29000.0 340.1151 16000000.0 340.1897 60000.0 340.2125 96000.0 340.2397 16000.0 483.8683 2700.0 504.1042 2400.0 604.2342 2400.0 612.3163 2800.0 636.7711 2400.0 END IONS BEGIN IONS SCANS=385 PEPMASS=317.1267 CHARGE=1 COLLISION_ENERGY=0.0 49.0768 2200.0 52.8525 2500.0 53.0386 12000.0 56.5067 2100.0 58.7247 2300.0 64.292 2100.0 72.9926 2300.0 75.2511 2400.0 81.0335 56000.0 81.0381 3000.0 82.4304 2300.0 83.9783 2200.0 91.054 8200.0 93.2076 2500.0 96.0439 2700.0 98.06 52000.0 98.337 2400.0 105.93 2300.0 111.4918 2600.0 113.9165 2200.0 117.0333 15000.0 118.0418 3100.0 118.0655 3100.0 119.049 12000.0 125.2784 2200.0 129.6453 2700.0 131.0491 3000.0 132.0569 2900.0 133.0649 12000.0 135.0435 5700.0 145.0283 11000.0 146.0599 36000.0 147.044 46000.0 148.0526 3200.0 149.0595 39000.0 150.0667 2900.0 151.0752 9400.0 153.6581 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190.0628 15000.0 191.0642 13000.0 192.0379 13000.0 192.0679 130000.0 193.0391 67000.0 193.0853 3500.0 194.0892 3000.0 195.091 63000.0 207.0573 3200.0 208.0381 8800.0 208.0625 42000.0 223.0855 8400.0 END IONS BEGIN IONS SCANS=389 PEPMASS=340.1159 CHARGE=1 COLLISION_ENERGY=0.0 53.2336 13000.0 56.0795 17000.0 58.0594 13000.0 59.7033 14000.0 60.2691 14000.0 63.2113 13000.0 63.9992 15000.0 65.5548 13000.0 77.5002 17000.0 86.1416 14000.0 89.4362 5400.0 93.1695 15000.0 110.018 4200.0 110.9308 5100.0 120.0417 1100000.0 125.8308 15000.0 168.5506 4700.0 173.5249 360000.0 173.5429 200000.0 175.6927 4600.0 183.0837 16000.0 187.7118 14000.0 190.062 90000.0 193.0859 75000.0 206.0597 18000.0 221.081 480000.0 243.0598 15000.0 246.5439 14000.0 246.8267 17000.0 261.5005 6100.0 279.0908 16000.0 325.0916 68000.0 340.1156 1100000.0 340.1642 19000.0 END IONS BEGIN IONS SCANS=390 PEPMASS=208.0439 CHARGE=1 COLLISION_ENERGY=0.0 41.3484 2200.0 52.9306 2200.0 54.6653 2100.0 56.4002 2200.0 70.125 2200.0 73.0282 9100.0 76.9669 2600.0 77.4386 2400.0 84.9593 68000.0 85.8034 2200.0 92.5701 2100.0 102.9703 7800.0 107.1876 2200.0 115.9637 12000.0 116.961 2800.0 126.0621 2700.0 132.6509 2200.0 138.9862 2700.0 149.0598 2800.0 149.67 3400.0 149.6917 6500.0 151.0557 2100.0 173.534 15000.0 174.9846 4200.0 221.5503 2500.0 END IONS BEGIN IONS SCANS=391 PEPMASS=346.0937 CHARGE=1 COLLISION_ENERGY=0.0 69.7907 2300.0 73.5208 2500.0 74.1323 2100.0 77.6922 2400.0 78.4357 2300.0 79.0119 2900.0 84.6581 2300.0 87.6967 2200.0 99.5637 2800.0 131.4254 2500.0 139.4917 2800.0 146.6867 2300.0 149.6698 3200.0 149.6819 8600.0 149.6922 11000.0 162.067 4000.0 173.5274 23000.0 173.5432 8000.0 174.442 2700.0 176.8679 2500.0 190.0623 37000.0 191.0342 8100.0 193.0858 21000.0 205.7346 2800.0 206.0577 11000.0 212.9087 2700.0 221.0808 150000.0 222.084 16000.0 385.3449 2800.0 463.6243 2700.0 532.4628 2600.0 END IONS BEGIN IONS SCANS=392 PEPMASS=418.0588 CHARGE=1 COLLISION_ENERGY=0.0 55.0579 2100.0 57.4196 2200.0 57.6936 2200.0 60.9186 2200.0 64.7738 2100.0 66.2125 2200.0 75.6752 2300.0 83.1468 2500.0 100.1121 3000.0 104.1131 2200.0 124.1602 2500.0 134.6714 2200.0 147.0435 2800.0 148.0507 3000.0 148.7119 2600.0 149.6701 2900.0 149.6805 3600.0 149.6914 5800.0 161.0602 2500.0 161.8407 2300.0 162.0673 12000.0 163.0406 2400.0 163.0758 2400.0 163.6168 2700.0 169.9903 2300.0 172.7964 2400.0 173.527 3700.0 173.5365 30000.0 178.0622 6500.0 181.0856 10000.0 189.0544 8300.0 190.0623 90000.0 190.5458 2500.0 191.0338 16000.0 191.0697 15000.0 191.3733 2400.0 193.0858 79000.0 206.0574 32000.0 221.0809 420000.0 221.1001 3300.0 222.0819 2300.0 235.4782 2700.0 247.621 2400.0 320.8605 2500.0 326.0121 3000.0 328.0271 9500.0 331.0507 4400.0 334.0366 5600.0 344.0227 12000.0 359.0456 30000.0 362.0335 9200.0 377.056 20000.0 410.291 2500.0 END IONS BEGIN IONS SCANS=393 PEPMASS=463.0563 CHARGE=1 COLLISION_ENERGY=0.0 58.6203 2700.0 69.2764 2800.0 69.8383 2300.0 76.62 2700.0 78.8994 2100.0 86.3127 2400.0 92.3316 2300.0 99.0706 2400.0 99.368 2100.0 102.4248 2400.0 149.6675 4600.0 149.6883 5200.0 149.7092 3600.0 162.0677 3200.0 165.0025 2400.0 172.9781 7400.0 173.5235 8300.0 173.5392 21000.0 177.0543 11000.0 179.0707 2700.0 181.0861 22000.0 186.9575 18000.0 190.0624 34000.0 191.0347 5800.0 191.0695 3800.0 192.0782 16000.0 193.0863 29000.0 194.0937 24000.0 205.0499 70000.0 206.0577 11000.0 220.0729 20000.0 221.081 960000.0 222.0875 25000.0 234.0771 4600.0 236.0677 27000.0 246.1156 3400.0 260.1275 13000.0 260.6922 2900.0 272.1283 60000.0 273.1373 2900.0 274.1076 290000.0 286.1067 11000.0 289.1311 280000.0 289.1596 2300.0 302.1026 140000.0 302.1382 3600.0 305.9905 2800.0 317.0827 4100.0 317.1259 360000.0 319.0141 3100.0 320.0232 17000.0 335.047 55000.0 350.8268 3100.0 363.0424 15000.0 378.0647 6800.0 410.9435 2900.0 460.3823 2600.0 473.4468 2800.0 END IONS BEGIN IONS SCANS=394 PEPMASS=342.134 CHARGE=1 COLLISION_ENERGY=0.0 55.1323 2100.0 55.4878 2500.0 56.5342 2600.0 59.0957 2500.0 60.5257 2900.0 61.4761 2400.0 61.7303 2400.0 63.0235 5800.0 86.7316 2300.0 87.8725 2400.0 88.7077 2600.0 89.0384 110000.0 91.0483 3000.0 91.0539 120000.0 95.0488 42000.0 105.5693 3000.0 115.9718 3000.0 117.0331 190000.0 118.4624 2200.0 119.0488 150000.0 130.152 2600.0 131.5429 2300.0 135.0438 110000.0 136.052 15000.0 137.0593 13000.0 145.0281 2000000.0 145.039 19000.0 147.0437 110000.0 151.0751 630000.0 151.0909 10000.0 163.0387 940000.0 163.0543 19000.0 173.5242 42000.0 173.5418 29000.0 175.0388 6300000.0 175.0528 14000.0 175.0744 45000.0 175.0843 5500.0 186.0549 25000.0 236.6951 2500.0 237.7991 2500.0 265.0842 2800.0 274.3448 2500.0 292.489 3000.0 301.4977 2200.0 331.4993 2600.0 END IONS BEGIN IONS SCANS=395 PEPMASS=246.2218 CHARGE=1 COLLISION_ENERGY=0.0 44.0492 69000.0 45.3217 2600.0 49.4517 2200.0 50.8873 2300.0 55.0539 15000.0 55.9342 24000.0 58.6332 2000.0 60.5088 2400.0 63.8517 2200.0 63.8785 2100.0 63.9253 2600.0 65.5205 2300.0 66.514 2500.0 66.9123 2600.0 67.0539 2800.0 67.5725 2200.0 69.0694 20000.0 69.8983 2700.0 70.0648 10000.0 70.7149 2400.0 75.7267 2400.0 81.0695 46000.0 83.0851 19000.0 84.0803 8800.0 88.9006 2800.0 89.5259 2300.0 91.0535 2400.0 91.5752 2200.0 93.0695 30000.0 95.0851 49000.0 96.0805 9500.0 98.3845 2300.0 101.0513 2500.0 103.2914 2400.0 105.0694 46000.0 107.0851 35000.0 108.0803 210000.0 109.101 24000.0 110.096 46000.0 114.9712 25000.0 117.9765 2300.0 119.0851 53000.0 121.1007 36000.0 123.1166 20000.0 128.9505 60000.0 131.0851 28000.0 132.9819 8800.0 133.1009 39000.0 134.5707 2300.0 135.1162 16000.0 135.9452 10000.0 138.9697 3200.0 142.8647 2500.0 145.1009 65000.0 146.9609 11000.0 147.1165 58000.0 148.1117 2900.0 149.1321 21000.0 152.143 62000.0 159.1164 49000.0 161.119 6000.0 161.1324 3400.0 162.127 9000.0 164.1436 13000.0 172.8472 2500.0 173.1323 47000.0 173.5209 9600.0 173.5368 80000.0 175.1483 16000.0 176.2134 2400.0 176.9714 6900.0 185.9665 2300.0 186.1393 3000.0 187.1478 27000.0 188.1428 26000.0 189.1635 110000.0 190.1599 3300.0 194.5434 2500.0 195.8063 2400.0 199.4202 2600.0 203.1666 85000.0 204.1747 86000.0 205.716 2500.0 218.1897 20000.0 221.7242 2600.0 229.1948 58000.0 243.0335 3100.0 244.1374 2500.0 246.2215 880000.0 246.2508 5300.0 END IONS BEGIN IONS SCANS=396 PEPMASS=290.1392 CHARGE=1 COLLISION_ENERGY=0.0 48.5618 7500.0 50.0159 8300.0 51.0236 3100.0 51.7659 96000.0 51.7671 9100.0 52.6978 5300.0 54.0337 98000.0 54.4651 3500.0 54.8432 6000.0 55.0178 35000.0 55.0541 78000.0 56.0494 120000.0 56.0847 3000.0 59.8079 3200.0 65.0385 170000.0 65.5326 6000.0 67.0415 170000.0 67.054 890000.0 67.5806 6000.0 67.8514 2200.0 68.0493 77000.0 68.6381 3200.0 69.0331 16000.0 71.2082 2600.0 71.7064 2400.0 73.2491 6900.0 74.4022 5800.0 75.6071 6600.0 75.7217 2500.0 76.0314 24000.0 77.0385 44000.0 78.8127 3500.0 80.0493 140000.0 81.6756 4900.0 82.0285 1600000.0 82.065 1600000.0 82.6969 2400.0 83.0727 240000.0 84.0754 14000.0 84.0804 1100000.0 86.5557 2400.0 87.9096 3400.0 88.9997 6100.0 89.0387 54000.0 91.0541 3100000.0 91.0603 11000.0 91.2254 3000.0 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163.039 22000.0 164.0467 230000.0 165.0549 4400.0 166.8979 5800.0 167.0703 150000.0 173.0238 17000.0 173.5277 91000.0 173.5391 64000.0 174.031 62000.0 174.9926 10000.0 175.003 27000.0 175.0113 21000.0 175.039 36000000.0 175.0746 280000.0 175.0849 52000.0 175.0943 24000.0 176.0461 78000.0 177.0174 6000.0 177.055 61000.0 178.0263 6400.0 179.0703 670000.0 186.2518 3100.0 189.0568 7800.0 191.0334 9700.0 192.0213 31000.0 192.0418 2000000.0 192.0623 43000.0 193.0497 480000.0 195.0605 2500.0 197.5588 5900.0 199.0185 3600.0 206.602 5900.0 207.0192 67000.0 207.0297 43000.0 207.0653 23000000.0 207.1112 160000.0 207.1238 20000.0 228.1024 6900.0 230.1188 6900.0 248.1278 76000.0 258.1115 2600.0 290.1391 76000.0 299.0626 3400.0 END IONS BEGIN IONS SCANS=397 PEPMASS=207.0656 CHARGE=1 COLLISION_ENERGY=0.0 43.0178 17000.0 43.6421 2500.0 45.0333 11000.0 47.6106 2300.0 48.0491 2300.0 49.3235 2400.0 49.3809 2300.0 52.6281 2200.0 54.5292 2100.0 55.546 2100.0 56.4569 2500.0 57.1696 2100.0 57.9346 16000.0 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2800.0 164.0469 18000.0 173.5269 32000.0 173.5389 26000.0 175.0389 30000.0 179.07 26000.0 201.4166 2500.0 207.3335 2500.0 END IONS BEGIN IONS SCANS=398 PEPMASS=365.2073 CHARGE=1 COLLISION_ENERGY=0.0 63.3032 2700.0 65.0202 2200.0 73.3875 2700.0 89.2609 2200.0 100.0752 15000.0 100.1044 2300.0 105.7094 2500.0 106.3752 2100.0 119.141 2500.0 131.266 2500.0 135.0435 2400.0 148.4705 2300.0 149.6824 3800.0 149.6896 11000.0 162.0671 32000.0 163.0394 3700.0 173.534 20000.0 176.0474 2700.0 177.0556 2300.0 178.0622 19000.0 189.0542 22000.0 190.0622 230000.0 191.0337 37000.0 191.0699 20000.0 193.0673 2300.0 193.0857 180000.0 206.0574 86000.0 217.027 2900.0 221.0808 1900000.0 END IONS BEGIN IONS SCANS=399 PEPMASS=221.0811 CHARGE=1 COLLISION_ENERGY=0.0 43.0178 2400.0 44.3567 2100.0 44.6717 2100.0 47.3494 2600.0 47.7978 2100.0 51.9672 2700.0 54.1719 2300.0 54.6339 2300.0 61.0637 2400.0 64.2489 3000.0 64.5483 2300.0 65.6664 2500.0 65.6799 2500.0 67.8384 2400.0 72.8676 2400.0 75.4007 2300.0 76.7404 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174.0312 21000.0 174.9849 22000.0 175.039 200000.0 176.0469 52000.0 177.0547 63000.0 178.0624 200000.0 188.0467 32000.0 189.0546 7600.0 190.0624 270000.0 190.0809 4300.0 191.0338 130000.0 191.0692 12000.0 193.0859 130000.0 205.0502 11000.0 206.0575 61000.0 209.3329 2300.0 221.0809 19000.0 END IONS BEGIN IONS SCANS=400 PEPMASS=320.1499 CHARGE=1 COLLISION_ENERGY=0.0 49.1466 2300.0 52.6124 2400.0 53.3565 2100.0 54.3722 2300.0 55.0592 2300.0 55.2699 13000.0 64.6503 2400.0 71.1124 2300.0 72.1466 2900.0 77.3549 2700.0 77.7207 2600.0 79.8426 2400.0 83.2423 2200.0 91.0539 3800.0 100.0755 59000.0 102.0461 7700.0 103.0541 4900.0 105.0696 6500.0 106.6527 2500.0 107.3761 2600.0 111.3102 2800.0 115.9145 2300.0 116.6334 2400.0 118.0415 8000.0 119.049 18000.0 130.0411 27000.0 131.0488 7200.0 132.0565 19000.0 133.0646 31000.0 135.044 34000.0 139.8325 2700.0 140.6259 2500.0 141.7897 2700.0 146.0355 2800.0 147.0439 120000.0 148.0517 19000.0 149.0594 21000.0 150.0673 22000.0 154.6445 2500.0 159.0439 9100.0 160.0517 36000.0 161.0595 63000.0 162.0674 400000.0 162.083 12000.0 163.0388 130000.0 163.0752 73000.0 165.0905 13000.0 165.3507 2400.0 167.0705 11000.0 167.1555 2500.0 173.5247 12000.0 173.5348 39000.0 174.0313 41000.0 175.0389 100000.0 176.0469 89000.0 177.0546 67000.0 178.0624 350000.0 179.078 2300.0 181.4243 2800.0 188.047 33000.0 189.0368 4400.0 189.0545 170000.0 190.0221 3200.0 190.0623 2000000.0 190.0777 18000.0 190.0831 6000.0 191.0139 9300.0 191.0337 410000.0 191.07 160000.0 192.0415 20000.0 193.0446 3200.0 193.0651 4900.0 193.0858 1500000.0 193.1036 17000.0 205.0501 12000.0 206.0346 15000.0 206.0573 780000.0 206.08 20000.0 210.5402 2600.0 221.0308 8700.0 221.0807 5000000.0 221.0999 38000.0 221.1199 10000.0 221.1315 16000.0 222.0841 3200.0 223.0864 5400.0 255.8816 4100.0 260.4284 2600.0 272.764 2800.0 277.1261 2700.0 END IONS BEGIN IONS SCANS=401 PEPMASS=342.1315 CHARGE=1 COLLISION_ENERGY=0.0 50.1191 2300.0 60.4393 2500.0 63.5241 2100.0 64.6554 2300.0 65.4683 2100.0 70.6054 2200.0 84.5063 2500.0 85.8966 2600.0 87.6182 2400.0 110.8222 2600.0 122.0573 20000.0 125.4548 2300.0 133.0672 2400.0 136.5029 2400.0 153.1274 2600.0 173.5203 5400.0 173.5351 48000.0 193.0877 2900.0 221.0796 6700.0 233.297 2300.0 252.4319 2700.0 252.4651 2600.0 271.7657 2600.0 328.8345 2500.0 342.1311 40000.0 END IONS BEGIN IONS SCANS=402 PEPMASS=625.2557 CHARGE=1 COLLISION_ENERGY=0.0 64.1522 2500.0 64.5482 3000.0 68.0125 2500.0 71.384 2400.0 76.8163 2400.0 77.9349 2300.0 83.4219 2200.0 84.8984 2200.0 84.9734 2400.0 88.5087 2500.0 90.2587 2300.0 90.5704 2300.0 92.8587 3200.0 93.0695 8600.0 95.9276 2600.0 96.5446 2100.0 102.8067 2500.0 102.9883 2700.0 105.6078 2200.0 121.0645 240000.0 121.4203 2300.0 122.7203 2500.0 122.7827 2700.0 133.0282 13000.0 136.0753 28000.0 136.1032 2700.0 137.0592 38000.0 138.0906 9000.0 143.0487 7500.0 149.0594 53000.0 150.0672 25000.0 161.0589 4200.0 164.0702 52000.0 173.5217 35000.0 173.5394 100000.0 173.5496 2800.0 175.0388 78000.0 175.0754 14000.0 177.0548 36000.0 181.6594 2300.0 187.0385 19000.0 198.8765 2300.0 201.0545 140000.0 203.0696 9800.0 221.0972 6100.0 227.07 8700.0 233.0593 27000.0 237.0912 18000.0 247.0051 2500.0 247.075 16000.0 249.0917 2600.0 251.0724 3100.0 254.0567 2300.0 261.0546 3100.0 263.0698 13000.0 264.0787 14000.0 265.0857 110000.0 266.0931 12000.0 272.1282 11000.0 275.0704 5900.0 276.5277 2400.0 278.0572 8300.0 279.1012 26000.0 292.0735 29000.0 293.0443 7200.0 293.0811 240000.0 295.096 16000.0 297.0781 2700.0 297.1123 49000.0 307.0967 450000.0 308.0681 210000.0 310.0837 14000.0 314.461 2200.0 319.0602 20000.0 322.5711 3000.0 323.0912 75000.0 325.0612 5100.0 325.0731 3000.0 325.1069 570000.0 325.1514 11000.0 336.0628 14000.0 340.1916 2600.0 351.0362 5600.0 351.086 760000.0 351.1233 3300.0 371.9644 2900.0 452.4577 2300.0 459.1305 2400.0 462.1897 22000.0 488.1738 3000.0 509.6094 2800.0 511.9201 2500.0 551.5922 2800.0 564.8727 3000.0 596.1522 2500.0 607.8865 2900.0 618.6901 2400.0 END IONS BEGIN IONS SCANS=403 PEPMASS=266.0814 CHARGE=1 COLLISION_ENERGY=0.0 45.6968 12000.0 46.0675 2600.0 48.5298 8700.0 50.4337 6800.0 54.0099 2700.0 57.5014 6500.0 57.6992 8800.0 59.0171 3100.0 62.7625 84000.0 62.7662 22000.0 63.4869 7800.0 63.5111 6000.0 64.603 3800.0 65.5627 2800.0 66.5183 40000.0 66.5221 16000.0 71.1826 7900.0 76.3828 8700.0 77.9306 8100.0 87.6254 7700.0 87.9531 6900.0 99.5404 8300.0 101.4497 3100.0 102.4253 3000.0 107.5177 3700.0 117.8242 3000.0 122.6549 8900.0 130.4519 3500.0 139.056 35000.0 140.0624 13000.0 143.1882 8400.0 161.9709 3200.0 165.0698 31000.0 166.0662 33000.0 167.0731 460000.0 168.0574 76000.0 169.302 3300.0 171.0672 19000.0 173.5245 35000.0 173.533 43000.0 179.0497 12000.0 179.0968 8200.0 180.0812 41000.0 182.0606 12000.0 182.0965 61000.0 192.0803 40000.0 194.0603 38000.0 195.0468 24000.0 195.0679 1100000.0 195.0886 10000.0 196.0518 63000.0 196.0757 150000.0 198.0548 14000.0 199.0638 12000.0 203.097 8900.0 206.0601 440000.0 208.076 64000.0 210.0552 9500.0 210.0917 120000.0 211.0759 82000.0 219.9454 8100.0 220.075 47000.0 222.0555 45000.0 223.0628 400000.0 230.7548 3100.0 234.0551 240000.0 238.0864 400000.0 243.4285 11000.0 250.0503 22000.0 250.9615 13000.0 250.9959 64000.0 251.0576 29000000.0 251.1194 190000.0 251.1372 40000.0 265.0747 11000.0 266.0136 110000.0 266.029 61000.0 266.0811 19000000.0 266.1482 120000.0 266.1665 24000.0 END IONS BEGIN IONS SCANS=404 PEPMASS=621.2449 CHARGE=1 COLLISION_ENERGY=0.0 64.5206 2200.0 69.7881 2100.0 72.4103 2200.0 78.6021 2400.0 79.054 4200.0 81.0332 340000.0 81.0386 4900.0 82.0284 3500.0 94.0649 2500.0 95.9429 2200.0 98.0596 9100.0 106.0655 3000.0 107.8755 2500.0 109.6856 2100.0 110.0234 19000.0 119.0497 2700.0 122.06 9800.0 123.3927 2500.0 132.0443 6600.0 134.06 4500.0 134.2878 2300.0 136.0388 7700.0 147.0444 3000.0 150.0547 140000.0 150.066 2100.0 165.5482 2700.0 173.5322 46000.0 175.0388 8700.0 178.0498 410000.0 181.0495 16000.0 195.0654 4600.0 196.0589 2300.0 205.0864 9000.0 207.0652 32000.0 221.0809 50000.0 244.4942 2300.0 245.0813 3000.0 273.0754 3400.0 290.104 3700.0 300.1219 4400.0 336.1006 4600.0 337.1089 3500.0 339.1237 5800.0 341.4686 2600.0 353.1015 10000.0 357.1335 5200.0 361.0238 16000.0 366.1123 5300.0 367.1186 23000.0 368.1253 18000.0 381.134 19000.0 384.1213 3900.0 385.1286 71000.0 389.0979 2600.0 395.116 5300.0 396.1203 9700.0 399.1443 24000.0 409.127 2900.0 412.1201 3400.0 427.1407 23000.0 459.2717 26000.0 510.2023 3200.0 615.9564 2900.0 621.3231 14000.0 END IONS BEGIN IONS SCANS=405 PEPMASS=597.2216 CHARGE=1 COLLISION_ENERGY=0.0 67.3207 2400.0 73.5578 2400.0 76.0916 2300.0 76.2434 2300.0 76.5205 2200.0 76.9058 2100.0 77.0276 2200.0 79.7985 2300.0 83.9468 2400.0 89.0392 2500.0 94.3516 2400.0 97.8585 2300.0 101.1221 2700.0 104.9264 2400.0 109.1179 2500.0 118.9887 2200.0 119.7462 2300.0 120.0414 23000.0 127.2334 2100.0 133.2068 2500.0 143.0789 2900.0 148.0134 2300.0 148.7233 2300.0 159.3648 2600.0 173.5221 7300.0 173.5323 110000.0 173.5411 11000.0 206.0437 2400.0 211.5775 2700.0 214.7722 2800.0 228.5142 2400.0 237.5999 2800.0 258.4243 2400.0 263.7636 2500.0 277.0904 2300.0 294.9262 2300.0 310.105 2400000.0 310.1894 3300.0 315.3971 2400.0 334.175 2800.0 354.6057 2300.0 364.1619 2800.0 368.3382 2800.0 422.9711 2400.0 443.3141 2700.0 466.3701 2400.0 542.1138 2700.0 END IONS BEGIN IONS SCANS=406 PEPMASS=288.1235 CHARGE=1 COLLISION_ENERGY=0.0 47.7672 560000.0 47.7688 52000.0 48.1445 5200.0 48.9981 9000.0 49.9679 5000.0 53.0021 13000.0 53.7223 2400.0 54.2864 5500.0 55.0178 98000.0 55.3527 5300.0 56.6153 2100.0 57.4875 4800.0 57.5946 4900.0 57.6265 5100.0 58.6221 8500.0 59.5369 4400.0 60.7405 5300.0 62.9194 7800.0 65.0385 14000.0 65.8524 4400.0 66.1151 6300.0 68.109 4300.0 69.8579 4800.0 70.5149 5400.0 70.9716 4100.0 72.4678 4800.0 75.5449 6900.0 76.7875 5800.0 77.0391 64000.0 79.054 570000.0 79.6578 6200.0 84.2803 4800.0 89.0389 100000.0 90.0463 71000.0 90.5189 3900.0 91.0542 600000.0 92.062 150000.0 92.9204 6400.0 95.049 150000.0 97.0766 5900.0 98.0599 400000.0 101.2243 4700.0 102.0469 140000.0 103.054 1200000.0 104.0619 22000.0 105.0334 360000.0 105.0426 14000.0 105.0442 6900.0 105.0618 22000.0 105.0698 1700000.0 105.0782 7600.0 107.0492 69000.0 109.0642 7400.0 112.1176 5600.0 115.0543 160000.0 116.2313 5600.0 117.0338 97000.0 117.0698 6600.0 118.0413 330000.0 119.0491 1100000.0 119.0579 14000.0 120.0569 910000.0 121.0646 65000.0 123.2477 5600.0 127.0811 8300.0 130.0413 160000.0 131.0491 220000.0 132.0453 10000.0 132.0569 1900000.0 132.0686 28000.0 133.0179 8800.0 133.0283 790000.0 133.0648 2000000.0 133.0765 26000.0 135.0445 9900.0 135.0803 660000.0 137.0602 91000.0 137.6867 4600.0 143.0608 54000.0 145.0289 6500.0 146.0362 470000.0 147.0441 810000.0 148.0402 23000.0 148.0518 7200000.0 148.0629 26000.0 149.0587 6500.0 151.076 8900.0 152.5068 4700.0 158.0366 45000.0 159.0435 110000.0 160.0398 9200.0 160.0519 3800000.0 160.0641 20000.0 160.1931 7500.0 161.0597 1100000.0 163.0431 260000.0 163.0496 29000.0 163.0754 33000000.0 163.101 38000.0 163.1063 350000.0 163.1162 86000.0 165.0551 18000.0 173.059 71000.0 173.5275 280000.0 173.5435 59000.0 176.0288 55000.0 176.047 4500000.0 178.0859 31000.0 190.8802 6400.0 190.9393 5000.0 190.9854 9300.0 190.9928 6600.0 191.0177 24000.0 191.0293 840000.0 191.0378 710000.0 191.0703 140000000.0 191.0855 330000.0 191.1019 810000.0 191.1112 980000.0 191.123 410000.0 191.1343 190000.0 191.1456 120000.0 191.1574 43000.0 192.0735 150000.0 212.1146 7900.0 246.1134 66000.0 257.7062 6300.0 270.2065 4900.0 END IONS BEGIN IONS SCANS=407 PEPMASS=310.1055 CHARGE=1 COLLISION_ENERGY=0.0 49.0702 3700.0 49.0852 2500.0 49.5533 2300.0 50.4455 2400.0 50.6455 6500.0 51.0067 2800.0 51.25 2300.0 53.7444 3900.0 53.7871 3400.0 54.0377 3800.0 56.9691 5800.0 58.6394 3400.0 60.269 2200.0 62.4704 7900.0 62.5168 3400.0 62.7679 3600.0 64.4328 3000.0 65.0066 3200.0 65.8363 4300.0 66.7575 5600.0 66.9673 2100.0 67.4563 2700.0 67.9335 4300.0 68.0017 2200.0 68.0631 5300.0 69.5623 5800.0 69.9058 6700.0 70.7297 5400.0 71.8528 2400.0 73.1315 2700.0 73.4011 3400.0 74.0071 2200.0 76.4129 5900.0 77.4598 2100.0 79.6235 3700.0 80.1221 4200.0 80.6725 4700.0 81.0736 5900.0 82.3934 4100.0 82.6129 2900.0 84.483 4200.0 87.9397 2800.0 88.305 6400.0 91.2175 3700.0 92.2973 2800.0 101.4904 4900.0 103.6394 4100.0 105.5498 2500.0 109.5576 3400.0 111.6654 3500.0 112.4063 3000.0 120.0416 200000.0 120.3847 6500.0 122.5571 2300.0 123.1075 2500.0 123.7517 7000.0 124.9385 3100.0 128.5806 2700.0 130.7751 4700.0 136.0439 2100.0 142.5704 4900.0 145.4341 4200.0 150.0939 2400.0 152.616 4100.0 163.0746 6700.0 165.6185 3700.0 170.3094 3000.0 173.5061 4400.0 173.5258 18000.0 173.5348 260000.0 173.5429 4200.0 174.3187 4100.0 175.3362 2800.0 179.0784 6000.0 179.2037 3700.0 184.6666 2300.0 191.07 230000.0 194.9328 4900.0 195.0442 12000.0 214.4281 2500.0 225.0561 2300.0 275.2114 4600.0 277.3925 2500.0 287.8205 2100.0 288.4825 4200.0 310.1053 430000.0 313.7245 6300.0 317.2225 4900.0 END IONS BEGIN IONS SCANS=408 PEPMASS=304.1185 CHARGE=1 COLLISION_ENERGY=0.0 50.2857 2700.0 52.4102 2600.0 53.0052 2500.0 53.0436 2600.0 55.1048 2200.0 56.3585 2500.0 59.2426 2200.0 59.8047 2100.0 61.8677 2500.0 62.9091 2500.0 65.0385 3100.0 69.945 2400.0 87.3698 2400.0 91.0541 200000.0 98.06 24000.0 103.0542 4300.0 119.0394 3900.0 119.049 650000.0 119.0565 4200.0 119.0592 12000.0 127.7641 2600.0 127.8092 2400.0 129.0341 3800.0 131.0484 3100.0 132.0204 10000.0 133.0273 2400.0 136.052 2600.0 136.2263 2800.0 145.0285 3000.0 147.0439 840000.0 149.0231 6400.0 157.0395 78000.0 164.0467 12000.0 173.5303 11000.0 173.5351 25000.0 175.0039 3600.0 175.039 1800000.0 176.0462 4100.0 179.0703 49000.0 179.0863 2800.0 180.8884 22000.0 188.0635 3700.0 190.873 7100.0 191.0704 2600.0 192.042 8700.0 207.0653 900000.0 207.0978 3500.0 208.8832 78000.0 226.8937 56000.0 256.4912 2900.0 END IONS BEGIN IONS SCANS=409 PEPMASS=207.0655 CHARGE=1 COLLISION_ENERGY=0.0 42.3157 2200.0 44.2245 2200.0 45.0334 6100.0 46.1742 2400.0 46.9021 2200.0 47.6328 2400.0 47.8546 2700.0 48.2165 2200.0 48.9931 2200.0 49.0663 2400.0 54.7254 2500.0 54.7291 2100.0 56.8838 2400.0 57.9347 13000.0 58.5027 2600.0 62.2982 2300.0 65.0383 20000.0 73.0281 4700.0 74.9377 5000.0 77.0384 5200.0 79.0538 2700.0 80.0618 3100.0 84.9455 15000.0 89.0383 18000.0 91.0539 420000.0 91.0608 6000.0 92.4687 2300.0 95.0486 3700.0 97.9533 20000.0 98.9611 46000.0 101.038 2500.0 102.956 24000.0 104.0254 2700.0 107.0491 6000.0 108.0563 3100.0 109.9381 2600.0 115.9638 350000.0 116.9716 140000.0 117.0329 3500.0 118.0412 11000.0 119.0392 6800.0 119.0488 300000.0 121.0274 2700.0 123.0802 2400.0 126.9339 2500.0 126.9663 3500.0 129.0331 15000.0 132.0203 37000.0 133.9743 21000.0 135.0437 18000.0 135.7229 2600.0 136.0517 12000.0 136.712 2500.0 145.0278 13000.0 146.0361 8600.0 147.0438 170000.0 147.4393 2300.0 149.0232 31000.0 155.9971 3200.0 157.0396 25000.0 162.0322 2900.0 164.0471 18000.0 171.8617 2300.0 173.5241 23000.0 173.5349 23000.0 173.5433 9700.0 174.0312 7800.0 175.0387 34000.0 179.0705 22000.0 187.426 2600.0 191.3735 2200.0 207.1745 2500.0 END IONS BEGIN IONS SCANS=410 PEPMASS=339.1595 CHARGE=1 COLLISION_ENERGY=0.0 51.0694 2200.0 53.7235 2200.0 55.4288 2300.0 60.061 2300.0 60.5072 2200.0 65.3547 2100.0 70.627 2100.0 73.2583 2400.0 77.0392 2800.0 79.0542 20000.0 80.3636 2400.0 83.2896 2100.0 84.2608 2300.0 87.9422 2400.0 91.0541 23000.0 93.0697 7400.0 95.0491 6600.0 99.3829 3100.0 100.3395 2800.0 101.5568 2500.0 103.0541 29000.0 103.4425 2700.0 105.0697 60000.0 107.0491 33000.0 109.2186 2700.0 115.0547 4800.0 117.0696 35000.0 118.3298 2300.0 118.7145 2900.0 119.0494 11000.0 121.0646 120000.0 123.0802 17000.0 126.4411 2300.0 129.0701 5900.0 131.049 82000.0 133.0529 3100.0 133.0647 510000.0 133.0763 4100.0 133.4564 2500.0 134.4168 2400.0 135.0319 3100.0 135.0439 1400000.0 135.068 3400.0 135.0804 16000.0 136.0518 120000.0 137.0595 33000.0 139.0747 2500.0 143.0491 12000.0 143.0858 3600.0 143.1088 2300.0 145.0646 92000.0 146.0725 86000.0 147.0803 80000.0 147.8409 3100.0 149.0595 65000.0 149.0959 8500.0 150.0674 73000.0 151.0752 1000000.0 157.0648 37000.0 157.5045 2400.0 158.0733 2700.0 159.0803 11000.0 160.0526 3300.0 160.0881 14000.0 161.0595 75000.0 162.0676 33000.0 162.7819 2400.0 162.9872 2800.0 163.0754 120000.0 164.0838 2900.0 165.091 200000.0 166.8484 2400.0 167.4245 2500.0 171.0804 32000.0 173.0597 16000.0 173.5292 58000.0 173.5435 9000.0 174.0671 15000.0 175.0757 22000.0 176.0833 30000.0 177.0732 5100.0 177.0911 780000.0 177.1079 6100.0 177.6229 2400.0 179.1062 6900.0 179.7144 2300.0 185.0603 2500.0 187.0755 36000.0 188.0835 15000.0 189.0911 82000.0 190.1001 3900.0 191.1068 50000.0 201.091 46000.0 202.0988 26000.0 203.1066 82000.0 209.1377 2700.0 215.1064 3800.0 217.1229 20000.0 246.8864 6900.0 247.1104 3000.0 251.1053 2400.0 276.1137 2700.0 277.1228 4200.0 278.1305 37000.0 279.1382 2600.0 281.1157 3700.0 294.1259 9400.0 296.4121 2700.0 307.133 7000.0 308.1404 10000.0 309.1501 11000.0 318.6784 2800.0 321.1494 6000.0 324.1357 84000.0 339.1575 2900.0 END IONS BEGIN IONS SCANS=411 PEPMASS=276.1599 CHARGE=1 COLLISION_ENERGY=0.0 46.1321 2100.0 46.5711 2300.0 48.2629 2200.0 50.5669 2100.0 53.4301 2500.0 56.0053 2100.0 58.6666 2700.0 63.667 2100.0 64.3031 2400.0 67.0921 2600.0 67.5775 2300.0 67.7314 2400.0 69.0695 120000.0 71.3803 2300.0 73.0281 54000.0 74.0959 2200.0 78.0574 2300.0 78.857 2500.0 79.9755 2300.0 84.0804 31000.0 86.0961 68000.0 88.9415 2700.0 98.6266 2300.0 105.0722 9600.0 106.9366 2200.0 109.4213 2400.0 112.0754 130000.0 115.0936 3800.0 119.0486 2700.0 130.7593 2600.0 132.0567 6000.0 133.0649 6500.0 133.104 24000.0 137.3242 2600.0 148.0516 38000.0 160.0517 23000.0 161.0592 3000.0 162.4604 2500.0 163.0753 220000.0 173.5264 25000.0 173.5399 36000.0 174.454 2200.0 176.0469 39000.0 180.8885 9500.0 181.3941 2500.0 181.9882 2700.0 191.0703 2100000.0 205.1224 8800.0 208.8829 24000.0 211.8845 2500.0 220.5303 2500.0 226.8937 17000.0 227.8512 2600.0 233.814 2300.0 276.1598 34000.0 END IONS BEGIN IONS SCANS=412 PEPMASS=233.1176 CHARGE=1 COLLISION_ENERGY=0.0 43.0178 13000.0 45.0335 24000.0 47.0197 3800.0 47.0217 2600.0 48.2765 2300.0 52.3013 2200.0 53.4501 2600.0 57.0335 51000.0 57.0698 5400.0 59.0585 2400.0 67.0542 55000.0 69.0699 3700.0 69.6283 2400.0 75.0437 10000.0 78.0846 4500.0 79.0541 22000.0 81.0696 3100.0 85.8514 4100.0 91.0542 34000.0 95.049 20000.0 96.6518 2300.0 103.054 14000.0 105.0698 27000.0 107.049 11000.0 107.1977 4700.0 108.0572 2900.0 109.0651 4100.0 115.0544 57000.0 116.0622 3100.0 117.0698 43000.0 119.0855 8300.0 121.0647 94000.0 127.0557 4600.0 128.062 190000.0 129.0318 2700.0 129.0698 170000.0 130.0777 26000.0 131.0491 26000.0 131.0854 89000.0 132.0572 8200.0 133.0649 29000.0 134.0359 3100.0 135.0806 25000.0 136.052 22000.0 137.0597 53000.0 138.0674 26000.0 139.0753 12000.0 140.0621 14000.0 141.0698 120000.0 142.0421 3200.0 142.0776 46000.0 143.0491 51000.0 143.0855 160000.0 144.0569 53000.0 144.093 11000.0 145.0516 7300.0 145.0647 270000.0 145.1011 23000.0 145.114 2900.0 146.0726 92000.0 147.0439 10000.0 147.0801 43000.0 149.0596 32000.0 151.0753 220000.0 152.062 13000.0 153.0699 130000.0 154.0776 75000.0 155.0604 12000.0 155.0854 84000.0 156.0568 59000.0 157.0647 410000.0 158.0612 3600.0 158.0726 330000.0 158.0874 4900.0 159.0442 49000.0 159.0586 3300.0 159.0804 670000.0 159.4884 2400.0 160.0518 15000.0 160.0882 140000.0 161.0596 120000.0 161.096 21000.0 162.0675 93000.0 163.0754 37000.0 164.0825 9100.0 165.0909 31000.0 168.0571 100000.0 169.0647 340000.0 170.0727 120000.0 171.0452 3100.0 171.0805 470000.0 171.0943 2000.0 172.0532 15000.0 172.0706 3500.0 172.0883 1700000.0 173.0598 870000.0 173.0962 170000.0 173.5241 11000.0 173.5373 42000.0 174.0676 260000.0 174.0857 5200.0 174.104 730000.0 174.122 3200.0 175.0755 180000.0 175.112 29000.0 176.0833 190000.0 177.055 7500.0 177.0911 190000.0 179.4014 2900.0 181.0631 4400.0 182.0729 23000.0 183.0805 110000.0 183.4664 2700.0 184.0883 820000.0 185.0598 340000.0 185.0961 45000.0 186.068 23000.0 187.0466 4900.0 187.0754 230000.0 188.0832 3600000.0 188.1222 7000.0 189.091 340000.0 190.0622 15000.0 190.0988 210000.0 191.0691 4900.0 191.1069 21000.0 192.0777 3400.0 199.0754 64000.0 200.0832 610000.0 201.0911 32000.0 202.0809 3600.0 202.099 290000.0 203.072 5000.0 203.1068 1400000.0 204.0787 3100.0 204.1143 13000.0 205.086 48000.0 205.1224 240000.0 214.0983 2700.0 215.1067 780000.0 216.8414 4400.0 218.0945 6000.0 233.1172 200000.0 239.6468 4400.0 END IONS BEGIN IONS SCANS=413 PEPMASS=434.2546 CHARGE=1 COLLISION_ENERGY=0.0 62.4464 2200.0 68.2326 2300.0 72.9651 2400.0 78.6583 2100.0 84.6943 2500.0 90.9716 2700.0 97.0623 2300.0 99.8145 2300.0 101.8305 2400.0 103.7365 2100.0 109.7545 2600.0 119.8107 2400.0 126.0551 5700.0 141.1139 2300.0 144.5003 2400.0 151.0755 12000.0 157.0871 2600.0 159.5227 2300.0 159.5447 2300.0 173.5246 34000.0 173.5409 28000.0 179.4624 2300.0 197.4753 2200.0 199.054 2400.0 201.0984 2100.0 203.1065 15000.0 227.9214 2400.0 232.0054 2300.0 233.1172 74000.0 235.263 2600.0 252.4421 2600.0 264.1577 2600.0 275.9996 2900.0 308.1404 2400.0 313.8029 2600.0 328.3606 2700.0 END IONS BEGIN IONS SCANS=414 PEPMASS=355.1544 CHARGE=1 COLLISION_ENERGY=0.0 51.9466 2200.0 51.9658 2300.0 52.6781 2300.0 60.8545 2500.0 61.7455 2300.0 63.401 2100.0 63.9355 2400.0 68.994 2300.0 70.0369 2600.0 70.8373 2500.0 71.049 66000.0 71.173 2200.0 72.8608 2100.0 75.0442 6800.0 79.4247 2600.0 91.0542 25000.0 91.421 2600.0 94.0412 6000.0 95.0493 2400.0 97.282 2300.0 98.2524 2100.0 101.3953 2400.0 105.4021 2300.0 105.4696 2300.0 107.0489 26000.0 108.0566 2300.0 108.8546 2500.0 109.0646 45000.0 111.0439 5700.0 117.0698 5500.0 117.4394 2300.0 119.0487 11000.0 119.0849 2700.0 120.3332 2100.0 121.0646 24000.0 122.0361 28000.0 125.0595 7600.0 127.694 2100.0 128.0617 3200.0 129.0698 43000.0 131.0491 23000.0 131.0858 3400.0 131.981 2300.0 132.8494 2400.0 133.0284 59000.0 133.2846 2400.0 135.0441 22000.0 136.0518 110000.0 136.827 2400.0 137.0502 2400.0 137.0596 1400000.0 139.0751 29000.0 143.049 21000.0 143.0858 6300.0 144.0575 3700.0 145.0647 23000.0 146.0724 2600.0 147.0445 5700.0 147.0803 2700.0 148.0516 3400.0 149.0595 62000.0 151.0386 25000.0 151.0753 1000000.0 151.0866 2900.0 153.0541 9200.0 157.0648 80000.0 158.0725 39000.0 158.9876 2500.0 159.081 7000.0 160.052 38000.0 161.0596 28000.0 162.0667 3000.0 163.0753 64000.0 165.0547 63000.0 165.0909 67000.0 167.0699 6100.0 171.0807 17000.0 172.0884 95000.0 173.0597 23000.0 173.0975 2900.0 173.524 26000.0 173.5376 67000.0 174.0676 120000.0 175.0755 280000.0 176.0853 3200.0 177.0547 110000.0 177.0911 65000.0 178.0586 14000.0 179.0703 130000.0 181.0645 6300.0 185.059 6900.0 186.0674 27000.0 187.0754 240000.0 188.0832 240000.0 189.091 290000.0 190.0985 26000.0 190.6228 2300.0 191.0702 89000.0 191.1066 29000.0 193.086 35000.0 194.7189 2500.0 194.7634 2600.0 199.0753 32000.0 201.0911 840000.0 201.1129 16000.0 202.0791 3100.0 202.0983 38000.0 203.0857 5300.0 203.1067 260000.0 204.8885 4300.0 205.0858 13000.0 205.9473 2600.0 210.068 4700.0 211.0748 8800.0 213.0911 87000.0 214.1012 2600.0 214.8737 18000.0 215.0857 5300.0 215.1074 2600.0 216.0776 7300.0 217.086 63000.0 218.8686 13000.0 219.0807 12000.0 219.1038 3100.0 220.088 2600.0 221.094 2600.0 224.0828 15000.0 225.0911 180000.0 226.0626 3000.0 227.0693 12000.0 231.0795 27000.0 231.1017 240000.0 233.0526 2300.0 233.0962 81000.0 234.1041 28000.0 239.0704 53000.0 239.1064 6600.0 240.0782 13000.0 241.086 230000.0 242.0942 16000.0 244.088 11000.0 245.0958 55000.0 245.14 2700.0 246.1037 110000.0 247.0751 66000.0 247.1127 5000.0 248.0828 16000.0 249.0912 20000.0 250.0988 15000.0 251.0725 2600.0 251.1064 30000.0 253.0857 130000.0 254.0627 15000.0 254.0936 680000.0 254.1247 14000.0 255.0649 110000.0 255.1011 68000.0 257.1154 3100.0 258.0664 3300.0 259.0743 17000.0 260.082 6200.0 260.4779 2400.0 261.0907 230000.0 262.0986 240000.0 263.0739 24000.0 263.1064 91000.0 264.0774 7200.0 264.1132 22000.0 265.0885 21000.0 265.1223 66000.0 266.0946 2800.0 267.102 31000.0 267.1377 11000.0 268.109 26000.0 269.0478 4800.0 269.0807 740000.0 269.1075 4200.0 269.1159 3600.0 270.0546 4700.0 270.0885 530000.0 270.1208 6000.0 272.8803 2800.0 273.0911 70000.0 274.0988 220000.0 275.0704 56000.0 275.1066 170000.0 276.0787 7100.0 276.1146 7800.0 277.0877 40000.0 277.1223 280000.0 278.0938 82000.0 278.1259 5800.0 279.1016 190000.0 280.1095 25000.0 281.0816 14000.0 281.1151 7700.0 281.539 3200.0 282.0885 83000.0 283.0964 23000.0 284.1044 1800000.0 284.1321 5000.0 284.1428 3900.0 285.1123 440000.0 285.1483 4100.0 289.0858 34000.0 289.1214 25000.0 290.0938 260000.0 290.8899 2600.0 291.1017 610000.0 291.1388 5600.0 292.075 2700.0 292.1095 21000.0 293.082 16000.0 293.1174 230000.0 294.0905 4200.0 294.1253 160000.0 295.0962 100000.0 295.1309 26000.0 296.1042 24000.0 296.1392 3200.0 297.1123 500000.0 297.1501 5300.0 298.1195 11000.0 304.1093 13000.0 305.077 5600.0 305.1173 690000.0 305.1476 2500.0 305.1584 3200.0 306.1252 700000.0 307.0589 4200.0 307.0966 340000.0 307.1343 7900.0 308.1047 28000.0 308.9005 68000.0 309.1125 61000.0 310.0793 4900.0 310.1199 400000.0 311.128 77000.0 319.1327 31000.0 321.1123 52000.0 322.1199 310000.0 324.1354 15000.0 325.1057 3100.0 325.1432 95000.0 337.1432 180000.0 355.1532 2800.0 END IONS BEGIN IONS SCANS=415 PEPMASS=312.1212 CHARGE=1 COLLISION_ENERGY=0.0 48.5759 2200.0 52.4638 2200.0 53.4598 2500.0 53.5886 2000.0 54.0216 3000.0 55.2701 2700.0 55.942 2500.0 61.2105 2000.0 67.0504 2200.0 69.0697 3000.0 70.7462 2400.0 72.8426 2100.0 74.4243 2200.0 77.7304 2200.0 78.7095 2100.0 79.2457 2200.0 82.9041 2300.0 93.6971 2400.0 94.1089 2700.0 94.9957 2400.0 97.7265 2100.0 98.5913 2700.0 101.2819 2800.0 104.0605 2100.0 112.0537 2300.0 112.0755 7400.0 112.1851 2400.0 112.3974 2600.0 117.7734 2300.0 120.365 2500.0 122.0575 15000.0 123.7249 2400.0 125.0171 2700.0 128.4594 2500.0 130.69 2500.0 133.0123 2500.0 134.7034 2500.0 140.6333 2200.0 141.069 2300.0 145.4997 2600.0 155.6104 2300.0 169.0646 6000.0 173.526 63000.0 173.542 35000.0 191.0696 3500.0 218.0699 3200.0 224.2785 2600.0 228.9928 2300.0 231.4903 2200.0 251.1286 2800.0 251.2878 2600.0 262.6259 2600.0 278.8423 2300.0 284.3403 2300.0 286.6907 2500.0 312.1209 64000.0 END IONS BEGIN IONS SCANS=416 PEPMASS=290.1392 CHARGE=1 COLLISION_ENERGY=0.0 47.7662 4900.0 47.7676 41000.0 50.757 2200.0 52.0279 2200.0 52.1454 2200.0 52.3102 2100.0 53.6914 2100.0 54.7082 2300.0 59.1438 2300.0 63.5296 2300.0 79.0541 33000.0 79.1853 2300.0 83.44 2400.0 86.6327 2300.0 87.2104 2500.0 90.0916 2800.0 90.5867 2400.0 91.0542 33000.0 100.0757 37000.0 101.9244 2100.0 103.0541 64000.0 105.0334 18000.0 105.0698 95000.0 108.0543 2100.0 111.4639 2300.0 111.9762 2200.0 112.4293 2500.0 115.0543 2400.0 118.0416 15000.0 118.5248 2300.0 119.0491 55000.0 120.057 43000.0 122.9821 2400.0 128.0462 2300.0 132.0569 120000.0 133.0285 47000.0 133.0647 110000.0 135.0803 41000.0 135.9671 3000.0 146.0364 22000.0 147.0441 51000.0 148.0518 400000.0 152.4822 3200.0 160.0517 210000.0 161.0595 53000.0 163.0592 17000.0 163.0753 1900000.0 168.9011 2400.0 173.5296 81000.0 173.5433 24000.0 175.0395 3000.0 176.0469 260000.0 191.0183 6900.0 191.0297 56000.0 191.0703 9200000.0 191.1019 15000.0 191.1113 43000.0 192.0732 2900.0 205.0499 6000.0 218.0565 2800.0 219.5424 2600.0 235.8703 2900.0 235.9046 2400.0 276.774 2800.0 288.7917 2400.0 298.221 3300.0 END IONS BEGIN IONS SCANS=417 PEPMASS=208.0439 CHARGE=1 COLLISION_ENERGY=0.0 41.9989 2500.0 43.5056 2200.0 49.2153 2300.0 50.6305 2300.0 56.7315 2500.0 57.1722 2300.0 58.7291 2300.0 59.5123 2600.0 59.6785 2400.0 59.7155 2300.0 59.9775 2400.0 62.3521 2200.0 65.6049 2600.0 69.0922 2700.0 69.8968 2200.0 70.6314 2400.0 74.6316 2300.0 78.8735 2500.0 84.9593 74000.0 87.357 2900.0 91.0541 2500.0 91.4286 2200.0 95.1118 2200.0 96.1833 2700.0 102.9202 2400.0 102.9696 4900.0 109.7755 2400.0 110.7536 2700.0 111.3582 2200.0 115.206 2500.0 115.9638 12000.0 116.1051 2400.0 116.961 5600.0 118.7829 2400.0 123.9658 2500.0 127.2121 2300.0 130.5461 2300.0 139.3409 2400.0 141.8765 2200.0 144.8033 2500.0 149.0584 2700.0 149.808 2300.0 157.1596 2500.0 165.0435 4400.0 165.6033 2600.0 170.6631 2400.0 173.5275 100000.0 173.5416 41000.0 184.9689 3500.0 257.8578 2500.0 282.0181 3000.0 293.761 2700.0 297.1691 2700.0 356.1404 3000.0 END IONS BEGIN IONS SCANS=418 PEPMASS=436.0645 CHARGE=1 COLLISION_ENERGY=0.0 55.8912 2400.0 68.8669 2500.0 72.522 2400.0 98.8213 2400.0 139.637 2600.0 173.5257 7400.0 183.1141 2600.0 190.0618 5600.0 191.0661 7800.0 193.0856 4900.0 194.0906 5300.0 205.0489 4900.0 206.0536 8300.0 221.0564 4000.0 221.0809 84000.0 222.0844 120000.0 222.1093 5300.0 223.0882 7000.0 237.07 3900.0 273.1313 10000.0 274.1081 12000.0 275.111 40000.0 289.1316 7600.0 290.1345 40000.0 302.1026 5000.0 303.1059 19000.0 317.1266 7600.0 318.1295 50000.0 335.1277 2400.0 434.3537 2900.0 END IONS BEGIN IONS SCANS=419 PEPMASS=207.0437 CHARGE=1 COLLISION_ENERGY=0.0 42.8969 2200.0 43.0543 2300.0 57.9346 3500.0 74.9372 3200.0 91.5989 2100.0 97.9532 5700.0 98.961 11000.0 102.9559 5000.0 115.9638 100000.0 116.9716 31000.0 133.9742 6500.0 134.5491 2400.0 137.8294 2200.0 147.5058 2600.0 164.0424 4900.0 173.5359 4600.0 190.9653 2400.0 192.0374 3600.0 207.1753 2700.0 END IONS BEGIN IONS SCANS=420 PEPMASS=422.0549 CHARGE=1 COLLISION_ENERGY=0.0 61.4475 2800.0 62.1763 2400.0 64.8326 2300.0 68.084 3100.0 72.5348 2300.0 87.8647 2400.0 89.5733 2300.0 100.1854 2600.0 114.9167 2600.0 118.2989 2600.0 149.6662 3300.0 149.681 4100.0 149.6889 13000.0 149.6976 4300.0 168.3426 2400.0 172.9783 3700.0 173.5315 15000.0 181.0858 16000.0 186.9575 12000.0 221.0814 16000.0 238.4325 2400.0 241.9905 2800.0 246.5742 2800.0 304.999 3500.0 308.3838 3000.0 320.0242 8800.0 335.0464 14000.0 338.8463 2400.0 388.6261 3100.0 END IONS BEGIN IONS SCANS=421 PEPMASS=760.3339 CHARGE=1 COLLISION_ENERGY=0.0 70.0648 290000.0 86.0962 27000.0 87.409 2200.0 89.1825 2600.0 89.8657 2500.0 95.1867 2500.0 97.0759 3200.0 98.797 2600.0 115.0862 33000.0 118.0647 7200.0 120.0707 3300.0 120.0804 160000.0 124.9996 15000.0 125.0706 27000.0 136.0756 7000.0 146.0598 39000.0 146.6981 2200.0 147.6681 2300.0 162.091 12000.0 164.0709 9900.0 172.112 46000.0 173.5202 3100.0 173.53 32000.0 173.5387 14000.0 174.0548 8200.0 182.081 10000.0 184.0458 2900.0 184.0733 330000.0 185.0767 46000.0 186.0779 15000.0 187.1235 2900.0 188.4652 2500.0 190.0623 2700.0 215.118 8300.0 216.1259 48000.0 217.1336 36000.0 221.0809 23000.0 236.1075 12000.0 243.1132 34000.0 265.0847 4700.0 265.1326 10000.0 277.1342 11000.0 282.1131 23000.0 289.1321 6300.0 293.1306 16000.0 296.3721 2500.0 309.1242 33000.0 317.1264 25000.0 329.1508 7100.0 339.1335 3200.0 355.1307 9600.0 385.6527 2400.0 417.1298 2500.0 417.1836 21000.0 429.1825 9300.0 458.21 4000.0 477.964 2500.0 502.1989 42000.0 543.2609 4300.0 END IONS BEGIN IONS SCANS=422 PEPMASS=464.0596 CHARGE=1 COLLISION_ENERGY=0.0 89.3581 2700.0 120.353 2200.0 121.8007 2300.0 173.5331 32000.0 177.055 2700.0 181.0878 2400.0 190.0622 11000.0 191.066 3300.0 193.0852 9700.0 194.0912 5900.0 195.0975 3500.0 205.0491 7700.0 206.0545 7900.0 221.0808 140000.0 222.0843 100000.0 223.0888 2900.0 236.0672 4500.0 237.0706 4500.0 272.1265 4700.0 273.1324 8400.0 274.1074 21000.0 275.111 38000.0 289.1315 15000.0 290.1344 39000.0 302.1019 7000.0 303.106 19000.0 317.1258 17000.0 318.1292 53000.0 321.0264 2500.0 336.0488 7800.0 END IONS BEGIN IONS SCANS=423 PEPMASS=426.0669 CHARGE=1 COLLISION_ENERGY=0.0 68.7647 2200.0 69.6672 2400.0 78.7807 2400.0 89.0012 2800.0 96.8536 2500.0 110.7516 2800.0 128.3629 2300.0 150.2023 2200.0 162.0674 23000.0 163.0391 3400.0 168.9965 2600.0 173.5351 37000.0 178.0625 16000.0 189.0547 12000.0 190.0624 130000.0 191.0335 22000.0 191.0708 12000.0 193.086 99000.0 205.0856 13000.0 206.0575 46000.0 220.8858 2400.0 221.0453 3600.0 221.081 540000.0 221.7955 2500.0 222.0851 11000.0 287.3685 2500.0 354.3951 2800.0 382.0804 3500.0 END IONS BEGIN IONS SCANS=424 PEPMASS=345.0935 CHARGE=1 COLLISION_ENERGY=0.0 67.2523 2400.0 67.8676 2200.0 72.4631 2000.0 72.6777 2500.0 74.6668 2300.0 76.1174 2700.0 82.6275 2400.0 84.8658 2300.0 85.6642 2600.0 89.2644 2100.0 130.0416 2400.0 140.1195 2400.0 147.0441 19000.0 149.6877 5600.0 150.0674 2600.0 151.1216 2200.0 153.2336 2500.0 160.053 2900.0 161.06 5300.0 162.0674 49000.0 163.0389 24000.0 163.0753 3900.0 173.5255 17000.0 173.5372 24000.0 174.0309 3900.0 175.039 14000.0 176.0468 10000.0 177.0545 6100.0 178.0625 52000.0 189.0545 26000.0 190.0429 3500.0 190.0624 280000.0 191.0339 59000.0 191.068 27000.0 193.0656 2700.0 193.086 210000.0 194.0896 4600.0 206.0576 98000.0 221.081 1200000.0 222.0845 68000.0 249.0324 39000.0 267.0428 57000.0 356.0226 3800.0 372.0555 6300.0 375.0407 11000.0 397.1961 2500.0 414.5987 2400.0 469.1103 3200.0 520.0839 2400.0 629.2126 2400.0 680.0906 2600.0 END IONS BEGIN IONS SCANS=425 PEPMASS=463.0564 CHARGE=1 COLLISION_ENERGY=0.0 58.7344 2200.0 60.5699 2300.0 62.2337 2400.0 66.0394 2400.0 66.7162 2100.0 69.9997 2300.0 71.0725 2100.0 71.1396 2500.0 71.9894 2600.0 72.332 2900.0 74.1712 2800.0 75.6361 2600.0 76.9002 2300.0 79.2706 2200.0 81.0336 13000.0 81.2545 2600.0 88.0582 2500.0 88.1935 2400.0 93.4462 2100.0 95.9074 2100.0 96.0443 24000.0 97.5205 2000.0 98.0601 7000.0 100.2269 2500.0 103.209 2500.0 104.1997 2400.0 104.3321 2400.0 112.1032 2400.0 112.305 2400.0 114.0807 2600.0 116.4865 2500.0 117.0685 2200.0 120.148 2900.0 121.5198 2500.0 124.9301 2300.0 128.0871 2300.0 131.269 2900.0 135.9315 2300.0 141.2564 2200.0 143.6214 2300.0 144.7543 2600.0 147.0436 2200.0 147.0809 2600.0 149.0587 2900.0 149.6926 5800.0 158.035 2600.0 162.0675 34000.0 163.0769 5100.0 168.077 5300.0 168.7355 2700.0 169.4518 2700.0 171.9708 6500.0 172.9777 42000.0 173.5304 110000.0 173.541 21000.0 173.9859 3700.0 175.0386 2900.0 177.0548 68000.0 178.0626 19000.0 178.108 2600.0 179.0703 32000.0 181.0858 95000.0 186.4349 2200.0 186.9571 77000.0 189.0545 22000.0 189.645 2900.0 190.0624 200000.0 191.0343 37000.0 191.0703 47000.0 192.0778 71000.0 193.0859 180000.0 194.0937 110000.0 195.0641 11000.0 195.1027 3100.0 205.0495 400000.0 206.0572 76000.0 206.0774 3200.0 220.073 100000.0 220.0947 9200.0 221.0808 5200000.0 221.0999 10000.0 222.0875 150000.0 222.1093 3000.0 222.1859 2500.0 234.0763 59000.0 236.0679 150000.0 237.1615 2300.0 246.1129 32000.0 255.9656 2400.0 256.0049 2800.0 257.0065 2500.0 257.5792 2200.0 258.1126 36000.0 260.1282 48000.0 261.1356 25000.0 262.0161 3000.0 269.9853 3200.0 270.076 9800.0 271.029 2500.0 272.128 330000.0 273.0447 2600.0 274.0725 22000.0 274.1074 1600000.0 274.1422 21000.0 274.1574 3500.0 275.2202 3000.0 286.1078 57000.0 288.1238 3200.0 289.0769 3200.0 289.0937 9800.0 289.1308 1400000.0 289.1592 6100.0 289.1698 11000.0 293.2161 2400.0 297.9784 2700.0 299.9971 2800.0 302.0621 2900.0 302.1023 750000.0 302.1358 2400.0 302.142 7100.0 305.0002 15000.0 307.0185 3000.0 317.0825 9500.0 317.1256 1800000.0 317.1695 20000.0 319.0137 4000.0 320.0227 76000.0 321.0258 2400.0 335.0464 230000.0 350.0698 36000.0 351.7005 2900.0 361.0302 2800.0 363.0408 77000.0 376.0495 3500.0 378.0656 42000.0 440.9575 2600.0 END IONS BEGIN IONS SCANS=426 PEPMASS=435.0615 CHARGE=1 COLLISION_ENERGY=0.0 57.0403 2400.0 57.9131 2200.0 58.0549 2600.0 58.8685 4600.0 61.1539 2800.0 62.6123 2400.0 65.7743 2400.0 66.402 2400.0 66.4162 2200.0 68.3325 2400.0 69.9514 2100.0 69.9847 2600.0 71.5864 2200.0 73.3384 2300.0 74.7777 2200.0 77.0559 2300.0 80.88 2800.0 81.0333 24000.0 81.1116 2300.0 81.8605 2500.0 81.9953 2400.0 82.0771 2300.0 82.6364 2400.0 83.4642 2500.0 85.4497 2300.0 88.8499 2500.0 92.7646 2400.0 93.7986 2600.0 96.0442 15000.0 96.1919 2400.0 96.2327 2400.0 98.0602 7400.0 98.4511 2400.0 100.2693 2700.0 100.4267 2300.0 107.3644 2500.0 112.9663 2500.0 113.4211 2300.0 113.7368 2500.0 117.3638 2700.0 119.103 2300.0 120.3158 2500.0 147.0436 3000.0 151.4472 2500.0 151.9128 2700.0 152.8594 2600.0 153.2533 2200.0 161.0607 3000.0 162.0675 49000.0 163.0395 11000.0 168.0769 2800.0 173.5283 120000.0 173.5443 24000.0 175.039 18000.0 176.0463 6000.0 177.0548 71000.0 178.0622 36000.0 179.0701 28000.0 187.7707 2400.0 189.0547 44000.0 190.0624 360000.0 190.0809 4600.0 191.0338 62000.0 191.0688 98000.0 192.0781 72000.0 193.0861 290000.0 194.093 140000.0 195.0649 9100.0 195.1007 3100.0 200.2941 2500.0 203.4987 2300.0 205.0496 410000.0 206.0573 130000.0 207.063 8800.0 214.0285 8700.0 220.0733 120000.0 220.0946 13000.0 221.0307 10000.0 221.0809 5900000.0 221.1302 4400.0 222.0855 360000.0 222.3596 2200.0 233.8663 2500.0 234.0767 53000.0 235.6414 2600.0 236.0679 140000.0 246.113 25000.0 250.9996 29000.0 258.1124 32000.0 260.1279 52000.0 261.1356 30000.0 266.023 22000.0 270.0764 13000.0 272.1281 320000.0 273.1366 3000.0 274.072 15000.0 274.1075 1600000.0 274.142 11000.0 274.1581 3100.0 278.995 76000.0 286.1072 65000.0 288.1215 3200.0 289.0939 8400.0 289.1309 1400000.0 289.1692 6900.0 302.0619 8500.0 302.1024 740000.0 305.1607 2700.0 308.2385 2500.0 315.0189 43000.0 316.1154 3800.0 317.066 12000.0 317.0831 8800.0 317.1258 1700000.0 317.1694 19000.0 318.0435 3400.0 330.0426 62000.0 330.084 2600.0 333.0294 13000.0 338.0081 7200.0 348.0531 7700.0 358.0364 11000.0 377.6124 2900.0 395.9898 2800.0 432.4557 2900.0 441.4247 2400.0 END IONS BEGIN IONS SCANS=427 PEPMASS=346.0938 CHARGE=1 COLLISION_ENERGY=0.0 67.024 2300.0 72.2162 2100.0 73.1891 2100.0 73.4074 2600.0 76.1119 2800.0 84.8442 2400.0 85.1042 2400.0 86.3864 2600.0 89.024 2300.0 90.786 2500.0 92.3821 2200.0 93.1195 2100.0 93.5534 2700.0 95.1948 2200.0 97.4706 2500.0 99.3122 2300.0 104.2274 2100.0 107.6452 2300.0 108.3148 2400.0 110.1568 2100.0 110.899 2500.0 111.1717 2100.0 120.3813 2400.0 121.0643 2600.0 123.2803 2500.0 131.0756 2600.0 133.0642 2900.0 134.6268 2600.0 138.5217 2200.0 147.0438 30000.0 149.684 9800.0 149.6946 9500.0 152.0491 2700.0 154.3428 2300.0 161.0597 5400.0 162.0672 80000.0 163.0386 36000.0 163.0745 8100.0 171.3688 2500.0 173.5271 23000.0 173.5356 38000.0 175.039 27000.0 176.0469 15000.0 177.0545 7200.0 178.0622 85000.0 189.054 30000.0 190.0429 3400.0 190.0622 390000.0 191.0335 91000.0 191.067 65000.0 192.04 3100.0 193.0674 4600.0 193.0857 290000.0 194.0894 32000.0 206.0573 140000.0 207.0612 3700.0 211.9458 2700.0 221.0808 1700000.0 222.0843 200000.0 223.0865 47000.0 232.2604 2900.0 239.4087 2400.0 274.1085 8800.0 280.9966 2900.0 317.0566 3400.0 319.0713 21000.0 321.2934 2500.0 333.0476 6100.0 359.032 2800.0 360.037 14000.0 374.0534 20000.0 376.0779 2300.0 389.3996 2400.0 392.0612 2700.0 411.1988 2900.0 422.7998 2400.0 441.4715 2400.0 528.9417 2700.0 589.2762 2600.0 END IONS BEGIN IONS SCANS=428 PEPMASS=459.0617 CHARGE=1 COLLISION_ENERGY=0.0 61.0717 2700.0 81.9173 2300.0 162.067 8000.0 163.0749 2900.0 167.0031 3400.0 173.5289 14000.0 175.0758 3500.0 176.083 11000.0 179.07 15000.0 180.9827 9900.0 181.0856 7500.0 181.9898 3000.0 182.998 13000.0 189.0554 3700.0 190.0623 48000.0 191.0333 6500.0 191.0701 21000.0 191.9736 3200.0 192.9808 3400.0 193.0857 36000.0 194.0938 10000.0 197.0134 12000.0 197.9848 3500.0 198.993 8600.0 205.0856 8200.0 206.0575 19000.0 207.0664 3300.0 207.1016 39000.0 210.9936 22000.0 221.0809 390000.0 222.0883 23000.0 229.0036 23000.0 238.0669 2700.0 247.0151 3700.0 310.5525 2500.0 324.4321 2800.0 326.0097 3800.0 327.0178 3900.0 327.0563 14000.0 331.0512 11000.0 334.0382 4800.0 338.0509 2700.0 341.0355 3700.0 342.0791 7000.0 344.0204 9100.0 345.029 3000.0 349.0608 2800.0 356.0593 21000.0 358.0366 4400.0 359.046 51000.0 362.0331 8300.0 374.0701 7300.0 377.0561 30000.0 388.0492 8400.0 418.0596 2900.0 END IONS BEGIN IONS SCANS=429 PEPMASS=420.0594 CHARGE=1 COLLISION_ENERGY=0.0 57.3475 2200.0 58.245 2300.0 59.0936 2400.0 60.9861 2400.0 62.2697 2200.0 62.8543 2500.0 63.4986 2500.0 65.9973 2300.0 67.6253 2400.0 70.515 2300.0 74.2815 2700.0 78.6605 2500.0 87.96 2200.0 88.2857 2400.0 92.3413 2300.0 93.7038 2400.0 94.4986 2100.0 97.9121 2600.0 102.652 2200.0 105.323 2300.0 105.7703 2700.0 105.9817 2300.0 106.2355 2800.0 112.9429 2300.0 115.1892 2500.0 125.3305 2800.0 135.3821 2400.0 138.6445 2600.0 142.1643 2400.0 147.0804 6000.0 149.0232 2500.0 152.7717 2300.0 152.9724 8200.0 153.4349 2300.0 157.7789 2400.0 162.0673 5100.0 169.9745 23000.0 170.9824 92000.0 171.9903 25000.0 172.9978 11000.0 173.5247 21000.0 173.5349 94000.0 173.5419 8700.0 178.062 2900.0 180.978 7900.0 181.0858 170000.0 184.9616 140000.0 190.0623 51000.0 191.0677 11000.0 192.0681 2700.0 193.0858 35000.0 194.0893 6000.0 204.8208 2500.0 206.0579 9200.0 212.2841 2600.0 213.8401 2600.0 221.0809 230000.0 222.0844 66000.0 223.0864 77000.0 225.9763 2600.0 229.0771 2400.0 229.4311 2500.0 232.4762 2400.0 237.0068 5700.0 239.9934 14000.0 243.3525 2100.0 253.2825 2600.0 253.9723 13000.0 254.01 2700.0 256.0256 12000.0 256.8351 2500.0 259.1283 2500.0 267.988 6200.0 270.0037 15000.0 271.7592 2900.0 295.9842 7100.0 303.0042 47000.0 317.0182 19000.0 318.0275 120000.0 319.0356 2900.0 329.4114 2500.0 331.0355 5000.0 333.0509 170000.0 346.0222 8900.0 354.161 2600.0 361.0462 68000.0 379.0603 3300.0 399.7035 2600.0 END IONS BEGIN IONS SCANS=430 PEPMASS=503.1587 CHARGE=1 COLLISION_ENERGY=0.0 85.8794 2200.0 91.3611 2400.0 93.9157 2600.0 102.534 2600.0 147.0441 2900.0 149.6875 7100.0 149.6988 4800.0 162.067 6600.0 163.0393 4000.0 173.5334 7000.0 175.0399 4000.0 178.0631 4000.0 187.0438 2900.0 189.0546 6500.0 190.0622 64000.0 191.0339 11000.0 191.069 6500.0 193.0857 53000.0 206.0574 20000.0 221.0807 1100000.0 221.1319 8100.0 222.0842 25000.0 248.0357 6900.0 249.0322 24000.0 266.0447 3000.0 266.1377 2300.0 267.0424 30000.0 340.1135 3700.0 344.5939 7500.0 345.0927 21000.0 357.0293 3600.0 371.0558 6800.0 372.0531 16000.0 375.041 6200.0 389.0684 3000.0 390.0639 13000.0 467.108 4000.0 468.1077 38000.0 469.0291 5300.0 469.1051 130000.0 469.1638 2400.0 485.1193 2500.0 486.1189 5800.0 487.1153 40000.0 END IONS BEGIN IONS SCANS=431 PEPMASS=343.1245 CHARGE=1 COLLISION_ENERGY=0.0 51.9112 2700.0 52.5339 2200.0 52.7735 2300.0 53.2835 2600.0 54.5167 2800.0 56.2068 2300.0 60.9711 2500.0 61.0166 2600.0 64.9789 2500.0 73.174 2500.0 75.8407 2300.0 78.4318 2300.0 84.1678 2100.0 84.6097 2200.0 85.4794 2300.0 91.7002 2600.0 96.7445 2600.0 127.8625 2800.0 131.3258 2400.0 133.054 2800.0 147.4984 2500.0 149.6839 10000.0 149.6948 11000.0 149.7056 3300.0 155.4704 2500.0 163.6428 2500.0 173.5217 22000.0 173.5367 76000.0 174.6553 2500.0 188.2211 2500.0 207.5538 2400.0 207.6844 2300.0 267.4292 2500.0 277.3464 2800.0 287.2596 2700.0 298.7066 2200.0 343.1237 2800.0 END IONS BEGIN IONS SCANS=432 PEPMASS=654.7352 CHARGE=1 COLLISION_ENERGY=0.0 97.8783 2700.0 116.9995 2600.0 120.4581 2900.0 149.6836 6800.0 149.6956 5400.0 154.0179 6200.0 162.0678 3800.0 172.0277 4200.0 173.5296 5400.0 180.3922 2500.0 190.0624 25000.0 191.0341 3400.0 191.0654 4000.0 193.0859 23000.0 194.0897 4000.0 206.0573 5800.0 221.081 260000.0 222.0846 48000.0 233.0602 13000.0 239.4126 3400.0 251.0703 20000.0 252.0722 3300.0 274.1073 7000.0 289.1312 12000.0 302.1015 4100.0 317.1262 18000.0 323.4176 3300.0 337.1082 27000.0 337.6089 24000.0 337.6454 3000.0 339.7097 2700.0 346.1144 4000.0 356.0811 35000.0 357.0846 14000.0 374.0912 24000.0 375.0957 6100.0 453.1345 54000.0 453.201 4100.0 454.1375 29000.0 471.1455 9800.0 472.1458 3900.0 END IONS BEGIN IONS SCANS=433 PEPMASS=418.0589 CHARGE=1 COLLISION_ENERGY=0.0 54.7366 2300.0 62.4903 2300.0 63.3803 2200.0 66.4638 2300.0 67.4131 2200.0 68.9007 2700.0 73.6482 2600.0 92.6239 2300.0 99.9058 2900.0 103.2616 2400.0 108.227 2500.0 110.3922 2100.0 128.3749 2600.0 133.0646 2700.0 146.9861 2400.0 147.0439 12000.0 153.9949 16000.0 159.6009 2300.0 161.059 3800.0 162.0672 56000.0 163.0391 9500.0 163.075 23000.0 163.9833 2400.0 167.9746 2300.0 169.9902 18000.0 170.9975 6800.0 173.5227 18000.0 173.5373 55000.0 173.5427 3600.0 174.0316 3200.0 175.0387 9000.0 176.0471 8800.0 176.7469 2400.0 177.0542 4600.0 178.0624 57000.0 181.0858 66000.0 189.0544 45000.0 190.0427 4300.0 190.0623 410000.0 191.0338 80000.0 191.0522 2300.0 191.0702 73000.0 193.0655 6900.0 193.0858 330000.0 197.9847 18000.0 206.0573 150000.0 206.447 2700.0 215.9228 2500.0 215.9938 2500.0 218.7966 2900.0 221.0809 2000000.0 221.1066 4400.0 223.0601 3300.0 248.9823 2400.0 249.9941 2900.0 264.0091 2800.0 273.0455 2300.0 285.1715 2700.0 293.0749 2600.0 298.0161 5500.0 299.0219 6300.0 304.0274 3600.0 311.9972 6500.0 314.0109 13000.0 316.0273 5000.0 318.0415 3300.0 326.0119 29000.0 328.0272 27000.0 328.9976 15000.0 330.0051 12000.0 330.0439 3500.0 331.0502 29000.0 332.0219 13000.0 334.0377 57000.0 344.0216 67000.0 345.0307 11000.0 347.0481 3400.0 349.0621 18000.0 358.037 28000.0 359.0455 95000.0 359.0917 4200.0 362.0325 76000.0 367.8093 2800.0 376.0478 3000.0 377.0563 150000.0 381.6749 2500.0 END IONS BEGIN IONS SCANS=434 PEPMASS=317.1269 CHARGE=1 COLLISION_ENERGY=0.0 50.8862 6600.0 52.4277 11000.0 53.0386 96000.0 53.3256 10000.0 55.2692 42000.0 55.7228 8600.0 56.0968 7100.0 59.2348 2300.0 59.5498 7600.0 60.6662 4800.0 61.7545 8200.0 62.2012 8600.0 64.5412 8300.0 68.6535 2200.0 68.957 6600.0 69.3165 2900.0 69.6913 8100.0 70.5155 8700.0 71.8881 8100.0 72.8681 9900.0 72.9529 3500.0 81.0334 500000.0 83.1672 4900.0 86.7273 8000.0 89.0384 8500.0 89.6662 2200.0 91.0543 71000.0 94.4518 6300.0 96.0442 98000.0 98.06 450000.0 102.704 9200.0 103.0543 33000.0 103.8067 2200.0 107.0498 2700.0 108.9371 5600.0 113.0886 2300.0 116.685 8300.0 117.0334 170000.0 118.0652 41000.0 119.049 110000.0 121.0647 6400.0 126.7604 2600.0 129.6036 2300.0 130.0415 67000.0 131.049 32000.0 131.712 9600.0 131.9669 3500.0 132.057 24000.0 133.0648 110000.0 134.0362 59000.0 135.0441 97000.0 137.0603 6600.0 138.4746 3500.0 145.0287 130000.0 146.0366 9800.0 146.06 320000.0 147.0441 450000.0 147.0684 8300.0 147.441 2400.0 148.0519 17000.0 149.0596 360000.0 150.0676 27000.0 151.075 59000.0 153.0535 6700.0 159.0442 9600.0 159.6004 3200.0 160.0519 98000.0 161.0596 260000.0 162.0315 40000.0 162.0531 34000.0 162.0676 1200000.0 163.039 340000.0 163.0756 210000.0 164.0466 3100.0 165.0908 17000.0 165.6425 5200.0 167.0702 36000.0 168.0779 10000.0 170.5191 4000.0 173.5083 9600.0 173.5234 59000.0 173.5366 450000.0 173.5469 6400.0 174.0312 140000.0 174.055 260000.0 175.0392 350000.0 176.047 230000.0 176.0704 53000.0 177.038 23000.0 177.0547 2200000.0 177.0721 25000.0 178.0625 1000000.0 178.086 190000.0 179.0704 520000.0 180.1873 11000.0 188.0466 61000.0 189.0547 700000.0 190.0304 13000.0 190.0624 6700000.0 190.0798 48000.0 191.0339 1300000.0 191.0565 7600.0 191.0703 680000.0 192.0434 27000.0 192.0781 450000.0 193.054 47000.0 193.0654 57000.0 193.086 5100000.0 193.1066 72000.0 193.4039 10000.0 194.0938 260000.0 195.0653 360000.0 196.8422 8700.0 201.869 2700.0 205.0497 2300000.0 205.07 13000.0 206.0351 13000.0 206.0575 2500000.0 206.08 160000.0 207.1514 10000.0 214.0866 140000.0 215.7351 11000.0 216.0642 21000.0 217.0862 12000.0 220.0735 52000.0 221.0163 3600.0 221.031 79000.0 221.0809 24000000.0 221.1 40000.0 221.1321 43000.0 222.076 40000.0 231.0891 130000.0 234.0761 640000.0 236.0679 160000.0 238.0863 2700.0 239.0937 42000.0 242.081 220000.0 242.1069 4000.0 243.0891 32000.0 244.0973 16000.0 246.1123 430000.0 256.0964 67000.0 257.1039 21000.0 258.1127 30000.0 259.0843 3500.0 260.1286 8200.0 265.8239 2600.0 270.075 20000.0 271.0827 39000.0 272.0938 4800.0 272.1283 540000.0 274.0725 12000.0 274.1076 9000000.0 286.1075 110000.0 288.1232 31000.0 289.1309 400000.0 302.1026 530000.0 317.126 48000.0 END IONS BEGIN IONS SCANS=435 PEPMASS=737.1861 CHARGE=1 COLLISION_ENERGY=0.0 116.5673 2100.0 131.0005 2200.0 137.8444 2500.0 147.0806 5900.0 152.9737 2600.0 162.0675 4700.0 169.9744 4600.0 170.9825 15000.0 171.9911 5800.0 173.537 29000.0 177.0909 4000.0 181.0861 34000.0 183.9899 2500.0 184.962 19000.0 186.0065 3200.0 190.062 11000.0 191.068 8800.0 192.0707 2700.0 193.0859 12000.0 194.0875 2800.0 205.0861 4700.0 206.0571 6900.0 209.0104 3000.0 221.0809 270000.0 222.0843 89000.0 223.0863 32000.0 237.0055 6100.0 239.0215 2800.0 241.0374 3100.0 246.4074 2700.0 254.007 3400.0 256.0262 8000.0 258.0422 5700.0 263.9924 3200.0 267.0161 2400.0 267.9888 4900.0 269.0315 6300.0 270.0031 5600.0 271.0464 7900.0 281.0348 2500.0 283.0116 2900.0 285.9998 2700.0 286.0374 13000.0 290.0338 3500.0 295.9809 4000.0 301.0256 5100.0 301.9254 2400.0 303.0044 6000.0 303.0395 4300.0 305.0196 6200.0 305.0566 4100.0 311.4079 2700.0 316.0476 7600.0 317.0186 11000.0 317.0572 11000.0 318.0271 36000.0 318.0639 4300.0 319.0346 9700.0 319.5997 2400.0 320.0408 3300.0 320.0791 6900.0 331.0374 10000.0 332.0503 3300.0 333.0039 5900.0 333.0504 200000.0 333.0975 3800.0 346.0199 5800.0 346.0604 6400.0 348.0738 85000.0 359.0399 11000.0 360.0475 13000.0 361.0454 73000.0 374.0547 19000.0 375.0721 3900.0 376.0688 110000.0 377.0545 7200.0 378.0586 8200.0 379.0591 7800.0 394.0784 4000.0 411.2636 2500.0 418.0585 3500.0 419.0599 4700.0 420.0624 9400.0 END IONS BEGIN IONS SCANS=436 PEPMASS=300.1234 CHARGE=1 COLLISION_ENERGY=0.0 47.5433 2100.0 50.3126 2500.0 50.9302 2300.0 52.9406 2200.0 53.0383 15000.0 54.7525 2400.0 55.0719 2300.0 55.7748 2500.0 55.8552 2300.0 59.3386 2400.0 59.8704 2500.0 60.2579 2200.0 61.8436 2200.0 62.7354 2300.0 64.7543 2900.0 66.9626 2200.0 69.9105 2100.0 70.1577 2500.0 71.2944 2300.0 72.0807 2400.0 72.211 2300.0 80.0492 13000.0 81.0331 370000.0 81.553 2000.0 83.4753 2500.0 89.8208 2500.0 98.3133 2600.0 100.1205 2200.0 103.0538 2100.0 104.7384 2100.0 107.5602 2500.0 108.8192 2800.0 114.5232 2400.0 118.379 2500.0 125.7567 3000.0 129.0038 2800.0 133.7683 2400.0 135.0442 6500.0 138.5549 2300.0 142.5053 2600.0 144.0565 6000.0 149.6846 11000.0 149.6946 8700.0 149.7071 3400.0 160.0515 31000.0 160.0757 8200.0 161.0832 27000.0 170.0604 5400.0 171.0675 24000.0 173.5311 92000.0 173.5414 21000.0 174.0547 25000.0 183.0803 7000.0 187.062 2600.0 188.0707 21000.0 189.0782 42000.0 197.8904 2500.0 198.0549 3400.0 199.0419 2000.0 199.0627 20000.0 202.0499 86000.0 204.0649 6500.0 217.0735 180000.0 220.0966 31000.0 232.0969 1300000.0 232.7917 2600.0 234.1446 2300.0 236.7184 2700.0 238.086 6200.0 239.0556 2800.0 239.0936 17000.0 242.0812 32000.0 249.7987 2400.0 256.0974 37000.0 257.1058 6800.0 260.4371 2700.0 270.0763 67000.0 271.0962 28000.0 284.0923 36000.0 285.1003 25000.0 291.6838 3000.0 300.1236 89000.0 END IONS BEGIN IONS SCANS=437 PEPMASS=206.0577 CHARGE=1 COLLISION_ENERGY=0.0 42.0156 2200.0 42.524 2100.0 44.3268 2500.0 45.0334 3700.0 45.5679 2100.0 45.8511 2200.0 47.717 2100.0 48.627 2500.0 49.4058 2100.0 49.4437 2600.0 49.4628 2200.0 49.9598 2200.0 50.5549 2200.0 51.035 2100.0 52.1206 2400.0 53.0075 2500.0 53.2198 2600.0 53.5894 2100.0 55.0176 7600.0 56.7143 2300.0 59.043 2100.0 61.1346 2200.0 61.2441 2300.0 61.7498 2300.0 63.2619 2300.0 64.3312 2100.0 67.5736 2800.0 68.2955 2700.0 68.9697 2600.0 68.9968 66000.0 73.0281 82000.0 73.3404 2300.0 77.0386 5800.0 78.0461 47000.0 79.054 98000.0 81.1208 2500.0 83.4029 2300.0 88.0753 2500.0 88.2877 2300.0 89.0384 19000.0 89.5731 2300.0 90.0463 2600.0 90.6342 2300.0 91.054 93000.0 92.0257 9600.0 95.0489 34000.0 98.3831 2400.0 98.6421 2500.0 100.742 2200.0 100.9419 2400.0 102.0461 81000.0 103.054 76000.0 103.5042 2200.0 104.0618 76000.0 105.0335 20000.0 107.0489 340000.0 107.424 2700.0 115.0551 2400.0 117.0332 37000.0 118.0411 44000.0 118.0935 2300.0 119.049 56000.0 120.0204 49000.0 120.0572 14000.0 121.0282 8700.0 121.0646 140000.0 126.2959 2400.0 130.0412 110000.0 130.0513 2300.0 131.0133 2700.0 131.049 140000.0 132.0568 82000.0 133.0283 93000.0 133.0647 13000.0 133.4686 2400.0 135.044 410000.0 135.0559 8900.0 138.0315 3100.0 138.1689 2500.0 138.2178 2500.0 138.8314 2500.0 141.8749 2300.0 145.0283 62000.0 145.0399 5800.0 146.0366 26000.0 147.0441 96000.0 148.0153 21000.0 148.0519 37000.0 149.0233 21000.0 149.0596 120000.0 149.6661 3000.0 149.6882 12000.0 149.6988 6300.0 151.9321 2300.0 159.044 27000.0 160.0518 41000.0 161.0231 25000.0 161.0599 23000.0 162.0314 7000.0 163.0231 18000.0 163.039 950000.0 163.0551 13000.0 169.1415 2500.0 171.529 2700.0 173.0236 4700.0 173.5082 4300.0 173.5228 33000.0 173.5386 64000.0 173.5516 4500.0 175.0389 35000.0 176.0107 63000.0 176.0473 39000.0 177.0549 81000.0 178.0627 210000.0 178.0805 3500.0 187.0391 8300.0 187.161 2600.0 188.0474 2400.0 191.0341 270000.0 191.0522 4200.0 205.0493 2900.0 206.0575 61000.0 206.1908 5500.0 END IONS BEGIN IONS SCANS=438 PEPMASS=690.1872 CHARGE=1 COLLISION_ENERGY=0.0 67.0675 2100.0 74.0167 2200.0 76.4583 2200.0 77.9599 2300.0 80.2257 2400.0 81.3503 2400.0 82.2761 3000.0 82.2899 2600.0 105.1982 2400.0 118.9636 2600.0 126.013 2500.0 135.0442 2300.0 146.4452 2500.0 149.6899 5400.0 151.0748 11000.0 164.3293 2700.0 173.5194 5700.0 173.5345 72000.0 176.7318 2100.0 177.0552 5400.0 187.8898 2800.0 190.0445 2700.0 190.0624 34000.0 193.0858 32000.0 200.1559 2200.0 200.7955 2600.0 206.0578 6200.0 206.1819 2500.0 221.0303 3100.0 221.0809 1300000.0 221.9705 2900.0 222.0847 24000.0 249.0322 75000.0 267.043 100000.0 299.5104 3000.0 357.0312 4600.0 358.0375 11000.0 372.054 34000.0 375.0411 20000.0 380.7485 2700.0 390.0636 19000.0 396.1369 2400.0 457.4067 2600.0 469.107 140000.0 469.1773 6900.0 470.1094 3400.0 487.1174 47000.0 505.0119 2700.0 END IONS BEGIN IONS SCANS=439 PEPMASS=735.1849 CHARGE=1 COLLISION_ENERGY=0.0 69.9947 2000.0 74.7919 2700.0 76.3088 2500.0 77.6432 2300.0 79.4985 2100.0 79.918 2900.0 81.3895 2500.0 86.9459 2500.0 90.8869 2000.0 96.7081 2200.0 102.2935 2300.0 114.1141 2200.0 118.9584 2300.0 119.0488 2800.0 121.2426 2300.0 125.7419 2100.0 127.8287 2300.0 133.0641 2600.0 135.0443 2600.0 138.8076 2000.0 147.044 28000.0 149.6758 3700.0 149.686 12000.0 149.6964 6900.0 153.9949 13000.0 161.0598 16000.0 162.0676 67000.0 163.039 23000.0 163.0753 27000.0 167.974 3200.0 169.9904 28000.0 171.3902 2400.0 173.5209 4300.0 173.5335 110000.0 175.0395 21000.0 176.047 6400.0 177.0546 10000.0 178.0627 55000.0 181.0859 100000.0 185.2944 3200.0 189.0546 49000.0 190.0431 2500.0 190.0625 520000.0 190.6023 2400.0 191.0341 86000.0 191.0702 240000.0 193.0653 2800.0 193.086 430000.0 197.985 72000.0 205.0861 67000.0 206.0576 180000.0 215.9961 7000.0 221.0166 12000.0 221.0306 61000.0 221.0407 13000.0 221.0809 11000000.0 221.1201 32000.0 221.132 51000.0 221.1468 12000.0 222.0845 100000.0 263.0004 3300.0 264.0035 2700.0 270.9668 2500.0 271.1531 2400.0 277.0151 9000.0 299.0227 4000.0 304.0269 3400.0 306.0441 2900.0 307.1691 2400.0 310.7662 2600.0 311.996 7700.0 314.0077 3300.0 316.0263 6300.0 318.0419 2600.0 326.012 48000.0 327.0186 14000.0 328.0275 49000.0 329.0348 12000.0 330.0046 11000.0 330.0478 4100.0 331.0505 330000.0 334.0378 52000.0 342.042 32000.0 343.0555 2600.0 344.0216 150000.0 344.0585 23000.0 345.0291 46000.0 346.0746 24000.0 347.0453 24000.0 349.0609 110000.0 358.0384 73000.0 358.9928 11000.0 359.007 7600.0 359.0452 1100000.0 359.0967 25000.0 360.0523 29000.0 361.0595 3000.0 362.0321 100000.0 362.0588 3900.0 362.0737 25000.0 364.0838 28000.0 371.7932 2600.0 372.0541 16000.0 374.0143 7500.0 374.069 450000.0 375.0418 18000.0 376.0495 3100.0 376.999 3300.0 377.0142 3200.0 377.0561 1100000.0 390.0637 11000.0 392.0799 200000.0 417.9926 3800.0 418.0111 2100.0 418.0589 550000.0 418.1245 3600.0 502.3071 2700.0 511.9328 2300.0 534.7039 2900.0 576.5334 2700.0 654.9898 2600.0 698.2972 2700.0 END IONS BEGIN IONS SCANS=440 PEPMASS=752.1874 CHARGE=1 COLLISION_ENERGY=0.0 70.8484 2300.0 94.8586 2500.0 100.3456 2400.0 120.9824 2400.0 135.0439 4900.0 137.2424 2300.0 141.7969 2900.0 148.9108 2300.0 149.6708 3000.0 149.6909 14000.0 151.0754 9000.0 154.6259 2800.0 161.096 2500.0 167.383 2200.0 172.7525 2100.0 173.0594 2900.0 173.5245 26000.0 173.5352 51000.0 173.5435 11000.0 176.1254 2400.0 177.0549 2900.0 178.0629 3600.0 180.4834 2700.0 181.002 2700.0 183.3415 2500.0 189.0554 3000.0 190.0623 43000.0 191.0338 2700.0 191.0702 9300.0 191.3557 2800.0 192.0781 3600.0 193.067 2400.0 193.0858 27000.0 194.0944 5300.0 201.9765 2900.0 203.667 2300.0 205.0498 24000.0 206.058 9700.0 220.0729 16000.0 221.0567 3800.0 221.0809 640000.0 222.0873 32000.0 234.9305 2600.0 236.068 21000.0 240.5964 2800.0 241.3189 2600.0 245.8944 2200.0 261.1353 2400.0 272.1287 43000.0 274.1075 110000.0 278.9939 9000.0 289.0943 3300.0 289.1309 270000.0 291.9996 2400.0 302.1027 81000.0 317.0597 4000.0 317.067 2600.0 317.0836 3800.0 317.1259 1300000.0 317.1695 6000.0 318.1267 2500.0 330.044 7000.0 338.0085 34000.0 358.0345 3800.0 392.7502 2800.0 432.2201 3000.0 436.7552 2800.0 438.7754 2500.0 446.4049 3000.0 470.1312 3300.0 478.557 2700.0 490.7456 2600.0 538.3663 2600.0 546.6264 2400.0 553.9721 2900.0 628.1152 2800.0 644.0045 2400.0 END IONS BEGIN IONS SCANS=441 PEPMASS=357.0932 CHARGE=1 COLLISION_ENERGY=0.0 118.31 2200.0 147.0441 2600.0 154.0169 7700.0 172.0282 4500.0 173.5275 8900.0 190.0625 14000.0 193.0858 11000.0 206.0569 2900.0 221.081 40000.0 233.059 3000.0 251.0705 4900.0 333.3409 2300.0 356.0827 3200.0 END IONS BEGIN IONS SCANS=442 PEPMASS=743.1928 CHARGE=1 COLLISION_ENERGY=0.0 70.9744 2700.0 80.0131 2100.0 84.447 2300.0 86.5945 2600.0 87.4012 2300.0 98.3111 2300.0 134.2498 2500.0 138.7108 2400.0 162.0678 5100.0 163.0386 2600.0 163.3254 2600.0 173.5264 52000.0 173.5396 37000.0 174.6421 2200.0 175.0396 2400.0 178.0622 6500.0 178.5326 2600.0 189.0554 6900.0 190.0623 62000.0 190.3351 2300.0 191.0341 5500.0 191.0686 3100.0 193.0859 52000.0 205.0857 27000.0 206.0578 23000.0 207.2451 2400.0 221.081 1300000.0 221.1068 3500.0 222.0845 21000.0 265.7924 2700.0 271.5688 2500.0 317.1262 12000.0 318.1314 6000.0 329.0144 42000.0 339.042 6300.0 367.0505 7200.0 367.9574 2900.0 370.0767 16000.0 380.0611 11000.0 382.0723 9900.0 385.0643 2700.0 398.0728 32000.0 400.0898 7300.0 426.0676 130000.0 531.1086 2500.0 551.5164 2800.0 571.9158 2300.0 628.3445 2700.0 702.933 2800.0 END IONS BEGIN IONS SCANS=443 PEPMASS=340.1158 CHARGE=1 COLLISION_ENERGY=0.0 50.6461 18000.0 51.2368 46000.0 54.7958 62000.0 54.9288 25000.0 59.9246 22000.0 60.1221 36000.0 60.831 47000.0 61.1988 39000.0 61.5019 21000.0 62.1763 41000.0 64.7705 43000.0 65.9207 55000.0 67.3299 54000.0 67.4213 75000.0 67.6441 60000.0 68.4646 59000.0 70.9272 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346.0942 330000.0 346.5943 94000.0 347.066 300000.0 348.0735 320000.0 349.0793 9400.0 351.0623 3200.0 359.0297 170000.0 360.0375 790000.0 361.0413 81000.0 365.0747 2400.0 372.0489 42000.0 373.0569 25000.0 373.9736 6600.0 373.9976 38000.0 374.0534 2300000.0 374.1092 24000.0 375.0573 340000.0 376.069 930000.0 377.0739 84000.0 378.0493 170000.0 379.0552 70000.0 390.0614 32000.0 391.0647 8100.0 392.0644 430000.0 393.0687 52000.0 394.0809 10000.0 407.0526 35000.0 467.5582 5100.0 469.1058 280000.0 470.1086 320000.0 470.9513 5900.0 471.106 6100000.0 472.1084 950000.0 472.1801 3400.0 487.1163 89000.0 488.1183 99000.0 489.1224 20000.0 568.5278 5300.0 821.8644 4200.0 850.2739 4700.0 852.6832 8600.0 1012.1895 4200.0 END IONS BEGIN IONS SCANS=449 PEPMASS=654.2336 CHARGE=1 COLLISION_ENERGY=0.0 139.7873 2300.0 140.4471 2000.0 149.6695 3400.0 149.6804 3100.0 149.6912 5800.0 149.711 2500.0 152.5227 2200.0 154.0173 31000.0 162.0674 18000.0 162.2163 2200.0 163.581 2200.0 165.3454 2400.0 168.2288 2300.0 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195.3383 2400.0 196.094 1100000.0 196.1244 3400.0 200.4365 2600.0 205.6877 2600.0 206.0571 100000.0 207.0607 300000.0 208.0626 620000.0 209.0655 710000.0 221.0809 520000.0 222.0586 21000.0 222.0844 1700000.0 222.11 5600.0 223.0598 5400.0 223.0865 3300000.0 223.138 3000.0 224.0379 4100.0 224.0891 4900000.0 224.116 9700.0 227.2908 2300.0 235.8435 2900.0 241.6922 2600.0 265.9282 2500.0 273.6423 2300.0 281.8108 2700.0 316.0755 2600.0 END IONS BEGIN IONS SCANS=455 PEPMASS=487.6817 CHARGE=1 COLLISION_ENERGY=0.0 78.2086 2200.0 79.9039 2000.0 88.9711 2200.0 90.4846 2200.0 91.9076 2500.0 96.2482 2100.0 105.1315 2600.0 115.7502 2300.0 118.7828 2700.0 120.3584 2600.0 130.1573 2500.0 147.044 14000.0 149.6881 6200.0 149.7092 3800.0 155.2031 2500.0 161.0587 2600.0 162.0674 46000.0 163.039 11000.0 163.0777 2500.0 168.7694 2300.0 173.5278 13000.0 173.5359 80000.0 175.0398 7300.0 177.0546 2500.0 178.0623 42000.0 189.0549 39000.0 190.0624 320000.0 191.0337 61000.0 191.0694 42000.0 193.0858 290000.0 193.2407 2300.0 194.0887 2900.0 206.0575 130000.0 220.3934 2200.0 221.0306 5300.0 221.0808 4800000.0 221.1468 3400.0 222.0842 270000.0 228.0862 7700.0 228.5883 2500.0 233.0775 2900.0 235.0927 50000.0 240.9324 2600.0 253.104 6000.0 257.3762 2600.0 264.666 2500.0 265.5699 2900.0 269.7893 2400.0 273.0803 36000.0 273.5822 8000.0 280.592 61000.0 281.0933 11000.0 289.5976 50000.0 290.0989 7600.0 325.5898 2800.0 329.0729 5400.0 329.1181 1100000.0 329.1654 6500.0 329.6194 380000.0 329.6874 2900.0 338.0768 5300.0 338.1233 440000.0 338.6244 140000.0 340.1059 77000.0 343.0894 12000.0 349.6298 22000.0 350.131 3300.0 358.1133 190000.0 359.1159 27000.0 365.4707 2600.0 392.9101 3300.0 428.6263 2700.0 437.1557 740000.0 438.1579 150000.0 448.7527 2500.0 455.1655 1400000.0 456.1679 290000.0 474.0577 2800.0 494.2832 2700.0 518.7738 2700.0 615.4286 2700.0 782.3442 2900.0 792.5682 2700.0 END IONS BEGIN IONS SCANS=456 PEPMASS=208.0438 CHARGE=1 COLLISION_ENERGY=0.0 42.0642 2100.0 42.169 2000.0 43.0633 2300.0 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160.052 48000.0 161.0233 2200.0 161.0599 82000.0 162.0513 3300.0 162.0557 2400.0 162.0675 520000.0 162.0823 7100.0 162.0903 2900.0 163.039 130000.0 163.0752 81000.0 165.0915 15000.0 167.0703 22000.0 172.6502 2300.0 173.5258 96000.0 173.5433 37000.0 174.0314 55000.0 175.0392 110000.0 176.047 86000.0 177.0548 110000.0 178.0626 440000.0 178.0807 14000.0 181.0861 26000.0 182.6768 3100.0 188.0469 27000.0 189.0349 2500.0 189.0548 300000.0 190.0223 6400.0 190.0625 2900000.0 190.0783 22000.0 191.0137 8500.0 191.0339 670000.0 191.0702 230000.0 191.0891 4900.0 192.042 30000.0 192.6328 2300.0 193.0652 11000.0 193.086 2300000.0 193.1065 11000.0 193.1275 4000.0 193.1628 2700.0 205.0504 20000.0 206.0349 6500.0 206.0576 1200000.0 206.0797 3300.0 220.0366 5400.0 221.0024 3900.0 221.015 7400.0 221.0303 70000.0 221.0407 34000.0 221.0809 11000000.0 221.0998 54000.0 221.1202 34000.0 221.1321 62000.0 221.1464 21000.0 235.0608 8800.0 245.1404 11000.0 258.1128 14000.0 262.3618 2500.0 276.1206 3300.0 305.2305 2700.0 306.1704 14000.0 END IONS BEGIN IONS SCANS=459 PEPMASS=217.0863 CHARGE=1 COLLISION_ENERGY=0.0 42.0983 2400.0 43.0178 36000.0 43.1097 4300.0 44.0115 2100.0 45.0334 22000.0 46.1822 2500.0 47.7549 2200.0 51.6509 2400.0 53.0383 3200.0 53.3133 2100.0 54.007 3700.0 55.0177 19000.0 57.0333 93000.0 62.0158 2400.0 63.0235 4300.0 65.0386 12000.0 67.0541 32000.0 67.3353 2200.0 67.7136 3000.0 68.4436 2600.0 68.7397 2500.0 74.068 2100.0 74.4423 2200.0 77.0392 2400.0 79.0543 2700.0 80.3931 4000.0 83.5636 2700.0 89.4293 2600.0 90.3462 2200.0 91.0474 4100.0 91.054 510000.0 91.0595 2900.0 91.0609 6100.0 94.133 2300.0 95.049 6200.0 96.0135 3800.0 102.0468 8100.0 103.054 100000.0 105.0696 16000.0 111.0438 2500.0 112.5529 2400.0 113.3045 2500.0 114.0462 3200.0 115.054 750000.0 115.0628 6300.0 116.0619 150000.0 116.0707 3100.0 117.0697 200000.0 119.0849 2500.0 120.0604 2700.0 120.1012 2500.0 127.0547 19000.0 128.0618 670000.0 129.0696 8700000.0 129.0787 110000.0 129.0921 100000.0 129.0982 9200.0 129.9904 2300.0 130.041 21000.0 130.0774 14000.0 131.049 310000.0 131.0853 2300000.0 131.0948 14000.0 133.0647 42000.0 135.0439 170000.0 135.0803 22000.0 138.562 2200.0 139.0549 3100.0 141.0369 3100.0 141.0571 4900.0 141.0696 4300000.0 141.0796 73000.0 141.0895 9600.0 141.0952 35000.0 142.5558 2200.0 143.0489 240000.0 143.0601 6600.0 143.0853 130000.0 144.0441 3800.0 144.0568 280000.0 145.0519 4200.0 145.0646 220000.0 147.0438 7400.0 149.0595 33000.0 153.0695 23000.0 155.0603 73000.0 156.0568 54000.0 156.6914 2300.0 157.0646 3700000.0 157.0764 17000.0 158.9918 2400.0 159.0439 80000.0 159.0803 1100000.0 159.1018 3700.0 159.1423 2600.0 160.0519 62000.0 161.0596 160000.0 168.0567 14000.0 169.0407 3300.0 169.0647 1400000.0 169.0795 2800.0 171.0439 25000.0 171.0804 16000.0 172.0345 3100.0 172.0519 530000.0 172.0691 12000.0 173.0597 500000.0 173.5218 12000.0 173.5355 71000.0 174.068 33000.0 175.0398 16000.0 175.0756 32000.0 176.0463 16000.0 179.0603 2800.0 184.2193 2600.0 185.0597 160000.0 186.0488 3400.0 186.0675 550000.0 187.0754 2500000.0 188.0834 23000.0 189.0544 47000.0 189.0911 80000.0 194.2068 2700.0 198.0913 24000.0 199.0754 1600000.0 199.092 4700.0 199.106 3700.0 202.0622 6000.0 217.086 300000.0 END IONS BEGIN IONS SCANS=460 PEPMASS=342.2431 CHARGE=1 COLLISION_ENERGY=0.0 50.7967 2800.0 52.9881 2200.0 53.5343 2100.0 53.6843 2300.0 55.0541 120000.0 57.0698 11000.0 58.5566 2100.0 63.2813 2500.0 65.0384 6200.0 67.05 4200.0 67.0541 490000.0 67.9391 2200.0 68.0781 2300.0 69.0697 120000.0 71.4072 2500.0 74.3335 2100.0 74.9286 2100.0 75.1045 2700.0 78.1236 2300.0 78.8121 2100.0 79.054 250000.0 80.8174 2100.0 81.0697 420000.0 83.0853 30000.0 83.2544 2200.0 91.054 110000.0 93.0697 280000.0 94.8645 2500.0 95.0488 10000.0 95.0853 300000.0 95.0959 2700.0 95.4865 2300.0 97.101 4700.0 103.0541 15000.0 105.0697 64000.0 107.0853 160000.0 109.0648 3000.0 109.101 89000.0 109.8595 2400.0 115.0542 6800.0 117.0697 41000.0 118.065 2900.0 119.0853 79000.0 120.6799 2300.0 121.101 98000.0 123.0439 320000.0 123.117 15000.0 127.6258 2800.0 129.0698 42000.0 131.049 100000.0 131.0855 50000.0 133.0647 4400.0 133.101 47000.0 135.0434 3500.0 135.1166 21000.0 137.0481 4400.0 137.0596 370000.0 137.0715 10000.0 141.0697 15000.0 143.0489 40000.0 143.0856 21000.0 143.7858 2300.0 145.0646 130000.0 145.1007 18000.0 145.8622 2300.0 146.0597 15000.0 147.0439 42000.0 147.0807 2800.0 147.1165 19000.0 148.0504 2900.0 149.0596 420000.0 151.0752 66000.0 152.0706 11000.0 152.3993 2800.0 153.069 4600.0 155.0854 60000.0 157.0648 73000.0 157.1007 17000.0 159.0804 74000.0 160.0521 19000.0 161.044 14000.0 161.0597 770000.0 161.0755 9300.0 162.0679 12000.0 163.0612 4400.0 163.0754 160000.0 164.0706 41000.0 165.0704 5500.0 166.0862 27000.0 167.0859 15000.0 169.0648 33000.0 169.1011 31000.0 171.0805 54000.0 173.0599 320000.0 173.0965 12000.0 173.522 24000.0 173.5315 10000.0 173.5405 51000.0 174.068 25000.0 175.0756 470000.0 175.0928 3200.0 176.0829 2300.0 177.0911 53000.0 181.0649 14000.0 181.1005 6200.0 183.0805 94000.0 183.1171 11000.0 185.0961 61000.0 186.0681 5800.0 187.0756 140000.0 187.1113 3400.0 188.0831 19000.0 189.0912 130000.0 189.109 3500.0 191.1068 17000.0 195.0805 22000.0 195.1169 6300.0 197.0963 55000.0 197.132 5300.0 199.0756 59000.0 199.1116 18000.0 200.0834 24000.0 201.0697 4000.0 201.0913 400000.0 202.0991 26000.0 203.1069 86000.0 203.5521 2400.0 209.097 12000.0 209.1323 7400.0 211.1119 19000.0 213.0915 82000.0 213.1272 3800.0 214.0989 18000.0 215.0699 3000.0 215.107 240000.0 216.1146 15000.0 217.1229 23000.0 223.112 25000.0 225.127 8600.0 227.1068 34000.0 228.1145 5100.0 229.1228 62000.0 237.1283 10000.0 241.1226 46000.0 243.1375 27000.0 252.7187 2400.0 255.1379 40000.0 256.0748 2600.0 256.1463 6700.0 266.5213 2500.0 271.5031 2500.0 277.8061 3000.0 312.7333 2700.0 328.3362 2300.0 342.2432 100000.0 352.4108 2700.0 END IONS BEGIN IONS SCANS=461 PEPMASS=296.0923 CHARGE=1 COLLISION_ENERGY=0.0 50.8728 2400.0 58.2399 2100.0 61.1827 2400.0 70.4413 2400.0 70.8358 2200.0 92.8881 2600.0 99.89 2500.0 121.9053 2500.0 152.0623 7200.0 173.5302 24000.0 179.0737 3200.0 181.0648 39000.0 190.0668 3000.0 206.0601 3900.0 207.0682 19000.0 208.076 27000.0 209.0594 15000.0 210.0553 3000.0 219.0676 3200.0 225.079 10000.0 226.9528 2600.0 234.055 41000.0 235.0628 1400000.0 235.084 6200.0 236.0705 110000.0 238.0497 51000.0 247.0631 16000.0 249.041 9600.0 251.0577 7000.0 252.0383 2500.0 252.0651 15000.0 253.0725 7500.0 262.0501 7100.0 263.0574 780000.0 263.0813 4900.0 264.0654 170000.0 264.0981 4700.0 265.073 45000.0 266.0448 110000.0 266.0764 4400.0 267.0529 40000.0 280.0606 80000.0 281.0684 390000.0 282.076 21000.0 296.0919 360000.0 296.1479 3900.0 END IONS BEGIN IONS SCANS=462 PEPMASS=221.0812 CHARGE=1 COLLISION_ENERGY=0.0 42.3367 8000.0 45.0335 48000.0 45.3118 6600.0 45.5287 6500.0 47.076 9400.0 47.2708 7500.0 48.0781 7700.0 48.4353 7400.0 53.0022 48000.0 53.0384 6700.0 55.0178 76000.0 58.1275 8300.0 58.9015 8200.0 61.6656 9200.0 63.5221 8900.0 65.0386 8400.0 68.997 40000.0 74.2648 6800.0 77.0386 100000.0 78.0463 340000.0 79.054 660000.0 81.5063 6600.0 89.0387 84000.0 90.0463 130000.0 91.0541 860000.0 92.0258 8400.0 92.0619 86000.0 93.0699 48000.0 95.049 150000.0 96.7099 7400.0 97.4128 8500.0 102.0386 11000.0 102.0463 1200000.0 103.0099 9600.0 103.0541 560000.0 104.0619 530000.0 105.0335 140000.0 105.0443 10000.0 105.0697 350000.0 106.0412 8400.0 107.0488 1000000.0 109.0646 9000.0 114.0463 12000.0 115.0542 66000.0 116.0621 140000.0 117.0335 150000.0 117.0698 9400.0 118.0412 780000.0 119.0394 20000.0 119.049 1700000.0 119.0591 24000.0 120.0206 36000.0 120.0569 230000.0 121.0286 42000.0 121.0647 420000.0 121.8178 11000.0 122.0725 200000.0 129.0337 29000.0 130.0413 1900000.0 130.0523 18000.0 131.013 7700.0 131.049 900000.0 132.0206 140000.0 132.0453 9300.0 132.0569 1600000.0 132.0657 7100.0 132.0685 23000.0 133.0283 360000.0 133.0648 580000.0 134.0364 90000.0 134.0725 130000.0 134.5787 11000.0 135.044 2600000.0 135.056 49000.0 135.0804 23000.0 136.052 7900.0 137.0603 9100.0 141.5996 7700.0 142.0415 38000.0 144.0568 130000.0 145.0284 240000.0 145.0401 13000.0 145.0647 56000.0 146.0362 360000.0 147.044 5800000.0 148.0518 930000.0 149.0229 9200.0 149.0459 10000.0 149.0596 1300000.0 149.0698 6400.0 150.0675 540000.0 151.0759 18000.0 157.0395 140000.0 158.0362 190000.0 159.0076 120000.0 159.0441 280000.0 160.037 13000.0 160.0519 1600000.0 160.0668 19000.0 161.0233 290000.0 161.0479 5300.0 161.0598 1300000.0 162.0335 40000.0 162.0516 13000.0 162.0529 44000.0 162.0676 4400000.0 163.039 7500000.0 163.0552 21000.0 163.0752 730000.0 165.0913 19000.0 170.0359 18000.0 172.0527 10000.0 173.0231 110000.0 173.5261 81000.0 173.534 110000.0 173.5426 17000.0 174.0313 450000.0 175.0255 17000.0 175.0391 4100000.0 176.0104 17000.0 176.0307 7900.0 176.047 1100000.0 176.0643 8400.0 177.0548 1100000.0 178.0465 52000.0 178.0626 3900000.0 187.0389 60000.0 188.047 560000.0 189.0548 250000.0 190.0625 5200000.0 190.0831 15000.0 191.0137 45000.0 191.034 2200000.0 191.0705 210000.0 192.0418 77000.0 193.0677 26000.0 193.0694 9200.0 193.0861 2400000.0 193.1065 43000.0 205.0497 180000.0 206.0576 1200000.0 218.1167 7400.0 221.0811 410000.0 224.3188 7600.0 226.535 7700.0 END IONS BEGIN IONS SCANS=463 PEPMASS=320.1497 CHARGE=1 COLLISION_ENERGY=0.0 55.018 33000.0 55.2697 290000.0 55.2718 29000.0 55.8978 8200.0 59.5028 8800.0 62.2987 7600.0 63.0335 9100.0 66.2296 8500.0 66.5701 11000.0 68.2727 9200.0 69.1544 9700.0 70.2281 10000.0 75.126 8600.0 76.3852 8300.0 78.0464 55000.0 79.0542 130000.0 81.7542 7800.0 82.0651 10000.0 86.7176 11000.0 86.7463 7900.0 89.8204 11000.0 91.0543 240000.0 92.8048 11000.0 93.0702 11000.0 95.049 23000.0 100.0757 1100000.0 102.0466 200000.0 103.0542 150000.0 104.0619 83000.0 104.1587 8100.0 105.0333 13000.0 105.0699 230000.0 107.0492 160000.0 113.5255 10000.0 113.8215 11000.0 116.062 39000.0 117.0332 14000.0 118.0414 190000.0 119.0492 380000.0 120.057 42000.0 121.0648 120000.0 122.0727 93000.0 130.0414 600000.0 130.2535 8500.0 131.0493 230000.0 132.0211 23000.0 132.0571 410000.0 133.0281 79000.0 133.0649 600000.0 134.0727 85000.0 135.0442 620000.0 135.0804 110000.0 141.4679 13000.0 144.0572 95000.0 145.0289 16000.0 145.0649 11000.0 146.0364 170000.0 147.0332 6900.0 147.0442 2400000.0 148.0519 340000.0 149.0598 440000.0 150.0677 450000.0 157.0397 13000.0 157.4046 11000.0 158.0362 60000.0 159.0442 200000.0 160.0521 710000.0 161.0249 30000.0 161.0599 1200000.0 162.0513 93000.0 162.0677 7100000.0 163.0233 47000.0 163.0391 2400000.0 163.0755 1300000.0 163.3336 13000.0 165.0914 290000.0 167.0705 260000.0 172.0522 88000.0 173.0229 19000.0 173.5253 25000.0 173.533 160000.0 173.5425 19000.0 174.0314 850000.0 175.0393 1900000.0 176.0471 1700000.0 176.0647 27000.0 177.0549 1200000.0 178.0441 69000.0 178.049 23000.0 178.0628 6400000.0 188.047 630000.0 189.0343 69000.0 189.0396 10000.0 189.0549 3300000.0 189.0746 95000.0 190.0111 18000.0 190.0227 290000.0 190.0307 54000.0 190.0626 35000000.0 190.0937 54000.0 190.1031 180000.0 191.0341 7300000.0 191.0704 2700000.0 191.4475 9200.0 192.0419 330000.0 192.061 8600.0 193.0448 110000.0 193.0539 86000.0 193.0714 98000.0 193.0862 26000000.0 193.1193 25000.0 193.1273 180000.0 193.139 27000.0 194.0902 19000.0 205.0502 240000.0 206.013 9700.0 206.0415 100000.0 206.0578 14000000.0 206.1031 14000.0 221.0021 20000.0 221.0158 120000.0 221.0305 600000.0 221.041 470000.0 221.0811 87000000.0 221.121 290000.0 221.1322 580000.0 221.1467 170000.0 221.1608 22000.0 222.0846 150000.0 223.0865 140000.0 273.0711 9400.0 277.127 93000.0 293.641 12000.0 299.0117 11000.0 308.0672 10000.0 END IONS BEGIN IONS SCANS=464 PEPMASS=661.2738 CHARGE=1 COLLISION_ENERGY=0.0 71.8631 2200.0 72.5924 2500.0 72.6618 2300.0 78.5499 2300.0 80.1661 2200.0 80.4231 2700.0 80.8726 2500.0 85.5333 17000.0 85.5348 3000.0 86.4695 2500.0 88.0691 2700.0 98.4324 2300.0 104.3528 2800.0 108.3343 2300.0 109.3349 2500.0 114.2908 2300.0 117.0564 2200.0 118.0293 2600.0 118.5687 2300.0 118.8716 2100.0 122.0572 53000.0 122.3333 2200.0 123.0412 26000.0 125.8711 2600.0 130.4611 2200.0 133.9412 2100.0 136.0168 2400.0 140.3046 2300.0 158.1349 2200.0 173.5253 44000.0 173.5392 27000.0 188.7172 2900.0 199.5022 2800.0 202.8856 2800.0 217.3739 2500.0 221.0802 11000.0 243.0622 3100.0 244.6397 2800.0 254.735 2700.0 304.4031 2600.0 327.1077 36000.0 330.1187 2600.0 342.0344 35000.0 342.1307 6100000.0 342.2059 19000.0 342.2291 31000.0 343.133 3500.0 345.1059 2900.0 350.567 2600.0 383.1559 9000.0 455.6665 2500.0 479.3565 2300.0 525.0709 2600.0 593.6865 2700.0 END IONS BEGIN IONS SCANS=465 PEPMASS=342.1316 CHARGE=1 COLLISION_ENERGY=0.0 50.038 3700.0 51.1809 3500.0 52.2676 3600.0 54.7629 3900.0 55.4169 3500.0 57.439 3200.0 57.9043 2800.0 58.3144 2900.0 58.8868 2500.0 59.1161 2800.0 60.3916 2800.0 60.6754 2700.0 63.6259 3700.0 66.2391 3300.0 67.6569 3400.0 69.472 3100.0 71.6597 2400.0 81.0696 3900.0 82.9908 2400.0 94.36 2700.0 97.5236 2700.0 106.5579 3300.0 114.5182 3500.0 121.3991 2800.0 122.0572 130000.0 123.0413 48000.0 127.0245 2800.0 129.1971 4400.0 135.0802 25000.0 138.721 2500.0 142.58 4200.0 146.3728 3300.0 160.7299 3500.0 161.0601 2900.0 163.0751 5500.0 164.0699 12000.0 167.2154 3200.0 173.4065 3000.0 173.522 29000.0 173.5379 130000.0 179.3049 3600.0 181.6029 4400.0 187.6984 2200.0 190.0639 2900.0 191.0702 77000.0 193.0866 2800.0 197.2691 2900.0 221.0807 110000.0 228.2761 3100.0 228.5988 3600.0 230.4212 3000.0 264.1868 3800.0 265.0842 2900.0 267.0241 3500.0 280.0956 2500.0 281.104 3000.0 296.727 4300.0 299.1133 3600.0 322.3414 3900.0 327.1082 37000.0 342.0834 13000.0 342.0967 2500.0 342.1311 580000.0 END IONS BEGIN IONS SCANS=466 PEPMASS=358.1053 CHARGE=1 COLLISION_ENERGY=0.0 58.0657 2200.0 66.4586 2200.0 66.8823 2400.0 76.2765 2200.0 79.8854 2600.0 80.7193 2400.0 84.7846 2200.0 87.4338 2100.0 90.1713 2500.0 97.5473 2600.0 103.6037 2400.0 103.6117 2300.0 112.3789 2500.0 124.8552 2100.0 149.6879 5500.0 149.7392 2400.0 170.2379 2300.0 173.5308 55000.0 173.5448 14000.0 180.0106 2600.0 183.6175 2600.0 217.9704 2600.0 222.2153 2800.0 239.452 2200.0 276.3654 2900.0 318.1549 2900.0 END IONS BEGIN IONS SCANS=467 PEPMASS=467.1817 CHARGE=1 COLLISION_ENERGY=0.0 61.424 4000.0 65.2249 5000.0 73.6868 2200.0 73.8828 3900.0 79.0541 16000.0 81.2988 5300.0 81.8453 5400.0 88.5311 4700.0 91.0542 16000.0 95.0494 2800.0 98.0601 13000.0 99.2362 4300.0 102.0464 21000.0 103.0541 10000.0 105.0697 11000.0 107.049 16000.0 118.0411 15000.0 119.049 30000.0 120.0573 8700.0 130.0414 27000.0 131.049 14000.0 132.0569 18000.0 133.028 3100.0 133.0649 29000.0 135.044 39000.0 146.0373 4700.0 147.044 130000.0 148.052 18000.0 149.0595 30000.0 150.0548 15000.0 150.0676 19000.0 159.0444 3700.0 160.0521 32000.0 161.0598 55000.0 162.0675 360000.0 162.0832 13000.0 163.039 130000.0 163.0752 55000.0 165.0914 14000.0 167.0703 17000.0 173.5236 20000.0 173.5325 23000.0 173.5428 19000.0 174.0313 39000.0 174.0466 2300.0 175.0391 96000.0 176.0471 71000.0 177.0548 68000.0 178.0626 290000.0 181.0876 2500.0 188.0463 26000.0 189.0547 220000.0 190.0624 2200000.0 191.014 16000.0 191.0339 420000.0 191.0701 200000.0 192.0413 20000.0 193.086 1800000.0 193.1276 9600.0 205.0498 11000.0 206.0575 850000.0 219.049 5700.0 221.0302 90000.0 221.0405 56000.0 221.0809 14000000.0 221.1203 68000.0 221.1321 92000.0 221.1465 27000.0 221.1606 6600.0 221.1748 8900.0 222.0844 84000.0 223.0865 15000.0 231.4379 5300.0 247.1068 15000.0 422.52 5100.0 END IONS BEGIN IONS SCANS=468 PEPMASS=342.2431 CHARGE=1 COLLISION_ENERGY=0.0 53.9134 2100.0 55.054 28000.0 57.0699 3700.0 60.0022 2100.0 67.0539 140000.0 67.058 2100.0 69.0695 23000.0 69.8596 2300.0 77.0384 2600.0 77.7704 2200.0 79.0539 81000.0 81.0695 90000.0 83.0852 8700.0 91.0539 27000.0 93.0695 87000.0 94.7934 2600.0 95.0488 5300.0 95.0852 76000.0 97.1003 3100.0 103.0544 3500.0 105.0698 8900.0 105.9464 2400.0 107.0852 48000.0 109.1009 33000.0 117.07 3600.0 119.0491 3200.0 119.0853 12000.0 121.0645 5700.0 121.1009 29000.0 123.0438 26000.0 123.1164 5100.0 129.07 5600.0 131.0489 17000.0 131.0857 5400.0 133.0648 3400.0 133.1019 6000.0 135.0436 15000.0 135.1164 12000.0 136.0474 11000.0 137.0595 63000.0 143.0496 5000.0 143.0855 3400.0 145.0645 14000.0 146.0596 5700.0 147.044 10000.0 147.1163 4000.0 149.0595 87000.0 150.0545 2800.0 151.0752 8100.0 155.0852 4800.0 157.0646 10000.0 159.0803 9700.0 161.0596 96000.0 162.0665 6500.0 163.0754 22000.0 164.0706 33000.0 164.8962 2500.0 166.0862 37000.0 169.0649 5200.0 169.1015 2400.0 171.081 4700.0 173.0598 43000.0 173.5306 18000.0 175.0756 42000.0 177.0913 11000.0 178.0859 4500.0 180.1006 2400.0 181.066 3700.0 183.0803 8600.0 185.0955 6000.0 187.0754 20000.0 189.0912 16000.0 191.1062 3100.0 197.0962 3200.0 199.0757 6600.0 201.0913 31000.0 203.107 8100.0 204.1025 6800.0 206.1907 12000.0 213.0915 10000.0 215.1071 19000.0 217.121 3600.0 227.1073 4400.0 229.1207 3000.0 240.8427 2900.0 241.1218 3100.0 255.139 3900.0 342.1409 3100.0 342.2439 49000.0 END IONS BEGIN IONS SCANS=469 PEPMASS=407.2587 CHARGE=1 COLLISION_ENERGY=0.0 54.5185 2300.0 54.6474 2300.0 55.0268 2200.0 55.0541 6000.0 57.0696 26000.0 59.0491 7100.0 59.8205 2100.0 61.0361 2300.0 62.2288 2900.0 64.0299 2400.0 65.4182 2300.0 67.0539 3500.0 67.8966 2400.0 69.0333 16000.0 69.0694 3100.0 70.7878 2900.0 70.8039 2300.0 70.9203 2400.0 71.786 2300.0 74.2407 2400.0 78.6276 2100.0 79.054 20000.0 81.0695 65000.0 83.0489 13000.0 84.183 2500.0 85.0645 22000.0 85.2406 2100.0 91.0539 23000.0 91.3247 2400.0 93.0695 88000.0 95.0488 130000.0 95.0852 30000.0 97.0645 15000.0 100.1085 2500.0 105.0173 2400.0 105.0695 100000.0 107.0851 76000.0 108.4658 2500.0 109.0645 43000.0 109.0721 2600.0 109.1015 3100.0 111.0798 2800.0 113.3712 3000.0 117.0695 10000.0 119.047 2300.0 119.0851 95000.0 119.4161 2500.0 121.0645 52000.0 121.1009 40000.0 123.08 47000.0 123.1169 3600.0 128.0997 2300.0 129.0697 9300.0 131.0853 58000.0 133.0646 26000.0 133.1008 48000.0 135.0802 46000.0 137.0585 2800.0 137.096 22000.0 137.8877 2800.0 139.0746 9600.0 142.0773 6800.0 143.0851 80000.0 144.0931 7200.0 144.3839 2300.0 145.1008 120000.0 146.1425 2400.0 147.08 57000.0 147.1164 16000.0 147.1488 2400.0 149.0957 49000.0 151.0751 93000.0 155.0854 13000.0 156.093 22000.0 157.1009 98000.0 157.3207 2600.0 159.0805 23000.0 159.1166 93000.0 161.0958 49000.0 161.1324 6700.0 163.1118 9100.0 165.0907 79000.0 167.0853 6000.0 167.4821 2600.0 168.093 2800.0 169.1009 52000.0 170.1086 3300.0 171.0807 3900.0 171.1167 85000.0 173.0962 28000.0 173.1325 26000.0 173.5315 100000.0 173.5442 7700.0 175.1115 13000.0 177.0908 56000.0 177.1273 6900.0 181.1008 40000.0 182.1092 6200.0 183.1168 44000.0 183.8065 2800.0 185.096 13000.0 185.1328 18000.0 186.1018 2900.0 187.1115 41000.0 189.1271 41000.0 193.1011 3200.0 194.1092 9300.0 195.1169 34000.0 197.095 2600.0 197.1323 35000.0 199.1117 63000.0 199.1478 15000.0 201.1276 16000.0 203.1426 27000.0 207.1166 23000.0 207.1381 37000.0 209.1328 41000.0 211.1116 14000.0 211.1485 4800.0 213.1272 24000.0 215.1436 6800.0 216.792 2800.0 217.1219 2900.0 221.1322 11000.0 221.1541 13000.0 223.1122 8500.0 223.1479 15000.0 224.1223 2700.0 225.1284 8900.0 225.1637 12000.0 227.1429 21000.0 229.1229 35000.0 231.1384 12000.0 235.1481 6900.0 237.1276 8700.0 241.1227 2300.0 247.145 4300.0 249.1279 3500.0 249.1625 2700.0 253.1559 2700.0 267.1424 2300.0 267.1746 10000.0 271.171 5700.0 278.4828 2300.0 279.173 2800.0 285.1843 12000.0 286.1926 9200.0 287.2004 9800.0 289.1647 2700.0 298.9062 2400.0 302.2735 2300.0 365.1493 2400.0 389.2461 2600.0 407.259 53000.0 END IONS BEGIN IONS SCANS=470 PEPMASS=340.1161 CHARGE=1 COLLISION_ENERGY=0.0 55.4184 2500.0 59.5615 2400.0 61.3331 2200.0 72.6618 2300.0 73.8085 2300.0 78.0461 5800.0 95.2487 2500.0 106.0412 3600.0 115.0541 3200.0 116.0616 6300.0 129.0694 8300.0 131.0488 9700.0 133.0648 2900.0 135.0437 65000.0 136.0515 45000.0 143.0484 3600.0 144.0567 8000.0 146.0598 3400.0 148.0513 7400.0 149.0593 7400.0 157.0643 23000.0 160.05 2500.0 161.0595 9600.0 173.0597 120000.0 173.5351 29000.0 174.0672 14000.0 176.0698 7800.0 186.0675 11000.0 187.0753 36000.0 189.0551 4800.0 192.0781 7200.0 204.0783 23000.0 209.8509 2300.0 296.267 2400.0 340.1132 3600.0 END IONS BEGIN IONS SCANS=471 PEPMASS=358.1413 CHARGE=1 COLLISION_ENERGY=0.0 51.9764 2200.0 54.9947 3000.0 57.1512 2300.0 65.7971 2200.0 68.4135 2400.0 71.7677 2700.0 71.8349 2200.0 73.7339 2300.0 78.0421 2400.0 78.0463 80000.0 79.0544 3400.0 100.2885 2400.0 103.0543 21000.0 104.2242 2800.0 106.0412 59000.0 112.0034 2900.0 114.9802 2800.0 115.0543 23000.0 116.0619 78000.0 117.0695 3600.0 119.0491 8700.0 122.0361 33000.0 124.0517 16000.0 128.0625 4000.0 128.2476 2400.0 129.0697 150000.0 131.049 180000.0 132.0568 6100.0 133.0646 3500.0 135.0439 960000.0 135.0535 5500.0 136.0517 500000.0 136.0633 8000.0 137.0607 3300.0 143.049 41000.0 144.0568 180000.0 145.0646 15000.0 146.0704 2600.0 147.0437 8000.0 147.0804 5600.0 148.0518 180000.0 149.0596 42000.0 150.0671 13000.0 157.0501 3700.0 157.0647 280000.0 159.043 3100.0 160.0516 6400.0 161.0596 120000.0 162.0674 26000.0 171.9829 2500.0 172.0519 22000.0 173.0598 800000.0 173.5265 36000.0 173.5426 10000.0 174.0676 220000.0 174.085 3300.0 175.0753 22000.0 176.0829 4000.0 185.0599 13000.0 186.0675 96000.0 187.0754 390000.0 187.095 13000.0 189.0546 42000.0 191.0702 26000.0 192.078 91000.0 200.0835 20000.0 201.6768 2900.0 204.0783 100000.0 224.1502 2600.0 259.8222 2300.0 310.7884 2500.0 342.1336 3000.0 END IONS BEGIN IONS SCANS=472 PEPMASS=205.0862 CHARGE=1 COLLISION_ENERGY=0.0 43.0177 16000.0 43.0447 2200.0 44.0806 2200.0 45.0334 59000.0 46.154 2400.0 48.7722 2300.0 50.3096 2100.0 50.8683 2400.0 54.1265 2300.0 55.0179 8000.0 55.054 3200.0 55.9342 21000.0 62.0916 2700.0 64.9454 2300.0 70.842 2500.0 72.937 22000.0 73.2091 2100.0 73.3746 2500.0 74.2605 2200.0 75.6827 2000.0 79.3038 2300.0 81.0696 6300.0 90.9475 23000.0 91.054 56000.0 99.0954 2800.0 100.5651 2500.0 103.0539 31000.0 105.0697 25000.0 107.0487 5100.0 107.085 6100.0 112.513 2600.0 113.9636 43000.0 114.9713 2700.0 115.0541 42000.0 116.0619 29000.0 117.0698 440000.0 117.0786 3400.0 119.0853 77000.0 123.1169 8400.0 126.2507 2500.0 127.0542 9400.0 128.0618 110000.0 128.9507 11000.0 129.0538 3100.0 129.0696 1300000.0 129.0792 6800.0 131.0489 110000.0 131.0854 40000.0 133.0647 52000.0 135.0333 4300.0 135.0439 120000.0 135.1165 2800.0 135.9446 2900.0 144.0568 97000.0 145.0515 6300.0 145.0646 1200000.0 145.0761 10000.0 147.0673 4200.0 147.0802 140000.0 149.0602 13000.0 155.06 22000.0 157.05 4100.0 157.0646 740000.0 157.0767 3600.0 159.0437 2400.0 159.0805 5800.0 160.0515 3800.0 161.0596 37000.0 163.0392 11000.0 163.0745 8200.0 172.0518 61000.0 173.0596 6400.0 173.5198 4000.0 173.5346 80000.0 174.05 7400.0 174.0675 330000.0 174.0857 4600.0 175.0576 3400.0 175.0753 300000.0 175.0934 9100.0 176.046 8300.0 177.0915 13000.0 187.0753 720000.0 187.095 4200.0 196.3267 2500.0 204.8578 2300.0 205.0859 45000.0 210.8929 2600.0 END IONS BEGIN IONS SCANS=473 PEPMASS=219.1019 CHARGE=1 COLLISION_ENERGY=0.0 43.0176 5600.0 43.5267 2300.0 46.6674 2000.0 51.4949 2900.0 55.0177 8400.0 55.8503 2400.0 55.9343 2500.0 57.5654 2300.0 79.0539 10000.0 91.054 11000.0 92.7588 2300.0 103.0541 4200.0 105.0694 8700.0 107.2093 2500.0 115.0451 7700.0 115.0539 130000.0 117.0695 36000.0 127.0538 5600.0 128.0617 310000.0 128.0706 2000.0 128.0777 3300.0 129.0695 17000.0 131.0489 15000.0 131.0853 51000.0 133.065 3300.0 135.0437 16000.0 137.0945 2600.0 141.0695 21000.0 142.0764 3000.0 143.049 82000.0 143.0589 3600.0 143.0853 750000.0 143.0957 8200.0 144.0574 3100.0 145.0644 55000.0 145.1011 14000.0 149.0595 18000.0 149.6829 4600.0 149.6937 5600.0 153.0698 17000.0 153.8537 2600.0 155.0602 19000.0 156.0569 9700.0 156.2221 2500.0 158.0722 3100.0 159.0439 13000.0 159.0802 46000.0 160.0514 11000.0 161.0596 14000.0 161.0965 4600.0 171.0446 11000.0 171.0803 390000.0 172.0518 95000.0 173.0597 210000.0 173.0758 7400.0 173.5244 22000.0 173.5428 19000.0 175.0748 9800.0 185.0594 6900.0 186.0675 120000.0 189.091 10000.0 191.3161 2500.0 196.5987 2500.0 201.091 140000.0 203.1436 2700.0 219.1759 4300.0 END IONS BEGIN IONS SCANS=474 PEPMASS=458.0663 CHARGE=1 COLLISION_ENERGY=0.0 56.3121 2400.0 74.6019 2400.0 78.046 3400.0 81.0333 3700.0 92.9048 2300.0 101.0376 2500.0 106.0404 3100.0 109.7862 2600.0 117.0696 20000.0 120.0858 2300.0 129.0694 4000.0 131.0486 15000.0 135.0437 160000.0 136.0515 50000.0 143.9119 2300.0 145.0647 16000.0 145.8534 2400.0 148.0519 8400.0 149.0587 2400.0 149.5386 2300.0 157.0647 12000.0 161.0594 17000.0 162.0677 9300.0 167.9863 2600.0 172.0524 3900.0 173.0596 64000.0 173.5214 7100.0 173.5366 28000.0 174.0674 20000.0 175.0752 36000.0 178.9795 7500.0 179.9866 25000.0 186.0674 11000.0 187.0751 53000.0 191.0693 2600.0 191.9866 31000.0 192.078 19000.0 193.9659 11000.0 194.9737 14000.0 195.9814 11000.0 197.998 2600.0 204.078 43000.0 207.959 8000.0 207.9817 220000.0 208.6454 2300.0 208.9907 2800.0 209.9612 2900.0 209.9987 3100.0 211.9765 7000.0 221.961 97000.0 221.9986 3200.0 223.977 3100.0 225.9922 80000.0 232.9907 3400.0 235.9768 18000.0 244.0179 2500.0 245.998 7300.0 247.0051 42000.0 249.0087 3600.0 262.0111 3000.0 263.0158 6800.0 264.0192 11000.0 265.0149 10000.0 276.0085 19000.0 277.0164 32000.0 288.1343 2400.0 295.027 20000.0 322.0285 10000.0 334.0329 2800.0 343.0949 2300.0 352.0397 75000.0 364.0397 59000.0 369.0575 3700.0 382.0512 89000.0 457.8282 2600.0 END IONS BEGIN IONS SCANS=475 PEPMASS=770.2024 CHARGE=1 COLLISION_ENERGY=0.0 74.514 2500.0 81.0335 12000.0 89.3626 2700.0 90.9474 3000.0 90.98 2200.0 94.6348 2200.0 133.0644 3100.0 135.0439 160000.0 149.0595 27000.0 149.6788 3400.0 149.6874 10000.0 149.6974 6600.0 157.966 12000.0 161.0595 3800.0 164.2085 2400.0 173.0598 3100.0 173.5308 21000.0 173.5422 2500.0 179.9867 2900.0 186.0749 2300.0 187.0756 6900.0 191.9868 64000.0 193.9657 3400.0 194.9739 23000.0 195.9817 13000.0 206.9743 2800.0 207.9817 80000.0 208.9881 6000.0 209.9975 6900.0 210.9686 2400.0 211.9761 7300.0 212.9849 2800.0 219.0109 4900.0 219.9816 4100.0 220.9887 11000.0 221.9608 19000.0 221.9979 5900.0 225.9923 27000.0 231.0103 31000.0 232.9896 16000.0 233.9975 7700.0 237.9922 21000.0 245.9978 16000.0 247.0053 48000.0 248.0129 14000.0 249.0199 8000.0 249.9918 13000.0 251.0005 9500.0 251.9749 2900.0 252.0067 7400.0 260.0123 14000.0 261.0199 12000.0 264.0072 2500.0 265.0151 16000.0 266.0236 2900.0 268.0033 3300.0 276.0081 280000.0 276.0429 5100.0 277.0159 180000.0 278.9968 4900.0 279.0315 71000.0 288.8136 2700.0 294.0188 3000.0 295.0265 150000.0 295.062 2500.0 312.0084 28000.0 318.0398 3700.0 322.029 27000.0 324.0435 14000.0 326.0607 15000.0 331.8773 2500.0 334.03 8300.0 336.0421 5100.0 340.039 19000.0 352.039 460000.0 353.0469 8200.0 353.2236 2800.0 354.0541 3300.0 364.0393 39000.0 365.0303 2600.0 366.0546 44000.0 372.0645 4800.0 382.0498 96000.0 383.0574 26000.0 384.0656 22000.0 385.8365 2900.0 396.0659 14000.0 400.0599 17000.0 412.0605 100000.0 414.076 230000.0 430.0713 10000.0 517.0949 8800.0 545.1454 2300.0 679.111 2800.0 END IONS BEGIN IONS SCANS=476 PEPMASS=293.1177 CHARGE=1 COLLISION_ENERGY=0.0 49.0697 2800.0 52.0645 3000.0 53.3063 2600.0 54.7219 2800.0 55.0178 58000.0 62.1784 2700.0 63.3009 2600.0 69.0337 3800.0 77.0388 13000.0 79.0541 51000.0 89.1291 3000.0 91.0073 2700.0 91.0541 88000.0 93.0697 34000.0 95.0491 32000.0 103.0541 580000.0 103.0602 3900.0 103.0623 4100.0 105.0444 4000.0 105.0617 6500.0 105.0697 550000.0 105.077 6700.0 105.0782 2500.0 107.049 220000.0 115.0542 61000.0 117.0698 22000.0 119.049 29000.0 121.0551 5400.0 121.0647 480000.0 121.0733 3600.0 125.2261 2600.0 128.0623 17000.0 129.0695 16000.0 130.0411 12000.0 131.0263 6700.0 131.049 2800000.0 131.0578 26000.0 131.0725 3500.0 132.0569 26000.0 132.1028 2600.0 133.0647 3100000.0 133.0882 19000.0 135.0319 2800.0 135.044 480000.0 135.0559 13000.0 138.2175 3000.0 141.0693 11000.0 143.0491 62000.0 143.0857 13000.0 144.0569 23000.0 145.0527 4700.0 145.0647 210000.0 147.0443 3700.0 149.0459 3700.0 149.0596 760000.0 149.0738 15000.0 153.0698 10000.0 154.0777 2900.0 156.0571 18000.0 157.0648 110000.0 159.0443 4100.0 160.0518 98000.0 160.2818 3000.0 161.0597 2200000.0 161.091 14000.0 165.0705 3500.0 169.0647 17000.0 171.0806 58000.0 172.0522 8300.0 173.0599 280000.0 173.0767 5500.0 173.5341 53000.0 174.0675 25000.0 179.0857 21000.0 181.0642 4100.0 185.0421 5700.0 185.0598 180000.0 186.0676 200000.0 187.0752 17000.0 192.0938 16000.0 193.0655 9500.0 193.1008 14000.0 194.073 17000.0 195.0806 7500.0 199.0758 21000.0 202.078 45000.0 203.0868 3400.0 204.1354 3400.0 205.0655 2800.0 205.1027 3000.0 206.0733 5000.0 207.0806 52000.0 207.1171 48000.0 214.1008 2600.0 217.1015 110000.0 218.0745 3500.0 219.0806 20000.0 220.0885 120000.0 221.0964 14000.0 222.115 2500.0 223.0752 15000.0 227.0848 8000.0 231.0809 14000.0 233.096 21000.0 235.0759 24000.0 235.112 340000.0 237.0911 2700.0 238.0628 4900.0 241.6271 2800.0 244.0885 3700.0 245.0669 3200.0 245.0961 140000.0 247.0756 13000.0 248.0833 93000.0 250.0981 3600.0 251.07 11000.0 251.8999 3100.0 260.0829 2900.0 261.0913 3600.0 263.0812 2500.0 263.1066 220000.0 264.079 10000.0 265.0872 7900.0 265.1221 11000.0 275.1067 3500.0 278.0942 43000.0 293.1174 150000.0 END IONS BEGIN IONS SCANS=477 PEPMASS=341.1387 CHARGE=1 COLLISION_ENERGY=0.0 50.408 8600.0 51.0234 57000.0 52.8484 5500.0 52.9605 5200.0 53.0386 27000.0 53.2851 5400.0 55.0179 100000.0 60.5185 5000.0 62.6741 9700.0 65.0388 6100.0 66.8095 5600.0 67.0542 57000.0 69.0335 49000.0 74.7486 8600.0 77.0389 120000.0 78.0463 48000.0 79.0542 310000.0 81.0334 87000.0 81.0699 45000.0 81.5633 8800.0 83.0491 47000.0 91.0542 270000.0 93.07 69000.0 94.0774 6900.0 95.0491 380000.0 100.4656 9100.0 103.0542 500000.0 103.0615 17000.0 105.0335 120000.0 105.0446 71000.0 105.0698 900000.0 106.0414 94000.0 107.0046 12000.0 107.0491 510000.0 108.2462 9900.0 109.065 54000.0 115.0543 110000.0 115.0947 5800.0 117.0698 230000.0 119.0492 190000.0 121.0285 81000.0 121.0647 510000.0 123.0338 6100.0 123.044 550000.0 123.0536 6700.0 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239.0706 43000.0 239.1087 7700.0 240.079 6800.0 241.0865 44000.0 242.0959 12000.0 245.0963 200000.0 247.0756 10000.0 247.1118 64000.0 248.0838 110000.0 249.0913 28000.0 251.0709 24000.0 251.1069 55000.0 253.1217 7100.0 255.1027 6300.0 257.0811 72000.0 261.0911 15000.0 263.1068 320000.0 265.0871 47000.0 265.1224 69000.0 267.1384 23000.0 269.1179 6600.0 275.1076 46000.0 277.122 7100.0 278.0954 33000.0 293.1176 190000.0 295.1334 22000.0 308.1048 400000.0 323.1281 420000.0 323.1668 16000.0 326.0706 13000.0 326.1153 760000.0 326.1598 6800.0 326.3135 5400.0 332.45 12000.0 341.1385 3000000.0 END IONS BEGIN IONS SCANS=478 PEPMASS=201.0912 CHARGE=1 COLLISION_ENERGY=0.0 40.7065 2400.0 43.0177 9500.0 44.0317 2900.0 49.3053 2200.0 50.5924 2300.0 55.0176 33000.0 55.9341 80000.0 56.9346 30000.0 57.4864 2800.0 63.0241 2700.0 63.0386 2500.0 65.0384 9100.0 66.0719 2300.0 66.1063 2100.0 68.6626 2800.0 72.9369 15000.0 73.937 3300.0 78.7123 2300.0 79.0539 41000.0 81.1232 2400.0 86.0232 2300.0 87.7482 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159.0802 4400.0 160.0518 35000.0 161.0594 14000.0 169.0636 3100.0 170.0731 5900.0 171.0444 55000.0 171.0804 960000.0 172.052 310000.0 172.0691 5400.0 173.0598 360000.0 173.0844 3000.0 173.5286 19000.0 173.5362 8100.0 181.0765 11000.0 185.06 32000.0 186.0676 250000.0 199.0753 8800.0 201.0912 150000.0 203.5991 3100.0 END IONS BEGIN IONS SCANS=479 PEPMASS=717.2909 CHARGE=1 COLLISION_ENERGY=0.0 69.3799 5600.0 77.0389 23000.0 79.0542 33000.0 81.0696 5200.0 82.8545 6300.0 84.3353 5200.0 91.0542 18000.0 95.049 22000.0 95.0854 11000.0 102.8276 2900.0 103.0542 38000.0 105.034 12000.0 105.0698 50000.0 107.0492 37000.0 115.0548 4300.0 117.0702 12000.0 121.0647 130000.0 123.0438 7900.0 128.0624 7600.0 131.0491 250000.0 133.0648 1400000.0 135.044 3600000.0 135.0679 10000.0 137.0597 3200.0 143.0491 11000.0 143.0853 23000.0 145.0647 90000.0 149.0458 6900.0 149.0597 360000.0 149.0697 3100.0 151.0756 4500.0 157.0647 52000.0 159.0431 3200.0 160.0516 12000.0 161.0598 1400000.0 163.0754 78000.0 171.0807 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264.0789 56000.0 265.0867 180000.0 265.1218 320000.0 275.1068 400000.0 278.0935 450000.0 291.1019 200000.0 293.1171 2700000.0 305.1164 200000.0 308.1043 8800000.0 308.1648 64000.0 323.0819 32000.0 323.1277 14000000.0 326.1146 360000.0 END IONS BEGIN IONS SCANS=481 PEPMASS=381.1314 CHARGE=1 COLLISION_ENERGY=0.0 58.1469 2500.0 80.2254 2100.0 88.1143 2200.0 93.2006 2200.0 97.9833 2300.0 110.8176 2200.0 150.0174 2800.0 167.3757 2300.0 173.5306 33000.0 200.0451 3000.0 339.7369 2400.0 END IONS BEGIN IONS SCANS=482 PEPMASS=739.2728 CHARGE=1 COLLISION_ENERGY=0.0 134.9584 2300.0 149.6708 3200.0 149.688 15000.0 149.698 2800.0 158.8779 2300.0 173.5321 10000.0 204.5017 2600.0 381.1311 62000.0 698.9624 3000.0 END IONS BEGIN IONS SCANS=483 PEPMASS=453.0874 CHARGE=1 COLLISION_ENERGY=0.0 60.6835 2400.0 62.3043 2800.0 65.3401 2300.0 65.6422 2500.0 73.5053 2400.0 75.1777 2300.0 77.6741 2300.0 77.9807 2800.0 79.2792 2600.0 79.4616 2700.0 79.7202 2200.0 81.0331 15000.0 83.2675 2200.0 86.9792 2400.0 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280.0187 2900.0 288.3813 2300.0 295.0265 58000.0 297.6846 2400.0 318.4551 2800.0 322.0283 69000.0 340.0391 13000.0 352.0389 490000.0 356.232 2200.0 382.0495 12000.0 383.2539 2500.0 END IONS BEGIN IONS SCANS=484 PEPMASS=233.1175 CHARGE=1 COLLISION_ENERGY=0.0 50.7952 2500.0 51.189 2300.0 53.8 2400.0 55.0174 2400.0 56.0318 2500.0 57.0333 11000.0 67.0541 7700.0 71.3092 2300.0 73.6477 2500.0 76.1577 2800.0 79.0548 2400.0 84.2937 2600.0 85.7582 2500.0 91.0541 5000.0 95.049 2600.0 105.0695 5600.0 109.1891 2100.0 115.0542 8300.0 117.0697 9500.0 121.0646 18000.0 122.9789 2300.0 128.062 28000.0 129.0695 41000.0 131.0488 2500.0 131.0855 16000.0 131.867 2300.0 135.0806 4600.0 137.0596 7000.0 141.0697 23000.0 142.0775 5700.0 143.0489 10000.0 143.0854 34000.0 144.0565 10000.0 145.0645 47000.0 146.0724 16000.0 147.0806 6200.0 149.0597 9900.0 149.0975 2800.0 151.0751 43000.0 153.0695 21000.0 154.0775 12000.0 155.0855 16000.0 156.0568 13000.0 157.0646 89000.0 158.0726 62000.0 159.0442 9200.0 159.0658 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2500.0 169.1013 120000.0 170.7454 3500.0 171.1044 41000.0 173.5228 15000.0 173.5357 85000.0 173.5425 5000.0 175.039 110000.0 176.0469 140000.0 177.0552 7900.0 182.4776 2200.0 186.1278 150000.0 187.1116 21000.0 191.03 23000.0 191.0703 4900000.0 191.1018 7600.0 191.1113 9400.0 207.0657 21000.0 232.1334 12000.0 233.6312 2700.0 240.8978 2300.0 241.36 2500.0 242.7877 2200.0 247.8932 2300.0 257.2697 2800.0 258.5764 2600.0 274.1439 42000.0 END IONS BEGIN IONS SCANS=486 PEPMASS=337.144 CHARGE=1 COLLISION_ENERGY=0.0 50.8732 2100.0 52.3792 2200.0 53.2375 2200.0 53.7096 2100.0 53.8619 2600.0 54.5357 2400.0 54.7109 2400.0 54.7695 2300.0 56.1881 2300.0 57.131 2400.0 61.1011 2500.0 61.4789 4700.0 61.8284 2300.0 62.0284 2200.0 62.0588 2300.0 63.8709 2300.0 63.8928 2300.0 64.3365 2600.0 66.6438 2200.0 67.0489 2500.0 67.4178 2400.0 67.9218 2300.0 70.1702 2200.0 71.3034 2300.0 74.3535 2100.0 76.8262 2400.0 78.0523 2300.0 79.0968 2100.0 83.1273 2200.0 83.7184 2600.0 85.3545 2300.0 88.2437 2700.0 91.054 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208.194 2900.0 215.107 13000.0 221.3699 2300.0 231.5782 2700.0 233.3309 2400.0 236.4697 2500.0 241.974 2600.0 242.2448 2600.0 243.3297 2500.0 243.3405 2500.0 244.0714 2300.0 247.9185 2600.0 248.1197 38000.0 256.2276 2700.0 256.7129 2500.0 261.0909 4000.0 264.1147 3300.0 274.1929 2300.0 275.1066 11000.0 276.1146 27000.0 277.0854 5600.0 278.9993 2500.0 279.1383 75000.0 291.1025 12000.0 292.1109 7400.0 305.1173 3700.0 306.1254 200000.0 307.0953 2800.0 307.1336 65000.0 319.0524 2600.0 322.1202 32000.0 337.143 28000.0 END IONS BEGIN IONS SCANS=487 PEPMASS=538.2076 CHARGE=1 COLLISION_ENERGY=0.0 64.8575 5400.0 66.1577 7400.0 67.0298 2200.0 69.4969 4700.0 73.7944 2200.0 75.044 33000.0 77.1964 5000.0 77.324 6300.0 77.533 4600.0 79.0542 6500.0 80.0497 5600.0 81.0333 1400000.0 81.0382 8000.0 82.0286 48000.0 83.5453 4500.0 94.0652 18000.0 98.0598 42000.0 99.8395 4400.0 104.0492 13000.0 105.0546 6400.0 107.9046 4900.0 110.0235 150000.0 115.7956 2600.0 116.5057 2600.0 122.0597 40000.0 122.6199 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7500.0 354.1461 66000.0 363.0866 12000.0 365.0992 72000.0 365.1389 180000.0 366.1461 400000.0 367.1175 350000.0 367.1645 8900.0 368.1255 7900.0 370.1392 10000.0 377.1028 7200.0 379.0712 19000.0 379.1173 110000.0 380.1254 100000.0 381.1329 160000.0 382.1412 500000.0 383.1132 47000.0 385.1648 66000.0 393.0968 58000.0 394.1053 22000.0 395.1074 160000.0 395.1497 310000.0 397.164 76000.0 398.1365 51000.0 408.1208 180000.0 409.1283 200000.0 410.0895 4100.0 410.1363 470000.0 411.1075 130000.0 413.1594 200000.0 421.1545 7800.0 423.1442 170000.0 424.1751 40000.0 426.1314 110000.0 426.1975 7100.0 428.8657 2700.0 441.1541 190000.0 452.1709 3200.0 470.1747 7100.0 492.1998 67000.0 514.1749 5200.0 527.1172 6800.0 END IONS BEGIN IONS SCANS=488 PEPMASS=680.3183 CHARGE=1 COLLISION_ENERGY=0.0 71.9725 5700.0 75.0441 7100.0 78.8986 5700.0 79.0542 34000.0 80.0494 42000.0 81.0221 29000.0 81.0334 6500000.0 81.0446 46000.0 82.0288 30000.0 85.1654 5700.0 91.9504 3300.0 94.065 54000.0 95.0491 26000.0 98.0235 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381.133 140000.0 382.1407 350000.0 383.1125 13000.0 385.1646 33000.0 395.1489 270000.0 397.1655 33000.0 398.136 41000.0 399.1411 4500.0 408.1207 26000.0 409.1284 79000.0 410.1359 210000.0 411.1069 36000.0 413.1592 450000.0 423.1436 85000.0 426.1313 67000.0 441.1539 390000.0 492.2007 54000.0 495.741 3200.0 520.1976 10000.0 538.206 30000.0 END IONS BEGIN IONS SCANS=489 PEPMASS=652.2871 CHARGE=1 COLLISION_ENERGY=0.0 67.0182 15000.0 68.317 4500.0 79.0541 83000.0 80.0494 98000.0 81.027 29000.0 81.0332 17000000.0 81.0417 100000.0 81.0426 300000.0 81.0443 64000.0 81.0823 14000.0 82.0053 18000.0 82.0285 57000.0 83.6679 4500.0 86.7967 4800.0 89.0612 12000.0 94.0648 160000.0 94.533 14000.0 95.0491 61000.0 95.6453 4800.0 98.0598 150000.0 104.0493 43000.0 106.0648 110000.0 108.0439 31000.0 110.0235 590000.0 115.7782 14000.0 122.0597 340000.0 128.6942 12000.0 132.0441 320000.0 134.0599 340000.0 136.039 390000.0 150.0547 7000000.0 150.0662 89000.0 160.0392 91000.0 160.4429 19000.0 166.6921 13000.0 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492.202 140000.0 499.3958 15000.0 520.1976 5600.0 533.7605 14000.0 538.2064 50000.0 538.7529 14000.0 626.4964 5300.0 END IONS BEGIN IONS SCANS=490 PEPMASS=635.2606 CHARGE=1 COLLISION_ENERGY=0.0 66.2638 12000.0 67.8465 10000.0 75.044 40000.0 79.054 150000.0 80.0493 230000.0 81.0221 55000.0 81.0333 26000000.0 81.0448 440000.0 81.0479 24000.0 82.0286 260000.0 83.0499 19000.0 87.7259 4900.0 88.5378 12000.0 91.7383 12000.0 94.065 290000.0 94.3216 18000.0 95.0489 170000.0 96.0445 38000.0 98.0235 44000.0 98.0599 320000.0 104.0493 160000.0 105.6802 16000.0 106.0649 180000.0 107.0492 33000.0 108.044 79000.0 110.0147 17000.0 110.0235 1300000.0 113.9402 5100.0 122.0599 620000.0 129.3912 12000.0 132.0442 580000.0 134.0598 460000.0 136.0392 550000.0 138.0542 12000.0 144.0938 11000.0 150.0266 15000.0 150.0548 11000000.0 150.0659 31000.0 160.0395 140000.0 165.5224 20000.0 173.5212 76000.0 173.5304 260000.0 173.5397 200000.0 178.0133 190000.0 178.0217 130000.0 178.0366 62000.0 178.05 28000000.0 178.0862 220000.0 178.0967 49000.0 181.086 340000.0 195.0653 140000.0 196.0608 8300.0 221.081 650000.0 232.0736 6200.0 232.0972 210000.0 247.0961 36000.0 250.3851 12000.0 254.2039 5800.0 260.8401 11000.0 271.0971 21000.0 273.0762 170000.0 285.1011 38000.0 300.1235 1300000.0 314.1395 15000.0 322.1207 35000.0 323.1275 14000.0 335.1298 49000.0 336.1001 25000.0 337.1035 61000.0 339.1228 67000.0 345.1342 81000.0 349.1066 72000.0 350.1148 100000.0 351.0847 57000.0 351.123 530000.0 352.131 64000.0 354.1466 150000.0 360.1566 75000.0 362.1155 18000.0 365.0981 140000.0 365.14 150000.0 366.1078 190000.0 366.1472 350000.0 367.1181 720000.0 370.1383 20000.0 377.1058 5300.0 379.1195 86000.0 380.1272 190000.0 381.1333 500000.0 382.1414 1600000.0 383.1133 160000.0 385.1636 110000.0 393.0971 22000.0 394.1071 15000.0 395.0998 9600.0 395.1495 1300000.0 397.1664 22000.0 398.1372 220000.0 399.1423 26000.0 408.1206 160000.0 409.1285 210000.0 410.1368 880000.0 411.1078 190000.0 413.16 1300000.0 413.2218 21000.0 423.1447 190000.0 426.1315 250000.0 441.1549 720000.0 492.202 140000.0 520.2013 40000.0 END IONS BEGIN IONS SCANS=491 PEPMASS=441.1548 CHARGE=1 COLLISION_ENERGY=0.0 59.7066 2500.0 65.4059 2200.0 76.8368 2200.0 81.5381 2200.0 84.1402 3000.0 89.7768 2500.0 95.2742 2700.0 136.7432 2400.0 136.8347 2300.0 140.7748 2300.0 156.2292 2200.0 162.2687 2700.0 173.5221 21000.0 173.5386 55000.0 181.0859 7800.0 193.0424 2900.0 195.0657 4100.0 221.081 12000.0 304.122 2700.0 336.0989 7100.0 337.1062 5200.0 339.1236 4400.0 351.1235 13000.0 354.1453 7200.0 365.102 3800.0 367.1178 45000.0 379.1216 3300.0 381.1334 6000.0 382.1415 26000.0 395.1123 20000.0 410.1359 11000.0 411.108 11000.0 426.5862 2800.0 END IONS BEGIN IONS SCANS=492 PEPMASS=657.2423 CHARGE=1 COLLISION_ENERGY=0.0 73.0244 6400.0 73.0272 29000.0 73.1528 3900.0 73.1904 3900.0 78.736 4700.0 81.0332 33000.0 85.0261 6700.0 85.0314 6600.0 89.1942 3900.0 92.132 4200.0 93.4483 4000.0 118.026 10000.0 119.1409 4100.0 120.0415 90000.0 125.3417 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4800.0 657.2408 650000.0 END IONS BEGIN IONS SCANS=493 PEPMASS=673.2161 CHARGE=1 COLLISION_ENERGY=0.0 69.0444 7800.0 70.8921 2200.0 75.0798 2300.0 81.2289 2300.0 90.7057 2300.0 103.4242 2200.0 108.8116 2300.0 127.4758 2200.0 160.0558 2400.0 173.5236 21000.0 173.539 43000.0 175.0314 2300.0 176.513 2300.0 178.0498 10000.0 184.968 2200.0 215.0733 2300.0 235.7083 2700.0 255.2967 2400.0 274.7345 2500.0 290.0449 2500.0 317.1878 2700.0 322.1158 2300.0 340.1208 2600.0 348.7607 2800.0 356.0928 2800.0 383.3275 2800.0 385.2351 2700.0 518.6226 2600.0 599.5239 2500.0 624.4489 2600.0 639.7154 2600.0 673.2185 11000.0 END IONS BEGIN IONS SCANS=494 PEPMASS=275.1028 CHARGE=1 COLLISION_ENERGY=0.0 53.0383 42000.0 59.7097 2500.0 78.3469 2500.0 80.2895 2200.0 81.0332 230000.0 84.7184 2200.0 88.9397 2300.0 94.0644 2300.0 110.0234 14000.0 122.0597 8200.0 132.044 7800.0 149.6836 4200.0 149.6938 4100.0 150.0547 74000.0 161.4264 2900.0 166.6876 2300.0 173.5231 6900.0 173.5375 32000.0 177.8173 2600.0 178.0499 46000.0 219.0998 2200.0 221.243 3400.0 221.8019 2400.0 252.06 2300.0 261.6609 2400.0 267.5663 2500.0 END IONS BEGIN IONS SCANS=495 PEPMASS=605.2498 CHARGE=1 COLLISION_ENERGY=0.0 69.5875 2700.0 79.0541 16000.0 80.0493 22000.0 81.0333 2800000.0 81.0427 48000.0 82.0286 31000.0 94.065 26000.0 95.049 15000.0 96.0444 2600.0 98.0234 6700.0 98.0598 60000.0 104.0493 14000.0 106.0649 17000.0 108.0441 7000.0 110.0235 140000.0 110.0315 4700.0 122.0597 62000.0 125.5786 2700.0 130.0718 2500.0 132.0442 53000.0 134.0598 47000.0 136.0391 59000.0 150.0547 1100000.0 150.0672 12000.0 151.0754 15000.0 157.8183 2600.0 160.0394 16000.0 165.0544 9000.0 173.5259 42000.0 173.5435 16000.0 174.4055 2700.0 178.0131 9700.0 178.022 6600.0 178.0498 3200000.0 178.0862 25000.0 195.0651 5600.0 196.0616 3300.0 201.5282 2700.0 218.9644 2100.0 221.0805 14000.0 232.0974 9600.0 241.4177 2400.0 243.065 9800.0 244.626 2300.0 252.9173 2600.0 275.9795 2300.0 300.1235 57000.0 305.0809 2800.0 305.1175 4300.0 307.0964 6500.0 320.1046 3200.0 321.0745 3600.0 321.1129 31000.0 324.1358 14000.0 330.1476 7100.0 335.0896 13000.0 335.1292 21000.0 336.0972 16000.0 336.1363 25000.0 337.1071 37000.0 340.1262 3000.0 349.1072 7000.0 349.4732 2400.0 350.115 20000.0 351.1225 57000.0 352.1304 180000.0 353.1001 13000.0 355.1549 23000.0 364.0941 3200.0 365.138 150000.0 368.1249 34000.0 369.1333 12000.0 378.1087 6300.0 379.1175 28000.0 380.1256 120000.0 381.0966 19000.0 383.1491 200000.0 393.133 25000.0 396.1206 35000.0 411.1437 140000.0 411.2017 4900.0 459.6936 2500.0 462.1913 8300.0 END IONS BEGIN IONS SCANS=496 PEPMASS=508.1968 CHARGE=1 COLLISION_ENERGY=0.0 61.1377 2200.0 67.0806 2200.0 73.3478 2100.0 81.033 210000.0 82.0287 2900.0 92.8768 2500.0 97.7559 2500.0 98.06 4000.0 110.0235 19000.0 122.0599 2700.0 132.0438 2600.0 141.7641 2300.0 149.5976 2100.0 150.0546 71000.0 151.0747 14000.0 159.1713 2400.0 165.0554 3400.0 166.1593 2500.0 173.5266 30000.0 173.5366 47000.0 178.0497 100000.0 195.0641 2400.0 195.3294 2400.0 221.0803 2600.0 232.0969 23000.0 243.0653 16000.0 246.1139 5600.0 300.1235 97000.0 305.0811 2800.0 305.1173 12000.0 320.103 3800.0 321.1124 24000.0 324.1348 14000.0 335.0886 8700.0 335.1279 38000.0 336.1356 47000.0 336.1749 3100.0 337.1069 29000.0 347.9841 2300.0 349.1102 3000.0 350.1146 13000.0 351.1227 28000.0 352.0863 3900.0 352.1303 64000.0 353.1011 6200.0 355.1524 7200.0 365.0951 8900.0 365.1388 37000.0 366.1461 2800.0 367.1545 12000.0 368.1249 6500.0 378.1093 14000.0 379.1176 24000.0 380.1259 59000.0 381.0966 15000.0 383.15 32000.0 393.133 22000.0 396.1204 19000.0 411.1443 38000.0 462.1908 5200.0 489.8201 2600.0 504.105 2600.0 END IONS BEGIN IONS SCANS=497 PEPMASS=627.2318 CHARGE=1 COLLISION_ENERGY=0.0 64.4985 2500.0 66.0129 2800.0 71.8074 2300.0 73.729 2100.0 92.3542 2500.0 96.2721 2700.0 96.6293 2200.0 99.6871 2300.0 103.6257 2600.0 120.0415 20000.0 124.9443 2800.0 140.6468 2700.0 141.3251 2300.0 143.4313 2100.0 149.6839 9300.0 149.6944 7700.0 152.3682 2500.0 162.541 2500.0 173.529 38000.0 173.5444 8400.0 178.0495 7000.0 200.0319 7400.0 215.4245 2600.0 220.9111 2400.0 252.2368 2400.0 253.094 16000.0 269.0894 110000.0 297.0846 440000.0 310.105 430000.0 310.1466 5300.0 316.4331 2400.0 322.1043 8500.0 325.0886 2800.0 330.0111 2700.0 340.1152 380000.0 340.1649 3000.0 352.1143 3900.0 377.0509 2700.0 382.893 2400.0 405.1318 9500.0 433.1226 8100.0 456.1411 39000.0 471.1655 17000.0 486.1883 20000.0 502.1832 74000.0 530.1789 37000.0 589.536 2800.0 627.231 79000.0 END IONS BEGIN IONS SCANS=498 PEPMASS=650.3076 CHARGE=1 COLLISION_ENERGY=0.0 65.323 4700.0 67.6509 2800.0 71.3265 2200.0 81.0333 670000.0 81.0389 5800.0 87.5815 2500.0 91.1967 2800.0 94.065 2600.0 98.0598 6300.0 99.6665 2600.0 101.3937 2500.0 102.1403 2400.0 106.0645 2700.0 107.9032 2900.0 110.0235 21000.0 110.3071 3000.0 122.0599 13000.0 132.0441 15000.0 134.0598 15000.0 136.0395 13000.0 137.7339 2400.0 146.4731 2500.0 150.0411 3700.0 150.0547 280000.0 162.1989 2300.0 166.2465 2500.0 172.5361 2600.0 173.5202 5600.0 173.5356 81000.0 178.0498 1400000.0 185.0715 2500.0 219.6758 2600.0 252.8792 2500.0 258.7371 2800.0 279.8394 2600.0 285.2986 2500.0 292.5379 2600.0 300.1238 24000.0 330.147 3600.0 351.122 6000.0 352.1298 24000.0 354.8698 2500.0 365.1376 21000.0 380.1253 17000.0 383.1493 49000.0 396.1208 4600.0 411.1438 45000.0 450.4547 3000.0 507.4238 2400.0 594.6995 2900.0 END IONS BEGIN IONS SCANS=499 PEPMASS=280.0948 CHARGE=1 COLLISION_ENERGY=0.0 49.1195 2200.0 54.8663 2300.0 58.4264 2200.0 59.2393 2300.0 60.8363 2600.0 63.1085 2500.0 65.2857 2200.0 70.2721 2200.0 81.8484 2700.0 83.2903 2100.0 93.0574 2400.0 93.7606 2500.0 95.5203 2300.0 96.4257 2200.0 98.9281 2900.0 98.9819 2300.0 109.4923 2300.0 111.605 2700.0 115.3264 2600.0 118.245 2200.0 120.0415 5200.0 121.1257 2700.0 137.9423 2300.0 161.0584 2700.0 164.9294 2300.0 173.5285 54000.0 175.6325 2400.0 180.9866 2300.0 202.05 2900.0 219.0571 19000.0 220.0599 41000.0 221.4831 2200.0 280.0962 83000.0 END IONS BEGIN IONS SCANS=500 PEPMASS=675.267 CHARGE=1 COLLISION_ENERGY=0.0 66.8021 18000.0 66.8049 4000.0 66.9711 2500.0 68.406 2400.0 69.2673 2500.0 70.3603 88000.0 70.3641 15000.0 75.0269 2200.0 79.4357 2500.0 81.0088 2300.0 82.1458 2700.0 83.385 2500.0 84.6698 2500.0 85.1773 2400.0 86.3357 2300.0 88.8576 2300.0 101.0737 2300.0 115.3543 2400.0 129.5169 2600.0 158.3077 2200.0 173.5265 16000.0 173.5372 62000.0 180.7317 2700.0 197.1542 2300.0 209.7531 2400.0 222.0257 2300.0 223.946 2700.0 286.0149 2400.0 287.061 2500.0 287.4895 2500.0 324.0716 2400.0 349.3474 2500.0 368.0897 2400.0 369.7715 2500.0 372.8662 2200.0 394.1755 2900.0 408.1696 2600.0 424.5204 3200.0 426.3569 2800.0 443.0478 2700.0 444.1785 6300.0 445.1895 3500.0 457.1499 6700.0 469.1817 2900.0 472.1745 88000.0 473.1837 10000.0 478.1956 3000.0 486.1535 11000.0 497.1789 15000.0 497.1874 3000.0 500.1703 35000.0 501.178 15000.0 527.1922 3500.0 544.2276 7800.0 545.2323 50000.0 556.1954 57000.0 560.3754 2500.0 573.1254 4600.0 573.2351 1200000.0 573.3389 5000.0 574.2354 6600.0 597.265 2900.0 601.2303 450000.0 605.2508 18000.0 615.2452 4600.0 632.2523 3400.0 633.0097 9000.0 633.2557 2500000.0 643.2397 25000.0 657.2556 26000.0 675.2673 120000.0 682.7578 2400.0 END IONS BEGIN IONS SCANS=501 PEPMASS=288.1235 CHARGE=1 COLLISION_ENERGY=0.0 47.0495 2400.0 47.4871 2200.0 47.7664 4400.0 47.7687 7600.0 48.7824 2500.0 52.2479 2400.0 55.7401 2700.0 61.3253 2600.0 61.6237 2500.0 65.5028 2200.0 66.137 2300.0 70.6197 2700.0 73.0755 2400.0 74.096 2400.0 78.0612 2200.0 78.3179 2200.0 79.0542 14000.0 80.3113 2600.0 91.0542 18000.0 91.7476 2500.0 92.0333 2200.0 98.0598 8400.0 102.0463 2500.0 103.0541 31000.0 105.0336 3300.0 105.0697 43000.0 106.2332 2400.0 108.6786 2800.0 111.5691 2100.0 115.0543 2500.0 118.042 9200.0 119.0491 31000.0 119.7404 2500.0 120.0569 19000.0 121.0645 2600.0 129.9304 2300.0 132.0569 51000.0 133.0285 20000.0 133.0648 53000.0 133.5214 2400.0 135.0803 15000.0 135.1898 2300.0 136.3133 2400.0 146.0357 7800.0 147.0439 47000.0 148.0515 190000.0 151.0415 2500.0 151.3949 2200.0 156.6224 2600.0 160.0518 95000.0 161.0595 27000.0 163.059 11000.0 163.0753 840000.0 163.0914 5000.0 167.0341 46000.0 168.0375 38000.0 173.5232 5200.0 173.5317 74000.0 173.5412 6900.0 176.047 110000.0 184.0328 2300.0 187.5032 2500.0 191.0302 18000.0 191.0703 3900000.0 204.1093 3000.0 211.0842 2800.0 239.4389 2800.0 245.2666 2700.0 250.4921 2300.0 261.6057 2200.0 284.438 2400.0 288.0959 7900.0 END IONS BEGIN IONS SCANS=502 PEPMASS=627.232 CHARGE=1 COLLISION_ENERGY=0.0 66.6221 2400.0 66.7017 2200.0 68.7749 2500.0 74.6857 2400.0 78.725 2500.0 82.9803 2100.0 101.9928 2300.0 106.1061 2500.0 107.2946 2200.0 108.9042 2500.0 112.2516 2300.0 120.0414 22000.0 126.9754 2300.0 128.9849 2100.0 132.3295 2500.0 136.3172 2400.0 138.2757 2700.0 140.5775 2400.0 141.3815 2300.0 153.382 2000.0 162.5913 2600.0 172.0696 2500.0 173.5304 98000.0 173.542 15000.0 177.8176 3000.0 188.0312 140000.0 191.0704 3000.0 226.2144 2900.0 297.0851 2700.0 310.0742 2100.0 310.1049 330000.0 310.1461 3700.0 325.0917 3000.0 340.1153 280000.0 365.1355 7700.0 406.5245 2600.0 416.1407 2600.0 433.1257 110000.0 433.1891 3900.0 530.1771 50000.0 537.1439 2500.0 627.2298 60000.0 END IONS BEGIN IONS SCANS=503 PEPMASS=304.1548 CHARGE=1 COLLISION_ENERGY=0.0 48.2715 5200.0 48.8502 2200.0 49.2096 2400.0 52.4772 2200.0 52.6415 2300.0 54.0338 23000.0 55.0179 6600.0 55.0542 11000.0 55.2684 5300.0 55.2709 44000.0 55.4605 2400.0 56.0494 30000.0 56.0967 2600.0 60.1426 2100.0 62.2501 2300.0 65.0386 22000.0 67.0415 40000.0 67.054 250000.0 68.0493 30000.0 69.0334 8900.0 71.0269 2200.0 79.054 7000.0 80.0494 29000.0 82.0232 5400.0 82.0285 450000.0 82.0649 450000.0 83.0728 120000.0 84.0806 150000.0 91.0542 33000.0 92.0494 7000.0 102.0465 10000.0 103.0541 19000.0 104.0621 7000.0 105.022 2500.0 105.0697 39000.0 107.0489 31000.0 108.0805 3900.0 110.06 1200000.0 113.0595 73000.0 113.8139 2600.0 118.0411 30000.0 119.049 48000.0 120.2167 2700.0 121.0647 7100.0 122.0721 3600.0 130.0314 3100.0 130.0413 69000.0 131.049 33000.0 132.0568 39000.0 133.0647 110000.0 134.0724 14000.0 135.0441 77000.0 135.0804 6400.0 136.075 3600.0 138.8455 3100.0 139.2962 2900.0 144.0568 3500.0 145.7888 2400.0 146.0362 23000.0 147.044 360000.0 148.0519 44000.0 149.0596 56000.0 150.0675 64000.0 158.035 6600.0 158.2866 2700.0 159.0441 22000.0 160.0518 91000.0 161.0597 230000.0 162.0513 4500.0 162.0675 1100000.0 163.0389 330000.0 163.0753 190000.0 164.0479 2500.0 164.4524 2200.0 165.0912 48000.0 167.0702 51000.0 172.0516 5100.0 173.5212 10000.0 173.5338 76000.0 173.5488 2800.0 174.0161 2500.0 174.0313 120000.0 175.0391 290000.0 176.047 230000.0 177.0547 240000.0 178.0442 9100.0 178.0493 4400.0 178.0626 1000000.0 178.0807 15000.0 179.0705 8700.0 180.8879 13000.0 181.086 42000.0 188.0469 65000.0 189.0347 7900.0 189.0547 610000.0 189.0744 7300.0 190.0226 21000.0 190.0624 5600000.0 190.0773 30000.0 190.1017 4700.0 190.4612 2300.0 190.8697 2700.0 191.0141 5100.0 191.0339 1600000.0 191.0701 450000.0 191.088 6900.0 192.0415 81000.0 193.0445 8400.0 193.086 4200000.0 193.2549 3100.0 195.0516 2400.0 201.8845 2500.0 205.0499 61000.0 206.0347 5900.0 206.0575 2500000.0 207.0652 140000.0 208.8832 70000.0 221.0019 4000.0 221.0301 89000.0 221.0406 21000.0 221.0809 14000000.0 221.0999 36000.0 221.1202 46000.0 221.1318 63000.0 221.1466 17000.0 226.8941 55000.0 242.1184 24000.0 262.1436 19000.0 270.1116 6900.0 END IONS BEGIN IONS SCANS=504 PEPMASS=217.0862 CHARGE=1 COLLISION_ENERGY=0.0 42.2832 2200.0 42.4815 5100.0 43.0178 76000.0 44.0087 2200.0 45.0335 58000.0 45.1593 2300.0 45.7493 3100.0 45.8503 2500.0 47.0591 2600.0 47.9032 2400.0 47.9599 2300.0 48.275 2400.0 49.5677 4900.0 50.9607 4900.0 53.0386 12000.0 55.0177 43000.0 55.4483 2200.0 57.0333 220000.0 57.3061 2200.0 57.7436 2400.0 58.3207 2900.0 58.6886 2500.0 58.7185 2200.0 59.4079 2400.0 63.6705 2400.0 64.0696 5100.0 67.0541 72000.0 68.068 2300.0 70.2039 2100.0 73.5758 2200.0 73.6768 2800.0 75.4901 2300.0 77.0389 5300.0 77.5863 2500.0 78.1659 2500.0 79.582 2200.0 80.5172 2300.0 81.0331 2500.0 81.847 2400.0 82.3509 2200.0 91.0541 1200000.0 91.0592 5000.0 91.0608 10000.0 94.9671 2800.0 95.0493 19000.0 102.046 2800.0 103.054 210000.0 105.0697 51000.0 110.9998 2400.0 111.4513 2500.0 114.4518 2200.0 115.0406 2900.0 115.0449 3800.0 115.0541 1700000.0 115.0624 9400.0 116.0619 340000.0 117.0697 430000.0 119.1364 3400.0 121.6561 3000.0 125.411 2300.0 127.0544 60000.0 127.6007 2100.0 128.0512 5300.0 128.0619 1500000.0 128.0709 4200.0 129.0469 9900.0 129.0696 19000000.0 129.0789 180000.0 129.0875 20000.0 129.0923 180000.0 129.112 2800.0 130.0411 41000.0 130.0776 39000.0 131.0489 690000.0 131.0616 4600.0 131.0853 5200000.0 131.0948 37000.0 131.1085 4300.0 132.8973 4800.0 133.0646 85000.0 133.3363 3200.0 135.0439 390000.0 135.0802 120000.0 139.0547 8900.0 140.0612 6000.0 141.0441 28000.0 141.0697 9900000.0 141.0798 110000.0 141.0926 33000.0 141.0953 9000.0 141.103 4600.0 141.5743 2300.0 143.0489 520000.0 143.061 32000.0 143.0854 290000.0 144.044 12000.0 144.0568 650000.0 144.0692 11000.0 145.0531 5700.0 145.0646 480000.0 147.0445 14000.0 148.0194 2800.0 148.9005 2500.0 149.0229 4300.0 149.0595 78000.0 151.0535 2500.0 152.0622 31000.0 153.0698 82000.0 155.0484 6300.0 155.0602 170000.0 156.0568 150000.0 157.035 5100.0 157.0646 8100000.0 157.0763 80000.0 157.0943 27000.0 158.0727 12000.0 159.044 160000.0 159.0803 2400000.0 159.0924 7200.0 160.0518 160000.0 161.0596 360000.0 168.0571 51000.0 169.0647 3200000.0 171.0439 55000.0 171.0804 69000.0 172.0519 1100000.0 172.0689 32000.0 173.0597 1000000.0 173.0767 5200.0 173.5215 32000.0 173.5367 120000.0 174.0677 48000.0 175.0393 23000.0 175.0755 72000.0 176.047 43000.0 179.0599 18000.0 185.0598 370000.0 186.0485 9900.0 186.0676 1300000.0 186.0827 5500.0 187.0556 5100.0 187.0754 5300000.0 187.0897 6500.0 188.0467 6600.0 188.0833 44000.0 189.0546 110000.0 189.0734 2400.0 189.0912 170000.0 195.3627 3500.0 198.0713 6000.0 198.0911 50000.0 199.0753 3500000.0 199.0925 2600.0 199.1057 3400.0 202.0627 6700.0 215.0696 2500.0 217.0861 630000.0 END IONS BEGIN IONS SCANS=505 PEPMASS=680.3184 CHARGE=1 COLLISION_ENERGY=0.0 68.0829 2400.0 74.1151 3900.0 74.5746 4200.0 76.4496 2500.0 81.0334 100000.0 85.0082 2400.0 90.4356 2300.0 91.0362 2400.0 98.0598 130000.0 98.4926 5300.0 112.7393 2500.0 117.2045 2300.0 119.049 2900.0 129.0287 2600.0 130.0403 4500.0 134.0397 2700.0 135.0439 5800.0 135.9472 2400.0 136.5608 2900.0 140.3099 2600.0 147.0441 36000.0 150.0549 16000.0 161.0601 3000.0 162.0675 73000.0 163.0388 32000.0 163.0753 3700.0 165.1206 2400.0 169.7104 2500.0 173.5256 73000.0 173.5374 140000.0 173.5452 14000.0 175.0396 29000.0 177.0557 9500.0 178.0497 75000.0 178.0634 42000.0 181.0857 9400.0 181.1599 2600.0 183.0345 2500.0 189.0547 41000.0 190.0624 510000.0 191.034 84000.0 191.0705 53000.0 193.0859 440000.0 195.0652 260000.0 205.0859 81000.0 206.0574 190000.0 219.1021 12000.0 220.9722 3700.0 221.0154 31000.0 221.0299 150000.0 221.0408 44000.0 221.0809 22000000.0 221.12 66000.0 221.132 150000.0 221.1465 28000.0 221.161 11000.0 222.0847 18000.0 240.0055 2500.0 244.745 2600.0 245.0807 14000.0 273.0757 63000.0 288.4161 3100.0 289.8533 2300.0 290.1028 57000.0 299.8408 2700.0 300.1237 130000.0 300.7198 2800.0 310.1067 8700.0 318.1334 52000.0 326.1404 4600.0 339.7556 2700.0 342.1338 39000.0 353.1021 14000.0 354.1449 31000.0 367.118 6500.0 368.1262 33000.0 369.095 3900.0 370.1324 19000.0 371.149 79000.0 382.1401 34000.0 384.1222 6800.0 385.1651 36000.0 399.144 1100000.0 399.2055 13000.0 413.1602 120000.0 441.1544 190000.0 459.3759 2700.0 461.7388 2500.0 512.668 2500.0 520.1962 10000.0 584.2372 2600.0 591.6115 4500.0 613.1817 4800.0 622.0554 49000.0 667.1505 2800.0 END IONS BEGIN IONS SCANS=506 PEPMASS=637.2727 CHARGE=1 COLLISION_ENERGY=0.0 75.9065 2300.0 76.2147 2800.0 81.0333 290000.0 81.039 4000.0 82.0288 3200.0 82.065 30000.0 98.0599 5600.0 108.0443 3600.0 110.0234 110000.0 119.4248 2800.0 124.0393 11000.0 131.0747 2300.0 134.0599 4700.0 136.0391 56000.0 136.0755 55000.0 147.0443 2900.0 150.0547 110000.0 152.0705 66000.0 153.0177 2300.0 162.0669 6800.0 171.9509 2300.0 173.5235 16000.0 173.5317 59000.0 173.5429 12000.0 175.1404 2800.0 178.0498 320000.0 178.0676 3900.0 179.0532 6300.0 180.0654 430000.0 180.0841 6000.0 181.0856 3800.0 190.0621 20000.0 191.067 17000.0 192.0687 4000.0 193.086 16000.0 194.089 5700.0 195.0651 55000.0 196.0684 29000.0 197.0699 13000.0 205.0858 15000.0 206.0564 5000.0 206.0895 9600.0 219.1018 3000.0 221.0808 300000.0 221.0997 3300.0 222.0843 220000.0 222.1097 3200.0 223.0864 100000.0 273.0752 7900.0 274.0787 3500.0 275.0811 2700.0 280.5205 2900.0 290.1023 4300.0 300.123 28000.0 301.1256 17000.0 302.1327 11000.0 326.1312 2400.0 351.1221 8200.0 353.0977 3100.0 354.1013 3000.0 355.1505 4100.0 367.1162 14000.0 368.1229 9100.0 369.1253 10000.0 370.1328 4900.0 371.1469 6600.0 372.1506 15000.0 373.1553 16000.0 381.1333 10000.0 382.1402 30000.0 383.1463 3800.0 384.1499 5500.0 386.1654 3500.0 387.171 7200.0 395.1485 24000.0 398.1322 2600.0 399.1431 67000.0 400.1468 150000.0 401.1495 180000.0 409.1243 3700.0 410.136 17000.0 413.1596 35000.0 414.1614 9200.0 415.1641 16000.0 426.1316 3100.0 441.1529 25000.0 442.1573 14000.0 443.1601 26000.0 510.1209 2500.0 END IONS BEGIN IONS SCANS=507 PEPMASS=657.2425 CHARGE=1 COLLISION_ENERGY=0.0 66.6954 2400.0 73.0246 7800.0 73.0276 12000.0 81.932 2500.0 83.5111 3300.0 85.0263 15000.0 85.0309 4500.0 86.4609 2500.0 90.3373 3800.0 107.0635 2400.0 115.6994 3700.0 117.0223 2700.0 119.0342 2800.0 120.0417 170000.0 130.3307 2900.0 135.6241 2600.0 147.0301 2600.0 157.7898 2400.0 165.0095 3200.0 173.5295 120000.0 173.5419 30000.0 188.0119 5500.0 188.0317 1200000.0 188.0517 7600.0 205.0858 3300.0 215.4759 4400.0 217.047 3600.0 221.0812 38000.0 243.0631 12000.0 279.0892 5600.0 296.0903 5000.0 297.0848 15000.0 300.1218 3100.0 310.0705 7300.0 320.1288 2600.0 324.0851 8900.0 325.0924 100000.0 338.1001 6300.0 340.0198 29000.0 340.1154 5700000.0 340.1899 6400.0 340.2126 10000.0 364.118 3000.0 389.0952 5000.0 395.1468 160000.0 399.1437 11000.0 431.6431 2600.0 433.0877 13000.0 448.1099 18000.0 461.1663 3800.0 463.0582 15000.0 463.1362 1400000.0 463.212 7600.0 486.153 2900.0 516.1989 31000.0 530.1367 3100.0 532.1969 4300.0 559.2039 31000.0 560.1889 440000.0 567.6682 3900.0 657.2406 580000.0 657.3655 5700.0 END IONS BEGIN IONS SCANS=508 PEPMASS=221.0812 CHARGE=1 COLLISION_ENERGY=0.0 43.0177 12000.0 45.0335 14000.0 46.2724 2400.0 46.9784 5700.0 53.0021 26000.0 54.5171 7400.0 55.0178 32000.0 55.7278 5600.0 61.6214 5600.0 65.0385 17000.0 66.5371 8100.0 68.997 28000.0 69.1203 2500.0 69.791 5700.0 71.9108 5800.0 72.0274 7400.0 73.4358 7500.0 73.9448 4200.0 76.0502 6000.0 77.0385 44000.0 78.0462 180000.0 79.0539 320000.0 82.1317 7500.0 85.246 4800.0 85.4241 8700.0 89.0385 39000.0 90.0462 55000.0 91.0483 13000.0 91.0539 470000.0 92.0257 15000.0 92.0619 53000.0 93.07 30000.0 94.0411 6300.0 95.0488 88000.0 102.0387 9800.0 102.0462 620000.0 103.054 290000.0 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4200.0 158.0362 78000.0 159.0076 59000.0 159.044 170000.0 160.0518 860000.0 160.0645 4000.0 161.0233 160000.0 161.0596 680000.0 161.0754 7000.0 162.0332 26000.0 162.0513 20000.0 162.0675 2300000.0 163.0389 4100000.0 163.0508 25000.0 163.0751 390000.0 163.0902 4100.0 165.0911 12000.0 167.0711 6500.0 170.036 6500.0 173.023 53000.0 173.5247 53000.0 173.5369 120000.0 174.0313 240000.0 175.0255 2600.0 175.0391 2200000.0 176.0105 5800.0 176.0469 560000.0 176.0646 18000.0 177.0547 630000.0 177.0723 23000.0 178.0439 36000.0 178.0626 2100000.0 187.0388 51000.0 188.0469 290000.0 189.0549 150000.0 190.0624 2800000.0 191.0138 30000.0 191.0339 1200000.0 191.07 120000.0 192.041 45000.0 193.0707 3400.0 193.086 1300000.0 193.1067 43000.0 205.0276 2400.0 205.0498 91000.0 206.0348 6800.0 206.0576 700000.0 206.0798 2600.0 221.081 220000.0 END IONS BEGIN IONS SCANS=509 PEPMASS=319.1373 CHARGE=1 COLLISION_ENERGY=0.0 49.1485 2100.0 50.4843 3200.0 69.3746 2500.0 82.2281 2500.0 82.7067 2200.0 86.1739 2900.0 86.9223 2500.0 92.0003 2400.0 98.8868 2200.0 119.721 3000.0 128.1728 2600.0 161.0568 2700.0 162.067 10000.0 163.0707 17000.0 173.5244 22000.0 173.5405 21000.0 175.0363 3100.0 177.0507 2800.0 178.0617 10000.0 179.0655 15000.0 190.0617 46000.0 191.0344 9900.0 191.0658 68000.0 192.0371 15000.0 192.0723 2600.0 193.086 27000.0 194.0892 63000.0 206.0574 18000.0 207.0607 33000.0 221.0809 95000.0 222.0843 190000.0 248.5656 2700.0 322.1586 2500.0 END IONS BEGIN IONS SCANS=510 PEPMASS=635.2604 CHARGE=1 COLLISION_ENERGY=0.0 71.2226 2700.0 71.5626 2600.0 73.0126 2700.0 74.9574 2400.0 75.7471 2100.0 76.4388 2300.0 77.0877 2400.0 79.0542 4100.0 81.0333 800000.0 86.2994 2300.0 86.6182 2700.0 88.3152 2200.0 91.0543 2400.0 95.0491 2800.0 96.933 2800.0 97.8429 2100.0 98.0599 71000.0 99.7799 2400.0 99.868 2800.0 104.0358 2600.0 105.0698 2600.0 106.5278 2800.0 107.0482 2900.0 108.6111 2500.0 109.5444 3000.0 110.0237 20000.0 113.9639 2300.0 117.4006 2500.0 119.049 9800.0 122.06 16000.0 124.5589 2200.0 125.1312 2100.0 129.7932 2300.0 130.041 4200.0 131.0486 2600.0 132.0439 7800.0 132.0571 9000.0 133.0645 3300.0 134.0602 6900.0 135.0439 16000.0 136.0397 11000.0 137.1669 2400.0 138.055 4800.0 139.0501 2100.0 145.9628 2300.0 147.0439 53000.0 148.0518 5600.0 149.0596 7400.0 150.0411 4400.0 150.0548 260000.0 150.0674 2800.0 151.0874 2400.0 152.0469 2500.0 154.8757 2800.0 158.1589 3100.0 158.8133 2300.0 160.052 12000.0 161.0595 9200.0 162.0676 71000.0 163.0389 74000.0 163.0749 23000.0 163.6432 2200.0 166.0489 3200.0 167.0702 3600.0 167.9789 2100.0 173.5105 3100.0 173.5304 130000.0 173.5377 40000.0 174.462 2300.0 175.0388 30000.0 175.8249 2400.0 175.8693 2500.0 176.0468 5100.0 177.0551 5700.0 178.0335 22000.0 178.0499 910000.0 178.0636 56000.0 180.042 3500.0 181.0859 50000.0 182.607 2200.0 189.0548 13000.0 190.0624 290000.0 191.034 64000.0 191.0697 12000.0 193.0859 220000.0 194.7467 2700.0 195.0652 710000.0 197.078 2400.0 198.0572 2300.0 198.2822 2200.0 205.086 250000.0 206.0575 100000.0 211.2224 2800.0 219.1017 41000.0 221.0165 3800.0 221.0304 16000.0 221.0809 4600000.0 221.1322 13000.0 222.0847 20000.0 226.7964 2400.0 244.9753 2400.0 245.0808 66000.0 247.0955 2600.0 248.1203 2500.0 273.0759 120000.0 274.1064 8400.0 274.9985 2300.0 275.1109 7700.0 283.0956 4300.0 285.6404 2400.0 289.1313 13000.0 290.1024 96000.0 290.1354 5900.0 291.6359 2500.0 300.1234 290000.0 300.1622 6400.0 302.102 7700.0 302.2538 2600.0 309.1034 2800.0 310.1084 12000.0 312.3416 2600.0 313.1084 2600.0 314.1384 10000.0 317.127 11000.0 318.1308 13000.0 322.1203 4700.0 324.122 2600.0 325.1069 4100.0 326.1388 21000.0 327.121 5500.0 328.1184 3900.0 330.1458 3700.0 337.1016 3500.0 338.1154 5000.0 339.122 23000.0 340.1309 3200.0 341.1004 4500.0 342.1336 57000.0 350.1153 3600.0 351.1235 24000.0 352.0923 7300.0 352.1241 8400.0 353.1016 70000.0 353.1399 3100.0 354.146 110000.0 355.1166 6300.0 356.1257 16000.0 357.382 3400.0 358.1427 4400.0 365.1008 10000.0 366.1087 24000.0 367.1176 120000.0 368.1253 140000.0 369.097 23000.0 370.1338 39000.0 371.1488 240000.0 380.1259 11000.0 381.1331 65000.0 382.141 240000.0 383.1102 23000.0 384.1203 48000.0 385.1646 120000.0 395.1008 2500.0 395.1493 120000.0 398.1355 30000.0 399.022 7800.0 399.0839 5000.0 399.1438 2900000.0 399.2048 5100.0 399.2676 3300.0 409.1286 12000.0 410.1368 41000.0 411.1061 7600.0 413.1597 350000.0 413.221 3300.0 417.0536 3200.0 423.1456 6000.0 426.1315 12000.0 441.1542 420000.0 520.1952 30000.0 596.1783 2700.0 608.5355 2800.0 634.1426 2700.0 635.0578 22000.0 END IONS BEGIN IONS SCANS=511 PEPMASS=318.1341 CHARGE=1 COLLISION_ENERGY=0.0 49.0042 3700.0 51.1122 9000.0 55.0179 19000.0 55.2697 160000.0 55.2717 34000.0 57.5317 4100.0 71.372 10000.0 76.0322 9300.0 76.0544 11000.0 78.0463 32000.0 78.8432 8000.0 79.0541 92000.0 81.8558 3500.0 88.264 3800.0 89.039 4100.0 89.0935 3600.0 91.0543 150000.0 95.0492 38000.0 95.0853 12000.0 98.06 400000.0 102.0464 110000.0 103.0542 84000.0 104.0619 73000.0 105.0339 20000.0 105.0697 130000.0 105.3645 9200.0 105.4479 7700.0 107.049 130000.0 111.0443 7600.0 112.1824 3600.0 115.0546 6500.0 116.0623 20000.0 116.1013 7900.0 118.0412 110000.0 118.0493 4100.0 119.0491 250000.0 120.0571 24000.0 121.0649 65000.0 122.0723 50000.0 125.6304 7400.0 125.9626 13000.0 130.0413 380000.0 131.0489 150000.0 132.0568 260000.0 133.0284 45000.0 133.0648 380000.0 134.0729 55000.0 134.255 14000.0 135.0441 380000.0 135.0805 45000.0 137.8393 4400.0 144.0571 60000.0 145.0288 21000.0 145.0654 5000.0 146.0363 100000.0 147.0441 1500000.0 147.0552 3200.0 148.0519 200000.0 149.0596 260000.0 150.0675 260000.0 151.0757 5300.0 158.0359 41000.0 159.0442 120000.0 160.0519 470000.0 161.0244 17000.0 161.0598 720000.0 161.4831 4400.0 162.0559 9400.0 162.0676 4200000.0 163.039 1400000.0 163.055 4000.0 163.0754 790000.0 165.0912 210000.0 167.0704 150000.0 172.0515 42000.0 173.0233 23000.0 173.5299 230000.0 173.5576 9400.0 174.0313 460000.0 175.0391 1200000.0 176.047 1100000.0 176.0646 4900.0 177.0548 780000.0 178.0438 16000.0 178.0626 4000000.0 188.047 420000.0 189.0348 18000.0 189.0547 1900000.0 189.0746 26000.0 190.0111 6100.0 190.0225 110000.0 190.0625 21000000.0 190.0936 83000.0 190.1031 120000.0 191.0339 4500000.0 191.0703 1500000.0 191.0855 12000.0 192.0416 220000.0 193.0328 14000.0 193.0861 15000000.0 193.1272 100000.0 193.1392 6500.0 203.986 8100.0 205.05 160000.0 206.0576 8000000.0 221.0155 15000.0 221.0302 310000.0 221.0405 140000.0 221.081 48000000.0 221.1203 200000.0 221.132 290000.0 221.1467 30000.0 221.1747 7400.0 235.4184 13000.0 290.4157 4600.0 294.528 8700.0 310.7798 11000.0 323.4232 12000.0 END IONS BEGIN IONS SCANS=512 PEPMASS=538.2075 CHARGE=1 COLLISION_ENERGY=0.0 60.5983 2300.0 67.1325 2200.0 69.1531 2200.0 69.8118 2400.0 74.5811 2200.0 77.9835 2300.0 81.0334 41000.0 82.6481 2600.0 83.7689 2200.0 85.004 2700.0 95.8071 2600.0 97.3638 2200.0 98.0601 23000.0 99.6887 2500.0 104.7732 2700.0 111.8771 2300.0 114.3934 2500.0 122.0601 2700.0 132.1276 2700.0 140.82 3000.0 145.4023 2200.0 149.6874 5000.0 149.6978 3700.0 152.0467 5700.0 156.4637 2400.0 163.0757 12000.0 163.7101 2500.0 167.0701 2700.0 173.5221 14000.0 173.531 58000.0 173.5412 17000.0 173.6847 2400.0 178.0489 2800.0 178.5824 2100.0 181.0861 11000.0 185.2636 2500.0 190.0622 30000.0 192.3059 2800.0 193.0859 23000.0 195.0444 2600.0 195.0653 340000.0 195.0859 6400.0 205.0862 170000.0 206.0576 25000.0 219.1021 22000.0 221.0809 1000000.0 238.7744 2900.0 244.5509 2500.0 245.0811 33000.0 269.5546 2600.0 273.0756 24000.0 279.9697 2400.0 290.1006 3800.0 300.123 21000.0 307.0966 2600.0 309.1125 2300.0 310.1086 6200.0 317.3214 2400.0 318.1318 2600.0 324.1234 5700.0 327.122 4500.0 337.0686 4200.0 337.1096 4100.0 338.1161 7300.0 339.1236 19000.0 340.1293 3200.0 341.1014 11000.0 342.1331 35000.0 351.0845 3200.0 351.1254 3700.0 352.0921 23000.0 352.1192 7300.0 353.1015 85000.0 354.1464 51000.0 356.1257 21000.0 358.14 3000.0 358.4862 2400.0 366.1084 6600.0 367.118 47000.0 368.1253 130000.0 369.0961 42000.0 370.1412 7200.0 371.0959 3400.0 371.1487 190000.0 381.1329 11000.0 382.1405 44000.0 383.1122 7400.0 384.1203 48000.0 385.1651 30000.0 391.0242 2600.0 395.1528 4300.0 398.1364 6300.0 399.1437 1900000.0 399.2063 3100.0 410.1312 3600.0 413.1594 42000.0 415.6976 2500.0 419.849 3100.0 423.1384 2600.0 423.1476 3400.0 426.132 2400.0 441.1541 85000.0 444.4185 2600.0 530.7488 2500.0 END IONS BEGIN IONS SCANS=513 PEPMASS=617.25 CHARGE=1 COLLISION_ENERGY=0.0 67.6746 2700.0 68.1033 2700.0 74.2001 2200.0 81.4061 2200.0 82.8903 2200.0 86.7954 2300.0 102.51 3100.0 118.2173 2500.0 122.0597 19000.0 131.8907 2700.0 140.489 2600.0 145.1713 2400.0 148.1218 2600.0 149.6888 16000.0 159.3089 2500.0 162.0669 3600.0 173.523 29000.0 173.5408 36000.0 178.0632 2600.0 178.4566 2300.0 181.0859 19000.0 184.0144 2400.0 185.0126 3100.0 189.0551 3100.0 190.0623 58000.0 191.0702 5000.0 193.0859 47000.0 198.1912 2300.0 203.5112 2500.0 206.0572 26000.0 211.4095 2100.0 219.1017 71000.0 221.0808 1600000.0 270.076 2700.0 285.1001 17000.0 300.1232 2400000.0 300.2031 7600.0 324.1234 10000.0 337.1024 2900.0 339.1206 2500.0 346.9607 2500.0 352.1176 140000.0 353.1027 11000.0 356.1249 7700.0 368.1262 19000.0 369.0982 3900.0 371.1485 78000.0 384.1203 15000.0 385.473 2500.0 399.082 5400.0 399.1436 900000.0 399.2054 4700.0 407.3198 2500.0 416.2353 2600.0 441.1548 2400.0 446.1585 2800.0 462.1538 2900.0 474.1503 3200.0 490.1463 4400.0 492.2025 4700.0 505.1721 18000.0 520.1958 360000.0 520.2844 5500.0 END IONS BEGIN IONS SCANS=514 PEPMASS=673.2163 CHARGE=1 COLLISION_ENERGY=0.0 66.7947 2500.0 72.376 2500.0 72.6427 2500.0 74.105 2300.0 79.0448 2400.0 79.5301 2700.0 79.803 2000.0 120.5487 2400.0 121.2148 2400.0 125.2849 2500.0 128.892 2200.0 142.7443 2600.0 156.603 2500.0 161.4902 2700.0 173.5276 55000.0 173.544 16000.0 201.4119 2300.0 201.5685 2700.0 207.2705 2300.0 234.8189 2200.0 420.723 3900.0 500.51 2600.0 526.7961 2900.0 628.6236 2900.0 630.8904 2600.0 END IONS BEGIN IONS SCANS=515 PEPMASS=222.0844 CHARGE=1 COLLISION_ENERGY=0.0 51.2875 2200.0 54.7291 2400.0 55.4732 2300.0 57.9563 2400.0 58.0649 17000.0 61.2676 2700.0 62.0658 2500.0 62.1786 2300.0 65.2754 2300.0 65.5809 2500.0 65.7319 2200.0 70.8441 2900.0 73.0266 2500.0 91.0539 12000.0 98.2808 2300.0 103.0491 2500.0 107.0485 2600.0 109.9041 2400.0 111.9676 9400.0 112.9535 6300.0 117.8855 2400.0 119.0486 18000.0 120.0521 2700.0 120.23 2200.0 121.6127 2400.0 122.3107 2700.0 131.0444 3800.0 133.06 2800.0 134.0695 2500.0 135.0434 18000.0 135.9696 5100.0 136.0472 4000.0 147.0438 8300.0 148.0473 22000.0 149.0549 3700.0 149.6865 12000.0 150.9102 2300.0 153.9803 6100.0 154.8577 2900.0 162.0643 4900.0 163.039 13000.0 163.0708 25000.0 164.0421 37000.0 173.5281 12000.0 173.5388 17000.0 176.0422 19000.0 178.058 2800.0 178.1378 2300.0 179.0661 18000.0 190.0618 2600.0 191.0658 33000.0 192.0373 10000.0 194.0894 12000.0 203.1971 2300.0 207.0603 3100.0 207.6944 2400.0 214.6943 2100.0 226.788 2200.0 228.2394 2500.0 END IONS BEGIN IONS SCANS=516 PEPMASS=346.0937 CHARGE=1 COLLISION_ENERGY=0.0 67.8304 2100.0 92.0291 2600.0 95.7843 2300.0 98.0595 7300.0 112.9802 2100.0 128.4985 2200.0 129.8371 2800.0 132.97 2400.0 147.0434 5500.0 147.0798 12000.0 162.0664 4300.0 166.9439 2200.0 169.9749 2900.0 171.9899 16000.0 173.5368 44000.0 178.062 2700.0 190.0623 32000.0 191.0628 2900.0 193.0858 24000.0 206.0572 11000.0 220.0185 7000.0 221.0808 120000.0 222.0851 13000.0 238.8313 2700.0 245.081 18000.0 251.0316 6600.0 320.043 2700.0 324.7066 2400.0 374.0593 2600.0 END IONS BEGIN IONS SCANS=517 PEPMASS=285.0762 CHARGE=1 COLLISION_ENERGY=0.0 50.4616 11000.0 51.6802 4500.0 53.7261 4500.0 56.5819 13000.0 56.8111 9800.0 57.0335 32000.0 61.359 13000.0 61.668 9400.0 61.7781 13000.0 67.0178 90000.0 68.9969 30000.0 69.6632 11000.0 71.2675 350000.0 71.2713 67000.0 79.4117 12000.0 80.2408 5300.0 81.0334 100000.0 86.6309 12000.0 87.8713 4700.0 88.9825 12000.0 91.054 52000.0 113.4745 4000.0 119.0404 32000.0 119.049 700000.0 120.0569 75000.0 121.0284 270000.0 122.8445 12000.0 124.0156 320000.0 131.6 11000.0 140.2294 13000.0 141.0547 19000.0 145.0283 570000.0 154.5737 11000.0 157.0206 16000.0 157.299 12000.0 160.0526 29000.0 160.2501 4100.0 163.0406 13000.0 167.0339 3000000.0 167.0484 26000.0 168.0573 21000.0 169.0649 14000.0 173.5235 130000.0 173.5374 250000.0 177.1128 4600.0 177.9384 14000.0 185.0445 350000.0 185.0604 48000.0 186.0675 33000.0 187.0389 150000.0 194.0032 4800.0 196.0522 56000.0 197.0597 220000.0 204.7347 11000.0 210.885 6700.0 213.0551 170000.0 214.0631 100000.0 217.0834 15000.0 223.5446 5200.0 224.0459 56000.0 225.0546 510000.0 228.8949 8500.0 233.9002 5500.0 238.8799 7200.0 242.0278 36000.0 242.0574 7200000.0 243.0645 110000.0 253.0481 68000.0 257.081 140000.0 267.0653 19000.0 268.0762 46000.0 270.0272 49000.0 270.0523 9000000.0 283.0616 35000.0 284.0667 17000.0 284.9589 65000.0 284.9799 200000.0 285.001 680000.0 285.0168 400000.0 285.0758 99000000.0 285.135 650000.0 285.1502 730000.0 285.1717 250000.0 285.1922 130000.0 285.2124 22000.0 END IONS BEGIN IONS SCANS=518 PEPMASS=344.2587 CHARGE=1 COLLISION_ENERGY=0.0 50.1026 2100.0 52.1903 2100.0 53.4097 2100.0 55.054 28000.0 56.7834 2700.0 57.0696 4300.0 58.8214 2600.0 62.3495 2400.0 64.7196 2200.0 67.0505 3600.0 67.0539 76000.0 69.0695 44000.0 79.0538 13000.0 81.0695 83000.0 83.0853 16000.0 89.4987 2600.0 91.054 14000.0 93.0696 19000.0 95.0852 71000.0 96.0511 2900.0 96.5419 2400.0 97.101 3500.0 102.0912 3200.0 105.0694 3600.0 107.0851 8800.0 107.6464 2400.0 109.1008 34000.0 113.7577 2200.0 117.0701 5800.0 121.0645 28000.0 121.101 23000.0 122.3651 2600.0 122.8413 2600.0 123.0437 62000.0 123.117 6800.0 124.6432 2400.0 129.07 2400.0 131.0488 16000.0 133.0646 2900.0 135.1166 4400.0 137.0595 72000.0 143.0494 2800.0 145.0647 17000.0 147.0431 3300.0 147.0802 11000.0 149.0595 110000.0 151.0752 23000.0 153.1762 2200.0 155.0851 9000.0 157.0648 14000.0 159.0802 16000.0 161.0595 190000.0 161.0735 2400.0 163.0753 64000.0 164.0699 9700.0 165.0909 13000.0 166.0861 3000.0 169.1017 8800.0 171.0808 10000.0 173.0598 60000.0 173.5282 36000.0 173.5437 7000.0 175.0591 4400.0 175.0754 130000.0 177.0906 9500.0 180.173 2500.0 183.0806 21000.0 185.097 6600.0 187.075 21000.0 189.0912 30000.0 191.1066 3500.0 197.0968 17000.0 199.1113 2900.0 200.0816 3000.0 201.091 110000.0 202.098 8700.0 203.1071 16000.0 211.1131 3500.0 215.1068 70000.0 216.1159 8200.0 225.1285 5900.0 229.1226 21000.0 256.1133 2900.0 266.4879 2400.0 267.8271 2800.0 285.1485 8100.0 338.4112 2400.0 344.2588 20000.0 END IONS BEGIN IONS SCANS=519 PEPMASS=274.2744 CHARGE=1 COLLISION_ENERGY=0.0 46.6638 2400.0 48.8792 2400.0 49.0975 2300.0 51.2184 2700.0 51.3112 2400.0 53.9977 2300.0 56.8766 2700.0 57.0696 480000.0 57.0729 6000.0 58.0649 21000.0 58.2056 2100.0 61.1669 2500.0 62.0597 26000.0 65.4177 2300.0 70.0647 570000.0 71.0852 190000.0 73.267 2400.0 74.198 2200.0 79.8893 2300.0 83.288 2100.0 85.0958 2200.0 85.1008 80000.0 85.5941 2300.0 86.0595 5400.0 88.0753 1200000.0 88.0815 7200.0 89.6535 2100.0 89.942 2500.0 100.9722 2300.0 102.0909 330000.0 102.8923 2300.0 106.0857 730000.0 108.3354 2200.0 109.6266 2400.0 112.2785 2200.0 112.2924 2200.0 118.3263 2600.0 122.1773 2400.0 124.2654 2400.0 124.4293 2300.0 127.595 2800.0 130.1417 2400.0 132.1663 3200.0 135.0437 52000.0 135.944 2500.0 136.2128 2400.0 142.5065 2300.0 143.0489 8900.0 144.9044 2300.0 148.1663 2700.0 153.7845 2400.0 155.5312 2200.0 157.3738 2300.0 157.8199 2200.0 161.5601 2500.0 162.3169 2600.0 167.9583 2600.0 169.1014 2800.0 171.0439 5000.0 171.3253 2700.0 173.0608 2800.0 173.5309 93000.0 173.5412 9100.0 186.1264 4500.0 201.0545 49000.0 211.4755 2400.0 212.2376 20000.0 230.2478 80000.0 237.0153 2400.0 246.3383 2300.0 248.7885 2300.0 256.2167 3300.0 256.2322 7100.0 256.2631 550000.0 274.183 2900.0 274.2486 8900.0 274.2741 2200000.0 274.3085 17000.0 274.3438 3500.0 274.5629 2300.0 274.7158 2400.0 END IONS BEGIN IONS SCANS=520 PEPMASS=369.17 CHARGE=1 COLLISION_ENERGY=0.0 54.6503 2600.0 55.6055 2200.0 57.7276 2300.0 68.4192 2300.0 70.0035 2200.0 70.065 7600.0 71.049 32000.0 71.7564 2300.0 75.044 17000.0 77.1853 2400.0 77.2516 2300.0 79.0539 2300.0 80.0387 2700.0 80.4389 2500.0 81.4792 2500.0 88.8327 2500.0 91.0541 20000.0 93.246 2400.0 95.0236 2400.0 104.6685 2700.0 107.0493 18000.0 108.0571 5000.0 112.5147 2200.0 121.0647 34000.0 123.0811 2700.0 124.0521 2500.0 135.0442 22000.0 136.0519 230000.0 136.879 2400.0 137.0596 10000.0 139.0753 67000.0 143.0852 3000.0 146.0726 16000.0 148.0519 14000.0 149.0599 13000.0 150.0675 14000.0 150.4885 2900.0 151.0753 2000000.0 151.1001 6800.0 153.0907 7000.0 154.1996 2400.0 157.0649 18000.0 158.0726 31000.0 159.0803 9600.0 160.0882 5500.0 161.0594 4800.0 161.0963 3100.0 162.0034 2700.0 162.0677 4700.0 163.0755 59000.0 165.0549 59000.0 165.0911 170000.0 167.0704 22000.0 170.7088 2200.0 171.0804 15000.0 172.0885 89000.0 173.0602 16000.0 173.0962 2700.0 173.5227 30000.0 173.5346 44000.0 173.5429 29000.0 174.0676 140000.0 175.0753 40000.0 177.0911 79000.0 179.0703 180000.0 186.0676 9500.0 187.0752 4300.0 188.0832 290000.0 188.0962 2000.0 189.0721 7800.0 189.0911 430000.0 189.1108 7700.0 190.0992 21000.0 191.0703 170000.0 191.1067 60000.0 193.086 79000.0 195.0798 3400.0 200.0821 3800.0 201.0689 3800.0 201.0911 840000.0 201.1132 6700.0 202.0998 3000.0 203.086 2700.0 203.1068 350000.0 205.0858 21000.0 205.3423 2400.0 213.0913 85000.0 214.4826 2900.0 215.1067 41000.0 216.0769 4300.0 223.9019 2600.0 224.0834 59000.0 225.0919 16000.0 227.1061 4000.0 231.0762 5700.0 231.1017 260000.0 233.096 8500.0 237.0902 3400.0 238.0975 2600.0 239.1073 8100.0 240.078 29000.0 241.0858 26000.0 245.0967 19000.0 246.103 9600.0 247.1111 3400.0 249.0929 8000.0 250.0998 3000.0 252.0787 3700.0 253.0859 79000.0 254.094 19000.0 255.0699 3300.0 255.1016 450000.0 255.1322 9600.0 258.1048 7100.0 259.1125 10000.0 261.0907 62000.0 262.0988 58000.0 263.1049 14000.0 265.0873 7700.0 265.1231 15000.0 267.1015 39000.0 268.0761 14000.0 268.084 7500.0 268.1095 780000.0 268.1429 5400.0 269.0809 160000.0 269.1124 7500.0 273.0909 34000.0 274.0986 13000.0 275.1068 79000.0 275.1379 2800.0 276.1144 100000.0 277.0881 29000.0 277.1224 130000.0 278.0949 23000.0 278.128 6200.0 279.1017 22000.0 281.0831 7600.0 281.1179 23000.0 282.1242 12000.0 283.0599 8900.0 283.0968 1100000.0 284.0688 8600.0 284.1045 510000.0 284.1353 2200.0 287.1072 33000.0 288.1147 73000.0 289.0866 47000.0 289.1227 350000.0 289.1599 4800.0 290.0938 16000.0 290.1282 8400.0 291.1019 21000.0 292.1098 57000.0 293.1174 220000.0 294.0904 3300.0 294.1253 24000.0 295.097 23000.0 295.1323 15000.0 296.1045 65000.0 297.1104 3900.0 298.0898 11000.0 298.1201 2300000.0 298.1768 3500.0 299.128 310000.0 303.1014 11000.0 304.1098 89000.0 305.0767 4800.0 305.1173 780000.0 305.1583 8800.0 306.0901 7600.0 306.1261 21000.0 307.0952 5400.0 307.1331 120000.0 308.1035 13000.0 308.1408 180000.0 309.1122 110000.0 310.1191 10000.0 310.1558 3800.0 311.0967 3100.0 311.128 580000.0 311.1695 5000.0 312.1363 10000.0 318.1264 5200.0 319.133 310000.0 320.0978 5700.0 320.1408 870000.0 321.1122 320000.0 321.1542 6400.0 322.1207 26000.0 323.1278 59000.0 324.1357 330000.0 325.1436 61000.0 335.1283 57000.0 335.7509 2800.0 336.1356 230000.0 338.1507 23000.0 338.2554 3000.0 339.1591 72000.0 351.159 180000.0 369.1692 5300.0 END IONS BEGIN IONS SCANS=521 PEPMASS=320.2589 CHARGE=1 COLLISION_ENERGY=0.0 49.3713 2800.0 54.2575 2200.0 55.0541 7000.0 56.9231 2400.0 57.0697 41000.0 61.7036 2300.0 62.4118 2200.0 65.7565 2400.0 66.7768 2200.0 67.0541 2400.0 67.2091 3000.0 67.2997 2100.0 69.0696 14000.0 70.4219 2400.0 71.0853 17000.0 71.2148 2200.0 78.6963 2700.0 81.0698 3100.0 83.0855 3000.0 83.6439 2400.0 84.5862 2200.0 86.2624 2400.0 91.0539 2600.0 91.1086 2400.0 91.2841 2700.0 92.4935 2700.0 94.8475 2300.0 95.0852 5600.0 98.0599 13000.0 98.6497 2200.0 101.394 2300.0 103.0539 46000.0 104.796 2500.0 104.8675 2100.0 109.1009 3100.0 110.173 2300.0 112.3963 2500.0 117.0696 45000.0 118.7121 2500.0 123.0438 92000.0 131.0379 3400.0 131.0489 300000.0 131.0854 31000.0 133.0646 20000.0 135.2416 2600.0 136.8669 2400.0 137.0594 130000.0 145.0517 3700.0 145.0646 250000.0 147.0808 5700.0 149.046 5000.0 149.0595 1900000.0 149.0715 22000.0 151.0752 400000.0 151.4746 2500.0 157.473 2100.0 159.0804 160000.0 159.1685 2200.0 159.5185 2100.0 161.0956 3100.0 161.6728 2600.0 162.0671 7600.0 162.8421 2400.0 163.0593 14000.0 163.0753 850000.0 163.091 6400.0 166.086 7500.0 173.0958 27000.0 173.5228 17000.0 173.5332 52000.0 173.5406 19000.0 173.9456 2900.0 177.0911 170000.0 181.0852 5900.0 184.2056 5900.0 185.4158 2700.0 185.7187 2300.0 187.1126 2500.0 190.0627 37000.0 191.1066 21000.0 192.0676 13000.0 193.0858 17000.0 194.4414 2600.0 194.7891 2400.0 195.0911 14000.0 199.3297 2600.0 208.0632 3400.0 221.081 60000.0 222.0844 27000.0 223.0867 60000.0 234.518 2500.0 235.9824 2900.0 269.6816 2400.0 289.9384 2300.0 299.6201 2200.0 302.1753 2500.0 303.2325 100000.0 303.2631 2100.0 320.2587 32000.0 END IONS BEGIN IONS SCANS=522 PEPMASS=280.0973 CHARGE=1 COLLISION_ENERGY=0.0 56.9234 2300.0 60.3084 2700.0 63.7083 2100.0 65.3376 2300.0 66.2678 13000.0 66.2694 3600.0 68.0716 2400.0 70.0223 2400.0 70.026 2600.0 77.0277 2300.0 81.1427 2600.0 86.3203 2500.0 93.5881 2200.0 96.307 2300.0 114.8332 2300.0 151.0892 2400.0 152.0624 5500.0 166.3522 2200.0 171.9772 2300.0 173.5356 32000.0 180.0807 15000.0 181.0885 20000.0 196.1126 2800.0 205.2169 2400.0 208.0753 8700.0 209.0834 94000.0 210.0914 8900.0 219.0576 10000.0 219.0675 38000.0 219.666 2400.0 220.0594 26000.0 220.0773 12000.0 224.1069 4200.0 234.0912 6000.0 235.0629 13000.0 236.0486 2000.0 236.0704 99000.0 237.0779 29000.0 247.0622 10000.0 248.0702 21000.0 250.0499 27000.0 251.0573 17000.0 252.1016 27000.0 262.0494 3100.0 264.0652 320000.0 265.006 9900.0 265.0213 6700.0 265.0477 8100.0 265.0731 3800000.0 265.1389 21000.0 280.0253 7900.0 280.0968 2500000.0 283.426 2500.0 END IONS BEGIN IONS SCANS=523 PEPMASS=315.0868 CHARGE=1 COLLISION_ENERGY=0.0 48.5859 2100.0 56.5633 2200.0 58.0651 2900.0 59.8907 2200.0 63.0706 2300.0 65.5606 2200.0 68.2237 2000.0 69.5511 2400.0 69.629 2200.0 86.1674 2200.0 102.1345 2300.0 111.7377 2800.0 115.4245 2200.0 115.7423 2300.0 118.4971 2300.0 128.2579 2600.0 130.2905 2300.0 141.2922 2500.0 167.0345 2800.0 173.5257 12000.0 173.5375 35000.0 240.774 2600.0 267.4456 3000.0 272.0372 4200.0 272.0676 130000.0 300.0629 1100000.0 315.0861 1200000.0 315.13 5300.0 END IONS BEGIN IONS SCANS=524 PEPMASS=354.0975 CHARGE=1 COLLISION_ENERGY=0.0 57.0723 2200.0 57.1085 2200.0 60.4962 2500.0 74.288 2100.0 85.4691 2500.0 95.3651 2300.0 114.1837 2900.0 125.3895 2700.0 126.9706 2700.0 139.6184 2300.0 157.0898 2200.0 165.5317 2800.0 173.5252 29000.0 173.5429 13000.0 197.8988 2300.0 220.2382 2600.0 228.3292 2400.0 232.839 2900.0 237.0789 6000.0 264.0659 17000.0 265.0732 63000.0 272.2767 2400.0 278.045 17000.0 287.9755 2800.0 292.0606 27000.0 293.0683 270000.0 294.0784 3100.0 296.0555 200000.0 302.2051 2700.0 306.04 16000.0 307.8028 2900.0 308.0551 13000.0 310.0711 75000.0 320.0123 4200.0 320.0554 250000.0 321.0635 87000.0 322.0732 3300.0 324.006 5400.0 324.0503 550000.0 336.0874 6600.0 338.0659 80000.0 339.0737 400000.0 354.0972 200000.0 END IONS BEGIN IONS SCANS=525 PEPMASS=376.0797 CHARGE=1 COLLISION_ENERGY=0.0 59.1717 2300.0 61.4017 2400.0 71.6481 2500.0 73.0916 2400.0 74.5493 2300.0 77.2176 2600.0 87.6243 2300.0 90.3647 2200.0 99.6096 2500.0 102.704 2500.0 135.0441 4000.0 159.165 2700.0 165.5156 2400.0 173.5229 13000.0 173.541 19000.0 198.4497 2400.0 325.0091 3400.0 346.0321 42000.0 360.0489 16000.0 361.0559 79000.0 376.0796 45000.0 END IONS BEGIN IONS SCANS=526 PEPMASS=438.0403 CHARGE=1 COLLISION_ENERGY=0.0 55.4689 2100.0 56.3678 2500.0 57.0537 2200.0 57.1849 2200.0 58.0193 2400.0 58.6654 2400.0 59.6465 2000.0 61.2632 2500.0 61.7972 2400.0 62.4362 2200.0 62.5796 2400.0 63.3415 2500.0 63.4731 2100.0 63.5347 2400.0 70.667 2300.0 73.539 2400.0 75.7399 2300.0 76.6343 2200.0 78.307 2400.0 81.1449 2700.0 82.074 2100.0 83.1321 2300.0 84.7207 2100.0 84.8133 2200.0 85.9388 2600.0 89.5368 2200.0 93.0192 2300.0 99.9061 2500.0 101.5553 2200.0 114.5615 2100.0 120.9331 2500.0 122.0557 2200.0 125.3192 2100.0 126.4161 2300.0 137.8711 2700.0 148.0515 85000.0 148.2032 2300.0 152.0125 2400.0 154.3319 2800.0 163.3406 2200.0 172.0509 2900.0 173.5191 11000.0 173.5342 150000.0 194.1139 2300.0 206.2779 2700.0 207.9816 73000.0 221.9609 56000.0 225.9924 14000.0 231.9814 71000.0 237.7536 2600.0 237.7817 2600.0 239.9714 22000.0 244.1127 2200.0 249.9919 3300.0 267.7767 2900.0 274.7808 2700.0 279.0896 6900.0 286.4091 2600.0 288.2338 2500.0 291.7493 2300.0 304.0728 56000.0 306.09 6400.0 308.1303 2700.0 309.4935 2300.0 320.014 20000.0 322.028 2600.0 334.0284 3600.0 336.0081 27000.0 338.0222 10000.0 341.1256 2400.0 350.9944 26000.0 362.0235 340000.0 364.0027 250000.0 364.0454 6900.0 366.0186 190000.0 366.945 2600.0 370.6427 2400.0 371.4949 2300.0 376.0028 37000.0 378.0154 3800.0 379.9916 29000.0 380.0376 64000.0 382.0131 23000.0 387.8307 2500.0 392.0371 28000.0 393.0068 26000.0 394.014 150000.0 407.9926 6700.0 412.0259 14000.0 436.5729 3100.0 END IONS BEGIN IONS SCANS=527 PEPMASS=356.1257 CHARGE=1 COLLISION_ENERGY=0.0 54.0907 2400.0 54.1086 2200.0 55.0429 2200.0 57.6983 2200.0 58.8011 2300.0 59.7163 2100.0 62.8749 2200.0 65.0385 8900.0 66.8829 2400.0 67.054 10000.0 69.5968 2900.0 71.4122 2300.0 71.977 2300.0 72.1077 2400.0 72.6165 2400.0 73.028 5200.0 73.3019 2300.0 74.7907 2500.0 75.6858 2300.0 76.1386 2500.0 77.0389 7200.0 77.1395 3400.0 77.1803 2200.0 77.2129 2200.0 77.8735 2200.0 78.0461 230000.0 78.6432 2400.0 79.0539 43000.0 81.0331 290000.0 81.0695 9700.0 81.1679 2100.0 82.8425 2400.0 85.028 35000.0 88.8614 2300.0 91.0539 3500.0 93.0332 17000.0 93.3476 2100.0 94.9458 2400.0 95.0488 20000.0 99.0438 48000.0 102.1047 2100.0 102.6884 2600.0 103.0539 62000.0 103.9115 2300.0 104.0617 5800.0 106.041 170000.0 107.0415 3200.0 107.0487 200000.0 108.8886 2200.0 111.0437 74000.0 113.4314 2200.0 114.1086 2200.0 115.054 6700.0 117.0696 120000.0 118.3157 2200.0 121.6838 2200.0 122.0358 90000.0 123.0437 260000.0 124.0515 71000.0 125.0593 8100.0 128.6112 2800.0 130.0411 12000.0 131.0378 5800.0 131.0488 500000.0 132.0561 39000.0 133.0639 3400.0 135.0318 4400.0 135.0437 1300000.0 135.0542 15000.0 136.0515 2000000.0 136.063 27000.0 137.048 9500.0 137.0594 1100000.0 137.0704 11000.0 143.0489 32000.0 144.0567 16000.0 145.0645 470000.0 145.4563 2800.0 147.0439 6400.0 148.0516 240000.0 149.0595 44000.0 150.0672 39000.0 151.0386 32000.0 158.0711 2800.0 159.0436 17000.0 159.0795 3700.0 160.0517 240000.0 161.0595 270000.0 162.0672 240000.0 163.075 10000.0 163.6372 2700.0 164.0464 7000.0 169.9879 2300.0 172.0517 28000.0 173.0596 590000.0 173.5267 68000.0 173.5404 77000.0 174.0671 43000.0 175.0391 30000.0 175.0753 130000.0 178.0632 6100.0 185.0598 39000.0 186.067 6700.0 187.0757 9200.0 188.0828 35000.0 189.0544 60000.0 190.0624 35000.0 193.0491 5800.0 202.0625 93000.0 203.0702 180000.0 221.0821 2800.0 228.2996 2500.0 228.5574 2800.0 232.0849 11000.0 243.5901 2400.0 243.9493 2300.0 245.3372 2500.0 249.1549 3000.0 253.8699 2400.0 255.0248 2600.0 256.0188 2500.0 256.3854 2300.0 260.0789 2500.0 260.3901 2800.0 261.2241 2600.0 262.0957 15000.0 283.0023 2400.0 290.0919 11000.0 291.8182 2300.0 294.3462 2500.0 295.0746 13000.0 298.0606 8800.0 303.4907 2700.0 303.7538 2600.0 305.0807 13000.0 309.4739 2200.0 309.5268 2300.0 309.9009 38000.0 322.0614 11000.0 323.0685 2700.0 325.0541 3400.0 326.0568 34000.0 339.7089 2700.0 340.0737 7000.0 341.08 25000.0 345.7777 2300.0 356.1031 12000.0 END IONS BEGIN IONS SCANS=528 PEPMASS=321.1127 CHARGE=1 COLLISION_ENERGY=0.0 49.9257 6100.0 51.0236 16000.0 51.0729 2500.0 53.0386 3100.0 53.8603 7600.0 55.0178 5600.0 55.8138 3500.0 58.4759 4000.0 62.8531 4700.0 63.3137 3100.0 63.3646 8900.0 63.4958 3200.0 65.0388 96000.0 65.8188 2000.0 66.6279 3300.0 67.6938 3300.0 68.0679 2300.0 68.6277 3300.0 68.7627 2200.0 69.0336 4100.0 70.3315 3100.0 70.7252 7000.0 72.5415 2200.0 72.5887 2400.0 73.3436 3200.0 74.8638 2200.0 76.0314 2600.0 76.3894 2300.0 77.0391 92000.0 77.0712 9100.0 79.0541 85000.0 81.0398 5200.0 83.9864 5400.0 87.9717 3400.0 89.0394 3200.0 91.0483 14000.0 91.0542 770000.0 91.8416 4300.0 93.0698 260000.0 94.5913 7500.0 95.0491 200000.0 95.3076 5800.0 100.7332 2900.0 101.4891 3200.0 101.596 3900.0 102.0465 14000.0 103.0462 25000.0 103.0542 1700000.0 103.0659 4100.0 104.3284 6300.0 105.0327 3800.0 105.0447 65000.0 105.1209 3500.0 107.0484 8800.0 111.3415 4600.0 112.419 3200.0 115.0542 570000.0 117.07 66000.0 119.0491 450000.0 120.4695 4100.0 121.0646 37000.0 123.0625 3300.0 127.8131 2500.0 130.042 4600.0 131.0262 38000.0 131.0491 13000000.0 131.0576 130000.0 131.0669 8100.0 131.0723 14000.0 131.2004 7700.0 135.0168 13000.0 135.0253 3500.0 135.044 11000000.0 135.068 39000.0 137.0596 52000.0 138.312 7500.0 140.8444 2300.0 141.0698 240000.0 143.0362 6500.0 143.0491 1000000.0 143.0864 8700.0 145.1183 4600.0 147.0436 15000.0 148.0521 57000.0 149.0238 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7400.0 222.0669 23000.0 225.3396 5300.0 231.0808 34000.0 232.3476 3400.0 233.0565 18000.0 233.0962 3700000.0 233.1237 29000.0 235.0754 170000.0 235.1113 28000.0 243.0808 130000.0 243.5561 2500.0 245.0957 49000.0 246.0674 75000.0 248.0833 180000.0 249.0912 31000.0 259.0758 15000.0 261.0586 30000.0 261.0909 1800000.0 261.1234 26000.0 262.0625 59000.0 262.0968 8000.0 263.0714 290000.0 263.1065 4200000.0 263.1321 8300.0 266.0577 15000.0 273.091 390000.0 275.0715 20000.0 276.0784 440000.0 279.0642 24000.0 289.0863 170000.0 290.0961 3300.0 291.0725 12000.0 291.1017 3700000.0 292.0731 70000.0 293.0817 91000.0 306.0889 590000.0 321.1121 820000.0 328.3031 3100.0 END IONS BEGIN IONS SCANS=529 PEPMASS=657.2426 CHARGE=1 COLLISION_ENERGY=0.0 69.5401 2400.0 70.3161 2700.0 71.236 2400.0 73.0265 13000.0 73.0286 3400.0 74.2701 10000.0 74.2726 3300.0 75.7288 2400.0 81.0334 3700.0 82.8564 2100.0 85.4258 2300.0 91.0965 2200.0 91.9379 2400.0 96.4299 2200.0 101.3614 2300.0 103.3523 2600.0 103.9486 2600.0 111.4624 3100.0 118.026 30000.0 120.0416 84000.0 121.4809 2400.0 123.2829 2700.0 123.4102 2400.0 125.1958 2300.0 125.9313 2600.0 127.8638 2500.0 128.0465 9500.0 129.0857 2300.0 130.7989 2500.0 134.0606 3200.0 139.5122 2300.0 143.1979 2300.0 150.0542 5800.0 152.9121 2300.0 156.0414 35000.0 157.0496 8600.0 157.3009 2600.0 158.0575 32000.0 160.2936 2400.0 160.3954 2400.0 162.2449 2500.0 163.1235 2200.0 172.0366 31000.0 173.5218 42000.0 173.5334 160000.0 173.5418 29000.0 175.7199 2300.0 176.5773 2500.0 178.0504 14000.0 180.485 2700.0 188.0308 7300.0 190.0811 2500.0 199.0482 2600.0 200.0314 160000.0 212.8433 2900.0 213.752 2500.0 224.171 2500.0 253.0943 210000.0 254.9108 2500.0 267.6843 2800.0 269.0569 5700.0 269.0895 1400000.0 269.1152 2700.0 273.0766 24000.0 277.0181 2500.0 279.087 2500.0 285.1712 2600.0 297.0074 14000.0 297.0226 8400.0 297.0542 4700.0 297.0846 6200000.0 297.1625 3900.0 310.0689 14000.0 325.0917 84000.0 340.0465 3400.0 340.1152 1600000.0 352.115 110000.0 354.1443 4400.0 357.0715 2600.0 359.3719 2700.0 368.1237 9400.0 378.2383 2800.0 383.1457 12000.0 385.1631 4100.0 402.4492 2900.0 405.0943 18000.0 413.1599 20000.0 420.1199 21000.0 433.0899 2900.0 435.1415 110000.0 449.7007 2600.0 450.7814 2500.0 460.3309 2400.0 463.1361 97000.0 486.152 84000.0 501.1759 19000.0 502.1463 5700.0 516.1995 22000.0 517.1709 12000.0 525.2804 2500.0 530.1401 7600.0 532.1939 440000.0 541.58 3000.0 559.2042 3100.0 560.1893 240000.0 633.2497 3100.0 657.2417 660000.0 END IONS BEGIN IONS SCANS=530 PEPMASS=680.3185 CHARGE=1 COLLISION_ENERGY=0.0 67.3818 2300.0 67.5017 2200.0 67.815 2000.0 68.6541 2000.0 75.0439 19000.0 76.8574 2400.0 77.445 2600.0 78.6082 2200.0 78.7981 2500.0 79.281 3100.0 80.0493 8900.0 80.278 3000.0 81.0334 2200000.0 81.0391 15000.0 82.6039 2500.0 83.7367 2300.0 85.2999 2200.0 87.0985 2600.0 88.07 2400.0 88.6792 2400.0 89.7544 2100.0 91.2676 2400.0 93.1271 2400.0 94.0651 16000.0 94.8628 2300.0 95.0489 6200.0 98.0598 88000.0 99.6021 2300.0 100.0724 2400.0 101.9805 2300.0 103.3939 2400.0 104.0495 2500.0 106.0648 10000.0 107.5551 2500.0 110.0236 71000.0 111.9317 2300.0 122.0599 41000.0 128.7872 2400.0 132.0443 37000.0 134.0599 45000.0 134.3303 2500.0 136.0393 44000.0 138.0543 6600.0 149.6829 4800.0 149.6931 4200.0 150.0547 920000.0 150.0652 2700.0 160.0386 6400.0 161.9327 2700.0 165.4109 2900.0 168.0752 2500.0 173.5253 70000.0 173.538 130000.0 174.3482 2700.0 178.0313 9100.0 178.0498 4400000.0 178.0862 18000.0 178.0971 3500.0 178.8394 2800.0 181.0858 100000.0 188.9303 2200.0 190.0624 11000.0 193.0858 9300.0 193.4137 2400.0 195.0649 79000.0 196.0604 9500.0 199.7958 2300.0 206.0576 13000.0 207.1013 8400.0 221.0565 3600.0 221.0809 980000.0 221.1072 2600.0 223.061 4900.0 223.0944 2400.0 230.3379 2600.0 245.0809 2800.0 247.0963 10000.0 262.6172 2400.0 263.9194 2300.0 265.0698 2400.0 273.0764 35000.0 275.1029 42000.0 281.756 2600.0 300.1223 17000.0 314.1152 2700.0 321.1883 2600.0 322.1203 11000.0 324.6585 2600.0 325.1538 2400.0 330.1455 11000.0 337.1034 8500.0 339.1246 12000.0 349.1066 5000.0 350.1173 6100.0 351.0843 8000.0 351.1227 52000.0 352.123 12000.0 353.1378 2900.0 354.146 36000.0 361.1654 18000.0 364.3216 2500.0 365.101 18000.0 366.1083 55000.0 366.152 13000.0 366.6527 2500.0 367.1174 130000.0 370.1373 2800.0 380.1265 23000.0 381.1332 200000.0 382.0847 10000.0 382.1412 510000.0 382.1933 3700.0 383.1115 25000.0 385.1647 63000.0 394.104 3300.0 395.1011 2800.0 395.1491 350000.0 398.1362 60000.0 399.1436 32000.0 409.129 12000.0 410.1363 150000.0 411.1078 47000.0 413.1596 580000.0 422.0588 3400.0 423.1445 5700.0 426.1307 65000.0 441.1543 350000.0 485.5563 2300.0 486.0357 2900.0 492.1919 3000.0 520.1966 7800.0 538.9649 2600.0 640.2341 2400.0 652.5799 2800.0 END IONS BEGIN IONS SCANS=531 PEPMASS=275.103 CHARGE=1 COLLISION_ENERGY=0.0 51.023 3000.0 51.5989 2300.0 53.0384 710000.0 53.0414 6600.0 53.0428 6600.0 54.8832 2200.0 55.0176 66000.0 55.054 20000.0 55.4395 2400.0 57.0697 13000.0 63.2458 2700.0 67.0539 22000.0 69.0331 3800.0 69.0697 17000.0 69.8992 2300.0 70.4164 2400.0 71.0488 37000.0 71.2616 2600.0 74.9169 2100.0 75.4866 2100.0 76.12 2200.0 79.0539 62000.0 80.0492 51000.0 81.027 5900.0 81.0332 3900000.0 81.0417 22000.0 81.0425 92000.0 81.0453 17000.0 81.0696 25000.0 82.0286 12000.0 83.0489 12000.0 83.0852 3400.0 84.9064 2200.0 85.0646 13000.0 85.3787 2300.0 87.1895 2300.0 87.8256 2200.0 91.0539 22000.0 93.0695 49000.0 94.0597 2200.0 94.0648 76000.0 95.0489 42000.0 95.0851 56000.0 95.4853 2300.0 97.0644 11000.0 98.0598 12000.0 100.3921 2200.0 104.0491 30000.0 104.2853 2600.0 105.0696 47000.0 106.0648 21000.0 107.049 12000.0 107.0852 56000.0 108.0442 21000.0 108.1408 2500.0 109.0644 30000.0 109.1008 20000.0 110.0148 2700.0 110.0233 230000.0 111.0801 51000.0 117.0695 17000.0 119.0852 55000.0 121.1009 58000.0 121.1179 2200.0 122.0506 3800.0 122.0597 160000.0 123.0801 3500.0 125.2422 2400.0 125.6163 2400.0 129.0703 9500.0 131.0853 79000.0 132.0441 140000.0 133.1009 61000.0 134.0597 36000.0 135.0801 43000.0 135.1174 2800.0 136.039 63000.0 137.0958 19000.0 142.0773 8900.0 143.0574 2500.0 143.0853 33000.0 144.0935 8600.0 145.1009 62000.0 147.1165 20000.0 149.0959 2500.0 150.0409 5300.0 150.0546 1200000.0 150.067 20000.0 154.8214 2400.0 155.0854 7000.0 156.0934 12000.0 157.1009 54000.0 158.1089 27000.0 159.1166 100000.0 160.0389 13000.0 161.0963 7900.0 168.0935 5800.0 169.1009 12000.0 171.1016 2500.0 171.1169 32000.0 173.0968 2500.0 173.1324 100000.0 173.5242 4300.0 173.5359 43000.0 174.1404 7600.0 175.1115 15000.0 175.2018 3000.0 177.1271 24000.0 178.0498 810000.0 178.0677 3000.0 183.1169 19000.0 184.1232 2400.0 186.2849 2600.0 187.1111 14000.0 187.1484 8900.0 189.1278 2600.0 191.1433 2900.0 197.1322 8800.0 197.965 2400.0 198.458 2300.0 199.1483 27000.0 201.1273 9000.0 206.7172 2300.0 233.1541 3500.0 257.1532 2700.0 END IONS BEGIN IONS SCANS=532 PEPMASS=635.2606 CHARGE=1 COLLISION_ENERGY=0.0 66.365 2600.0 70.3409 3500.0 73.7488 3400.0 75.0439 48000.0 79.0541 38000.0 80.0494 58000.0 81.0221 22000.0 81.027 7500.0 81.0334 6500000.0 81.0421 22000.0 81.0433 86000.0 81.0444 19000.0 81.0478 9000.0 82.0286 75000.0 93.2355 2800.0 94.0649 92000.0 95.049 38000.0 96.0446 4100.0 98.0235 12000.0 98.0599 370000.0 98.1606 3100.0 100.3413 2400.0 104.0494 44000.0 106.0648 38000.0 107.0492 7000.0 108.0444 26000.0 110.0235 380000.0 110.0321 6700.0 115.435 2300.0 122.0599 170000.0 130.8395 3800.0 132.0443 160000.0 134.0599 120000.0 136.0392 130000.0 138.0546 32000.0 150.0548 2600000.0 150.0655 17000.0 151.0754 4000.0 160.0394 32000.0 161.084 2800.0 167.0708 12000.0 173.4549 3400.0 173.5285 15000.0 173.5365 42000.0 176.0845 4600.0 178.0132 36000.0 178.0215 21000.0 178.0499 8100000.0 178.0863 57000.0 178.0966 12000.0 181.086 320000.0 188.0464 2700.0 193.0858 8100.0 195.0652 270000.0 195.1002 7300.0 196.0606 28000.0 205.084 3900.0 206.0576 65000.0 207.0666 2900.0 207.1016 35000.0 209.0019 3900.0 219.1009 10000.0 221.0562 4700.0 221.0809 770000.0 221.0997 4900.0 223.0598 21000.0 230.0585 5900.0 235.0959 17000.0 243.0769 3900.0 245.0809 41000.0 245.1065 3600.0 247.0966 77000.0 273.0759 82000.0 275.1034 44000.0 276.1222 5300.0 300.1232 59000.0 307.0966 27000.0 308.1036 12000.0 315.1222 5900.0 319.0974 4900.0 321.1125 30000.0 322.0816 3400.0 322.1197 61000.0 323.0907 21000.0 323.1287 16000.0 330.1467 60000.0 334.12 10000.0 335.0906 23000.0 335.1299 14000.0 336.0997 35000.0 337.1033 85000.0 338.1161 11000.0 339.122 85000.0 345.1328 8700.0 348.1023 13000.0 349.107 56000.0 350.1145 86000.0 351.084 96000.0 351.1228 390000.0 352.088 29000.0 352.1271 66000.0 353.138 50000.0 354.146 190000.0 355.1164 29000.0 360.1574 13000.0 361.1637 22000.0 362.1145 34000.0 365.1013 170000.0 365.139 3500.0 366.1092 300000.0 366.1464 45000.0 367.0629 3100.0 367.1175 730000.0 367.1705 13000.0 368.127 28000.0 369.1346 14000.0 370.1404 57000.0 371.1494 34000.0 377.1015 7200.0 378.1105 22000.0 379.1191 28000.0 380.1255 170000.0 381.0773 5300.0 381.1334 610000.0 381.176 4100.0 382.141 1900000.0 382.1832 11000.0 383.1128 200000.0 384.1218 4300.0 385.1648 170000.0 392.1239 4500.0 393.0961 28000.0 394.1047 15000.0 395.149 1500000.0 395.1954 2500.0 396.0853 6000.0 396.8714 3000.0 397.1248 28000.0 398.136 280000.0 399.1433 60000.0 401.1621 4600.0 407.1165 8200.0 408.1208 45000.0 409.128 69000.0 410.0721 5400.0 410.0874 2900.0 410.1362 680000.0 411.1075 250000.0 413.1112 7000.0 413.1594 1600000.0 423.1432 61000.0 425.1225 3100.0 426.1306 230000.0 426.189 3400.0 441.1004 2400.0 441.1542 730000.0 460.7765 3000.0 488.1689 9300.0 490.1505 13000.0 492.2006 23000.0 520.1969 49000.0 548.12 4300.0 END IONS BEGIN IONS SCANS=533 PEPMASS=538.2076 CHARGE=1 COLLISION_ENERGY=0.0 65.4961 2700.0 66.9267 2700.0 67.9693 2600.0 75.044 18000.0 77.5681 2300.0 79.7132 2400.0 81.0333 96000.0 84.3839 2200.0 90.0193 2600.0 91.0079 2200.0 91.0611 2300.0 91.8283 2500.0 96.0245 2200.0 98.0599 37000.0 98.5226 2300.0 105.0548 2700.0 105.5511 2700.0 110.0237 8500.0 111.8514 2300.0 118.8395 2700.0 119.506 2400.0 134.0602 13000.0 135.847 2500.0 136.7418 2100.0 138.0546 11000.0 139.7973 2200.0 150.0549 30000.0 173.525 48000.0 173.5415 14000.0 178.0497 53000.0 181.0859 120000.0 188.939 2400.0 191.7885 2600.0 195.0652 49000.0 206.0575 31000.0 208.7415 2700.0 211.2634 2800.0 221.081 310000.0 223.0604 14000.0 232.0958 3000.0 245.0814 4600.0 247.097 16000.0 270.5121 2500.0 273.0762 19000.0 276.1226 6400.0 300.1236 36000.0 310.1003 2600.0 321.1136 2600.0 322.1194 13000.0 323.0948 3500.0 332.6324 2600.0 335.0892 3200.0 336.0985 8100.0 337.1005 34000.0 338.1145 2900.0 339.1237 20000.0 349.1072 15000.0 350.1155 14000.0 351.0842 20000.0 351.1234 74000.0 351.9967 2400.0 352.1217 21000.0 353.1406 6300.0 354.1461 50000.0 355.1176 4200.0 365.1007 34000.0 366.1082 46000.0 366.1485 31000.0 367.1177 180000.0 370.1421 8800.0 380.1262 29000.0 381.133 130000.0 382.1413 360000.0 383.1131 49000.0 385.1649 44000.0 393.0978 3200.0 395.0999 13000.0 395.1493 180000.0 397.1251 4500.0 398.1358 52000.0 399.1422 7500.0 408.1226 2900.0 409.129 19000.0 410.1361 100000.0 411.1077 81000.0 413.1598 220000.0 423.1441 8800.0 426.131 51000.0 441.1544 93000.0 454.0001 2600.0 479.4773 2800.0 END IONS BEGIN IONS SCANS=534 PEPMASS=318.1341 CHARGE=1 COLLISION_ENERGY=0.0 49.0249 2300.0 49.0854 2600.0 50.6198 2400.0 51.1843 2200.0 54.554 2200.0 54.5642 2400.0 55.2696 21000.0 55.2716 4900.0 55.6971 2800.0 58.347 2600.0 59.3915 2800.0 60.1071 2300.0 61.381 2400.0 61.5481 2800.0 63.5813 2100.0 64.3996 2600.0 67.05 2500.0 68.305 2600.0 69.2304 2100.0 69.2979 2600.0 69.5592 2700.0 71.5748 2200.0 71.7893 2400.0 73.0274 2300.0 73.7964 2300.0 75.0707 2500.0 77.0762 2300.0 79.194 2600.0 80.3205 2100.0 83.1811 2300.0 84.6304 2500.0 85.8403 2400.0 89.6142 2200.0 89.7127 2300.0 91.0542 9000.0 95.0421 2300.0 96.3975 2300.0 98.0599 60000.0 99.1202 2500.0 99.6186 2800.0 102.0464 5300.0 102.9933 2500.0 103.0541 6500.0 105.0696 13000.0 106.8321 2700.0 107.0495 5200.0 111.5992 2300.0 112.4934 2400.0 113.0263 2600.0 117.812 2300.0 118.0413 15000.0 118.4471 2100.0 119.0489 34000.0 119.4879 2800.0 120.9664 2500.0 121.6937 2300.0 121.7688 2400.0 122.9342 3000.0 123.4853 2500.0 126.1848 2300.0 128.698 2400.0 130.0412 51000.0 131.0491 17000.0 131.8754 2200.0 132.057 38000.0 133.0288 2600.0 133.0646 58000.0 135.044 61000.0 135.0798 2800.0 135.9261 11000.0 138.9534 2200.0 144.0565 2700.0 146.035 6100.0 147.0439 260000.0 148.0518 26000.0 149.0593 48000.0 149.3014 2400.0 150.0676 36000.0 158.0344 2500.0 159.044 14000.0 160.0517 73000.0 160.1781 2100.0 161.0597 120000.0 162.0523 6900.0 162.0675 750000.0 162.0828 4200.0 163.0249 2800.0 163.0389 260000.0 163.0752 130000.0 163.9485 2600.0 165.0915 16000.0 167.0701 21000.0 172.0517 2400.0 173.5248 9200.0 173.5322 96000.0 173.5403 8500.0 174.0313 64000.0 174.4539 2300.0 175.0391 200000.0 176.0469 180000.0 177.0548 140000.0 177.2268 2200.0 178.046 4300.0 178.0625 710000.0 178.0805 3100.0 178.2322 2700.0 180.7873 2600.0 188.0466 65000.0 188.5958 2700.0 189.0545 330000.0 190.0225 3500.0 190.0337 3400.0 190.0624 3700000.0 190.0773 12000.0 191.0139 9400.0 191.0338 780000.0 191.0701 290000.0 191.2175 2300.0 192.0416 35000.0 193.0653 13000.0 193.0859 2800000.0 193.1064 15000.0 205.0499 20000.0 206.0246 3300.0 206.0344 9900.0 206.0574 1400000.0 206.0801 11000.0 220.3872 2500.0 221.0306 31000.0 221.0809 8600000.0 221.1002 8000.0 221.1201 15000.0 221.1319 19000.0 227.0305 2600.0 227.1946 2700.0 244.8707 2900.0 247.1098 3200.0 248.2289 2500.0 256.2666 2300.0 271.8933 3100.0 277.7099 2500.0 END IONS BEGIN IONS SCANS=535 PEPMASS=221.0811 CHARGE=1 COLLISION_ENERGY=0.0 43.0178 27000.0 43.5153 2700.0 49.035 2500.0 55.0504 4900.0 56.8599 2300.0 57.0695 2600.0 59.9913 2100.0 61.719 2400.0 62.345 2700.0 67.054 12000.0 68.9968 2500.0 69.0696 11000.0 69.1803 2100.0 71.0125 52000.0 72.8767 2600.0 73.4608 2400.0 77.0386 2400.0 78.0462 21000.0 79.054 48000.0 81.0696 10000.0 85.0435 2500.0 86.6803 2100.0 88.5534 2400.0 89.0376 2700.0 90.0465 3600.0 91.0539 60000.0 92.9712 2200.0 93.0074 2500.0 93.0698 8900.0 95.049 26000.0 95.0854 37000.0 96.4261 2800.0 102.0461 74000.0 103.0541 42000.0 103.3642 2300.0 104.0618 40000.0 104.9515 4600.0 105.0333 7100.0 105.0698 43000.0 107.0488 69000.0 107.0852 12000.0 107.97 2400.0 109.0645 2400.0 109.1011 22000.0 113.0594 84000.0 115.0543 3600.0 116.0624 4500.0 118.0411 50000.0 119.0489 130000.0 119.085 7100.0 120.0572 11000.0 121.0296 3000.0 121.0646 31000.0 121.101 2600.0 122.0726 10000.0 129.5522 2300.0 130.0412 130000.0 131.049 67000.0 132.0207 2900.0 132.0567 110000.0 133.0283 26000.0 133.0647 43000.0 134.0361 2700.0 134.0724 4200.0 135.0438 190000.0 137.0595 13000.0 139.0751 2400.0 144.0572 3200.0 145.0281 12000.0 145.0648 3600.0 146.0361 22000.0 146.4111 2800.0 147.0438 460000.0 147.1176 6000.0 148.0518 66000.0 149.0595 94000.0 150.0676 44000.0 157.0396 7000.0 158.036 5600.0 159.0077 9600.0 159.0441 15000.0 160.0518 120000.0 161.0237 15000.0 161.0598 99000.0 162.0675 320000.0 163.0232 6000.0 163.0389 570000.0 163.0552 3300.0 163.0752 59000.0 163.1117 2500.0 172.1248 2400.0 173.0234 3300.0 173.5231 4400.0 173.535 62000.0 174.0311 35000.0 174.9846 6300.0 175.0391 300000.0 176.047 77000.0 177.0547 83000.0 178.0626 290000.0 180.7751 2800.0 187.0408 2900.0 187.4121 2300.0 188.0471 40000.0 189.0542 12000.0 190.0431 5500.0 190.0625 390000.0 190.0809 4700.0 191.0143 2700.0 191.034 180000.0 191.0704 6800.0 192.0424 3100.0 193.0861 190000.0 203.1803 3800.0 205.0497 6300.0 206.0576 97000.0 221.0813 23000.0 221.1539 2800.0 230.5667 2500.0 END IONS BEGIN IONS SCANS=536 PEPMASS=657.2422 CHARGE=1 COLLISION_ENERGY=0.0 66.0822 2200.0 70.3943 2700.0 73.0243 6400.0 73.0275 15000.0 78.9676 2300.0 120.0416 32000.0 123.2837 2500.0 173.294 2600.0 173.5271 23000.0 188.0315 100000.0 221.0806 8800.0 269.0896 34000.0 279.0867 4300.0 296.0883 3800.0 297.0847 160000.0 310.0688 11000.0 324.0836 4300.0 325.0919 65000.0 340.0198 8500.0 340.1153 1800000.0 352.1161 3000.0 395.1467 15000.0 397.1727 3100.0 437.1679 11000.0 461.1693 3800.0 463.1364 120000.0 463.2105 3200.0 516.1961 7300.0 532.1916 10000.0 559.2032 13000.0 560.189 67000.0 592.1245 2300.0 641.2083 4500.0 657.2418 460000.0 END IONS BEGIN IONS SCANS=537 PEPMASS=322.1083 CHARGE=1 COLLISION_ENERGY=0.0 57.8927 2700.0 79.022 2400.0 88.0754 2900.0 103.0541 3000.0 104.8949 2300.0 113.2651 2900.0 131.049 31000.0 132.0524 22000.0 135.0439 30000.0 136.0472 18000.0 143.049 3500.0 149.0595 77000.0 149.0735 3300.0 150.0629 62000.0 151.5632 2300.0 161.0596 57000.0 162.063 65000.0 173.0598 20000.0 173.5294 11000.0 174.0632 22000.0 185.0595 4100.0 186.0627 4100.0 200.0793 4200.0 206.1024 3000.0 223.099 11000.0 232.0769 2600.0 233.0838 11000.0 234.0969 16000.0 236.0724 2800.0 241.5709 2700.0 249.0544 26000.0 249.079 4900.0 250.0609 4100.0 250.0867 15000.0 251.094 9900.0 261.0783 150000.0 262.0872 38000.0 263.0942 27000.0 264.066 24000.0 264.1095 15000.0 265.072 6900.0 274.0504 7400.0 276.0679 2500.0 277.0739 29000.0 278.0812 610000.0 279.0891 110000.0 279.1253 3000.0 280.0975 10000.0 289.0734 54000.0 290.0812 150000.0 292.0228 5400.0 292.0605 160000.0 292.1023 13000.0 293.0684 65000.0 294.0758 5300.0 294.1124 67000.0 304.0954 3000.0 306.0762 580000.0 307.0432 6100.0 307.0841 320000.0 322.1075 1000000.0 322.1956 8500.0 END IONS BEGIN IONS SCANS=538 PEPMASS=344.0897 CHARGE=1 COLLISION_ENERGY=0.0 50.1755 2300.0 53.1991 2100.0 54.6006 2000.0 58.688 2500.0 59.758 2200.0 66.9168 2100.0 70.0128 2100.0 70.413 2400.0 73.0281 3100.0 78.0403 2700.0 78.9812 2100.0 89.0595 6200.0 89.4323 2300.0 101.9023 2300.0 102.0917 2900.0 121.0642 3600.0 126.6119 2400.0 168.0546 2900.0 173.5246 10000.0 173.5332 43000.0 173.5429 4700.0 174.7614 2900.0 179.4126 2200.0 184.7393 2600.0 189.14 2300.0 190.8225 2800.0 201.5177 2600.0 216.8742 2300.0 226.654 2600.0 249.1342 2300.0 283.0617 3800.0 297.6001 2600.0 298.5577 2400.0 300.0633 15000.0 328.0584 120000.0 329.0665 34000.0 344.0407 8000.0 344.0893 300000.0 344.1338 4300.0 353.1429 2400.0 END IONS BEGIN IONS SCANS=539 PEPMASS=235.0967 CHARGE=1 COLLISION_ENERGY=0.0 43.0177 260000.0 57.0697 44000.0 64.0509 2200.0 66.4037 3100.0 66.928 2200.0 73.0281 47000.0 73.8421 2400.0 74.0315 13000.0 74.0658 2400.0 77.106 2100.0 82.6991 2400.0 83.2346 2600.0 84.1024 2200.0 86.8922 2700.0 88.2441 2400.0 91.0537 2300.0 93.3368 2600.0 94.1228 2300.0 95.1604 3000.0 105.0696 48000.0 110.0361 6300.0 112.2705 2300.0 114.4297 2800.0 118.6412 2300.0 119.0853 6400.0 123.0437 180000.0 127.1042 2200.0 129.0698 32000.0 133.0647 22000.0 137.0964 2700.0 140.0802 2800.0 147.0805 2700.0 148.8951 2500.0 149.6877 5500.0 149.7077 3000.0 151.0751 130000.0 157.0646 13000.0 170.0621 2600.0 173.5188 5600.0 173.5271 35000.0 173.5367 58000.0 173.5451 4500.0 175.0754 34000.0 178.7573 2300.0 179.1068 11000.0 191.9401 2300.0 224.1932 2400.0 233.6104 2400.0 235.1706 2500.0 235.2044 6800.0 240.1218 2400.0 END IONS BEGIN IONS SCANS=540 PEPMASS=252.1232 CHARGE=1 COLLISION_ENERGY=0.0 44.679 2300.0 45.0334 2300.0 46.877 2300.0 46.919 2100.0 48.4233 2200.0 51.2491 2200.0 51.6129 4300.0 52.2811 2300.0 53.5259 2000.0 55.0177 26000.0 56.7203 2100.0 57.9511 2700.0 59.2137 2100.0 60.0442 130000.0 60.0946 2300.0 61.7003 2100.0 62.1615 2400.0 65.0826 2400.0 67.2627 2200.0 67.4504 2600.0 70.5787 2200.0 73.0283 5400.0 76.0451 2700.0 77.4131 2300.0 78.6005 2700.0 79.0542 3400.0 81.0268 2400.0 81.0762 2600.0 84.8195 2600.0 88.2154 2400.0 104.9469 2300.0 105.0697 580000.0 105.0782 3100.0 110.0362 93000.0 111.3769 2400.0 114.3826 2500.0 115.0051 2600.0 116.7414 2100.0 120.2876 2300.0 123.0336 5200.0 123.0439 3100000.0 123.0524 14000.0 123.0802 43000.0 128.4812 2800.0 129.0697 190000.0 131.0494 6600.0 131.2776 2400.0 131.4033 2300.0 133.0647 470000.0 134.4084 2300.0 135.0438 32000.0 135.1349 2600.0 147.0803 45000.0 149.0597 14000.0 151.0646 15000.0 151.0752 7400000.0 151.1036 40000.0 151.6829 2500.0 157.0647 370000.0 160.0519 29000.0 161.1329 3100.0 170.5922 3100.0 173.5256 19000.0 173.5365 66000.0 175.0496 3500.0 175.0577 11000.0 175.0755 890000.0 175.0933 21000.0 184.0374 3400.0 193.086 150000.0 196.0607 110000.0 199.0729 2600.0 209.0596 12000.0 224.0927 12000.0 237.0552 2800.0 242.9261 2600.0 END IONS BEGIN IONS SCANS=541 PEPMASS=257.0785 CHARGE=1 COLLISION_ENERGY=0.0 46.7374 2400.0 47.1028 2100.0 47.8609 2500.0 49.3147 2400.0 53.6092 2000.0 55.1173 2300.0 56.3257 2300.0 56.5515 2700.0 56.9112 2800.0 58.6465 2300.0 61.1267 2300.0 62.2545 2300.0 62.6299 2200.0 63.1568 2200.0 63.708 2700.0 65.44 2500.0 67.5453 2000.0 73.028 9900.0 74.9629 2300.0 78.5836 2400.0 84.3362 2400.0 88.2274 2300.0 92.3691 2600.0 101.9817 2300.0 115.2569 2300.0 121.101 2400.0 122.7333 2500.0 122.9322 2900.0 125.1232 2300.0 132.0837 2200.0 134.8343 2200.0 135.3615 2300.0 136.2451 2600.0 139.2821 2300.0 141.8745 2500.0 142.6911 2200.0 150.234 2400.0 151.4302 2700.0 154.1213 2500.0 167.1236 3100.0 173.5302 83000.0 173.5433 8600.0 195.568 2400.0 205.8802 9500.0 229.7865 2600.0 238.7921 2400.0 242.651 2500.0 253.4232 2300.0 END IONS BEGIN IONS SCANS=542 PEPMASS=643.2266 CHARGE=1 COLLISION_ENERGY=0.0 65.0252 2600.0 66.5678 2600.0 69.8385 2300.0 73.4904 2100.0 82.4392 2300.0 94.4738 2100.0 95.0491 2500.0 108.4457 2200.0 119.0336 28000.0 120.0415 18000.0 147.0286 18000.0 173.5243 7000.0 173.5315 42000.0 173.5429 4100.0 215.0677 2800.0 217.0833 31000.0 221.0804 28000.0 229.0462 6200.0 255.8605 2500.0 259.1942 2700.0 275.1009 3300.0 279.0865 3500.0 282.1103 2900.0 297.0908 2400.0 318.2956 2400.0 324.0849 15000.0 325.0917 56000.0 326.0346 3400.0 326.0996 270000.0 340.115 300000.0 341.1235 29000.0 362.3222 2500.0 401.2767 3100.0 430.2971 2700.0 449.1181 2700.0 457.5725 3200.0 465.9429 2700.0 529.7254 2400.0 563.5421 2600.0 603.5651 2600.0 END IONS BEGIN IONS SCANS=543 PEPMASS=201.0912 CHARGE=1 COLLISION_ENERGY=0.0 43.2472 2200.0 49.4013 2100.0 50.03 2400.0 51.1922 2400.0 55.1201 2300.0 55.7068 2400.0 55.9341 110000.0 56.9346 43000.0 56.942 2600.0 59.1215 2200.0 60.5174 2400.0 60.7242 2400.0 60.9088 2200.0 66.27 2300.0 68.3778 2400.0 72.9368 23000.0 73.9372 3900.0 75.0023 2600.0 76.9327 2700.0 78.0568 2200.0 78.4805 2200.0 79.3495 2200.0 86.5817 2500.0 89.9389 2500.0 90.9474 31000.0 91.9479 8200.0 92.5452 2200.0 102.9484 3200.0 107.9499 14000.0 114.9479 12000.0 114.9716 6000.0 115.0541 40000.0 115.9793 9200.0 116.0617 2600.0 116.8582 2300.0 117.9593 7000.0 119.086 2600.0 123.5697 2200.0 128.062 22000.0 128.9507 25000.0 129.0696 77000.0 129.9524 24000.0 130.0776 110000.0 131.0853 3900.0 131.974 53000.0 132.329 2500.0 132.9584 2800.0 135.945 11000.0 136.9449 3100.0 140.0619 46000.0 141.0697 24000.0 143.0491 20000.0 145.1005 3800.0 147.9635 2400.0 149.6702 3500.0 149.6893 9700.0 149.985 9000.0 155.9746 3200.0 156.0569 20000.0 157.0433 3300.0 157.0647 580000.0 158.061 2800.0 158.0726 370000.0 159.1176 2500.0 168.0559 3300.0 171.0444 12000.0 173.5314 39000.0 174.8613 2700.0 185.0598 55000.0 186.0677 110000.0 201.0914 140000.0 201.1104 4200.0 END IONS BEGIN IONS SCANS=544 PEPMASS=231.1018 CHARGE=1 COLLISION_ENERGY=0.0 43.9363 2500.0 44.2961 2200.0 45.148 2300.0 47.1645 2300.0 53.4535 2300.0 53.5275 2200.0 55.0176 12000.0 59.9899 2500.0 67.415 2100.0 72.6941 2200.0 86.1037 2200.0 86.5946 2200.0 91.0803 2400.0 111.5048 2500.0 128.0619 12000.0 129.0695 35000.0 129.0787 2500.0 130.0771 4500.0 141.0696 9000.0 142.0773 6300.0 143.0851 18000.0 145.0644 28000.0 151.7653 2100.0 156.0571 13000.0 157.0645 78000.0 158.0724 57000.0 159.0802 20000.0 170.0724 23000.0 171.0804 17000.0 172.0882 120000.0 173.0596 130000.0 173.5258 6500.0 173.5368 26000.0 175.0759 3000.0 185.0598 3700.0 186.0674 30000.0 187.0752 47000.0 188.083 120000.0 189.0906 17000.0 194.6114 2300.0 198.0689 2400.0 200.0826 3800.0 201.0553 11000.0 201.091 83000.0 203.1065 22000.0 216.0788 19000.0 216.2197 2600.0 216.4366 2100.0 229.6114 2300.0 231.102 14000.0 240.0811 2200.0 END IONS BEGIN IONS SCANS=545 PEPMASS=597.2213 CHARGE=1 COLLISION_ENERGY=0.0 67.4399 2100.0 69.2834 2400.0 70.4552 2200.0 70.7399 2400.0 80.2378 2300.0 82.4149 2700.0 85.1307 2500.0 91.8269 2300.0 96.9382 2400.0 99.0699 2200.0 105.1746 2200.0 106.4459 2300.0 120.042 2500.0 135.3561 2900.0 149.6781 2600.0 149.6884 5800.0 149.7088 3700.0 159.9151 2400.0 173.5239 18000.0 173.5395 25000.0 184.6228 2500.0 193.74 2800.0 219.6734 2700.0 230.1158 2300.0 233.7334 2300.0 236.844 2400.0 264.3713 2400.0 269.0893 31000.0 280.0948 130000.0 297.0849 130000.0 318.2243 2500.0 340.1157 130000.0 363.886 2700.0 398.056 2500.0 426.1292 7700.0 456.1753 3100.0 472.1733 23000.0 500.1712 8300.0 539.2056 2500.0 597.2212 30000.0 END IONS BEGIN IONS SCANS=546 PEPMASS=741.2907 CHARGE=1 COLLISION_ENERGY=0.0 70.2539 2700.0 71.0492 2600.0 71.2864 2400.0 73.1898 2500.0 77.0388 3400.0 79.0541 10000.0 81.0333 25000.0 85.3184 2100.0 87.672 2200.0 91.0541 7200.0 92.706 2200.0 92.7846 2300.0 95.0492 15000.0 96.1125 2100.0 96.151 2300.0 102.6226 2500.0 103.0541 13000.0 107.049 17000.0 108.2852 3000.0 109.9822 2400.0 111.0437 3200.0 115.0542 66000.0 117.07 15000.0 119.9066 2300.0 121.0648 8200.0 123.044 7800.0 124.052 3200.0 128.0623 9400.0 129.0699 40000.0 131.049 39000.0 131.7847 2800.0 133.0279 6200.0 135.0314 3500.0 135.0439 1400000.0 136.0517 41000.0 137.0592 2800.0 139.0752 29000.0 143.049 150000.0 143.0867 3100.0 143.0999 2900.0 145.0646 220000.0 146.0718 3900.0 147.0439 16000.0 148.7585 2500.0 149.0233 20000.0 149.0596 29000.0 151.0096 3100.0 151.0387 50000.0 151.0647 4300.0 151.0753 570000.0 151.0891 4200.0 155.0609 3200.0 157.0647 68000.0 158.0725 24000.0 159.0441 55000.0 159.0802 3500.0 161.0459 3000.0 161.0596 92000.0 163.0384 3100.0 163.0764 3000.0 165.0549 13000.0 165.0906 14000.0 167.0702 42000.0 171.081 9400.0 172.0883 35000.0 173.0597 1500000.0 173.0948 4200.0 173.5331 32000.0 173.5415 6600.0 174.0676 180000.0 175.0393 14000.0 175.0753 50000.0 177.0549 14000.0 177.0911 81000.0 179.0705 12000.0 181.0663 3000.0 181.0843 5100.0 185.0455 3100.0 185.0598 500000.0 185.0785 3400.0 186.0676 12000.0 187.0754 120000.0 188.0832 79000.0 189.071 9000.0 189.0911 790000.0 191.0712 7800.0 191.1067 14000.0 193.0862 12000.0 197.0596 4300.0 199.0752 27000.0 201.0692 10000.0 201.0911 490000.0 201.1131 10000.0 203.0704 100000.0 203.1068 170000.0 205.0877 2500.0 209.0598 4100.0 211.0758 3000.0 213.0909 13000.0 215.0704 59000.0 216.0783 13000.0 219.0804 3700.0 219.1021 25000.0 223.0753 2700.0 224.0084 2700.0 225.0936 2600.0 231.0764 11000.0 231.1018 180000.0 233.0808 32000.0 234.1052 2500.0 237.0548 3200.0 239.071 9700.0 245.0966 11000.0 246.1041 13000.0 247.0761 6900.0 249.1143 3100.0 251.1057 3300.0 252.0781 100000.0 253.0503 6800.0 253.0861 14000.0 260.0836 5800.0 261.0909 43000.0 262.0985 23000.0 265.1228 14000.0 267.065 31000.0 267.1385 2600.0 268.0732 69000.0 273.091 26000.0 274.099 48000.0 275.0719 7300.0 275.1064 6900.0 277.0878 10000.0 277.1226 45000.0 278.0942 11000.0 280.0734 2900.0 282.0891 160000.0 283.097 150000.0 288.0784 9900.0 289.0863 35000.0 290.0941 25000.0 291.102 16000.0 292.1097 57000.0 293.0838 4300.0 293.1173 35000.0 295.0965 58000.0 295.1323 5100.0 303.1021 57000.0 304.1098 230000.0 304.1495 5500.0 305.0808 25000.0 305.1179 100000.0 308.1049 90000.0 309.1138 13000.0 320.1046 120000.0 321.8253 2700.0 322.1205 7800.0 323.1282 130000.0 325.1435 7300.0 335.1279 190000.0 335.1732 7800.0 353.1379 23000.0 491.9146 2400.0 591.7997 2500.0 622.7922 2600.0 END IONS BEGIN IONS SCANS=547 PEPMASS=282.0891 CHARGE=1 COLLISION_ENERGY=0.0 48.4799 2300.0 51.9759 2300.0 54.9257 2100.0 57.0696 4800.0 60.8527 2600.0 64.4317 2300.0 68.9695 2300.0 69.0695 6400.0 69.425 2400.0 70.9517 2300.0 72.1451 2100.0 83.0855 5800.0 88.5463 2300.0 97.1012 2100.0 101.2062 2500.0 128.1067 2400.0 132.0132 2800.0 132.6491 2600.0 134.096 36000.0 149.6809 4100.0 149.6913 4400.0 153.0697 38000.0 155.0849 2800.0 171.6535 2400.0 173.5288 25000.0 181.0646 110000.0 197.0603 7300.0 207.8872 12000.0 209.0598 96000.0 211.0754 150000.0 211.1361 5500.0 221.0597 53000.0 222.068 5600.0 224.0468 11000.0 225.0553 13000.0 235.8853 2500.0 237.0557 4400.0 238.0623 63000.0 239.0702 650000.0 239.0976 5800.0 249.0544 9700.0 267.0319 7600.0 267.065 260000.0 282.0888 180000.0 282.2216 95000.0 END IONS BEGIN IONS SCANS=548 PEPMASS=323.1281 CHARGE=1 COLLISION_ENERGY=0.0 55.2431 2400.0 60.046 2300.0 63.2548 2400.0 64.8662 2700.0 71.6075 2400.0 77.2159 2200.0 78.7251 2500.0 79.0537 13000.0 80.6902 2200.0 86.6844 2500.0 89.1894 2200.0 95.0486 8900.0 96.5484 2400.0 97.8162 2400.0 105.0333 2800.0 107.0488 3700.0 111.3217 2300.0 118.5415 2400.0 118.857 2700.0 130.3574 2300.0 133.682 2500.0 135.0437 510000.0 135.0534 6500.0 136.0515 57000.0 138.7821 2700.0 147.0438 14000.0 151.075 120000.0 158.0724 3600.0 159.0521 2500.0 167.7924 2300.0 173.528 23000.0 173.5375 17000.0 173.5455 5100.0 185.0597 32000.0 186.0679 5400.0 188.7027 2500.0 201.0907 58000.0 218.0724 3400.0 219.079 6600.0 222.1531 2300.0 224.5349 2500.0 231.0804 5500.0 233.0961 41000.0 234.1037 40000.0 235.0753 9300.0 239.6478 2700.0 247.0752 14000.0 247.7713 2700.0 248.0841 4000.0 249.0912 5400.0 249.7983 2400.0 250.0991 13000.0 261.0907 72000.0 262.0984 64000.0 263.0702 9800.0 263.1059 7400.0 264.1135 2600.0 265.0905 4700.0 265.1221 64000.0 267.0655 17000.0 274.0983 6700.0 276.0783 9200.0 276.856 6000.0 277.0861 29000.0 278.0936 31000.0 280.0732 9400.0 282.0886 13000.0 290.0948 3000.0 291.1017 22000.0 292.1096 170000.0 292.146 7200.0 293.0809 40000.0 293.1175 44000.0 295.0969 48000.0 308.1046 110000.0 323.128 27000.0 END IONS BEGIN IONS SCANS=549 PEPMASS=335.1281 CHARGE=1 COLLISION_ENERGY=0.0 50.086 2500.0 51.1231 2200.0 52.921 2100.0 53.7308 2300.0 58.118 2100.0 58.2879 2700.0 60.1467 2200.0 63.1227 2600.0 66.5441 2700.0 67.0969 2500.0 68.3873 2100.0 68.6087 2900.0 69.1587 2200.0 70.8388 2700.0 75.0438 37000.0 75.2592 2400.0 78.558 2200.0 83.0052 2500.0 91.0542 3600.0 96.6306 2200.0 98.0144 2200.0 105.6439 2200.0 119.6056 2100.0 122.9611 2500.0 123.5877 2500.0 131.3128 2500.0 135.0436 14000.0 147.0438 25000.0 151.0752 13000.0 152.9813 2800.0 158.5887 2400.0 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280.0742 2900.0 282.0887 67000.0 287.0699 21000.0 288.078 160000.0 289.0469 3100.0 289.0859 650000.0 289.1173 11000.0 290.0584 7500.0 290.0936 170000.0 291.0646 26000.0 291.1013 23000.0 291.6312 2400.0 292.0729 19000.0 292.1089 20000.0 302.0944 17000.0 303.0434 3500.0 303.1015 700000.0 303.1314 3500.0 303.1433 3800.0 304.1094 1200000.0 304.6696 2700.0 305.0804 340000.0 305.1177 220000.0 306.0886 110000.0 307.0964 70000.0 307.1331 8400.0 319.0964 120000.0 320.061 5000.0 320.1041 310000.0 320.1367 2100.0 335.1276 230000.0 345.7503 2600.0 END IONS BEGIN IONS SCANS=550 PEPMASS=353.1387 CHARGE=1 COLLISION_ENERGY=0.0 51.0235 25000.0 53.0387 11000.0 53.2316 13000.0 53.9766 17000.0 55.0179 28000.0 57.4447 8900.0 59.0708 13000.0 64.6072 8800.0 65.0386 26000.0 71.0491 640000.0 73.848 8800.0 75.044 110000.0 77.0387 69000.0 79.0542 280000.0 91.0542 170000.0 93.0336 87000.0 95.0491 140000.0 96.4787 8900.0 97.3009 9700.0 100.9398 16000.0 103.054 32000.0 105.0336 83000.0 105.0447 46000.0 107.0492 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149.0955 18000.0 149.6815 4700.0 149.6926 5700.0 150.0269 26000.0 150.0647 10000.0 151.039 25000.0 151.0605 3500.0 151.0627 7500.0 151.0754 1500000.0 151.0877 3200.0 152.0793 60000.0 153.0873 11000.0 156.0571 2500.0 157.0647 60000.0 158.0727 16000.0 159.0442 38000.0 159.0805 40000.0 160.0522 3000.0 160.0884 5100.0 161.0597 140000.0 162.0674 120000.0 163.0389 220000.0 163.0754 13000.0 164.0823 8500.0 164.2378 2800.0 165.0549 88000.0 165.0905 78000.0 166.0585 24000.0 166.0994 2900.0 167.0698 4100.0 171.0807 11000.0 172.0886 61000.0 173.0599 190000.0 173.0952 4700.0 173.5261 27000.0 173.5399 34000.0 174.0675 45000.0 175.0392 440000.0 175.0757 51000.0 176.0467 11000.0 176.0822 19000.0 177.0546 44000.0 177.0911 1400000.0 177.1097 3000.0 178.0951 45000.0 179.0705 100000.0 179.1032 2400.0 183.081 3700.0 185.0599 83000.0 186.0683 6100.0 187.0752 85000.0 188.0835 180000.0 189.0548 27000.0 189.0762 2900.0 189.0912 330000.0 190.0628 12000.0 190.0977 23000.0 191.0705 23000.0 191.1066 9600.0 193.0862 37000.0 197.0598 19000.0 198.0684 3400.0 199.0756 200000.0 200.0838 4200.0 201.0567 13000.0 201.0913 640000.0 202.0588 5600.0 202.0793 3800.0 202.0989 4300.0 203.0879 10000.0 203.107 340000.0 204.075 3300.0 204.1111 3600.0 205.0862 120000.0 206.0909 2800.0 209.0605 2500.0 213.0532 5700.0 213.0914 67000.0 215.0704 78000.0 215.0897 3700.0 216.0778 6400.0 217.0857 48000.0 218.0935 27000.0 219.0798 5300.0 219.1032 5000.0 220.0896 9400.0 223.0735 2300.0 224.0837 3400.0 225.0547 3700.0 225.0916 34000.0 230.071 3400.0 231.0805 27000.0 231.1021 270000.0 231.4897 2400.0 232.0884 13000.0 233.0965 25000.0 234.1046 16000.0 235.0754 3700.0 235.1117 160000.0 237.0541 3800.0 238.0613 2500.0 238.0997 3300.0 239.0708 15000.0 239.1061 3800.0 244.0885 3500.0 245.0961 120000.0 246.104 120000.0 246.1307 4600.0 247.0764 27000.0 247.111 5600.0 248.0837 25000.0 249.0914 6400.0 250.0998 7800.0 250.6525 4800.0 251.0709 4800.0 251.1067 17000.0 252.0784 110000.0 253.0501 12000.0 253.0862 42000.0 255.1014 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5200.0 302.0951 9600.0 303.0621 12000.0 303.1021 730000.0 304.11 470000.0 305.081 67000.0 305.1179 360000.0 306.0894 18000.0 307.0969 17000.0 308.0735 2500.0 308.105 190000.0 309.113 46000.0 310.1205 8500.0 319.0969 24000.0 320.1049 160000.0 321.1123 27000.0 322.1199 19000.0 323.1284 150000.0 323.1724 4800.0 325.1441 6500.0 333.1139 5200.0 335.1283 240000.0 338.1125 3100.0 353.1364 5400.0 END IONS BEGIN IONS SCANS=553 PEPMASS=393.1314 CHARGE=1 COLLISION_ENERGY=0.0 77.8638 2200.0 87.7853 2800.0 91.1219 2900.0 99.2615 2400.0 138.2042 2800.0 149.0235 2900.0 150.0265 3600.0 157.1986 3100.0 168.1738 2500.0 172.1904 2600.0 173.5205 5100.0 173.5382 29000.0 185.1178 2500.0 243.4988 2300.0 255.129 2700.0 255.5178 2500.0 393.1312 41000.0 END IONS BEGIN IONS SCANS=554 PEPMASS=388.1761 CHARGE=1 COLLISION_ENERGY=0.0 56.0854 2500.0 56.4513 3100.0 59.2955 2400.0 61.4338 3100.0 72.8367 2600.0 75.0439 13000.0 77.0392 13000.0 79.0543 18000.0 91.0541 13000.0 95.0491 16000.0 98.1794 3000.0 104.6613 2500.0 105.0338 4000.0 107.049 6600.0 107.9839 2600.0 117.0698 16000.0 121.0647 340000.0 125.0598 8500.0 126.5632 2700.0 131.0491 51000.0 133.0649 4400.0 135.0127 17000.0 135.021 68000.0 135.0247 21000.0 135.044 8200000.0 135.0633 35000.0 135.0672 80000.0 135.0753 22000.0 135.0816 7700.0 136.0519 28000.0 137.0594 4100.0 139.0753 16000.0 139.7554 2000.0 139.7578 2000.0 145.0647 190000.0 146.0726 85000.0 147.044 62000.0 147.0804 120000.0 149.0238 2800.0 149.0596 650000.0 149.096 10000.0 151.0646 7100.0 151.0753 1100000.0 153.0914 4700.0 157.0648 14000.0 159.0441 25000.0 159.0804 15000.0 160.0517 6300.0 161.0597 130000.0 162.0676 57000.0 163.039 280000.0 165.0547 50000.0 165.091 41000.0 167.2248 2500.0 171.0802 8200.0 172.0525 3000.0 172.0896 2500.0 173.06 23000.0 173.5281 16000.0 173.5376 11000.0 174.0673 4800.0 175.0391 580000.0 175.0751 17000.0 176.0468 17000.0 177.0544 39000.0 177.0911 1500000.0 179.0705 59000.0 181.0857 4600.0 185.0598 72000.0 187.0754 34000.0 188.0828 8300.0 189.0548 19000.0 189.0911 200000.0 190.063 3400.0 193.0864 27000.0 197.0598 12000.0 199.0755 280000.0 201.0541 4400.0 202.0806 3800.0 203.1069 79000.0 205.086 110000.0 215.0705 65000.0 217.0862 38000.0 218.0942 38000.0 231.0795 9600.0 231.1023 14000.0 232.0877 4100.0 235.1119 130000.0 245.0959 49000.0 246.1039 22000.0 247.1107 3700.0 249.1124 18000.0 260.083 9000.0 261.0909 14000.0 262.0988 35000.0 263.1066 170000.0 271.0763 3200.0 272.0835 55000.0 273.091 130000.0 274.0989 79000.0 275.1074 10000.0 277.1223 160000.0 278.0945 8100.0 288.0784 52000.0 289.0859 24000.0 290.0939 51000.0 291.1019 52000.0 292.1101 9600.0 293.0841 16000.0 293.1173 430000.0 293.1479 3800.0 302.0931 4100.0 303.1016 1500000.0 304.1096 200000.0 305.0827 9000.0 305.1173 210000.0 306.0901 7800.0 320.1042 79000.0 321.1122 190000.0 323.1247 3100.0 325.1445 11000.0 333.1111 13000.0 335.1276 480000.0 344.0879 2400.0 353.138 76000.0 371.1484 15000.0 END IONS BEGIN IONS SCANS=555 PEPMASS=286.1442 CHARGE=1 COLLISION_ENERGY=0.0 50.2622 4800.0 50.264 21000.0 51.3615 2300.0 55.0178 17000.0 56.2332 2300.0 56.7538 2300.0 65.1188 2600.0 67.0541 6300.0 68.0945 2500.0 69.0697 400000.0 70.065 15000.0 71.6007 2500.0 77.0385 3000.0 82.6384 2600.0 83.0487 2400.0 84.0803 190000.0 84.9852 2100.0 86.0962 190000.0 97.7038 2300.0 98.0961 2800.0 103.0543 7300.0 109.0519 2600.0 110.7901 2500.0 112.0668 4700.0 112.0755 420000.0 114.0915 6000.0 115.0541 570000.0 117.0697 43000.0 117.8797 2800.0 118.9971 2800.0 122.0964 2700.0 127.0544 3300.0 131.0492 13000.0 133.493 2400.0 134.0962 36000.0 135.0439 1700000.0 135.0537 8900.0 135.0681 3800.0 143.049 760000.0 143.0588 3900.0 143.0625 4600.0 145.0647 31000.0 148.4277 3000.0 150.0912 42000.0 151.086 4200.0 151.0991 170000.0 157.0636 3400.0 157.1011 11000.0 159.0439 190000.0 161.0597 41000.0 164.1073 2700.0 171.0441 740000.0 173.0598 410000.0 173.5309 31000.0 173.5378 11000.0 185.0962 42000.0 189.0547 28000.0 201.0106 39000.0 201.0197 19000.0 201.0547 6000000.0 201.0898 38000.0 201.0986 46000.0 201.1104 10000.0 215.1067 28000.0 218.1182 13000.0 224.9335 2600.0 228.8449 2400.0 243.1438 2700.0 258.1489 17000.0 286.1442 260000.0 290.854 2900.0 END IONS BEGIN IONS SCANS=556 PEPMASS=409.1055 CHARGE=1 COLLISION_ENERGY=0.0 64.584 2100.0 72.8689 2300.0 79.6982 2200.0 80.9952 2800.0 81.8253 2800.0 89.8477 2200.0 148.8029 2500.0 173.5245 18000.0 173.5423 11000.0 180.1841 2200.0 187.3542 2200.0 217.5038 2200.0 233.8568 2400.0 237.7936 2400.0 256.8086 2500.0 395.8059 2400.0 END IONS BEGIN IONS SCANS=557 PEPMASS=416.2075 CHARGE=1 COLLISION_ENERGY=0.0 54.2773 2300.0 54.6293 2600.0 56.0621 2300.0 57.0543 2500.0 61.143 3000.0 61.4403 2800.0 61.93 2700.0 64.4444 2500.0 64.9309 2300.0 69.2977 2500.0 70.0885 2600.0 70.3024 2500.0 71.541 2200.0 76.0375 2800.0 78.6129 2800.0 80.2817 2300.0 81.3461 2800.0 82.5479 2200.0 83.9384 2800.0 92.851 2100.0 94.2437 2500.0 96.1386 2400.0 102.6091 2400.0 102.909 2200.0 115.2429 2400.0 120.131 2300.0 142.2036 2300.0 142.3933 2300.0 145.0937 2500.0 149.6682 2900.0 149.6868 10000.0 152.9341 2400.0 166.9559 2300.0 167.1409 2300.0 170.8985 2400.0 173.5305 130000.0 173.5447 8700.0 175.3706 2600.0 194.552 2900.0 198.7619 2300.0 210.9756 2400.0 219.4265 2300.0 225.3857 2700.0 233.811 2900.0 241.7008 2800.0 244.5836 2600.0 245.8505 2400.0 250.1075 2500.0 270.7401 2200.0 289.9318 2400.0 290.4001 2300.0 292.8149 2800.0 306.3849 2600.0 307.2819 28000.0 318.4079 2600.0 335.3113 2300.0 343.0803 2700.0 354.9639 2600.0 376.886 2500.0 426.2382 2700.0 END IONS BEGIN IONS SCANS=558 PEPMASS=383.1495 CHARGE=1 COLLISION_ENERGY=0.0 54.1219 2400.0 55.5171 2300.0 58.9801 2200.0 61.9823 2300.0 68.6298 2400.0 72.4276 2300.0 105.1055 2400.0 115.5259 2400.0 117.5144 2300.0 127.603 2500.0 135.0437 110000.0 147.9807 2400.0 149.0591 3700.0 150.3347 2200.0 157.0633 3800.0 166.0623 16000.0 173.06 8300.0 173.5255 11000.0 173.5411 14000.0 179.6313 2400.0 181.0861 29000.0 185.0596 9200.0 187.0752 12000.0 198.0665 2400.0 199.0766 2900.0 202.0987 39000.0 218.0939 13000.0 219.1022 3200.0 222.4384 2200.0 230.0947 8800.0 231.1015 68000.0 233.1175 9800.0 261.1119 26000.0 269.081 12000.0 275.0705 5500.0 276.0747 2700.0 276.1166 2900.0 277.0867 9200.0 279.1021 3600.0 282.0898 17000.0 289.0865 3300.0 290.0959 3600.0 291.068 3200.0 291.1023 17000.0 292.1099 7200.0 293.0819 8500.0 297.0758 50000.0 303.1024 12000.0 304.1099 17000.0 305.0817 13000.0 306.0887 3300.0 307.0956 13000.0 308.1039 11000.0 308.8999 6400.0 312.0993 47000.0 319.0972 28000.0 320.1079 2800.0 322.1203 47000.0 323.0914 22000.0 325.1074 13000.0 333.1116 10000.0 334.1201 43000.0 335.0919 19000.0 338.1155 43000.0 350.1149 13000.0 360.0298 2800.0 365.1381 7900.0 END IONS BEGIN IONS SCANS=559 PEPMASS=310.108 CHARGE=1 COLLISION_ENERGY=0.0 57.2756 3400.0 57.44 3700.0 60.0415 2100.0 62.2685 13000.0 62.2713 7400.0 69.2663 5200.0 69.2692 11000.0 71.1021 2800.0 72.0445 2500.0 72.7881 2300.0 73.7689 3800.0 73.7731 3700.0 83.5479 2200.0 86.7514 2600.0 88.0378 2600.0 89.3831 2300.0 100.3593 2900.0 117.879 3400.0 125.1674 2200.0 128.4082 2700.0 141.9945 2400.0 142.3226 2400.0 165.0703 4500.0 173.5299 42000.0 181.0645 12000.0 184.3969 2400.0 192.0813 22000.0 193.0892 13000.0 194.0968 11000.0 195.0436 4800.0 195.0807 8700.0 196.075 5200.0 203.0731 21000.0 204.0807 12000.0 207.0688 2700.0 209.0601 16000.0 220.0757 47000.0 221.0835 81000.0 222.0916 74000.0 223.9143 2400.0 224.0708 25000.0 231.0464 2500.0 231.068 230000.0 231.0884 2400.0 232.0758 120000.0 232.6406 3300.0 233.0859 3700.0 235.0629 41000.0 236.0723 4700.0 238.0859 4800.0 239.0942 19000.0 241.0743 9500.0 247.0615 5100.0 248.0471 2300.0 248.0706 230000.0 249.0174 30000.0 249.0299 19000.0 249.0783 6200000.0 249.1268 24000.0 249.1387 47000.0 249.1556 9000.0 249.173 5900.0 249.2703 3300.0 250.0861 320000.0 250.1162 7600.0 252.0355 8100.0 252.0653 240000.0 260.07 4200.0 261.0783 78000.0 263.0575 77000.0 264.0654 16000.0 264.1022 8000.0 265.073 53000.0 266.0809 72000.0 267.0876 52000.0 267.7339 2500.0 268.0584 5100.0 276.0659 42000.0 277.0024 19000.0 277.0165 15000.0 277.0733 3900000.0 277.1301 13000.0 277.1445 18000.0 278.0452 6700.0 278.0813 530000.0 278.1174 8000.0 279.089 150000.0 280.0605 650000.0 280.0883 6800.0 281.0682 54000.0 282.1142 8300.0 294.0761 350000.0 294.1147 7200.0 295.084 1600000.0 295.1242 4400.0 296.0918 48000.0 304.395 2500.0 310.0247 6500.0 310.1074 1800000.0 319.5869 2800.0 END IONS BEGIN IONS SCANS=560 PEPMASS=703.2982 CHARGE=1 COLLISION_ENERGY=0.0 70.0936 2700.0 73.0255 8100.0 73.0287 59000.0 73.1374 7900.0 73.1407 44000.0 73.8513 2200.0 76.1401 5200.0 76.1434 31000.0 78.1409 9300.0 78.1448 69000.0 78.4411 2400.0 80.3706 2500.0 89.543 2600.0 93.6621 2400.0 99.4892 2300.0 104.2512 2500.0 106.4026 2700.0 108.0292 2800.0 111.131 2900.0 116.8486 2500.0 123.114 2300.0 131.1565 2400.0 131.6959 2600.0 137.6426 2700.0 140.2791 2300.0 145.6417 2400.0 153.2855 2600.0 157.2042 2700.0 164.0916 2400.0 167.2474 2600.0 168.8214 2600.0 173.5262 46000.0 173.5378 68000.0 182.4478 2400.0 204.9237 2300.0 210.4547 2600.0 221.0806 12000.0 235.2644 2500.0 236.3644 2700.0 251.3943 2600.0 278.7636 2900.0 285.269 3400.0 293.6342 2400.0 297.7747 2600.0 383.0844 3000.0 460.412 2600.0 469.1494 40000.0 470.1598 3300.0 474.3347 2700.0 482.1632 2500.0 483.1667 51000.0 484.1774 7800.0 496.176 20000.0 497.1822 380000.0 498.1888 55000.0 499.1974 28000.0 510.1811 2900.0 511.1972 16000.0 515.1937 3200.0 524.1678 3800.0 525.2102 22000.0 526.2205 15000.0 528.164 28000.0 529.1719 30000.0 541.1693 6900.0 542.1795 29000.0 543.1863 6000.0 553.2117 2600.0 555.1874 20000.0 556.1956 320000.0 556.294 4000.0 557.2031 250000.0 569.2059 16000.0 570.2065 3200.0 573.2341 57000.0 578.6572 2900.0 584.2287 7300.0 585.2345 48000.0 597.209 11000.0 598.2168 2900.0 599.2479 21000.0 600.2565 30000.0 601.2275 25000.0 611.2137 6900.0 614.202 2800.0 625.2324 15000.0 627.246 31000.0 629.2243 190000.0 630.2323 330000.0 631.2467 7800.0 633.2543 140000.0 642.2362 2400.0 643.2383 14000.0 644.2485 88000.0 657.1599 3700.0 657.2556 1600000.0 657.44 3500.0 658.1334 15000.0 658.2629 1300000.0 658.3563 3300.0 658.3938 3400.0 659.2677 180000.0 674.2558 6300.0 675.2643 3400.0 685.1454 4500.0 685.2867 1100000.0 685.4235 3800.0 703.1885 3200.0 703.2968 1600000.0 END IONS BEGIN IONS SCANS=561 PEPMASS=635.2606 CHARGE=1 COLLISION_ENERGY=0.0 65.0766 2400.0 65.9533 2300.0 70.9297 2800.0 71.8809 2400.0 80.04 2100.0 86.8875 2900.0 86.9451 2500.0 90.5909 2200.0 98.0595 10000.0 105.0413 2700.0 106.2152 2200.0 110.6513 2200.0 116.0435 2300.0 117.665 2200.0 126.4711 2500.0 127.6923 2500.0 137.7499 2600.0 146.0959 2900.0 147.044 2300.0 152.6493 2400.0 156.3824 2600.0 162.0677 11000.0 173.5257 39000.0 173.5363 17000.0 173.5445 15000.0 178.0628 5800.0 189.0545 5400.0 190.0625 56000.0 191.0336 7400.0 191.0695 3400.0 193.0859 51000.0 206.0574 14000.0 221.0809 1600000.0 280.2769 2900.0 290.8369 2500.0 318.134 9200.0 410.0688 2500.0 434.7419 2700.0 491.7952 2500.0 575.233 4600.0 634.4406 2700.0 635.2565 4600.0 641.1904 2400.0 END IONS BEGIN IONS SCANS=562 PEPMASS=338.1027 CHARGE=1 COLLISION_ENERGY=0.0 61.8525 2600.0 73.259 2800.0 77.9252 6200.0 80.5152 3000.0 84.524 15000.0 84.5282 10000.0 100.2834 2900.0 168.0391 2800.0 173.5252 47000.0 173.5355 18000.0 173.5442 25000.0 206.3674 2700.0 209.0602 5400.0 220.0751 6600.0 221.0836 32000.0 222.0914 19000.0 231.068 22000.0 232.0763 8300.0 233.0829 3300.0 235.0643 5700.0 236.0461 4500.0 236.0707 7200.0 237.0561 6200.0 239.0925 7600.0 248.0713 34000.0 249.0542 5800.0 249.0786 410000.0 249.1079 17000.0 250.0862 110000.0 252.0661 23000.0 260.0713 9700.0 261.0782 11000.0 263.0572 24000.0 264.0413 150000.0 264.0666 70000.0 265.0495 320000.0 265.0733 31000.0 266.0815 6500.0 267.0879 11000.0 276.0665 16000.0 277.0737 1700000.0 278.0815 230000.0 279.0894 52000.0 280.0609 280000.0 281.0686 41000.0 282.0521 24000.0 282.1089 6200.0 290.0457 36000.0 291.0528 22000.0 292.0616 4500.0 292.0959 7000.0 293.0682 66000.0 294.0413 4700.0 294.0766 170000.0 295.0461 13000.0 295.0843 430000.0 296.0928 23000.0 304.0607 11000.0 305.0377 27000.0 305.0686 2700000.0 305.1499 4500.0 306.0415 14000.0 306.0766 280000.0 306.1167 7200.0 308.0557 1300000.0 309.062 4100.0 310.1079 270000.0 321.9814 22000.0 322.003 16000.0 322.0384 48000.0 322.0714 4100000.0 322.1595 26000.0 323.0452 21000.0 323.0792 1900000.0 338.0089 20000.0 338.0276 24000.0 338.1025 5400000.0 338.1777 9500.0 338.1985 11000.0 END IONS BEGIN IONS SCANS=563 PEPMASS=360.0845 CHARGE=1 COLLISION_ENERGY=0.0 56.3528 2200.0 56.6625 2400.0 62.2386 5500.0 64.814 2500.0 70.2616 4500.0 97.0332 2500.0 132.669 4900.0 173.5257 41000.0 173.544 13000.0 198.3626 4900.0 208.4004 2400.0 221.7029 2300.0 294.7558 2400.0 299.0537 10000.0 313.1644 2300.0 327.0474 7400.0 344.0525 120000.0 345.061 16000.0 360.0318 12000.0 360.0837 460000.0 360.1357 9600.0 END IONS BEGIN IONS SCANS=564 PEPMASS=370.1413 CHARGE=1 COLLISION_ENERGY=0.0 53.1491 2300.0 53.298 2100.0 55.0177 210000.0 57.535 2100.0 61.9376 2200.0 62.596 2300.0 63.0983 2500.0 65.1053 2100.0 69.0333 41000.0 71.2709 2200.0 76.8046 2100.0 77.0392 4500.0 79.054 14000.0 79.0808 2300.0 80.0981 2500.0 80.2898 2300.0 81.0334 15000.0 82.3847 2100.0 83.3746 2600.0 84.1687 2300.0 90.4809 2200.0 91.0541 26000.0 93.0701 3200.0 94.918 2300.0 95.0489 37000.0 98.2493 2300.0 102.7232 2200.0 103.054 210000.0 104.0624 5000.0 106.0414 3300.0 106.4383 2500.0 107.049 39000.0 109.0648 7400.0 111.0442 3300.0 115.0407 2300.0 115.0541 27000.0 115.3482 2900.0 116.0617 2400.0 117.0696 85000.0 118.9187 2400.0 119.0491 17000.0 120.0566 13000.0 121.0285 12000.0 121.0646 160000.0 122.036 190000.0 123.0437 51000.0 124.0524 3000.0 128.061 3200.0 128.3922 2500.0 129.0701 8800.0 130.0412 20000.0 131.0379 5000.0 131.049 1400000.0 131.0597 11000.0 131.0849 3300.0 132.0566 21000.0 133.0283 14000.0 133.0647 18000.0 135.0318 12000.0 135.0439 1800000.0 135.0552 13000.0 135.0684 3500.0 135.0804 41000.0 136.0509 120000.0 137.0594 69000.0 138.0559 3900.0 138.0673 580000.0 139.0751 110000.0 143.049 53000.0 145.0647 98000.0 146.0362 19000.0 146.0725 200000.0 147.0438 97000.0 147.0803 110000.0 148.0389 4900.0 148.0517 640000.0 149.0106 6900.0 149.0232 1400000.0 149.0348 7300.0 149.0596 120000.0 149.0961 17000.0 150.0307 40000.0 150.0674 180000.0 151.0387 130000.0 151.0531 4800.0 151.0752 1800000.0 151.0874 10000.0 152.0802 98000.0 155.0701 35000.0 156.0569 6300.0 157.0644 24000.0 158.0722 15000.0 159.0439 58000.0 159.0803 27000.0 160.0518 170000.0 160.087 5400.0 161.044 7300.0 161.0596 720000.0 161.0755 6100.0 161.0957 37000.0 162.0674 120000.0 163.0388 16000.0 163.0753 160000.0 164.0474 16000.0 164.0831 410000.0 165.0418 3500.0 165.0546 2700000.0 165.0686 11000.0 165.089 47000.0 166.0602 90000.0 166.0988 260000.0 166.4016 2800.0 167.0701 80000.0 171.0439 18000.0 172.089 7400.0 173.0597 120000.0 173.526 35000.0 173.5345 12000.0 173.5376 70000.0 174.0671 70000.0 175.0386 29000.0 175.0753 140000.0 176.0468 30000.0 176.0831 110000.0 177.0546 120000.0 177.0741 6600.0 177.091 1200000.0 177.1055 4600.0 177.6123 2700.0 178.0625 130000.0 178.0775 2400.0 178.0989 98000.0 179.0704 37000.0 180.078 65000.0 185.0598 24000.0 186.0674 64000.0 187.0387 2700.0 187.0753 100000.0 188.0466 40000.0 188.0835 37000.0 189.0547 120000.0 189.091 190000.0 190.0623 21000.0 191.0702 83000.0 191.1069 62000.0 192.078 170000.0 193.0859 100000.0 194.0937 170000.0 201.0547 230000.0 201.0889 5500.0 202.062 3900.0 202.099 27000.0 203.0702 160000.0 203.1068 140000.0 204.0781 61000.0 205.0859 140000.0 205.105 3200.0 208.0729 2600.0 213.0548 3500.0 217.086 110000.0 219.0653 37000.0 219.1017 98000.0 229.3311 2500.0 238.168 2600.0 241.7249 2800.0 243.2477 2400.0 263.3649 2600.0 267.1014 5400.0 267.678 2300.0 271.0965 340000.0 277.0857 2600.0 279.1011 4400.0 284.105 8700.0 290.0926 2300.0 291.1003 16000.0 293.1184 3100.0 296.1039 4300.0 296.2743 2700.0 297.1107 8300.0 303.1009 34000.0 308.1071 2400.0 309.1124 19000.0 312.063 2800.0 321.1124 93000.0 323.127 3300.0 333.1117 16000.0 337.1077 7700.0 339.1226 110000.0 343.5683 2900.0 348.6028 2500.0 351.1245 6100.0 369.1337 27000.0 376.5862 2400.0 378.6587 2500.0 END IONS BEGIN IONS SCANS=565 PEPMASS=282.0891 CHARGE=1 COLLISION_ENERGY=0.0 48.739 2100.0 53.3678 2400.0 56.3064 2600.0 57.0696 6400.0 58.6529 2500.0 61.2444 2400.0 61.8848 2400.0 62.0698 2300.0 62.6607 2300.0 63.3241 2400.0 64.5198 2600.0 65.0206 2800.0 69.0694 8800.0 72.8265 2300.0 76.617 2300.0 76.7344 2400.0 82.7582 2200.0 96.4754 2100.0 97.101 2600.0 102.3618 2400.0 106.3235 2400.0 108.3247 2300.0 109.3299 2100.0 113.6298 2400.0 113.8236 2300.0 114.9114 2500.0 120.1605 2200.0 121.4822 2800.0 131.9359 2300.0 134.096 88000.0 153.0696 93000.0 153.7134 2500.0 155.0851 3100.0 156.2124 2600.0 156.9629 2500.0 158.8916 2400.0 165.0702 5600.0 169.0647 3100.0 173.5245 26000.0 173.5371 63000.0 175.4448 2300.0 177.1238 2500.0 181.0646 260000.0 183.0808 11000.0 183.9686 2400.0 194.715 2700.0 197.0593 11000.0 203.5061 2600.0 207.8866 19000.0 209.0596 200000.0 210.0667 2400.0 211.0534 13000.0 211.0754 340000.0 211.0983 4000.0 211.135 27000.0 221.0597 120000.0 222.0662 8700.0 223.6247 2500.0 223.6746 2300.0 224.0465 31000.0 225.0544 36000.0 225.5755 2400.0 235.8822 3200.0 237.0546 9000.0 238.0625 140000.0 239.0701 1400000.0 244.9338 2200.0 249.0546 22000.0 267.0318 4600.0 267.0651 590000.0 267.0967 6500.0 273.0173 2500.0 281.3972 3300.0 282.0889 360000.0 282.2219 240000.0 END IONS BEGIN IONS SCANS=566 PEPMASS=393.1315 CHARGE=1 COLLISION_ENERGY=0.0 56.8152 2100.0 58.4466 2200.0 58.9179 2100.0 60.809 2200.0 62.6708 2400.0 62.8105 2300.0 67.3683 2400.0 70.9319 2500.0 73.4612 2300.0 75.3852 2500.0 79.0828 2900.0 80.6817 2200.0 81.0424 2200.0 89.3181 2500.0 118.9813 2300.0 119.4123 2300.0 120.0204 2500.0 125.1802 2900.0 126.7061 2700.0 128.563 2400.0 141.9415 2400.0 149.0231 15000.0 149.4453 2600.0 149.6871 7900.0 149.6957 3900.0 150.0264 12000.0 160.3044 2500.0 173.5295 36000.0 173.5385 18000.0 179.0058 2300.0 183.4441 2700.0 198.5214 2900.0 203.3902 2400.0 212.4758 2600.0 223.6416 2400.0 234.3411 2400.0 241.0804 2600.0 256.8571 2400.0 281.9948 2800.0 309.0718 2200.0 334.9219 2600.0 347.2818 2300.0 END IONS BEGIN IONS SCANS=567 PEPMASS=201.0913 CHARGE=1 COLLISION_ENERGY=0.0 41.0384 9000.0 41.5681 2100.0 43.0541 2500.0 49.9467 2300.0 50.6655 2200.0 51.9214 2100.0 54.5596 2300.0 55.054 5300.0 55.9341 110000.0 56.9346 36000.0 57.0696 12000.0 58.9774 2200.0 61.8077 2300.0 64.2483 2300.0 67.0539 12000.0 67.3483 2800.0 67.8082 2300.0 69.0696 14000.0 72.9369 24000.0 73.0278 2400.0 76.9333 3000.0 77.9332 4900.0 79.054 10000.0 81.0651 2700.0 81.0696 25000.0 85.7363 2300.0 86.938 2400.0 87.9919 2200.0 90.9473 29000.0 91.0539 16000.0 91.9475 6000.0 93.0696 18000.0 95.0852 16000.0 95.9094 2200.0 97.2368 2500.0 99.5828 2500.0 99.6333 2600.0 100.9911 2400.0 102.7276 2300.0 105.0696 49000.0 107.0853 21000.0 107.9499 9300.0 109.1011 4800.0 112.7226 2500.0 113.9626 2500.0 114.948 7200.0 114.9714 2900.0 115.0541 65000.0 115.9792 15000.0 116.0619 11000.0 117.0696 26000.0 118.9418 2900.0 118.9617 2400.0 119.0852 18000.0 119.7052 2500.0 120.1522 2600.0 121.1008 9300.0 128.0619 35000.0 128.9507 28000.0 129.0696 120000.0 129.9526 23000.0 130.0775 180000.0 131.0853 44000.0 131.974 49000.0 132.9585 5700.0 133.101 11000.0 135.9451 16000.0 136.9466 3000.0 137.9628 3200.0 139.8985 2400.0 140.0619 71000.0 141.0696 34000.0 143.0491 29000.0 143.0853 14000.0 144.0932 16000.0 145.101 110000.0 146.1093 5300.0 149.684 4500.0 149.6945 5400.0 149.9847 6400.0 155.0499 3700.0 156.057 32000.0 157.0647 810000.0 157.1012 15000.0 158.061 2200.0 158.0725 520000.0 158.0848 3000.0 158.1088 9100.0 159.1167 57000.0 162.6636 2800.0 164.6333 2600.0 171.0435 15000.0 171.1169 5800.0 172.0525 3500.0 173.1327 11000.0 173.5283 32000.0 173.5426 5500.0 185.0599 72000.0 186.0676 140000.0 186.1403 5300.0 188.5989 2400.0 190.7523 2800.0 201.0913 190000.0 201.1105 4100.0 201.1639 12000.0 202.0642 2600.0 END IONS BEGIN IONS SCANS=568 PEPMASS=323.1282 CHARGE=1 COLLISION_ENERGY=0.0 49.9263 2500.0 51.5673 2200.0 52.1535 2300.0 52.3444 2400.0 54.4615 2100.0 57.3441 2200.0 59.9646 2400.0 62.5811 2500.0 72.3462 2300.0 79.0539 11000.0 82.9731 2500.0 83.4841 2400.0 84.1746 2600.0 88.8694 2500.0 91.054 3700.0 95.0488 6300.0 95.4372 2300.0 111.1162 2600.0 115.3248 2400.0 127.7435 2600.0 131.0489 4800.0 133.0643 7400.0 135.0332 4500.0 135.0437 490000.0 135.054 9500.0 136.0516 55000.0 138.7193 3000.0 141.6537 2600.0 145.8242 2300.0 147.0435 8500.0 149.059 3800.0 150.1036 2200.0 151.0751 110000.0 157.0642 2800.0 158.0724 6700.0 161.0593 6000.0 173.5232 5600.0 173.5375 27000.0 185.0596 38000.0 186.0674 7100.0 201.0911 57000.0 203.0857 3300.0 205.1015 2800.0 218.0729 7500.0 219.0808 7600.0 231.08 5700.0 233.0959 39000.0 234.1041 36000.0 235.0747 3600.0 246.0693 2800.0 246.1031 5800.0 246.4661 2700.0 247.0753 14000.0 249.0911 11000.0 250.0993 9800.0 261.091 65000.0 262.0984 59000.0 263.0701 9700.0 263.1042 4200.0 265.0896 8100.0 265.1223 50000.0 267.0656 6300.0 275.0663 2600.0 276.078 8000.0 277.0858 24000.0 278.0938 22000.0 280.073 11000.0 282.0875 4500.0 285.7668 2600.0 290.092 2800.0 291.1017 18000.0 292.1098 160000.0 293.0807 33000.0 293.1177 33000.0 295.0969 47000.0 297.4461 2600.0 308.1047 97000.0 323.1282 24000.0 END IONS BEGIN IONS SCANS=569 PEPMASS=763.2727 CHARGE=1 COLLISION_ENERGY=0.0 76.5178 2200.0 77.1607 2800.0 83.9841 2400.0 92.4698 2500.0 93.2486 2500.0 94.4176 2500.0 96.0901 2500.0 100.2355 2400.0 100.7883 2500.0 102.0604 2200.0 104.5475 2500.0 122.6984 2900.0 132.293 2300.0 139.7861 2600.0 142.3534 2800.0 144.0563 2600.0 149.6821 3900.0 149.6924 4400.0 160.1606 2400.0 162.434 2500.0 173.522 14000.0 173.5362 78000.0 179.9712 2300.0 201.6233 2300.0 225.9035 2500.0 243.5724 2500.0 249.7516 2400.0 265.2819 2600.0 335.633 2500.0 347.6269 2600.0 358.3917 2400.0 376.5699 2500.0 393.1313 280000.0 427.0495 2600.0 484.4383 2900.0 610.662 2500.0 646.4857 3300.0 763.8313 2600.0 END IONS BEGIN IONS SCANS=570 PEPMASS=233.081 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76.856 2100.0 79.0537 2400.0 84.2889 2400.0 86.0961 4800.0 91.0535 4000.0 96.6313 2200.0 113.676 2300.0 116.7284 2400.0 117.1041 2400.0 120.2509 2300.0 129.0696 38000.0 129.2173 2600.0 133.8569 2500.0 135.0437 320000.0 135.0558 4200.0 136.0512 39000.0 143.0485 11000.0 149.0595 23000.0 151.0621 4300.0 151.075 200000.0 151.0889 3500.0 153.0898 3500.0 157.0645 56000.0 158.0721 10000.0 161.0592 15000.0 171.2559 2500.0 172.0882 21000.0 173.0595 46000.0 173.5033 2300.0 173.525 19000.0 173.5386 23000.0 174.0673 44000.0 177.0905 25000.0 187.0752 51000.0 188.0827 27000.0 189.0907 190000.0 192.5157 3100.0 203.1066 52000.0 207.543 3100.0 283.606 2500.0 292.6616 2400.0 294.119 3100.0 302.7157 2300.0 END IONS BEGIN IONS SCANS=572 PEPMASS=231.1018 CHARGE=1 COLLISION_ENERGY=0.0 46.34 2200.0 50.6543 2600.0 53.8429 2100.0 55.0176 12000.0 56.0628 2400.0 57.294 2300.0 58.0649 23000.0 59.0682 4500.0 62.0598 3900.0 64.0821 2300.0 76.9332 2500.0 79.4695 2400.0 79.9137 2600.0 81.0695 10000.0 86.8078 2500.0 87.375 2200.0 88.9942 2300.0 89.0143 2100.0 92.0278 2400.0 106.1956 2500.0 106.4823 2200.0 109.0639 3400.0 128.0618 20000.0 129.0697 37000.0 130.0773 4100.0 136.7559 2500.0 141.0691 3300.0 142.0777 8300.0 143.0851 25000.0 145.0644 32000.0 149.6763 3300.0 149.6857 11000.0 149.7052 3700.0 156.0562 16000.0 157.0644 94000.0 158.0724 76000.0 159.0803 26000.0 159.5065 2500.0 160.0883 5400.0 170.0725 31000.0 171.0801 23000.0 172.0882 150000.0 173.0596 150000.0 173.1753 2400.0 173.5302 30000.0 173.5396 3600.0 177.3859 2600.0 185.059 11000.0 186.0672 41000.0 187.0582 2500.0 187.0751 49000.0 188.083 160000.0 198.0678 2800.0 200.0822 4600.0 201.0558 13000.0 201.0907 100000.0 203.1065 29000.0 216.0777 17000.0 231.102 13000.0 231.1362 3200.0 END IONS BEGIN IONS SCANS=573 PEPMASS=335.1282 CHARGE=1 COLLISION_ENERGY=0.0 50.4201 2900.0 52.2129 2500.0 52.531 2500.0 53.4254 2200.0 53.6283 2500.0 55.3019 2800.0 57.357 2300.0 64.2941 2300.0 65.5829 2100.0 68.2069 2200.0 69.6223 2300.0 69.7663 2100.0 75.0437 90000.0 77.7792 2200.0 80.6761 2300.0 81.3214 2800.0 85.293 2500.0 89.3344 2500.0 91.0544 2700.0 92.4856 2600.0 95.4092 2700.0 98.0198 2200.0 100.3061 2700.0 102.7098 2300.0 102.9214 2300.0 104.9732 2300.0 112.4819 2300.0 113.4471 2300.0 116.2217 2300.0 118.4744 2400.0 125.1705 2300.0 133.5295 2200.0 135.0438 20000.0 147.0437 49000.0 150.8327 2700.0 151.075 24000.0 151.4331 2300.0 159.0439 6800.0 161.0598 11000.0 162.2013 2200.0 163.4137 2500.0 173.5193 16000.0 173.5338 130000.0 175.0758 3700.0 182.0708 3000.0 184.5555 2400.0 185.0591 19000.0 187.0753 5600.0 197.0588 7000.0 199.0751 220000.0 202.0783 38000.0 203.0854 45000.0 210.0908 3000.0 212.8633 4500.0 213.0911 42000.0 215.0858 57000.0 216.0935 7200.0 216.2051 2500.0 217.101 57000.0 219.0798 41000.0 230.0725 53000.0 230.8739 41000.0 231.0805 130000.0 232.0881 39000.0 233.0617 2500.0 233.0957 60000.0 234.1037 55000.0 236.082 2900.0 238.4736 2600.0 239.0713 9800.0 242.0722 13000.0 243.0802 56000.0 244.0882 35000.0 245.0704 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600.834 3600.0 681.1343 3400.0 702.9866 4000.0 END IONS BEGIN IONS SCANS=576 PEPMASS=488.0767 CHARGE=1 COLLISION_ENERGY=0.0 58.0955 2800.0 66.8461 2900.0 71.0566 2300.0 74.116 3100.0 74.5337 2500.0 76.1405 2600.0 83.8405 2200.0 84.1362 2300.0 85.9671 2700.0 96.065 2800.0 99.0572 2600.0 108.8932 2200.0 112.2301 2300.0 122.0362 3100.0 123.3552 2500.0 129.5008 2300.0 131.0488 74000.0 134.7534 2300.0 135.0437 99000.0 136.0504 2500.0 138.0675 20000.0 144.088 2400.0 145.0645 3300.0 148.0516 77000.0 149.023 190000.0 150.067 19000.0 151.0387 3000.0 151.075 86000.0 152.5051 2500.0 160.0518 15000.0 161.0594 110000.0 162.0667 2900.0 164.0831 86000.0 165.0544 180000.0 166.0989 20000.0 167.0687 3000.0 167.1501 2300.0 173.0595 3000.0 173.5249 31000.0 173.5401 52000.0 175.0762 7800.0 176.0829 32000.0 177.0552 13000.0 177.0909 140000.0 178.0623 37000.0 178.0988 6600.0 180.0774 3400.0 183.3623 2600.0 186.9447 2300.0 187.0755 11000.0 187.7981 2400.0 189.055 18000.0 189.0909 20000.0 191.0722 3200.0 191.1073 2400.0 192.0777 30000.0 193.0857 7300.0 193.306 2600.0 194.0937 51000.0 201.0542 3600.0 201.7891 2400.0 203.0709 7400.0 203.1064 34000.0 204.0781 9900.0 205.0857 17000.0 206.8407 2900.0 211.9758 3200.0 217.0867 6800.0 219.0652 20000.0 219.1021 11000.0 224.9574 2700.0 247.748 2500.0 260.2621 2500.0 271.0964 22000.0 279.5744 2700.0 281.9556 2500.0 290.6296 2400.0 310.1191 15000.0 316.1339 3000.0 321.1103 12000.0 333.7725 2700.0 338.1164 5600.0 339.1228 79000.0 340.2108 2900.0 369.1301 7800.0 373.5956 3000.0 387.8727 2500.0 410.1376 2400.0 475.0615 2600.0 END IONS BEGIN IONS SCANS=577 PEPMASS=219.1746 CHARGE=1 COLLISION_ENERGY=0.0 42.9097 2200.0 43.0177 86000.0 43.0541 7400.0 47.6929 2100.0 50.8636 2300.0 53.0385 9900.0 54.6675 2100.0 55.0174 2700.0 55.054 51000.0 57.0333 30000.0 57.0697 18000.0 58.194 2300.0 60.1425 2300.0 61.8255 2500.0 67.0539 49000.0 67.7646 2300.0 68.1278 2400.0 68.1573 2300.0 69.0333 14000.0 69.0696 440000.0 71.0487 150000.0 77.0387 3500.0 77.4452 2300.0 79.0539 71000.0 81.0696 100000.0 83.0488 15000.0 83.0851 20000.0 85.5278 2400.0 89.1706 2100.0 89.7861 2400.0 91.0539 98000.0 93.0695 350000.0 95.0488 22000.0 95.0852 52000.0 97.0643 16000.0 98.1563 2700.0 99.5638 2500.0 99.9779 2300.0 105.0443 2600.0 105.0695 140000.0 106.9663 2200.0 107.0773 3500.0 107.0852 160000.0 109.0645 19000.0 109.1008 54000.0 110.9431 2400.0 111.0798 3700.0 111.2281 2300.0 117.0696 27000.0 119.0852 120000.0 121.0646 15000.0 121.0922 3900.0 121.1009 140000.0 123.0805 6600.0 123.1165 28000.0 129.0696 5400.0 129.2448 2500.0 130.0775 9300.0 131.0853 48000.0 131.6152 2800.0 133.1009 61000.0 133.5393 2600.0 135.0802 13000.0 135.1167 22000.0 137.0591 3800.0 137.0957 3800.0 143.0851 5600.0 144.0922 2700.0 145.0648 9500.0 145.1009 90000.0 147.1172 4200.0 149.0958 42000.0 149.1322 92000.0 151.0748 2800.0 151.4933 2700.0 157.0643 7400.0 157.1011 6000.0 158.0723 19000.0 159.0439 9800.0 159.1166 62000.0 161.1322 77000.0 163.1115 54000.0 173.0596 7400.0 173.1321 6100.0 173.535 35000.0 173.5396 7200.0 174.0674 43000.0 175.1479 10000.0 177.1267 3100.0 181.5489 2500.0 184.1828 2300.0 188.0829 10000.0 189.0908 19000.0 201.0909 12000.0 201.1639 20000.0 203.1426 8100.0 219.1744 34000.0 END IONS BEGIN IONS SCANS=578 PEPMASS=302.1756 CHARGE=1 COLLISION_ENERGY=0.0 50.2052 2400.0 51.0233 11000.0 53.0385 16000.0 53.9806 2100.0 54.9604 2700.0 55.0177 250000.0 55.054 2600.0 56.0494 2200.0 57.0698 1900000.0 57.0727 5700.0 58.0651 6200.0 63.0394 3100.0 65.0386 3800.0 66.0463 81000.0 66.4981 2200.0 66.8852 2200.0 67.0541 300000.0 68.0619 850000.0 68.0656 3600.0 68.0665 6100.0 69.0697 22000.0 71.073 9700.0 71.4679 2400.0 72.0442 110000.0 72.0806 47000.0 74.0963 610000.0 75.5571 2400.0 77.0389 16000.0 79.0541 170000.0 80.3158 2300.0 81.0333 8200.0 81.0697 290000.0 81.6947 2400.0 82.065 5900.0 86.06 19000.0 86.0909 4600.0 86.0962 200000.0 87.1879 2600.0 90.6273 2500.0 94.0412 10000.0 95.049 93000.0 96.0443 63000.0 96.0807 19000.0 98.06 57000.0 99.0382 2400.0 100.0755 50000.0 102.0114 2300.0 102.0913 47000.0 103.0541 62000.0 104.6375 2500.0 104.7578 2400.0 105.0334 15000.0 105.044 2200.0 107.0492 32000.0 109.1901 2300.0 109.9572 2300.0 110.06 28000.0 111.068 29000.0 112.0756 63000.0 113.0837 3700.0 113.3662 2200.0 115.0542 37000.0 117.0697 6200.0 117.2087 2600.0 118.7189 2200.0 119.05 2300.0 123.044 160000.0 124.0755 94000.0 124.9677 2400.0 125.0834 30000.0 126.0912 16000.0 128.0622 63000.0 128.1069 180000.0 129.059 5100.0 129.0698 530000.0 129.0783 3000.0 129.0817 2800.0 131.0383 7200.0 131.049 450000.0 131.0609 2900.0 131.086 3800.0 133.0648 20000.0 133.7113 2400.0 135.0126 5800.0 135.0197 59000.0 135.0439 9900000.0 135.0536 49000.0 135.068 110000.0 135.0774 10000.0 137.0594 3300.0 139.099 14000.0 140.628 2300.0 142.1224 15000.0 143.049 110000.0 143.0855 140000.0 145.0646 65000.0 145.1011 19000.0 147.417 2700.0 147.9938 2500.0 149.0238 3300.0 149.0599 33000.0 152.1069 480000.0 152.1209 5400.0 153.0699 62000.0 154.1226 50000.0 155.0613 6600.0 155.0854 18000.0 157.0647 990000.0 159.044 100000.0 160.0518 38000.0 161.0437 5200.0 161.0597 570000.0 161.0754 3500.0 161.5641 2800.0 166.1227 23000.0 167.1137 5600.0 167.1304 690000.0 167.146 14000.0 169.0654 12000.0 171.0805 520000.0 172.0524 17000.0 173.0598 540000.0 173.0962 66000.0 173.5213 25000.0 173.5366 80000.0 175.0376 3100.0 175.0756 30000.0 180.1384 28000.0 181.0648 150000.0 183.0801 6100.0 184.8903 2600.0 185.045 2200.0 185.0597 360000.0 185.0789 5400.0 187.0362 9300.0 187.0451 6200.0 187.0558 4000.0 187.0754 4100000.0 187.0951 7900.0 187.1147 18000.0 189.091 14000.0 199.0753 240000.0 201.0548 120000.0 201.0911 340000.0 203.1077 9500.0 211.0756 110000.0 217.0857 6500.0 218.1283 2400.0 229.086 560000.0 236.5901 2500.0 272.0899 2500.0 302.1754 180000.0 END IONS BEGIN IONS SCANS=579 PEPMASS=731.2105 CHARGE=1 COLLISION_ENERGY=0.0 71.1596 2600.0 71.5777 2300.0 82.7433 2500.0 83.3424 2300.0 89.3388 2300.0 94.8337 2100.0 101.9433 2300.0 123.9065 2500.0 128.2958 2200.0 131.8024 2400.0 135.0432 4000.0 135.3118 2800.0 140.2057 3000.0 141.1878 2600.0 146.4109 2500.0 150.17 2600.0 151.4544 2400.0 159.2485 2300.0 172.1057 2500.0 173.5238 38000.0 173.5415 36000.0 173.5599 2600.0 174.0391 2300.0 176.9782 2800.0 218.4304 2300.0 253.2195 2500.0 299.2741 2300.0 377.0993 460000.0 377.1511 5200.0 550.9951 2700.0 END IONS BEGIN IONS SCANS=580 PEPMASS=377.1002 CHARGE=1 COLLISION_ENERGY=0.0 52.5857 2400.0 64.8625 2500.0 66.4661 2300.0 82.3327 2300.0 87.276 2500.0 87.7947 2200.0 87.9036 2100.0 93.3525 2200.0 103.843 2300.0 117.0936 2700.0 127.7168 2700.0 137.5672 2900.0 146.149 2400.0 151.7856 2500.0 152.2966 2300.0 161.6613 2400.0 164.1252 2200.0 173.5228 26000.0 173.5335 89000.0 173.5431 17000.0 183.7318 2600.0 216.1148 3000.0 253.4881 3200.0 284.9853 2300.0 314.3392 2300.0 325.7007 2500.0 363.4915 2800.0 377.098 8700.0 END IONS BEGIN IONS SCANS=581 PEPMASS=355.1176 CHARGE=1 COLLISION_ENERGY=0.0 51.0236 16000.0 53.0386 2800.0 54.0134 2200.0 60.5581 2500.0 61.7919 2300.0 63.0238 2900.0 64.812 2500.0 66.5046 2100.0 73.0284 2500.0 73.0986 2200.0 77.0389 51000.0 78.0464 27000.0 79.0495 4800.0 79.054 99000.0 79.9844 2400.0 80.5396 2500.0 91.0542 9100.0 93.8871 2300.0 95.0491 64000.0 95.114 2300.0 97.5404 2400.0 103.0541 260000.0 105.0333 39000.0 105.0446 23000.0 105.4889 2900.0 106.0411 14000.0 107.0491 89000.0 113.9639 3700.0 115.0544 16000.0 117.0691 3200.0 119.0491 58000.0 123.0437 5300.0 129.0699 46000.0 131.0262 6800.0 131.0491 3000000.0 131.0602 31000.0 131.0724 8800.0 131.0854 4000.0 132.0532 41000.0 133.0646 48000.0 134.0365 35000.0 134.999 3800.0 135.0127 11000.0 135.0197 97000.0 135.0249 32000.0 135.044 16000000.0 135.0539 50000.0 135.0634 34000.0 135.0676 200000.0 135.0772 33000.0 135.0815 8200.0 136.0482 300000.0 137.0557 83000.0 142.3143 2700.0 143.0491 33000.0 144.0524 3700.0 145.0648 19000.0 146.0367 8000.0 146.0687 2400.0 147.044 180000.0 148.0518 17000.0 149.0234 87000.0 149.0363 3300.0 149.0596 270000.0 151.0393 2900.0 151.6838 2600.0 157.0648 120000.0 159.0442 68000.0 159.6097 2600.0 160.0518 23000.0 160.3651 2300.0 161.0597 1400000.0 161.0716 3700.0 161.0753 11000.0 162.0655 30000.0 162.1607 3200.0 163.0389 130000.0 163.0713 20000.0 165.0547 5000.0 167.032 2700.0 173.0599 480000.0 173.0766 4400.0 173.5296 70000.0 173.5441 5400.0 174.0635 100000.0 175.039 89000.0 175.0762 3200.0 176.047 230000.0 177.0547 150000.0 183.5581 2400.0 185.0602 32000.0 187.0755 210000.0 188.0795 10000.0 189.0547 150000.0 189.0722 4500.0 192.0415 12000.0 193.0455 18000.0 197.0595 23000.0 201.0547 47000.0 202.0608 11000.0 202.0784 2700.0 203.0857 320000.0 205.1018 3900.0 207.0607 3100.0 214.8733 20000.0 215.0706 120000.0 217.0487 2900.0 218.0578 36000.0 218.8683 21000.0 219.0615 31000.0 220.205 2800.0 221.0957 45000.0 231.0535 14000.0 231.0806 660000.0 231.1073 9400.0 233.0974 11000.0 235.0751 3600.0 241.0653 4300.0 242.8684 2800.0 246.0667 4200.0 247.0759 9900.0 249.0912 57000.0 251.1067 3000.0 258.8625 5200.0 259.0754 250000.0 260.0829 3200.0 261.091 1200000.0 261.1234 14000.0 271.0757 51000.0 274.0616 2300.0 276.1136 2300.0 277.086 7900.0 279.1012 29000.0 288.0777 4600.0 289.0471 2800.0 289.0863 790000.0 289.1169 3400.0 290.8881 6500.0 304.0741 5700.0 307.0943 7500.0 308.9004 74000.0 319.0969 140000.0 330.6013 2600.0 337.1072 34000.0 340.0949 9900.0 355.1179 69000.0 END IONS BEGIN IONS SCANS=582 PEPMASS=337.1076 CHARGE=1 COLLISION_ENERGY=0.0 81.9063 3200.0 88.8872 2200.0 89.9419 2200.0 98.7078 2400.0 103.0539 31000.0 104.4507 2700.0 107.0489 10000.0 110.5061 2800.0 112.4717 2300.0 119.049 4600.0 129.5287 2500.0 131.0488 410000.0 131.0577 4500.0 133.0648 4300.0 135.0437 170000.0 135.0558 3200.0 147.0437 25000.0 149.0591 11000.0 159.0429 3000.0 161.0442 4800.0 161.0594 220000.0 163.0389 19000.0 173.0594 5600.0 173.5252 24000.0 173.5439 11000.0 175.0388 15000.0 176.0466 38000.0 177.0544 28000.0 187.0742 3200.0 189.0547 5500.0 203.0852 19000.0 231.08 46000.0 240.0097 2400.0 249.0897 4000.0 258.4724 2200.0 259.0746 17000.0 261.0903 130000.0 261.8389 2500.0 268.4039 2300.0 268.4379 2700.0 279.1013 3900.0 289.0858 110000.0 293.3932 2500.0 307.0948 3000.0 319.0958 31000.0 337.1069 22000.0 END IONS BEGIN IONS SCANS=583 PEPMASS=237.1851 CHARGE=1 COLLISION_ENERGY=0.0 43.0177 94000.0 51.9399 9800.0 55.0178 2800.0 55.054 43000.0 55.9342 21000.0 56.0494 12000.0 57.0331 2700.0 57.0698 23000.0 59.049 11000.0 59.5154 2200.0 64.0322 2400.0 64.4562 2400.0 67.0539 28000.0 69.0333 8900.0 69.0696 69000.0 71.0488 220000.0 73.8409 2900.0 79.0541 19000.0 81.0696 94000.0 81.5711 2400.0 83.0489 24000.0 83.0853 34000.0 83.2657 2400.0 84.1174 2300.0 85.0644 19000.0 91.0541 13000.0 93.0695 78000.0 95.0491 5400.0 95.0852 120000.0 97.0645 18000.0 97.1007 2600.0 99.0437 41000.0 100.6848 2700.0 101.0595 6600.0 101.7968 2900.0 105.0697 53000.0 107.0852 87000.0 109.0646 25000.0 109.1009 68000.0 111.0801 26000.0 119.0852 77000.0 121.1008 72000.0 123.0801 62000.0 123.1165 44000.0 123.7116 2400.0 126.9721 2700.0 131.0856 2900.0 131.951 2800.0 133.101 29000.0 135.1167 32000.0 135.7165 2700.0 137.0954 12000.0 137.1323 14000.0 141.5834 2400.0 145.101 14000.0 147.7081 2500.0 149.0962 2800.0 149.1322 12000.0 151.1114 240000.0 151.1483 8900.0 159.1167 31000.0 161.1323 78000.0 163.1094 2600.0 163.3782 2400.0 167.1429 49000.0 169.9336 6200.0 173.5232 20000.0 173.5411 24000.0 175.1501 2600.0 179.1429 300000.0 183.912 5400.0 185.9288 2400.0 194.3974 3100.0 201.1642 2900.0 217.6479 2400.0 239.4211 3100.0 242.5972 2300.0 END IONS BEGIN IONS SCANS=584 PEPMASS=354.1099 CHARGE=1 COLLISION_ENERGY=0.0 77.0388 4100.0 78.0414 5400.0 78.0463 100000.0 78.0509 2100.0 78.3582 2500.0 79.0541 12000.0 91.0541 3000.0 95.049 8300.0 103.0541 42000.0 104.0619 28000.0 105.0334 5700.0 106.0335 4800.0 106.0412 79000.0 107.0493 4700.0 115.0542 14000.0 117.0696 16000.0 119.0489 12000.0 122.0361 10000.0 124.0517 27000.0 130.0412 16000.0 131.049 280000.0 131.0578 4800.0 132.0467 3600.0 132.0567 46000.0 132.708 2800.0 133.0648 3900.0 135.0196 15000.0 135.0439 2400000.0 135.0632 18000.0 135.068 19000.0 135.0748 7100.0 136.0517 600000.0 137.0598 3200.0 143.0489 47000.0 144.057 6900.0 145.0648 11000.0 146.037 2500.0 147.0442 9600.0 148.0517 74000.0 149.0595 38000.0 151.039 5600.0 157.0647 7300.0 159.0439 8300.0 160.0192 2300.0 160.0517 110000.0 161.0441 4100.0 161.0595 120000.0 161.1881 2400.0 162.0674 150000.0 162.083 4500.0 163.0382 2800.0 171.0446 5000.0 172.052 7100.0 173.0596 510000.0 173.5203 5800.0 173.5383 12000.0 174.0671 12000.0 175.0387 13000.0 176.0458 2500.0 177.0541 7300.0 186.0673 15000.0 187.0753 59000.0 187.9504 2700.0 188.0464 8200.0 188.083 3700.0 189.0545 20000.0 191.0339 9600.0 191.0699 7800.0 192.0415 99000.0 201.0544 34000.0 205.0494 20000.0 206.0571 26000.0 218.0573 110000.0 219.0651 25000.0 232.0719 7300.0 252.0783 3700.0 253.0806 4500.0 281.0803 3400.0 283.0922 6500.0 305.1115 3700.0 326.0882 2800.0 END IONS BEGIN IONS SCANS=585 PEPMASS=337.1075 CHARGE=1 COLLISION_ENERGY=0.0 50.016 2200.0 51.0232 6100.0 51.8158 2300.0 52.513 2200.0 53.0386 11000.0 53.6885 2200.0 54.4409 2300.0 55.0178 22000.0 60.3941 2400.0 62.4067 2200.0 63.2798 2100.0 65.0384 9700.0 65.2743 2200.0 67.829 2600.0 67.8582 2500.0 69.4373 2100.0 71.049 360000.0 73.4173 2500.0 77.0387 20000.0 79.0541 100000.0 79.0901 2200.0 84.1155 3200.0 84.9319 2400.0 88.5783 2500.0 91.0542 43000.0 93.0334 12000.0 93.1611 2600.0 93.6506 2600.0 95.049 41000.0 95.4043 2300.0 100.536 2500.0 102.3665 2200.0 103.0541 160000.0 105.0334 26000.0 105.0445 9500.0 107.0491 76000.0 111.0439 52000.0 112.1137 2300.0 115.0542 47000.0 116.9828 2300.0 117.0698 34000.0 119.049 88000.0 123.0439 60000.0 124.4799 2400.0 125.6146 2600.0 127.0553 6200.0 128.0622 18000.0 129.0698 520000.0 131.0261 3100.0 131.0491 2100000.0 131.0668 5700.0 131.0724 8800.0 131.0854 24000.0 132.0574 2900.0 133.0283 160000.0 133.0646 29000.0 134.4385 2700.0 135.0316 3100.0 135.044 5900000.0 135.0559 3000.0 135.068 25000.0 137.0595 12000.0 139.0547 11000.0 143.0491 86000.0 145.0647 57000.0 146.0362 7400.0 147.044 300000.0 149.0233 110000.0 149.0327 2200.0 149.0459 6500.0 149.0596 460000.0 149.0699 2100.0 149.2235 2200.0 151.0389 95000.0 153.0697 33000.0 153.633 2800.0 155.0486 7400.0 155.084 2700.0 155.1261 2400.0 157.0526 2600.0 157.0648 620000.0 157.0762 2300.0 159.044 110000.0 159.0806 2500.0 160.4658 2400.0 161.0438 4600.0 161.0596 1200000.0 163.039 220000.0 165.0549 25000.0 165.0706 2500.0 167.0494 40000.0 172.0521 38000.0 173.0598 710000.0 173.0768 4300.0 173.5274 70000.0 173.5388 31000.0 173.5431 5400.0 174.0677 82000.0 175.039 270000.0 175.0756 89000.0 176.0469 190000.0 176.0647 4100.0 177.0548 290000.0 178.0818 2700.0 181.065 45000.0 182.87 2800.0 185.0398 5500.0 185.0598 2200000.0 185.079 5000.0 185.0987 3600.0 187.0575 8900.0 187.0755 710000.0 187.095 12000.0 189.0545 94000.0 189.071 4000.0 190.0782 16000.0 191.0856 75000.0 191.1458 2600.0 192.9121 2300.0 193.1013 27000.0 196.0269 2400.0 197.0597 380000.0 201.054 20000.0 201.0736 2800.0 202.0789 56000.0 203.0664 3200.0 203.0856 980000.0 203.1061 6800.0 205.0653 35000.0 205.1012 61000.0 206.0729 3200.0 206.8045 2600.0 207.0815 8200.0 209.0598 780000.0 210.0674 6200.0 211.0757 65000.0 211.3966 2400.0 213.0714 13000.0 215.0465 16000.0 215.0704 700000.0 215.0918 9800.0 217.0641 2700.0 218.0726 45000.0 219.056 3400.0 219.0806 470000.0 221.0599 6100.0 221.0963 130000.0 222.0685 18000.0 223.0756 47000.0 225.0548 77000.0 231.0537 9300.0 231.0805 1900000.0 231.1076 12000.0 231.2829 2600.0 232.8688 11000.0 233.06 50000.0 233.0962 130000.0 233.6464 2600.0 234.068 17000.0 235.0754 200000.0 237.0258 4100.0 237.0547 930000.0 237.095 6300.0 238.0625 17000.0 239.0705 70000.0 241.065 24000.0 242.0736 3300.0 243.0803 36000.0 246.0676 280000.0 247.0754 370000.0 247.1035 9500.0 248.0829 31000.0 248.3305 2700.0 249.0603 16000.0 249.0911 830000.0 249.1206 11000.0 250.6301 2600.0 251.07 47000.0 251.1064 68000.0 253.0498 30000.0 258.0674 2500.0 259.0753 650000.0 259.1065 8900.0 260.0836 32000.0 261.0611 20000.0 261.0908 2900000.0 261.1239 11000.0 262.0624 220000.0 262.0939 2400.0 263.0703 160000.0 263.1062 96000.0 264.079 13000.0 265.0508 3700.0 265.0847 13000.0 266.0234 16000.0 266.0574 1900000.0 266.0899 5800.0 267.0651 1600000.0 267.0986 5500.0 271.0755 100000.0 272.0832 15000.0 273.0909 50000.0 274.0625 390000.0 275.0017 3000.0 275.0704 33000.0 276.0782 75000.0 277.0861 970000.0 279.0282 3200.0 279.0655 770000.0 279.1006 120000.0 280.0735 55000.0 280.4632 2300.0 281.0804 30000.0 288.0774 24000.0 289.047 5100.0 289.0574 11000.0 289.0861 3300000.0 290.0577 110000.0 290.0928 12000.0 291.0654 120000.0 291.1016 32000.0 292.0733 110000.0 293.081 190000.0 294.0899 8800.0 295.0654 2900.0 299.1973 2500.0 303.0654 160000.0 304.0732 450000.0 305.0793 2700.0 306.0887 40000.0 307.0968 120000.0 309.1118 19000.0 317.079 4000.0 319.0966 450000.0 322.0477 6600.0 337.0669 3500.0 337.1072 130000.0 341.9952 2600.0 END IONS BEGIN IONS SCANS=586 PEPMASS=319.097 CHARGE=1 COLLISION_ENERGY=0.0 51.5691 2300.0 62.9157 2100.0 64.187 2200.0 66.7276 2400.0 74.7658 2700.0 83.0697 2200.0 103.1584 2600.0 108.2978 2600.0 109.3777 2700.0 135.0439 13000.0 147.0441 3700.0 150.2462 2300.0 163.0708 3700.0 173.5265 15000.0 173.5414 7500.0 179.0661 3000.0 190.0615 19000.0 191.0333 2400.0 191.0658 37000.0 192.0374 5700.0 192.0751 3300.0 193.0856 14000.0 194.0891 25000.0 202.079 3900.0 203.0853 69000.0 205.1008 10000.0 206.0574 5500.0 207.0609 12000.0 215.0858 6400.0 218.0727 4300.0 219.0799 2800.0 221.0808 41000.0 222.0842 89000.0 225.9976 2600.0 231.0804 140000.0 233.0962 19000.0 235.0752 24000.0 241.519 2600.0 245.4857 2400.0 246.0672 25000.0 247.076 3700.0 248.0839 3700.0 259.0752 36000.0 261.0583 5200.0 261.0907 160000.0 261.2159 2300.0 263.0744 5100.0 263.1064 32000.0 271.0765 4400.0 273.0906 11000.0 274.0623 32000.0 276.0784 2700.0 284.4814 2600.0 289.0861 140000.0 289.1219 3100.0 290.0577 25000.0 291.0651 26000.0 291.1008 11000.0 293.8459 2300.0 303.0651 25000.0 304.0731 33000.0 319.0965 45000.0 319.1336 2500.0 END IONS BEGIN IONS SCANS=587 PEPMASS=353.1023 CHARGE=1 COLLISION_ENERGY=0.0 54.9983 2100.0 56.7325 2300.0 67.5334 2100.0 77.0385 2300.0 79.0538 2400.0 86.3703 2800.0 96.5419 2400.0 117.0695 3700.0 117.8545 2500.0 135.0437 920000.0 135.0527 15000.0 136.0527 3100.0 139.0018 2600.0 143.0489 22000.0 149.023 100000.0 149.0367 2700.0 149.6855 4700.0 149.6955 3800.0 151.0748 18000.0 157.0645 2900.0 173.0596 41000.0 173.5251 4600.0 173.5376 4600.0 177.0932 2400.0 187.0751 3900.0 188.0829 11000.0 189.0917 2600.0 201.055 16000.0 201.0909 32000.0 203.0706 15000.0 203.1064 11000.0 231.102 9700.0 246.1037 3000.0 252.0777 21000.0 260.9713 2400.0 267.0654 8700.0 268.0728 18000.0 273.0902 3200.0 274.0989 4500.0 277.1218 9100.0 282.089 29000.0 283.0968 9800.0 289.086 9500.0 290.094 8000.0 292.1097 7800.0 293.1168 4800.0 295.0959 6500.0 303.1031 5700.0 304.1098 21000.0 305.0804 8200.0 305.1161 10000.0 308.1046 14000.0 320.1045 6900.0 323.0904 13000.0 353.102 3300.0 END IONS BEGIN IONS SCANS=588 PEPMASS=257.115 CHARGE=1 COLLISION_ENERGY=0.0 45.9153 2100.0 45.9683 2300.0 47.4723 2400.0 47.8131 2600.0 48.154 2300.0 49.3306 2400.0 49.4842 2100.0 50.3143 2200.0 50.3232 2200.0 50.6167 2400.0 51.088 2300.0 51.2938 2200.0 52.5852 2100.0 52.8698 2300.0 54.3412 2300.0 55.1663 2300.0 56.0876 2500.0 56.1703 2100.0 56.3955 2500.0 59.2415 2800.0 59.8707 2100.0 60.4795 2400.0 60.7311 2600.0 60.8334 2300.0 61.4622 2300.0 61.6807 2300.0 63.2371 2100.0 65.9281 2700.0 66.1473 2200.0 66.7638 2200.0 67.7939 2500.0 69.4894 2700.0 69.8553 2700.0 71.7129 2000.0 73.028 8500.0 73.1078 2200.0 73.7255 2300.0 73.8392 2300.0 76.5023 2200.0 76.9608 2600.0 77.4736 2200.0 77.5565 2200.0 80.9225 2400.0 82.0742 2800.0 82.7852 2500.0 83.0509 2200.0 83.8404 2400.0 92.5441 2600.0 93.1947 2300.0 93.8061 2700.0 95.3515 2400.0 96.2966 2200.0 103.0471 2400.0 103.4939 2800.0 104.2158 2500.0 106.7067 2300.0 109.1022 2300.0 110.2026 2600.0 110.5622 2500.0 115.6469 2400.0 119.2913 2400.0 127.4047 3100.0 130.8733 2200.0 132.2076 2300.0 135.1766 2900.0 146.9007 2700.0 147.6447 2700.0 149.9291 2800.0 151.6771 2200.0 152.671 2200.0 153.6455 2200.0 159.9459 2700.0 166.0191 2300.0 169.4611 2300.0 171.0858 2500.0 171.8957 2400.0 173.5287 150000.0 173.5429 26000.0 181.3611 2400.0 189.3435 2400.0 193.483 2400.0 204.2329 2700.0 205.8809 11000.0 207.2336 2300.0 209.86 2600.0 211.1134 2600.0 214.9753 2800.0 215.0393 2300.0 221.4903 2300.0 222.4696 2700.0 230.2893 2500.0 230.9701 2500.0 239.1054 6200.0 242.2967 2200.0 256.6807 2100.0 257.1149 24000.0 257.1513 11000.0 257.2652 4000.0 END IONS BEGIN IONS SCANS=589 PEPMASS=235.1332 CHARGE=1 COLLISION_ENERGY=0.0 43.0177 130000.0 44.4674 2800.0 46.3614 2600.0 48.042 2200.0 49.3735 2800.0 55.0176 4200.0 55.054 57000.0 55.4507 2500.0 56.485 2500.0 57.0332 8500.0 57.0698 4100000.0 57.073 14000.0 57.0746 7800.0 57.0764 6700.0 59.049 2900.0 59.263 2500.0 60.2128 2500.0 60.4482 2200.0 60.6886 2200.0 60.8507 2400.0 64.0436 2100.0 65.8443 2300.0 67.0541 4300.0 67.3144 2500.0 67.5494 2400.0 69.0333 2800.0 69.0695 7400.0 73.0281 89000.0 74.0315 16000.0 77.3142 2500.0 79.0538 29000.0 80.5041 2700.0 80.9819 2500.0 81.0696 12000.0 82.681 2200.0 83.0487 22000.0 84.4789 2100.0 86.019 2300.0 87.4038 2300.0 91.054 24000.0 91.5623 2200.0 93.0697 49000.0 94.5798 2300.0 94.795 2100.0 95.0489 15000.0 95.0855 17000.0 96.0532 2700.0 97.0648 2900.0 99.0434 2500.0 99.7592 2300.0 103.1818 2300.0 103.9727 2300.0 105.0697 58000.0 105.5589 2200.0 105.6996 2200.0 106.5182 2900.0 107.0488 22000.0 107.0854 23000.0 107.3237 2300.0 108.7492 2700.0 109.0647 13000.0 109.8068 2400.0 111.0799 31000.0 113.4778 2300.0 114.1008 2200.0 118.6914 2600.0 119.0851 51000.0 119.3531 2100.0 121.0645 32000.0 121.1009 34000.0 123.0437 240000.0 123.0803 20000.0 124.6695 2200.0 125.0052 2600.0 130.2565 2400.0 131.0856 2500.0 131.2183 2500.0 133.0646 61000.0 133.1009 15000.0 135.4389 2500.0 135.8453 2500.0 137.0598 9500.0 137.0958 17000.0 139.0447 2200.0 141.0542 2800.0 145.0643 2600.0 145.1011 2700.0 145.5687 2400.0 147.0803 66000.0 149.0961 31000.0 149.1313 2300.0 150.2971 2700.0 151.0752 310000.0 152.0789 16000.0 153.0802 22000.0 153.4896 2600.0 154.8222 2700.0 159.08 14000.0 159.5337 2200.0 161.0361 2800.0 161.0456 4100.0 161.0595 480000.0 161.096 23000.0 161.1327 15000.0 162.0674 180000.0 163.0754 6400.0 165.0908 31000.0 165.8491 2400.0 166.6477 2500.0 169.7906 2400.0 171.1164 4900.0 173.0958 6800.0 173.5267 54000.0 173.5375 88000.0 174.104 27000.0 175.0754 120000.0 175.1119 49000.0 176.6663 2200.0 177.0924 3100.0 179.0702 580000.0 179.1069 48000.0 179.1427 3600.0 180.0779 110000.0 181.0251 2500.0 189.0917 9200.0 189.1273 120000.0 189.7831 2300.0 193.0857 24000.0 193.1212 5600.0 199.1131 3000.0 202.0987 30000.0 207.137 8200.0 208.2127 2100.0 215.3935 2700.0 217.1224 38000.0 218.0522 2300.0 235.133 22000.0 235.1693 24000.0 235.2053 7200.0 235.6279 2300.0 236.5941 2300.0 238.701 2700.0 242.5287 2500.0 243.3119 2500.0 END IONS BEGIN IONS SCANS=590 PEPMASS=353.2689 CHARGE=1 COLLISION_ENERGY=0.0 51.158 2500.0 53.9382 2000.0 55.0179 2000.0 55.054 47000.0 57.0332 36000.0 57.0697 24000.0 65.0383 2900.0 67.0539 340000.0 69.0696 64000.0 71.0489 11000.0 71.0854 8400.0 75.0436 3000.0 77.3159 2200.0 79.0539 140000.0 80.2231 2400.0 80.2588 2200.0 81.0696 460000.0 81.0777 3300.0 83.0488 5900.0 83.0851 48000.0 85.0645 15000.0 91.054 60000.0 91.9528 2100.0 93.0695 240000.0 93.0766 3700.0 95.0493 2500.0 95.0852 390000.0 97.0644 17000.0 97.1011 15000.0 99.0801 5600.0 105.0695 61000.0 107.0773 4500.0 107.0852 200000.0 109.0646 9800.0 109.0928 4200.0 109.1008 230000.0 110.0984 2500.0 111.0801 11000.0 114.0799 2200.0 117.0694 35000.0 118.2054 2300.0 119.0852 70000.0 121.1008 200000.0 123.0801 3300.0 123.1165 110000.0 126.1464 2800.0 131.0852 96000.0 132.7263 2400.0 133.0921 2800.0 133.1009 75000.0 135.0437 54000.0 135.0797 2300.0 135.1165 170000.0 137.096 5300.0 137.1322 27000.0 139.112 3900.0 144.6595 2800.0 145.101 73000.0 147.1165 69000.0 149.1322 110000.0 151.0751 16000.0 151.1108 3200.0 151.1481 4600.0 157.0638 2600.0 159.1166 72000.0 161.1321 53000.0 163.148 57000.0 173.0598 3000.0 173.1325 74000.0 173.5221 15000.0 173.5354 48000.0 175.148 15000.0 177.1275 2700.0 177.1639 17000.0 184.2542 2600.0 187.1479 42000.0 189.162 2500.0 199.0761 2900.0 201.0911 25000.0 201.1636 10000.0 205.1574 2500.0 210.7473 2500.0 224.7777 2400.0 231.0985 3800.0 233.2267 10000.0 243.2104 43000.0 246.1033 2700.0 252.0785 18000.0 253.1242 2900.0 261.2211 120000.0 267.0651 7400.0 268.073 12000.0 277.1227 2900.0 282.0893 17000.0 283.0955 4300.0 289.0867 6600.0 295.0956 10000.0 304.1092 17000.0 305.1168 3400.0 320.1027 5800.0 335.2583 2600.0 END IONS BEGIN IONS SCANS=591 PEPMASS=694.4012 CHARGE=1 COLLISION_ENERGY=0.0 67.05 3800.0 67.0541 240000.0 67.3027 2100.0 69.0334 11000.0 69.0697 43000.0 71.049 15000.0 71.0855 7600.0 73.0282 44000.0 75.044 7300.0 79.0493 4800.0 79.0541 110000.0 81.0333 3800.0 81.0697 440000.0 83.0242 2400.0 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6300.0 309.2219 12000.0 311.2014 17000.0 312.2085 45000.0 313.2181 4300.0 317.1859 2900.0 325.2168 3400.0 331.2063 6400.0 333.2221 10000.0 337.215 3200.0 349.2162 19000.0 351.2337 7400.0 352.2404 14000.0 359.2361 3800.0 364.2405 36000.0 365.2481 8600.0 373.2505 7800.0 376.0547 2400.0 377.2464 12000.0 378.2538 3000.0 391.2675 3800.0 402.1107 3000.0 449.3085 6400.0 453.8662 2400.0 471.3291 6500.0 489.3352 15000.0 507.3471 140000.0 509.1846 2900.0 556.4135 2500.0 564.5301 2600.0 581.3879 2600.0 599.4104 53000.0 END IONS BEGIN IONS SCANS=594 PEPMASS=518.3245 CHARGE=1 COLLISION_ENERGY=0.0 60.0804 72000.0 61.9199 2200.0 63.4553 2300.0 64.2335 2800.0 71.0726 6100.0 72.6523 2400.0 76.7497 2200.0 76.7766 2600.0 82.3125 2500.0 82.8902 2500.0 86.096 380000.0 95.085 2500.0 98.9842 5900.0 104.1065 63000.0 108.1634 2600.0 124.5662 2700.0 124.9995 170000.0 125.3699 2500.0 155.3001 2400.0 159.9473 2400.0 165.7 2800.0 173.5209 18000.0 173.534 97000.0 173.5419 9400.0 173.7021 2200.0 183.8137 2600.0 184.0351 18000.0 184.0733 3800000.0 184.103 4900.0 184.1107 5700.0 184.1701 2600.0 195.4713 2400.0 203.4951 2500.0 212.3172 2300.0 214.4784 2100.0 218.9747 2200.0 234.616 2700.0 304.5765 2400.0 316.2156 2400.0 329.7106 2700.0 335.2576 9500.0 360.2928 2300.0 474.2836 2400.0 500.3162 6100.0 523.5347 2800.0 END IONS BEGIN IONS SCANS=595 PEPMASS=398.1758 CHARGE=1 COLLISION_ENERGY=0.0 60.683 2100.0 63.0235 2800.0 64.922 2100.0 66.3912 2600.0 66.5929 2300.0 77.0389 18000.0 80.8175 2100.0 82.0884 2300.0 91.0535 5900.0 95.0488 24000.0 100.3465 2500.0 102.0464 3600.0 102.7401 2400.0 103.0539 840000.0 103.0618 11000.0 103.0705 2900.0 105.0332 9900.0 105.0447 8700.0 105.0697 10000.0 115.9638 12000.0 129.5988 2500.0 131.0365 12000.0 131.0488 7400000.0 131.0609 120000.0 131.0687 72000.0 131.0737 43000.0 131.0788 14000.0 148.0755 11000.0 173.5249 11000.0 173.5342 19000.0 173.5441 5700.0 174.0916 17000.0 191.0854 230000.0 191.1058 5200.0 205.0645 3900.0 205.1014 3300.0 206.0963 12000.0 207.0806 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148.6614 2200.0 149.2744 2700.0 149.3624 2600.0 149.6886 46000.0 149.7513 2900.0 149.7747 4700.0 151.1131 4900.0 152.7621 2600.0 153.4413 2900.0 153.4622 2600.0 154.0868 2900.0 154.4245 2400.0 154.5047 3000.0 154.6857 2600.0 155.1027 2400.0 155.5502 2500.0 155.6146 2700.0 155.8361 2600.0 156.12 310000.0 157.1033 2600.0 157.3373 2300.0 158.0621 2600.0 159.1379 2500.0 159.4736 2300.0 159.6638 2200.0 160.2652 2400.0 161.3462 2500.0 161.6281 2300.0 163.2483 2400.0 164.7636 2300.0 165.6225 2800.0 166.4516 2700.0 168.683 2500.0 171.1045 12000.0 171.1197 4700000.0 171.5303 2500.0 171.5863 2500.0 172.5585 2700.0 172.779 2900.0 173.2243 2300.0 173.5051 2800.0 173.5226 58000.0 173.5311 980000.0 173.5413 200000.0 173.9363 2400.0 174.5925 2400.0 174.666 2500.0 174.7063 2600.0 175.4892 2800.0 176.9658 2700.0 178.5775 2400.0 178.9971 2400.0 179.4331 2300.0 181.2516 2500.0 181.4239 2800.0 181.4551 2600.0 181.7767 2500.0 181.8515 2400.0 182.5751 2200.0 183.0041 2500.0 183.6853 2700.0 183.9302 2300.0 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2300.0 241.6144 2500.0 242.5732 2700.0 244.5068 2300.0 244.6277 2700.0 246.8703 2400.0 247.3424 2300.0 247.4389 2500.0 248.5038 2800.0 248.5459 2500.0 249.3297 2500.0 249.5053 2600.0 249.6656 2600.0 249.9931 2500.0 250.895 2300.0 250.9384 2400.0 252.0308 2500.0 257.0433 2500.0 257.8768 44000.0 258.8232 2600.0 259.2683 2400.0 261.4128 2600.0 262.55 2800.0 263.8472 2300.0 268.058 2600.0 268.0963 2200.0 268.7679 2600.0 269.8347 2800.0 270.0013 2200.0 272.1714 2500.0 274.2411 2600.0 274.9742 2400.0 275.8772 2500.0 276.207 2400.0 277.235 2200.0 277.6232 3100.0 279.3319 2500.0 279.488 2400.0 279.5427 2200.0 279.6365 2800.0 280.3845 3100.0 281.075 2500.0 284.5066 2700.0 285.2954 2600.0 285.8541 24000.0 286.821 2300.0 290.059 3000.0 290.5071 2500.0 290.6596 2400.0 293.0753 2400.0 293.3395 2600.0 296.2132 2400.0 296.4807 2700.0 297.901 2500.0 300.0857 2200.0 300.8087 2400.0 301.2012 2800.0 303.6741 2600.0 308.8664 12000.0 309.0964 2600.0 311.2056 2400.0 319.5931 2400.0 320.3986 2400.0 320.7358 2700.0 321.4904 2400.0 323.2941 2900.0 323.3368 2600.0 325.4007 2600.0 326.9865 2100.0 327.5533 2600.0 327.5681 3000.0 327.6856 2500.0 328.3119 2500.0 329.1792 2600.0 329.8425 2500.0 331.9803 2400.0 332.7671 2600.0 334.4041 2900.0 335.4877 2900.0 335.5607 2300.0 335.7388 2500.0 337.3741 3000.0 340.0941 2800.0 343.8904 2700.0 349.2422 2700.0 350.1245 2500.0 352.4677 2500.0 357.3807 2300.0 358.584 2500.0 360.4021 2400.0 END IONS BEGIN IONS SCANS=597 PEPMASS=299.092 CHARGE=1 COLLISION_ENERGY=0.0 47.0833 11000.0 48.6719 11000.0 51.9165 8800.0 57.3019 10000.0 62.0609 11000.0 64.0161 10000.0 64.5549 10000.0 66.088 9900.0 66.6513 10000.0 67.0177 20000.0 71.0151 13000.0 73.8699 9300.0 74.7716 210000.0 74.7753 50000.0 76.5144 11000.0 87.6789 9500.0 88.785 13000.0 98.9609 11000.0 124.0154 87000.0 124.083 9100.0 133.0647 660000.0 135.0443 81000.0 153.1485 11000.0 159.0439 210000.0 167.0339 980000.0 173.5288 110000.0 173.5387 98000.0 185.0443 110000.0 197.0598 43000.0 201.0544 57000.0 211.0752 35000.0 213.0565 28000.0 213.8484 14000.0 227.0708 35000.0 228.0782 14000.0 239.0705 150000.0 241.0511 28000.0 255.065 14000.0 256.0728 8400000.0 256.1061 19000.0 268.0741 24000.0 270.0852 16000.0 271.097 70000.0 284.0679 15000000.0 284.1426 35000.0 286.5095 11000.0 297.0784 47000.0 299.0112 380000.0 299.0275 290000.0 299.0912 64000000.0 299.153 370000.0 299.1715 460000.0 299.1943 180000.0 299.2167 37000.0 299.2392 21000.0 END IONS BEGIN IONS SCANS=598 PEPMASS=315.0869 CHARGE=1 COLLISION_ENERGY=0.0 48.1964 2300.0 49.1836 2400.0 50.2492 2200.0 51.2008 2100.0 51.8524 2600.0 52.5969 2100.0 52.6758 2300.0 52.7203 2600.0 53.4665 2300.0 53.6624 2300.0 54.4452 2200.0 54.6843 2300.0 57.951 2400.0 58.2817 3100.0 59.0313 2300.0 66.2115 2400.0 66.3426 2500.0 72.7825 2200.0 73.0279 9700.0 74.3055 2600.0 78.7733 3100.0 84.9593 6400.0 89.1124 2400.0 90.8747 2200.0 91.0536 2200.0 93.2236 2300.0 96.1532 2600.0 97.2818 2500.0 97.8324 2100.0 98.0751 2300.0 102.5436 2400.0 104.8616 2400.0 109.0075 2900.0 109.5634 2800.0 111.192 2700.0 111.8632 2400.0 121.0643 18000.0 121.367 2500.0 122.2517 2100.0 126.1442 2700.0 131.7908 2700.0 132.8959 2500.0 134.3795 2900.0 135.0435 98000.0 146.0748 2300.0 147.3432 2400.0 149.0595 9400.0 151.0386 15000.0 153.0541 120000.0 160.6707 2800.0 161.0594 3500.0 162.3875 2300.0 167.0336 120000.0 168.5397 2500.0 170.331 2500.0 173.527 35000.0 173.5373 85000.0 176.9006 2500.0 179.0336 59000.0 181.4573 2400.0 183.5353 2400.0 187.8234 2400.0 188.4073 2400.0 194.9108 5300.0 197.044 24000.0 227.071 4000.0 231.1553 2600.0 241.0853 3200.0 243.0652 11000.0 244.0725 64000.0 250.9005 2300.0 255.0655 15000.0 256.0737 4800.0 259.0957 29000.0 269.0801 2700.0 271.0607 14000.0 272.0677 240000.0 272.6737 2100.0 283.0599 23000.0 283.7748 2600.0 286.0833 40000.0 287.2388 2800.0 300.0629 460000.0 300.1019 4600.0 308.436 2500.0 315.0007 7100.0 315.0862 3200000.0 315.1306 4400.0 315.1494 3200.0 315.1945 3000.0 323.5969 2700.0 END IONS BEGIN IONS SCANS=599 PEPMASS=408.2665 CHARGE=1 COLLISION_ENERGY=0.0 55.0541 13000.0 55.7056 2400.0 58.427 2300.0 58.8584 2200.0 59.8275 2100.0 60.8224 2600.0 60.9696 2300.0 67.054 26000.0 69.0332 18000.0 69.0695 17000.0 69.1515 2600.0 70.0306 2200.0 70.6765 2100.0 77.6166 2300.0 77.8262 2200.0 78.0462 18000.0 79.0539 25000.0 80.0619 7400.0 80.7467 2500.0 81.0333 3300.0 81.0695 46000.0 82.041 37000.0 83.0489 33000.0 83.0853 18000.0 89.0592 12000.0 91.0539 32000.0 93.0695 80000.0 93.8714 2300.0 95.0435 2400.0 95.0488 85000.0 95.0852 46000.0 97.0644 24000.0 98.3559 2300.0 102.0229 2300.0 102.7054 2200.0 105.0695 81000.0 106.0773 13000.0 107.0486 3500.0 107.0783 3300.0 107.0852 99000.0 108.0566 8400.0 108.4047 2300.0 109.0645 34000.0 109.1008 27000.0 111.0797 2500.0 115.0537 2900.0 117.0695 52000.0 119.0851 58000.0 120.0932 6100.0 121.0645 48000.0 121.1009 85000.0 123.0803 8000.0 123.1165 9300.0 125.0957 36000.0 127.7903 2400.0 129.0694 21000.0 130.0773 6400.0 131.0853 90000.0 132.0931 8200.0 133.0643 25000.0 133.1007 41000.0 135.0801 20000.0 139.112 3400.0 142.0776 13000.0 142.1235 2400.0 143.0851 53000.0 144.0934 15000.0 145.0644 52000.0 145.1009 110000.0 146.0724 14000.0 147.0801 54000.0 147.1161 16000.0 148.0887 2400.0 148.9711 2300.0 149.0958 42000.0 149.6911 3600.0 155.0851 14000.0 156.093 11000.0 157.1009 62000.0 158.0731 2500.0 158.1088 7600.0 159.0802 140000.0 159.1165 52000.0 160.0882 10000.0 161.0959 42000.0 163.1109 11000.0 165.3541 2900.0 167.0856 4700.0 167.1065 58000.0 167.164 2400.0 169.1012 29000.0 170.1084 4200.0 171.0802 14000.0 171.1163 35000.0 172.0881 32000.0 173.0959 40000.0 173.1325 12000.0 173.5306 45000.0 173.5471 4200.0 174.104 2700.0 175.1115 17000.0 181.1014 16000.0 182.1083 6300.0 183.1169 19000.0 184.0881 2600.0 185.096 23000.0 185.1323 17000.0 186.4283 3100.0 187.1117 39000.0 189.128 7700.0 191.1071 3300.0 193.101 19000.0 194.109 7000.0 195.1174 21000.0 197.0971 9800.0 197.1322 28000.0 199.1123 15000.0 199.1476 10000.0 201.1273 13000.0 202.1343 2800.0 203.1437 8100.0 205.1223 13000.0 207.117 14000.0 208.124 6500.0 209.0977 4400.0 209.1327 18000.0 211.1119 22000.0 211.1481 11000.0 213.1274 35000.0 213.1636 2700.0 215.1428 13000.0 220.1458 7200.0 221.1321 12000.0 223.1123 2500.0 223.1475 5100.0 225.1277 18000.0 227.1435 18000.0 228.5742 3000.0 233.1316 3500.0 233.1536 63000.0 235.1118 8900.0 235.1493 6200.0 237.127 7900.0 239.143 11000.0 246.1613 27000.0 249.1279 2900.0 253.158 3700.0 255.1753 3400.0 267.1733 3000.0 271.1683 5900.0 273.1855 11000.0 282.9282 2300.0 285.1851 90000.0 297.1882 5900.0 299.2006 14000.0 335.202 9000.0 369.7441 2700.0 END IONS BEGIN IONS SCANS=600 PEPMASS=373.2531 CHARGE=1 COLLISION_ENERGY=0.0 55.0174 2600.0 55.054 25000.0 57.0697 3000.0 61.0511 2500.0 65.3253 2400.0 65.9082 2500.0 67.0539 40000.0 68.6233 2300.0 69.0696 26000.0 70.0063 2500.0 73.0822 2400.0 77.0382 3500.0 78.5005 2200.0 79.0539 51000.0 81.0696 92000.0 83.049 6600.0 84.8896 2400.0 90.7327 2100.0 91.0493 2400.0 91.0539 68000.0 93.0695 91000.0 95.0436 2900.0 95.0488 88000.0 95.0803 2100.0 95.0851 66000.0 97.0645 23000.0 103.0233 2200.0 103.0544 2800.0 105.0693 160000.0 107.0851 59000.0 109.0644 33000.0 109.1007 17000.0 115.0539 2400.0 117.0694 31000.0 119.0852 140000.0 121.0644 28000.0 121.1008 44000.0 128.0618 17000.0 129.0695 33000.0 130.0773 11000.0 131.0853 63000.0 133.0657 2600.0 133.1008 89000.0 135.0799 13000.0 139.4755 2600.0 140.8726 2800.0 141.0695 9900.0 142.0773 48000.0 143.0852 91000.0 144.093 20000.0 145.1009 90000.0 147.0801 2600.0 147.1166 17000.0 149.0959 13000.0 154.0781 3000.0 155.085 29000.0 156.093 36000.0 157.1009 110000.0 158.1087 21000.0 159.08 6700.0 159.1166 44000.0 161.0955 11000.0 165.0698 5800.0 167.0857 21000.0 168.0933 6500.0 169.101 65000.0 170.1087 17000.0 171.1166 54000.0 173.1325 33000.0 173.5282 42000.0 173.543 11000.0 179.0856 24000.0 179.1028 3000.0 180.0933 11000.0 181.1011 42000.0 182.1089 47000.0 183.1165 44000.0 184.1252 16000.0 185.0972 4200.0 185.1321 18000.0 192.0933 10000.0 193.101 40000.0 194.1087 28000.0 195.1166 58000.0 196.1245 25000.0 197.1324 50000.0 198.1401 5800.0 199.1484 16000.0 203.9821 2500.0 205.1015 8400.0 206.1087 25000.0 207.1168 65000.0 208.1249 26000.0 209.1323 49000.0 210.1403 7500.0 211.1486 23000.0 218.1092 3900.0 219.1168 23000.0 220.1247 25000.0 221.1325 59000.0 222.1404 21000.0 223.1482 26000.0 224.6698 2500.0 231.1171 8400.0 232.1244 12000.0 233.1325 34000.0 234.1398 18000.0 235.125 2300.0 235.1479 49000.0 236.1551 14000.0 237.1641 17000.0 245.1328 18000.0 246.139 14000.0 247.1477 31000.0 248.1551 14000.0 249.1637 54000.0 250.1713 2800.0 251.1804 2900.0 257.318 2400.0 258.1403 6500.0 259.1476 13000.0 260.1561 16000.0 261.1641 23000.0 263.1796 16000.0 264.1872 7300.0 265.1939 5900.0 269.1337 3300.0 271.1476 3000.0 273.1638 10000.0 274.1735 2400.0 275.1787 13000.0 277.1951 7000.0 283.1494 2800.0 284.155 2800.0 285.165 2500.0 289.1962 4900.0 299.1797 6200.0 317.1899 3200.0 373.2509 16000.0 END IONS BEGIN IONS SCANS=601 PEPMASS=391.2638 CHARGE=1 COLLISION_ENERGY=0.0 53.6201 2400.0 53.7396 2200.0 55.054 30000.0 57.0673 2800.0 57.0696 78000.0 58.9172 2400.0 59.0491 3100.0 59.9849 2500.0 63.4338 2600.0 64.8734 2600.0 65.0382 2400.0 67.0539 32000.0 69.0218 2200.0 69.0333 8800.0 69.0696 30000.0 71.0852 64000.0 73.261 2200.0 76.6618 2200.0 77.8715 2100.0 79.0539 48000.0 81.0696 120000.0 83.049 17000.0 83.0854 14000.0 85.0645 12000.0 87.5983 2300.0 91.0539 45000.0 93.0639 3700.0 93.0695 120000.0 95.0426 3300.0 95.0488 120000.0 95.0851 65000.0 97.0645 18000.0 98.9144 2400.0 105.0695 150000.0 107.0487 2600.0 107.0852 84000.0 109.0645 31000.0 109.1008 31000.0 111.0798 2300.0 112.9004 2100.0 113.5312 2300.0 115.0549 2800.0 117.0695 25000.0 119.0852 140000.0 121.0279 8500.0 121.0645 39000.0 121.1008 80000.0 123.08 15000.0 123.1167 11000.0 128.062 10000.0 129.0697 22000.0 130.0775 10000.0 131.0853 75000.0 133.0651 2900.0 133.1009 57000.0 135.08 17000.0 135.1166 11000.0 141.0699 9300.0 142.0775 22000.0 143.0852 86000.0 144.0932 17000.0 145.0644 4600.0 145.0889 4100.0 145.101 150000.0 146.0722 2500.0 147.08 23000.0 147.1166 41000.0 149.0231 690000.0 149.0958 18000.0 149.1328 4600.0 155.0852 31000.0 156.093 28000.0 157.1009 120000.0 158.1089 9000.0 159.0805 18000.0 159.1166 59000.0 161.096 27000.0 161.1324 8900.0 166.0781 2800.0 167.0334 4300.0 167.0854 16000.0 167.1062 2900.0 168.093 7000.0 169.1011 66000.0 170.1087 17000.0 171.081 6400.0 171.1167 67000.0 173.0958 19000.0 173.1325 66000.0 173.5328 47000.0 175.1117 18000.0 179.0855 17000.0 180.0938 6100.0 181.1011 44000.0 182.1091 24000.0 183.1166 72000.0 184.1246 14000.0 185.0957 3500.0 185.1324 37000.0 187.1114 11000.0 187.148 12000.0 189.1283 3100.0 191.1429 14000.0 192.0937 2900.0 193.1011 31000.0 194.1088 25000.0 195.1167 63000.0 196.1244 24000.0 197.0958 6200.0 197.1325 61000.0 198.1412 2400.0 199.1115 19000.0 199.1476 20000.0 201.1269 3200.0 206.1092 18000.0 207.1167 53000.0 208.1246 25000.0 209.1326 62000.0 210.1396 7600.0 211.1113 13000.0 211.1482 35000.0 213.1279 15000.0 215.1421 9500.0 216.0584 2400.0 217.1576 6000.0 218.1085 2700.0 219.1171 20000.0 220.1245 18000.0 221.1325 50000.0 222.1401 12000.0 223.1121 7200.0 223.1483 42000.0 225.1278 14000.0 225.1644 16000.0 227.1438 12000.0 231.1161 5800.0 232.124 4200.0 233.1321 30000.0 233.1547 16000.0 234.1404 17000.0 235.1484 37000.0 236.1558 7700.0 237.1274 4600.0 237.1637 25000.0 239.1429 3600.0 241.1595 2400.0 243.1163 3100.0 244.1246 2500.0 245.132 12000.0 246.1396 15000.0 247.1482 22000.0 248.1563 14000.0 249.1636 70000.0 251.1449 11000.0 251.1794 16000.0 253.158 3900.0 257.1329 3600.0 258.1399 5800.0 259.1478 14000.0 260.1546 3600.0 261.1639 21000.0 262.1687 3100.0 263.1791 21000.0 264.1869 9600.0 267.1745 28000.0 269.705 2600.0 273.1645 14000.0 275.1783 16000.0 277.1609 3300.0 277.1941 4700.0 279.1761 3500.0 281.1909 7100.0 282.1984 17000.0 283.2074 2900.0 287.18 4900.0 289.1958 12000.0 291.1746 9200.0 293.1888 9600.0 295.2059 3400.0 297.1855 28000.0 298.3142 2400.0 299.1811 3200.0 305.1909 3100.0 308.2144 4300.0 314.1997 3100.0 315.2094 3200.0 316.1808 2600.0 322.9916 2800.0 335.2005 3900.0 354.248 2500.0 373.2528 7400.0 391.2642 13000.0 END IONS BEGIN IONS SCANS=602 PEPMASS=696.4172 CHARGE=1 COLLISION_ENERGY=0.0 67.0539 52000.0 68.4625 2600.0 69.0696 28000.0 70.2788 2500.0 71.0852 12000.0 72.7335 2100.0 73.0281 11000.0 76.2591 2300.0 79.0539 15000.0 81.0693 140000.0 82.4208 2700.0 83.0851 39000.0 85.028 73000.0 85.0648 3200.0 85.1008 5600.0 86.874 2400.0 87.2009 2700.0 89.4514 2200.0 90.0803 2300.0 91.0386 57000.0 91.0539 11000.0 93.0696 23000.0 93.8078 2600.0 95.0851 130000.0 97.028 35000.0 97.0645 16000.0 97.1008 38000.0 99.0799 7700.0 105.0698 12000.0 106.6604 2700.0 107.0851 29000.0 109.0929 3400.0 109.1008 97000.0 111.0802 8200.0 111.1165 14000.0 113.0177 2300.0 113.0959 8300.0 119.0852 22000.0 121.1007 62000.0 123.1164 67000.0 125.0962 2900.0 125.132 3200.0 127.0386 27000.0 127.1117 2700.0 133.1008 43000.0 135.1165 43000.0 137.1321 30000.0 139.1114 2800.0 141.1269 7100.0 142.472 2300.0 145.0492 31000.0 147.1165 37000.0 149.1322 52000.0 150.8089 2800.0 151.1118 8500.0 151.1476 28000.0 153.1273 2700.0 155.142 8000.0 157.6038 2800.0 161.1323 49000.0 163.0601 8500.0 163.1479 48000.0 164.3511 2500.0 165.1272 3200.0 165.1635 27000.0 172.8626 2200.0 173.3316 2600.0 173.5229 19000.0 173.5374 35000.0 173.543 5500.0 175.148 46000.0 177.1638 8800.0 179.1422 2400.0 179.1795 20000.0 181.158 3000.0 182.4646 2200.0 189.1635 22000.0 193.1585 4400.0 198.5191 2300.0 203.1786 3000.0 217.1928 2900.0 245.2263 170000.0 249.3119 2200.0 252.2625 2600.0 259.0042 2500.0 263.2368 200000.0 296.9904 2700.0 337.2742 160000.0 337.3162 4200.0 342.3297 2800.0 366.8343 3200.0 381.9319 2500.0 577.9653 2600.0 594.4008 2800.0 611.5497 2600.0 625.6497 2800.0 654.4083 2600.0 700.0663 3100.0 END IONS BEGIN IONS SCANS=603 PEPMASS=231.1383 CHARGE=1 COLLISION_ENERGY=0.0 43.0178 180000.0 47.3787 2400.0 48.6402 2600.0 49.5945 2400.0 52.6296 2600.0 53.0385 16000.0 55.0177 98000.0 55.0541 140000.0 57.8925 2600.0 59.0491 28000.0 60.5402 2200.0 61.2681 2300.0 62.5296 2200.0 62.6575 2400.0 63.7831 2500.0 67.0541 76000.0 67.6718 2300.0 68.9658 2200.0 69.0333 71000.0 69.0698 26000.0 69.8303 2100.0 70.1843 2400.0 71.5995 2200.0 71.8382 2900.0 73.0279 2100.0 73.1461 2300.0 73.5106 2100.0 74.976 2500.0 75.6747 2500.0 77.4392 2200.0 78.4588 2200.0 79.054 240000.0 79.1336 2300.0 79.6844 2400.0 81.0696 650000.0 83.0489 18000.0 84.5681 2400.0 85.8854 2200.0 85.9739 2600.0 86.0213 2600.0 87.0439 21000.0 90.9494 2300.0 91.054 250000.0 91.1581 2100.0 91.2742 2100.0 92.301 2400.0 93.0696 260000.0 93.591 2800.0 94.3589 2600.0 95.0491 60000.0 95.0853 210000.0 96.026 2900.0 96.171 2300.0 97.0648 17000.0 97.9651 2500.0 99.3188 2500.0 101.0027 2500.0 101.682 2400.0 103.0538 23000.0 103.9186 2500.0 105.0616 16000.0 105.0696 1100000.0 105.0759 2100.0 105.0803 6300.0 105.7186 2300.0 107.0492 6000.0 107.0854 130000.0 107.9468 2200.0 108.4551 2700.0 109.0647 24000.0 111.0439 130000.0 111.0806 3200.0 112.6879 2300.0 115.054 42000.0 117.0697 460000.0 119.049 61000.0 119.0757 5300.0 119.0853 680000.0 121.0646 24000.0 122.0733 2500.0 123.0802 92000.0 125.0596 44000.0 128.0619 160000.0 128.2987 2300.0 129.0697 280000.0 130.0775 40000.0 131.0854 170000.0 133.054 4200.0 133.0646 460000.0 133.0757 11000.0 133.1011 170000.0 134.291 2400.0 135.0804 68000.0 136.8036 2500.0 137.0595 45000.0 140.6284 2400.0 141.0698 83000.0 141.296 2500.0 142.0659 4800.0 142.0776 560000.0 143.0727 5500.0 143.0853 870000.0 143.0978 5300.0 144.0934 52000.0 145.0645 33000.0 145.1011 330000.0 147.0803 29000.0 147.1156 2700.0 147.7541 2700.0 149.5607 2800.0 149.8992 2500.0 151.0753 230000.0 151.9343 2800.0 152.9122 2600.0 153.0699 9700.0 154.0777 2800.0 155.0853 180000.0 156.0931 390000.0 157.0639 2800.0 157.0846 12000.0 157.0887 2100.0 157.101 1500000.0 157.1156 18000.0 157.4026 2600.0 158.109 73000.0 159.0805 19000.0 159.1168 100000.0 161.0959 35000.0 161.1315 2300.0 163.0754 60000.0 165.0699 130000.0 166.1067 2400.0 167.0857 19000.0 169.1012 42000.0 170.109 890000.0 170.1257 4800.0 171.0805 110000.0 171.117 110000.0 172.0883 56000.0 172.125 26000.0 173.0963 16000.0 173.5293 120000.0 173.5399 41000.0 173.8939 2400.0 175.0754 41000.0 175.1124 12000.0 179.0856 6200.0 180.0934 150000.0 182.3112 2700.0 182.4987 2500.0 183.0804 100000.0 183.1167 9800.0 183.4947 2600.0 184.0884 58000.0 185.0956 44000.0 185.1131 3100.0 185.1325 1100000.0 185.1516 19000.0 186.1398 13000.0 187.1486 6200.0 189.0914 31000.0 191.2516 2700.0 195.1169 170000.0 197.0957 5200.0 197.6038 2600.0 198.104 250000.0 203.1429 5600.0 208.0374 2700.0 213.1275 460000.0 215.2694 2400.0 216.1155 2400.0 216.1633 2300.0 216.2934 2300.0 217.7238 3000.0 220.6388 2400.0 223.4744 2300.0 231.138 50000.0 239.1339 2200.0 240.9255 2500.0 241.502 2300.0 END IONS BEGIN IONS SCANS=604 PEPMASS=478.2935 CHARGE=1 COLLISION_ENERGY=0.0 59.1614 2300.0 59.8224 2400.0 61.51 2500.0 61.5486 2300.0 62.0597 10000.0 62.6551 2300.0 64.9351 2700.0 67.0538 810000.0 67.0581 3600.0 67.446 2300.0 68.3832 2300.0 69.0694 730000.0 69.0739 4100.0 70.5146 2600.0 70.6403 2000.0 71.0488 25000.0 71.0851 56000.0 79.0538 210000.0 81.0694 1200000.0 81.0777 7500.0 81.9822 2800.0 82.3718 2100.0 82.4684 2300.0 82.7163 2600.0 83.0487 33000.0 83.085 590000.0 84.0152 2400.0 85.0644 48000.0 85.1007 20000.0 89.3541 2600.0 91.0537 140000.0 91.4391 2500.0 91.7054 2400.0 93.0369 2500.0 93.0694 320000.0 93.0916 2600.0 94.3183 2300.0 95.0487 3000.0 95.085 1100000.0 95.0923 2200.0 97.0643 110000.0 97.0944 3400.0 97.1007 380000.0 99.08 52000.0 100.585 2400.0 101.0588 3000.0 101.2867 2600.0 101.9137 2800.0 105.0693 120000.0 107.085 250000.0 109.1006 590000.0 109.3216 2300.0 109.8656 2200.0 110.9107 2700.0 111.08 69000.0 111.1163 78000.0 112.0131 2500.0 112.3049 2600.0 113.096 3600.0 115.075 2400.0 116.7431 2500.0 119.0768 2700.0 119.085 170000.0 120.4991 2400.0 121.1006 280000.0 123.0799 31000.0 123.1163 320000.0 124.0153 9900.0 125.0957 51000.0 125.1318 3300.0 126.2999 2400.0 133.1006 240000.0 135.1163 180000.0 137.0955 31000.0 137.1319 130000.0 138.8425 2300.0 139.1115 32000.0 141.9279 2600.0 144.602 2300.0 147.1163 200000.0 148.8249 2900.0 149.1319 110000.0 150.2199 2400.0 151.1117 26000.0 151.1478 49000.0 153.1271 35000.0 159.117 2000.0 161.1319 150000.0 163.1339 3500.0 163.1476 100000.0 163.1624 3000.0 165.1276 11000.0 165.1632 8700.0 167.1419 5700.0 173.1083 2400.0 173.5213 9100.0 173.5312 180000.0 173.5408 29000.0 175.1478 120000.0 177.1638 13000.0 177.8848 2300.0 179.1425 9200.0 181.1583 6000.0 184.5241 2600.0 184.9177 3000.0 189.1634 47000.0 193.1579 3900.0 202.8766 2200.0 203.1787 8900.0 207.1744 2500.0 211.2844 2400.0 217.1954 2600.0 219.2101 3000.0 220.8081 2600.0 226.0426 2400.0 232.625 2300.0 239.2134 2300.0 240.7424 2500.0 244.7039 2200.0 245.2257 68000.0 247.0499 2400.0 249.1059 2300.0 252.1446 2800.0 259.3815 2300.0 263.2365 140000.0 264.9617 2600.0 270.4901 2800.0 278.1976 2700.0 284.287 2600.0 285.6924 2600.0 294.2894 2300.0 299.1428 3000.0 306.2788 190000.0 314.9211 2800.0 337.2259 17000.0 337.2735 3400000.0 402.4049 2500.0 426.7874 2400.0 434.6256 2700.0 437.3109 2300.0 459.1958 2300.0 END IONS BEGIN IONS SCANS=605 PEPMASS=324.1237 CHARGE=1 COLLISION_ENERGY=0.0 55.835 2300.0 64.5713 2400.0 66.2173 2200.0 71.8427 2600.0 83.7063 2500.0 87.9174 2300.0 91.9972 2300.0 97.6574 2500.0 98.135 2300.0 98.7689 2600.0 110.1236 2400.0 112.8294 2500.0 136.5787 2200.0 147.9435 2200.0 158.7475 2400.0 173.5233 5400.0 173.5342 40000.0 175.2205 2500.0 207.1033 4800.0 217.0872 2900.0 224.0701 7800.0 233.0824 2400.0 234.0922 20000.0 235.0992 72000.0 245.0833 3400.0 246.0923 2700.0 247.0981 3100.0 248.0708 31000.0 249.0782 6600.0 250.0865 10000.0 262.0619 2200.0 262.0861 110000.0 263.0939 140000.0 264.1019 100000.0 265.0746 4000.0 266.081 120000.0 272.0717 4800.0 273.079 7400.0 274.0874 11000.0 276.0655 130000.0 276.1009 3500.0 278.0817 28000.0 279.0889 5900.0 280.0969 74000.0 290.0812 85000.0 291.0518 4300.0 291.0893 620000.0 291.127 8300.0 292.0969 17000.0 293.1048 59000.0 293.8121 2300.0 294.037 5300.0 294.0764 700000.0 294.1144 2900.0 298.9684 2200.0 308.0561 2800.0 308.092 52000.0 309.0652 2400.0 309.0999 270000.0 324.0833 7300.0 324.1233 420000.0 END IONS BEGIN IONS SCANS=606 PEPMASS=520.3404 CHARGE=1 COLLISION_ENERGY=0.0 60.0805 330000.0 61.6608 2500.0 62.1588 2400.0 62.7141 2200.0 63.1088 2100.0 63.1551 2500.0 64.2047 2200.0 67.054 6600.0 69.0695 3000.0 69.7964 2300.0 69.8523 2500.0 71.0727 66000.0 72.6761 2800.0 74.8506 2600.0 77.5292 2600.0 77.7695 2400.0 81.0696 8900.0 81.4843 2100.0 83.0854 3200.0 84.6038 2200.0 85.8478 2600.0 86.0961 1800000.0 86.102 3100.0 86.3648 2800.0 86.4796 2500.0 88.0226 2700.0 89.62 2600.0 90.0411 2500.0 95.0853 18000.0 97.1004 2900.0 97.5675 2600.0 98.9841 56000.0 99.5157 2200.0 100.6013 2800.0 104.0996 3000.0 104.1066 290000.0 107.9108 2700.0 109.101 4700.0 122.8841 3000.0 124.9903 4100.0 124.9995 740000.0 125.0104 7100.0 132.2594 2700.0 133.763 2500.0 150.2355 2400.0 151.8318 2200.0 152.8458 2600.0 157.9262 2900.0 163.0155 2900.0 168.2201 2300.0 173.5251 40000.0 173.5365 170000.0 184.0136 3100.0 184.035 160000.0 184.0426 22000.0 184.0733 19000000.0 184.103 72000.0 184.1122 130000.0 184.123 25000.0 184.1551 2600.0 184.7521 2700.0 214.4616 2500.0 228.7249 2600.0 231.4336 2800.0 240.4646 2300.0 257.3974 2300.0 258.1089 22000.0 285.88 2600.0 299.2882 2500.0 299.2972 2500.0 321.3591 2700.0 321.3924 2500.0 332.4608 2700.0 333.3051 2800.0 337.1044 2600.0 337.2745 83000.0 340.1161 3500.0 342.8085 2500.0 353.1288 2500.0 368.5145 2400.0 404.0117 2300.0 412.1293 2400.0 415.3155 2300.0 429.7845 2500.0 434.5681 2700.0 441.7077 2500.0 443.2565 11000.0 476.1152 2800.0 502.3303 48000.0 END IONS BEGIN IONS SCANS=607 PEPMASS=537.3039 CHARGE=1 COLLISION_ENERGY=0.0 80.473 2300.0 83.1179 2600.0 85.1133 2700.0 113.1415 2100.0 119.6868 2600.0 129.4218 2200.0 134.3197 2300.0 149.6844 4600.0 149.6946 4100.0 168.7814 2200.0 173.5281 21000.0 173.5448 5000.0 185.0416 18000.0 194.529 2300.0 203.0523 42000.0 220.8679 2700.0 259.0782 26000.0 262.6661 2700.0 281.2952 9400.0 282.279 59000.0 375.2505 12000.0 467.0404 2500.0 537.303 1600000.0 END IONS BEGIN IONS SCANS=608 PEPMASS=353.2689 CHARGE=1 COLLISION_ENERGY=0.0 53.0018 2600.0 55.0177 10000.0 55.054 120000.0 57.0332 85000.0 57.0696 66000.0 65.0384 7700.0 66.8818 2200.0 67.0539 870000.0 67.0581 6200.0 67.0604 8700.0 69.0695 150000.0 70.7061 2500.0 71.0488 26000.0 71.0852 22000.0 73.6766 2100.0 75.0436 18000.0 75.0479 2500.0 75.8221 2400.0 77.0387 3900.0 79.0538 330000.0 81.0696 1100000.0 81.0763 18000.0 81.0781 8300.0 83.0488 9500.0 83.0851 100000.0 85.0644 34000.0 91.0483 3700.0 91.0537 150000.0 93.0695 590000.0 93.0766 3600.0 95.049 15000.0 95.0852 970000.0 95.0924 4000.0 95.096 6700.0 97.0644 44000.0 97.1008 59000.0 99.0802 23000.0 105.0448 3100.0 105.0695 170000.0 107.0851 490000.0 109.0645 17000.0 109.1008 570000.0 111.0801 23000.0 111.1165 2700.0 117.0695 89000.0 119.0851 180000.0 121.0911 10000.0 121.1008 480000.0 121.1097 3000.0 123.08 21000.0 123.1069 5400.0 123.1165 270000.0 125.0958 16000.0 127.6163 2500.0 131.0748 8400.0 131.0852 240000.0 133.0905 3600.0 133.1008 190000.0 135.0436 24000.0 135.0805 5800.0 135.1165 410000.0 135.1271 5400.0 137.0959 14000.0 137.1322 74000.0 139.1118 10000.0 145.1009 190000.0 147.1165 150000.0 149.0961 12000.0 149.1322 290000.0 149.1463 3900.0 151.0749 5800.0 151.1118 9700.0 151.1477 22000.0 152.8029 2500.0 153.1277 7200.0 159.1166 170000.0 159.516 2400.0 161.1182 7400.0 161.1323 140000.0 163.1119 13000.0 163.1479 140000.0 165.127 14000.0 167.1434 2200.0 167.7243 2300.0 173.1325 190000.0 173.518 3800.0 173.5269 11000.0 173.5338 40000.0 173.545 5000.0 175.1481 43000.0 177.128 10000.0 177.1639 46000.0 179.143 10000.0 187.148 100000.0 189.1647 3400.0 191.1436 12000.0 199.9703 2500.0 201.0911 8000.0 201.1638 31000.0 205.159 9700.0 215.18 6600.0 219.1741 10000.0 222.748 2600.0 223.1692 3200.0 233.19 5400.0 233.2263 15000.0 243.2108 110000.0 244.425 2500.0 252.0784 2600.0 261.1898 5300.0 261.2213 290000.0 261.2467 2600.0 279.2309 12000.0 282.0886 11000.0 283.0968 3400.0 292.8852 2700.0 304.1112 9400.0 320.1033 2300.0 END IONS BEGIN IONS SCANS=609 PEPMASS=327.2323 CHARGE=1 COLLISION_ENERGY=0.0 50.664 2400.0 53.0384 2500.0 55.0176 4700.0 55.054 35000.0 56.39 2500.0 57.0333 6400.0 57.0697 19000.0 59.0489 3100.0 67.0539 51000.0 69.0332 6000.0 69.0695 33000.0 70.6212 2200.0 71.0489 5700.0 77.0383 6700.0 79.0539 42000.0 81.0333 6900.0 81.0646 2300.0 81.0695 81000.0 83.0488 3600.0 83.0852 7600.0 85.0643 5600.0 85.1005 2200.0 91.0539 53000.0 93.0695 180000.0 95.0425 3400.0 95.0488 140000.0 95.0794 3500.0 95.0852 110000.0 95.987 2300.0 97.0645 34000.0 103.0087 2400.0 103.0539 2700.0 105.0695 130000.0 107.0851 83000.0 108.2363 2400.0 109.0643 26000.0 109.1009 49000.0 115.0539 2800.0 117.0694 37000.0 119.0851 130000.0 121.0644 37000.0 121.1008 73000.0 123.0802 14000.0 123.1166 9400.0 128.0621 5300.0 129.0694 13000.0 130.0768 2400.0 131.0852 74000.0 132.7653 2600.0 133.0826 2800.0 133.1008 100000.0 135.0798 17000.0 135.1166 24000.0 137.0956 2700.0 142.0775 21000.0 143.0851 41000.0 144.0932 13000.0 145.1009 110000.0 147.1165 36000.0 149.0956 11000.0 149.1324 3500.0 152.0615 6200.0 153.0699 6300.0 155.085 11000.0 156.0929 13000.0 157.1009 63000.0 158.1082 15000.0 159.0808 6000.0 159.1166 80000.0 160.1235 2500.0 161.0959 31000.0 161.1322 8200.0 163.1351 2700.0 167.0846 3200.0 169.101 27000.0 170.1081 6500.0 171.1168 36000.0 172.1238 4100.0 173.0962 7400.0 173.1323 36000.0 173.5323 41000.0 175.1472 12000.0 179.085 3100.0 181.1011 6900.0 182.1088 7300.0 183.1167 22000.0 184.1248 7300.0 185.1324 20000.0 187.1476 18000.0 189.1629 2800.0 194.1084 2600.0 195.1168 9600.0 197.1325 25000.0 199.1479 11000.0 201.1637 3500.0 207.118 2800.0 209.1324 18000.0 210.1391 2900.0 211.1474 10000.0 216.4739 2500.0 217.1556 2800.0 225.1638 8100.0 229.1015 2800.0 233.0363 12000.0 233.8989 2800.0 235.1497 3300.0 239.1789 3200.0 251.0479 6300.0 317.5234 2500.0 327.0786 15000.0 END IONS BEGIN IONS SCANS=610 PEPMASS=497.3114 CHARGE=1 COLLISION_ENERGY=0.0 58.0192 2400.0 61.0281 120000.0 63.8308 2300.0 67.0539 130000.0 69.0332 70000.0 69.0696 38000.0 71.0488 17000.0 73.0281 67000.0 79.0539 74000.0 81.0331 42000.0 81.0647 4600.0 81.0695 180000.0 83.0488 11000.0 83.0852 21000.0 85.0226 3600.0 85.028 150000.0 85.0646 3000.0 87.0436 9800.0 91.0386 99000.0 91.0538 38000.0 91.1067 2500.0 93.0695 100000.0 95.0488 12000.0 95.0852 150000.0 97.0281 120000.0 97.0645 5200.0 97.101 12000.0 99.0438 28000.0 101.0229 32000.0 103.0386 18000.0 104.8191 2300.0 105.0695 45000.0 107.0852 75000.0 109.028 29000.0 109.0643 4600.0 109.1008 74000.0 111.0437 3200.0 115.0388 12000.0 117.0698 20000.0 119.0852 48000.0 119.0936 2500.0 120.8223 2800.0 121.1008 83000.0 123.0797 3200.0 123.1166 28000.0 127.0386 59000.0 129.0541 8100.0 129.5511 2400.0 131.0853 35000.0 133.1009 40000.0 133.1362 2200.0 135.1166 55000.0 145.0493 7400.0 145.1009 28000.0 147.1167 28000.0 149.1321 30000.0 154.2341 2500.0 159.1164 25000.0 161.1324 24000.0 163.1479 11000.0 168.5292 2800.0 171.1184 2800.0 173.1323 27000.0 173.5205 10000.0 173.5301 24000.0 173.5382 38000.0 175.1489 8200.0 179.1445 2400.0 185.1326 5600.0 186.6005 2500.0 187.1477 13000.0 199.1445 2400.0 199.6676 2400.0 201.1633 3300.0 211.4397 2300.0 243.2113 4100.0 261.2213 20000.0 295.655 2600.0 317.2446 2200.0 332.6198 2400.0 333.7273 2500.0 335.2584 51000.0 345.5007 2700.0 361.9443 2300.0 365.1668 2500.0 385.2988 2600.0 489.5982 2500.0 END IONS BEGIN IONS SCANS=611 PEPMASS=618.4285 CHARGE=1 COLLISION_ENERGY=0.0 64.9321 2500.0 65.0389 3900.0 65.8521 2400.0 67.0541 33000.0 67.3225 2400.0 69.0333 29000.0 69.0697 45000.0 70.9379 2700.0 71.0489 23000.0 71.1845 2000.0 74.4376 2500.0 76.3459 2600.0 77.9004 2600.0 78.8235 2400.0 79.0541 47000.0 80.0173 2700.0 80.0622 6200.0 81.0697 150000.0 83.049 53000.0 83.0852 250000.0 84.6206 2400.0 85.0282 7300.0 85.0646 25000.0 87.0439 8500.0 87.497 2200.0 90.7984 2200.0 91.0541 53000.0 93.0696 180000.0 95.049 91000.0 95.0793 4300.0 95.0853 130000.0 97.0646 110000.0 97.1013 3300.0 99.0439 27000.0 99.0804 7800.0 102.575 3200.0 103.0539 2500.0 105.0697 190000.0 107.0492 13000.0 107.0853 270000.0 108.0935 3500.0 109.0646 58000.0 109.101 130000.0 111.0803 29000.0 113.0597 12000.0 113.096 65000.0 115.0546 4800.0 117.0697 33000.0 118.0775 3400.0 119.0763 7200.0 119.0853 260000.0 120.0934 14000.0 121.0647 33000.0 121.0909 4500.0 121.101 260000.0 123.0803 80000.0 123.1167 35000.0 125.096 120000.0 126.1039 3200.0 127.1117 3900.0 129.0697 22000.0 130.0776 6500.0 131.0854 130000.0 132.0933 24000.0 132.6838 2300.0 133.0647 11000.0 133.1011 220000.0 133.1125 3500.0 134.1088 8400.0 135.0803 60000.0 135.1168 52000.0 136.0881 2500.0 137.0959 41000.0 139.1116 95000.0 141.0696 9500.0 142.0774 21000.0 143.0854 140000.0 144.0932 31000.0 145.0649 12000.0 145.1011 310000.0 145.1142 6300.0 146.1085 17000.0 147.0804 56000.0 147.1167 120000.0 149.096 70000.0 149.1324 19000.0 151.0747 14000.0 151.1119 17000.0 153.0906 8700.0 153.1273 10000.0 155.0855 40000.0 155.1065 50000.0 156.0933 39000.0 157.0869 5600.0 157.1011 260000.0 157.1144 5200.0 158.1089 25000.0 159.0805 60000.0 159.1167 170000.0 160.0882 75000.0 161.0961 80000.0 161.1325 33000.0 163.1118 36000.0 165.0694 2800.0 165.0912 14000.0 165.1278 13000.0 167.0846 4600.0 167.087 15000.0 167.1067 130000.0 167.1429 18000.0 168.0932 7300.0 169.1013 100000.0 169.1193 4100.0 170.109 27000.0 171.081 10000.0 171.1006 9000.0 171.1169 190000.0 172.0883 3200.0 172.1247 20000.0 173.0963 54000.0 173.1326 110000.0 173.524 8100.0 173.5293 40000.0 173.5424 6300.0 174.1039 6900.0 175.1118 64000.0 175.1482 24000.0 176.1194 3400.0 177.0913 3200.0 177.1276 15000.0 179.0864 11000.0 179.1065 2300.0 179.1431 41000.0 181.1015 53000.0 181.1224 98000.0 182.1091 34000.0 183.1169 130000.0 183.1377 23000.0 184.1247 20000.0 185.0963 26000.0 185.1326 120000.0 186.1047 3700.0 186.1405 14000.0 187.1118 39000.0 187.1482 54000.0 188.1199 6800.0 189.1275 33000.0 190.135 8900.0 191.1431 54000.0 192.0921 3200.0 193.1013 30000.0 193.1208 6600.0 193.1573 2900.0 194.109 24000.0 195.1169 120000.0 195.1367 16000.0 196.1247 38000.0 197.0984 13000.0 197.1127 5700.0 197.1326 220000.0 198.14 19000.0 199.1121 37000.0 199.1482 85000.0 200.1193 4000.0 200.1565 7900.0 201.1276 29000.0 201.1634 15000.0 203.1432 39000.0 205.123 3300.0 205.1584 8000.0 206.1084 3800.0 207.1172 61000.0 207.1378 16000.0 207.7421 3100.0 208.1245 26000.0 208.1455 15000.0 209.1326 130000.0 209.1535 14000.0 210.1403 28000.0 211.1119 20000.0 211.1484 120000.0 212.1201 7400.0 212.1564 19000.0 213.1278 51000.0 213.164 36000.0 214.1345 2700.0 215.1433 74000.0 217.1586 15000.0 218.166 6400.0 219.1168 19000.0 219.1385 9000.0 220.1255 11000.0 221.1323 69000.0 221.1542 68000.0 222.1401 22000.0 223.1115 9600.0 223.1215 3000.0 223.1483 110000.0 224.1555 11000.0 225.1271 35000.0 225.1642 43000.0 226.1364 3700.0 226.1711 3700.0 227.1434 40000.0 227.1809 7500.0 228.1513 4500.0 229.159 14000.0 231.116 8600.0 231.1388 2700.0 231.1749 11000.0 232.1248 7500.0 233.1318 29000.0 233.154 220000.0 234.1389 14000.0 234.1635 3100.0 235.148 74000.0 235.1707 4400.0 236.1557 11000.0 237.1266 4300.0 237.1641 69000.0 239.1435 21000.0 239.1797 23000.0 240.1483 3400.0 241.1591 23000.0 243.1736 10000.0 245.131 17000.0 245.1558 8100.0 246.1373 7300.0 246.162 28000.0 246.3886 2400.0 247.1477 42000.0 247.1709 16000.0 248.1567 13000.0 249.1638 64000.0 250.1712 10000.0 251.1451 8700.0 251.1794 41000.0 252.1868 3600.0 253.1586 29000.0 253.1939 11000.0 255.1743 180000.0 257.1903 7500.0 258.1394 3600.0 259.1472 20000.0 259.1734 3400.0 260.1544 13000.0 261.164 60000.0 262.1721 8900.0 263.1494 3900.0 263.1793 46000.0 265.1616 12000.0 265.1954 29000.0 267.1745 25000.0 268.1833 5300.0 269.1901 24000.0 270.1988 13000.0 271.1715 14000.0 271.2045 3100.0 273.1602 12000.0 273.1855 29000.0 274.1716 9600.0 275.18 41000.0 276.1883 7500.0 277.1613 3900.0 277.1956 29000.0 279.1759 13000.0 281.1907 31000.0 282.1986 11000.0 283.2061 15000.0 285.1853 20000.0 286.1941 13000.0 287.1765 6400.0 287.2046 5200.0 288.1915 2500.0 289.1956 26000.0 291.1761 7600.0 291.212 15000.0 293.1906 12000.0 294.198 2500.0 295.206 31000.0 297.1865 9400.0 297.2212 3200.0 298.1945 5000.0 299.2012 27000.0 301.1961 21000.0 303.2107 7500.0 305.1912 3300.0 307.2063 13000.0 309.2211 9900.0 311.2018 15000.0 313.1977 3500.0 315.211 9100.0 316.2218 2600.0 317.1892 3200.0 317.2266 13000.0 319.2046 8200.0 321.2228 3200.0 325.2133 3700.0 327.2118 7200.0 329.2262 8700.0 331.2432 3400.0 333.2209 10000.0 335.238 7200.0 337.2538 8600.0 345.2218 12000.0 347.2374 9800.0 349.2522 12000.0 359.2366 8900.0 365.2463 15000.0 367.2652 2900.0 381.2611 3100.0 383.2632 6400.0 399.2673 15000.0 417.2723 3300.0 439.3021 2900.0 457.3129 3700.0 523.3633 3200.0 626.561 2500.0 END IONS BEGIN IONS SCANS=612 PEPMASS=532.3486 CHARGE=1 COLLISION_ENERGY=0.0 61.0284 34000.0 65.0387 8100.0 67.0541 680000.0 67.0577 2400.0 67.0586 4400.0 69.0335 8800.0 69.0698 130000.0 71.049 27000.0 71.0854 26000.0 73.0283 8100.0 73.7359 2700.0 75.044 22000.0 77.0388 3600.0 78.1166 2700.0 79.0541 270000.0 81.0698 1100000.0 81.0747 5700.0 83.049 14000.0 83.0854 130000.0 85.0283 67000.0 85.0647 51000.0 85.1012 8500.0 91.0388 44000.0 91.0484 3900.0 91.0541 140000.0 93.0698 520000.0 93.0755 3400.0 93.0767 5600.0 93.3737 2600.0 95.0491 22000.0 95.0853 1000000.0 95.0914 6200.0 97.0283 37000.0 97.0647 52000.0 97.1011 93000.0 99.0439 5300.0 99.0804 51000.0 102.4465 2700.0 105.0697 180000.0 107.0155 2800.0 107.0854 510000.0 109.0285 3200.0 109.0647 18000.0 109.1011 740000.0 109.1111 2500.0 109.1134 4200.0 111.0803 41000.0 111.1167 23000.0 113.096 25000.0 113.8008 2700.0 115.3321 2500.0 117.0697 100000.0 118.6022 2800.0 119.0854 260000.0 121.0912 5300.0 121.101 740000.0 121.1104 8700.0 121.2994 2400.0 123.0803 29000.0 123.1167 430000.0 125.096 32000.0 127.0386 12000.0 127.1119 4900.0 128.073 2600.0 130.8184 2800.0 131.0854 300000.0 133.1011 310000.0 133.1127 9600.0 135.0801 6600.0 135.1043 3100.0 135.1167 730000.0 136.7298 2900.0 137.0959 34000.0 137.1324 160000.0 137.9966 2500.0 139.1117 37000.0 141.4841 2800.0 145.0499 3700.0 145.1011 300000.0 145.1143 4400.0 147.1167 290000.0 149.0961 18000.0 149.1185 3900.0 149.1324 600000.0 149.1464 17000.0 149.5822 2600.0 151.1118 36000.0 151.148 44000.0 153.1272 35000.0 154.9643 2500.0 159.1167 360000.0 159.1318 6000.0 161.1163 3800.0 161.1324 330000.0 161.1479 4900.0 163.112 23000.0 163.1337 8400.0 163.1481 370000.0 165.1274 44000.0 165.1636 13000.0 167.1431 6900.0 173.1182 3100.0 173.1326 430000.0 173.1499 9300.0 173.5004 2600.0 173.5326 85000.0 173.547 4100.0 175.1482 110000.0 177.1275 31000.0 177.1639 120000.0 179.1434 51000.0 181.1231 4800.0 181.1585 6000.0 187.1481 270000.0 189.1639 19000.0 191.1433 35000.0 191.1799 2700.0 193.1581 11000.0 195.1374 3400.0 199.1333 3000.0 201.1639 95000.0 203.1792 12000.0 205.1589 46000.0 209.1536 14000.0 215.18 31000.0 217.1947 8300.0 219.1743 35000.0 223.169 11000.0 233.1894 7400.0 233.1994 3100.0 233.2266 83000.0 236.9581 2800.0 237.1847 3200.0 243.188 2000.0 243.2105 500000.0 243.2333 2100.0 261.2211 1600000.0 261.2456 8100.0 261.2546 5900.0 263.2367 3500.0 264.4438 2400.0 279.1974 4500.0 279.232 81000.0 317.2476 6300.0 335.2127 6100.0 335.2582 330000.0 350.6324 2900.0 353.2683 40000.0 370.2182 2700.0 383.1051 2900.0 408.9656 3500.0 486.5912 2900.0 533.68 2800.0 END IONS BEGIN IONS SCANS=613 PEPMASS=599.4103 CHARGE=1 COLLISION_ENERGY=0.0 65.0101 2300.0 67.0541 47000.0 67.1496 2300.0 69.0334 64000.0 69.0697 53000.0 71.1023 2300.0 71.8244 2300.0 73.7149 2800.0 73.8102 3200.0 73.8999 2400.0 74.0395 2700.0 77.039 3000.0 79.0541 62000.0 80.6242 2200.0 81.0697 220000.0 83.049 70000.0 83.0855 22000.0 85.0647 63000.0 87.8945 2400.0 90.145 2700.0 91.0542 70000.0 92.426 2300.0 93.0698 390000.0 95.049 83000.0 95.0853 280000.0 97.0646 68000.0 105.0617 2900.0 105.0697 280000.0 105.9164 2500.0 107.0854 250000.0 109.0647 100000.0 109.101 120000.0 110.6757 2700.0 111.0432 2300.0 111.0803 59000.0 115.0545 3100.0 117.0698 29000.0 119.0494 4500.0 119.0854 520000.0 119.0954 3400.0 120.1712 3100.0 121.0647 74000.0 121.0911 14000.0 121.101 540000.0 121.5713 2200.0 123.0803 240000.0 123.1167 42000.0 123.8676 2600.0 124.4711 2300.0 125.0596 180000.0 125.0956 9800.0 128.0623 7600.0 129.0697 30000.0 130.308 2300.0 131.0854 160000.0 132.4285 2300.0 133.0646 34000.0 133.0904 5200.0 133.1011 360000.0 133.1125 3300.0 135.0803 300000.0 135.0912 2200.0 135.1167 200000.0 137.0598 32000.0 137.096 400000.0 137.1077 4700.0 139.0753 120000.0 139.1116 11000.0 141.0703 6200.0 142.0777 32000.0 143.0854 190000.0 144.0927 4600.0 145.1011 470000.0 145.1143 4500.0 147.0672 5200.0 147.0803 810000.0 147.1167 120000.0 149.096 110000.0 149.1324 3100.0 151.0753 420000.0 151.0891 3800.0 151.1117 24000.0 153.0909 31000.0 155.0856 77000.0 156.0932 39000.0 157.0863 6300.0 157.101 580000.0 157.1124 5300.0 158.109 11000.0 159.0674 2600.0 159.0805 62000.0 159.1167 360000.0 159.1315 4400.0 160.1256 2600.0 161.0961 210000.0 161.1325 320000.0 163.0767 3100.0 163.1117 470000.0 163.1962 2900.0 165.0784 8200.0 165.091 4000000.0 165.1235 5100.0 167.086 11000.0 167.1065 3800.0 168.0936 23000.0 169.047 2600.0 169.1013 200000.0 170.1092 47000.0 171.0809 16000.0 171.1169 480000.0 171.1301 2300.0 173.0962 160000.0 173.1325 130000.0 173.5213 21000.0 173.5347 140000.0 174.1037 3500.0 175.1118 70000.0 175.1482 120000.0 177.0912 100000.0 177.1278 76000.0 179.0871 3700.0 179.107 45000.0 179.1431 48000.0 179.26 2600.0 179.4199 2700.0 181.0641 2700.0 181.1018 55000.0 181.1224 220000.0 182.1086 15000.0 183.1169 490000.0 184.1255 9900.0 185.0963 34000.0 185.1326 430000.0 185.1513 7100.0 187.1117 84000.0 187.1297 2600.0 187.1482 140000.0 188.1196 7000.0 189.1274 220000.0 190.1356 3500.0 191.1067 270000.0 191.1428 70000.0 193.102 22000.0 193.1221 19000.0 193.5077 3200.0 193.923 2600.0 194.109 12000.0 195.1169 120000.0 195.1379 80000.0 196.1248 45000.0 197.0982 7300.0 197.1326 190000.0 199.1118 79000.0 199.1482 59000.0 201.1274 68000.0 201.164 25000.0 203.1096 2600.0 203.1255 3800.0 203.1431 1600000.0 205.1223 23000.0 205.1588 3100.0 207.117 58000.0 207.1383 290000.0 208.1252 15000.0 209.0978 3700.0 209.1326 180000.0 209.1532 26000.0 210.1403 12000.0 211.1119 63000.0 211.1483 310000.0 211.171 3100.0 212.1575 6300.0 213.1277 92000.0 213.1632 14000.0 214.1353 3000.0 215.1073 11000.0 215.1431 67000.0 217.1227 15000.0 217.1591 23000.0 219.1173 9500.0 219.1389 22000.0 221.104 3500.0 221.1103 3000.0 221.1342 85000.0 221.1537 4300000.0 221.2036 3800.0 221.2511 2900.0 222.1404 3700.0 223.1115 11000.0 223.1485 84000.0 225.1273 72000.0 225.1639 71000.0 227.1433 63000.0 227.1797 54000.0 227.2027 2700.0 229.122 33000.0 229.1591 160000.0 230.131 4000.0 231.1383 120000.0 232.1229 2900.0 233.1317 28000.0 233.1542 73000.0 234.1618 18000.0 235.1478 59000.0 235.1711 13000.0 236.1563 2800.0 237.1274 47000.0 237.1641 51000.0 239.1428 47000.0 239.1792 57000.0 240.1526 6900.0 240.1853 2700.0 241.1231 6200.0 241.1579 28000.0 241.6242 3500.0 243.1382 51000.0 243.1745 14000.0 245.1302 4000.0 245.1551 21000.0 247.1432 9200.0 247.1693 900000.0 247.1991 22000.0 249.1288 5700.0 249.1645 36000.0 250.1691 3100.0 251.1429 35000.0 251.1791 52000.0 252.1898 2600.0 253.1587 31000.0 253.1937 14000.0 255.1383 26000.0 255.1738 17000.0 257.1541 39000.0 257.1879 6400.0 260.1565 3500.0 261.1604 14000.0 261.1862 44000.0 263.1431 6700.0 263.179 47000.0 265.1593 37000.0 265.1931 21000.0 267.1412 6800.0 267.175 22000.0 268.1829 3000.0 269.1575 19000.0 269.19 92000.0 271.1694 48000.0 272.1778 2700.0 273.1624 14000.0 273.1879 4000.0 274.1947 22000.0 275.1786 22000.0 277.1595 5300.0 277.1951 4700.0 279.1744 18000.0 281.1906 87000.0 283.1715 13000.0 283.2059 16000.0 285.1851 81000.0 286.1931 120000.0 287.2009 680000.0 287.2378 14000.0 289.1955 25000.0 291.1747 29000.0 291.209 3300.0 293.1901 51000.0 295.2065 25000.0 298.1936 18000.0 299.2008 220000.0 301.2173 21000.0 303.2116 3000.0 305.1899 3300.0 307.2061 28000.0 309.1847 50000.0 309.2221 12000.0 310.193 12000.0 311.2009 140000.0 312.2092 38000.0 313.2165 220000.0 317.1913 9100.0 321.1833 3600.0 321.223 6600.0 324.2089 20000.0 325.2169 120000.0 327.2321 310000.0 329.228 4600.0 333.2227 3600.0 335.2005 27000.0 339.2327 22000.0 347.237 30000.0 351.2346 7400.0 363.2312 17000.0 364.2397 17000.0 365.2475 200000.0 373.2515 33000.0 376.2385 6100.0 377.2487 3100.0 387.2537 6800.0 390.4112 3000.0 391.2633 190000.0 401.2857 9400.0 409.2664 3100.0 412.2595 2700.0 413.2686 210000.0 413.3221 2800.0 419.2948 260000.0 427.2344 2200.0 427.2846 460000.0 427.3505 7300.0 445.2908 3300.0 453.3 110000.0 472.3805 2400.0 472.7334 2600.0 479.3137 12000.0 486.8534 2900.0 492.3272 3100.0 504.3177 2900.0 507.3471 58000.0 519.3462 170000.0 526.6768 2600.0 535.882 2500.0 543.35 4000.0 581.3991 19000.0 589.5659 2600.0 599.4093 140000.0 END IONS BEGIN IONS SCANS=614 PEPMASS=478.2935 CHARGE=1 COLLISION_ENERGY=0.0 61.4223 2400.0 61.5965 2300.0 62.0597 83000.0 67.054 60000.0 69.0696 32000.0 70.1157 2200.0 75.255 2600.0 79.054 14000.0 80.258 2400.0 81.0695 83000.0 82.4632 2500.0 83.0851 29000.0 87.8222 2300.0 88.22 2400.0 91.0537 5200.0 93.0697 29000.0 93.283 2500.0 95.0851 73000.0 97.1007 17000.0 98.9842 19000.0 99.0794 2800.0 105.0696 8900.0 107.0853 25000.0 109.1009 35000.0 112.4038 2400.0 119.0852 8500.0 121.1009 30000.0 123.1165 21000.0 132.6251 2200.0 133.1007 15000.0 134.4756 2300.0 135.1167 19000.0 135.1944 2800.0 136.4146 2800.0 137.1322 10000.0 140.3049 2600.0 147.1162 12000.0 149.1317 4700.0 155.01 21000.0 161.1322 4700.0 161.9262 2400.0 163.1485 5100.0 173.0216 3000.0 173.524 19000.0 173.5374 43000.0 173.5443 6200.0 175.1478 5800.0 189.9952 2600.0 191.0805 2900.0 196.8277 2400.0 198.0532 3400.0 217.1736 2700.0 238.4011 2500.0 263.2362 17000.0 306.2791 76000.0 319.2696 2500.0 325.2352 2700.0 337.274 340000.0 337.3182 8700.0 338.8386 2600.0 343.7589 2300.0 344.4452 2500.0 362.0969 2500.0 END IONS BEGIN IONS SCANS=615 PEPMASS=520.3405 CHARGE=1 COLLISION_ENERGY=0.0 60.0805 100000.0 63.005 2300.0 64.2339 2300.0 65.424 2500.0 66.9473 2100.0 67.0539 9100.0 67.4082 2600.0 69.0695 9800.0 70.9422 2300.0 71.0727 22000.0 78.6208 2400.0 81.0695 19000.0 82.9006 2500.0 84.1556 2800.0 86.0961 390000.0 93.0695 2900.0 94.7939 2600.0 95.0852 12000.0 98.9841 4700.0 104.0975 2600.0 104.1067 1700000.0 104.1154 18000.0 104.1192 7600.0 104.1228 7600.0 107.0848 3400.0 109.1011 2700.0 123.1171 2400.0 124.9995 130000.0 163.0151 12000.0 163.316 2300.0 166.1078 2700.0 173.5236 18000.0 173.5334 25000.0 173.5417 11000.0 181.0265 6500.0 184.0352 5800.0 184.0733 2500000.0 184.0928 5200.0 207.2448 2400.0 223.887 2400.0 236.1429 2800.0 258.1104 36000.0 332.4041 2500.0 337.2745 45000.0 368.6182 2500.0 378.6516 2600.0 387.3564 2500.0 443.2575 19000.0 502.3307 78000.0 520.3419 25000.0 END IONS BEGIN IONS SCANS=616 PEPMASS=532.3486 CHARGE=1 COLLISION_ENERGY=0.0 60.4057 2300.0 67.0538 69000.0 68.0166 2500.0 69.0694 13000.0 71.0852 2300.0 78.3158 2700.0 79.0537 31000.0 81.0694 110000.0 83.0852 14000.0 85.0279 9300.0 85.0645 3100.0 85.9385 2700.0 88.2772 2200.0 91.0389 2700.0 91.0539 15000.0 93.0694 54000.0 95.0849 96000.0 97.0288 2600.0 97.1008 7100.0 99.0798 6200.0 105.0693 20000.0 107.085 57000.0 109.1007 79000.0 111.0802 6100.0 113.0955 2700.0 117.0695 7200.0 119.085 26000.0 121.1007 81000.0 123.1163 43000.0 125.0957 3200.0 131.0851 35000.0 133.1007 32000.0 135.1164 82000.0 137.0959 2400.0 137.1322 18000.0 139.1112 3000.0 145.1005 35000.0 147.1163 33000.0 149.0967 2800.0 149.132 70000.0 151.1113 2900.0 159.1165 40000.0 161.1319 32000.0 163.1478 43000.0 173.1324 44000.0 173.5326 46000.0 175.1481 14000.0 177.1635 16000.0 179.1425 2600.0 187.1477 32000.0 201.1647 8900.0 205.1586 7000.0 208.9367 2500.0 233.2266 10000.0 243.2103 61000.0 261.1896 5200.0 261.2209 200000.0 299.0627 2600.0 325.1267 2700.0 335.2581 21000.0 353.27 3200.0 372.1102 2700.0 END IONS BEGIN IONS SCANS=617 PEPMASS=353.269 CHARGE=1 COLLISION_ENERGY=0.0 52.7254 2500.0 55.054 14000.0 57.0334 8900.0 57.0696 9800.0 63.4802 2300.0 65.9637 2600.0 67.0538 98000.0 69.0696 21000.0 69.668 2500.0 71.0856 2600.0 73.0279 2100.0 74.1776 2200.0 76.0004 2400.0 79.0538 45000.0 81.0646 3100.0 81.0694 130000.0 83.0852 12000.0 84.0152 3200.0 91.0539 21000.0 93.0695 81000.0 95.0795 4700.0 95.0852 110000.0 95.1805 3000.0 97.0648 3200.0 97.1008 8900.0 105.0696 23000.0 107.0852 69000.0 109.1008 59000.0 117.0695 11000.0 119.0767 2600.0 119.0852 26000.0 121.1008 69000.0 121.5334 2600.0 122.0282 2500.0 123.1165 29000.0 131.0851 36000.0 133.1009 27000.0 135.0437 14000.0 135.1165 65000.0 137.1322 8200.0 145.101 29000.0 147.1165 25000.0 149.1322 44000.0 151.0757 3200.0 159.1165 25000.0 161.1323 22000.0 163.1475 20000.0 173.1324 27000.0 173.5289 42000.0 173.5447 6600.0 175.1482 7800.0 177.1633 5800.0 183.2465 2500.0 186.4872 2200.0 187.1479 13000.0 194.108 2200.0 201.0916 6100.0 201.1647 4100.0 243.2101 15000.0 252.078 2700.0 261.221 41000.0 268.0739 2700.0 270.6366 2600.0 282.0886 5800.0 304.1107 3700.0 305.1159 2600.0 END IONS BEGIN IONS SCANS=618 PEPMASS=203.1796 CHARGE=1 COLLISION_ENERGY=0.0 41.0385 8200.0 46.1439 2300.0 53.0564 2200.0 55.054 74000.0 56.8106 2500.0 57.0696 14000.0 58.7427 2300.0 59.9475 2300.0 65.0384 2300.0 65.7031 2400.0 67.0507 2800.0 67.0539 74000.0 69.0695 72000.0 70.1654 2200.0 70.9419 3600.0 72.3656 2600.0 79.0539 37000.0 81.0646 3300.0 81.0694 140000.0 83.0851 24000.0 87.9873 2500.0 91.0538 66000.0 93.0693 84000.0 95.0488 7200.0 95.0785 3300.0 95.085 200000.0 97.101 3600.0 99.5357 2500.0 103.054 3000.0 105.0617 4500.0 105.0694 240000.0 105.0781 2200.0 105.132 2400.0 107.0852 98000.0 109.1008 130000.0 111.9681 10000.0 117.0695 8200.0 119.0755 3300.0 119.0851 250000.0 119.0939 4700.0 119.2638 2400.0 121.1008 71000.0 123.0801 2500.0 123.1165 14000.0 131.0853 16000.0 133.1008 300000.0 133.1111 2500.0 133.9746 2600.0 135.1164 30000.0 145.1008 21000.0 146.1086 2500.0 147.1165 200000.0 148.1912 2300.0 157.2505 2500.0 159.1167 11000.0 160.1244 14000.0 161.1322 49000.0 173.5219 11000.0 173.5302 14000.0 173.542 21000.0 174.139 3800.0 175.1482 24000.0 196.6796 2600.0 202.0792 3400.0 203.0849 16000.0 203.1792 37000.0 210.413 2400.0 END IONS BEGIN IONS SCANS=619 PEPMASS=355.227 CHARGE=1 COLLISION_ENERGY=0.0 55.054 73000.0 57.0697 27000.0 59.2094 2600.0 59.9083 2700.0 62.0677 2000.0 63.1562 2400.0 63.9635 2500.0 65.2465 2500.0 65.7387 2700.0 66.8441 2000.0 67.0539 76000.0 69.014 2300.0 69.0695 120000.0 73.8899 2300.0 77.0386 2400.0 79.054 41000.0 80.0498 2300.0 80.4357 2200.0 81.0655 3200.0 81.0696 170000.0 83.0852 46000.0 85.6626 2600.0 89.1931 2300.0 90.3146 2400.0 91.0539 44000.0 92.7661 2900.0 93.0631 2800.0 93.0695 280000.0 95.0488 4400.0 95.0792 3400.0 95.0852 200000.0 97.1009 58000.0 101.0001 2700.0 101.4445 2200.0 103.6177 2300.0 103.6253 2600.0 105.0696 68000.0 106.0628 2400.0 107.0488 7900.0 107.0852 300000.0 109.0648 8300.0 109.0928 7400.0 109.1009 280000.0 119.0852 62000.0 121.0642 15000.0 121.0913 2400.0 121.1009 180000.0 123.1165 93000.0 126.0346 2500.0 131.0839 2100.0 133.101 52000.0 135.0438 36000.0 135.1055 8900.0 135.1166 280000.0 137.0595 2900.0 137.1324 11000.0 139.0252 2300.0 147.0438 16000.0 147.0801 21000.0 147.1166 85000.0 149.1324 90000.0 151.0388 3200.0 159.044 28000.0 159.0805 15000.0 160.5295 2400.0 161.0593 5600.0 161.1324 13000.0 163.1482 25000.0 165.0546 1700000.0 173.0596 44000.0 173.0963 3400.0 173.5211 13000.0 173.5359 76000.0 175.0758 3100.0 175.1484 32000.0 177.055 19000.0 177.1633 29000.0 179.0704 120000.0 179.0857 2400.0 185.0596 4600.0 187.0756 49000.0 189.055 56000.0 189.1641 50000.0 190.1712 23000.0 191.0703 53000.0 191.1794 58000.0 193.0857 20000.0 199.0756 22000.0 199.1131 3300.0 201.0911 34000.0 203.0704 90000.0 204.889 3400.0 205.0867 36000.0 211.0754 3700.0 213.0913 11000.0 214.8737 34000.0 215.107 2400.0 217.0863 36000.0 218.869 29000.0 225.0914 4800.0 227.1068 25000.0 229.0869 10000.0 230.8681 3300.0 231.1023 52000.0 239.1057 3900.0 241.1229 6700.0 243.1015 56000.0 245.1172 23000.0 253.1254 2800.0 253.2798 2500.0 257.1172 14000.0 257.2468 2200.0 259.1337 14000.0 267.1381 16000.0 271.134 12000.0 273.148 7000.0 280.9055 2900.0 283.5749 2500.0 285.148 15000.0 290.8903 11000.0 299.1638 9800.0 308.901 82000.0 312.7235 2600.0 313.182 2900.0 323.2057 4100.0 332.0762 2500.0 355.228 32000.0 END IONS BEGIN IONS SCANS=620 PEPMASS=313.1802 CHARGE=1 COLLISION_ENERGY=0.0 48.1499 2500.0 48.3484 2300.0 54.3094 2400.0 55.054 3100.0 55.2046 2400.0 55.543 2300.0 57.0332 3200.0 57.0697 12000.0 65.7946 2200.0 67.054 16000.0 69.0696 11000.0 71.0847 2200.0 79.0539 34000.0 81.0695 62000.0 84.7902 2400.0 91.0539 21000.0 93.0695 92000.0 95.0852 43000.0 102.8612 2400.0 105.0336 7200.0 105.0696 59000.0 107.0852 94000.0 109.0646 13000.0 109.1009 11000.0 114.9654 2400.0 119.0852 27000.0 121.0645 6200.0 121.1008 35000.0 133.0289 2400.0 133.1014 11000.0 135.0438 29000.0 135.1166 48000.0 137.0595 9300.0 145.1013 2800.0 145.7627 2400.0 147.0799 2700.0 147.1166 64000.0 148.1246 10000.0 149.1202 3000.0 149.1323 140000.0 153.9475 2800.0 159.0432 6300.0 159.0804 10000.0 159.733 2400.0 160.086 2600.0 161.0962 2500.0 161.1324 20000.0 162.0955 2500.0 165.0546 1000000.0 173.0593 6500.0 173.5221 15000.0 173.5408 30000.0 177.0546 3400.0 179.0704 22000.0 185.0606 2900.0 187.0754 15000.0 189.0547 17000.0 191.0696 3300.0 196.1299 2200.0 197.0968 2700.0 197.198 2400.0 199.076 8300.0 201.0917 9900.0 203.0703 13000.0 205.0864 7100.0 217.0857 13000.0 219.1002 3000.0 221.0938 3000.0 225.0907 12000.0 231.1022 7000.0 247.6853 2300.0 253.156 6200.0 281.1538 14000.0 313.1795 8500.0 END IONS BEGIN IONS SCANS=621 PEPMASS=299.1646 CHARGE=1 COLLISION_ENERGY=0.0 48.7386 2500.0 51.4422 2900.0 52.5752 2500.0 54.9181 2300.0 55.0177 5600.0 55.054 18000.0 56.9561 2100.0 57.0697 5000.0 58.0972 2400.0 61.452 2400.0 62.4179 2600.0 62.7028 2300.0 62.9728 2500.0 65.085 2400.0 67.054 18000.0 69.0696 13000.0 73.0284 2400.0 77.0384 13000.0 79.0539 34000.0 81.0653 2700.0 81.0696 80000.0 86.6735 2300.0 87.2447 2200.0 91.0539 34000.0 93.0695 75000.0 95.0489 15000.0 95.0852 38000.0 97.0645 16000.0 105.0334 3100.0 105.0696 42000.0 107.0488 79000.0 107.0852 75000.0 109.0645 32000.0 109.1009 14000.0 111.0801 35000.0 112.0757 2400.0 117.0696 14000.0 119.0487 2600.0 119.0854 19000.0 121.0645 31000.0 121.1008 12000.0 123.08 64000.0 123.1161 9500.0 127.0752 18000.0 128.3705 3000.0 131.0475 2600.0 131.0856 20000.0 133.0179 3300.0 133.0281 180000.0 133.0646 36000.0 133.1008 18000.0 134.0361 5700.0 135.0437 280000.0 135.0557 2900.0 135.1165 9000.0 137.0953 4700.0 142.1488 2700.0 145.0644 24000.0 145.1007 16000.0 146.1091 2600.0 147.0437 31000.0 147.0557 2800.0 147.0804 24000.0 147.1165 65000.0 149.0593 33000.0 149.1322 3100.0 151.0387 110000.0 151.1117 14000.0 155.0852 3300.0 158.0722 9700.0 159.0436 2600.0 159.0803 21000.0 159.1165 21000.0 161.06 7400.0 161.096 24000.0 165.0549 19000.0 165.1272 79000.0 171.0802 11000.0 173.0596 2700.0 173.0962 7000.0 173.5248 14000.0 173.5391 28000.0 175.0759 14000.0 175.1138 2700.0 177.0543 6500.0 177.1271 2900.0 183.0802 8000.0 185.0963 11000.0 187.0752 15000.0 188.4965 2600.0 189.0911 55000.0 197.0967 8200.0 199.0758 3600.0 201.091 48000.0 203.1054 2700.0 211.1128 2400.0 213.0915 2900.0 226.6842 2500.0 231.1035 3600.0 239.1054 3700.0 251.2261 2800.0 267.2425 2300.0 281.1534 6800.0 282.2795 7300.0 284.067 2600.0 299.0914 41000.0 299.1278 2500.0 299.1649 24000.0 END IONS BEGIN IONS SCANS=622 PEPMASS=618.4283 CHARGE=1 COLLISION_ENERGY=0.0 64.5696 2200.0 67.054 28000.0 67.8054 2300.0 69.0333 20000.0 69.0695 33000.0 71.0489 16000.0 72.0486 2200.0 72.4963 2500.0 73.7034 2400.0 74.2434 2300.0 79.0538 37000.0 79.2854 2600.0 81.0694 130000.0 82.8644 2500.0 83.0488 41000.0 83.0851 180000.0 84.0725 2500.0 85.0645 22000.0 87.044 7900.0 87.5466 2400.0 91.0538 38000.0 93.0695 130000.0 93.6514 2300.0 95.0488 68000.0 95.0794 2400.0 95.0852 93000.0 95.9599 2300.0 97.0644 81000.0 97.101 3100.0 99.0441 13000.0 99.0804 5900.0 105.0695 130000.0 107.0489 12000.0 107.0851 200000.0 109.0644 42000.0 109.1008 100000.0 111.0802 20000.0 111.1167 3200.0 113.0596 3100.0 113.0958 44000.0 115.0546 2700.0 117.0696 19000.0 119.0757 2700.0 119.0851 210000.0 120.0929 4000.0 121.0642 23000.0 121.1008 200000.0 123.0801 66000.0 123.1165 24000.0 124.0885 2700.0 125.0957 82000.0 128.0623 6400.0 129.0696 17000.0 130.0779 2700.0 131.0852 100000.0 132.093 19000.0 132.1489 2300.0 133.0646 6900.0 133.1008 170000.0 135.08 41000.0 135.1164 38000.0 136.0888 3200.0 137.0957 26000.0 139.1114 68000.0 139.1216 2700.0 141.0911 2500.0 142.0778 18000.0 142.8144 2700.0 143.0852 110000.0 144.0929 27000.0 145.0649 7300.0 145.1008 240000.0 146.1084 6500.0 147.0801 38000.0 147.1164 87000.0 149.0958 53000.0 149.1319 10000.0 151.0752 8700.0 151.1112 13000.0 153.0903 4200.0 153.1273 7000.0 153.1829 2400.0 155.0851 36000.0 155.1063 34000.0 156.0928 32000.0 157.0865 2900.0 157.1008 210000.0 158.1082 19000.0 159.0801 44000.0 159.1025 2800.0 159.1166 140000.0 160.0879 55000.0 161.0958 60000.0 161.132 21000.0 163.1114 23000.0 165.0915 8500.0 165.1268 10000.0 167.0843 2400.0 167.0877 12000.0 167.1064 120000.0 167.1423 6400.0 168.0924 2900.0 169.1011 85000.0 169.1191 3600.0 170.1087 22000.0 171.0812 2600.0 171.1004 8200.0 171.1167 150000.0 172.1247 6800.0 173.096 42000.0 173.1324 77000.0 173.5268 32000.0 173.5388 45000.0 174.1035 2900.0 175.1116 48000.0 175.1482 16000.0 177.127 8800.0 179.0855 10000.0 179.1068 2800.0 179.1428 34000.0 181.101 41000.0 181.1221 74000.0 182.1093 31000.0 183.1166 110000.0 183.1365 15000.0 184.1241 17000.0 185.0959 18000.0 185.1325 100000.0 186.1031 2700.0 186.1398 16000.0 187.1115 31000.0 187.1478 49000.0 188.0203 2900.0 189.1269 30000.0 190.1343 3700.0 191.143 48000.0 193.1011 20000.0 194.1091 16000.0 195.1166 82000.0 195.1365 3700.0 196.1243 27000.0 197.0987 8200.0 197.1323 180000.0 198.14 15000.0 199.112 29000.0 199.148 75000.0 200.1191 2700.0 201.1275 18000.0 201.1635 14000.0 203.1428 27000.0 205.1574 3500.0 206.1093 4800.0 207.1164 43000.0 207.138 23000.0 208.1244 21000.0 208.1457 6900.0 209.1323 110000.0 209.1535 13000.0 210.1403 20000.0 211.1122 14000.0 211.1481 99000.0 212.1195 3000.0 212.1556 17000.0 213.1272 36000.0 213.1638 28000.0 215.143 67000.0 217.1591 11000.0 219.117 7600.0 220.1244 12000.0 221.1319 51000.0 221.1538 56000.0 222.1407 16000.0 223.148 74000.0 224.1554 8200.0 225.1264 19000.0 225.1639 34000.0 227.1432 27000.0 227.1796 5900.0 229.1586 9800.0 231.1731 6700.0 233.1325 17000.0 233.1538 180000.0 234.1392 8800.0 235.1481 52000.0 236.1563 11000.0 237.1267 4400.0 237.1639 54000.0 239.1433 11000.0 239.1791 15000.0 241.1588 16000.0 245.1313 8000.0 245.1557 4800.0 246.1376 7800.0 246.1625 16000.0 247.1471 24000.0 247.1711 14000.0 248.1554 3300.0 249.1635 53000.0 250.1708 4300.0 251.1442 6800.0 251.179 30000.0 253.1591 20000.0 253.1948 6400.0 255.174 120000.0 257.1885 5500.0 259.1478 16000.0 260.1546 9600.0 261.1637 39000.0 263.1488 2400.0 263.1793 31000.0 264.1871 2900.0 265.1583 14000.0 265.1953 22000.0 267.1746 19000.0 268.1811 7700.0 269.1899 17000.0 270.1961 5300.0 271.2029 6400.0 273.1606 4500.0 273.1871 18000.0 275.1795 27000.0 277.1955 18000.0 279.1746 17000.0 279.2095 5800.0 281.1901 24000.0 282.1979 4200.0 283.2066 8800.0 285.1862 15000.0 286.1935 15000.0 287.1755 3700.0 287.2033 5400.0 288.0089 2400.0 289.1955 21000.0 291.1739 3200.0 291.2104 4700.0 293.19 14000.0 294.1957 3500.0 295.2061 19000.0 298.1935 5800.0 299.2027 18000.0 301.1944 14000.0 301.585 3100.0 303.2099 3900.0 307.2067 4200.0 311.2005 8700.0 313.1946 2900.0 315.2114 3300.0 317.2249 4400.0 321.2193 5900.0 331.2458 3100.0 333.224 3000.0 337.2539 7300.0 345.2203 3000.0 347.2355 3400.0 349.2507 3100.0 353.2481 2500.0 354.25 2900.0 359.2389 2600.0 361.2523 2800.0 365.2469 12000.0 373.2567 4100.0 399.2673 7800.0 450.2859 2600.0 457.3063 3300.0 575.4084 2500.0 600.1047 2300.0 END IONS BEGIN IONS SCANS=623 PEPMASS=599.4102 CHARGE=1 COLLISION_ENERGY=0.0 67.0538 6800.0 67.9201 2900.0 69.0334 3000.0 69.0697 12000.0 73.9858 2200.0 79.0537 2600.0 79.1844 2300.0 81.0696 42000.0 83.0487 7900.0 83.0849 6200.0 83.1191 2100.0 85.0643 11000.0 87.9212 2300.0 89.8027 3100.0 91.0533 2800.0 93.0696 49000.0 95.049 9900.0 95.0853 37000.0 95.5816 2200.0 97.0643 8200.0 97.0756 2600.0 105.0695 45000.0 107.07 2200.0 107.0852 52000.0 108.6838 2100.0 109.0646 15000.0 109.1007 25000.0 111.0803 2700.0 111.2212 2800.0 119.0852 73000.0 121.0645 6100.0 121.1007 77000.0 121.5321 2300.0 123.0801 37000.0 123.1165 3600.0 125.0591 23000.0 131.0852 26000.0 133.1008 63000.0 135.08 34000.0 135.1165 23000.0 137.0957 47000.0 139.0752 6200.0 141.9198 2600.0 143.085 31000.0 145.1008 79000.0 147.08 92000.0 147.1167 24000.0 149.0956 14000.0 151.0749 50000.0 155.0856 6900.0 156.0924 2700.0 157.1007 75000.0 159.1166 54000.0 161.096 26000.0 161.1318 36000.0 163.1115 54000.0 165.0756 4500.0 165.0908 430000.0 165.1065 5400.0 167.1064 6200.0 169.101 32000.0 171.1166 73000.0 173.0963 14000.0 173.1324 21000.0 173.5289 44000.0 173.5423 18000.0 175.1105 3000.0 175.1476 14000.0 177.091 8700.0 177.1277 3300.0 179.1436 3300.0 181.1009 6800.0 181.122 21000.0 183.1166 60000.0 184.1239 3000.0 185.1324 51000.0 187.1116 7300.0 187.148 13000.0 189.1269 27000.0 191.106 29000.0 191.1422 6800.0 193.1016 2800.0 193.1201 2800.0 195.1166 20000.0 195.1364 9700.0 196.1265 2900.0 197.132 31000.0 199.1121 3000.0 199.1479 4100.0 201.1269 7900.0 203.143 170000.0 207.1163 11000.0 207.1376 35000.0 207.4949 2600.0 209.1322 34000.0 211.1124 6000.0 211.1479 41000.0 213.1284 3200.0 215.1409 2700.0 221.1327 19000.0 221.1536 420000.0 223.148 12000.0 225.1269 3400.0 225.1632 7600.0 229.1584 16000.0 231.1369 15000.0 233.1538 14000.0 235.1472 3500.0 239.1405 6800.0 247.1693 72000.0 261.2152 2600.0 263.1769 3100.0 269.1892 8600.0 281.1908 6500.0 285.1867 11000.0 286.1937 9600.0 287.2008 79000.0 289.2037 2500.0 299.2009 23000.0 311.1999 9100.0 313.216 48000.0 320.1853 2800.0 325.2148 12000.0 327.2315 23000.0 364.2386 3400.0 365.246 14000.0 374.9988 2300.0 377.4676 2500.0 386.5625 2300.0 391.2622 13000.0 413.2686 6700.0 419.2931 18000.0 427.285 36000.0 427.3552 2500.0 453.2978 9200.0 464.7291 2600.0 466.3105 3400.0 507.347 28000.0 509.2549 2900.0 519.3446 8100.0 527.2557 3500.0 527.2679 7300.0 537.2509 2600.0 599.4079 9800.0 END IONS BEGIN IONS SCANS=624 PEPMASS=205.1954 CHARGE=1 COLLISION_ENERGY=0.0 41.0385 61000.0 43.0177 28000.0 43.0542 25000.0 46.1079 2100.0 47.8792 2400.0 49.875 2700.0 50.3413 2500.0 50.5538 2400.0 50.8304 2200.0 51.1156 2100.0 51.5774 2500.0 51.9709 2800.0 52.7485 2500.0 53.0384 15000.0 53.0635 2200.0 53.6527 2500.0 55.054 570000.0 55.1469 2300.0 55.9342 74000.0 56.1964 2400.0 56.6116 2300.0 57.0672 2300.0 57.0696 150000.0 57.5966 2600.0 58.1321 2400.0 58.9156 2700.0 59.8811 2600.0 60.8642 2300.0 61.9183 2000.0 64.7901 2200.0 64.9464 3100.0 67.0539 370000.0 67.1369 2300.0 69.0695 690000.0 71.0853 13000.0 71.5004 2100.0 71.9402 2100.0 72.9368 510000.0 73.0165 2400.0 73.0282 5000.0 75.2977 2400.0 77.0386 5700.0 77.3427 2300.0 78.3343 2300.0 79.0539 380000.0 79.7625 2300.0 81.0695 1300000.0 81.0778 3000.0 83.0852 180000.0 83.4278 2500.0 87.4355 2500.0 88.4507 2500.0 88.9448 2500.0 90.9473 380000.0 91.0539 150000.0 93.0695 1600000.0 93.0759 3600.0 93.8354 2300.0 95.049 36000.0 95.0851 750000.0 97.1008 92000.0 99.5551 2300.0 99.9476 96000.0 101.0368 2200.0 101.051 2700.0 101.4075 2400.0 105.0695 140000.0 107.0851 1000000.0 107.093 2400.0 107.8701 2300.0 107.9505 2300.0 108.958 19000.0 109.0642 8100.0 109.0927 9200.0 109.1008 540000.0 111.1165 8200.0 113.4175 2900.0 113.9549 23000.0 113.9634 1000000.0 115.9426 17000.0 116.6696 2200.0 119.0854 38000.0 119.5101 2300.0 121.0911 15000.0 121.1008 1700000.0 121.1096 3800.0 121.1112 18000.0 123.0801 680000.0 123.1165 220000.0 125.1416 2300.0 126.7327 2500.0 128.9506 8500.0 130.7547 2200.0 131.0065 2200.0 131.974 150000.0 133.0752 2600.0 133.101 4200.0 133.9534 17000.0 134.2393 2400.0 135.1057 5100.0 135.1165 390000.0 135.7225 2200.0 137.1324 16000.0 141.699 2300.0 143.3799 2400.0 147.1165 2700.0 149.1203 3200.0 149.1322 470000.0 152.2987 2700.0 154.9891 8100.0 163.1109 3100.0 163.1479 50000.0 173.0385 2400.0 173.5207 8800.0 173.5344 97000.0 174.3778 2500.0 175.495 2200.0 181.4495 2500.0 182.2106 2300.0 185.2526 2300.0 186.5117 2600.0 198.4708 2400.0 202.117 2700.0 205.1946 17000.0 210.4762 2400.0 215.5585 2900.0 END IONS BEGIN IONS SCANS=625 PEPMASS=299.1647 CHARGE=1 COLLISION_ENERGY=0.0 52.372 2300.0 52.8867 2400.0 54.1142 2500.0 55.0176 5000.0 55.0541 12000.0 55.5438 2200.0 59.1508 2400.0 64.6611 2200.0 67.0539 22000.0 69.0695 14000.0 75.8948 2800.0 77.0382 6900.0 79.0538 26000.0 81.0654 2300.0 81.0695 72000.0 82.3015 2400.0 83.649 2600.0 91.0539 28000.0 93.0695 60000.0 95.0488 11000.0 95.0852 38000.0 97.0646 11000.0 100.8276 2200.0 101.3878 2400.0 105.0695 34000.0 107.0487 49000.0 107.0851 45000.0 109.0646 18000.0 109.1007 18000.0 111.0802 10000.0 117.0697 6600.0 119.0484 2500.0 119.0853 16000.0 121.0643 17000.0 121.1005 9500.0 122.9245 2500.0 123.0799 29000.0 123.1163 13000.0 127.0752 6100.0 131.0849 15000.0 133.0279 150000.0 133.0644 35000.0 133.1011 14000.0 134.036 2600.0 135.0436 230000.0 145.0645 21000.0 145.1003 13000.0 146.1089 3200.0 147.0436 23000.0 147.0799 30000.0 147.1163 30000.0 149.0592 28000.0 149.0714 3200.0 151.0385 88000.0 154.1045 2700.0 157.0642 7900.0 158.0718 7100.0 159.0802 20000.0 159.1166 8500.0 161.0594 12000.0 161.0958 21000.0 165.1272 33000.0 171.0807 6500.0 173.0603 4400.0 173.0962 7800.0 173.5249 17000.0 173.5382 23000.0 173.5441 6100.0 175.075 13000.0 175.1113 5200.0 177.0542 13000.0 183.0809 7500.0 185.0957 8100.0 187.0751 16000.0 189.0904 29000.0 196.3156 2400.0 197.096 7200.0 197.3538 2800.0 199.0755 10000.0 201.0909 26000.0 205.0871 2400.0 211.1113 6300.0 213.0906 7600.0 231.1017 2400.0 235.6292 2600.0 243.1379 3200.0 246.8831 2300.0 269.1507 3000.0 281.1544 8400.0 282.2785 7900.0 284.067 7100.0 299.0913 42000.0 299.1642 26000.0 302.5746 2600.0 END IONS BEGIN IONS SCANS=626 PEPMASS=264.2325 CHARGE=1 COLLISION_ENERGY=0.0 46.0813 2500.0 47.5349 2300.0 47.6225 2300.0 48.4984 2200.0 48.9112 2100.0 49.4122 2300.0 51.9094 2600.0 52.1928 2800.0 52.5126 3000.0 53.7081 2500.0 54.3473 2100.0 55.0541 120000.0 55.8488 2400.0 57.0697 92000.0 57.079 2300.0 57.7449 2500.0 57.8516 2900.0 59.2143 2300.0 59.2435 2400.0 59.5029 2200.0 60.0403 3900.0 60.0442 3600000.0 60.0477 14000.0 60.0495 13000.0 61.529 2500.0 62.0965 2100.0 62.1637 2000.0 62.5531 3000.0 62.6107 2200.0 63.2561 2700.0 66.7856 2300.0 67.0539 120000.0 67.4702 2200.0 67.5841 2400.0 67.6054 2400.0 68.5949 2300.0 68.7177 2200.0 69.0695 360000.0 69.9401 2200.0 71.0852 19000.0 73.3998 2300.0 75.3221 5300.0 75.703 2700.0 76.1899 2400.0 78.8609 2300.0 79.0539 140000.0 79.169 2400.0 81.0695 1600000.0 81.0779 6300.0 81.7978 2200.0 82.6939 2100.0 83.0852 120000.0 83.2827 2200.0 84.9842 2300.0 85.4463 2500.0 85.7013 2400.0 89.2271 2900.0 90.7113 2200.0 91.054 34000.0 91.0696 2600.0 91.1984 2300.0 93.0695 860000.0 93.08 2400.0 93.46 2100.0 93.7408 2300.0 94.7366 2800.0 95.049 2600.0 95.0852 750000.0 97.1009 120000.0 97.8524 2500.0 99.623 2800.0 99.7354 2300.0 100.7656 2400.0 101.1238 2400.0 104.7359 2400.0 105.0697 39000.0 105.1368 2900.0 106.6647 2400.0 107.0852 650000.0 107.7607 2500.0 109.0927 8000.0 109.1008 680000.0 111.1166 35000.0 112.9835 2800.0 119.0853 8400.0 121.0911 10000.0 121.1008 4100000.0 121.1108 81000.0 123.1165 310000.0 125.9048 3100.0 133.0754 2500.0 134.9902 2500.0 135.1056 3100.0 135.1166 510000.0 136.5186 2100.0 137.1325 40000.0 137.6593 2300.0 139.3848 2300.0 141.0242 2200.0 143.0687 2500.0 143.1009 2900.0 146.2566 2600.0 147.1165 2300.0 147.3808 2500.0 149.1187 12000.0 149.1322 1400000.0 149.1462 35000.0 154.0448 2300.0 159.6176 2500.0 160.4654 2600.0 160.9837 2300.0 163.148 86000.0 163.1921 2300.0 167.9282 2400.0 172.8156 2300.0 173.5251 100000.0 173.5405 88000.0 174.7906 2400.0 176.6153 2400.0 177.1633 2600.0 180.0822 3000.0 188.2152 2400.0 189.1636 11000.0 201.6203 2300.0 201.6333 2600.0 202.9428 2300.0 205.1735 4200.0 205.1952 630000.0 206.1892 6100.0 206.9037 2500.0 208.1902 2300.0 209.2717 2400.0 211.1234 2300.0 218.3739 2900.0 218.5443 2300.0 219.4278 2400.0 223.3028 2800.0 223.4959 2400.0 236.0699 2700.0 248.5489 2400.0 258.8523 2400.0 263.3905 2500.0 264.2323 170000.0 266.6282 2300.0 END IONS BEGIN IONS SCANS=627 PEPMASS=355.227 CHARGE=1 COLLISION_ENERGY=0.0 55.054 29000.0 57.0696 9300.0 57.1806 2200.0 64.0727 2400.0 66.6923 2300.0 66.9409 2300.0 67.0539 25000.0 69.0695 40000.0 69.5082 2300.0 70.0274 2400.0 70.5678 2400.0 74.2722 2300.0 78.552 2700.0 79.0539 35000.0 81.0695 220000.0 83.0851 37000.0 84.4419 2600.0 89.2665 2100.0 91.0539 31000.0 93.0639 3200.0 93.0695 130000.0 95.0793 2800.0 95.0852 150000.0 97.0566 2600.0 97.101 23000.0 97.2841 2500.0 99.6631 2500.0 104.9527 2200.0 105.0337 5800.0 105.0696 43000.0 107.0852 200000.0 109.0648 4100.0 109.1009 170000.0 111.5654 2400.0 111.8433 2700.0 116.065 2400.0 117.2371 2400.0 119.0852 51000.0 121.0647 13000.0 121.1009 180000.0 123.1165 44000.0 123.6467 2400.0 129.9955 2200.0 133.101 56000.0 135.0437 27000.0 135.1166 280000.0 137.0599 9100.0 137.132 2900.0 142.4939 2600.0 145.1002 3200.0 147.044 17000.0 147.0803 13000.0 147.1166 29000.0 149.0594 3400.0 149.1323 92000.0 159.0441 28000.0 159.0809 12000.0 160.0859 2500.0 161.0593 6000.0 161.1318 12000.0 163.148 78000.0 165.0546 1500000.0 173.06 25000.0 173.0958 11000.0 173.5231 7000.0 173.5383 44000.0 174.1901 2500.0 175.0745 3700.0 175.1488 17000.0 177.0549 14000.0 177.1641 40000.0 179.0704 91000.0 185.0598 3500.0 185.1289 2500.0 187.0755 37000.0 189.0544 20000.0 189.1637 47000.0 190.1716 16000.0 191.07 36000.0 191.1795 55000.0 191.963 2300.0 193.0862 15000.0 201.0913 59000.0 203.0706 20000.0 204.8893 6800.0 205.0865 21000.0 207.1023 10000.0 213.0912 2900.0 214.8733 19000.0 215.1068 24000.0 217.0863 20000.0 218.8677 23000.0 219.1025 13000.0 220.8834 2400.0 227.1073 13000.0 231.1025 18000.0 233.1164 6100.0 239.1072 12000.0 241.1237 3800.0 243.1021 3000.0 245.1178 6700.0 251.9489 2400.0 253.1228 6300.0 257.1182 2400.0 258.8619 2400.0 259.1335 2800.0 267.1375 9700.0 273.1499 7300.0 275.166 2700.0 285.1494 4100.0 290.8906 10000.0 299.1628 3700.0 308.9008 50000.0 323.2004 11000.0 326.313 3000.0 355.2271 28000.0 END IONS BEGIN IONS SCANS=628 PEPMASS=411.2148 CHARGE=1 COLLISION_ENERGY=0.0 60.2982 2300.0 62.0041 2500.0 62.1468 2300.0 63.0519 2300.0 63.2006 2800.0 63.3833 2300.0 63.6888 2400.0 64.1256 2600.0 67.6932 2500.0 69.6908 2400.0 71.2496 2300.0 74.2731 2700.0 74.9062 2300.0 77.7409 2300.0 78.7723 2500.0 80.1531 2200.0 83.7461 2500.0 94.4819 2700.0 96.5711 2400.0 100.6726 2400.0 101.6628 2500.0 103.664 2100.0 104.8407 2300.0 106.0202 2300.0 109.7803 2500.0 110.3562 2300.0 119.2353 2400.0 120.6856 2200.0 123.2734 2500.0 124.9073 2200.0 127.9316 2500.0 129.9811 2100.0 135.6397 2100.0 138.2154 2200.0 149.67 3000.0 149.6907 5300.0 151.886 2500.0 162.0596 2500.0 173.5258 37000.0 173.5394 62000.0 175.9232 2300.0 176.2673 2800.0 179.0222 4700.0 188.1241 2400.0 199.5736 3100.0 213.1121 2800.0 233.8964 2800.0 253.5022 2800.0 290.8211 2500.0 309.0342 2800.0 309.111 2900.0 311.0836 4100.0 311.1252 550000.0 311.1688 3100.0 324.8521 2400.0 351.8542 2200.0 360.2663 2400.0 379.189 22000.0 411.2142 270000.0 413.1755 2700.0 END IONS BEGIN IONS SCANS=629 PEPMASS=689.2459 CHARGE=1 COLLISION_ENERGY=0.0 68.0769 2300.0 71.4699 15000.0 71.4731 4900.0 72.2681 2200.0 73.8571 2500.0 80.8306 2100.0 83.0075 2500.0 83.6949 2200.0 86.7325 2200.0 94.2346 2000.0 95.2003 2300.0 99.5501 2300.0 104.1689 2200.0 104.2565 2500.0 109.8703 2400.0 123.4786 2300.0 123.4914 2400.0 125.1067 2400.0 128.9392 2300.0 158.0413 2100.0 159.3585 2500.0 173.526 77000.0 173.5431 37000.0 181.4966 2400.0 182.6078 2600.0 234.5079 2600.0 258.9836 2700.0 262.0491 2700.0 282.0371 2500.0 399.1399 3300.0 400.1533 68000.0 401.1614 3100.0 414.1684 26000.0 415.1736 7600.0 427.1771 8600.0 428.1845 41000.0 429.1922 350000.0 429.2436 3500.0 441.1939 3800.0 442.1636 20000.0 443.1723 2500.0 444.1419 16000.0 447.2023 14000.0 450.305 2600.0 455.1707 70000.0 456.1796 37000.0 457.1867 140000.0 458.1941 29000.0 459.1663 13000.0 469.1875 4300.0 472.172 23000.0 473.1018 3700.0 473.1818 360000.0 473.2601 5100.0 474.1888 11000.0 475.1976 5000.0 480.1904 2500.0 482.1621 3000.0 483.1663 95000.0 484.2088 34000.0 485.181 9000.0 486.2274 4200.0 487.162 39000.0 491.1925 19000.0 497.1797 16000.0 499.1602 29000.0 500.1692 43000.0 501.054 3200.0 501.1765 650000.0 501.2424 2100.0 502.1847 170000.0 509.1842 10000.0 510.1581 3800.0 511.1952 58000.0 512.2038 37000.0 513.1389 2900.0 514.1867 18000.0 519.1835 20000.0 525.1765 2400.0 527.1558 120000.0 528.1587 2600.0 528.1754 4400.0 529.2138 18000.0 530.2517 250000.0 537.1762 20000.0 538.1816 4600.0 539.1924 270000.0 540.1948 150000.0 541.2421 3600.0 542.185 12000.0 543.2237 25000.0 555.2228 14000.0 556.2326 8400.0 557.2383 380000.0 558.247 590000.0 558.3915 3700.0 560.2278 14000.0 569.2031 40000.0 571.2151 11000.0 573.2261 24000.0 574.2408 270000.0 583.2162 34000.0 584.224 31000.0 585.1248 5500.0 585.2346 930000.0 586.2372 220000.0 587.2143 31000.0 597.2009 8100.0 599.2509 9300.0 600.2197 20000.0 601.2273 120000.0 602.2373 1900000.0 602.4639 11000.0 604.2172 3600.0 611.2107 11000.0 612.2208 9500.0 615.2421 150000.0 622.9518 3100.0 627.2485 4100.0 628.2154 27000.0 629.2235 65000.0 630.229 3400.0 643.1159 5300.0 643.2391 450000.0 671.2346 71000.0 END IONS BEGIN IONS SCANS=630 PEPMASS=583.4154 CHARGE=1 COLLISION_ENERGY=0.0 65.9705 2300.0 67.0539 71000.0 67.1798 2200.0 69.0334 11000.0 69.0696 100000.0 69.9117 2500.0 71.5991 2500.0 71.6639 2500.0 72.1339 2300.0 74.6614 3000.0 78.4427 2800.0 78.8343 2900.0 79.0539 72000.0 81.0695 260000.0 82.1101 2300.0 82.6625 2600.0 83.0488 44000.0 83.0852 64000.0 85.0645 45000.0 86.0062 2200.0 86.1595 2200.0 86.6415 2300.0 87.1407 2600.0 88.0523 2300.0 88.7092 2500.0 89.9858 2200.0 90.8684 2800.0 91.0539 74000.0 93.0695 340000.0 93.185 2300.0 95.0489 45000.0 95.0852 300000.0 95.9116 2300.0 97.0646 38000.0 105.05 2200.0 105.0695 270000.0 107.0851 410000.0 107.8337 2300.0 109.0646 60000.0 109.1008 260000.0 111.0799 21000.0 117.0695 33000.0 119.0765 9700.0 119.0851 700000.0 120.8886 2800.0 121.0641 17000.0 121.0923 3800.0 121.1008 450000.0 123.08 98000.0 123.1164 85000.0 125.0594 49000.0 129.0696 18000.0 131.0851 190000.0 133.0643 13000.0 133.0903 15000.0 133.1009 440000.0 135.0801 110000.0 135.0915 2500.0 135.1075 2800.0 135.1165 300000.0 135.2499 2400.0 135.3316 2300.0 137.059 3500.0 137.0958 130000.0 139.075 75000.0 139.1118 8200.0 142.0768 5600.0 143.0852 170000.0 144.0933 5300.0 145.0888 8800.0 145.1009 540000.0 147.0801 160000.0 147.1165 200000.0 149.0957 120000.0 149.1081 2400.0 149.1321 46000.0 151.075 220000.0 151.1113 10000.0 151.1477 6200.0 153.0907 32000.0 155.085 43000.0 156.093 30000.0 157.1008 380000.0 158.1084 8500.0 159.0804 32000.0 159.1166 380000.0 160.1252 5100.0 161.0958 88000.0 161.1323 140000.0 163.1115 140000.0 163.1474 2500.0 165.0908 630000.0 165.1262 2800.0 167.0852 2900.0 169.1011 180000.0 170.1091 16000.0 171.1166 300000.0 172.1248 2700.0 172.9016 2500.0 173.0961 49000.0 173.1324 310000.0 173.5251 4500.0 173.5283 120000.0 173.5424 34000.0 175.1118 53000.0 175.1312 2400.0 175.148 260000.0 177.091 51000.0 177.1095 3000.0 177.1272 39000.0 179.0863 3900.0 179.1054 7300.0 181.1013 57000.0 181.1214 50000.0 182.108 14000.0 183.1167 250000.0 184.1243 22000.0 185.0735 2600.0 185.0949 5200.0 185.1324 210000.0 187.1115 39000.0 187.1479 170000.0 189.1273 100000.0 191.1064 29000.0 191.1428 57000.0 193.1016 31000.0 193.122 12000.0 193.8848 2100.0 194.1083 14000.0 195.1166 160000.0 195.1361 34000.0 196.1245 34000.0 196.5226 2600.0 197.1323 230000.0 198.1395 3000.0 199.1119 37000.0 199.1482 110000.0 201.1275 35000.0 201.1637 130000.0 201.2344 2500.0 203.1074 2900.0 203.1429 270000.0 205.1223 17000.0 205.1588 3600.0 207.1168 73000.0 207.138 180000.0 208.1244 11000.0 209.1323 250000.0 209.1535 16000.0 210.1396 6700.0 211.1115 43000.0 211.1481 150000.0 212.1572 2700.0 213.1275 42000.0 213.1639 34000.0 215.1431 30000.0 217.1225 11000.0 217.1589 31000.0 219.1168 9800.0 219.1745 2800.0 220.1238 6100.0 221.1322 70000.0 221.1537 460000.0 222.1395 6100.0 223.1102 3800.0 223.1481 120000.0 224.1542 3400.0 225.1271 19000.0 225.1639 90000.0 227.143 59000.0 227.1795 22000.0 229.1221 39000.0 229.1589 15000.0 230.1663 2900.0 231.138 8100.0 233.1315 30000.0 233.1547 35000.0 235.1479 93000.0 237.1269 6400.0 237.1638 80000.0 238.1335 2600.0 239.1408 7900.0 239.1795 39000.0 241.1585 16000.0 241.1951 16000.0 243.1361 5800.0 243.174 14000.0 245.1306 2800.0 247.1463 31000.0 247.1708 32000.0 249.1638 58000.0 250.1715 12000.0 251.1435 6500.0 251.1794 36000.0 253.1581 3100.0 253.1951 11000.0 255.1377 7600.0 255.1734 6300.0 257.1902 6300.0 259.147 9600.0 259.2063 5800.0 259.2546 2600.0 261.1607 14000.0 261.1868 31000.0 263.1791 36000.0 265.1616 7600.0 265.195 75000.0 267.1385 2800.0 267.1739 20000.0 267.2094 9700.0 269.1512 2800.0 269.1894 27000.0 271.1697 4100.0 273.164 6700.0 275.1794 35000.0 277.1595 5700.0 277.1964 2700.0 279.175 2900.0 279.2112 3500.0 281.1902 11000.0 282.2785 6600.0 283.2055 76000.0 283.2826 23000.0 285.1851 86000.0 285.2162 2600.0 286.193 40000.0 287.2014 69000.0 289.1947 7200.0 291.1781 2800.0 291.2108 3400.0 293.1909 21000.0 293.2278 3200.0 295.2072 3300.0 296.0434 2700.0 297.2219 6800.0 299.2006 38000.0 303.1765 3900.0 303.2129 3100.0 305.1906 3100.0 311.199 28000.0 311.2377 7500.0 312.2094 3200.0 315.2115 2500.0 323.2055 2600.0 325.2166 7600.0 337.2184 2800.0 338.224 13000.0 349.2156 24000.0 352.6146 2400.0 353.2481 45000.0 357.2618 3000.0 357.8337 2700.0 364.2399 68000.0 375.2694 10000.0 377.2466 10000.0 385.2743 53000.0 399.2893 62000.0 425.3048 44000.0 438.3067 3300.0 451.3181 2900.0 451.4883 2300.0 473.3389 15000.0 477.3412 2900.0 491.2689 5200.0 491.3521 650000.0 491.4294 9500.0 504.3595 18000.0 556.9847 2800.0 574.2989 2800.0 583.4153 95000.0 END IONS BEGIN IONS SCANS=631 PEPMASS=205.1954 CHARGE=1 COLLISION_ENERGY=0.0 41.0385 170000.0 43.0177 4100.0 43.0541 91000.0 49.6685 2500.0 53.0384 76000.0 53.098 2200.0 55.054 1100000.0 55.0572 9800.0 55.9343 36000.0 57.0696 290000.0 57.4638 2500.0 58.8791 2200.0 62.0598 2300.0 63.0874 2200.0 63.9278 2100.0 65.0383 19000.0 66.2479 2300.0 66.7066 2300.0 67.0539 790000.0 67.0581 4800.0 67.7337 3000.0 67.9223 2100.0 68.7379 2600.0 69.0697 1700000.0 69.0739 15000.0 69.076 10000.0 71.0852 62000.0 71.5748 2800.0 72.5341 2600.0 72.9368 280000.0 73.4464 2200.0 74.9056 2300.0 75.9974 2500.0 76.5752 2300.0 77.0384 55000.0 79.054 1200000.0 79.0594 7200.0 81.0697 4500000.0 81.0781 25000.0 81.0782 71000.0 81.0806 13000.0 83.0852 300000.0 83.6063 2600.0 88.8478 2200.0 89.7196 2700.0 90.942 3000.0 90.9474 210000.0 91.0539 510000.0 92.2724 2400.0 93.0697 5400000.0 93.0765 27000.0 93.0801 67000.0 93.0831 16000.0 93.0873 7900.0 95.0489 140000.0 95.0853 1600000.0 95.0924 6700.0 95.2994 2600.0 96.6001 2400.0 97.0943 2800.0 97.1009 180000.0 99.0199 2100.0 99.9477 57000.0 103.0539 15000.0 105.0443 53000.0 105.0617 4700.0 105.0695 440000.0 106.0776 26000.0 107.0853 2200000.0 107.0929 9400.0 107.0969 18000.0 107.5879 2600.0 109.0645 60000.0 109.0928 16000.0 109.1009 950000.0 111.1166 31000.0 112.8035 2300.0 113.9634 570000.0 114.6771 2500.0 115.9429 3600.0 119.06 16000.0 119.0852 100000.0 121.1009 6500000.0 121.1096 96000.0 121.1185 41000.0 121.1209 17000.0 121.1275 8000.0 123.0801 380000.0 123.1165 430000.0 125.9606 2500.0 126.3159 2600.0 127.3089 2700.0 128.9514 2700.0 129.2522 2400.0 130.8366 2800.0 131.974 71000.0 133.0758 13000.0 133.1014 11000.0 133.9534 3000.0 135.1166 620000.0 135.1273 3200.0 137.1323 52000.0 137.2617 2600.0 141.9244 2800.0 145.5622 2300.0 147.1163 17000.0 149.1183 6200.0 149.1323 1200000.0 149.1447 22000.0 154.2625 2400.0 163.148 100000.0 173.5312 54000.0 173.5405 4600.0 176.4065 2500.0 177.9719 3300.0 205.1948 37000.0 END IONS BEGIN IONS SCANS=632 PEPMASS=264.2325 CHARGE=1 COLLISION_ENERGY=0.0 45.914 2300.0 47.3077 2700.0 51.0142 2200.0 51.0232 2400.0 51.3412 2300.0 53.0385 38000.0 54.4206 2000.0 54.4498 2300.0 55.054 490000.0 56.1255 2100.0 57.0697 260000.0 57.459 2700.0 58.5787 2100.0 60.0443 16000000.0 60.0479 93000.0 60.0513 55000.0 60.0533 25000.0 60.0537 150000.0 60.0556 10000.0 60.5062 2400.0 61.4431 2300.0 62.516 2400.0 65.0386 14000.0 66.4452 2700.0 67.0539 440000.0 67.7319 2800.0 68.5072 2400.0 69.0696 1300000.0 69.0738 9500.0 69.076 8000.0 70.1427 2900.0 71.0853 110000.0 72.6987 5000.0 74.4697 2800.0 77.0387 35000.0 79.0539 680000.0 81.0696 6300000.0 81.0782 38000.0 81.0786 110000.0 81.0805 21000.0 81.8747 2300.0 83.0805 8600.0 83.0852 390000.0 86.6375 3100.0 86.8393 2600.0 89.3142 2200.0 89.5651 2500.0 91.0481 8100.0 91.054 210000.0 93.0696 4000000.0 93.08 20000.0 93.08 40000.0 95.049 56000.0 95.0852 2200000.0 95.0925 15000.0 97.0943 6800.0 97.1009 360000.0 105.0444 18000.0 105.0696 210000.0 106.078 5200.0 107.0852 2300000.0 107.0945 4000.0 109.0644 4000.0 109.0928 5200.0 109.1009 1800000.0 109.1102 3800.0 111.1165 150000.0 111.688 2100.0 114.8274 5300.0 116.8216 5000.0 119.0853 51000.0 120.5478 2600.0 121.0898 6300.0 121.1009 17000000.0 121.1116 350000.0 121.1215 51000.0 121.1221 150000.0 121.1282 25000.0 121.1327 7900.0 122.1117 2800.0 123.0803 37000.0 123.1165 880000.0 124.312 2400.0 125.1321 7700.0 126.0303 2800.0 129.5037 2500.0 133.0758 4400.0 133.1009 7600.0 135.1055 5100.0 135.1166 1400000.0 135.1267 9700.0 137.1323 110000.0 147.1172 9400.0 149.1323 3900000.0 149.145 22000.0 149.1606 3900.0 159.0632 5800.0 160.8675 2900.0 161.1333 2900.0 163.148 300000.0 165.0365 2200.0 169.9498 2400.0 171.8872 2800.0 173.5288 66000.0 173.5414 24000.0 177.1634 18000.0 189.1646 3000.0 205.1952 560000.0 255.9059 2400.0 258.9587 3200.0 259.6519 2500.0 264.2322 68000.0 END IONS BEGIN IONS SCANS=633 PEPMASS=371.222 CHARGE=1 COLLISION_ENERGY=0.0 53.9955 2200.0 55.0541 23000.0 57.0569 2200.0 57.0697 17000.0 59.049 11000.0 59.5685 2100.0 60.1286 2300.0 65.4121 2400.0 67.0541 18000.0 68.2456 2800.0 68.4622 2300.0 69.0695 66000.0 69.218 2200.0 70.5805 2100.0 79.0539 5300.0 81.0696 54000.0 82.8822 2300.0 83.0493 2400.0 83.0853 13000.0 93.0696 49000.0 95.0851 73000.0 97.0644 25000.0 99.0804 2300.0 101.0593 35000.0 105.0696 35000.0 107.0489 31000.0 107.0852 59000.0 107.5494 2500.0 109.0645 4200.0 109.1008 60000.0 111.0436 27000.0 111.0802 3300.0 111.1165 48000.0 118.6872 2700.0 119.0852 23000.0 121.0647 9600.0 121.1008 39000.0 123.1164 20000.0 129.0544 17000.0 131.0856 3500.0 131.5626 2400.0 133.0281 37000.0 133.0647 14000.0 133.1009 33000.0 135.0437 89000.0 135.08 39000.0 135.1164 22000.0 136.4912 2800.0 137.1321 6300.0 143.0848 2600.0 145.0644 4100.0 145.1008 35000.0 145.9708 2600.0 147.0439 7200.0 147.08 19000.0 147.1164 28000.0 149.0595 51000.0 149.0961 5800.0 149.1322 34000.0 149.6721 2500.0 151.0386 21000.0 151.1114 6500.0 157.0645 9800.0 157.0994 3500.0 159.0434 2700.0 159.0799 11000.0 159.1176 4000.0 161.0962 4100.0 161.1328 2800.0 163.0756 3200.0 165.0544 310000.0 167.1426 6700.0 171.0802 2500.0 173.0596 22000.0 173.0969 2700.0 173.1328 6200.0 173.5284 61000.0 173.542 16000.0 175.0753 16000.0 175.1111 6200.0 175.1477 4000.0 179.0699 7300.0 182.6445 2300.0 185.0595 34000.0 185.0959 12000.0 186.2966 2300.0 187.0752 14000.0 187.1488 2800.0 188.1564 5800.0 189.0551 29000.0 189.0906 16000.0 189.1642 8700.0 191.07 9000.0 193.9335 2500.0 197.0972 2300.0 197.2578 2400.0 199.0763 2700.0 201.0905 33000.0 203.0702 35000.0 203.1066 5900.0 205.0862 31000.0 209.0972 3100.0 211.0757 3000.0 213.0911 63000.0 215.1077 8700.0 217.0861 78000.0 227.0698 3300.0 227.1057 3000.0 228.6764 2600.0 229.0859 24000.0 231.1018 28000.0 239.1051 3000.0 240.3225 2700.0 241.1225 2800.0 243.1016 11000.0 243.1386 3700.0 244.0469 3000.0 245.1179 4200.0 255.1371 3300.0 257.1172 60000.0 269.1198 3000.0 269.1519 3300.0 271.1326 4000.0 279.9292 2700.0 280.3512 2700.0 281.1552 6000.0 296.8279 2800.0 297.1509 2700.0 321.1848 22000.0 339.1956 89000.0 357.2061 35000.0 END IONS BEGIN IONS SCANS=634 PEPMASS=599.4102 CHARGE=1 COLLISION_ENERGY=0.0 63.4366 2700.0 67.054 13000.0 69.0332 13000.0 69.0696 6000.0 78.252 2500.0 79.054 5400.0 79.7924 2300.0 81.0695 56000.0 83.0489 13000.0 83.0854 11000.0 83.6373 2200.0 85.0648 6700.0 91.0542 19000.0 93.0695 81000.0 94.7863 2200.0 95.049 19000.0 95.0852 70000.0 97.0645 13000.0 97.1005 2900.0 104.0937 2300.0 104.7893 2300.0 105.0696 61000.0 106.9868 2400.0 107.0851 57000.0 109.0646 21000.0 109.1009 24000.0 111.0799 5200.0 114.8844 2600.0 115.3301 2100.0 115.7408 2400.0 117.0702 3000.0 119.0851 100000.0 121.0648 12000.0 121.1007 110000.0 121.6661 2700.0 123.0799 54000.0 123.1161 6300.0 123.155 2400.0 125.0594 37000.0 129.0697 5500.0 131.0852 29000.0 131.5155 2400.0 133.1008 72000.0 135.0801 64000.0 135.1165 41000.0 137.0957 79000.0 139.0751 28000.0 141.0707 2900.0 141.604 2600.0 143.0852 34000.0 143.1776 2400.0 145.1009 89000.0 147.0801 150000.0 147.1166 26000.0 149.0958 24000.0 149.8395 2400.0 151.075 84000.0 153.0913 5000.0 155.0845 12000.0 157.1009 100000.0 159.0801 3100.0 159.1165 74000.0 161.0959 37000.0 161.1321 62000.0 163.1115 94000.0 165.0907 730000.0 167.1076 5800.0 169.101 35000.0 170.1099 6300.0 171.1166 91000.0 173.0961 26000.0 173.1321 23000.0 173.5215 8500.0 173.5275 39000.0 173.5403 48000.0 175.1118 7600.0 175.1483 24000.0 177.0912 20000.0 177.127 8000.0 179.1063 5400.0 179.143 9600.0 179.818 2400.0 181.1024 8400.0 181.1222 44000.0 183.1168 88000.0 185.1322 75000.0 187.1118 20000.0 187.1478 25000.0 189.1271 42000.0 190.8349 2500.0 191.1066 42000.0 191.1429 13000.0 195.1172 25000.0 195.1364 3000.0 196.1241 3400.0 197.1321 41000.0 199.1126 7300.0 199.1481 3700.0 201.1278 10000.0 203.1429 290000.0 203.164 2500.0 205.1221 3500.0 207.118 2800.0 207.138 53000.0 209.1325 35000.0 209.155 2500.0 211.1124 2900.0 211.1482 54000.0 213.1277 12000.0 215.1431 12000.0 217.1573 2700.0 221.1341 18000.0 221.1536 720000.0 223.1491 14000.0 225.1267 8600.0 225.1637 15000.0 227.144 8500.0 227.1788 10000.0 229.159 28000.0 231.1378 24000.0 233.1539 17000.0 237.1658 8800.0 239.1427 3200.0 240.7392 2300.0 243.1386 6500.0 247.1437 3500.0 247.1692 150000.0 257.1544 3500.0 263.178 3700.0 267.8703 2600.0 268.1785 2800.0 268.4777 2900.0 269.1904 16000.0 271.1694 9700.0 273.1823 2400.0 281.1898 11000.0 283.7058 2800.0 285.1852 15000.0 286.1929 13000.0 287.2006 110000.0 289.1942 2800.0 291.1754 5800.0 293.1883 2500.0 297.4912 2300.0 298.1924 2400.0 299.2008 37000.0 309.184 2800.0 311.2005 27000.0 312.2089 3700.0 313.2164 35000.0 325.2162 14000.0 327.2321 51000.0 339.2896 12000.0 365.2464 29000.0 391.2628 23000.0 413.2697 32000.0 419.2948 39000.0 427.2848 70000.0 453.2999 11000.0 505.967 2800.0 507.3449 2800.0 519.345 23000.0 557.8373 2800.0 599.4114 19000.0 END IONS BEGIN IONS SCANS=635 PEPMASS=311.2585 CHARGE=1 COLLISION_ENERGY=0.0 49.1419 2500.0 53.0384 2800.0 55.0176 3500.0 55.0539 260000.0 57.0332 100000.0 57.0696 130000.0 58.8871 2400.0 67.0539 27000.0 69.0695 260000.0 69.0739 4800.0 71.0851 48000.0 71.6861 2200.0 78.7076 2300.0 79.0539 17000.0 80.9298 2300.0 81.0695 42000.0 83.0851 190000.0 85.1008 17000.0 93.0695 27000.0 95.0851 25000.0 96.2531 3100.0 97.0644 20000.0 97.0944 3500.0 97.1008 120000.0 107.0852 19000.0 109.1008 4600.0 111.0803 4500.0 111.1165 19000.0 113.5171 2600.0 121.101 21000.0 135.1167 14000.0 136.2436 2500.0 144.8543 3100.0 173.5273 51000.0 173.544 7200.0 175.5305 2500.0 209.1168 14000.0 215.7284 2600.0 225.9283 2800.0 246.95 8400.0 311.2598 2600.0 END IONS BEGIN IONS SCANS=636 PEPMASS=298.2382 CHARGE=1 COLLISION_ENERGY=0.0 55.0539 26000.0 57.0696 68000.0 59.7654 2300.0 60.7347 2300.0 62.3796 2100.0 63.0147 2600.0 64.6018 2300.0 68.4547 2200.0 71.0852 8900.0 76.8542 2800.0 79.0537 2600.0 83.0109 2200.0 83.0853 12000.0 83.1576 2200.0 85.1011 3000.0 89.0593 70000.0 91.0539 280000.0 93.6808 2800.0 95.6319 2300.0 101.0959 13000.0 106.1509 2400.0 107.0699 33000.0 108.2099 2800.0 119.0851 1100000.0 119.0936 17000.0 123.7454 2100.0 137.5153 2900.0 143.1003 2300.0 145.3641 2400.0 147.8305 2400.0 155.4461 2700.0 158.1902 2700.0 163.1327 13000.0 168.8308 2000.0 173.5196 7700.0 173.5298 38000.0 173.5428 13000.0 174.2766 2400.0 181.4631 2200.0 192.5168 2600.0 196.9294 3200.0 271.2422 2700.0 298.3472 61000.0 END IONS BEGIN IONS SCANS=637 PEPMASS=205.1954 CHARGE=1 COLLISION_ENERGY=0.0 41.0385 150000.0 43.0178 3600.0 43.0541 67000.0 53.0384 54000.0 55.0176 3800.0 55.0541 1600000.0 55.0572 14000.0 55.0587 12000.0 55.9342 25000.0 57.0696 430000.0 61.7686 3000.0 65.0383 14000.0 66.7253 2600.0 67.0539 900000.0 67.0582 4800.0 67.0603 4700.0 69.0697 2000000.0 69.0739 18000.0 69.0762 11000.0 69.0786 4000.0 71.0852 55000.0 72.0766 2800.0 72.9368 240000.0 73.0281 3100.0 73.3043 2500.0 75.9009 2300.0 77.0385 35000.0 79.0539 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173.522 8600.0 173.5367 41000.0 175.495 2400.0 177.61 2800.0 191.6413 2400.0 192.2493 2400.0 199.7321 2400.0 239.2397 2700.0 257.0957 2300.0 265.1398 3000.0 282.2788 36000.0 313.2325 5400.0 313.2736 280000.0 394.9464 2500.0 414.7589 2900.0 421.0404 2900.0 462.242 2500.0 END IONS BEGIN IONS SCANS=639 PEPMASS=496.3405 CHARGE=1 COLLISION_ENERGY=0.0 60.0805 54000.0 60.6424 2300.0 61.8448 2500.0 63.1827 2400.0 65.9526 2500.0 66.1196 2200.0 68.3096 2800.0 71.0727 3600.0 72.7749 2000.0 83.0319 2400.0 86.0959 200000.0 89.0593 18000.0 91.1219 2600.0 93.7508 2500.0 103.6114 2800.0 104.1067 860000.0 104.1143 4100.0 105.8624 2800.0 112.0107 2500.0 121.0647 2900.0 122.7173 2300.0 124.9995 58000.0 128.8625 2400.0 133.0858 6300.0 136.4417 2500.0 141.4096 2300.0 146.8278 2400.0 152.75 2800.0 163.0149 7800.0 173.525 28000.0 173.5352 35000.0 173.5441 12000.0 174.2514 2500.0 179.1815 2700.0 184.0733 1200000.0 209.2447 2700.0 215.6861 2400.0 228.3575 2500.0 232.1491 2200.0 248.9954 2500.0 250.3371 2300.0 258.11 19000.0 288.6191 2300.0 313.2748 43000.0 315.62 2400.0 319.4391 2600.0 339.9919 3000.0 380.917 2500.0 390.683 2400.0 398.7138 2400.0 401.1197 2600.0 419.2509 2600.0 419.2572 7600.0 437.5553 3200.0 478.3307 33000.0 496.345 16000.0 END IONS BEGIN IONS SCANS=640 PEPMASS=205.1954 CHARGE=1 COLLISION_ENERGY=0.0 41.0385 12000.0 43.0541 4100.0 51.011 2300.0 53.0384 5600.0 55.054 91000.0 55.4183 2300.0 55.9342 7000.0 57.0696 24000.0 60.8898 2700.0 67.0501 3000.0 67.0539 56000.0 69.0695 130000.0 71.0852 4300.0 72.9368 49000.0 77.0382 3200.0 79.0539 86000.0 81.0695 320000.0 81.0778 3900.0 81.6814 2300.0 83.0852 25000.0 90.9473 38000.0 91.0539 41000.0 93.0695 390000.0 93.0759 3400.0 95.0489 12000.0 95.0851 120000.0 95.7239 2400.0 97.1009 15000.0 99.9477 10000.0 103.0543 3000.0 105.0445 4400.0 105.0695 33000.0 107.0851 170000.0 107.9504 3200.0 109.0645 2900.0 109.1008 70000.0 110.3221 2500.0 113.9633 94000.0 119.0597 3100.0 119.0855 4800.0 121.1008 490000.0 121.1096 5400.0 123.0801 57000.0 123.1164 32000.0 131.974 14000.0 135.1166 52000.0 137.1324 3100.0 149.1322 84000.0 163.1481 6200.0 173.5348 24000.0 191.5532 2800.0 205.1944 3000.0 END IONS BEGIN IONS SCANS=641 PEPMASS=264.2324 CHARGE=1 COLLISION_ENERGY=0.0 46.484 2300.0 51.7484 2200.0 52.4258 2200.0 53.0385 9700.0 53.5267 2700.0 55.054 140000.0 55.5194 2300.0 57.0697 84000.0 60.0403 9500.0 60.0442 3800000.0 60.0478 29000.0 60.05 41000.0 60.0512 19000.0 60.0533 9600.0 60.0579 2100.0 60.0592 2100.0 65.0387 3100.0 65.1872 2300.0 67.0501 3000.0 67.0539 130000.0 67.4591 2600.0 69.0696 390000.0 71.0852 37000.0 74.2827 2400.0 77.0387 3200.0 78.9599 2300.0 79.0539 210000.0 81.0696 1900000.0 81.0748 18000.0 81.0782 15000.0 81.0808 8200.0 83.0798 2500.0 83.0853 120000.0 91.0494 3000.0 91.054 63000.0 93.0698 1200000.0 93.0762 6600.0 95.049 17000.0 95.0853 710000.0 95.0918 3500.0 97.1009 110000.0 101.5664 2200.0 105.0697 60000.0 107.0852 730000.0 109.0642 2700.0 109.1008 600000.0 109.1086 4000.0 111.1166 51000.0 119.0851 15000.0 121.075 3600.0 121.0916 17000.0 121.1009 5500000.0 121.11 83000.0 121.1181 40000.0 121.1212 21000.0 121.1273 9700.0 121.1332 4400.0 123.0802 6000.0 123.1069 5400.0 123.1165 300000.0 124.2985 2400.0 135.1165 470000.0 135.1273 9400.0 136.9854 2700.0 137.1322 36000.0 147.1161 12000.0 149.1322 1300000.0 149.1464 3800.0 156.1375 2900.0 163.1479 99000.0 173.5326 61000.0 173.543 12000.0 177.1635 4700.0 178.2092 2600.0 187.7316 2500.0 189.1648 4800.0 205.195 270000.0 207.74 2500.0 233.9204 2500.0 264.232 52000.0 END IONS BEGIN IONS SCANS=642 PEPMASS=534.3642 CHARGE=1 COLLISION_ENERGY=0.0 61.0282 2900.0 61.3015 2700.0 63.5341 2200.0 65.8887 2400.0 67.0539 120000.0 68.3357 2500.0 69.0695 63000.0 70.5729 2200.0 71.0853 23000.0 74.7368 2900.0 75.0438 2600.0 75.8114 2200.0 76.5018 2600.0 79.0538 26000.0 80.8312 3000.0 81.0695 240000.0 83.0852 76000.0 85.028 11000.0 85.0646 3000.0 85.1011 8600.0 87.0002 2300.0 91.0541 12000.0 93.0695 46000.0 93.971 2300.0 94.7954 2200.0 95.085 250000.0 97.0281 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2400.0 371.0299 2700.0 389.6155 2400.0 408.0903 2700.0 418.8559 2800.0 443.7118 2300.0 505.7065 2700.0 END IONS BEGIN IONS SCANS=643 PEPMASS=205.1954 CHARGE=1 COLLISION_ENERGY=0.0 41.0384 30000.0 43.0177 5400.0 43.0542 13000.0 43.4779 2300.0 49.7954 2000.0 52.3749 2200.0 52.9298 2200.0 52.9505 2200.0 53.0384 2900.0 55.0539 200000.0 55.9341 30000.0 57.0697 46000.0 58.0487 2400.0 60.285 2400.0 61.4152 2000.0 64.2743 2400.0 67.0505 2800.0 67.0539 120000.0 68.3777 2300.0 69.0658 3100.0 69.0695 230000.0 72.9368 230000.0 73.162 2300.0 74.0317 2400.0 77.0386 5200.0 79.0539 150000.0 79.2653 2700.0 81.0695 540000.0 83.0852 43000.0 90.9422 2700.0 90.9473 170000.0 91.0539 69000.0 93.063 5600.0 93.0695 760000.0 95.0488 18000.0 95.0646 3200.0 95.0851 260000.0 95.4204 2200.0 97.1008 32000.0 97.4964 2500.0 98.0877 2600.0 99.9476 43000.0 105.0696 67000.0 107.0773 4100.0 107.0851 360000.0 108.9582 6000.0 109.0638 3200.0 109.1008 170000.0 109.422 2200.0 113.9549 9300.0 113.9633 440000.0 115.9425 7900.0 119.0853 17000.0 121.1008 880000.0 121.1097 2400.0 121.1111 11000.0 123.08 270000.0 123.1071 2300.0 123.1165 65000.0 127.4308 2500.0 128.9505 2400.0 129.4223 3000.0 131.9739 57000.0 133.1021 2900.0 133.9529 5000.0 134.0124 2400.0 135.1166 100000.0 137.1322 5300.0 138.1201 2200.0 139.9736 3300.0 141.9275 2200.0 149.1322 160000.0 149.6933 4600.0 154.9903 3200.0 158.2384 2600.0 163.1478 6600.0 164.8165 2400.0 168.1474 2300.0 169.921 2500.0 172.852 2800.0 173.5244 31000.0 173.5404 41000.0 182.4958 2400.0 185.9899 2600.0 END IONS BEGIN IONS SCANS=644 PEPMASS=371.222 CHARGE=1 COLLISION_ENERGY=0.0 52.732 2000.0 54.8118 2300.0 55.0176 7000.0 55.0541 16000.0 55.1359 2000.0 56.2092 2100.0 58.7084 2200.0 59.5547 2100.0 65.1612 2200.0 67.0539 17000.0 69.0332 77000.0 69.0696 14000.0 70.0413 2100.0 77.0384 2500.0 79.0539 12000.0 79.2202 2600.0 80.5218 2200.0 81.0696 62000.0 82.2674 2400.0 83.0491 2400.0 91.0539 15000.0 93.0697 35000.0 95.0491 12000.0 95.0851 46000.0 97.0645 31000.0 97.101 2800.0 101.0594 24000.0 105.0696 38000.0 105.9268 2500.0 106.545 2500.0 107.0487 70000.0 107.0851 62000.0 109.0645 38000.0 109.1009 60000.0 111.0436 44000.0 113.5785 2400.0 119.0854 24000.0 120.2268 2900.0 121.0645 23000.0 121.1007 37000.0 121.783 2200.0 123.0801 20000.0 123.1165 29000.0 125.0595 39000.0 125.0955 2700.0 126.6882 2500.0 129.0542 11000.0 131.0503 3100.0 131.0854 11000.0 133.0281 44000.0 133.0645 27000.0 133.1009 43000.0 135.0437 96000.0 135.0803 33000.0 135.1164 4900.0 137.0598 2700.0 137.0958 13000.0 143.0855 3200.0 145.0647 21000.0 145.1011 18000.0 147.0442 15000.0 147.0801 64000.0 147.1172 13000.0 147.1586 2400.0 149.0594 38000.0 149.0958 28000.0 151.0392 40000.0 151.1115 19000.0 157.0645 7700.0 158.0726 3700.0 159.0452 2500.0 159.0802 33000.0 159.1168 5200.0 161.0595 13000.0 161.0959 25000.0 163.0748 5200.0 163.112 5800.0 165.0544 300000.0 165.0698 3200.0 169.0615 2400.0 171.0809 17000.0 173.06 16000.0 173.0963 29000.0 173.1325 8900.0 173.5271 15000.0 173.5346 52000.0 173.5452 3800.0 175.0755 28000.0 175.1109 2500.0 175.1484 3600.0 177.0553 6900.0 177.0916 5900.0 179.07 6900.0 183.0811 6900.0 183.1484 2200.0 185.0968 11000.0 187.0752 32000.0 187.1496 3500.0 189.0911 50000.0 191.0707 12000.0 196.895 2600.0 197.0971 5900.0 199.075 6700.0 199.1114 6000.0 201.091 110000.0 203.0709 5400.0 205.0861 20000.0 209.0963 3000.0 211.1116 10000.0 213.091 6900.0 213.1275 7300.0 215.1072 8300.0 215.1436 4600.0 217.0862 35000.0 220.1478 2300.0 223.112 3500.0 224.547 2100.0 225.0927 2500.0 225.1277 20000.0 227.1066 3100.0 227.1433 14000.0 231.1022 12000.0 231.1992 2500.0 235.1133 2600.0 237.1264 11000.0 239.1078 3000.0 241.1223 3200.0 243.1382 21000.0 253.1223 28000.0 255.1382 26000.0 257.1189 2700.0 268.1828 3100.0 271.1333 17000.0 293.1893 3600.0 321.1853 10000.0 339.196 62000.0 351.7754 2800.0 357.2063 24000.0 371.2759 2900.0 END IONS BEGIN IONS SCANS=645 PEPMASS=618.4283 CHARGE=1 COLLISION_ENERGY=0.0 64.0975 2300.0 64.5323 2100.0 64.6615 2200.0 65.9802 2300.0 66.1844 2400.0 67.054 22000.0 67.1781 2400.0 69.0333 3000.0 69.0695 21000.0 71.049 4200.0 72.1583 2300.0 77.6461 2300.0 78.0102 2200.0 78.6238 2600.0 79.054 24000.0 79.3505 2200.0 81.0695 88000.0 81.606 2200.0 83.0489 25000.0 83.0852 87000.0 83.4442 2700.0 83.6794 2400.0 86.2843 2300.0 88.3788 2300.0 91.0541 24000.0 91.405 2900.0 92.5759 2400.0 93.0695 100000.0 95.0488 65000.0 95.0852 87000.0 97.0645 49000.0 101.3362 2300.0 105.0695 99000.0 107.0852 140000.0 109.0644 33000.0 109.1008 66000.0 110.9466 2400.0 111.0802 2800.0 111.5791 2400.0 113.0959 14000.0 113.7236 2600.0 114.5524 2400.0 117.0697 12000.0 119.0851 180000.0 120.093 2800.0 121.0645 23000.0 121.1009 120000.0 121.7845 2500.0 123.0802 28000.0 123.1165 17000.0 125.0958 38000.0 131.0852 63000.0 133.1008 130000.0 133.2895 2800.0 135.0803 23000.0 135.1165 45000.0 135.1816 2700.0 137.0962 4100.0 139.1113 42000.0 142.0773 4300.0 143.0852 60000.0 144.0931 13000.0 145.1008 180000.0 147.0802 19000.0 147.1165 73000.0 149.0958 34000.0 149.1312 3400.0 151.7178 3100.0 155.0856 8900.0 155.1061 7000.0 156.0932 8300.0 157.1009 150000.0 158.1084 2900.0 159.0803 19000.0 159.1165 120000.0 160.0875 17000.0 161.0957 43000.0 161.1316 11000.0 163.1113 25000.0 167.0872 2700.0 167.1065 46000.0 167.1425 3400.0 169.101 55000.0 171.1166 95000.0 172.125 2400.0 173.0962 22000.0 173.1325 69000.0 173.5258 35000.0 173.5355 120000.0 173.545 4400.0 175.1115 40000.0 175.148 33000.0 179.1429 4200.0 181.1013 14000.0 181.1219 56000.0 182.1083 11000.0 183.1168 62000.0 183.1364 2700.0 184.1246 3000.0 185.0955 6500.0 185.1323 67000.0 187.1122 17000.0 187.1481 36000.0 189.1272 10000.0 191.1431 14000.0 193.1004 3300.0 194.11 2800.0 195.1163 46000.0 196.1245 3700.0 197.1325 99000.0 197.5085 2600.0 199.112 5900.0 199.1478 47000.0 201.1265 2400.0 201.1632 15000.0 202.3785 2300.0 203.1437 11000.0 207.1167 27000.0 208.6033 2500.0 209.1324 62000.0 210.1392 7100.0 211.1124 2700.0 211.148 50000.0 213.1274 8500.0 213.1633 13000.0 215.1432 23000.0 217.1557 2800.0 219.1742 4400.0 221.1323 21000.0 221.1539 19000.0 223.1479 46000.0 225.1259 4200.0 225.1651 7900.0 227.1431 2800.0 227.5966 2400.0 228.1517 3000.0 230.4583 2300.0 233.131 4600.0 233.1538 72000.0 235.1475 35000.0 235.6129 2400.0 237.1637 24000.0 239.1784 3000.0 241.1581 3200.0 247.1467 6900.0 249.1634 17000.0 251.1055 2400.0 251.1794 5900.0 253.1582 7600.0 255.1742 52000.0 255.2378 2600.0 257.1927 2800.0 259.146 3200.0 261.164 7500.0 263.1791 8300.0 265.1947 3200.0 279.1741 2900.0 281.191 2400.0 291.1585 3100.0 295.205 6500.0 304.1313 2800.0 307.2086 2400.0 330.8963 2700.0 331.2404 3000.0 399.2722 2900.0 416.8901 2300.0 420.3867 2900.0 429.6388 2600.0 477.0559 2400.0 506.8117 2600.0 564.0316 3000.0 591.4614 2400.0 599.5714 2500.0 END IONS BEGIN IONS SCANS=646 PEPMASS=205.1954 CHARGE=1 COLLISION_ENERGY=0.0 41.0385 180000.0 42.0337 44000.0 43.0541 77000.0 44.0494 3200.0 51.023 12000.0 53.0018 2900.0 53.0132 6500.0 53.0384 190000.0 55.0541 2400000.0 55.0572 27000.0 55.0587 20000.0 55.9342 15000.0 57.0697 580000.0 65.0384 69000.0 66.0149 2900.0 66.046 9300.0 66.0499 3800.0 66.5929 2400.0 67.054 1700000.0 67.0582 12000.0 67.0604 15000.0 67.49 4200.0 69.0698 3600000.0 69.0739 38000.0 69.0761 26000.0 71.0853 130000.0 72.9368 240000.0 73.0284 6100.0 73.0456 2600.0 74.3088 2400.0 77.0384 100000.0 78.0468 5600.0 79.054 2600000.0 79.062 16000.0 79.062 44000.0 80.062 16000.0 81.0698 10000000.0 81.0781 64000.0 81.0795 240000.0 81.0806 34000.0 81.084 15000.0 83.0852 650000.0 83.0912 8100.0 85.1005 4600.0 87.0967 2400.0 90.2655 2500.0 90.9474 150000.0 91.054 1100000.0 91.0604 6800.0 91.0639 8300.0 93.0697 12000000.0 93.0807 82000.0 93.0818 250000.0 93.0831 42000.0 93.0874 19000.0 94.0774 3100.0 95.0489 310000.0 95.0853 3600000.0 95.0924 18000.0 95.096 41000.0 97.0944 6800.0 97.1008 410000.0 97.1988 2200.0 99.9477 37000.0 103.0543 37000.0 105.0444 110000.0 105.0617 9200.0 105.0696 950000.0 105.0783 22000.0 106.0774 62000.0 107.0686 3400.0 107.0853 4700000.0 107.0934 35000.0 107.102 11000.0 107.3674 2600.0 109.0645 110000.0 109.1009 2200000.0 109.1089 11000.0 109.1671 2200.0 111.1166 78000.0 112.8187 2500.0 113.6498 5300.0 113.9634 420000.0 115.9432 3000.0 119.0604 36000.0 119.0765 4000.0 119.0853 220000.0 119.1277 2400.0 121.0636 2900.0 121.0805 10000.0 121.0899 7300.0 121.1009 16000000.0 121.1101 67000.0 121.1141 360000.0 121.1275 21000.0 121.1275 83000.0 123.0801 400000.0 123.1165 910000.0 125.9346 2600.0 131.9741 58000.0 133.0758 54000.0 133.101 31000.0 133.9529 2400.0 135.1166 1300000.0 135.1269 17000.0 137.1322 100000.0 141.1374 2400.0 147.1168 47000.0 149.0233 18000.0 149.1185 9500.0 149.1323 2400000.0 149.1448 20000.0 150.0717 2500.0 151.6654 2300.0 154.9903 3500.0 157.0564 2200.0 161.1326 13000.0 162.1411 6000.0 163.1479 200000.0 173.5255 29000.0 173.54 50000.0 180.5688 2300.0 186.4362 2500.0 189.1844 4600.0 197.1696 2600.0 200.3753 4400.0 203.0006 2300.0 205.1954 90000.0 213.8651 2900.0 215.2242 2400.0 END IONS BEGIN IONS SCANS=647 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207.9839 2200.0 219.0571 510000.0 219.0813 9800.0 231.6882 2400.0 237.3184 2500.0 241.9252 2100.0 251.1423 2600.0 252.2191 2200.0 256.4821 2400.0 259.6272 2300.0 279.0937 370000.0 279.1246 7100.0 END IONS BEGIN IONS SCANS=648 PEPMASS=404.3529 CHARGE=1 COLLISION_ENERGY=0.0 55.0021 2500.0 55.0543 12000.0 55.1785 2300.0 55.2363 2100.0 56.9069 2300.0 57.0698 71000.0 59.5419 2400.0 59.7823 2200.0 60.5184 2200.0 60.7785 2100.0 61.4088 2400.0 64.6239 2500.0 65.1121 2300.0 65.2772 2300.0 65.9928 2100.0 67.0541 19000.0 67.7233 2400.0 69.0697 29000.0 69.215 2500.0 70.7397 2500.0 71.0853 48000.0 74.9328 2500.0 79.0735 2600.0 81.0697 40000.0 81.3981 2500.0 83.0853 34000.0 85.101 25000.0 86.3315 2400.0 89.0892 2300.0 89.2906 2500.0 89.3312 2600.0 90.3656 2200.0 95.0854 36000.0 95.5617 2500.0 97.101 26000.0 103.0541 46000.0 103.7543 2900.0 105.0698 25000.0 108.4759 2300.0 109.1009 13000.0 111.1161 2700.0 111.5424 2700.0 114.5677 2600.0 117.0696 38000.0 118.0334 2600.0 123.0438 170000.0 128.7167 2500.0 131.0379 3000.0 131.0489 290000.0 131.0854 51000.0 133.0648 42000.0 135.0803 2600.0 136.3392 2200.0 137.0595 240000.0 142.9068 2800.0 145.0646 270000.0 145.0768 2500.0 145.1008 3300.0 146.0958 2200.0 147.0801 5200.0 149.0318 3700.0 149.0458 3400.0 149.0595 3200000.0 149.0699 36000.0 149.3131 2500.0 150.6722 2500.0 151.0752 1900000.0 151.0955 7200.0 159.0803 430000.0 161.0959 58000.0 163.0592 29000.0 163.0752 1600000.0 163.0912 17000.0 164.7045 2200.0 165.0912 10000.0 166.0858 30000.0 173.0961 61000.0 173.3371 2300.0 173.5188 2800.0 173.5287 84000.0 173.5417 39000.0 177.0733 5500.0 177.091 580000.0 184.024 2600.0 187.1117 35000.0 191.1065 100000.0 201.1274 13000.0 205.1212 6400.0 215.1404 2700.0 215.3985 2400.0 222.1417 2600.0 228.226 2600.0 251.9616 2400.0 268.2995 23000.0 270.135 2600.0 278.847 2400.0 287.6671 2400.0 330.8197 33000.0 368.112 2600.0 369.3148 12000.0 387.3255 310000.0 404.293 4500.0 404.352 330000.0 END IONS BEGIN IONS SCANS=649 PEPMASS=205.1954 CHARGE=1 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110000.0 123.1068 5000.0 123.1165 170000.0 131.9739 23000.0 133.0759 3800.0 133.1012 3500.0 133.9533 2600.0 135.1166 200000.0 136.7866 2700.0 137.1321 13000.0 147.1166 14000.0 149.0105 4900.0 149.0231 150000.0 149.1184 3600.0 149.1323 600000.0 154.9901 3900.0 162.1403 7400.0 163.148 35000.0 173.536 20000.0 182.5305 2200.0 205.1957 14000.0 END IONS BEGIN IONS SCANS=650 PEPMASS=393.2042 CHARGE=1 COLLISION_ENERGY=0.0 57.8902 2100.0 60.9098 2400.0 67.4581 2700.0 67.831 2400.0 71.1889 2300.0 71.282 2300.0 75.4654 2100.0 81.0695 7000.0 81.6425 2100.0 83.7285 2400.0 90.5955 2300.0 93.0696 16000.0 93.4142 2400.0 95.0489 7500.0 95.0851 11000.0 102.5165 2900.0 105.0695 16000.0 106.1025 2400.0 106.259 2500.0 107.0852 10000.0 108.0196 2400.0 109.1012 2700.0 114.7648 2500.0 119.0854 25000.0 119.1438 2200.0 121.1004 3700.0 121.1673 2500.0 122.6325 2400.0 131.0853 4000.0 133.1008 13000.0 143.0852 2500.0 143.1042 2400.0 145.1007 20000.0 147.1169 3100.0 149.023 15000.0 150.0266 16000.0 151.0275 2700.0 155.5091 2500.0 155.8644 2400.0 157.1009 7000.0 159.1163 8500.0 161.0959 2600.0 167.7121 2800.0 170.1121 2300.0 173.1329 3400.0 173.5245 35000.0 173.5366 77000.0 173.6607 2400.0 189.198 2500.0 197.1321 5900.0 198.7778 2400.0 261.5462 2600.0 322.2546 2900.0 341.0164 2500.0 352.4061 2400.0 385.5151 2700.0 393.2044 180000.0 END IONS BEGIN IONS SCANS=651 PEPMASS=371.222 CHARGE=1 COLLISION_ENERGY=0.0 55.0541 2700.0 67.0541 16000.0 69.0696 7700.0 79.0542 5500.0 81.0697 23000.0 85.0647 2600.0 90.0399 2400.0 91.054 5500.0 93.0333 5900.0 93.0696 14000.0 95.0489 4200.0 95.0853 11000.0 97.0646 140000.0 97.0721 3200.0 101.0596 4600.0 105.0696 12000.0 107.0489 42000.0 107.0853 33000.0 109.0646 15000.0 109.101 60000.0 111.0437 7800.0 115.0328 2000.0 119.0493 5000.0 119.0854 12000.0 121.0646 10000.0 121.1009 12000.0 123.0437 31000.0 123.0803 4500.0 123.1168 3400.0 127.0751 11000.0 129.0547 4400.0 131.0853 12000.0 133.0281 8300.0 133.0647 31000.0 133.1009 15000.0 135.0439 130000.0 135.0558 4000.0 135.0802 120000.0 135.1165 6700.0 137.0958 18000.0 143.0855 3200.0 145.0648 6800.0 145.1013 13000.0 147.0437 11000.0 147.0802 16000.0 147.1166 9500.0 149.0594 33000.0 149.0959 12000.0 149.1321 4700.0 149.9537 2600.0 151.0387 14000.0 151.1117 7600.0 157.1007 5300.0 159.0446 3500.0 159.0803 9400.0 159.1167 6700.0 161.0593 6500.0 161.0957 19000.0 161.1316 4300.0 163.1118 4600.0 163.1481 3500.0 165.0545 88000.0 171.0801 4400.0 171.1171 2900.0 173.0598 10000.0 173.0961 3500.0 173.1322 13000.0 173.5224 4800.0 173.5409 10000.0 175.0753 18000.0 175.1117 59000.0 175.148 6200.0 179.0699 7800.0 185.096 20000.0 186.1402 9200.0 187.0753 11000.0 187.1481 6900.0 189.0911 7200.0 191.1428 4600.0 199.1114 3400.0 199.1485 3100.0 201.0907 13000.0 203.1067 71000.0 204.1509 4900.0 205.0857 3700.0 205.1586 49000.0 207.1751 4200.0 213.0913 11000.0 215.1061 7700.0 225.1268 12000.0 231.1016 58000.0 233.1164 3600.0 237.1269 5200.0 241.123 4300.0 243.1375 17000.0 265.1205 2700.0 269.1184 3700.0 271.1318 3000.0 279.1388 4000.0 293.1904 3200.0 321.1852 22000.0 339.1949 100000.0 357.2064 3800.0 END IONS BEGIN IONS SCANS=652 PEPMASS=313.2741 CHARGE=1 COLLISION_ENERGY=0.0 48.249 2300.0 54.9998 2700.0 55.054 98000.0 55.4295 2400.0 56.2621 2300.0 57.0332 280000.0 57.0696 800000.0 57.0729 8100.0 57.0745 4100.0 57.8394 2200.0 63.719 2400.0 66.6876 2500.0 67.0506 2600.0 67.0539 110000.0 69.0695 110000.0 71.0852 430000.0 71.2221 2400.0 72.9142 2400.0 76.0987 2300.0 76.3944 2500.0 78.7745 2600.0 79.0542 5300.0 81.0696 140000.0 82.3117 2400.0 83.0852 110000.0 83.3012 2400.0 83.6132 2400.0 85.0644 5400.0 85.1008 210000.0 88.4928 2100.0 89.0594 33000.0 91.0538 7500.0 91.1879 2200.0 93.0699 7500.0 94.8297 2400.0 95.0852 240000.0 95.1472 2200.0 97.1009 47000.0 103.075 27000.0 109.1008 80000.0 114.1531 2400.0 115.5045 2100.0 116.8633 2400.0 121.1004 2900.0 123.1166 12000.0 137.1316 3100.0 138.7547 2100.0 141.1986 2300.0 150.4338 2300.0 152.3737 2500.0 159.9322 2400.0 161.2824 2700.0 161.6917 2400.0 165.0544 21000.0 167.0062 3000.0 173.5276 91000.0 173.5426 15000.0 194.9843 2300.0 206.6461 2600.0 214.7508 2500.0 241.517 2400.0 243.8504 2400.0 248.5272 2400.0 248.5964 2500.0 295.1705 2400.0 295.2573 2400.0 304.7907 2500.0 305.2124 2500.0 310.3064 2400.0 313.2724 8400.0 313.4336 2400.0 END IONS BEGIN IONS SCANS=653 PEPMASS=212.1437 CHARGE=1 COLLISION_ENERGY=0.0 41.0386 35000.0 42.0339 2500.0 42.8977 2600.0 43.0178 21000.0 43.0543 26000.0 44.9061 2100.0 44.9309 2500.0 44.9748 2000.0 47.4562 2600.0 47.5018 2400.0 49.242 2300.0 54.6814 2200.0 57.9082 2200.0 61.1685 2400.0 63.692 2300.0 65.0385 38000.0 65.5103 2500.0 68.4529 2200.0 71.087 2800.0 71.4887 2500.0 73.435 2200.0 73.5139 2200.0 74.2002 2400.0 76.3073 3100.0 77.0002 2300.0 79.0539 2900.0 80.6405 2200.0 82.664 2200.0 83.2669 2600.0 83.3726 2500.0 83.6367 2500.0 87.0731 2400.0 89.0126 2200.0 89.4717 2500.0 89.6591 2300.0 90.4827 2400.0 91.0541 60000.0 92.0493 1000000.0 92.0551 2400.0 92.5608 2400.0 93.0571 560000.0 93.0693 33000.0 94.0651 5600.0 95.3896 2300.0 98.7499 2400.0 100.7898 2300.0 104.9263 2200.0 106.0649 4800.0 107.0854 94000.0 108.6703 2200.0 115.0544 2800.0 117.0697 34000.0 119.0729 63000.0 119.0821 2100.0 119.9571 6300.0 120.0807 4200000.0 120.0889 10000.0 120.1011 2800.0 121.0251 2600.0 124.0839 14000.0 128.0619 2400.0 131.5398 2400.0 132.1019 2500.0 134.0861 4200.0 134.0963 300000.0 135.08 2700.0 135.0921 18000.0 135.1041 1200000.0 135.1164 19000.0 135.3704 2500.0 143.0854 36000.0 148.0247 2300.0 153.0565 2500.0 153.0698 76000.0 154.0653 2700.0 154.0939 5800.0 155.073 11000.0 155.1383 2200.0 155.9168 2400.0 161.5937 2900.0 168.0809 40000.0 169.072 3300.0 169.0886 730000.0 169.104 4600.0 170.0791 11000.0 170.0964 2400000.0 170.1137 9600.0 173.5236 23000.0 173.5338 110000.0 178.1956 2600.0 196.1125 3500.0 197.1184 64000.0 205.28 2400.0 207.1585 2400.0 210.1908 2400.0 212.0969 4600.0 212.1434 4600000.0 212.1902 3500.0 END IONS BEGIN IONS SCANS=654 PEPMASS=252.2324 CHARGE=1 COLLISION_ENERGY=0.0 44.0132 33000.0 44.0495 11000.0 53.0386 640000.0 55.0179 350000.0 55.0543 2000000.0 55.0568 18000.0 56.0495 67000.0 57.0336 30000.0 57.0699 3000000.0 57.0726 34000.0 58.0652 58000.0 59.0492 14000.0 60.0444 21000.0 61.7988 7400.0 65.0387 17000.0 67.0543 940000.0 68.0621 44000.0 69.0335 64000.0 69.0699 1400000.0 69.0734 11000.0 69.0745 12000.0 70.0651 130000.0 71.0491 30000.0 71.0855 86000.0 72.0444 260000.0 72.0807 140000.0 73.0648 73000.0 74.0964 170000.0 79.0543 390000.0 80.0495 28000.0 81.0335 1900000.0 81.0699 1400000.0 81.0743 17000.0 82.0651 47000.0 83.0437 11000.0 83.0491 240000.0 83.0856 620000.0 84.0444 370000.0 84.0809 92000.0 85.0525 21000.0 85.0647 16000.0 85.1012 20000.0 86.06 87000.0 86.0968 27000.0 86.6925 2500.0 91.0543 140000.0 93.07 250000.0 94.0651 45000.0 95.0492 710000.0 95.0856 1500000.0 95.9669 2600.0 96.0447 21000.0 96.0809 21000.0 97.0649 110000.0 97.1012 720000.0 98.0601 820000.0 98.0965 37000.0 99.0676 7100.0 99.0804 4700.0 100.0757 57000.0 100.1121 21000.0 105.07 180000.0 107.0856 140000.0 107.0936 4000.0 108.0808 38000.0 109.0649 290000.0 109.1013 410000.0 111.0677 11000.0 111.0805 42000.0 111.117 43000.0 112.0669 3900.0 112.0758 270000.0 112.112 31000.0 114.0915 30000.0 114.1279 31000.0 119.0765 13000.0 119.0857 220000.0 120.081 7500.0 121.1011 56000.0 122.0965 27000.0 123.0805 150000.0 123.117 23000.0 125.0969 10000.0 126.0915 240000.0 126.1279 17000.0 128.1071 65000.0 128.1435 210000.0 133.1015 68000.0 135.117 74000.0 136.112 9600.0 137.0962 54000.0 137.1326 120000.0 140.1072 120000.0 140.1435 11000.0 141.1151 15000.0 142.123 23000.0 151.1483 53000.0 152.107 37000.0 154.1228 250000.0 154.1592 31000.0 155.1306 13000.0 156.1386 11000.0 161.1327 110000.0 167.1306 33000.0 168.1386 88000.0 168.1749 15000.0 173.5314 100000.0 176.6467 7100.0 178.1595 51000.0 179.1435 130000.0 182.1544 43000.0 184.2061 36000.0 184.903 2600.0 196.17 670000.0 196.1909 5500.0 210.1863 9200.0 210.2217 18000.0 224.2378 30000.0 252.2326 1100000.0 END IONS BEGIN IONS SCANS=655 PEPMASS=409.2742 CHARGE=1 COLLISION_ENERGY=0.0 55.0177 13000.0 55.0539 150000.0 57.0697 62000.0 59.0489 23000.0 65.0387 3200.0 67.054 83000.0 68.8136 2200.0 69.0333 55000.0 69.0696 60000.0 69.5275 2200.0 71.0491 17000.0 71.1509 2400.0 71.8763 2400.0 77.0385 2200.0 79.0539 120000.0 81.0336 6400.0 81.0696 290000.0 82.853 3000.0 83.0489 48000.0 83.0854 18000.0 85.0646 29000.0 89.6016 2300.0 90.5395 2700.0 91.0482 4100.0 91.0538 170000.0 93.0631 3700.0 93.0697 400000.0 93.0769 3900.0 95.0489 470000.0 95.0548 2200.0 95.0853 260000.0 97.0646 85000.0 103.0542 2800.0 105.0447 6000.0 105.0697 850000.0 105.0774 15000.0 106.078 2800.0 107.0492 12000.0 107.0773 3800.0 107.0853 240000.0 109.0646 120000.0 109.101 81000.0 111.0436 3400.0 111.0803 22000.0 112.1594 2200.0 113.096 5900.0 115.0544 7200.0 117.0697 69000.0 119.0489 23000.0 119.0755 16000.0 119.0853 620000.0 119.095 20000.0 120.0934 23000.0 121.0553 4300.0 121.0646 170000.0 121.101 180000.0 123.0802 120000.0 123.1167 17000.0 125.0593 16000.0 125.096 9100.0 128.0625 16000.0 129.0697 52000.0 130.0776 20000.0 131.0854 190000.0 131.0966 3500.0 132.0932 20000.0 133.0646 61000.0 133.0745 3400.0 133.101 210000.0 135.0802 120000.0 135.1166 42000.0 135.1795 2700.0 137.0595 19000.0 137.0959 88000.0 139.112 3100.0 141.0698 15000.0 142.0776 81000.0 143.0854 150000.0 144.0932 43000.0 145.0648 16000.0 145.0873 2500.0 145.0909 2200.0 145.1011 430000.0 145.1143 9500.0 146.0729 3500.0 146.1086 29000.0 147.0803 210000.0 147.1167 580000.0 148.0882 12000.0 149.096 130000.0 150.1039 16000.0 151.0623 5100.0 151.0752 210000.0 151.0891 3600.0 153.0905 21000.0 155.0854 64000.0 155.1074 2800.0 156.0932 38000.0 157.0862 3300.0 157.1011 260000.0 158.0732 3000.0 158.1088 18000.0 159.0803 52000.0 159.1168 170000.0 160.0887 16000.0 161.096 97000.0 161.1325 54000.0 162.1022 3200.0 163.0752 6600.0 163.1117 58000.0 165.091 430000.0 167.0857 16000.0 167.1067 17000.0 168.0935 30000.0 169.1013 110000.0 170.109 35000.0 171.08 8700.0 171.1169 110000.0 171.1306 3400.0 172.0877 6500.0 172.1238 13000.0 173.0961 63000.0 173.1326 84000.0 173.5227 25000.0 173.5396 36000.0 174.1033 15000.0 175.1119 110000.0 175.1484 20000.0 177.0911 67000.0 177.1284 3400.0 178.099 50000.0 179.0859 11000.0 179.1065 2400.0 179.1443 2800.0 180.0935 11000.0 181.1013 38000.0 181.1182 9100.0 182.1091 28000.0 183.1169 110000.0 184.1246 12000.0 185.0959 18000.0 185.1325 68000.0 186.1049 4400.0 187.1117 47000.0 187.1482 30000.0 188.1185 3900.0 189.1274 65000.0 190.1324 2600.0 191.1064 8500.0 191.1425 15000.0 193.1011 24000.0 194.1091 22000.0 195.1169 54000.0 196.1246 32000.0 197.0971 6600.0 197.1327 54000.0 198.1391 3800.0 199.1121 31000.0 199.1482 25000.0 200.1193 12000.0 201.1276 72000.0 201.1631 18000.0 202.1318 2500.0 203.1432 160000.0 206.1104 6700.0 207.1167 25000.0 207.1384 70000.0 208.1247 9700.0 209.1328 50000.0 210.1402 11000.0 211.112 13000.0 211.1485 53000.0 213.1277 36000.0 213.1643 6100.0 215.1435 30000.0 216.1508 32000.0 219.1166 8000.0 219.1383 76000.0 220.125 10000.0 221.1322 23000.0 221.154 140000.0 223.149 27000.0 224.1555 3900.0 225.1279 12000.0 225.1641 28000.0 227.1431 18000.0 227.1795 4400.0 229.1593 24000.0 230.1287 2900.0 231.1163 2900.0 231.1385 24000.0 233.1306 13000.0 233.154 24000.0 234.1377 12000.0 234.1617 130000.0 235.1474 12000.0 236.1579 3100.0 237.1277 3600.0 237.1647 11000.0 239.1436 16000.0 239.1795 10000.0 241.1586 3800.0 243.1383 4100.0 247.1468 9200.0 248.1554 2700.0 249.1644 25000.0 251.1808 12000.0 253.1601 9700.0 254.1675 2900.0 255.1386 3400.0 255.1721 3200.0 261.1624 3200.0 263.1782 4300.0 267.1746 18000.0 268.1829 6000.0 269.1889 10000.0 271.17 8600.0 275.1833 3100.0 281.193 3800.0 285.1857 10000.0 286.1928 28000.0 287.2018 26000.0 300.2072 6500.0 312.2084 6000.0 319.6655 2500.0 329.2159 3300.0 345.8697 2400.0 347.2402 3400.0 369.8227 2400.0 409.2738 4600.0 END IONS BEGIN IONS SCANS=656 PEPMASS=657.2566 CHARGE=1 COLLISION_ENERGY=0.0 66.3582 18000.0 66.3611 5100.0 66.7102 2400.0 112.6137 2200.0 168.5534 2500.0 173.5216 11000.0 173.5372 46000.0 192.123 2700.0 220.664 2200.0 237.8922 2300.0 291.0912 2700.0 365.433 2600.0 396.94 2800.0 439.1406 8200.0 441.1921 47000.0 453.16 4500.0 467.1723 21000.0 468.1788 23000.0 469.1868 32000.0 481.1493 3800.0 495.1693 12000.0 496.1702 110000.0 497.181 20000.0 507.4714 2500.0 509.1837 20000.0 510.1921 2700.0 523.1977 9200.0 528.2371 10000.0 537.1681 2900.0 541.2416 13000.0 556.2298 10000.0 559.6758 3100.0 569.2372 160000.0 597.234 640000.0 598.2372 16000.0 599.3745 3600.0 601.2659 13000.0 625.2297 3700.0 628.2529 7200.0 629.2577 14000.0 657.2609 36000.0 657.3969 4600.0 END IONS BEGIN IONS SCANS=657 PEPMASS=391.2638 CHARGE=1 COLLISION_ENERGY=0.0 55.054 12000.0 57.0696 100000.0 58.6912 2600.0 60.5847 2200.0 61.2717 2200.0 61.8165 2400.0 62.8221 2400.0 65.0382 3700.0 67.054 15000.0 69.0696 15000.0 71.0852 88000.0 71.9915 2800.0 79.0539 38000.0 81.0696 60000.0 83.049 3200.0 83.0851 9200.0 83.8936 2600.0 85.0645 2700.0 91.054 30000.0 92.6343 2100.0 92.8909 2700.0 93.0695 93000.0 95.0437 2200.0 95.0488 88000.0 95.0851 37000.0 97.0646 9700.0 97.1031 2300.0 105.0695 75000.0 107.0852 65000.0 107.1981 2600.0 109.0646 14000.0 109.1009 24000.0 114.9388 2200.0 117.0696 16000.0 119.0852 78000.0 121.0284 2800.0 121.0643 22000.0 121.0881 2200.0 121.1008 51000.0 123.08 2400.0 129.0699 4400.0 131.0852 40000.0 133.0643 2800.0 133.1009 49000.0 133.9595 2300.0 135.0798 2900.0 135.1167 14000.0 142.0775 13000.0 143.0852 48000.0 144.0934 2600.0 145.1009 76000.0 147.0801 5400.0 147.1166 15000.0 149.023 930000.0 149.0957 2400.0 155.0852 15000.0 156.0403 2300.0 156.0925 18000.0 157.1008 76000.0 158.1091 5800.0 159.0803 2700.0 159.1167 57000.0 161.0959 18000.0 161.1322 10000.0 165.0712 2800.0 167.0339 9700.0 167.0846 3500.0 168.0941 3900.0 169.101 49000.0 170.1088 12000.0 171.1165 65000.0 172.1239 7300.0 173.097 9900.0 173.1322 24000.0 173.534 55000.0 179.0852 3700.0 181.1012 28000.0 182.1086 16000.0 183.1169 40000.0 185.1326 61000.0 187.148 38000.0 193.1015 17000.0 194.1087 7500.0 195.1169 60000.0 196.1246 17000.0 197.1324 54000.0 199.1112 12000.0 199.1478 12000.0 203.1443 3300.0 206.1092 9500.0 207.1168 34000.0 208.125 18000.0 209.1324 62000.0 210.1405 8700.0 211.1486 34000.0 213.1277 15000.0 213.1633 2700.0 217.1563 3300.0 219.1175 7900.0 220.1242 11000.0 221.1327 43000.0 222.1403 18000.0 223.1484 40000.0 224.1565 5100.0 225.1296 2500.0 225.1633 16000.0 231.1174 2700.0 232.1231 2800.0 233.133 16000.0 234.1402 7400.0 235.1481 29000.0 236.1555 12000.0 237.1632 20000.0 238.1709 9200.0 239.1426 3600.0 245.1321 6400.0 247.1482 16000.0 248.1582 3100.0 249.1638 73000.0 250.1717 3000.0 251.1445 2800.0 251.1788 19000.0 252.7919 2700.0 253.1949 4000.0 255.1736 3600.0 259.1479 7600.0 260.154 3000.0 261.1636 15000.0 262.1731 3000.0 263.1781 13000.0 264.1871 7800.0 265.1954 7800.0 267.1746 43000.0 273.1647 5600.0 275.1795 19000.0 277.1952 7600.0 278.4675 2300.0 282.198 19000.0 289.1954 10000.0 317.1888 2800.0 347.2362 3500.0 373.6614 2500.0 384.4745 2500.0 391.2098 14000.0 391.263 4600.0 394.8677 2400.0 END IONS BEGIN IONS SCANS=658 PEPMASS=409.2741 CHARGE=1 COLLISION_ENERGY=0.0 55.0177 19000.0 55.054 260000.0 56.314 2400.0 57.0333 16000.0 57.0696 110000.0 57.6606 2500.0 58.6529 2100.0 59.0489 50000.0 63.0009 2300.0 65.0385 8800.0 66.2301 2100.0 67.0507 3200.0 67.0539 180000.0 69.0332 100000.0 69.0696 110000.0 70.319 2300.0 71.0489 33000.0 73.1512 2700.0 77.0213 2300.0 77.0387 15000.0 78.654 2300.0 79.0494 3300.0 79.0538 240000.0 81.0332 25000.0 81.0696 580000.0 81.7877 2300.0 83.0488 89000.0 83.0853 33000.0 84.7642 2500.0 85.0645 64000.0 91.0539 310000.0 93.0696 810000.0 93.0768 6200.0 95.0489 930000.0 95.0572 7000.0 95.0852 520000.0 95.0927 4400.0 96.0567 2300.0 97.0644 190000.0 100.2472 2700.0 103.0541 14000.0 105.0441 7700.0 105.0696 1700000.0 105.0776 19000.0 105.1908 2500.0 106.0774 5500.0 107.0489 25000.0 107.0773 4800.0 107.085 510000.0 108.0568 5500.0 109.0573 4000.0 109.0645 230000.0 109.1008 280000.0 111.0433 5200.0 111.0802 43000.0 111.9836 2600.0 113.0598 2800.0 113.0959 11000.0 115.0541 17000.0 116.4338 2300.0 117.0609 2400.0 117.0696 140000.0 119.0489 41000.0 119.0582 2700.0 119.0755 10000.0 119.0852 1200000.0 119.0946 31000.0 120.093 45000.0 121.0553 12000.0 121.0645 340000.0 121.0911 7000.0 121.1009 370000.0 121.7202 2600.0 122.0722 6300.0 123.0801 260000.0 123.1167 27000.0 125.0594 31000.0 125.0956 11000.0 128.0618 25000.0 129.0696 90000.0 130.0774 38000.0 130.5589 2300.0 131.0748 12000.0 131.0853 370000.0 132.093 39000.0 133.0645 100000.0 133.1009 420000.0 133.1127 4300.0 134.0723 2400.0 134.109 2800.0 135.0801 240000.0 135.1166 85000.0 137.0594 35000.0 137.0958 170000.0 139.074 6600.0 139.111 5800.0 141.0698 31000.0 142.0775 160000.0 143.0853 300000.0 144.0569 2600.0 144.0929 79000.0 145.0649 34000.0 145.1009 890000.0 145.1161 14000.0 146.0729 12000.0 146.1084 47000.0 147.0802 380000.0 147.0942 4900.0 147.1165 1100000.0 147.1275 8900.0 148.0877 23000.0 149.0958 240000.0 149.132 10000.0 150.1034 35000.0 151.0621 4400.0 151.0751 440000.0 151.0892 10000.0 151.1111 3900.0 153.0907 38000.0 154.0775 5400.0 155.0852 120000.0 156.093 87000.0 157.0862 7700.0 157.1009 500000.0 157.1165 3400.0 158.0725 6400.0 158.1086 36000.0 159.0803 110000.0 159.1024 4700.0 159.1166 340000.0 160.0878 37000.0 161.0959 190000.0 161.1322 110000.0 163.0756 9900.0 163.1116 110000.0 165.0705 6600.0 165.0909 820000.0 165.1037 2300.0 166.0784 3000.0 166.0953 2500.0 167.0854 33000.0 167.1065 35000.0 168.0931 66000.0 169.1012 220000.0 170.1091 66000.0 171.081 21000.0 171.1167 240000.0 172.0882 12000.0 172.1242 33000.0 173.0961 120000.0 173.1324 180000.0 173.5278 76000.0 173.5348 18000.0 173.5452 18000.0 174.1037 32000.0 175.1117 210000.0 175.1481 46000.0 176.1177 6800.0 177.091 120000.0 177.1271 14000.0 178.0987 100000.0 179.0855 28000.0 179.1047 3600.0 180.0933 15000.0 181.1012 87000.0 181.1206 12000.0 182.1089 51000.0 183.1168 230000.0 184.1242 14000.0 185.0959 34000.0 185.1325 140000.0 186.1028 9500.0 186.1398 2800.0 187.1117 100000.0 187.1272 3100.0 187.148 53000.0 188.1191 2400.0 189.0925 2400.0 189.1273 140000.0 189.7785 2700.0 190.1345 15000.0 191.1066 14000.0 191.1424 42000.0 193.1012 46000.0 193.1206 8000.0 194.1088 33000.0 195.1168 120000.0 196.1246 61000.0 197.0966 15000.0 197.1325 110000.0 198.1395 23000.0 199.1117 68000.0 199.1482 43000.0 200.1192 23000.0 201.1273 150000.0 201.1636 32000.0 202.1346 2600.0 203.1226 3900.0 203.1431 290000.0 205.1011 3800.0 206.1091 26000.0 207.1167 58000.0 207.1382 140000.0 208.1246 26000.0 209.1324 100000.0 209.1536 3800.0 210.1407 8300.0 211.112 33000.0 211.1482 110000.0 213.1274 62000.0 213.1641 18000.0 213.4037 2600.0 214.1348 13000.0 215.1084 3000.0 215.1431 60000.0 216.1508 77000.0 217.1229 3800.0 217.159 4800.0 219.1173 14000.0 219.1382 140000.0 220.1249 28000.0 221.1322 51000.0 221.1538 270000.0 222.1391 10000.0 223.1122 6600.0 223.1482 59000.0 224.1547 3300.0 225.1269 26000.0 225.1639 54000.0 226.1351 3500.0 227.143 31000.0 227.1794 7300.0 229.1234 2700.0 229.1588 50000.0 230.128 2800.0 231.1152 3300.0 231.1382 56000.0 233.1309 20000.0 233.1542 46000.0 234.1391 17000.0 234.1615 260000.0 234.1888 2400.0 235.148 34000.0 236.1545 10000.0 237.1272 8500.0 237.1644 18000.0 239.1433 23000.0 239.1795 24000.0 241.1595 18000.0 243.1381 15000.0 246.1401 2700.0 247.1463 14000.0 248.1548 3300.0 249.1637 51000.0 251.1434 2600.0 251.179 23000.0 253.1589 27000.0 254.1649 3100.0 255.1387 8500.0 255.1744 6800.0 259.1473 4900.0 260.1569 4100.0 261.163 13000.0 263.1794 14000.0 267.1743 34000.0 268.1809 11000.0 269.19 26000.0 271.1697 24000.0 273.1631 3000.0 275.1799 3700.0 277.1964 2900.0 279.2132 2800.0 281.1903 9200.0 282.1977 7400.0 285.186 11000.0 286.193 58000.0 287.2008 62000.0 291.1758 2800.0 293.1916 3300.0 299.2014 2800.0 300.2081 15000.0 311.9152 2600.0 312.2083 6900.0 356.5939 2600.0 377.5165 2700.0 391.2625 2600.0 409.2755 15000.0 END IONS BEGIN IONS SCANS=659 PEPMASS=343.2272 CHARGE=1 COLLISION_ENERGY=0.0 51.346 2600.0 51.849 2200.0 54.2027 2100.0 55.054 98000.0 56.0654 2500.0 57.0697 66000.0 57.8658 2200.0 58.778 2600.0 59.0468 2700.0 60.5007 2100.0 61.4334 2800.0 61.7903 2400.0 62.5177 2500.0 62.7038 2600.0 63.47 2200.0 65.9623 2800.0 67.0539 110000.0 69.0695 440000.0 70.5625 2300.0 70.592 2300.0 71.5594 2200.0 71.9377 2400.0 72.5346 2500.0 74.0904 2500.0 76.9514 2500.0 79.0541 22000.0 79.3208 2200.0 81.0695 540000.0 83.0852 110000.0 84.0757 2500.0 84.1117 2500.0 91.054 21000.0 91.1628 2100.0 91.4401 2200.0 91.5177 2900.0 93.0696 47000.0 94.3016 2200.0 95.0489 7500.0 95.0852 550000.0 95.6367 2200.0 97.0949 3100.0 97.1009 130000.0 105.0696 17000.0 105.3809 2500.0 107.0489 110000.0 107.0851 42000.0 108.6148 2600.0 109.0927 12000.0 109.1009 490000.0 111.1166 18000.0 117.8008 2700.0 119.0491 16000.0 119.0849 2500.0 121.0648 29000.0 121.101 50000.0 121.3639 2500.0 123.1166 410000.0 124.0236 2300.0 131.1565 2400.0 132.1843 2600.0 133.0537 3400.0 133.0647 160000.0 135.1167 58000.0 137.1323 200000.0 138.3834 2500.0 138.6245 2200.0 145.0274 2500.0 145.0647 6300.0 147.0429 2800.0 147.0803 66000.0 149.1324 64000.0 151.0244 11000.0 151.0389 2400000.0 151.0515 17000.0 151.0594 3500.0 151.1484 4500.0 153.0544 2800.0 158.9876 2600.0 159.0443 2600.0 159.0802 20000.0 161.0608 2200.0 161.0961 150000.0 163.0393 46000.0 163.1481 2800.0 164.2899 2800.0 165.0547 460000.0 165.07 4300.0 171.4464 2400.0 173.061 3200.0 173.5243 11000.0 173.5334 140000.0 173.5447 17000.0 175.0392 24000.0 175.1119 56000.0 177.0397 2300.0 177.0548 120000.0 177.7501 2100.0 179.0704 92000.0 179.1792 3400.0 180.044 2400.0 183.257 2600.0 187.0753 27000.0 189.0546 68000.0 191.0703 66000.0 191.1791 19000.0 193.0861 57000.0 193.1943 5600.0 199.3375 2300.0 201.0911 35000.0 203.0705 27000.0 205.0861 43000.0 205.1959 6300.0 207.101 5800.0 217.0866 44000.0 219.102 39000.0 227.1057 5800.0 229.7833 2700.0 231.1021 35000.0 233.1161 9600.0 240.3496 2500.0 245.1174 21000.0 247.1336 38000.0 259.1335 38000.0 259.466 2300.0 261.1476 7400.0 273.1491 14000.0 287.1638 5400.0 289.1454 2500.0 290.0236 2500.0 290.5768 2900.0 299.4648 2700.0 301.8461 2400.0 325.2153 4500.0 336.8799 2800.0 342.9721 2300.0 343.2279 310000.0 343.2719 4200.0 END IONS BEGIN IONS SCANS=660 PEPMASS=205.1954 CHARGE=1 COLLISION_ENERGY=0.0 41.0386 290000.0 42.0337 140000.0 43.0541 130000.0 44.9044 12000.0 47.997 10000.0 50.9443 2900.0 51.0231 49000.0 51.1902 2400.0 53.002 19000.0 53.0384 510000.0 54.2647 4200.0 55.0543 6200000.0 55.0572 55000.0 55.0587 50000.0 55.9342 12000.0 57.0697 1400000.0 57.7618 3000.0 61.2577 11000.0 64.0657 2200.0 65.0385 160000.0 65.6367 2400.0 66.0461 17000.0 66.2322 2800.0 67.054 4200000.0 67.0582 22000.0 69.07 9300000.0 69.075 97000.0 69.076 54000.0 69.0786 25000.0 71.0852 300000.0 71.9291 4100.0 72.9368 300000.0 77.0384 310000.0 77.3592 11000.0 79.0543 7400000.0 79.0593 39000.0 79.062 56000.0 79.4773 4100.0 80.0619 50000.0 80.359 2300.0 81.0697 30000000.0 81.0784 190000.0 81.0792 650000.0 81.0806 110000.0 81.0908 14000.0 82.1477 2900.0 82.4796 13000.0 83.0852 1600000.0 90.9474 140000.0 91.054 3200000.0 92.0618 3800.0 93.0621 53000.0 93.0696 35000000.0 93.0763 170000.0 93.0814 860000.0 93.0832 110000.0 93.0878 55000.0 94.0773 5100.0 95.0489 900000.0 95.0853 9000000.0 95.0921 42000.0 95.0969 100000.0 95.88 3000.0 97.1009 1000000.0 98.3311 2800.0 99.9477 27000.0 100.7374 3100.0 102.803 4500.0 103.0541 150000.0 105.0445 300000.0 105.0617 27000.0 105.0696 2900000.0 105.0782 44000.0 106.0774 200000.0 107.0488 3300.0 107.0853 12000000.0 107.0927 43000.0 108.0933 21000.0 108.3866 2400.0 108.9582 2800.0 109.0646 320000.0 109.101 5200000.0 109.1102 11000.0 111.1166 190000.0 113.9548 4700.0 113.9634 470000.0 114.2856 2400.0 115.943 3300.0 116.5102 14000.0 116.8067 3500.0 118.8396 2300.0 119.0604 120000.0 119.0853 640000.0 120.0036 3100.0 120.0945 8300.0 121.0899 60000.0 121.1009 46000000.0 121.1121 980000.0 121.1221 160000.0 121.1231 470000.0 121.1273 66000.0 121.139 12000.0 122.3941 4400.0 123.0713 4000.0 123.0802 800000.0 123.1166 2400000.0 123.1259 2300.0 131.9742 54000.0 133.0759 210000.0 133.1012 75000.0 133.9524 3400.0 135.1166 3400000.0 135.1271 50000.0 135.9436 2300.0 137.1323 300000.0 140.2865 2900.0 147.1167 130000.0 149.0232 39000.0 149.1185 9700.0 149.1323 5900000.0 152.2046 3200.0 154.9905 5600.0 156.0025 2300.0 161.1333 16000.0 163.148 500000.0 165.337 2300.0 165.6118 10000.0 173.5253 18000.0 173.5374 120000.0 174.8727 2200.0 184.0488 2500.0 187.1268 2700.0 205.1953 220000.0 205.478 2500.0 212.386 2700.0 END IONS BEGIN IONS SCANS=661 PEPMASS=623.2508 CHARGE=1 COLLISION_ENERGY=0.0 65.6929 2200.0 66.8949 2500.0 67.2479 6800.0 67.2504 4600.0 69.9394 2400.0 70.3521 2400.0 70.791 2300.0 70.8498 2500.0 80.6857 2300.0 82.9107 2200.0 83.3349 2600.0 85.2948 2300.0 85.5301 2200.0 87.1205 2400.0 94.9985 2500.0 103.1302 2500.0 106.1228 2700.0 112.6563 2400.0 116.0325 2200.0 118.7059 2300.0 123.255 2900.0 133.6258 2200.0 148.661 2200.0 152.0089 3000.0 153.3601 2400.0 160.2935 2200.0 161.3647 2800.0 164.2809 2500.0 173.528 86000.0 173.5407 20000.0 225.2952 2600.0 251.678 2500.0 308.7775 2700.0 376.3563 2700.0 421.374 2700.0 434.2132 2800.0 435.2146 4800.0 436.2227 3700.0 444.1948 10000.0 445.2048 3400.0 461.1955 7300.0 462.2043 6600.0 462.2151 3100.0 463.2069 7700.0 471.2174 59000.0 472.1877 6400.0 473.1982 71000.0 474.2049 5800.0 475.2131 9600.0 483.2234 4200.0 485.1964 19000.0 486.206 20000.0 487.2129 12000.0 489.2248 58000.0 490.205 31000.0 490.2225 6000.0 491.2092 30000.0 492.2147 2800.0 499.2125 310000.0 500.1862 58000.0 501.2251 88000.0 502.1994 3000.0 503.2066 41000.0 505.2248 2700.0 507.2362 27000.0 508.2457 23000.0 511.2116 25000.0 513.1916 100000.0 514.2027 15000.0 516.2135 11000.0 517.2226 450000.0 517.2942 2200.0 518.2148 26000.0 518.2266 2700.0 519.2042 30000.0 521.2103 3000.0 527.2067 88000.0 528.2139 3600.0 529.2227 360000.0 531.2028 100000.0 532.207 4900.0 535.233 180000.0 536.2412 36000.0 545.2176 1400000.0 545.3179 7500.0 546.2201 5800.0 547.234 23000.0 549.2351 6700.0 555.2028 110000.0 562.2224 15000.0 563.2292 79000.0 564.2367 140000.0 573.2129 490000.0 577.244 210000.0 591.2239 110000.0 595.2554 53000.0 605.2391 420000.0 605.326 2200.0 623.2494 220000.0 END IONS BEGIN IONS SCANS=662 PEPMASS=600.4176 CHARGE=1 COLLISION_ENERGY=0.0 65.039 2500.0 67.054 10000.0 69.0333 3700.0 69.0696 24000.0 69.6796 2200.0 70.5545 2300.0 70.7738 2100.0 79.0539 12000.0 81.0695 43000.0 83.0489 9900.0 83.0853 21000.0 85.0648 3200.0 89.0595 8500.0 91.0541 15000.0 92.1283 2500.0 93.0695 64000.0 95.0491 2600.0 95.0851 50000.0 97.0644 13000.0 97.1015 3500.0 98.5855 2600.0 100.7801 2400.0 105.0695 46000.0 105.0769 3300.0 107.0851 78000.0 109.0646 7800.0 109.1008 45000.0 111.0797 2800.0 111.1163 2500.0 117.0692 8300.0 119.0851 100000.0 121.0644 10000.0 121.1008 110000.0 123.0808 3500.0 123.1164 18000.0 125.0597 2800.0 125.0955 14000.0 127.1432 2500.0 131.0852 41000.0 133.1008 71000.0 135.0802 13000.0 135.1165 44000.0 137.0957 5500.0 139.1114 15000.0 142.0772 3200.0 143.0852 31000.0 144.0939 3200.0 145.0646 5600.0 145.1008 93000.0 147.1164 28000.0 148.5116 2300.0 149.0958 25000.0 149.1321 12000.0 155.0848 6500.0 156.0932 3000.0 157.1009 55000.0 159.0803 13000.0 159.1165 64000.0 161.0964 12000.0 161.1322 16000.0 163.1117 13000.0 166.5688 2600.0 167.1064 85000.0 169.1008 23000.0 171.1165 40000.0 171.131 2400.0 173.1323 38000.0 173.518 2800.0 173.5315 86000.0 175.1119 12000.0 175.1479 36000.0 177.127 12000.0 178.9315 2400.0 181.1012 17000.0 182.107 2800.0 183.0079 2300.0 183.1168 32000.0 185.0958 3000.0 185.1323 24000.0 187.1478 21000.0 193.1024 4300.0 194.2463 2800.0 195.1165 25000.0 196.1241 5700.0 197.1137 3400.0 197.1322 33000.0 199.1103 2900.0 199.148 19000.0 201.1637 16000.0 203.1425 4100.0 207.1165 13000.0 209.1323 29000.0 211.1117 3800.0 211.1481 20000.0 213.1269 5300.0 213.1637 6500.0 217.1577 2800.0 219.1375 3500.0 221.1323 16000.0 221.1548 2500.0 223.1483 23000.0 225.1644 6000.0 227.1437 2400.0 233.1549 7700.0 235.148 8100.0 237.1639 10000.0 239.1796 8000.0 241.1594 2300.0 247.1471 12000.0 247.2422 6300.0 249.1625 6200.0 251.1795 3100.0 261.1633 3900.0 261.5549 2300.0 263.1797 5300.0 265.1953 6500.0 265.2522 12000.0 275.1788 3200.0 285.2184 3100.0 306.8998 2600.0 337.6905 2600.0 339.2906 12000.0 356.1843 2400.0 379.5291 2400.0 402.5135 3000.0 407.3105 2400.0 459.5454 2200.0 593.4709 2400.0 END IONS BEGIN IONS SCANS=663 PEPMASS=349.2528 CHARGE=1 COLLISION_ENERGY=0.0 54.8208 2500.0 55.054 25000.0 57.0697 10000.0 57.7284 2200.0 65.4916 2200.0 67.0539 39000.0 68.8048 2600.0 69.0695 32000.0 70.5837 2400.0 71.0488 4500.0 72.0827 2300.0 72.4475 2500.0 74.2379 2400.0 77.0383 2600.0 78.5753 2200.0 79.0538 34000.0 80.2069 2200.0 81.0696 63000.0 81.9051 2200.0 82.188 2600.0 83.0852 12000.0 86.1364 2400.0 91.0539 45000.0 93.0639 2700.0 93.0695 120000.0 95.0489 46000.0 95.0852 91000.0 97.0644 21000.0 105.0695 120000.0 105.4472 2400.0 107.0852 100000.0 109.0648 12000.0 109.1008 76000.0 117.0696 21000.0 119.0851 140000.0 121.0643 5400.0 121.1008 130000.0 123.0801 12000.0 123.1166 14000.0 129.0694 12000.0 131.0852 80000.0 132.0923 2500.0 133.1009 74000.0 135.0801 14000.0 135.1165 33000.0 142.0778 16000.0 143.0852 56000.0 144.0931 21000.0 145.1009 110000.0 146.1077 2600.0 147.0802 9400.0 147.1165 33000.0 149.0958 5400.0 155.0854 19000.0 156.0932 15000.0 157.1009 84000.0 158.1093 8500.0 159.1166 49000.0 160.8317 2800.0 161.0957 25000.0 161.1323 17000.0 167.0852 5400.0 168.0931 3000.0 169.1011 28000.0 170.109 15000.0 171.1167 45000.0 172.1245 11000.0 172.2857 2300.0 173.0962 4400.0 173.1323 34000.0 173.5286 32000.0 173.5383 16000.0 175.1113 3000.0 175.1479 10000.0 175.5508 2900.0 179.0853 8600.0 179.1426 3000.0 180.0933 2600.0 181.1009 14000.0 182.1084 4600.0 183.1168 28000.0 184.1248 3200.0 185.0957 2600.0 185.1325 33000.0 187.111 3500.0 187.148 24000.0 189.1288 2500.0 194.1086 14000.0 195.1168 24000.0 196.1245 4900.0 197.1322 28000.0 199.1486 11000.0 201.1633 2700.0 207.1156 5900.0 209.1328 25000.0 210.1407 6100.0 211.1486 14000.0 221.1308 3400.0 223.1482 9500.0 225.1642 14000.0 227.1427 3000.0 233.1322 2700.0 251.1797 9100.0 309.5614 2800.0 338.7448 2700.0 347.6337 2700.0 349.2532 12000.0 END IONS BEGIN IONS SCANS=664 PEPMASS=367.2632 CHARGE=1 COLLISION_ENERGY=0.0 55.054 41000.0 57.0696 29000.0 59.0489 9800.0 59.4118 2500.0 64.2837 2300.0 67.0539 62000.0 69.0332 21000.0 69.0695 49000.0 70.4559 2000.0 71.0489 18000.0 75.1246 2300.0 76.401 2100.0 79.0539 57000.0 80.6749 2300.0 80.9009 2200.0 81.0695 120000.0 83.0489 10000.0 83.0853 22000.0 85.0645 6800.0 88.7974 2200.0 90.21 2400.0 91.0484 3000.0 91.0539 66000.0 93.0693 180000.0 95.0488 73000.0 95.0849 170000.0 97.0645 40000.0 102.0475 2400.0 105.0695 160000.0 107.0494 2600.0 107.0773 3300.0 107.0851 150000.0 109.0643 33000.0 109.1008 110000.0 111.0802 8400.0 115.0545 2500.0 116.0618 2600.0 117.0694 35000.0 119.0852 230000.0 120.5757 2800.0 121.0645 26000.0 121.0921 7300.0 121.1008 140000.0 123.0803 16000.0 123.1167 24000.0 128.0619 12000.0 129.0697 25000.0 130.0776 5200.0 131.0852 160000.0 132.0939 2800.0 133.0651 2700.0 133.0904 3500.0 133.1009 160000.0 135.0801 39000.0 135.1166 44000.0 137.0957 11000.0 142.0774 28000.0 143.0852 95000.0 144.0928 27000.0 145.1009 180000.0 145.1138 3200.0 146.0722 9100.0 146.1073 9300.0 147.0802 28000.0 147.1165 58000.0 149.0959 24000.0 149.1321 3700.0 154.0771 2600.0 155.0854 25000.0 156.0926 27000.0 157.1008 140000.0 158.1084 20000.0 159.0806 16000.0 159.1165 110000.0 160.0891 3300.0 160.1241 2700.0 161.0959 120000.0 161.132 22000.0 163.1117 2600.0 167.0859 9800.0 168.0926 6300.0 169.101 49000.0 170.1087 21000.0 171.1166 76000.0 172.1237 15000.0 172.7208 2200.0 173.0961 18000.0 173.1323 77000.0 173.521 5300.0 173.5354 32000.0 175.1116 16000.0 175.1482 30000.0 179.0854 19000.0 180.0937 2700.0 181.1009 22000.0 182.1087 15000.0 183.1167 54000.0 184.1238 16000.0 185.0956 4300.0 185.1324 49000.0 186.1392 6300.0 187.1479 26000.0 192.9927 2400.0 193.1016 9000.0 194.1088 26000.0 195.1168 30000.0 196.1238 16000.0 197.1322 39000.0 199.148 24000.0 200.1556 3300.0 201.127 7300.0 201.1635 11000.0 203.804 2700.0 206.1899 2700.0 207.1172 7300.0 209.1324 36000.0 210.1381 5700.0 211.1481 23000.0 212.1571 2400.0 213.1284 7500.0 221.1317 4300.0 223.148 6700.0 225.1634 13000.0 227.143 3500.0 236.1552 3200.0 237.1631 8500.0 238.9835 2300.0 239.1807 4800.0 251.1788 4100.0 255.1734 2400.0 279.1737 3700.0 291.8649 3000.0 302.4102 2500.0 307.1965 2300.0 316.472 2600.0 END IONS BEGIN IONS SCANS=665 PEPMASS=618.428 CHARGE=1 COLLISION_ENERGY=0.0 67.0538 24000.0 69.033 14000.0 69.0694 20000.0 71.0487 8900.0 77.4071 2100.0 79.0539 29000.0 80.0616 5400.0 80.8521 2600.0 81.0694 110000.0 83.0486 34000.0 83.085 190000.0 85.0642 17000.0 85.3169 2600.0 86.7603 2400.0 89.7197 2500.0 91.0538 24000.0 93.0693 100000.0 95.0434 2500.0 95.0486 69000.0 95.085 89000.0 95.461 2800.0 97.0643 69000.0 99.0437 21000.0 105.0694 100000.0 106.0776 3300.0 107.085 150000.0 109.0643 43000.0 109.1006 66000.0 111.08 21000.0 113.0955 37000.0 117.0694 18000.0 119.085 180000.0 120.0927 22000.0 121.0643 23000.0 121.1007 140000.0 123.08 71000.0 123.116 18000.0 125.0592 22000.0 125.0956 61000.0 128.0619 2800.0 129.0695 15000.0 131.0851 87000.0 132.0928 18000.0 133.0645 3300.0 133.0905 6400.0 133.1007 130000.0 134.1083 12000.0 135.08 54000.0 135.1165 46000.0 136.0882 2300.0 137.059 4200.0 137.0957 35000.0 139.0748 12000.0 139.1112 55000.0 141.0909 2500.0 142.0775 13000.0 143.085 80000.0 144.0928 47000.0 145.1007 220000.0 145.114 3300.0 146.1077 13000.0 147.08 67000.0 147.1163 69000.0 149.0957 47000.0 149.1325 3400.0 150.1041 3500.0 151.075 47000.0 151.1112 9900.0 153.0905 17000.0 155.085 27000.0 155.1061 38000.0 156.0932 19000.0 157.1007 200000.0 158.1084 37000.0 159.08 27000.0 159.1164 140000.0 160.0878 77000.0 160.1239 3500.0 161.0957 54000.0 161.132 34000.0 162.1023 2600.0 163.1114 82000.0 165.0907 200000.0 165.1263 14000.0 166.0941 3600.0 167.0858 3400.0 167.1063 47000.0 168.114 3300.0 169.101 69000.0 169.117 2700.0 169.1226 2500.0 170.1088 24000.0 171.0807 3500.0 171.1013 9800.0 171.1166 140000.0 172.124 49000.0 173.096 36000.0 173.1324 78000.0 173.5234 20000.0 173.5389 41000.0 174.1028 3100.0 175.1115 54000.0 175.1478 19000.0 176.1189 8400.0 177.0904 12000.0 177.1269 16000.0 178.0982 11000.0 179.106 9500.0 179.1428 27000.0 180.1142 13000.0 181.1012 28000.0 181.122 120000.0 182.1089 13000.0 182.1259 3000.0 183.1165 81000.0 183.1375 25000.0 184.1236 18000.0 185.0961 14000.0 185.1322 95000.0 186.1396 10000.0 187.1114 46000.0 187.1271 2600.0 187.1302 2500.0 187.148 53000.0 189.1271 47000.0 190.1348 67000.0 191.1064 16000.0 191.1426 44000.0 193.1027 14000.0 193.1221 43000.0 194.1094 9000.0 194.1297 5900.0 195.1164 54000.0 195.1368 18000.0 196.1243 15000.0 197.1322 110000.0 198.1045 2800.0 198.1387 14000.0 199.1116 24000.0 199.1481 46000.0 200.1193 2600.0 201.1271 38000.0 201.1628 4100.0 202.1351 2400.0 203.1429 130000.0 204.1477 3100.0 205.1223 5200.0 206.1095 2900.0 207.1165 30000.0 207.138 56000.0 208.1248 9800.0 208.1456 51000.0 209.1323 87000.0 209.1533 14000.0 210.1395 13000.0 211.1116 20000.0 211.1482 68000.0 212.1194 4400.0 212.155 10000.0 213.127 32000.0 213.1636 23000.0 215.1432 28000.0 216.1509 13000.0 217.1233 8600.0 217.1584 5700.0 219.1162 7400.0 219.1382 30000.0 221.1324 29000.0 221.1536 340000.0 222.1392 4700.0 222.1594 3400.0 223.1483 52000.0 224.1557 10000.0 225.1262 17000.0 225.1484 44000.0 225.1669 13000.0 227.1429 20000.0 227.1798 17000.0 228.1513 3100.0 229.1587 21000.0 231.1381 36000.0 231.1735 3800.0 233.131 12000.0 233.1537 120000.0 234.1388 7700.0 234.1613 66000.0 235.1479 27000.0 237.127 17000.0 237.1638 40000.0 238.1695 3500.0 239.1429 12000.0 239.1794 18000.0 241.1588 16000.0 243.1376 3000.0 243.174 5200.0 245.1543 14000.0 246.1616 15000.0 247.1461 8000.0 247.1694 73000.0 249.1302 2400.0 249.1635 24000.0 251.1441 10000.0 251.179 25000.0 253.1585 23000.0 253.1918 6300.0 255.174 42000.0 257.1894 9800.0 259.1708 14000.0 260.1777 3100.0 261.1613 10000.0 261.1866 11000.0 263.1796 17000.0 265.1597 12000.0 265.1951 14000.0 267.1741 22000.0 269.1577 3400.0 269.1899 26000.0 271.1695 17000.0 273.1852 38000.0 274.1934 23000.0 275.1793 8400.0 277.1943 7000.0 279.1752 16000.0 281.156 2700.0 281.1898 24000.0 283.1711 14000.0 285.1857 20000.0 286.1929 61000.0 287.2009 410000.0 291.2113 9900.0 293.1899 8400.0 294.199 2900.0 295.1718 3700.0 295.2061 14000.0 297.1853 23000.0 298.1946 13000.0 299.2007 70000.0 300.2073 17000.0 303.1976 10000.0 307.2059 13000.0 308.5944 2500.0 309.1847 11000.0 309.2226 3000.0 310.1932 10000.0 311.2009 20000.0 312.2083 24000.0 313.2159 46000.0 315.2109 2800.0 319.2054 24000.0 321.2203 3300.0 323.1995 7100.0 325.2162 37000.0 326.2242 2900.0 329.2134 14000.0 333.2196 3800.0 334.2269 2700.0 337.2164 68000.0 339.2323 49000.0 352.2399 200000.0 353.248 47000.0 363.2291 3700.0 365.2478 92000.0 367.264 18000.0 377.2483 6900.0 379.2651 3000.0 391.2663 3900.0 395.2588 75000.0 404.8769 2600.0 438.3198 2800.0 440.2897 3800.0 480.3233 23000.0 523.3452 2900.0 525.3589 27000.0 526.3604 11000.0 538.3661 91000.0 603.4066 3300.0 END IONS BEGIN IONS SCANS=666 PEPMASS=655.3128 CHARGE=1 COLLISION_ENERGY=0.0 68.8082 2700.0 68.8119 2500.0 69.0398 2100.0 74.7924 2300.0 78.0213 2200.0 78.4348 2300.0 82.3461 2400.0 82.8247 2500.0 87.7992 2100.0 88.6985 2600.0 89.627 2100.0 100.2424 2300.0 101.4958 2900.0 101.9628 2300.0 107.952 2500.0 112.0262 2400.0 120.6302 2400.0 131.7962 2800.0 131.8931 2300.0 138.3925 2300.0 163.9611 2500.0 173.5251 57000.0 173.5334 29000.0 173.544 32000.0 178.4724 2700.0 187.3214 2500.0 227.1182 3200.0 239.1528 5300.0 246.8627 2400.0 269.1276 2700.0 275.8958 2700.0 327.1736 7800.0 334.1938 2500.0 351.6282 2400.0 355.2712 2600.0 384.1714 22000.0 389.2112 4000.0 390.2169 16000.0 402.2176 14000.0 406.2123 8400.0 407.2223 11000.0 412.1655 40000.0 419.2231 3300.0 420.2285 21000.0 421.236 26000.0 426.182 22000.0 427.1894 12000.0 433.2366 28000.0 434.2425 7100.0 435.2522 48000.0 436.2599 92000.0 444.1927 27000.0 447.2477 2700.0 448.2602 69000.0 449.233 2800.0 450.6787 2500.0 454.5166 3000.0 460.2275 8300.0 463.2128 46000.0 473.235 15000.0 474.2415 3500.0 475.2138 12000.0 477.2289 45000.0 487.2508 11000.0 488.2576 3700.0 491.2438 19000.0 492.2558 5400.0 505.2605 3800.0 509.2889 7200.0 515.2439 16000.0 517.226 10000.0 519.279 9200.0 520.2826 38000.0 531.2402 14000.0 532.2517 3400.0 532.2648 2600.0 533.259 35000.0 535.2343 19000.0 536.2439 16000.0 537.284 12000.0 546.2677 2800.0 547.2707 9300.0 549.2583 21000.0 553.2659 4100.0 559.2694 120000.0 561.2867 320000.0 561.3864 8800.0 563.2662 170000.0 564.2736 390000.0 565.2788 21000.0 577.2739 66000.0 578.2885 83000.0 580.2638 40000.0 581.2726 2900.0 587.2675 11000.0 591.2746 60000.0 593.3132 150000.0 594.2515 2900.0 595.29 46000.0 600.5212 2800.0 605.2755 100000.0 608.2603 42000.0 609.2805 3500.0 619.2915 300000.0 623.2855 29000.0 637.3023 160000.0 640.2848 58000.0 655.3082 34000.0 END IONS BEGIN IONS SCANS=667 PEPMASS=205.1954 CHARGE=1 COLLISION_ENERGY=0.0 41.0385 400000.0 42.0337 92000.0 43.0541 170000.0 48.8218 5600.0 51.023 25000.0 53.0021 3400.0 53.0205 5700.0 53.0384 370000.0 53.6504 2600.0 54.0048 5500.0 55.0178 2700.0 55.0541 5300000.0 55.0572 22000.0 55.0587 16000.0 55.5709 2600.0 55.9343 37000.0 57.0697 1300000.0 57.227 2700.0 57.6255 2200.0 58.8167 2500.0 60.7317 6100.0 65.0384 140000.0 66.0463 11000.0 66.0671 6200.0 67.054 3700000.0 67.0584 9100.0 68.9186 2100.0 69.0698 7600000.0 69.0738 27000.0 69.0764 23000.0 69.0786 8200.0 69.2675 2200.0 70.9566 2500.0 71.0853 250000.0 71.4352 2300.0 71.6189 6000.0 71.9403 2500.0 72.9368 430000.0 73.0283 9900.0 73.6 2500.0 74.737 2300.0 77.0385 220000.0 77.7352 2600.0 78.0463 2300.0 78.9524 2800.0 79.0541 5500000.0 79.0604 32000.0 79.0621 14000.0 79.065 7500.0 80.0619 21000.0 81.0697 22000000.0 81.0783 75000.0 81.0794 590000.0 81.0807 45000.0 81.0909 5700.0 81.7249 2400.0 82.8927 2400.0 83.0852 1500000.0 83.0924 13000.0 85.4615 2200.0 90.9474 260000.0 91.054 2400000.0 91.0602 5300.0 93.0621 28000.0 93.0696 26000000.0 93.0802 69000.0 93.0815 680000.0 93.0832 52000.0 93.0873 20000.0 93.0915 7800.0 95.0489 680000.0 95.0853 7500000.0 95.0937 76000.0 95.0992 12000.0 95.1147 2600.0 96.2912 2400.0 97.1009 920000.0 97.1729 2400.0 99.9479 53000.0 100.0731 2300.0 103.0541 87000.0 105.0444 230000.0 105.0696 2000000.0 105.0783 21000.0 106.0774 140000.0 107.0495 5800.0 107.0853 10000000.0 107.093 39000.0 107.0994 22000.0 107.102 16000.0 107.9504 2500.0 108.1808 2300.0 108.6825 2300.0 108.9576 8800.0 109.0645 250000.0 109.1009 4600000.0 109.1119 19000.0 111.1166 180000.0 113.9549 3500.0 113.9634 740000.0 114.4055 2500.0 114.5308 2600.0 115.9426 5600.0 117.07 2700.0 119.0603 90000.0 119.0768 4100.0 119.0853 480000.0 120.0933 2700.0 120.2495 2100.0 121.0794 19000.0 121.0898 35000.0 121.1009 33000000.0 121.1097 600000.0 121.1219 400000.0 121.123 79000.0 121.1274 25000.0 122.3808 2700.0 123.0802 780000.0 123.1069 12000.0 123.1166 2000000.0 126.653 2800.0 131.9742 100000.0 133.0758 130000.0 133.1012 82000.0 133.3061 2300.0 135.1166 2900000.0 135.1268 23000.0 137.1323 260000.0 138.4553 7200.0 141.3396 2200.0 146.612 2700.0 147.1167 110000.0 148.1241 3200.0 149.0232 47000.0 149.1184 3000.0 149.1324 4900000.0 149.1451 13000.0 150.3009 2400.0 151.3814 2400.0 158.9671 2300.0 161.1328 25000.0 162.1402 7300.0 163.148 440000.0 173.5267 240000.0 173.5416 130000.0 177.1649 3100.0 178.9452 2400.0 179.0601 6700.0 187.577 6700.0 197.7856 5300.0 205.1953 170000.0 210.8115 2800.0 211.2287 2200.0 215.9342 2700.0 END IONS BEGIN IONS SCANS=668 PEPMASS=303.1959 CHARGE=1 COLLISION_ENERGY=0.0 49.8252 2000.0 53.6163 2200.0 53.7083 2300.0 55.0542 3800.0 55.2184 2500.0 55.7458 2500.0 57.8988 2600.0 58.569 2500.0 60.8717 2100.0 67.054 7500.0 69.0696 23000.0 71.4463 2200.0 73.9734 2500.0 79.0539 54000.0 79.5252 2400.0 81.0695 17000.0 84.0238 2400.0 91.0538 7100.0 91.4456 2300.0 93.0695 34000.0 95.0852 3100.0 96.3791 2200.0 107.0851 26000.0 109.101 2400.0 121.2626 2300.0 121.9395 2400.0 123.08 3800.0 131.8271 2700.0 133.1012 2900.0 135.1162 7200.0 136.0513 18000.0 139.0145 2800.0 149.6886 5400.0 151.0751 34000.0 153.0916 2800.0 154.0624 10000.0 159.0808 4300.0 166.0624 150000.0 166.0768 4600.0 167.07 7300.0 173.5337 44000.0 176.0842 5800.0 181.0858 240000.0 185.0958 2600.0 188.0833 2500.0 189.0907 9700.0 190.0979 16000.0 190.6902 2300.0 192.5791 2300.0 195.101 3200.0 198.1044 2700.0 201.0913 10000.0 202.0984 12000.0 203.1079 3600.0 206.0945 2600.0 208.2061 2400.0 213.0909 24000.0 216.115 12000.0 217.0015 2700.0 219.1015 23000.0 228.1151 2700.0 229.1222 79000.0 232.1087 2600.0 232.6509 2700.0 245.1172 22000.0 247.1318 3000.0 251.0959 2200.0 272.1788 7300.0 293.7867 2600.0 END IONS BEGIN IONS SCANS=669 PEPMASS=454.2592 CHARGE=1 COLLISION_ENERGY=0.0 56.0657 2200.0 56.1472 2300.0 56.3366 2400.0 57.0697 10000.0 57.2867 2300.0 60.5512 2100.0 61.1324 2200.0 61.2158 2100.0 61.246 2300.0 61.4394 2200.0 61.9093 2400.0 62.1086 2200.0 62.1922 2600.0 62.8145 2100.0 65.2272 2500.0 67.0542 33000.0 69.0334 3000.0 69.0698 38000.0 69.449 2600.0 69.7527 3500.0 70.1088 2400.0 70.1977 2100.0 70.3878 2400.0 70.835 2200.0 71.0853 3000.0 71.1505 2200.0 71.3729 2500.0 71.6233 2300.0 72.0584 2100.0 72.403 2300.0 73.8094 2300.0 74.8329 2300.0 79.0541 17000.0 81.0334 14000.0 81.0698 130000.0 81.4355 2400.0 82.4956 2300.0 83.0492 5400.0 83.0852 17000.0 84.3149 2600.0 88.0404 2400.0 88.2192 2400.0 89.0595 110000.0 89.3888 2300.0 90.9761 2500.0 91.0542 19000.0 93.0698 180000.0 95.0489 5600.0 95.0854 58000.0 95.5431 2700.0 96.1967 2500.0 96.2645 2500.0 97.4564 2500.0 97.8501 2200.0 98.0599 2400000.0 98.0685 14000.0 99.3756 3100.0 102.4937 2500.0 105.0698 65000.0 106.6552 2400.0 107.0856 44000.0 109.0647 6500.0 109.1011 62000.0 109.3457 5000.0 110.0518 5500.0 110.0599 280000.0 110.924 2200.0 115.3266 2500.0 117.3061 2700.0 119.0493 8000.0 119.0855 72000.0 120.0206 2500.0 121.0646 5700.0 121.101 76000.0 121.816 2500.0 123.0803 3200.0 123.1167 76000.0 124.6803 2300.0 125.0965 3500.0 128.3499 2600.0 129.0699 18000.0 129.7222 2300.0 133.0291 2400.0 133.0646 120000.0 133.0858 35000.0 133.1011 25000.0 133.3139 2400.0 133.435 2300.0 134.9674 2500.0 135.0793 3000.0 135.1168 100000.0 136.0756 24000.0 137.0961 5600.0 137.133 7600.0 139.3391 2400.0 141.6975 2300.0 147.0802 87000.0 147.1168 170000.0 148.0515 21000.0 149.6874 5500.0 149.7175 2600.0 151.0753 6100.0 152.0595 3200.0 152.0705 590000.0 152.0847 9000.0 160.947 2400.0 161.1324 130000.0 162.0669 3000.0 163.1116 74000.0 164.0826 2400.0 165.0553 9000.0 166.0625 67000.0 167.0712 2200.0 168.2604 2300.0 169.0856 17000.0 171.117 24000.0 173.5265 160000.0 173.5404 130000.0 174.6414 2600.0 175.0758 26000.0 175.1121 11000.0 176.083 51000.0 178.1766 2400.0 179.0698 9400.0 180.0782 110000.0 181.0691 8400.0 181.0859 2500000.0 181.1019 11000.0 183.5512 2500.0 188.0838 5100.0 189.1274 190000.0 190.0624 99000.0 190.0987 9600.0 191.0705 31000.0 192.0799 2900.0 193.0488 5400.0 193.0858 46000.0 194.4542 2500.0 195.045 3300.0 195.0654 260000.0 195.1015 710000.0 202.0985 13000.0 203.0704 35000.0 204.0783 80000.0 204.115 2900.0 205.086 35000.0 206.0576 22000.0 206.0952 2900.0 207.1017 250000.0 208.0731 160000.0 209.1175 25000.0 215.1069 3200.0 216.1138 7300.0 216.3014 2600.0 218.1303 21000.0 219.1016 170000.0 220.0733 29000.0 221.0564 11000.0 221.0809 930000.0 221.1058 3700.0 221.118 80000.0 222.0853 2700.0 223.0708 3300.0 223.0965 500000.0 224.4139 2600.0 227.3242 2300.0 228.1143 7900.0 228.6059 2200.0 230.0944 15000.0 231.1018 110000.0 231.1372 2800.0 232.1102 17000.0 233.0805 17000.0 233.0925 2900.0 233.1172 120000.0 233.7751 2600.0 234.3289 2200.0 235.0963 480000.0 235.1324 22000.0 236.1023 5400.0 238.0409 2700.0 239.1076 3000.0 240.1151 11000.0 241.1225 49000.0 242.1307 14000.0 244.1094 17000.0 245.1172 170000.0 246.1238 8600.0 247.0964 17000.0 247.1327 84000.0 249.1482 38000.0 250.9823 2800.0 251.6561 2400.0 252.1122 2500.0 255.1022 21000.0 255.1407 5500.0 256.1091 39000.0 257.1168 48000.0 257.2513 3200.0 258.1253 29000.0 259.1021 3000.0 259.1327 180000.0 261.112 39000.0 261.1473 35000.0 265.667 2600.0 266.1301 19000.0 269.1175 16000.0 269.1523 9500.0 270.1253 6100.0 271.1329 59000.0 272.1405 28000.0 272.1748 3600.0 273.1127 85000.0 273.1481 130000.0 275.128 36000.0 282.1247 4900.0 282.1609 14000.0 283.1329 55000.0 283.1675 27000.0 284.1431 3900.0 284.1773 93000.0 285.1458 3400.0 287.1279 100000.0 287.162 32000.0 289.1446 14000.0 293.1546 2800.0 296.1403 4400.0 297.1489 40000.0 298.1562 34000.0 298.1927 53000.0 299.1279 79000.0 299.1643 12000.0 300.1724 28000.0 301.1432 130000.0 301.1779 11000.0 303.196 17000.0 308.1771 62000.0 311.1669 7700.0 313.1426 2400.0 313.1798 130000.0 314.1515 12000.0 314.1884 3500.0 315.1587 56000.0 315.1958 510000.0 315.2277 2200.0 324.1713 8800.0 325.1794 6000.0 326.1873 72000.0 329.1733 19000.0 329.2115 180000.0 339.1951 180000.0 342.1836 35000.0 352.8063 2900.0 357.1533 5600.0 357.1676 3500.0 357.2057 1800000.0 357.2568 5800.0 370.869 2600.0 374.9507 2600.0 395.1149 2400.0 402.4371 2800.0 405.3531 2400.0 405.4181 2400.0 454.0652 2600.0 END IONS BEGIN IONS SCANS=670 PEPMASS=476.2412 CHARGE=1 COLLISION_ENERGY=0.0 61.1937 2300.0 61.2233 2700.0 61.4986 2300.0 61.654 2300.0 61.9528 2200.0 62.4891 2200.0 62.7953 2200.0 63.348 2200.0 65.7027 2500.0 67.5399 2100.0 69.1717 2100.0 73.6781 2200.0 75.4976 3600.0 75.7288 2300.0 78.6686 2500.0 79.7005 2200.0 83.2816 2400.0 85.7509 2400.0 90.8153 2700.0 92.1664 2300.0 92.4047 2900.0 95.0701 2300.0 96.609 2200.0 98.2492 2200.0 103.1 2700.0 106.1821 2400.0 108.2093 2800.0 108.5357 2400.0 115.805 2700.0 119.034 14000.0 120.0417 21000.0 120.2225 2300.0 128.1103 2200.0 136.3583 2300.0 139.4753 2400.0 142.9607 2500.0 145.7175 2500.0 145.9775 2200.0 147.0287 15000.0 149.5355 2500.0 149.6232 2900.0 149.6879 5500.0 153.5843 2400.0 156.2146 2300.0 168.023 2800.0 173.526 53000.0 173.5376 99000.0 174.0523 52000.0 183.0795 2200.0 186.4025 2200.0 193.2947 2200.0 203.7849 2400.0 217.0835 22000.0 217.3623 2300.0 227.1924 3100.0 229.1105 3400.0 235.0079 2500.0 248.1877 2100.0 260.2031 2600.0 261.6698 2400.0 274.437 2600.0 274.6358 2600.0 282.1128 2600.0 292.5614 3100.0 304.3403 2800.0 309.2411 2200.0 309.9062 2500.0 317.8886 2500.0 321.4301 2400.0 325.0915 3100.0 336.7242 2700.0 338.036 2300.0 338.8126 2500.0 340.0679 4200.0 340.1153 960000.0 341.123 26000.0 369.4641 2600.0 379.1844 6800.0 386.3129 2900.0 431.9655 3100.0 441.3488 2900.0 460.6343 2800.0 476.2408 170000.0 485.7976 2500.0 END IONS BEGIN IONS SCANS=671 PEPMASS=653.2971 CHARGE=1 COLLISION_ENERGY=0.0 68.2613 2300.0 68.534 2700.0 71.253 2300.0 73.0213 2200.0 78.9558 2500.0 81.8545 2500.0 84.3404 2200.0 84.6446 2100.0 87.7833 2300.0 92.0637 2700.0 98.5276 2700.0 99.6962 2200.0 105.0981 2900.0 108.7482 2400.0 119.336 2400.0 147.4258 2200.0 149.3115 2700.0 163.1966 2400.0 173.524 30000.0 173.5374 61000.0 173.5442 7100.0 182.8053 2600.0 183.7831 2600.0 222.0773 3000.0 235.7735 2600.0 358.108 2900.0 436.2259 12000.0 446.2403 2800.0 449.1953 9500.0 450.2029 2600.0 463.2097 11000.0 464.2198 54000.0 465.2242 5300.0 467.1206 2600.0 475.211 7400.0 477.1931 11000.0 478.1996 7400.0 491.2098 6800.0 492.2119 34000.0 493.2222 3300.0 503.2467 3900.0 505.2255 3800.0 519.2375 2900.0 523.2369 12000.0 536.2911 2800.0 537.2079 3400.0 547.234 19000.0 549.2536 8200.0 550.2551 14000.0 551.2657 10000.0 552.2335 15000.0 564.2728 39000.0 565.2541 54000.0 565.2713 32000.0 575.2642 61000.0 577.8436 3100.0 578.2518 92000.0 579.2591 18000.0 583.2944 8800.0 592.2614 4000.0 593.1675 8400.0 593.2753 310000.0 596.2927 2600.0 606.2471 16000.0 607.2544 6800.0 609.2708 16000.0 610.2747 22000.0 611.2835 3400.0 621.269 26000.0 622.8051 2800.0 624.2905 46000.0 625.2943 21000.0 635.2856 57000.0 636.2742 5800.0 638.2728 170000.0 653.2964 270000.0 653.4194 4500.0 END IONS BEGIN IONS SCANS=672 PEPMASS=499.317 CHARGE=1 COLLISION_ENERGY=0.0 60.1743 3000.0 60.5104 2300.0 63.3701 2400.0 64.5935 2200.0 66.881 2400.0 68.8315 2200.0 70.3837 2300.0 71.2578 2500.0 72.2708 2300.0 72.7143 2700.0 73.8189 2500.0 74.3825 2400.0 78.3202 2300.0 78.753 2900.0 79.054 3000.0 81.0335 6500.0 81.0696 130000.0 81.9855 2200.0 83.1097 2500.0 83.3523 2500.0 86.9976 2500.0 89.0596 28000.0 90.766 2300.0 93.0697 36000.0 94.5831 2300.0 95.0853 21000.0 95.9367 4200.0 98.0598 1000000.0 98.0708 3200.0 100.1302 2400.0 100.3244 2400.0 100.4444 2600.0 100.9299 2100.0 101.3329 2600.0 105.07 3000.0 107.0851 2500.0 109.1011 5600.0 110.0517 4200.0 110.0598 240000.0 110.8328 2400.0 112.9297 2400.0 114.5402 2200.0 115.1402 2300.0 116.8598 2400.0 118.6929 2600.0 119.0856 3400.0 121.1012 3400.0 122.694 2300.0 123.1182 2300.0 125.0063 2200.0 125.2962 2700.0 128.4143 2500.0 131.5265 2700.0 133.0649 15000.0 133.0851 3100.0 133.4518 2100.0 135.1167 20000.0 135.7414 2300.0 137.1321 22000.0 139.9643 2300.0 140.068 3100.0 141.4136 2300.0 145.9058 2400.0 147.0806 7000.0 147.1165 25000.0 149.1682 2400.0 149.6694 3800.0 149.6899 12000.0 151.4373 2400.0 152.0561 4900.0 152.0704 1200000.0 152.0849 4600.0 153.7952 2200.0 161.1322 17000.0 169.7935 2700.0 172.6144 2600.0 173.5246 43000.0 173.5351 200000.0 173.5475 3900.0 178.6976 2500.0 180.0783 12000.0 181.0859 530000.0 181.102 2200.0 182.3216 2500.0 189.1277 43000.0 190.0625 30000.0 191.0699 3700.0 193.0856 3500.0 195.0653 47000.0 195.1013 150000.0 195.3857 2400.0 202.5456 2400.0 203.8448 2400.0 204.0787 3200.0 206.0576 3000.0 207.1018 25000.0 208.0731 34000.0 209.4381 2700.0 214.2229 2600.0 216.1152 2600.0 219.102 31000.0 221.0809 1100000.0 221.1185 9100.0 223.0967 210000.0 228.2795 2500.0 231.9298 2500.0 233.1164 19000.0 235.0965 110000.0 237.4999 2600.0 245.1168 21000.0 247.0969 2800.0 247.1326 18000.0 247.8385 2800.0 249.1483 2800.0 249.3075 2400.0 251.5509 2500.0 255.8833 2500.0 257.1178 2400.0 259.1322 23000.0 263.2768 2600.0 269.1828 2500.0 272.1777 2800.0 273.1131 11000.0 273.1476 17000.0 283.1297 2500.0 284.1768 6000.0 287.1281 12000.0 292.219 2500.0 301.1438 14000.0 303.1957 74000.0 304.9669 2400.0 308.1812 2500.0 308.2462 2600.0 313.1803 14000.0 315.159 7800.0 315.196 130000.0 326.1188 2400.0 326.186 3700.0 329.2117 56000.0 339.1956 37000.0 357.1673 3100.0 357.2061 730000.0 357.2566 11000.0 364.3046 2700.0 395.5104 2400.0 410.3533 2500.0 412.7327 2800.0 425.8279 2700.0 435.5302 2300.0 438.3363 2400.0 442.8694 2800.0 448.1729 3100.0 451.7095 3000.0 465.3929 2500.0 469.4545 2900.0 476.9292 2600.0 479.8723 2600.0 480.9402 2200.0 END IONS BEGIN IONS SCANS=673 PEPMASS=639.2455 CHARGE=1 COLLISION_ENERGY=0.0 73.9169 2200.0 75.4803 2200.0 82.701 2500.0 91.2412 2500.0 123.0671 2500.0 129.4031 2700.0 133.352 2900.0 173.5166 9200.0 173.5311 76000.0 173.5465 13000.0 189.3448 2800.0 253.0379 2500.0 284.1444 2900.0 321.6617 3000.0 330.1601 3200.0 342.121 2500.0 370.1547 10000.0 396.1716 2700.0 409.1412 2500.0 414.1439 37000.0 421.2024 10000.0 426.1421 8200.0 434.2092 39000.0 435.2171 20000.0 436.2249 14000.0 445.2408 3600.0 451.2121 4200.0 458.3523 2400.0 461.2335 2700.0 462.2405 5100.0 463.2465 30000.0 465.1918 100000.0 466.2001 11000.0 474.2033 8900.0 475.2133 3700.0 477.1917 2700.0 479.2079 130000.0 480.2154 120000.0 489.2254 40000.0 489.2979 6800.0 490.2355 15000.0 491.2412 33000.0 493.2216 10000.0 501.1909 10000.0 502.1991 12000.0 505.1875 29000.0 506.197 99000.0 507.2379 120000.0 508.2464 87000.0 515.2074 17000.0 516.2152 18000.0 517.134 9300.0 517.2226 430000.0 518.2291 38000.0 519.2029 33000.0 523.2292 46000.0 524.2413 29000.0 533.2171 22000.0 534.2263 13000.0 535.1384 3400.0 535.2328 330000.0 535.329 3500.0 536.2424 8800.0 537.213 76000.0 540.2363 18000.0 548.2063 6300.0 549.2425 3300.0 551.2283 95000.0 552.2361 570000.0 561.213 220000.0 561.315 4500.0 562.2206 30000.0 563.2281 12000.0 563.3489 23000.0 567.2621 2800.0 577.2479 5000.0 579.2236 290000.0 580.2313 30000.0 581.3604 43000.0 589.2072 3600.0 593.2382 59000.0 595.2548 36000.0 611.2503 16000.0 621.2332 120000.0 621.3671 4600.0 621.3945 8700.0 639.245 68000.0 639.4003 28000.0 END IONS BEGIN IONS SCANS=674 PEPMASS=409.2741 CHARGE=1 COLLISION_ENERGY=0.0 54.4861 2200.0 55.054 72000.0 55.7374 2100.0 57.0697 29000.0 57.9898 2100.0 58.8384 2100.0 59.0489 8200.0 60.9451 2300.0 65.7816 2300.0 67.054 53000.0 69.0332 30000.0 69.0696 24000.0 71.757 2700.0 71.9232 2800.0 73.1581 2100.0 73.1761 2300.0 73.956 2400.0 74.2958 2400.0 79.0539 54000.0 80.5536 2200.0 81.0653 2700.0 81.0695 160000.0 81.2753 2500.0 83.0488 35000.0 83.0856 11000.0 83.1809 2200.0 84.9453 2700.0 85.0646 12000.0 85.1687 2000.0 86.5714 2400.0 86.6067 2100.0 88.1675 2300.0 89.7465 2300.0 90.4855 2300.0 91.0539 80000.0 91.7768 2500.0 93.0695 240000.0 94.4858 2300.0 95.0425 3200.0 95.0488 240000.0 95.0852 150000.0 95.4343 2200.0 97.0498 2300.0 97.0645 70000.0 97.3896 3200.0 98.0772 2300.0 103.053 2300.0 104.737 2400.0 105.0695 410000.0 107.0483 2800.0 107.0851 140000.0 107.4667 2400.0 109.0645 65000.0 109.1008 57000.0 111.0801 7000.0 114.9215 2500.0 117.0696 31000.0 119.0485 7000.0 119.0768 4000.0 119.0852 300000.0 121.0645 92000.0 121.1009 100000.0 121.1865 2100.0 121.3457 2400.0 123.08 71000.0 123.288 2700.0 125.0966 2800.0 129.0695 19000.0 131.0852 100000.0 131.8313 2500.0 133.0647 26000.0 133.1008 120000.0 135.0802 63000.0 135.1166 27000.0 137.0957 46000.0 139.1131 2400.0 141.07 3000.0 142.0777 32000.0 143.0851 78000.0 144.0928 14000.0 144.6481 2500.0 145.0648 2900.0 145.1008 230000.0 146.1082 6600.0 147.0801 110000.0 147.1165 240000.0 149.0958 70000.0 151.0751 140000.0 153.09 6900.0 155.0854 32000.0 156.0932 17000.0 157.1009 140000.0 159.0804 29000.0 159.1166 110000.0 160.6299 2600.0 161.0959 50000.0 161.1322 19000.0 162.1302 2700.0 163.1115 26000.0 164.2085 2700.0 165.0907 240000.0 168.0934 10000.0 169.1012 68000.0 170.1078 12000.0 171.1167 70000.0 173.0958 29000.0 173.1323 42000.0 173.5165 5600.0 173.5273 55000.0 173.5364 110000.0 173.5465 7300.0 174.1023 2800.0 174.3999 2400.0 175.1115 48000.0 177.091 21000.0 178.0985 3200.0 181.1009 13000.0 183.1168 61000.0 185.1328 27000.0 187.1117 18000.0 187.1488 9200.0 188.44 2800.0 189.1273 42000.0 191.1443 2700.0 193.1015 6800.0 195.1169 24000.0 195.2719 2300.0 196.1236 13000.0 196.2505 2400.0 197.1325 35000.0 199.1115 9600.0 199.1479 6200.0 201.1273 30000.0 201.1632 2500.0 203.143 88000.0 207.1177 4400.0 207.1381 38000.0 209.1327 23000.0 211.1484 30000.0 213.1267 10000.0 215.1425 3900.0 216.151 7000.0 216.6012 2500.0 219.138 27000.0 221.1326 9300.0 221.1536 83000.0 223.1475 4400.0 225.1629 6700.0 229.1582 4300.0 233.1535 3000.0 234.1613 46000.0 239.1412 2500.0 249.1633 8700.0 253.159 2500.0 258.1942 3000.0 280.5752 2500.0 283.3543 2600.0 286.1931 18000.0 287.2015 3300.0 309.5574 2300.0 312.2101 2700.0 317.6024 2600.0 376.3655 2500.0 382.3468 2500.0 409.2739 6100.0 416.8551 2500.0 END IONS BEGIN IONS SCANS=675 PEPMASS=476.2411 CHARGE=1 COLLISION_ENERGY=0.0 58.8772 2300.0 62.2956 2900.0 64.913 2300.0 70.9703 2400.0 78.2107 2600.0 79.4157 2400.0 89.0595 3400.0 109.5614 2300.0 110.7448 2400.0 120.0413 3600.0 120.209 2700.0 120.6057 2500.0 128.1149 2200.0 128.5551 2400.0 134.4938 2500.0 136.4486 2200.0 137.4824 2600.0 149.6837 4200.0 149.7039 4100.0 172.9034 3200.0 173.5247 40000.0 173.5428 28000.0 182.3263 2300.0 190.9757 2400.0 220.9132 2600.0 226.9604 2400.0 288.912 2500.0 325.0929 3000.0 340.0685 3300.0 340.1153 240000.0 373.5704 2400.0 379.1854 2900.0 395.2322 2400.0 422.1228 2700.0 476.241 140000.0 476.3157 4100.0 END IONS BEGIN IONS SCANS=676 PEPMASS=454.2592 CHARGE=1 COLLISION_ENERGY=0.0 57.0697 2500.0 57.9523 2100.0 58.1927 2200.0 58.4837 2300.0 59.1849 2600.0 62.084 2100.0 62.5802 2700.0 63.9064 2600.0 67.0542 13000.0 68.1705 2400.0 69.0697 76000.0 70.449 2600.0 71.5248 2100.0 72.9689 2700.0 73.5785 2500.0 74.7569 2100.0 77.0624 2300.0 78.0218 2300.0 79.0541 24000.0 81.0696 180000.0 83.0852 16000.0 88.0625 2700.0 88.523 2400.0 89.0595 41000.0 90.4961 2700.0 91.0539 32000.0 91.3325 2800.0 93.0696 200000.0 94.1422 2300.0 95.0488 6800.0 95.0853 66000.0 96.7122 2300.0 97.1009 7900.0 98.0597 780000.0 98.0651 3300.0 99.8562 2600.0 104.129 2300.0 104.9531 2200.0 105.0696 69000.0 105.3011 2100.0 107.0853 45000.0 107.6178 2100.0 109.0644 2500.0 109.1009 62000.0 110.06 11000.0 119.0852 67000.0 121.065 8600.0 121.101 67000.0 122.5804 2500.0 123.0803 6600.0 123.1166 44000.0 128.4172 2600.0 133.0644 17000.0 133.0856 11000.0 133.1011 30000.0 135.1166 140000.0 135.8992 2300.0 137.0959 7900.0 137.1322 22000.0 140.0699 2800.0 143.9669 2700.0 144.7174 2500.0 145.1015 2900.0 147.0801 12000.0 147.1165 160000.0 148.0517 18000.0 149.0605 2700.0 149.6801 4700.0 149.6917 6500.0 150.0675 6700.0 151.0748 3100.0 151.6978 2500.0 152.0703 32000.0 154.0621 10000.0 158.0431 2500.0 161.1323 140000.0 162.0673 10000.0 163.0749 5700.0 163.1121 20000.0 164.0834 14000.0 164.2655 2500.0 165.0542 8700.0 165.0911 2600.0 166.0627 23000.0 167.0712 2900.0 169.0861 4300.0 171.1167 8600.0 173.5204 11000.0 173.5337 140000.0 173.5446 10000.0 174.6382 2800.0 175.039 2400.0 175.6407 2500.0 176.0833 26000.0 178.0613 3400.0 180.078 260000.0 181.0858 1200000.0 181.1001 9600.0 188.0828 3800.0 189.0919 5500.0 189.1275 120000.0 190.0623 80000.0 190.099 16000.0 191.034 5400.0 191.0698 8700.0 192.0788 2900.0 193.086 50000.0 194.0946 3800.0 195.0655 93000.0 195.1014 1000000.0 195.131 3600.0 202.0991 32000.0 204.078 44000.0 204.1142 5500.0 205.0858 31000.0 206.0571 47000.0 206.0934 27000.0 206.4363 2500.0 207.1017 110000.0 208.0731 62000.0 209.117 28000.0 215.1043 3300.0 216.1153 6900.0 218.0933 22000.0 219.1016 210000.0 219.124 4900.0 220.1085 3900.0 221.0808 1200000.0 221.118 110000.0 223.0966 82000.0 226.0978 2600.0 226.2116 2900.0 227.1077 3300.0 228.1146 28000.0 230.0925 8000.0 231.1016 50000.0 232.1094 18000.0 233.0808 25000.0 233.1171 110000.0 235.0963 54000.0 235.1321 17000.0 239.1067 2600.0 240.1133 18000.0 241.1224 44000.0 241.1503 2000.0 242.0927 3300.0 242.1303 22000.0 244.1089 27000.0 245.117 140000.0 246.125 22000.0 247.098 15000.0 247.1328 59000.0 249.1482 5900.0 255.1013 24000.0 255.1371 13000.0 256.1093 12000.0 257.1172 18000.0 258.0868 2800.0 258.1246 29000.0 259.1326 190000.0 261.1132 9600.0 261.1479 25000.0 269.1167 5900.0 269.1499 2700.0 270.1256 7100.0 271.1325 44000.0 272.1406 26000.0 273.1135 26000.0 273.1486 140000.0 275.1276 6500.0 282.1606 6300.0 283.1336 12000.0 283.1688 8700.0 284.1771 110000.0 285.1496 3700.0 285.1841 3800.0 286.1556 4300.0 287.1281 15000.0 287.1638 16000.0 289.1441 23000.0 289.1797 21000.0 297.1471 3300.0 297.1844 4000.0 298.1933 81000.0 299.1653 3900.0 300.174 22000.0 301.1428 33000.0 308.1771 17000.0 310.1534 3100.0 313.1804 23000.0 314.1875 11000.0 315.1632 8300.0 315.1958 410000.0 315.2273 2500.0 315.2379 4500.0 326.1874 13000.0 329.2115 150000.0 339.1953 40000.0 339.3181 2500.0 357.2062 370000.0 378.9836 2400.0 409.9447 2300.0 462.7778 2400.0 END IONS BEGIN IONS SCANS=677 PEPMASS=499.3169 CHARGE=1 COLLISION_ENERGY=0.0 67.5651 2600.0 69.0697 5000.0 72.3859 2800.0 74.8158 2500.0 77.5068 2500.0 80.3277 2900.0 81.0697 45000.0 83.0956 2300.0 89.0593 2200.0 89.4852 2500.0 93.0697 26000.0 95.0852 11000.0 96.2289 2500.0 98.0598 150000.0 98.0673 2900.0 98.3934 2400.0 105.0699 5700.0 106.703 2400.0 106.964 2400.0 109.1009 10000.0 115.4995 2600.0 119.0853 9700.0 119.4889 2400.0 121.1008 13000.0 122.0416 2200.0 123.1167 6700.0 135.1165 23000.0 137.1322 15000.0 142.8746 3000.0 143.2898 2400.0 143.4144 2300.0 147.1165 35000.0 152.0701 16000.0 161.1321 25000.0 163.112 6000.0 173.5227 18000.0 173.5399 37000.0 180.078 33000.0 181.0859 210000.0 189.1273 29000.0 190.0631 4100.0 193.0868 2500.0 195.0673 9300.0 195.1015 250000.0 203.2995 2200.0 204.0797 2500.0 205.0853 3300.0 207.1013 16000.0 208.0731 13000.0 209.1172 4100.0 219.1016 45000.0 221.0562 4800.0 221.0809 400000.0 221.1186 25000.0 223.0967 24000.0 226.5018 2700.0 231.1006 5900.0 233.1167 18000.0 235.0969 6800.0 235.132 2700.0 241.1228 3700.0 243.6982 2600.0 245.117 22000.0 247.0957 2400.0 247.1324 8000.0 257.119 2700.0 258.127 3200.0 259.133 32000.0 271.1339 7300.0 273.117 2800.0 273.149 25000.0 282.166 2500.0 284.1776 13000.0 289.1451 3300.0 289.1803 5200.0 298.1927 12000.0 301.1425 6400.0 313.1778 2800.0 315.1958 120000.0 326.1873 3900.0 329.2111 53000.0 339.1953 12000.0 341.5254 2800.0 357.2062 130000.0 412.7347 6600.0 419.233 5100.0 432.1989 2700.0 458.9088 2500.0 461.9738 2300.0 END IONS BEGIN IONS SCANS=678 PEPMASS=623.2505 CHARGE=1 COLLISION_ENERGY=0.0 67.2463 3600.0 67.2503 17000.0 69.2515 2500.0 88.4972 2900.0 93.6152 2300.0 120.9999 3000.0 130.4391 2300.0 131.2564 2200.0 136.2994 3100.0 136.3097 4700.0 146.7394 3000.0 148.9809 2100.0 168.3394 2200.0 173.5276 54000.0 173.5428 17000.0 188.6655 2300.0 231.5667 2600.0 273.143 2400.0 311.8321 2300.0 315.7685 2500.0 378.1457 2400.0 407.2213 3100.0 415.1869 2700.0 421.2021 15000.0 428.1999 3500.0 430.2163 4500.0 434.2115 4400.0 435.2176 17000.0 436.2254 10000.0 437.5781 2500.0 438.2099 2500.0 443.2225 19000.0 444.1953 34000.0 445.2028 13000.0 447.2223 3900.0 457.1967 4000.0 458.2102 17000.0 461.2014 2100.0 461.2362 3600.0 462.2061 17000.0 463.2124 19000.0 471.2173 120000.0 472.1833 5700.0 472.1931 24000.0 473.1981 160000.0 474.206 15000.0 475.2116 24000.0 480.255 12000.0 481.2056 2900.0 483.2178 13000.0 484.1855 3100.0 485.1962 25000.0 486.2049 45000.0 487.2127 22000.0 488.2181 8700.0 489.2264 100000.0 490.2062 32000.0 490.2322 30000.0 491.2107 46000.0 492.2107 7600.0 493.2239 3000.0 499.1255 4400.0 499.2129 770000.0 500.186 100000.0 501.2265 140000.0 502.1984 7600.0 503.2081 48000.0 504.2104 3600.0 505.2203 6500.0 507.236 36000.0 508.2461 52000.0 511.2126 43000.0 513.1923 70000.0 514.2003 37000.0 516.2142 29000.0 517.223 470000.0 517.2904 2100.0 518.2181 39000.0 519.2332 13000.0 521.2202 2600.0 527.2079 170000.0 528.2167 11000.0 529.1301 4200.0 529.2233 690000.0 530.1936 7400.0 531.2038 38000.0 532.2139 14000.0 533.2168 11000.0 535.2332 140000.0 536.24 41000.0 545.0241 16000.0 545.2183 3000000.0 546.2245 9200.0 547.233 27000.0 549.2432 4400.0 555.2031 260000.0 555.5806 2600.0 562.222 27000.0 563.2296 80000.0 564.2375 170000.0 567.2612 3500.0 573.2136 960000.0 577.2448 93000.0 591.2249 91000.0 595.2558 66000.0 605.24 610000.0 623.2504 180000.0 END IONS BEGIN IONS SCANS=679 PEPMASS=375.2685 CHARGE=1 COLLISION_ENERGY=0.0 52.1644 2200.0 52.2568 2300.0 53.0021 17000.0 53.0386 32000.0 53.1471 2200.0 55.0178 32000.0 55.0514 3700.0 55.0541 240000.0 55.3683 2300.0 57.0335 13000.0 57.0698 59000.0 57.384 2300.0 59.5976 3100.0 62.6924 2400.0 65.0386 25000.0 66.0069 2500.0 67.0541 400000.0 67.0585 3200.0 69.0334 33000.0 69.0657 3900.0 69.0698 250000.0 69.4237 2800.0 71.049 33000.0 74.3425 2100.0 77.0387 32000.0 79.0541 490000.0 79.0596 5800.0 80.0618 7800.0 81.0335 14000.0 81.0698 1000000.0 81.0746 4200.0 83.049 55000.0 83.0854 73000.0 85.0651 2200.0 89.9632 2500.0 90.4231 2700.0 91.0541 530000.0 91.0597 2800.0 91.0608 6100.0 92.1124 2600.0 93.0698 1500000.0 93.0753 8000.0 94.3963 2600.0 95.049 650000.0 95.0548 2800.0 95.0854 880000.0 95.0914 4500.0 96.3435 2200.0 97.0582 3800.0 97.0647 170000.0 103.0541 34000.0 104.1323 2200.0 105.0446 30000.0 105.0551 6300.0 105.0698 1500000.0 105.0767 12000.0 105.0867 2800.0 106.0777 18000.0 107.0491 22000.0 107.0772 4400.0 107.0855 960000.0 107.0922 4200.0 109.0647 200000.0 109.1011 520000.0 111.0804 3200.0 115.0543 25000.0 116.0621 18000.0 117.0606 4800.0 117.0698 250000.0 117.0792 3700.0 118.0778 11000.0 119.0496 20000.0 119.0597 7600.0 119.0854 1500000.0 119.0937 2200.0 119.0956 4100.0 120.0934 12000.0 121.0647 330000.0 121.0747 4900.0 121.0909 5400.0 121.1011 1300000.0 123.0803 93000.0 123.1167 100000.0 127.4376 2300.0 128.0621 73000.0 129.0698 160000.0 130.0777 85000.0 131.0755 7900.0 131.0855 820000.0 132.0935 46000.0 133.0646 35000.0 133.0765 23000.0 133.0891 8400.0 133.1011 860000.0 134.1096 6200.0 135.0804 57000.0 135.1168 270000.0 136.3406 2200.0 137.0962 6900.0 141.07 59000.0 141.7601 2500.0 142.0777 240000.0 142.0903 3400.0 143.0751 2000.0 143.0855 530000.0 144.0934 180000.0 145.0649 33000.0 145.0875 4200.0 145.1011 1300000.0 145.1141 5200.0 146.073 22000.0 146.1089 39000.0 147.0805 68000.0 147.1059 2400.0 147.1168 400000.0 149.0962 15000.0 149.1327 26000.0 153.0213 2500.0 153.0702 15000.0 154.078 30000.0 155.0855 170000.0 156.0934 160000.0 157.1012 830000.0 157.1164 10000.0 158.0727 15000.0 158.1091 110000.0 159.0806 70000.0 159.1169 640000.0 160.0881 17000.0 160.1244 11000.0 161.0962 190000.0 161.1325 110000.0 163.1121 6600.0 165.0702 30000.0 166.0777 18000.0 167.0857 69000.0 168.0935 57000.0 169.1014 320000.0 169.1178 8400.0 170.1091 100000.0 171.0814 9700.0 171.1169 370000.0 172.0885 16000.0 172.1248 69000.0 173.0962 52000.0 173.1328 300000.0 173.15 8600.0 173.5263 63000.0 173.5426 17000.0 174.1043 6200.0 175.1119 32000.0 175.1484 110000.0 175.3797 2800.0 178.0786 3000.0 179.0858 84000.0 180.0936 41000.0 181.1014 160000.0 182.1094 91000.0 183.1171 260000.0 184.1249 51000.0 185.096 21000.0 185.1328 180000.0 186.1404 33000.0 187.1119 46000.0 187.1485 160000.0 191.0858 2900.0 192.0937 32000.0 193.1014 91000.0 194.1093 86000.0 195.1171 220000.0 196.09 2600.0 196.1249 82000.0 197.0981 13000.0 197.1327 240000.0 198.1404 36000.0 199.1125 25000.0 199.1484 110000.0 200.1194 9800.0 200.1558 12000.0 201.128 12000.0 201.1638 34000.0 205.1013 28000.0 206.1094 47000.0 207.1173 88000.0 208.1248 45000.0 208.1444 2900.0 209.0988 6000.0 209.1329 190000.0 210.1407 68000.0 211.1127 15000.0 211.1485 130000.0 212.1561 12000.0 213.128 13000.0 213.164 46000.0 217.1004 3000.0 218.1102 4700.0 219.1169 28000.0 220.1253 48000.0 221.1329 78000.0 222.1404 21000.0 223.1487 100000.0 224.1561 31000.0 225.1267 5700.0 225.1641 69000.0 226.171 3300.0 227.1423 10000.0 227.1804 11000.0 231.1172 4600.0 232.1245 5000.0 233.1328 28000.0 234.1402 14000.0 235.1483 59000.0 236.1556 13000.0 237.1643 49000.0 238.1726 9700.0 239.1435 10000.0 239.1802 34000.0 240.187 8100.0 241.1952 6400.0 245.1329 13000.0 246.1406 13000.0 247.1482 20000.0 248.1545 3000.0 249.1293 2500.0 249.1637 29000.0 250.1735 2900.0 251.1798 77000.0 252.1872 6400.0 253.1592 18000.0 253.1958 32000.0 259.1478 6900.0 261.1648 13000.0 262.1711 6200.0 263.1471 3200.0 263.1792 21000.0 264.1891 3400.0 265.1952 20000.0 266.203 33000.0 267.2089 3200.0 271.1486 3200.0 275.1784 4200.0 277.1952 19000.0 279.21 15000.0 281.1894 3500.0 287.1807 5900.0 291.2111 12000.0 292.2181 3000.0 301.1949 8400.0 319.207 12000.0 347.2721 13000.0 357.2583 14000.0 375.268 55000.0 END IONS BEGIN IONS SCANS=680 PEPMASS=205.1954 CHARGE=1 COLLISION_ENERGY=0.0 41.0385 210000.0 42.0337 37000.0 43.0541 110000.0 50.1853 2300.0 50.8873 2400.0 51.0231 13000.0 51.2637 2500.0 53.0021 2400.0 53.0384 160000.0 53.7908 2700.0 54.0101 3000.0 55.0541 2200000.0 55.0572 15000.0 55.0587 13000.0 55.0606 6300.0 55.9343 23000.0 57.0697 530000.0 58.7343 3100.0 60.1948 2400.0 61.0484 2300.0 65.0385 44000.0 65.6119 2100.0 67.054 1500000.0 67.0585 6200.0 67.3587 2500.0 67.5395 2400.0 67.7339 2300.0 69.0697 3300000.0 69.0739 23000.0 69.0764 19000.0 69.2414 2200.0 69.458 2600.0 70.5212 4000.0 71.0853 110000.0 71.3022 2300.0 72.9369 240000.0 73.0284 7000.0 74.0317 2700.0 75.0152 2600.0 76.2644 2400.0 77.0385 110000.0 78.6846 2600.0 79.054 2400000.0 79.062 11000.0 79.062 29000.0 79.0651 5000.0 80.0619 6300.0 81.0696 9800000.0 81.0783 52000.0 81.0787 240000.0 81.0806 31000.0 81.084 13000.0 82.8183 2300.0 83.0852 620000.0 83.7595 2200.0 88.9574 2500.0 88.9987 2700.0 90.2377 4600.0 90.9474 160000.0 91.054 1100000.0 91.0603 5200.0 92.0615 4600.0 93.062 15000.0 93.0696 12000000.0 93.0801 52000.0 93.0812 250000.0 93.0832 39000.0 93.0914 6900.0 95.0425 6500.0 95.0489 310000.0 95.0853 3100000.0 95.0919 14000.0 96.3598 4500.0 97.1009 330000.0 99.9476 27000.0 103.054 36000.0 103.6269 2600.0 105.0445 97000.0 105.0615 8200.0 105.0696 940000.0 105.0768 4000.0 105.0783 10000.0 106.0774 57000.0 107.0853 4500000.0 107.0932 23000.0 107.1019 7800.0 108.0648 2700.0 108.9585 2800.0 109.0646 110000.0 109.0927 9700.0 109.1009 1800000.0 109.1086 5200.0 111.1166 62000.0 113.9548 6700.0 113.9634 460000.0 117.6129 2500.0 119.0603 42000.0 119.0768 6100.0 119.0853 210000.0 120.094 2700.0 121.028 3200.0 121.0899 40000.0 121.1009 15000000.0 121.1097 250000.0 121.119 130000.0 121.1213 41000.0 121.1333 15000.0 123.0802 400000.0 123.1069 8600.0 123.1166 810000.0 128.378 2500.0 131.9741 60000.0 133.0759 55000.0 133.1014 22000.0 135.1056 9500.0 135.1166 1200000.0 135.1267 13000.0 135.6358 2400.0 136.4553 4300.0 137.1323 87000.0 139.0779 2300.0 143.6599 4900.0 147.1168 39000.0 149.023 18000.0 149.1185 3200.0 149.1323 2200000.0 149.1451 21000.0 154.9891 3300.0 161.133 8600.0 162.1409 3100.0 163.148 180000.0 168.187 2300.0 173.526 35000.0 173.5382 70000.0 192.3981 2500.0 205.1417 2600.0 205.1609 2600.0 205.1954 65000.0 211.3511 2500.0 END IONS BEGIN IONS SCANS=681 PEPMASS=618.4278 CHARGE=1 COLLISION_ENERGY=0.0 67.0539 3600.0 67.5871 2500.0 69.0696 4600.0 69.4075 2300.0 79.0539 3900.0 81.0696 25000.0 83.049 4300.0 83.0805 3700.0 83.0852 55000.0 85.0646 4800.0 93.0695 24000.0 94.0012 2400.0 95.0489 13000.0 95.0852 21000.0 97.0645 10000.0 105.0695 21000.0 107.0851 34000.0 109.0644 7100.0 109.1009 14000.0 111.0802 6400.0 113.0958 4600.0 117.0689 3000.0 119.0852 41000.0 119.3217 2800.0 120.0934 3300.0 121.1008 31000.0 123.0801 17000.0 125.0595 5900.0 125.0958 14000.0 129.0699 3400.0 131.0853 17000.0 132.0928 4300.0 133.101 32000.0 135.0802 11000.0 135.1164 9200.0 137.0958 8200.0 139.0752 2700.0 139.1108 11000.0 143.0853 19000.0 144.0928 14000.0 145.1009 50000.0 146.1069 3700.0 147.0804 17000.0 147.1166 18000.0 149.0958 12000.0 149.1328 2700.0 151.0751 13000.0 153.091 3000.0 155.1063 5900.0 156.0934 4900.0 157.1008 45000.0 158.1085 7900.0 159.1168 41000.0 160.0879 18000.0 160.1238 3200.0 161.0959 15000.0 161.1326 6400.0 163.1114 26000.0 165.0909 65000.0 167.1073 4900.0 169.1011 16000.0 170.1085 5100.0 171.1167 35000.0 172.1241 14000.0 173.0961 6900.0 173.1323 14000.0 173.5327 43000.0 175.1118 9400.0 175.1485 3100.0 176.1183 2900.0 177.091 4300.0 177.1275 3400.0 178.098 3800.0 179.1065 3900.0 180.115 3100.0 181.1055 4000.0 181.1222 33000.0 183.1167 16000.0 183.1357 2700.0 185.1325 23000.0 187.1119 8400.0 187.1481 16000.0 189.1269 14000.0 190.1349 17000.0 191.107 5600.0 191.1429 5600.0 193.1221 12000.0 195.0984 2500.0 195.1166 16000.0 195.1369 5500.0 196.1248 4700.0 197.1325 23000.0 198.1377 2400.0 199.1117 7500.0 199.1476 7400.0 201.1271 6800.0 203.1432 37000.0 207.1173 4600.0 207.1386 22000.0 208.1253 2500.0 208.1457 15000.0 209.1326 21000.0 209.1525 3500.0 211.1115 4200.0 211.1482 17000.0 213.127 7600.0 213.1642 4500.0 215.1433 6400.0 219.1381 12000.0 221.1325 7900.0 221.1538 110000.0 223.1481 8200.0 225.1271 4300.0 225.1475 11000.0 227.1433 3400.0 227.1798 6400.0 229.1593 4700.0 231.1382 8200.0 233.1537 22000.0 234.1616 16000.0 235.1466 4900.0 237.129 2800.0 237.1634 9200.0 239.1438 4100.0 239.1804 4300.0 241.1604 2700.0 245.1553 4100.0 246.1624 6100.0 247.1696 19000.0 249.1631 3000.0 251.1791 3600.0 253.1589 5100.0 255.1732 3900.0 259.1702 6500.0 261.1869 4400.0 269.1558 4300.0 269.1899 5300.0 271.1705 7400.0 273.1849 11000.0 274.1933 6600.0 281.1896 3600.0 283.169 4000.0 285.1862 5200.0 286.1931 19000.0 287.2011 130000.0 299.2014 17000.0 300.2081 3600.0 303.1952 3000.0 305.1916 3700.0 310.1918 4100.0 311.2007 3200.0 312.2082 9400.0 313.217 14000.0 319.2075 7900.0 325.2173 14000.0 329.2123 2400.0 337.2162 15000.0 339.2321 11000.0 347.2383 2600.0 352.2402 61000.0 353.2479 12000.0 365.2479 27000.0 367.2616 5800.0 395.2589 19000.0 435.5926 2900.0 438.3163 2600.0 480.3242 6700.0 525.3581 7600.0 526.3642 4700.0 531.4224 2800.0 538.3661 31000.0 618.4241 2800.0 END IONS BEGIN IONS SCANS=682 PEPMASS=392.2715 CHARGE=1 COLLISION_ENERGY=0.0 55.054 14000.0 57.0696 22000.0 67.0539 19000.0 69.0333 6600.0 69.0696 20000.0 71.0853 11000.0 79.0543 39000.0 80.0617 20000.0 81.0332 4900.0 81.0654 2900.0 81.0696 69000.0 82.0409 7900.0 83.0489 12000.0 83.0853 6800.0 85.0645 7400.0 89.0594 2900.0 91.0539 44000.0 92.062 11000.0 93.0638 2900.0 93.0693 100000.0 95.0488 77000.0 95.0853 46000.0 96.0563 3100.0 97.0649 7200.0 105.0695 160000.0 106.0774 25000.0 107.0491 6900.0 107.0852 83000.0 108.0567 16000.0 109.0644 27000.0 109.1008 26000.0 117.0695 40000.0 118.0772 2900.0 119.0489 6600.0 119.0852 180000.0 120.0561 2900.0 120.093 40000.0 121.0565 2400.0 121.0646 31000.0 121.1009 49000.0 123.0802 27000.0 123.1165 5900.0 125.8053 2400.0 128.062 9900.0 129.0696 31000.0 130.0773 10000.0 131.0748 4000.0 131.0852 110000.0 132.093 34000.0 133.0646 16000.0 133.1009 120000.0 134.109 11000.0 134.273 2400.0 135.0803 20000.0 135.1164 21000.0 135.9602 2800.0 137.0961 3800.0 141.0697 7700.0 142.0774 18000.0 143.0852 110000.0 144.0931 34000.0 145.0645 11000.0 145.1009 220000.0 145.1143 9800.0 146.1089 9100.0 147.0803 28000.0 147.1165 42000.0 149.023 72000.0 149.0959 4200.0 149.1328 2300.0 150.0265 36000.0 154.8947 2700.0 155.0852 28000.0 156.0931 24000.0 157.1009 120000.0 158.1088 26000.0 159.0803 26000.0 159.1165 100000.0 160.0865 2600.0 160.1239 6700.0 161.0959 23000.0 161.1322 15000.0 163.1123 5100.0 164.9571 2500.0 167.0855 11000.0 168.0928 3400.0 169.101 49000.0 170.1088 14000.0 171.0807 11000.0 171.1167 89000.0 172.1241 11000.0 173.0961 24000.0 173.1325 59000.0 173.5268 29000.0 173.5454 4300.0 175.1117 11000.0 175.1481 24000.0 177.1272 12000.0 179.0853 6800.0 181.1009 26000.0 182.1087 12000.0 183.1167 52000.0 184.1243 6300.0 185.096 6700.0 185.1324 35000.0 186.1038 7500.0 187.1118 4100.0 187.1482 16000.0 189.1275 10000.0 191.1428 9600.0 193.1012 12000.0 194.1092 10000.0 195.1166 37000.0 196.1244 9100.0 197.0969 3300.0 197.1325 53000.0 198.1399 3400.0 199.1126 10000.0 199.1483 18000.0 201.1277 9400.0 201.1634 3800.0 203.1442 2800.0 206.1083 3000.0 207.1166 15000.0 208.1241 7900.0 209.1328 25000.0 210.1402 7600.0 211.1483 27000.0 211.1681 2700.0 213.1284 6500.0 213.1651 3400.0 215.1423 6000.0 217.1583 3000.0 221.1324 17000.0 223.1483 16000.0 224.1569 2600.0 225.1266 5800.0 225.1637 16000.0 233.1327 5800.0 235.1489 9500.0 237.1641 10000.0 239.1427 4100.0 239.1789 12000.0 249.165 8600.0 251.1787 8100.0 255.174 2800.0 257.1894 3900.0 261.1649 2300.0 263.178 4900.0 296.3436 2700.0 END IONS BEGIN IONS SCANS=683 PEPMASS=393.2789 CHARGE=1 COLLISION_ENERGY=0.0 53.002 8100.0 53.0384 6600.0 55.0177 9700.0 55.054 99000.0 55.9365 2200.0 57.0333 3800.0 57.0696 53000.0 59.0488 7700.0 62.5571 2100.0 62.5987 2400.0 63.6694 2300.0 65.0383 5300.0 66.6364 2100.0 67.0539 140000.0 67.6552 2500.0 69.0332 21000.0 69.0695 130000.0 71.0488 15000.0 71.0853 3500.0 74.4209 2200.0 75.3958 2200.0 77.0384 15000.0 77.5103 2400.0 77.7746 2300.0 79.0539 170000.0 80.0619 3100.0 81.0336 5000.0 81.0695 440000.0 81.0777 3400.0 83.0489 33000.0 83.0851 54000.0 84.9962 2200.0 85.0645 29000.0 85.1005 2300.0 91.0539 180000.0 93.0695 550000.0 93.0764 6300.0 95.0487 340000.0 95.0555 3700.0 95.0852 410000.0 95.0921 4000.0 96.0522 4500.0 96.0885 3000.0 97.0583 4500.0 97.0644 76000.0 97.1011 4800.0 99.0806 4200.0 103.054 4400.0 104.9334 2400.0 105.0442 8500.0 105.0695 490000.0 105.0783 6300.0 106.078 4500.0 107.0487 12000.0 107.0851 400000.0 108.056 3200.0 109.0644 120000.0 109.1008 200000.0 109.7637 2900.0 111.0803 15000.0 113.0956 2700.0 115.0542 7100.0 117.0609 3000.0 117.0695 100000.0 119.0488 11000.0 119.0591 3200.0 119.0755 2700.0 119.0852 610000.0 119.0946 6800.0 120.0925 14000.0 121.0645 160000.0 121.1008 310000.0 123.0801 38000.0 123.1069 3000.0 123.1165 70000.0 123.5477 2400.0 125.096 2700.0 128.0618 28000.0 129.0696 63000.0 130.0773 26000.0 131.0852 280000.0 132.0919 16000.0 133.0643 18000.0 133.1009 410000.0 133.1109 4300.0 134.1047 5200.0 135.0802 41000.0 135.1165 140000.0 137.096 16000.0 139.1117 5400.0 141.0696 23000.0 142.0774 96000.0 143.0852 230000.0 144.0927 63000.0 145.0645 14000.0 145.1009 520000.0 145.1134 12000.0 146.0721 9600.0 146.106 25000.0 147.0801 32000.0 147.1165 180000.0 148.1201 3100.0 149.0227 4800.0 149.0958 31000.0 149.1322 14000.0 150.0261 3100.0 151.0286 2700.0 151.1111 3700.0 153.0692 4000.0 154.0774 11000.0 155.0852 71000.0 155.4413 2400.0 156.093 66000.0 157.1009 400000.0 157.1133 2900.0 157.1168 4600.0 158.0718 3300.0 158.108 50000.0 159.0801 36000.0 159.1024 4100.0 159.1166 360000.0 159.1295 3400.0 160.0879 5300.0 160.1223 16000.0 161.0959 130000.0 161.1322 60000.0 163.1116 22000.0 163.1474 10000.0 165.0696 7900.0 166.0769 3200.0 167.0851 28000.0 168.0931 27000.0 169.1011 160000.0 170.1085 51000.0 171.081 6100.0 171.1167 190000.0 172.0879 4800.0 172.1238 46000.0 173.0959 27000.0 173.1324 190000.0 173.1499 3800.0 173.5223 11000.0 173.5365 70000.0 174.1025 3700.0 174.1376 11000.0 175.1117 30000.0 175.1309 4800.0 175.1481 95000.0 177.1274 6300.0 179.0857 34000.0 180.0932 14000.0 181.1011 66000.0 182.1087 38000.0 183.1167 130000.0 184.1237 28000.0 185.0959 9200.0 185.1324 100000.0 186.1398 26000.0 187.1115 37000.0 187.148 67000.0 189.1273 5000.0 191.1431 6900.0 192.0938 12000.0 193.1009 36000.0 194.1089 42000.0 195.1167 86000.0 196.1241 42000.0 197.0962 5400.0 197.1324 110000.0 198.1392 22000.0 199.112 8200.0 199.1478 56000.0 200.1194 3500.0 200.1562 6200.0 201.1273 10000.0 201.1638 37000.0 203.1424 4700.0 205.1012 7800.0 205.1576 3900.0 206.1092 17000.0 207.1169 44000.0 208.1239 20000.0 209.1324 94000.0 210.1396 31000.0 211.1125 6600.0 211.1482 72000.0 212.1199 2900.0 212.155 7600.0 213.1278 4700.0 213.1636 31000.0 215.1427 5400.0 219.117 6100.0 220.1246 21000.0 221.1325 31000.0 222.1397 14000.0 223.1119 2800.0 223.1482 45000.0 224.1552 16000.0 225.1285 4700.0 225.1639 29000.0 226.1708 7400.0 227.143 7300.0 227.1794 4700.0 229.1593 3200.0 233.1328 9600.0 234.1389 4600.0 235.1481 27000.0 236.1554 6500.0 237.164 21000.0 239.144 3900.0 239.1791 13000.0 240.185 5000.0 241.1599 6700.0 241.1944 8200.0 245.1313 2800.0 247.1482 8200.0 248.154 2900.0 249.1651 6400.0 251.1797 19000.0 253.1586 6900.0 253.195 6400.0 255.1749 5100.0 257.1895 5400.0 261.1632 3000.0 263.1801 6300.0 265.1946 9600.0 266.2035 3400.0 267.2117 3400.0 269.1893 3400.0 273.1638 3100.0 275.1808 4200.0 277.1954 3900.0 281.1901 4100.0 283.2058 3100.0 293.1881 2800.0 383.8691 2400.0 END IONS BEGIN IONS SCANS=684 PEPMASS=476.2411 CHARGE=1 COLLISION_ENERGY=0.0 66.897 2300.0 67.1135 2500.0 69.9864 2200.0 89.0596 2700.0 106.6238 2300.0 109.6747 2500.0 109.825 2100.0 117.0588 2300.0 120.0415 2800.0 134.0706 2500.0 139.1069 2400.0 149.6842 2600.0 149.695 3000.0 162.7295 2600.0 170.9719 2800.0 173.302 2200.0 173.5252 29000.0 173.5404 22000.0 174.0522 28000.0 190.3351 2500.0 214.084 5400.0 218.2737 2200.0 229.1069 8300.0 251.047 2900.0 307.6172 2600.0 315.8574 2800.0 325.0912 4300.0 340.0684 4100.0 340.1152 630000.0 346.3194 2800.0 376.7904 2800.0 377.3887 2200.0 379.1877 2600.0 431.1347 2300.0 438.803 3500.0 476.2409 46000.0 484.056 2500.0 END IONS BEGIN IONS SCANS=685 PEPMASS=303.1959 CHARGE=1 COLLISION_ENERGY=0.0 50.9828 2200.0 58.7907 2600.0 61.9734 2600.0 62.0917 3000.0 62.9631 2300.0 67.0538 3700.0 68.3881 2200.0 69.0695 16000.0 70.9396 2400.0 71.0125 11000.0 79.0538 45000.0 81.0695 13000.0 83.0852 2600.0 89.1977 2200.0 90.8246 2500.0 91.0541 4500.0 92.3051 2400.0 92.5402 2600.0 93.0696 22000.0 95.0493 3500.0 95.085 2300.0 97.0652 2200.0 97.3964 2200.0 100.6582 2400.0 107.0852 20000.0 109.1011 6900.0 115.9222 3000.0 121.1007 9100.0 133.1015 5000.0 135.1167 8000.0 136.0515 9900.0 143.0861 2800.0 148.051 2800.0 151.0752 23000.0 154.0613 4400.0 159.0798 3200.0 166.0476 2600.0 166.0623 99000.0 167.0707 4400.0 173.5207 6200.0 173.537 49000.0 175.0752 2900.0 177.1634 2800.0 181.0858 170000.0 182.8212 2500.0 188.0857 2200.0 189.0925 4000.0 190.0992 9400.0 197.2125 2600.0 202.0987 14000.0 205.0867 2700.0 206.0942 3000.0 207.0994 3000.0 212.1828 2500.0 213.0912 19000.0 215.1077 2600.0 216.1138 2700.0 219.1013 21000.0 229.1221 60000.0 232.1089 3000.0 233.1171 2500.0 245.117 11000.0 260.0374 2600.0 272.1773 6700.0 287.1759 2400.0 END IONS BEGIN IONS SCANS=686 PEPMASS=454.2591 CHARGE=1 COLLISION_ENERGY=0.0 59.9096 2300.0 67.0542 7600.0 67.2911 2600.0 69.0699 6700.0 71.6314 2600.0 74.9586 2800.0 75.3826 2400.0 77.4459 3000.0 79.0543 2300.0 79.6846 2200.0 81.0333 6500.0 81.0696 11000.0 86.2267 2300.0 89.0595 14000.0 91.0537 2500.0 93.0699 4700.0 98.0598 620000.0 98.0663 5600.0 105.0697 3600.0 109.1012 8500.0 110.0519 3300.0 110.0598 140000.0 119.0855 5500.0 119.7897 2700.0 121.101 5600.0 122.0172 2400.0 123.1163 9500.0 129.0694 6900.0 133.0646 31000.0 133.0854 4100.0 133.1005 7000.0 135.1167 6800.0 136.0764 3100.0 141.8498 2500.0 146.8319 2300.0 147.0801 14000.0 147.1165 20000.0 152.0704 290000.0 152.0846 7000.0 161.1319 5800.0 166.0626 15000.0 173.5291 63000.0 173.5458 8700.0 175.0746 4400.0 176.0835 8900.0 180.0775 2900.0 181.0859 320000.0 189.1273 20000.0 190.0631 4100.0 193.0849 3900.0 195.0647 11000.0 195.1018 7400.0 203.0706 8200.0 204.0781 17000.0 205.0854 3800.0 207.1018 46000.0 219.1021 26000.0 220.0732 8100.0 221.0809 100000.0 221.1174 3400.0 221.3599 2500.0 231.1016 21000.0 233.1171 19000.0 235.0966 110000.0 237.4292 2500.0 245.1173 17000.0 247.132 7100.0 255.102 2500.0 257.1175 7200.0 259.1324 13000.0 261.1128 8000.0 265.1205 2600.0 270.1263 2800.0 272.1756 2800.0 273.1122 18000.0 273.1452 5200.0 275.1284 7500.0 282.1239 2400.0 283.1346 8000.0 283.169 3000.0 284.142 3200.0 284.1762 15000.0 297.1501 11000.0 299.128 26000.0 299.1619 2500.0 301.1432 24000.0 301.1779 3200.0 303.1965 4600.0 308.179 11000.0 313.1803 30000.0 315.1958 41000.0 324.1762 3900.0 326.1864 4900.0 329.173 4200.0 329.2126 14000.0 339.1959 33000.0 342.1802 6400.0 357.2062 170000.0 357.2566 3500.0 395.5511 2700.0 398.1632 2700.0 430.4445 2400.0 END IONS BEGIN IONS SCANS=687 PEPMASS=499.317 CHARGE=1 COLLISION_ENERGY=0.0 61.5523 2300.0 65.9348 2200.0 76.8855 2300.0 78.0602 2900.0 79.0542 4700.0 81.0691 2700.0 89.0595 2800.0 90.9769 2900.0 93.2521 2600.0 95.0852 2800.0 98.0598 600000.0 98.0663 3500.0 110.0598 190000.0 110.0686 3400.0 112.5304 2100.0 114.5759 2100.0 118.9954 2300.0 123.3609 2500.0 126.4658 2800.0 130.5458 2300.0 133.0649 5400.0 135.1164 5800.0 147.0809 2500.0 152.0411 3000.0 152.056 7800.0 152.0705 920000.0 152.087 9600.0 153.8664 2300.0 160.4927 2700.0 163.1115 2700.0 166.0635 2500.0 173.5286 79000.0 173.545 8400.0 181.086 140000.0 189.1279 4800.0 193.879 2300.0 195.1021 3000.0 207.1017 12000.0 219.1018 6000.0 221.0813 130000.0 235.097 62000.0 236.2125 2600.0 247.1326 11000.0 248.2304 2500.0 266.129 2300.0 272.1772 3400.0 273.0318 2100.0 273.1454 2700.0 276.652 2700.0 299.1703 3400.0 301.1443 7900.0 303.1967 62000.0 315.1956 15000.0 338.6264 2400.0 339.1964 7400.0 340.2403 2500.0 342.1862 3100.0 357.2072 99000.0 391.3955 2500.0 392.9274 2700.0 400.8572 2500.0 474.1994 2800.0 499.3887 2600.0 END IONS BEGIN IONS SCANS=688 PEPMASS=842.5624 CHARGE=1 COLLISION_ENERGY=0.0 73.4439 2700.0 73.7584 2400.0 75.1002 2600.0 75.7542 2100.0 79.0538 160000.0 79.3764 2500.0 81.0127 2700.0 81.0695 430000.0 83.0488 12000.0 83.0852 110000.0 83.1182 2600.0 83.5694 2300.0 85.0646 16000.0 85.082 2700.0 87.262 2400.0 88.8049 2500.0 91.0538 110000.0 91.1574 2400.0 93.0695 270000.0 95.049 8800.0 95.0793 3700.0 95.0851 350000.0 96.3873 2400.0 97.0403 3300.0 97.0644 55000.0 97.1009 47000.0 99.08 17000.0 99.9275 2400.0 101.1829 2200.0 104.9112 2600.0 105.0695 120000.0 106.9382 2800.0 107.0488 4700.0 107.0851 250000.0 107.5882 2600.0 109.0644 26000.0 109.093 3000.0 109.1007 370000.0 109.8559 2100.0 110.1334 2400.0 111.0801 44000.0 112.9736 2700.0 117.0695 55000.0 117.6403 2500.0 119.0851 150000.0 119.0934 2500.0 121.0644 2900.0 121.0924 2900.0 121.1007 250000.0 123.08 8600.0 123.1163 93000.0 125.0957 60000.0 127.1646 2900.0 128.6585 2500.0 129.0699 3500.0 130.7999 2400.0 131.0851 120000.0 133.1007 200000.0 135.0802 14000.0 135.1164 200000.0 135.1274 2900.0 136.2472 2400.0 137.0958 28000.0 137.1324 7000.0 139.1114 3200.0 145.1007 130000.0 147.1164 160000.0 149.0958 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257.4979 2500.0 258.87 3000.0 259.2054 9600.0 261.2209 180000.0 269.1746 190000.0 272.6107 2300.0 273.1416 2700.0 275.2005 330000.0 293.21 15000.0 297.4712 2600.0 302.4374 2300.0 308.7344 2400.0 313.2705 2800.0 317.2467 7000.0 335.2581 1100000.0 335.3028 5600.0 349.2369 64000.0 352.1903 3000.0 360.9992 2500.0 367.2483 33000.0 380.9159 2300.0 383.7863 2900.0 394.5757 2600.0 401.2682 3000.0 412.5858 2400.0 419.7035 2800.0 419.7638 2700.0 427.054 2600.0 429.2946 2800.0 466.7544 2400.0 469.2999 2500.0 475.6265 2400.0 489.3578 95000.0 505.9389 2600.0 511.2623 2700.0 512.5786 2400.0 513.2507 2600.0 514.8116 2900.0 526.9104 2500.0 529.3886 200000.0 533.2722 8000.0 534.2753 19000.0 546.7482 2400.0 549.2696 6400.0 550.2693 13000.0 569.414 2800.0 592.9767 2700.0 600.205 3200.0 609.1868 2300.0 609.4536 22000.0 614.2218 2300.0 627.4531 2400.0 640.5194 3100.0 678.1052 2400.0 695.6945 3100.0 734.5626 2500.0 737.4755 2700.0 746.8295 2700.0 827.1888 3200.0 842.4719 47000.0 846.9481 3000.0 END IONS BEGIN IONS SCANS=689 PEPMASS=618.4279 CHARGE=1 COLLISION_ENERGY=0.0 64.7701 2400.0 66.0561 2300.0 67.0542 15000.0 69.0332 3100.0 69.0696 11000.0 71.049 3500.0 71.8984 2300.0 71.9202 2900.0 76.3193 2300.0 79.054 17000.0 79.4593 2400.0 81.0696 63000.0 83.0489 13000.0 83.0805 3500.0 83.0853 120000.0 85.0646 6300.0 86.9993 2200.0 91.0542 12000.0 93.0696 50000.0 95.0488 32000.0 95.0852 51000.0 97.0645 34000.0 99.0441 5900.0 101.6014 2500.0 105.0695 54000.0 106.0779 2900.0 107.0852 77000.0 109.0645 27000.0 109.1009 34000.0 111.0801 4500.0 112.5788 2400.0 113.0591 2700.0 113.0958 25000.0 117.0697 5900.0 119.0852 100000.0 120.0929 12000.0 121.0649 7400.0 121.0767 2600.0 121.1009 74000.0 123.0801 46000.0 123.1162 6400.0 125.0593 15000.0 125.0958 31000.0 129.0694 4100.0 131.0853 46000.0 132.0931 5700.0 133.101 71000.0 133.6221 2800.0 135.0802 26000.0 135.1166 32000.0 137.0961 23000.0 139.0753 9000.0 139.1113 29000.0 142.0779 2600.0 143.0853 37000.0 144.0931 28000.0 145.1009 130000.0 146.1087 11000.0 147.0801 41000.0 147.1166 36000.0 149.096 29000.0 151.075 35000.0 153.0909 5700.0 155.0852 8000.0 155.1064 19000.0 156.0935 6300.0 157.101 100000.0 158.1085 27000.0 159.0805 13000.0 159.1166 71000.0 160.0881 49000.0 161.096 27000.0 161.1325 21000.0 163.1116 51000.0 165.0909 150000.0 165.1269 10000.0 167.1068 14000.0 169.1009 33000.0 170.1086 12000.0 171.1021 7400.0 171.1169 77000.0 172.1243 30000.0 173.0964 17000.0 173.1325 43000.0 173.531 93000.0 173.5442 9900.0 175.1117 31000.0 175.1477 7700.0 177.0916 9600.0 177.1272 7300.0 178.0988 3200.0 179.1054 2800.0 179.1432 12000.0 180.1153 2700.0 181.1035 12000.0 181.1222 73000.0 182.1098 2600.0 182.1267 3000.0 183.1166 44000.0 183.1351 11000.0 184.1244 10000.0 185.0955 6700.0 185.1323 55000.0 187.1117 25000.0 187.1481 33000.0 189.1273 35000.0 190.1351 46000.0 191.1069 8200.0 191.1428 20000.0 193.1037 3500.0 193.1222 30000.0 195.1167 33000.0 195.1364 15000.0 196.1234 5700.0 197.0963 3600.0 197.1325 56000.0 198.1387 4000.0 199.1114 15000.0 199.1483 23000.0 201.1272 17000.0 203.1431 83000.0 207.1178 9900.0 207.138 45000.0 208.1263 3000.0 208.1459 35000.0 209.1324 45000.0 209.1524 12000.0 210.1387 6100.0 211.1126 9200.0 211.1483 35000.0 213.1272 14000.0 213.1637 12000.0 215.1433 15000.0 216.1504 8400.0 217.1587 2700.0 219.1382 24000.0 221.1322 16000.0 221.1537 240000.0 222.1561 3600.0 223.1479 28000.0 224.1551 3100.0 225.1269 8000.0 225.1485 34000.0 227.1431 8400.0 227.1798 16000.0 229.1591 13000.0 231.138 26000.0 233.1537 62000.0 234.1613 54000.0 235.1476 13000.0 235.1712 2800.0 237.1275 4700.0 237.1642 15000.0 239.1431 6800.0 239.1796 8300.0 241.1582 5900.0 241.1943 2800.0 243.1374 7900.0 245.1535 13000.0 246.161 9600.0 247.1467 2600.0 247.1692 54000.0 249.1647 12000.0 251.1415 2900.0 251.1784 11000.0 253.1594 3300.0 255.175 6200.0 256.1799 2600.0 256.4473 2900.0 257.188 2500.0 259.1707 9300.0 261.1596 4000.0 261.1869 9600.0 263.1792 2300.0 265.1594 7000.0 265.1937 2400.0 267.1756 3700.0 269.1535 2600.0 269.19 22000.0 271.1696 6900.0 273.1853 25000.0 274.1935 15000.0 281.1897 15000.0 283.1694 7700.0 285.1849 15000.0 286.193 37000.0 287.1714 2200.0 287.2009 310000.0 287.2373 7300.0 293.1893 3000.0 297.185 11000.0 299.2009 51000.0 300.2083 8600.0 301.345 2500.0 303.1979 2700.0 309.1851 3300.0 309.223 3200.0 310.1936 6000.0 311.2015 12000.0 312.2084 15000.0 313.2164 31000.0 319.2054 14000.0 321.2212 6300.0 325.2169 32000.0 329.2125 11000.0 337.2165 55000.0 339.232 41000.0 340.2409 2800.0 347.2325 2400.0 352.2396 150000.0 353.2474 35000.0 365.2474 59000.0 367.2619 14000.0 377.249 3100.0 395.2587 52000.0 480.3242 19000.0 503.7378 2400.0 511.3464 2500.0 525.3562 15000.0 538.3642 76000.0 618.5182 7100.0 END IONS BEGIN IONS SCANS=690 PEPMASS=600.4175 CHARGE=1 COLLISION_ENERGY=0.0 64.9442 2300.0 66.9586 2500.0 67.0539 7300.0 69.0331 2600.0 69.0696 6400.0 73.0645 11000.0 79.0543 3900.0 81.0696 19000.0 82.0368 2500.0 83.0488 3400.0 83.0851 7800.0 85.0648 2900.0 87.0436 47000.0 87.7684 2400.0 89.0593 740000.0 89.0663 5400.0 91.0538 6000.0 93.0695 35000.0 95.0487 12000.0 95.0852 24000.0 97.0645 14000.0 105.0694 26000.0 107.0693 2800.0 107.0852 41000.0 109.0647 7400.0 109.1008 27000.0 113.0954 3200.0 116.0094 2700.0 116.0323 2500.0 117.0906 2900.0 119.0852 42000.0 121.1008 43000.0 123.0803 21000.0 125.096 6800.0 129.0698 3000.0 131.0697 12000.0 131.0854 24000.0 133.0742 2900.0 133.0855 370000.0 133.1004 34000.0 134.8037 2500.0 135.0803 12000.0 135.1165 14000.0 137.0959 7200.0 139.1123 2900.0 139.8655 2400.0 143.0853 26000.0 144.093 3100.0 145.1008 45000.0 147.0801 8800.0 147.1166 17000.0 149.0959 15000.0 151.0761 3800.0 155.0849 4800.0 155.107 2600.0 157.1008 47000.0 158.1085 6200.0 159.0806 12000.0 159.1166 37000.0 161.0961 11000.0 161.132 3000.0 165.0906 7100.0 167.1065 18000.0 169.101 18000.0 170.1088 3000.0 171.1167 40000.0 173.0961 5300.0 173.1325 21000.0 173.524 41000.0 173.5427 28000.0 175.0961 2800.0 175.1118 8300.0 175.1481 8500.0 177.0969 3100.0 177.112 54000.0 181.1009 12000.0 183.1165 26000.0 185.132 21000.0 187.1119 3600.0 187.1479 8300.0 189.1267 3700.0 190.1351 2500.0 195.1172 20000.0 197.1321 26000.0 199.1111 3200.0 199.1478 10000.0 203.1442 4500.0 204.484 2700.0 207.1173 12000.0 209.1324 25000.0 211.1481 18000.0 213.1272 3900.0 213.1632 3700.0 215.1441 2600.0 220.892 3400.0 221.1328 15000.0 221.1546 10000.0 223.1477 17000.0 227.1418 3000.0 233.1538 21000.0 235.1474 6400.0 237.1645 7300.0 239.1481 3100.0 247.1447 2900.0 249.165 4300.0 251.1462 2800.0 251.179 3200.0 255.1741 21000.0 261.0247 2700.0 261.1628 2900.0 263.1774 6200.0 275.1809 3500.0 277.1932 2900.0 334.1079 2400.0 368.7173 2800.0 411.1591 2400.0 442.5897 2600.0 448.5576 2200.0 455.7804 2700.0 553.2837 2600.0 END IONS BEGIN IONS SCANS=691 PEPMASS=371.2585 CHARGE=1 COLLISION_ENERGY=0.0 52.2486 2200.0 52.9818 2200.0 54.1414 2200.0 55.2853 2200.0 57.0328 2200.0 57.0698 4600.0 57.4346 2600.0 58.3431 2200.0 60.5608 2400.0 63.3193 2300.0 67.8941 2300.0 68.9362 2300.0 71.0489 22000.0 71.0852 2600.0 71.9253 2200.0 72.2784 2500.0 75.2614 2500.0 75.3 2700.0 75.8995 2000.0 80.7283 2200.0 83.0491 2400.0 83.2926 2200.0 83.8151 2400.0 87.8462 2600.0 99.0797 2300.0 99.0879 2300.0 99.0962 2400.0 99.9349 2500.0 101.0593 34000.0 102.9056 2200.0 110.5229 2500.0 111.0439 33000.0 114.5784 2300.0 115.0858 2400.0 119.0854 18000.0 121.0644 2800.0 124.2805 2200.0 125.096 15000.0 127.1799 2200.0 129.0546 13000.0 133.1008 1500000.0 133.1113 15000.0 133.1246 2500.0 135.0444 5500.0 143.9195 2200.0 147.0799 34000.0 147.1166 18000.0 149.0833 2900.0 149.0992 2900.0 149.6851 4500.0 149.6954 3900.0 151.1114 120000.0 152.7281 2700.0 153.0906 270000.0 155.8857 2300.0 157.1008 25000.0 159.7577 2500.0 160.0885 11000.0 160.2406 2700.0 161.134 3200.0 164.5474 2500.0 164.6483 2300.0 166.2075 2200.0 168.2814 2500.0 171.1168 17000.0 173.1324 230000.0 173.5289 48000.0 173.5374 76000.0 174.4736 2100.0 175.1116 210000.0 175.148 240000.0 183.1172 7000.0 185.1323 26000.0 188.3085 2300.0 190.4418 2300.0 191.1061 11000.0 201.1274 61000.0 203.6897 2600.0 207.9777 2200.0 211.1118 11000.0 213.1639 6100.0 223.148 10000.0 229.1224 170000.0 241.1586 480000.0 241.1864 4700.0 276.2017 2500.0 279.8232 2300.0 283.2062 61000.0 290.4381 2600.0 295.5952 2200.0 305.7859 2400.0 306.6315 2300.0 308.2912 2800.0 310.4415 2200.0 311.2006 28000.0 329.2115 270000.0 329.8504 2500.0 332.5141 2400.0 363.7288 2900.0 374.9906 2500.0 END IONS BEGIN IONS SCANS=692 PEPMASS=794.5783 CHARGE=1 COLLISION_ENERGY=0.0 71.0489 67000.0 71.0854 76000.0 72.3542 2300.0 73.0282 3400.0 73.4288 2100.0 73.5527 2600.0 77.0387 6300.0 79.0541 930000.0 79.0586 2400.0 79.0595 4500.0 81.0334 3600.0 81.0697 3400000.0 81.0745 4500.0 82.4126 3100.0 83.049 94000.0 83.0852 930000.0 83.0913 4500.0 85.0282 120000.0 85.0645 130000.0 85.101 61000.0 85.559 2500.0 87.7153 2100.0 91.0388 59000.0 91.0482 5500.0 91.0539 560000.0 91.4343 2500.0 93.0697 1500000.0 93.0754 3400.0 93.0768 6400.0 95.049 86000.0 95.0853 3400000.0 95.091 6400.0 95.5837 2600.0 95.6903 2700.0 97.0282 71000.0 97.0646 250000.0 97.1009 630000.0 99.0439 3600.0 99.0802 150000.0 99.3127 2400.0 101.0598 6500.0 103.2221 2400.0 105.0444 9300.0 105.0618 3600.0 105.0696 660000.0 107.0772 14000.0 107.0853 1300000.0 109.0646 67000.0 109.093 9300.0 109.101 2000000.0 109.1084 2800.0 111.0445 2700.0 111.0801 180000.0 111.1166 160000.0 113.0959 68000.0 115.0755 5500.0 117.0696 200000.0 118.2744 2200.0 119.0769 6500.0 119.0853 850000.0 121.091 37000.0 121.1009 1600000.0 121.1108 20000.0 121.158 2300.0 122.7947 3800.0 123.0802 98000.0 123.107 11000.0 123.1166 1000000.0 123.1267 8300.0 125.0959 130000.0 125.1319 12000.0 125.7495 3200.0 127.0391 9700.0 127.0755 12000.0 127.1116 27000.0 129.0546 16000.0 129.0694 34000.0 130.1848 3000.0 130.835 2000.0 131.075 2900.0 131.0853 510000.0 133.0906 6700.0 133.1009 1000000.0 133.1127 10000.0 135.0804 19000.0 135.1057 3800.0 135.1166 1300000.0 135.1273 2600.0 135.4208 2400.0 137.0959 120000.0 137.1322 430000.0 139.0963 2600.0 139.1115 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3500.0 299.2365 31000.0 301.2533 30000.0 301.2878 3200.0 303.2332 8100.0 305.2482 15000.0 313.2506 6900.0 315.2707 3200.0 317.2474 150000.0 317.2856 4300.0 319.2624 28000.0 323.2581 3600.0 329.2841 6500.0 333.2421 37000.0 335.2216 2700.0 335.258 3600000.0 335.3257 4000.0 337.2263 14000.0 337.2737 4500000.0 337.3213 14000.0 339.2893 130000.0 343.2585 3500.0 343.3028 2800.0 345.7156 2400.0 349.2298 2500.0 351.2968 2700.0 354.7741 3700.0 357.316 8500.0 357.5555 2500.0 371.3323 3300.0 379.1732 3900.0 415.3568 3500.0 420.459 3500.0 426.0496 2500.0 445.8975 3000.0 453.0999 2300.0 459.6405 4400.0 472.3727 2600.0 505.4401 3200.0 510.7032 2400.0 514.0461 3100.0 523.4509 80000.0 530.4066 2600.0 537.4794 3000.0 541.4616 37000.0 571.4711 2700.0 583.335 4600.0 597.4869 440000.0 597.7538 2700.0 615.4962 69000.0 646.0274 2600.0 656.8094 2600.0 END IONS BEGIN IONS SCANS=693 PEPMASS=609.2711 CHARGE=1 COLLISION_ENERGY=0.0 67.6959 26000.0 67.6989 7200.0 80.8461 2300.0 81.0692 5500.0 95.0849 2600.0 108.5687 2400.0 120.6935 2600.0 155.3164 2600.0 173.5249 41000.0 173.5413 35000.0 183.8149 2500.0 202.9509 2500.0 253.3758 2100.0 421.3088 2500.0 461.2317 5300.0 475.211 2800.0 477.2266 3300.0 477.7841 2300.0 485.2354 2500.0 487.2502 12000.0 503.2401 9000.0 519.2361 28000.0 521.2188 14000.0 531.1472 3600.0 531.2387 170000.0 532.2498 5400.0 549.2499 310000.0 563.2665 19000.0 577.2435 7900.0 580.2346 3400.0 581.2646 3300.0 581.2751 15000.0 591.2605 81000.0 609.2709 900000.0 END IONS BEGIN IONS SCANS=694 PEPMASS=602.4332 CHARGE=1 COLLISION_ENERGY=0.0 63.8949 2300.0 67.0539 22000.0 69.033 2800.0 69.0696 24000.0 71.0492 6500.0 79.0539 25000.0 80.0617 4100.0 81.0694 92000.0 83.0488 16000.0 83.0852 130000.0 85.0644 12000.0 87.0437 4300.0 89.0593 40000.0 90.0627 5100.0 91.0539 22000.0 93.0695 110000.0 95.0488 34000.0 95.0852 77000.0 96.8253 2400.0 97.0591 2500.0 97.0644 44000.0 97.1011 3100.0 99.0437 15000.0 99.0803 3000.0 105.0696 110000.0 106.0774 4100.0 107.0851 140000.0 108.0928 3500.0 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161.1324 30000.0 163.1113 15000.0 163.1487 3800.0 165.1268 11000.0 167.0853 6900.0 167.1067 20000.0 168.1141 2700.0 169.1011 64000.0 170.1089 12000.0 171.1013 7000.0 171.1168 120000.0 172.1246 12000.0 173.0961 7300.0 173.1324 75000.0 173.5216 6900.0 173.5365 34000.0 175.1114 12000.0 175.1482 60000.0 177.1278 11000.0 179.0851 5900.0 179.1429 17000.0 181.1014 21000.0 181.1223 59000.0 182.1089 10000.0 183.1168 68000.0 183.1375 20000.0 184.1242 15000.0 185.1324 60000.0 186.1397 14000.0 187.1117 9600.0 187.1481 40000.0 189.1274 14000.0 189.1627 5400.0 191.1429 32000.0 193.1012 13000.0 193.1585 3100.0 194.1096 7900.0 195.1168 59000.0 195.1366 4000.0 196.1245 20000.0 197.1325 110000.0 198.1397 12000.0 199.1115 4200.0 199.148 46000.0 201.1264 6600.0 201.1638 23000.0 203.1432 13000.0 205.158 3400.0 207.1171 27000.0 207.1371 8400.0 208.1251 8300.0 208.1461 4300.0 209.1326 74000.0 209.1536 3200.0 210.1402 16000.0 211.1482 66000.0 212.156 9300.0 213.1279 3400.0 213.1638 43000.0 215.1429 6400.0 217.1589 14000.0 219.1175 3400.0 219.1747 3500.0 220.125 4100.0 221.1323 26000.0 221.1545 29000.0 222.141 6000.0 223.1484 48000.0 224.1564 6300.0 225.1484 23000.0 225.1668 8800.0 227.142 7900.0 233.1313 6600.0 233.1541 46000.0 235.1481 20000.0 237.1639 24000.0 238.1722 3000.0 238.3025 2600.0 239.1419 3300.0 239.1794 13000.0 241.1954 10000.0 243.1732 2700.0 246.1614 7200.0 247.1466 11000.0 247.172 3900.0 249.1637 19000.0 250.1734 3300.0 251.1791 15000.0 253.1622 3000.0 253.1945 9000.0 255.1751 4300.0 257.1897 10000.0 259.171 3200.0 259.206 5600.0 261.162 9100.0 263.1796 25000.0 265.1949 18000.0 267.21 7800.0 273.1854 7400.0 275.1793 3200.0 276.1872 5200.0 277.1956 8900.0 279.2114 3800.0 281.1934 3600.0 283.2075 6500.0 285.1842 6300.0 286.1931 15000.0 289.1964 4100.0 291.2116 8700.0 295.2083 2900.0 297.2208 2900.0 299.2012 13000.0 309.2221 3800.0 311.2368 3000.0 351.2699 8500.0 410.8864 3200.0 438.2458 2400.0 END IONS BEGIN IONS SCANS=695 PEPMASS=401.2842 CHARGE=1 COLLISION_ENERGY=0.0 53.6083 2100.0 55.054 18000.0 57.9585 2400.0 60.0811 2500.0 65.6311 2600.0 67.0539 23000.0 69.0696 28000.0 71.0487 24000.0 74.5045 2300.0 77.9733 2600.0 79.0538 27000.0 80.295 2200.0 81.0695 49000.0 83.0419 2600.0 83.0855 7500.0 91.0539 35000.0 93.0695 88000.0 95.0488 14000.0 95.0852 41000.0 98.8649 2300.0 101.8935 2100.0 105.0627 3700.0 105.0695 130000.0 107.0851 80000.0 109.0644 89000.0 109.1008 30000.0 111.08 13000.0 111.2225 2700.0 117.0696 34000.0 119.0851 160000.0 121.1008 41000.0 123.0803 6800.0 123.5976 2300.0 128.0616 4500.0 129.0694 24000.0 130.0774 7100.0 130.135 2700.0 131.0749 7400.0 131.0852 130000.0 133.1008 160000.0 135.0801 32000.0 135.1164 43000.0 137.0955 5300.0 137.5152 3000.0 139.3353 2200.0 140.6406 2300.0 141.0693 5300.0 142.0772 30000.0 143.0852 74000.0 144.0931 13000.0 145.1009 210000.0 147.0801 16000.0 147.1165 36000.0 153.2724 2400.0 155.0852 25000.0 156.0929 29000.0 157.1009 130000.0 158.1087 23000.0 159.1165 82000.0 161.0959 5900.0 161.1321 3000.0 165.0711 3800.0 166.3428 3100.0 167.0856 17000.0 168.0928 11000.0 169.1011 42000.0 170.1087 18000.0 171.1166 67000.0 172.1248 13000.0 173.1323 95000.0 173.5299 62000.0 173.546 10000.0 175.1478 20000.0 177.1489 2200.0 179.0852 14000.0 180.0935 6200.0 181.1015 23000.0 182.1091 15000.0 183.1167 49000.0 184.1252 11000.0 185.1325 34000.0 187.1483 34000.0 190.5661 2300.0 192.0914 3000.0 193.1013 16000.0 194.1085 18000.0 195.1166 44000.0 196.1241 9400.0 196.8769 2300.0 197.1324 38000.0 199.1478 30000.0 206.1089 18000.0 207.1165 21000.0 208.1244 6100.0 209.1324 47000.0 210.1386 3200.0 211.1486 16000.0 221.1328 25000.0 222.1404 5100.0 223.1485 14000.0 233.1334 4100.0 235.1484 11000.0 237.1638 17000.0 245.1327 3200.0 246.1396 6600.0 247.1476 3200.0 249.1647 2700.0 251.1796 6500.0 262.6397 2500.0 263.179 3200.0 273.1608 2700.0 287.1771 2500.0 291.0583 3100.0 356.5268 2600.0 378.199 2500.0 401.2817 3500.0 403.2453 2500.0 END IONS BEGIN IONS SCANS=696 PEPMASS=794.5782 CHARGE=1 COLLISION_ENERGY=0.0 71.0489 18000.0 71.0852 36000.0 71.3109 2400.0 71.4625 2200.0 72.2051 2000.0 72.2608 2600.0 72.3508 2300.0 72.3705 2700.0 72.849 2200.0 73.0641 2400.0 74.0128 2600.0 74.1477 2700.0 74.6336 2300.0 75.6255 2800.0 75.6883 2200.0 75.7661 2100.0 75.823 2500.0 76.4325 2200.0 76.5265 2200.0 76.9569 2800.0 77.0821 2100.0 77.476 2200.0 77.7275 2200.0 79.0538 590000.0 79.9785 2400.0 80.281 2400.0 80.3981 2400.0 81.0694 2200000.0 81.5648 2200.0 81.6305 2200.0 82.1208 2700.0 83.0488 29000.0 83.085 590000.0 85.0281 46000.0 85.0644 44000.0 85.1006 9500.0 85.2084 2400.0 86.1707 2600.0 87.7883 2300.0 88.8317 2500.0 91.0384 6800.0 91.0538 350000.0 91.0631 2400.0 91.5999 2200.0 92.0041 2700.0 92.7693 2600.0 93.0694 1000000.0 93.7722 2200.0 94.085 2400.0 94.1913 2700.0 95.049 26000.0 95.0785 3800.0 95.085 2200000.0 96.1772 2200.0 96.503 2300.0 97.0282 8000.0 97.0643 140000.0 97.1007 400000.0 98.1134 2300.0 99.08 62000.0 101.5717 2400.0 101.932 2300.0 103.5136 2400.0 104.7913 2600.0 104.932 2200.0 105.044 2600.0 105.0694 430000.0 106.045 2300.0 107.085 830000.0 109.0644 15000.0 109.1007 1300000.0 109.9536 2400.0 111.0801 100000.0 111.1164 87000.0 111.6523 2300.0 112.4883 2700.0 113.0956 21000.0 114.2975 2200.0 117.0693 120000.0 119.085 550000.0 121.0924 6200.0 121.1006 1100000.0 121.641 2500.0 123.0801 36000.0 123.1075 5300.0 123.1163 660000.0 123.3128 2600.0 125.0957 62000.0 127.0748 8300.0 128.8734 2600.0 129.0691 2600.0 131.0851 310000.0 132.7713 2800.0 133.0904 6300.0 133.1007 660000.0 133.5315 2400.0 133.8965 2300.0 134.7731 2300.0 135.1063 12000.0 135.1163 860000.0 136.4232 2300.0 136.5466 2600.0 137.0956 37000.0 137.1319 250000.0 137.4456 3000.0 137.8773 2900.0 138.709 2600.0 139.1112 43000.0 141.2081 2400.0 141.5291 2400.0 142.6127 2300.0 143.0589 2800.0 143.0857 16000.0 145.0495 2300.0 145.1007 310000.0 145.2669 2400.0 147.0214 2500.0 147.1163 590000.0 147.2033 2300.0 148.4093 2700.0 149.0951 8500.0 149.122 4800.0 149.132 580000.0 150.0056 2500.0 151.1114 34000.0 151.1477 91000.0 151.9703 2300.0 152.9881 2600.0 153.1269 31000.0 157.1008 31000.0 158.2239 2500.0 158.9622 2200.0 159.1164 350000.0 160.9474 2700.0 161.132 510000.0 163.1119 7600.0 163.1476 390000.0 164.7384 2600.0 165.1272 24000.0 165.1637 18000.0 167.1428 2900.0 169.7381 3200.0 171.1167 40000.0 173.1321 340000.0 173.5229 120000.0 173.5335 680000.0 173.5446 47000.0 174.0114 2400.0 175.1323 2400.0 175.1479 290000.0 175.1637 2500.0 177.1634 110000.0 179.1424 12000.0 181.1592 2700.0 182.0717 2900.0 183.1161 5100.0 183.3118 2700.0 183.8271 2800.0 184.0357 2400.0 185.1325 45000.0 185.2661 2600.0 185.3519 2300.0 187.1476 190000.0 188.1486 2800.0 189.1635 110000.0 189.8297 2700.0 190.3514 2400.0 191.1421 2800.0 191.1781 14000.0 191.6887 2700.0 192.5244 2400.0 197.1292 2600.0 199.0783 2200.0 199.1479 19000.0 200.9812 2700.0 201.1634 59000.0 202.373 2800.0 203.1799 25000.0 205.159 3300.0 205.1947 2400.0 206.1346 2800.0 210.1416 2300.0 210.2835 2900.0 212.4282 2900.0 213.1634 3100.0 215.1798 17000.0 215.4295 2500.0 216.3405 2500.0 217.1949 3100.0 219.1745 15000.0 219.211 5800.0 222.7521 2700.0 226.593 2900.0 229.3464 2400.0 229.7086 2200.0 230.5556 2300.0 231.2748 2300.0 233.2262 28000.0 241.1954 25000.0 243.2104 270000.0 245.1958 2800.0 245.2258 130000.0 257.9481 2300.0 258.1442 2400.0 259.205 110000.0 260.935 2900.0 261.2207 830000.0 263.2363 250000.0 263.6428 2300.0 265.0424 2400.0 266.7254 2300.0 270.8586 3000.0 271.1158 2700.0 275.2372 2800.0 279.6724 2300.0 280.1559 2400.0 280.975 3600.0 284.441 2400.0 291.2309 2700.0 294.7843 2500.0 297.5847 2400.0 299.2334 2400.0 300.5858 2900.0 301.7259 3000.0 303.0037 2500.0 311.6534 2600.0 313.2114 2900.0 316.6765 2600.0 317.2472 76000.0 317.5537 2300.0 319.2638 2900.0 327.2709 2900.0 333.2413 3100.0 335.258 2300000.0 335.3022 3900.0 336.0087 2700.0 337.2258 25000.0 337.2737 2800000.0 337.321 29000.0 339.2894 51000.0 340.3498 2600.0 340.4294 2300.0 347.9833 2300.0 363.7084 2500.0 366.6687 2400.0 368.3079 2500.0 368.5358 2600.0 371.3341 3300.0 378.5182 2500.0 388.5228 2400.0 394.1907 2700.0 405.0237 2400.0 406.2985 2500.0 423.5477 2700.0 426.2451 2500.0 426.9329 3100.0 427.011 2800.0 429.3247 2400.0 442.0508 2800.0 445.766 2500.0 452.9023 2600.0 460.245 2500.0 475.1053 2600.0 503.0587 2400.0 520.0181 2400.0 521.913 2700.0 523.45 16000.0 530.725 2400.0 534.963 2700.0 541.3246 3000.0 560.1764 2800.0 560.3926 3000.0 560.5637 3000.0 565.2043 2800.0 570.497 2800.0 572.1389 2800.0 580.6742 2600.0 584.9413 2700.0 587.3882 2400.0 597.4877 260000.0 604.209 2800.0 611.763 2200.0 615.5015 2800.0 616.5096 2700.0 620.1661 2500.0 627.8587 2500.0 633.5615 2700.0 651.405 2800.0 652.0803 2300.0 663.0712 2600.0 664.5915 2600.0 700.5663 2700.0 722.5486 2400.0 732.5524 2800.0 761.8511 2700.0 765.233 2400.0 799.0058 3200.0 END IONS BEGIN IONS SCANS=697 PEPMASS=799.5333 CHARGE=1 COLLISION_ENERGY=0.0 71.0122 8600.0 71.0486 15000.0 71.2792 2400.0 71.586 2500.0 73.0278 320000.0 73.2663 2700.0 73.3129 2400.0 73.5767 2700.0 74.2654 2600.0 74.9649 2100.0 76.2434 2300.0 78.5617 2700.0 78.9272 2200.0 78.9672 2200.0 79.0536 150000.0 80.3295 3100.0 80.3452 2100.0 81.0329 130000.0 81.0692 540000.0 83.0487 17000.0 83.0848 130000.0 85.0277 650000.0 85.0641 9000.0 87.0435 55000.0 88.8362 410000.0 88.8404 24000.0 90.9279 2600.0 91.0382 580000.0 91.0535 83000.0 91.2974 2400.0 93.0692 220000.0 93.2815 2400.0 94.6074 2500.0 95.0848 520000.0 96.0618 2400.0 97.0276 560000.0 97.0642 34000.0 97.1005 83000.0 98.7131 2600.0 99.0434 120000.0 99.08 12000.0 101.0225 240000.0 102.4211 2500.0 103.0382 110000.0 105.0692 81000.0 105.6989 2300.0 107.0847 190000.0 107.7436 2400.0 108.6523 2300.0 109.0276 120000.0 109.0645 2700.0 109.0939 3400.0 109.1004 300000.0 109.8518 2900.0 110.2193 2400.0 111.0799 13000.0 115.0383 58000.0 117.0539 5700.0 117.0701 3300.0 119.0849 100000.0 119.3521 2400.0 121.1004 240000.0 123.116 160000.0 123.1248 3800.0 124.0281 2300.0 124.4157 2700.0 125.7496 2400.0 126.4 2600.0 127.0298 3100.0 127.0381 380000.0 129.054 54000.0 129.8283 3700.0 131.0848 45000.0 133.1004 140000.0 133.8811 2500.0 134.6053 2800.0 135.1059 2700.0 135.1159 180000.0 136.8923 2700.0 137.1318 68000.0 139.1115 2500.0 145.0487 120000.0 145.1006 40000.0 147.1161 110000.0 147.722 2400.0 149.1316 130000.0 151.111 3700.0 151.1471 13000.0 153.1263 9200.0 159.0659 2700.0 159.1163 32000.0 161.1317 110000.0 162.294 2500.0 163.1473 74000.0 166.9769 2800.0 173.1321 44000.0 173.5223 11000.0 173.5313 410000.0 173.5422 31000.0 175.1479 66000.0 177.1285 2300.0 177.1638 12000.0 177.2883 2400.0 180.5889 2300.0 183.0649 63000.0 184.0731 17000.0 185.0258 6500.0 185.0413 420000.0 187.1476 12000.0 189.1629 13000.0 196.2687 2600.0 196.5939 2900.0 199.8741 5200.0 199.8939 5200.0 200.8174 2500.0 201.0747 41000.0 203.036 2400.0 203.0519 240000.0 220.7479 2700.0 224.9763 3200.0 227.3175 2300.0 237.9338 2800.0 241.0679 64000.0 243.057 3700.0 243.0831 610000.0 243.2104 20000.0 245.2256 78000.0 246.5556 2200.0 247.6646 2800.0 251.151 2500.0 259.0773 7000.0 261.2202 150000.0 263.2359 180000.0 301.2136 38000.0 303.2308 14000.0 327.7754 2300.0 332.1042 2300.0 335.2134 3500.0 335.2573 520000.0 335.2978 3700.0 337.2311 3900.0 337.2729 700000.0 337.3162 8800.0 344.8253 2800.0 351.3094 2300.0 353.155 2500.0 358.1671 2500.0 363.2529 26000.0 365.2673 36000.0 366.7649 2600.0 373.368 2300.0 381.877 2800.0 397.2874 3000.0 422.6605 2300.0 448.722 2300.0 477.3928 2500.0 479.2992 3500.0 481.3211 2900.0 484.0883 2600.0 497.3103 71000.0 498.4056 2900.0 499.325 72000.0 519.1998 3400.0 519.2924 7800000.0 519.4728 18000.0 520.75 2600.0 521.1276 4100.0 521.3077 8100000.0 521.4885 19000.0 530.5924 2600.0 564.5056 3000.0 566.7251 2100.0 594.2481 2500.0 619.4658 2600.0 637.4804 160000.0 653.251 2900.0 656.5039 3100.0 710.8896 2400.0 718.9642 3100.0 731.6379 2700.0 778.3073 2500.0 786.5027 2900.0 799.1846 13000.0 799.3593 6000.0 799.5321 9800000.0 799.879 21000.0 800.5216 3400.0 800.5409 5400.0 END IONS BEGIN IONS SCANS=698 PEPMASS=663.175 CHARGE=1 COLLISION_ENERGY=0.0 67.0143 4900.0 67.0174 24000.0 69.9163 2200.0 72.756 2400.0 79.0712 2200.0 79.3229 2200.0 81.0692 3500.0 83.0848 3000.0 101.3065 2300.0 103.0806 2300.0 111.2462 2500.0 121.2725 2800.0 149.6898 5800.0 153.2352 2300.0 171.5305 2300.0 173.5227 11000.0 173.5402 25000.0 197.0994 2500.0 325.2027 2300.0 337.5636 3000.0 378.4624 2700.0 458.8271 2500.0 473.0899 22000.0 475.0635 7600.0 475.1419 310000.0 487.1049 3500.0 490.128 11000.0 494.8284 2400.0 501.122 45000.0 502.1297 35000.0 503.1367 190000.0 515.1131 6900.0 518.1573 16000.0 519.1667 19000.0 522.4246 7100.0 529.1197 18000.0 530.1229 79000.0 531.1316 53000.0 532.1434 3300.0 534.1507 7100.0 534.1619 4400.0 543.1318 21000.0 546.1548 87000.0 547.1628 36000.0 557.1472 19000.0 562.1525 4400.0 569.1611 2800.0 575.1582 120000.0 588.1198 3200.0 603.1532 630000.0 603.2693 3500.0 606.142 19000.0 634.1736 8900.0 635.1716 4100.0 END IONS BEGIN IONS SCANS=699 PEPMASS=629.2374 CHARGE=1 COLLISION_ENERGY=0.0 65.8226 2300.0 77.903 2300.0 78.4572 2200.0 78.6833 2600.0 85.8531 2600.0 89.097 3100.0 97.6583 2300.0 108.7301 2700.0 114.2924 2300.0 122.092 2300.0 130.2538 2300.0 133.0133 2600.0 136.7987 2500.0 138.2989 20000.0 138.311 14000.0 138.9553 2400.0 145.195 2200.0 156.2554 2800.0 165.007 2400.0 173.5247 16000.0 173.5334 76000.0 173.5438 10000.0 174.7195 2300.0 184.8928 2500.0 192.7482 2400.0 209.8539 2500.0 214.4248 2400.0 216.8685 2400.0 226.623 2800.0 238.798 2600.0 256.8432 2600.0 268.6707 2300.0 357.8442 2600.0 435.1615 2500.0 496.1177 3600.0 496.1867 130000.0 509.1942 3000.0 510.2024 59000.0 524.2171 500000.0 525.2254 2700000.0 525.4087 5400.0 526.2238 2200.0 535.2111 30000.0 537.2034 2800.0 538.1965 68000.0 551.2064 25000.0 552.2178 7700.0 552.9612 12000.0 553.0202 59000.0 553.0596 45000.0 553.2205 9600000.0 553.3807 49000.0 553.4217 71000.0 553.4771 16000.0 554.2225 14000.0 565.0822 3000.0 585.2458 21000.0 597.2111 3800.0 611.7481 3000.0 END IONS BEGIN IONS SCANS=700 PEPMASS=606.248 CHARGE=1 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74000.0 502.2208 7500.0 502.2326 4800.0 503.2061 19000.0 504.2163 7000.0 505.2233 93000.0 506.231 57000.0 514.2065 3400.0 515.2063 17000.0 517.2186 13000.0 517.2297 3500.0 518.2282 56000.0 519.2337 100000.0 520.2479 12000.0 528.2103 2800.0 529.2204 15000.0 530.2262 19000.0 531.2027 81000.0 532.2089 9800.0 533.218 270000.0 534.2244 19000.0 535.2329 14000.0 545.2172 25000.0 546.225 190000.0 547.2336 2200000.0 547.4331 9400.0 559.1921 3200.0 560.2026 3600.0 561.2509 2900.0 563.2291 110000.0 563.3221 4400.0 565.6106 2600.0 573.2114 9500.0 574.2198 77000.0 577.2351 33000.0 578.2524 22000.0 579.2593 60000.0 588.2359 11000.0 589.2438 20000.0 591.2239 97000.0 605.2317 3100.0 606.1363 4500.0 606.2473 330000.0 606.4207 13000.0 607.2552 120000.0 END IONS BEGIN IONS SCANS=701 PEPMASS=607.2556 CHARGE=1 COLLISION_ENERGY=0.0 64.3612 490000.0 64.3642 99000.0 67.4716 1100000.0 67.475 190000.0 70.2899 17000.0 70.4406 12000.0 75.5162 13000.0 89.4585 14000.0 89.5828 21000.0 98.5837 19000.0 105.998 18000.0 125.6782 13000.0 136.8148 17000.0 149.7121 18000.0 151.8077 79000.0 151.8202 53000.0 167.5624 22000.0 173.5198 21000.0 173.5338 630000.0 181.1953 12000.0 184.721 22000.0 187.2105 19000.0 200.1373 18000.0 200.9558 15000.0 269.7246 17000.0 290.1036 18000.0 340.5361 20000.0 368.6559 13000.0 385.0736 19000.0 385.1823 17000.0 403.1896 44000.0 406.9666 12000.0 417.1693 110000.0 419.2223 260000.0 420.2278 47000.0 431.1859 120000.0 432.1947 130000.0 433.2035 380000.0 442.1753 73000.0 445.2032 430000.0 446.2106 1100000.0 447.2183 1100000.0 448.2252 130000.0 458.2127 21000.0 459.2173 290000.0 460.1927 28000.0 460.2292 30000.0 461.1987 260000.0 462.2402 130000.0 463.2482 94000.0 473.2003 400000.0 474.2046 1500000.0 475.2133 1300000.0 476.2211 170000.0 477.23 83000.0 478.2358 300000.0 479.2416 39000.0 487.2131 950000.0 488.2231 81000.0 489.2296 21000.0 490.2343 200000.0 491.2119 510000.0 501.2286 710000.0 502.2349 27000.0 503.2427 86000.0 504.2171 110000.0 505.2243 240000.0 505.4063 15000.0 506.2317 410000.0 507.2393 38000.0 517.2206 72000.0 517.2327 32000.0 518.2284 87000.0 519.2391 11000000.0 520.2493 72000.0 529.2239 420000.0 531.2385 47000.0 532.2104 150000.0 532.788 21000.0 533.2481 210000.0 534.2265 180000.0 536.2408 20000.0 537.2482 23000.0 539.1992 19000.0 547.038 100000.0 547.2343 18000000.0 548.2379 720000.0 550.2226 210000.0 551.2656 450000.0 557.2213 51000.0 561.2498 680000.0 563.2372 17000.0 564.2356 95000.0 575.2293 420000.0 578.2516 160000.0 579.2609 15000000.0 589.2454 640000.0 592.2352 35000.0 607.0236 190000.0 607.1352 37000.0 607.2555 31000000.0 608.2554 44000.0 END IONS BEGIN IONS SCANS=702 PEPMASS=655.3124 CHARGE=1 COLLISION_ENERGY=0.0 67.254 12000.0 68.8075 5800.0 68.8102 28000.0 69.7802 2300.0 70.8089 2700.0 70.8128 3500.0 76.3179 2400.0 79.9342 2400.0 81.6575 2100.0 81.8701 2200.0 89.9038 2500.0 89.9786 2500.0 95.5837 2300.0 96.7263 2100.0 102.2553 2600.0 139.5618 2400.0 142.0859 2500.0 168.8846 2500.0 171.8081 2600.0 173.5223 21000.0 173.5402 31000.0 186.8887 3000.0 253.1336 7000.0 292.1797 9200.0 384.1662 3200.0 385.8633 2400.0 389.2097 2500.0 400.2045 2600.0 407.2224 2800.0 420.2268 8600.0 421.2388 13000.0 424.1629 9500.0 427.1851 2700.0 432.2338 3000.0 433.2377 46000.0 434.2499 3500.0 435.2537 4100.0 436.2616 7800.0 445.2395 14000.0 446.2448 6500.0 447.2542 15000.0 448.2616 27000.0 449.2331 15000.0 459.2558 7300.0 460.2256 39000.0 461.229 5600.0 462.2079 6100.0 463.2126 140000.0 472.2266 11000.0 473.233 72000.0 474.2401 31000.0 475.2127 47000.0 476.2063 29000.0 477.2277 170000.0 478.2343 12000.0 485.232 16000.0 487.2488 54000.0 488.2552 27000.0 489.2269 18000.0 490.2359 13000.0 491.2437 89000.0 492.251 49000.0 493.2552 3300.0 494.2309 2900.0 503.2403 38000.0 504.2126 3800.0 505.2585 28000.0 506.2678 3100.0 507.213 2800.0 508.2127 3200.0 508.2864 16000.0 509.2907 32000.0 513.2276 4800.0 515.2433 74000.0 517.2238 47000.0 517.3035 3000.0 518.2314 16000.0 519.2731 43000.0 520.2829 110000.0 521.2222 7000.0 522.2166 2900.0 524.2717 2900.0 531.24 56000.0 532.2491 24000.0 533.2592 100000.0 534.2227 19000.0 535.2374 33000.0 536.2433 53000.0 537.2848 48000.0 538.2531 3100.0 540.2692 6300.0 546.2616 24000.0 547.2684 23000.0 549.2587 53000.0 550.2605 3700.0 550.2725 3100.0 552.2386 9400.0 553.2686 16000.0 559.2687 360000.0 560.2768 38000.0 561.2098 4900.0 561.2859 910000.0 562.2535 8300.0 563.265 500000.0 564.2728 1100000.0 565.2804 65000.0 567.2544 3700.0 575.2264 7700.0 577.2795 170000.0 578.2882 220000.0 579.2637 13000.0 580.2629 130000.0 587.2651 37000.0 588.2473 3000.0 590.2518 27000.0 591.2721 180000.0 593.3123 380000.0 593.4225 5700.0 594.2499 2800.0 595.274 3000.0 595.2902 3200.0 598.2644 3100.0 605.2752 230000.0 607.2546 12000.0 608.258 110000.0 609.2905 25000.0 619.2909 790000.0 619.3784 11000.0 620.2855 7200.0 622.2772 12000.0 637.2048 2000.0 637.3018 330000.0 637.4216 8700.0 640.2837 100000.0 655.2741 3400.0 END IONS BEGIN IONS SCANS=703 PEPMASS=618.4278 CHARGE=1 COLLISION_ENERGY=0.0 67.054 24000.0 67.8558 2300.0 68.2037 3100.0 69.0334 12000.0 69.0697 19000.0 71.0489 13000.0 72.7386 2400.0 75.0234 2300.0 76.1461 2500.0 79.054 29000.0 80.0617 2600.0 81.0696 120000.0 82.9136 2100.0 83.049 31000.0 83.0853 230000.0 84.0889 2800.0 85.0646 18000.0 86.7814 2500.0 88.2439 2700.0 88.6415 2300.0 89.0479 2700.0 91.0541 29000.0 93.0696 92000.0 95.049 75000.0 95.0853 88000.0 97.0645 69000.0 99.0439 15000.0 99.0804 5900.0 105.0696 100000.0 106.0776 4600.0 107.0853 150000.0 108.094 5100.0 109.0646 50000.0 109.1009 70000.0 111.0803 23000.0 113.0597 3600.0 113.0958 42000.0 117.0698 19000.0 118.1133 2700.0 119.0853 210000.0 119.0953 2800.0 120.0929 23000.0 121.0647 18000.0 121.1009 140000.0 121.1107 4800.0 123.0802 87000.0 123.1167 16000.0 123.294 2600.0 124.0868 2500.0 125.0595 30000.0 125.0959 56000.0 127.1117 5500.0 129.0697 20000.0 130.0767 2300.0 131.0853 86000.0 132.0931 22000.0 133.0647 6900.0 133.0904 3200.0 133.101 130000.0 134.1089 7400.0 135.0802 57000.0 135.1166 61000.0 137.0601 3600.0 137.0959 50000.0 139.075 22000.0 139.1115 50000.0 140.0623 2600.0 142.0778 11000.0 143.0853 77000.0 144.0931 56000.0 145.0461 2600.0 145.0651 7900.0 145.0888 4400.0 145.101 250000.0 145.1142 5200.0 146.1084 19000.0 147.0802 74000.0 147.1166 68000.0 148.0883 2600.0 149.0959 52000.0 149.1325 5500.0 150.1038 4300.0 151.0752 69000.0 151.1115 8900.0 152.0814 2700.0 153.0906 23000.0 153.1269 5900.0 155.0852 19000.0 155.1064 37000.0 156.0935 21000.0 156.2754 2400.0 157.0862 3800.0 157.101 230000.0 158.1085 49000.0 159.0802 22000.0 159.1166 160000.0 160.088 87000.0 160.1229 12000.0 161.0959 59000.0 161.1323 39000.0 162.1031 3400.0 163.1116 110000.0 165.0754 4700.0 165.0909 310000.0 165.1267 16000.0 166.0942 12000.0 167.1064 32000.0 167.1425 3000.0 169.1012 55000.0 169.1169 3900.0 170.1087 27000.0 171.0799 2800.0 171.1011 15000.0 171.1167 160000.0 171.1329 3700.0 172.0886 2800.0 172.1244 67000.0 173.0963 30000.0 173.1324 88000.0 173.5281 49000.0 173.5441 14000.0 174.1365 2800.0 175.1117 68000.0 175.1483 20000.0 176.1197 14000.0 177.091 23000.0 177.1277 27000.0 178.099 14000.0 179.1061 19000.0 179.143 32000.0 180.1144 21000.0 181.1017 31000.0 181.1222 140000.0 182.1084 13000.0 182.1261 5900.0 183.1167 83000.0 183.138 25000.0 184.1243 23000.0 185.096 13000.0 185.1325 93000.0 186.1389 14000.0 187.1116 47000.0 187.1481 60000.0 189.1272 62000.0 190.135 92000.0 191.0876 2800.0 191.1064 22000.0 191.1429 44000.0 193.103 13000.0 193.1221 65000.0 194.1097 7800.0 194.1283 2700.0 195.1166 56000.0 195.1377 28000.0 196.1241 17000.0 197.0972 6200.0 197.1324 98000.0 198.1035 13000.0 198.1396 16000.0 199.1116 31000.0 199.148 42000.0 200.1187 2600.0 200.1551 6800.0 201.1271 35000.0 201.1658 2500.0 202.1345 3100.0 203.1431 170000.0 204.146 3100.0 205.1223 6000.0 205.1587 5900.0 207.1167 25000.0 207.1381 92000.0 208.1254 12000.0 208.1456 71000.0 209.1324 91000.0 209.154 17000.0 210.1391 15000.0 211.1119 19000.0 211.1482 70000.0 212.1543 7700.0 213.1274 42000.0 213.1638 21000.0 214.1354 2600.0 215.1426 26000.0 216.1514 13000.0 217.1228 13000.0 217.1583 7500.0 219.138 51000.0 220.1451 8500.0 221.133 29000.0 221.1537 480000.0 222.1582 17000.0 223.1482 50000.0 224.1543 18000.0 225.1262 19000.0 225.1486 63000.0 225.1688 6400.0 227.1425 20000.0 227.1796 28000.0 229.1213 6900.0 229.1586 26000.0 231.1378 43000.0 231.1747 2900.0 233.1317 9800.0 233.1538 110000.0 234.1377 4200.0 234.1612 99000.0 235.1477 23000.0 235.1707 4900.0 236.1541 4600.0 237.1272 24000.0 237.1637 41000.0 239.1428 19000.0 239.1791 21000.0 241.1586 20000.0 243.1379 18000.0 243.1738 8300.0 245.1542 21000.0 246.1617 18000.0 247.1463 9700.0 247.1693 110000.0 248.177 3800.0 249.1292 2500.0 249.1635 28000.0 250.1712 3000.0 251.1437 13000.0 251.1786 29000.0 252.1863 7500.0 253.1582 24000.0 253.1919 5500.0 255.1739 9300.0 257.1546 4100.0 257.191 3800.0 259.1692 27000.0 260.1768 8500.0 261.1851 25000.0 263.1428 6500.0 263.1793 8000.0 265.1587 14000.0 265.1951 8200.0 267.1741 22000.0 268.1824 6000.0 269.1554 13000.0 269.1898 39000.0 271.1694 24000.0 272.177 7000.0 273.185 49000.0 274.1926 33000.0 275.1762 3000.0 275.2038 3400.0 277.161 7900.0 277.1956 4900.0 279.1741 19000.0 281.1569 3000.0 281.1906 21000.0 283.1693 16000.0 283.2034 3600.0 285.185 36000.0 286.1927 84000.0 287.2007 590000.0 287.2379 4600.0 288.2054 2900.0 291.2099 10000.0 293.1883 7100.0 295.1694 4300.0 295.2067 8700.0 297.1847 37000.0 298.1932 9200.0 299.2006 110000.0 300.2078 22000.0 303.1963 16000.0 307.206 13000.0 309.185 17000.0 309.2211 9400.0 310.1931 13000.0 311.2003 24000.0 312.208 34000.0 313.2157 64000.0 319.2058 30000.0 321.2222 4900.0 323.2003 11000.0 325.216 61000.0 327.2339 3300.0 329.2122 27000.0 337.216 110000.0 339.2318 76000.0 340.2387 12000.0 347.238 8300.0 351.2372 3200.0 352.1904 4200.0 352.2394 280000.0 353.2472 67000.0 363.2331 3200.0 365.2469 120000.0 366.2548 2500.0 367.2626 28000.0 377.2478 12000.0 378.2513 3800.0 391.2608 12000.0 395.2582 110000.0 401.2702 3100.0 404.7182 2800.0 426.2755 2700.0 438.3141 6500.0 440.2891 5500.0 467.3163 4300.0 475.3174 8300.0 480.3227 37000.0 505.3308 2900.0 507.3416 3200.0 523.3445 3700.0 523.9589 2800.0 525.3571 37000.0 526.3591 17000.0 538.3645 140000.0 542.223 3200.0 568.6686 2500.0 603.4036 6600.0 618.4187 3700.0 END IONS BEGIN IONS SCANS=704 PEPMASS=662.4396 CHARGE=1 COLLISION_ENERGY=0.0 67.0539 160000.0 68.7063 2300.0 69.0695 150000.0 71.0488 21000.0 71.0852 22000.0 73.0644 6800.0 74.7076 2300.0 79.0538 46000.0 81.0645 4400.0 81.0695 270000.0 83.049 15000.0 83.0851 220000.0 85.0645 20000.0 85.1013 10000.0 91.0539 24000.0 93.0694 110000.0 94.2652 2400.0 95.0849 210000.0 97.0644 62000.0 97.1008 77000.0 98.1096 2300.0 98.9838 2700.0 99.08 16000.0 101.0594 14000.0 101.1919 2300.0 105.0694 21000.0 107.085 110000.0 109.1007 130000.0 111.08 64000.0 111.1163 9000.0 111.8207 3000.0 112.2287 2300.0 113.0951 2200.0 115.0749 20000.0 119.0851 22000.0 120.1241 2400.0 121.1007 91000.0 123.1165 89000.0 125.0957 41000.0 125.1323 11000.0 129.0908 12000.0 129.1013 2300.0 133.1007 39000.0 135.1164 38000.0 137.1321 27000.0 144.3913 2400.0 147.1166 30000.0 149.132 350000.0 149.1456 8800.0 151.148 12000.0 153.1274 8100.0 155.0099 22000.0 157.0074 2200.0 161.1323 29000.0 163.1479 27000.0 167.1427 190000.0 170.4805 3000.0 173.1326 2500.0 173.5292 24000.0 173.5389 15000.0 175.1478 27000.0 177.1633 5900.0 185.1532 30000.0 189.1639 7800.0 194.4064 2600.0 200.3086 2700.0 203.1783 3600.0 207.2292 2300.0 228.1956 80000.0 236.1136 2600.0 241.1794 180000.0 245.2262 26000.0 259.1897 54000.0 263.2362 64000.0 306.2784 20000.0 315.9813 2500.0 319.2638 3200.0 337.2734 62000.0 338.0286 2700.0 371.503 3100.0 429.3712 8400.0 438.1466 2400.0 447.382 12000.0 521.3519 2500.0 521.4195 390000.0 521.5096 11000.0 END IONS BEGIN IONS SCANS=705 PEPMASS=450.3194 CHARGE=1 COLLISION_ENERGY=0.0 56.6456 2300.0 59.9764 2200.0 67.2533 2300.0 67.3698 2200.0 67.9109 2200.0 68.6333 2200.0 69.0698 2900.0 69.4121 3200.0 69.6518 2700.0 69.991 2500.0 72.1374 2700.0 73.4958 2300.0 78.4473 2700.0 80.2023 2800.0 111.3227 2300.0 129.5705 2400.0 152.8022 2400.0 155.317 2800.0 163.6223 2600.0 173.5219 54000.0 173.5412 47000.0 225.4874 2500.0 232.4184 2300.0 252.1475 2800.0 265.4109 2500.0 358.3079 43000.0 360.3238 120000.0 376.3151 3800.0 404.3168 4900.0 450.3204 51000.0 END IONS BEGIN IONS SCANS=706 PEPMASS=375.2686 CHARGE=1 COLLISION_ENERGY=0.0 53.0384 10000.0 53.6649 2300.0 54.2354 2400.0 55.0177 11000.0 55.054 66000.0 57.0697 12000.0 57.2498 2300.0 58.8221 2100.0 59.8986 2200.0 60.2064 2400.0 60.426 2200.0 65.0385 7400.0 67.0539 110000.0 69.0333 6200.0 69.0695 72000.0 71.049 5400.0 77.0384 5300.0 77.3006 2200.0 77.3195 2200.0 79.0539 130000.0 81.0696 260000.0 83.0487 16000.0 83.0852 21000.0 90.9762 6200.0 91.0483 4200.0 91.0539 150000.0 93.0631 4400.0 93.0696 450000.0 93.0767 5600.0 95.0488 170000.0 95.0784 3400.0 95.0852 230000.0 97.0645 45000.0 99.9282 2500.0 102.1068 2300.0 103.0539 7300.0 103.2764 2200.0 105.0445 11000.0 105.0616 5400.0 105.0696 420000.0 105.0783 8000.0 107.0488 4500.0 107.0772 4900.0 107.0852 260000.0 109.0645 55000.0 109.1009 120000.0 115.054 8300.0 117.0696 78000.0 119.0755 7500.0 119.0852 400000.0 119.0932 2800.0 119.1264 2500.0 121.0553 3200.0 121.0646 97000.0 121.091 4700.0 121.1009 340000.0 121.1105 4900.0 123.0804 29000.0 123.1165 15000.0 128.0618 20000.0 129.0697 48000.0 130.0775 23000.0 131.0853 240000.0 132.0934 6500.0 133.0648 8900.0 133.0763 3300.0 133.101 220000.0 133.1126 7800.0 133.6161 2300.0 133.9843 2400.0 134.559 2200.0 135.0803 13000.0 135.1166 66000.0 141.0696 17000.0 142.0776 72000.0 143.0853 140000.0 144.0931 45000.0 145.101 340000.0 145.1144 5100.0 146.1086 12000.0 147.0802 16000.0 147.1166 93000.0 149.0956 2900.0 153.0691 3100.0 154.0761 3800.0 155.0854 44000.0 156.0931 43000.0 157.0863 8000.0 157.101 220000.0 157.1981 2500.0 158.1089 30000.0 159.0803 20000.0 159.1167 170000.0 161.0961 68000.0 161.1326 22000.0 161.9151 2400.0 164.9541 3000.0 165.0706 3100.0 167.0857 15000.0 168.0937 14000.0 169.1012 74000.0 170.0919 3000.0 170.109 22000.0 171.0807 2700.0 171.1169 84000.0 172.0886 3000.0 172.1245 14000.0 173.0961 8600.0 173.1327 82000.0 173.52 3300.0 173.5348 56000.0 175.1117 13000.0 175.1486 26000.0 179.0856 22000.0 180.0935 12000.0 181.1013 38000.0 182.1094 21000.0 183.1171 64000.0 184.1253 9200.0 185.0953 3500.0 185.1327 38000.0 187.1112 12000.0 187.1482 31000.0 189.1641 2500.0 193.1013 23000.0 194.109 22000.0 195.0998 2800.0 195.117 49000.0 196.125 25000.0 197.0979 2600.0 197.1326 54000.0 198.1412 3100.0 199.1485 37000.0 201.1638 9700.0 206.1089 11000.0 207.1177 21000.0 208.1243 12000.0 209.1121 2400.0 209.1327 45000.0 210.1412 6900.0 210.4746 2400.0 211.1485 28000.0 213.1641 6800.0 217.5684 2600.0 220.1249 15000.0 221.1328 20000.0 223.1484 26000.0 225.1641 5000.0 230.1528 2500.0 233.1319 3400.0 235.1486 11000.0 237.164 11000.0 239.1792 2800.0 247.1487 3000.0 249.1647 5800.0 251.18 6400.0 253.1962 3300.0 265.1946 5400.0 273.1641 5700.0 275.1795 6900.0 277.1934 3400.0 375.2707 17000.0 END IONS BEGIN IONS SCANS=707 PEPMASS=556.4427 CHARGE=1 COLLISION_ENERGY=0.0 63.6348 2200.0 63.9463 2400.0 64.5945 2200.0 66.786 2400.0 67.0322 2300.0 69.0698 7900.0 69.0899 2600.0 69.1444 2500.0 71.0852 160000.0 71.3 2200.0 71.345 2400.0 72.3587 2100.0 72.7277 2600.0 73.0645 49000.0 73.422 2600.0 76.0934 2300.0 79.1692 2300.0 80.2882 2500.0 85.1009 120000.0 87.0437 81000.0 88.0928 2600.0 88.3301 2500.0 88.3511 2300.0 89.0593 1400000.0 89.9783 2500.0 97.101 6000.0 97.8307 2500.0 101.4848 2500.0 103.6006 2900.0 107.5557 2300.0 108.0143 2400.0 109.0457 2300.0 109.6088 2500.0 114.6372 2700.0 115.7412 2600.0 116.5263 2400.0 116.5791 2500.0 117.0905 19000.0 120.4111 2500.0 122.5455 2300.0 123.211 2800.0 125.8813 2200.0 126.7182 2500.0 128.0425 2700.0 133.0856 610000.0 133.0974 2900.0 141.242 2400.0 143.6237 2100.0 144.9481 2200.0 154.5387 2700.0 156.841 2200.0 157.3581 2700.0 158.1411 2400.0 158.8014 2500.0 163.9922 2400.0 166.5834 2300.0 166.677 2600.0 173.5217 4300.0 173.5311 180000.0 173.5413 32000.0 173.6781 2500.0 176.5156 2300.0 177.1122 110000.0 180.6423 3100.0 181.4204 2800.0 186.3326 2500.0 187.1971 2300.0 188.0613 2300.0 197.7936 2200.0 204.8513 2200.0 206.3274 2800.0 207.1715 2500.0 220.3831 2200.0 221.1389 2800.0 222.0249 2700.0 239.2774 2600.0 242.16 2500.0 252.9249 2500.0 267.7156 2800.0 269.0202 2600.0 278.3387 3300.0 289.8536 2300.0 295.1055 2300.0 295.2356 2200.0 300.8463 2200.0 314.4137 2400.0 329.3949 2700.0 353.7488 2600.0 362.3131 2700.0 369.4335 2300.0 371.0482 2300.0 384.9138 2300.0 411.4056 3100.0 459.6488 2600.0 493.6261 2800.0 516.465 2400.0 533.567 2500.0 END IONS BEGIN IONS SCANS=708 PEPMASS=583.4153 CHARGE=1 COLLISION_ENERGY=0.0 65.0384 2500.0 67.0539 21000.0 69.0333 3000.0 69.0695 25000.0 74.4058 2600.0 79.0538 18000.0 81.0695 60000.0 83.0489 15000.0 83.0853 16000.0 83.3739 2500.0 85.0644 15000.0 91.0538 27000.0 93.064 2600.0 93.0694 91000.0 94.223 2700.0 95.0489 7700.0 95.0794 3400.0 95.0851 95000.0 97.0647 7400.0 105.0695 79000.0 107.0785 3600.0 107.0851 96000.0 109.0646 14000.0 109.1008 55000.0 111.08 6200.0 113.0966 2500.0 117.0696 14000.0 119.0768 4100.0 119.0851 140000.0 121.0644 3100.0 121.1008 120000.0 123.08 30000.0 123.1164 18000.0 125.0594 10000.0 129.0698 14000.0 130.0767 2500.0 131.0852 64000.0 133.0643 2900.0 133.1007 88000.0 133.5215 2400.0 135.0802 23000.0 135.1165 31000.0 137.0957 31000.0 137.6161 2200.0 139.075 2900.0 142.0773 14000.0 143.0852 65000.0 144.093 10000.0 145.0907 2700.0 145.1008 120000.0 147.0801 49000.0 147.1165 47000.0 149.096 14000.0 149.1324 12000.0 151.0749 57000.0 153.0911 3600.0 155.0853 17000.0 156.0933 18000.0 157.1008 130000.0 158.1087 16000.0 159.0808 9200.0 159.1166 72000.0 161.096 15000.0 161.1323 27000.0 163.0749 4300.0 163.1114 26000.0 165.0908 180000.0 167.0856 10000.0 167.1064 26000.0 168.0937 3400.0 169.1011 56000.0 170.1094 11000.0 171.1167 91000.0 173.0961 7800.0 173.1324 73000.0 173.5268 67000.0 173.5449 14000.0 175.112 9000.0 175.1479 21000.0 177.0913 7400.0 179.0857 11000.0 180.0928 2400.0 181.1011 29000.0 181.1203 12000.0 182.1086 14000.0 183.1167 65000.0 184.1247 11000.0 185.1323 67000.0 187.1112 6300.0 187.1479 18000.0 189.1273 24000.0 190.0534 2200.0 191.1425 19000.0 193.1009 14000.0 194.1086 22000.0 195.1166 46000.0 195.1347 2700.0 196.1244 13000.0 196.6345 2400.0 197.1323 66000.0 199.148 46000.0 201.1289 3300.0 201.1634 6500.0 201.4132 3200.0 203.143 90000.0 205.1007 5600.0 205.1604 3300.0 206.1088 6100.0 207.1166 43000.0 207.1381 26000.0 208.1244 16000.0 209.1324 80000.0 210.1404 3700.0 211.1482 40000.0 212.1542 2400.0 213.1273 5900.0 213.1642 18000.0 215.1429 7100.0 217.1584 7600.0 219.1174 12000.0 220.1241 6800.0 221.081 3300.0 221.1322 34000.0 221.1537 200000.0 222.1409 4900.0 223.1481 49000.0 224.1562 7600.0 225.1644 13000.0 227.1423 5700.0 229.1584 8400.0 231.1751 8300.0 232.1248 3300.0 232.6207 2500.0 233.1321 22000.0 233.1555 10000.0 234.1403 8600.0 235.1482 37000.0 236.1559 5600.0 237.1639 27000.0 239.1798 10000.0 241.4748 2700.0 245.1324 11000.0 246.1405 10000.0 247.1481 25000.0 248.1553 8700.0 249.1635 30000.0 251.1797 19000.0 253.1956 14000.0 255.174 4200.0 257.1898 6600.0 259.1468 14000.0 260.1552 11000.0 261.1634 28000.0 262.1719 7000.0 263.1796 21000.0 265.1949 20000.0 269.1897 8300.0 271.2059 9200.0 273.1633 12000.0 274.171 3600.0 275.1796 31000.0 277.1956 14000.0 279.1743 3500.0 279.2102 8300.0 281.1897 7500.0 281.2956 93000.0 282.2796 350000.0 283.2067 20000.0 283.2827 380000.0 286.1954 6900.0 287.2024 16000.0 289.1946 14000.0 291.1762 3200.0 295.2059 18000.0 297.2222 18000.0 299.1774 2900.0 299.306 100000.0 300.3093 110000.0 301.1954 11000.0 303.3488 2500.0 305.6135 2500.0 306.3665 2400.0 307.2039 3200.0 309.2233 2800.0 311.1786 2900.0 313.1968 2900.0 315.2105 4100.0 316.3167 2800.0 327.5506 2600.0 329.227 6600.0 347.237 4100.0 349.2539 5900.0 357.2608 2900.0 365.2451 10000.0 375.268 16000.0 403.3002 32000.0 491.3516 3000.0 503.3516 19000.0 520.004 2700.0 538.538 2900.0 565.404 22000.0 583.4148 22000.0 END IONS BEGIN IONS SCANS=709 PEPMASS=600.4179 CHARGE=1 COLLISION_ENERGY=0.0 63.6405 5100.0 66.5057 5300.0 67.0542 94000.0 69.0334 100000.0 69.0698 86000.0 71.0491 23000.0 74.1419 4400.0 79.0542 110000.0 80.0619 6800.0 81.0698 310000.0 82.8982 5200.0 83.0491 160000.0 83.0855 81000.0 85.0647 55000.0 87.044 17000.0 89.0597 100000.0 91.0543 140000.0 92.6938 5100.0 93.0699 560000.0 95.0491 210000.0 95.0855 390000.0 95.8176 5400.0 96.9698 5600.0 97.0647 120000.0 97.1014 5100.0 99.0444 11000.0 103.0551 8100.0 105.0698 490000.0 105.0766 3900.0 106.0777 29000.0 107.049 33000.0 107.0855 610000.0 107.0923 4200.0 108.0568 5900.0 108.093 13000.0 109.0648 180000.0 109.1012 250000.0 111.0438 20000.0 111.0804 100000.0 113.0962 33000.0 117.0698 76000.0 118.74 4400.0 119.0491 14000.0 119.0855 730000.0 119.097 18000.0 120.0933 53000.0 120.1032 5400.0 121.0648 120000.0 121.0909 8700.0 121.1011 740000.0 122.0727 24000.0 122.1048 17000.0 123.0804 380000.0 123.1169 84000.0 124.0886 7200.0 125.0596 120000.0 125.0961 140000.0 128.0626 19000.0 129.0699 83000.0 130.0774 18000.0 130.5652 5600.0 131.0855 310000.0 132.093 48000.0 133.0647 96000.0 133.0862 59000.0 133.1012 550000.0 134.0727 6700.0 134.1083 26000.0 135.0688 7300.0 135.0804 330000.0 135.1168 270000.0 136.0876 6900.0 137.0598 50000.0 137.0961 200000.0 139.0751 85000.0 139.1117 55000.0 141.0703 23000.0 142.0777 56000.0 143.0856 440000.0 144.0932 170000.0 145.0651 17000.0 145.1012 770000.0 145.1143 11000.0 146.0732 14000.0 146.1082 50000.0 147.0673 11000.0 147.0805 440000.0 147.1168 230000.0 148.0881 36000.0 149.0961 260000.0 149.1326 46000.0 150.1036 27000.0 151.0754 400000.0 151.1119 59000.0 152.0824 32000.0 153.0911 66000.0 155.0855 83000.0 155.107 29000.0 156.0932 100000.0 157.086 19000.0 157.1012 930000.0 157.1166 5800.0 158.1088 180000.0 159.0806 160000.0 159.1169 600000.0 160.0884 64000.0 160.1224 25000.0 161.0962 410000.0 161.1326 190000.0 162.1032 47000.0 163.0757 32000.0 163.1118 420000.0 164.1187 5900.0 165.0776 6900.0 165.0912 1200000.0 165.1258 13000.0 166.0946 31000.0 167.0705 9300.0 167.0863 21000.0 167.1068 270000.0 167.1422 6500.0 168.0936 5900.0 168.1101 12000.0 169.1014 260000.0 170.1089 120000.0 171.081 44000.0 171.117 610000.0 171.13 3900.0 172.0881 16000.0 172.1245 220000.0 173.0963 190000.0 173.1125 5700.0 173.1149 24000.0 173.1328 330000.0 173.529 100000.0 173.5423 10000.0 174.1036 35000.0 174.1391 34000.0 175.112 380000.0 175.1483 130000.0 176.1193 31000.0 177.0912 91000.0 177.1277 120000.0 178.0987 45000.0 179.087 34000.0 179.1069 130000.0 179.1433 17000.0 180.0949 13000.0 180.1149 71000.0 181.0855 39000.0 181.1016 120000.0 181.1226 170000.0 182.1088 45000.0 183.117 350000.0 184.124 84000.0 185.0959 74000.0 185.1326 480000.0 186.1038 32000.0 186.1399 67000.0 187.1119 160000.0 187.1483 130000.0 188.1192 33000.0 189.0939 7200.0 189.1276 310000.0 190.1352 270000.0 191.1069 96000.0 191.143 120000.0 193.1012 94000.0 193.1225 220000.0 194.1088 53000.0 195.1169 300000.0 195.1379 51000.0 196.1243 73000.0 197.0963 71000.0 197.1135 18000.0 197.1326 410000.0 198.1039 46000.0 198.1396 58000.0 199.1119 170000.0 199.1483 190000.0 200.1191 30000.0 200.155 17000.0 201.0913 11000.0 201.1276 180000.0 201.1635 27000.0 202.1354 25000.0 203.1082 38000.0 203.1432 830000.0 203.1648 11000.0 204.1468 8400.0 205.1024 13000.0 205.1229 63000.0 205.1594 6600.0 206.1091 27000.0 207.1168 190000.0 207.1384 370000.0 208.1242 78000.0 208.1459 87000.0 209.0976 16000.0 209.1326 330000.0 209.154 61000.0 210.1036 7800.0 210.1399 76000.0 211.112 110000.0 211.1484 250000.0 212.1188 50000.0 212.1554 28000.0 213.1063 7500.0 213.1276 210000.0 213.1639 79000.0 214.1354 29000.0 215.1065 65000.0 215.1435 120000.0 216.1507 53000.0 217.1225 54000.0 217.1593 48000.0 218.1666 13000.0 219.1169 44000.0 219.1383 190000.0 220.1239 40000.0 220.1458 8500.0 221.1324 170000.0 221.1539 1300000.0 222.139 47000.0 222.1593 26000.0 223.1116 61000.0 223.1484 230000.0 224.1192 6900.0 224.1551 39000.0 225.1275 150000.0 225.164 170000.0 226.1334 18000.0 226.1701 6700.0 227.107 5600.0 227.1432 110000.0 227.1798 39000.0 228.1511 21000.0 229.1224 56000.0 229.159 93000.0 230.1293 35000.0 231.1383 61000.0 231.1737 11000.0 232.1237 26000.0 232.1463 13000.0 233.1319 64000.0 233.154 490000.0 234.1395 29000.0 234.1606 160000.0 235.1482 200000.0 235.1715 28000.0 236.1557 45000.0 237.1257 65000.0 237.1491 320000.0 238.1716 25000.0 239.1433 100000.0 239.1795 80000.0 240.1501 28000.0 241.1257 13000.0 241.1589 97000.0 242.1633 5400.0 243.1381 66000.0 243.1731 35000.0 245.1315 40000.0 245.1548 40000.0 246.139 48000.0 246.1632 28000.0 247.146 76000.0 247.1701 170000.0 248.1397 7700.0 248.1552 22000.0 249.13 29000.0 249.1637 170000.0 250.1615 5500.0 251.1432 68000.0 251.1795 90000.0 252.1513 13000.0 252.1875 14000.0 253.1587 170000.0 253.1899 26000.0 254.1672 7100.0 255.1431 29000.0 255.1743 420000.0 255.2036 3700.0 256.1818 9200.0 257.1539 44000.0 257.1892 38000.0 258.1647 6000.0 259.1459 50000.0 259.1697 88000.0 260.1532 17000.0 261.1633 210000.0 261.1874 19000.0 262.1706 28000.0 263.1418 36000.0 263.179 120000.0 264.151 6000.0 264.1857 13000.0 265.1586 72000.0 265.195 60000.0 266.1668 14000.0 267.142 7600.0 267.1743 99000.0 268.1814 62000.0 269.1545 41000.0 269.19 100000.0 270.1966 25000.0 271.1695 170000.0 272.1801 17000.0 273.1586 11000.0 273.1855 89000.0 274.1928 120000.0 275.1447 13000.0 275.1796 62000.0 276.1514 5400.0 276.1856 31000.0 277.1592 39000.0 277.195 80000.0 279.1747 190000.0 279.2074 8900.0 281.156 31000.0 281.1905 150000.0 282.197 27000.0 283.171 27000.0 283.205 22000.0 284.1806 5900.0 285.185 160000.0 286.1929 260000.0 287.201 190000.0 289.1944 64000.0 291.1741 49000.0 291.2106 39000.0 293.1909 51000.0 294.1979 76000.0 295.171 32000.0 295.2062 150000.0 296.1763 9100.0 297.1851 150000.0 298.1937 32000.0 299.2008 230000.0 300.2105 25000.0 301.1946 46000.0 303.1961 620000.0 305.19 32000.0 305.2264 18000.0 307.2064 55000.0 309.1847 58000.0 309.2218 39000.0 310.1934 64000.0 311.2002 72000.0 312.2085 74000.0 313.216 150000.0 315.2106 26000.0 317.1899 21000.0 317.2274 6900.0 319.2059 110000.0 320.2122 6500.0 321.2219 32000.0 322.2293 40000.0 323.2004 27000.0 325.2164 190000.0 329.1885 6400.0 329.2275 25000.0 331.2047 23000.0 332.2133 6200.0 333.2221 32000.0 334.2317 13000.0 335.2009 14000.0 335.2392 6300.0 337.2163 350000.0 339.2324 27000.0 341.226 28000.0 345.2204 20000.0 347.2373 55000.0 349.2163 31000.0 350.2239 7300.0 351.2311 39000.0 352.1898 23000.0 352.2396 810000.0 352.2787 6200.0 353.2475 17000.0 359.2365 35000.0 362.2248 5800.0 363.2317 40000.0 365.2472 350000.0 369.259 6300.0 373.2585 6000.0 375.1802 6000.0 377.247 68000.0 378.2533 9300.0 379.2638 10000.0 381.2444 23000.0 383.2573 9000.0 387.27 26000.0 391.261 15000.0 399.2536 16000.0 401.2793 6000.0 405.2769 28000.0 419.2941 29000.0 420.3005 19000.0 421.2749 16000.0 437.3053 28000.0 439.2842 19000.0 469.3087 44000.0 487.3196 190000.0 493.3284 14000.0 502.3434 45000.0 503.3509 230000.0 505.3302 130000.0 507.3446 56000.0 508.3493 32000.0 520.3526 85000.0 567.3779 23000.0 583.4082 6700.0 585.3911 34000.0 600.409 17000.0 END IONS BEGIN IONS SCANS=710 PEPMASS=468.3901 CHARGE=1 COLLISION_ENERGY=0.0 57.0696 260000.0 58.0328 2500.0 59.0522 2100.0 62.0598 37000.0 62.3853 2100.0 62.4616 2200.0 64.7231 2400.0 65.7747 2400.0 65.8992 2300.0 69.0696 6800.0 69.2175 2600.0 70.2588 2200.0 70.4875 2500.0 70.6423 2500.0 71.0816 2700.0 71.0852 240000.0 71.6913 2400.0 72.7068 2500.0 72.9276 2300.0 73.0285 3100.0 73.0645 53000.0 74.179 2500.0 74.2247 2600.0 74.4437 2300.0 75.4227 2500.0 75.5181 2500.0 75.7171 2600.0 76.8783 3000.0 78.819 2300.0 81.0693 3000.0 81.8885 2200.0 82.4723 2100.0 83.0853 11000.0 84.0803 2700.0 85.0736 2200.0 85.1009 160000.0 85.5361 2400.0 87.0437 49000.0 89.0593 2200000.0 89.0652 3000.0 89.6243 2500.0 89.9627 2600.0 92.239 2600.0 93.7001 2300.0 95.0998 2500.0 97.101 14000.0 102.0912 46000.0 102.6038 2400.0 103.0772 2300.0 108.9409 2300.0 109.3227 2300.0 109.8004 2100.0 110.5479 2200.0 114.6219 2500.0 117.0906 6600.0 123.1158 2500.0 127.502 2300.0 130.0225 2400.0 131.0564 2800.0 133.0757 2300.0 133.0856 840000.0 133.3194 2500.0 140.3823 2500.0 153.6902 2400.0 154.6106 2200.0 165.8545 2300.0 166.8971 2800.0 167.4249 3400.0 173.5264 170000.0 173.5407 130000.0 174.0763 2100.0 177.112 120000.0 180.9183 2300.0 181.9723 2900.0 194.9673 2600.0 195.1227 20000.0 198.1596 2300.0 198.6374 2700.0 201.6724 2500.0 204.2524 2300.0 209.4137 2600.0 214.0156 2800.0 215.0929 2700.0 219.3402 2600.0 223.6161 3000.0 224.8169 2200.0 224.9581 2600.0 235.7531 2500.0 236.9223 2400.0 238.6338 2400.0 239.149 17000.0 252.2968 2300.0 263.0527 2500.0 273.8805 2300.0 278.0719 2800.0 283.1753 30000.0 293.5317 2300.0 301.5775 3000.0 303.2363 2600.0 309.9779 2300.0 311.2947 110000.0 324.871 2500.0 328.3196 7900.0 345.5169 2600.0 348.2979 2500.0 358.9326 2400.0 368.3524 230000.0 370.1462 3000.0 398.6151 2600.0 451.2588 2700.0 454.3332 2400.0 468.4413 26000.0 END IONS BEGIN IONS SCANS=711 PEPMASS=607.2559 CHARGE=1 COLLISION_ENERGY=0.0 64.3611 26000.0 64.3641 7500.0 67.4716 43000.0 67.475 13000.0 71.9271 2200.0 74.416 2200.0 75.2569 2000.0 77.4665 2200.0 80.1174 2400.0 84.2249 3600.0 92.4907 2400.0 103.2732 2800.0 114.8313 2400.0 125.1089 4200.0 136.8027 17000.0 136.8143 16000.0 149.043 2400.0 154.4131 2800.0 156.8804 3900.0 162.5833 2300.0 173.5259 56000.0 173.5358 49000.0 173.5439 16000.0 184.8444 3700.0 195.0664 2600.0 208.4838 2600.0 228.4022 2200.0 230.9463 2300.0 246.6128 2600.0 273.1955 2600.0 309.7601 3100.0 327.6839 2700.0 364.68 2500.0 395.6231 2900.0 417.1686 9000.0 418.2251 4300.0 419.2244 38000.0 420.428 2400.0 431.1875 20000.0 432.1933 14000.0 433.2027 27000.0 445.2023 43000.0 446.2102 99000.0 446.2711 5000.0 447.2183 180000.0 448.2288 9800.0 454.083 2500.0 459.2186 24000.0 460.1895 3500.0 461.1962 23000.0 462.2416 12000.0 463.2486 35000.0 473.1988 46000.0 473.2387 3700.0 474.2055 280000.0 475.2132 440000.0 476.2163 11000.0 477.2351 4000.0 478.234 18000.0 487.2126 110000.0 488.2208 22000.0 489.2231 4300.0 490.2366 59000.0 491.2409 55000.0 501.2286 120000.0 502.2319 9200.0 503.2428 38000.0 504.2177 9600.0 505.2243 34000.0 506.2316 60000.0 517.2245 27000.0 518.2309 23000.0 519.1447 5000.0 519.2391 1100000.0 529.2236 57000.0 532.2124 32000.0 533.255 19000.0 534.2234 9100.0 545.2162 4700.0 546.2419 2700.0 546.9254 6600.0 546.9811 11000.0 547.0379 60000.0 547.0774 51000.0 547.2341 8400000.0 547.4331 55000.0 548.2369 38000.0 550.2233 9300.0 551.2647 42000.0 561.2501 190000.0 564.2317 7800.0 575.2308 33000.0 576.4371 2900.0 578.2514 8000.0 579.1527 3300.0 579.2608 910000.0 579.3668 9300.0 589.2459 120000.0 607.1672 4200.0 607.2555 1400000.0 END IONS BEGIN IONS SCANS=712 PEPMASS=653.2975 CHARGE=1 COLLISION_ENERGY=0.0 76.0693 2200.0 77.0893 2200.0 82.1199 2300.0 82.3096 2600.0 83.0421 2200.0 83.2445 2800.0 84.0867 2300.0 84.2879 2500.0 87.4587 2600.0 89.3597 2400.0 91.2201 2200.0 95.087 2500.0 102.7197 2400.0 102.9787 2400.0 109.2208 2800.0 111.1118 2700.0 121.456 2900.0 129.0442 2400.0 134.0598 24000.0 150.3756 2800.0 159.4981 2900.0 161.99 2200.0 166.0853 2800.0 173.5228 21000.0 173.5354 110000.0 181.2847 2700.0 184.3219 2400.0 195.4821 2600.0 201.8114 2700.0 204.0649 17000.0 210.9771 2700.0 226.1472 3200.0 237.1384 8500.0 238.1463 13000.0 239.1542 9200.0 240.1625 3700.0 251.1544 9500.0 252.1627 3300.0 253.17 8300.0 263.791 3100.0 279.1497 48000.0 287.9718 2400.0 307.1068 5900.0 313.1177 8600.0 337.1091 2400.0 338.5232 2600.0 339.1328 19000.0 351.133 3400.0 361.7596 2600.0 375.1013 2400.0 410.2119 6100.0 414.9865 2400.0 430.174 2900.0 440.1616 3200.0 446.205 3400.0 450.206 2900.0 451.215 15000.0 457.2404 2600.0 458.2235 2800.0 460.1919 2600.0 468.2149 6900.0 477.1971 3600.0 478.1962 8600.0 478.2097 2800.0 479.2068 12000.0 482.2308 26000.0 483.2392 42000.0 486.2019 67000.0 487.2121 13000.0 488.2179 20000.0 505.2253 11000.0 508.2613 12000.0 509.2437 3400.0 509.2564 3900.0 510.2569 19000.0 515.2073 6100.0 516.01 2700.0 519.2381 4300.0 520.242 2800.0 523.2698 250000.0 529.2233 17000.0 533.2327 4000.0 533.2519 20000.0 534.2294 12000.0 535.2696 19000.0 536.2502 17000.0 537.2373 6600.0 540.2843 8800.0 547.2394 12000.0 549.2853 8200.0 550.2595 8100.0 551.2651 480000.0 552.2522 6000.0 555.2913 7200.0 561.2493 34000.0 564.2381 3200.0 565.2801 150000.0 568.2692 8000.0 575.2653 300000.0 577.2837 2700.0 578.2528 12000.0 579.2605 370000.0 580.269 14000.0 582.2803 9100.0 583.1832 5300.0 583.2915 540000.0 583.4 5100.0 593.2749 120000.0 594.2662 3900.0 603.2619 30000.0 607.2861 10000.0 609.3076 8600.0 610.2779 48000.0 611.2868 300000.0 621.2706 50000.0 625.3009 40000.0 635.2859 39000.0 638.2725 9400.0 649.6039 2600.0 653.296 25000.0 END IONS BEGIN IONS SCANS=713 PEPMASS=424.364 CHARGE=1 COLLISION_ENERGY=0.0 55.7953 2500.0 57.0696 310000.0 59.0486 3200.0 59.8956 2400.0 60.4035 2400.0 60.7397 2400.0 61.3202 2400.0 62.936 2200.0 65.0957 2400.0 65.4826 2300.0 69.0697 18000.0 69.262 2200.0 71.0852 250000.0 71.9534 2100.0 73.0645 37000.0 73.4462 4700.0 74.001 2300.0 75.5493 2200.0 76.2727 2200.0 78.9262 2100.0 80.2393 2100.0 82.3638 2600.0 82.7455 2400.0 83.0849 2900.0 83.2562 2600.0 83.894 2200.0 84.067 2100.0 85.0055 2400.0 85.1008 160000.0 87.0439 25000.0 87.5275 2300.0 87.7186 2200.0 89.0593 1900000.0 89.0652 2300.0 89.7566 2200.0 91.4911 2600.0 92.0531 2400.0 92.2726 2200.0 93.8517 2600.0 97.101 10000.0 100.0339 2500.0 100.8004 2400.0 101.3494 2400.0 104.338 2300.0 105.2651 2100.0 107.0697 5600.0 107.2876 2400.0 108.6317 2700.0 109.5739 2900.0 113.3729 2500.0 113.5195 2300.0 114.6738 2300.0 116.9388 2600.0 117.0906 2500.0 128.0866 2600.0 129.2242 2300.0 129.8001 3000.0 131.4767 2300.0 133.0747 11000.0 133.0856 750000.0 134.2226 2600.0 134.4502 2400.0 134.5662 2600.0 139.4966 2400.0 148.5542 2700.0 149.2584 2200.0 149.6876 5300.0 151.0964 34000.0 162.7305 2400.0 173.5296 160000.0 173.5432 18000.0 177.1121 66000.0 185.1848 2400.0 187.6159 2400.0 193.9125 2700.0 195.1225 39000.0 215.4473 2700.0 222.3839 2500.0 224.7673 2200.0 239.149 64000.0 240.0478 2800.0 273.3854 2200.0 283.7198 2500.0 284.5 2400.0 288.2279 3000.0 306.1639 2600.0 331.0921 2400.0 339.8968 2200.0 343.9305 2200.0 347.4132 2400.0 348.3145 3000.0 356.5352 2300.0 367.9304 2300.0 432.3266 2700.0 END IONS BEGIN IONS SCANS=714 PEPMASS=319.2849 CHARGE=1 COLLISION_ENERGY=0.0 54.1069 2400.0 55.054 2900.0 57.0697 300000.0 62.036 2300.0 63.0374 2300.0 65.1104 2200.0 67.6831 2400.0 67.901 2400.0 68.1747 2300.0 69.0697 5100.0 69.8797 2300.0 71.0853 160000.0 75.4571 2300.0 79.4103 2300.0 79.4347 2400.0 80.0895 2600.0 80.8406 2300.0 81.6891 2400.0 85.1008 76000.0 87.8677 2600.0 88.0759 2200.0 89.0594 340000.0 90.8797 2200.0 92.744 2900.0 94.9806 3100.0 100.7297 2600.0 103.2767 2400.0 108.2675 2400.0 115.3032 2600.0 116.8409 2400.0 122.3748 2300.0 123.4285 2900.0 131.5413 2200.0 133.5394 2200.0 136.0749 2500.0 139.6272 2300.0 172.8231 2200.0 173.5255 100000.0 173.5425 42000.0 174.6275 2600.0 180.2696 2400.0 190.0627 8500.0 191.066 22000.0 194.0894 10000.0 194.4836 2400.0 205.8562 2200.0 207.0612 8600.0 208.2703 2400.0 216.5015 2400.0 220.7884 2300.0 221.0814 24000.0 222.0842 67000.0 244.8355 2400.0 255.5582 2300.0 260.2122 2500.0 270.0915 2500.0 274.8164 2600.0 278.077 2500.0 290.5421 3100.0 308.5375 2400.0 END IONS BEGIN IONS SCANS=715 PEPMASS=625.2663 CHARGE=1 COLLISION_ENERGY=0.0 66.5039 3000.0 66.673 2300.0 67.3116 2200.0 72.1695 2300.0 73.0652 2900.0 73.7209 2300.0 73.7611 2600.0 87.3468 2200.0 89.9528 2100.0 95.3693 2300.0 111.7332 2200.0 121.6679 2200.0 127.2373 2700.0 129.8671 2300.0 148.0946 2200.0 149.6843 5100.0 149.7054 3300.0 161.0788 2500.0 173.5226 9700.0 173.5323 6800.0 173.5412 17000.0 237.4437 2300.0 298.7013 2400.0 405.2082 8900.0 420.1664 5600.0 420.2314 340000.0 421.2391 5100.0 424.2231 10000.0 430.454 2200.0 433.2404 18000.0 434.2475 36000.0 448.2265 47000.0 449.2339 88000.0 451.211 7300.0 452.2213 120000.0 459.219 54000.0 460.2261 150000.0 460.2951 4100.0 461.2374 3300.0 462.2058 42000.0 463.2123 21000.0 465.2289 72000.0 475.2138 140000.0 476.2214 64000.0 477.2291 430000.0 478.2379 3800.0 479.2445 9000.0 487.2146 7300.0 488.218 5100.0 489.229 7800.0 491.2117 8700.0 491.2407 8800.0 492.2522 160000.0 493.2562 36000.0 499.5382 2900.0 501.2288 5300.0 502.2329 8500.0 503.2434 82000.0 504.2476 10000.0 509.2175 11000.0 518.2319 52000.0 520.2147 3200.0 521.2213 230000.0 523.2339 34000.0 524.2351 2500.0 533.2183 29000.0 534.2268 7900.0 535.2344 110000.0 536.2421 150000.0 537.2497 17000.0 538.2569 18000.0 547.2343 37000.0 548.2416 11000.0 549.2505 71000.0 563.2659 20000.0 565.246 43000.0 579.251 3200.0 593.2402 24000.0 607.2534 3400.0 608.2639 45000.0 END IONS BEGIN IONS SCANS=716 PEPMASS=393.279 CHARGE=1 COLLISION_ENERGY=0.0 53.0269 2200.0 55.054 35000.0 55.0569 2100.0 56.8319 2200.0 57.0697 26000.0 61.4269 2200.0 61.7956 2300.0 62.2221 2500.0 65.3934 2300.0 66.176 2400.0 66.3937 2600.0 67.0539 49000.0 67.0575 2200.0 67.4876 2200.0 68.5703 2300.0 69.0695 53000.0 69.4584 2500.0 70.6887 2100.0 71.0354 2300.0 74.881 2400.0 78.0494 2200.0 78.7835 2600.0 79.0497 2300.0 79.0539 61000.0 80.0894 2200.0 81.0696 130000.0 83.0488 10000.0 83.0853 19000.0 84.6558 2300.0 85.0645 5700.0 86.8607 2300.0 88.6689 2400.0 89.0592 3000.0 91.0539 59000.0 93.0639 4100.0 93.0693 200000.0 95.0488 120000.0 95.0852 130000.0 96.1417 2300.0 97.0644 21000.0 103.2822 2200.0 105.063 2500.0 105.0695 160000.0 105.97 2200.0 107.0784 2900.0 107.0851 140000.0 109.0644 34000.0 109.1008 71000.0 115.0544 2900.0 117.0695 35000.0 117.9651 2400.0 119.0769 3500.0 119.0852 220000.0 121.0645 61000.0 121.1008 98000.0 123.0802 6700.0 123.1165 25000.0 128.062 5100.0 129.0694 15000.0 130.0777 7100.0 131.0852 94000.0 131.3699 2300.0 133.1008 140000.0 135.0805 15000.0 135.1164 45000.0 137.0961 2500.0 141.0698 2500.0 142.0773 33000.0 143.0852 76000.0 144.0929 16000.0 145.0656 2700.0 145.1008 190000.0 146.1056 10000.0 147.0802 7500.0 147.1164 56000.0 149.0228 11000.0 149.0951 3600.0 149.1327 2700.0 149.6879 5700.0 150.0262 3400.0 151.0276 4100.0 155.0853 22000.0 156.0927 20000.0 157.1008 120000.0 158.1079 15000.0 159.0805 6900.0 159.1165 130000.0 160.1213 6000.0 161.0957 46000.0 161.1323 19000.0 164.9934 2400.0 167.0854 5500.0 168.0929 6000.0 169.1011 48000.0 170.108 14000.0 171.1167 64000.0 172.1239 11000.0 173.0964 2700.0 173.1325 64000.0 173.5266 27000.0 173.5364 29000.0 175.1479 30000.0 175.4601 2400.0 179.0854 5400.0 181.101 18000.0 182.1084 2800.0 183.1167 43000.0 184.1236 6800.0 185.1325 30000.0 187.1483 16000.0 188.5358 2600.0 193.1012 7300.0 194.1084 3200.0 195.1168 26000.0 196.1239 9400.0 197.1323 43000.0 198.1385 3000.0 199.1475 17000.0 200.154 2700.0 201.1636 3900.0 207.1158 6300.0 209.1324 29000.0 210.1406 3300.0 211.1479 22000.0 213.1635 2900.0 221.1336 3100.0 223.0665 2600.0 223.1473 9800.0 225.1625 2900.0 235.1498 3100.0 237.164 3800.0 240.3939 2400.0 251.1804 2900.0 253.9305 2100.0 290.3325 3100.0 293.6641 2400.0 299.9688 2400.0 322.2513 2500.0 357.6625 2500.0 373.1754 2400.0 389.9727 2500.0 END IONS BEGIN IONS SCANS=717 PEPMASS=669.2923 CHARGE=1 COLLISION_ENERGY=0.0 66.5852 20000.0 67.6957 50000.0 67.6989 10000.0 69.3308 2300.0 69.696 13000.0 69.6995 2700.0 70.6499 2400.0 73.9054 2400.0 96.4643 2100.0 101.8061 2100.0 103.5361 2200.0 105.0739 2400.0 118.0549 2300.0 135.9486 2400.0 147.5027 2700.0 150.1962 2300.0 162.7768 2400.0 169.0732 2400.0 173.5258 56000.0 173.5421 39000.0 181.7703 2600.0 183.2104 2500.0 201.5503 2300.0 225.1379 12000.0 237.1375 2800.0 238.1462 16000.0 239.1543 11000.0 251.1539 18000.0 252.164 2700.0 253.1694 88000.0 261.1386 26000.0 266.7027 2400.0 267.1497 12000.0 275.8778 2900.0 279.1494 48000.0 280.1565 15000.0 287.0628 2700.0 333.1451 3600.0 375.1179 2500.0 411.2188 6000.0 420.1939 3000.0 421.2035 2600.0 422.2038 2400.0 422.2099 6200.0 435.1824 5000.0 438.2087 11000.0 439.2137 8900.0 440.2218 12000.0 442.2416 2800.0 446.1725 2600.0 448.1924 16000.0 449.1966 19000.0 450.2048 24000.0 452.2191 2900.0 458.2415 12000.0 465.1933 36000.0 466.1979 5400.0 475.2009 2500.0 476.1858 38000.0 479.2034 5900.0 480.217 23000.0 481.2228 4500.0 482.2555 2500.0 483.2015 10000.0 483.2774 17000.0 490.2014 3600.0 493.2243 20000.0 494.1882 3200.0 494.2474 3300.0 496.2503 18000.0 497.2215 3100.0 497.2589 2800.0 498.2238 32000.0 503.2074 3200.0 507.2357 2700.0 508.2109 160000.0 509.2209 2900.0 511.2014 6900.0 511.2691 120000.0 512.2829 3000.0 521.2518 59000.0 522.2488 15000.0 523.2666 31000.0 524.2441 33000.0 525.2485 14000.0 526.2223 34000.0 528.2739 44000.0 534.2309 5700.0 535.2327 17000.0 538.2618 11000.0 539.1285 3100.0 539.2651 440000.0 540.2692 7900.0 543.2963 380000.0 549.2493 110000.0 550.2443 27000.0 551.2647 20000.0 552.2358 11000.0 553.2586 31000.0 554.2656 4100.0 555.2967 61000.0 556.271 44000.0 566.2527 27000.0 567.2602 320000.0 571.2901 240000.0 577.2449 110000.0 578.2316 4900.0 580.2258 6400.0 580.2383 9400.0 581.266 270000.0 582.2625 26000.0 583.2898 29000.0 584.2635 68000.0 591.2626 3500.0 594.2414 9100.0 595.2559 120000.0 599.2865 580000.0 600.6401 2900.0 609.2711 1500000.0 610.274 3800.0 612.2597 24000.0 627.282 330000.0 636.2854 3600.0 END IONS BEGIN IONS SCANS=718 PEPMASS=691.2741 CHARGE=1 COLLISION_ENERGY=0.0 67.6961 26000.0 67.6985 7500.0 70.1381 38000.0 70.1414 9400.0 71.8753 2700.0 86.5764 2400.0 100.5314 2300.0 100.9432 2400.0 104.5292 2300.0 109.6252 2100.0 111.4333 2500.0 114.6796 2900.0 117.4379 2200.0 123.9184 2400.0 124.2613 2500.0 124.2836 2300.0 141.2001 2200.0 173.5337 93000.0 197.7307 2900.0 207.4918 2300.0 273.6088 2300.0 278.8765 2400.0 344.0521 2800.0 382.9576 2400.0 397.6734 2500.0 410.5779 2500.0 423.9503 2600.0 439.6412 2700.0 449.1934 5200.0 465.1905 9900.0 472.1856 21000.0 476.1845 11000.0 498.1662 2600.0 499.175 19000.0 508.2103 71000.0 512.1799 2500.0 527.2053 48000.0 530.1928 21000.0 531.2001 31000.0 548.2773 2700.0 549.2491 29000.0 550.2568 4400.0 559.2305 3300.0 572.2218 6500.0 577.2442 25000.0 581.2611 90000.0 599.2265 18000.0 609.2706 870000.0 631.2524 1200000.0 690.1907 2700.0 691.3876 12000.0 END IONS BEGIN IONS SCANS=719 PEPMASS=583.4151 CHARGE=1 COLLISION_ENERGY=0.0 63.3567 2400.0 67.054 32000.0 69.0333 9700.0 69.0695 34000.0 69.4991 2400.0 72.1431 2600.0 73.1348 2200.0 79.001 2200.0 79.0539 33000.0 81.0696 72000.0 83.0489 18000.0 83.0854 21000.0 85.0646 16000.0 91.054 34000.0 93.0697 120000.0 95.0489 21000.0 95.085 110000.0 96.1733 2400.0 97.0648 12000.0 103.0544 4100.0 105.0694 120000.0 105.0771 3200.0 106.991 2500.0 107.0853 120000.0 109.0644 21000.0 109.1009 67000.0 111.0803 9100.0 117.0696 22000.0 119.0854 200000.0 121.0642 10000.0 121.0913 2700.0 121.101 160000.0 121.7801 2400.0 123.0803 42000.0 123.1164 21000.0 125.0595 15000.0 125.0957 11000.0 128.0618 7700.0 129.0699 21000.0 131.0854 80000.0 133.101 120000.0 135.0804 26000.0 135.1167 43000.0 135.4908 2400.0 137.0959 36000.0 139.0752 3000.0 139.1114 7900.0 141.0712 4500.0 142.0777 24000.0 143.0854 83000.0 144.0936 5900.0 145.0889 4200.0 145.1011 160000.0 145.1139 2600.0 147.0802 52000.0 147.1168 56000.0 149.0958 24000.0 149.1326 14000.0 151.0752 78000.0 155.0857 23000.0 156.0934 22000.0 157.088 3800.0 157.1011 180000.0 158.1088 24000.0 159.1169 98000.0 161.096 19000.0 161.1324 34000.0 163.1118 33000.0 165.0756 3100.0 165.091 230000.0 165.1062 5100.0 167.0865 10000.0 167.1067 46000.0 168.0937 8700.0 169.1012 71000.0 170.1092 17000.0 171.1168 120000.0 172.1251 2800.0 173.0966 11000.0 173.1184 3100.0 173.1326 100000.0 173.5257 54000.0 173.5433 23000.0 175.1114 9900.0 175.1481 31000.0 175.8504 2400.0 177.0907 2600.0 177.1273 10000.0 179.0856 16000.0 180.0941 3600.0 181.1013 37000.0 181.1208 14000.0 182.1085 13000.0 183.117 91000.0 184.1246 17000.0 185.1326 91000.0 185.6671 2400.0 186.1388 2600.0 187.1115 8100.0 187.1485 32000.0 189.1278 32000.0 189.1646 2600.0 191.1082 3600.0 191.1431 31000.0 193.1012 25000.0 194.1093 27000.0 195.117 76000.0 196.1245 21000.0 197.1326 85000.0 198.1413 4100.0 199.1113 7900.0 199.1482 70000.0 200.851 2400.0 201.128 6500.0 201.1642 5000.0 203.1433 110000.0 205.1026 2600.0 206.1088 9300.0 207.1168 55000.0 207.1382 34000.0 208.1243 20000.0 209.1327 110000.0 209.1542 4800.0 210.1404 18000.0 211.1124 2600.0 211.1484 52000.0 213.1282 5000.0 213.1646 21000.0 215.1427 13000.0 217.1592 16000.0 218.109 3300.0 219.1175 17000.0 220.125 12000.0 221.1321 47000.0 221.1541 260000.0 222.1402 16000.0 223.1483 59000.0 224.1572 4700.0 225.1274 6700.0 225.1639 22000.0 227.1424 4000.0 227.1804 7400.0 229.1594 5000.0 231.1166 6100.0 231.175 13000.0 232.125 4800.0 233.1325 27000.0 233.155 14000.0 234.1409 8100.0 235.1481 48000.0 235.1707 2400.0 236.1559 9300.0 237.1641 33000.0 239.1445 6900.0 239.1797 20000.0 241.1595 3700.0 243.1158 2700.0 243.175 6100.0 244.124 2800.0 245.1324 21000.0 246.1399 17000.0 247.1481 33000.0 248.1559 13000.0 249.1641 34000.0 250.1709 13000.0 251.1437 2900.0 251.1796 25000.0 253.1599 3300.0 253.195 14000.0 257.1903 16000.0 258.14 3200.0 259.1481 20000.0 260.1559 19000.0 261.1636 42000.0 263.1799 24000.0 265.1658 2800.0 265.1953 28000.0 267.1749 7300.0 268.7911 2600.0 269.1897 17000.0 271.2058 13000.0 273.1635 16000.0 274.1717 6700.0 275.18 39000.0 277.1949 20000.0 279.1739 2700.0 279.2108 11000.0 281.1916 15000.0 281.2955 110000.0 282.2798 360000.0 283.2061 27000.0 283.2829 380000.0 286.1951 7100.0 287.1752 6600.0 287.2065 4500.0 289.1957 19000.0 290.2045 3800.0 291.2111 10000.0 293.1906 3300.0 295.206 25000.0 297.2234 18000.0 297.6292 2600.0 299.2014 3100.0 299.3062 100000.0 300.3095 120000.0 301.1959 11000.0 303.213 3400.0 307.2065 9000.0 314.2045 2600.0 315.2121 8300.0 316.2202 3900.0 317.2284 3400.0 329.2269 6700.0 331.2457 3500.0 333.2256 3500.0 341.229 2800.0 347.238 3600.0 348.2452 3900.0 349.2556 4800.0 352.239 5300.0 357.2585 3800.0 361.2498 4100.0 365.2448 5300.0 375.2689 19000.0 403.3004 36000.0 403.6674 2900.0 470.0737 2600.0 501.7298 2500.0 503.3526 23000.0 509.3402 6800.0 565.4055 22000.0 583.4171 33000.0 END IONS BEGIN IONS SCANS=720 PEPMASS=600.4178 CHARGE=1 COLLISION_ENERGY=0.0 65.019 4300.0 67.0541 120000.0 69.0334 130000.0 69.0698 110000.0 69.876 3200.0 70.6781 4600.0 71.0492 30000.0 71.1022 7400.0 72.4972 3600.0 77.0388 4400.0 77.6639 5200.0 79.0542 160000.0 81.0698 370000.0 83.049 190000.0 83.0854 130000.0 85.0646 81000.0 87.044 26000.0 89.0596 130000.0 91.0542 160000.0 92.0623 4400.0 93.063 8100.0 93.0698 640000.0 94.0777 6100.0 95.0491 240000.0 95.0854 490000.0 97.0647 150000.0 97.1011 11000.0 98.0677 5400.0 99.0804 11000.0 100.17 5700.0 103.0535 3500.0 103.3443 6500.0 105.0455 6600.0 105.0698 580000.0 106.0777 19000.0 107.0492 39000.0 107.0772 21000.0 107.0854 750000.0 107.0922 4800.0 108.089 7700.0 109.0647 240000.0 109.1011 320000.0 111.0438 25000.0 111.0804 110000.0 113.0962 46000.0 115.0542 4600.0 117.0697 85000.0 118.0767 6600.0 119.049 6300.0 119.0757 8500.0 119.0854 870000.0 120.0931 68000.0 120.7783 5300.0 121.0647 140000.0 121.091 16000.0 121.101 860000.0 121.1085 5800.0 122.0722 19000.0 122.1042 16000.0 123.0432 5800.0 123.0803 480000.0 123.1166 110000.0 123.1254 3700.0 125.0595 140000.0 125.096 190000.0 128.0623 40000.0 129.0697 110000.0 130.0777 25000.0 131.0854 370000.0 132.093 74000.0 133.0648 120000.0 133.0854 12000.0 133.0865 61000.0 133.1011 700000.0 133.1126 5900.0 134.1089 38000.0 134.6141 6000.0 135.07 11000.0 135.0803 380000.0 135.1167 330000.0 136.0885 21000.0 137.0596 62000.0 137.096 250000.0 138.1014 8200.0 139.0752 90000.0 139.1116 66000.0 141.0702 14000.0 142.0778 79000.0 143.0854 510000.0 144.0931 200000.0 145.0649 36000.0 145.1011 910000.0 145.1143 9500.0 146.0722 7400.0 146.1082 72000.0 147.0803 520000.0 147.1167 280000.0 148.0879 40000.0 149.096 310000.0 149.1322 54000.0 150.1036 29000.0 151.0753 480000.0 151.089 9200.0 151.1117 66000.0 152.0817 32000.0 153.07 7700.0 153.091 69000.0 155.0853 110000.0 155.1065 23000.0 156.0931 120000.0 157.0647 5800.0 157.0861 26000.0 157.1011 1200000.0 157.1147 16000.0 158.1086 200000.0 159.0803 220000.0 159.1168 750000.0 160.0878 120000.0 160.1232 44000.0 161.0961 510000.0 161.1325 210000.0 162.1034 55000.0 163.0756 33000.0 163.1117 530000.0 163.1471 9300.0 164.1182 20000.0 165.0911 1400000.0 165.1248 7400.0 166.095 37000.0 167.0709 7100.0 167.0864 6100.0 167.0865 36000.0 167.1067 340000.0 168.0933 12000.0 168.1095 16000.0 169.1013 310000.0 170.1087 140000.0 171.0809 62000.0 171.1001 13000.0 171.1169 720000.0 171.1305 6400.0 172.0886 27000.0 172.1243 230000.0 173.0963 230000.0 173.1326 400000.0 173.5211 14000.0 173.5308 170000.0 173.5417 51000.0 174.1035 35000.0 174.1386 28000.0 175.1119 460000.0 175.1483 150000.0 176.1194 26000.0 177.0909 97000.0 177.1276 150000.0 178.0986 44000.0 179.0865 47000.0 179.1066 160000.0 179.1228 8600.0 179.143 19000.0 180.0951 23000.0 180.1142 93000.0 181.0851 46000.0 181.1014 150000.0 181.1223 190000.0 182.109 70000.0 183.1168 430000.0 184.1239 110000.0 185.0959 89000.0 185.1326 610000.0 185.1515 8400.0 186.1038 39000.0 186.1401 86000.0 187.1117 210000.0 187.1483 160000.0 188.1197 42000.0 189.0915 7100.0 189.1275 350000.0 190.1351 300000.0 191.1066 110000.0 191.1431 140000.0 193.1011 96000.0 193.1223 280000.0 194.1091 55000.0 195.1168 370000.0 195.1378 65000.0 196.1242 93000.0 197.0965 72000.0 197.1154 18000.0 197.1326 460000.0 198.104 43000.0 198.1392 81000.0 199.1119 180000.0 199.1482 230000.0 200.1193 34000.0 200.1546 39000.0 201.1275 210000.0 201.1637 47000.0 202.1337 15000.0 203.1094 20000.0 203.1261 6400.0 203.1431 930000.0 204.1483 23000.0 205.1022 19000.0 205.1224 72000.0 205.1599 3900.0 206.1094 41000.0 207.1167 220000.0 207.1382 420000.0 208.1239 95000.0 208.1454 110000.0 209.0969 27000.0 209.1325 410000.0 209.154 74000.0 210.104 13000.0 210.1395 110000.0 211.112 130000.0 211.1484 340000.0 212.1196 61000.0 212.1547 43000.0 213.1275 240000.0 213.1638 96000.0 214.1352 41000.0 215.1068 70000.0 215.1431 140000.0 216.1505 59000.0 217.1224 63000.0 217.159 59000.0 218.1297 14000.0 219.1164 53000.0 219.1382 200000.0 220.1244 45000.0 220.1468 10000.0 221.1322 190000.0 221.1537 1500000.0 222.1394 62000.0 222.1597 41000.0 223.1116 59000.0 223.1483 290000.0 224.1192 20000.0 224.1551 52000.0 225.1274 170000.0 225.164 230000.0 226.1338 22000.0 226.1695 19000.0 227.1434 130000.0 227.1793 55000.0 228.1497 9800.0 229.1221 74000.0 229.1589 120000.0 230.1307 41000.0 231.1161 9500.0 231.1383 77000.0 231.1746 22000.0 232.1235 7800.0 232.1469 18000.0 233.1318 82000.0 233.1539 600000.0 234.1394 25000.0 234.1604 200000.0 235.148 240000.0 235.1712 21000.0 236.1558 53000.0 237.1256 69000.0 237.1489 350000.0 237.1649 20000.0 238.1347 21000.0 238.1708 30000.0 239.1431 110000.0 239.179 99000.0 240.1498 22000.0 241.1241 25000.0 241.1588 130000.0 241.1902 5800.0 242.1654 7200.0 243.1384 64000.0 243.1744 42000.0 245.1307 43000.0 245.1558 43000.0 246.1388 51000.0 246.1631 35000.0 247.1461 88000.0 247.1699 200000.0 248.1393 23000.0 248.1541 14000.0 249.1309 34000.0 249.1635 190000.0 250.1576 14000.0 251.1435 83000.0 251.1788 110000.0 252.1502 15000.0 253.1588 180000.0 253.1938 40000.0 254.1642 9900.0 255.1437 11000.0 255.174 500000.0 255.2029 5400.0 256.1825 15000.0 257.1542 47000.0 257.1887 39000.0 259.1437 44000.0 259.1695 110000.0 260.1541 31000.0 261.1632 230000.0 261.1876 23000.0 262.1686 18000.0 263.1435 35000.0 263.1789 130000.0 264.1842 22000.0 265.1587 79000.0 265.1957 68000.0 266.1643 8100.0 266.1995 5300.0 266.7908 7800.0 267.141 10000.0 267.1745 98000.0 268.1823 60000.0 269.1559 41000.0 269.1899 120000.0 270.1973 45000.0 271.1692 210000.0 271.2014 10000.0 272.177 8600.0 273.1581 40000.0 273.1849 100000.0 274.1927 140000.0 275.1445 3600.0 275.1795 66000.0 276.1872 33000.0 277.1594 45000.0 277.1951 88000.0 277.226 9500.0 279.1745 210000.0 279.2079 9300.0 281.1568 32000.0 281.1905 180000.0 282.1952 28000.0 283.171 35000.0 283.2051 40000.0 285.1851 190000.0 286.1927 320000.0 287.2005 240000.0 289.1591 6200.0 289.1945 86000.0 290.2007 13000.0 291.1749 57000.0 291.2109 64000.0 293.1541 7300.0 293.1911 50000.0 294.1972 80000.0 295.1707 36000.0 295.2059 190000.0 296.1765 7800.0 297.1847 190000.0 298.1927 29000.0 299.2004 240000.0 300.2094 21000.0 301.1927 41000.0 303.1957 720000.0 305.1884 25000.0 305.2252 4900.0 307.2057 79000.0 309.1847 81000.0 309.2211 52000.0 310.1934 68000.0 311.2005 92000.0 312.2081 97000.0 313.2156 170000.0 315.2095 18000.0 317.2257 16000.0 319.206 120000.0 321.222 21000.0 322.2288 39000.0 323.2003 28000.0 325.2157 180000.0 327.2091 10000.0 329.2252 11000.0 331.2052 27000.0 333.2216 39000.0 334.2284 11000.0 335.1994 7000.0 335.2398 9700.0 337.216 360000.0 339.2305 18000.0 341.2277 33000.0 345.2212 26000.0 347.2374 67000.0 349.2147 20000.0 350.22 12000.0 351.2311 48000.0 352.1899 16000.0 352.2393 950000.0 353.2412 17000.0 353.2484 3800.0 359.2365 44000.0 361.2547 13000.0 363.2307 34000.0 364.2393 8100.0 365.2467 440000.0 369.2591 7100.0 373.2536 20000.0 377.2473 89000.0 378.2545 17000.0 379.2667 7900.0 381.2418 18000.0 383.2612 9100.0 387.2673 24000.0 389.2424 6900.0 391.2631 28000.0 397.2732 5000.0 401.2707 8800.0 403.2595 7000.0 405.2782 33000.0 417.2824 6500.0 419.2931 36000.0 420.3021 15000.0 421.2768 6000.0 437.3038 17000.0 439.283 7500.0 469.3082 42000.0 487.3192 210000.0 489.3374 16000.0 493.3241 7000.0 502.344 25000.0 503.351 250000.0 505.3299 160000.0 507.3478 51000.0 508.3491 35000.0 520.3536 82000.0 522.8188 5800.0 562.3765 5500.0 567.3828 13000.0 585.392 39000.0 598.6126 3600.0 600.411 22000.0 END IONS BEGIN IONS SCANS=721 PEPMASS=280.2641 CHARGE=1 COLLISION_ENERGY=0.0 49.0739 2200.0 50.7193 2200.0 51.8721 2300.0 53.0386 110000.0 55.0179 68000.0 55.0542 260000.0 56.0495 6900.0 57.0337 3300.0 57.0634 2900.0 57.0699 590000.0 57.0724 8300.0 58.0652 9000.0 60.0444 2700.0 66.8537 2600.0 67.0541 190000.0 67.0585 5100.0 68.062 7600.0 69.0336 7500.0 69.0698 390000.0 69.0733 3800.0 69.0745 2500.0 70.0651 17000.0 71.0855 29000.0 72.0444 37000.0 72.0807 24000.0 73.0649 3300.0 74.0964 42000.0 79.0542 60000.0 81.0334 320000.0 81.038 4000.0 81.0698 260000.0 81.0743 2900.0 81.0756 3200.0 82.0651 7100.0 83.0491 44000.0 83.0854 190000.0 83.0903 3100.0 84.0444 60000.0 84.0807 15000.0 85.1012 8100.0 86.06 12000.0 86.0967 3900.0 87.7143 2200.0 91.0541 30000.0 93.0699 46000.0 94.0653 6200.0 95.0492 130000.0 95.0854 230000.0 95.6156 2400.0 96.0809 3500.0 96.5904 2500.0 97.0646 18000.0 97.0942 2900.0 97.1012 79000.0 98.06 140000.0 98.0961 3400.0 100.0757 9300.0 100.1122 3000.0 101.0961 4600.0 105.07 28000.0 107.0855 36000.0 108.0806 5600.0 109.0648 50000.0 109.1012 120000.0 111.0806 4900.0 111.1171 9100.0 112.0757 61000.0 112.1119 6200.0 114.0918 3400.0 119.0856 33000.0 121.1011 15000.0 123.0804 24000.0 123.1168 40000.0 125.0961 5600.0 126.0914 48000.0 128.107 18000.0 128.1162 2300.0 133.1013 29000.0 135.1167 4900.0 136.7315 2300.0 137.0962 15000.0 137.1327 4900.0 139.1117 3600.0 140.1071 30000.0 140.1439 3100.0 142.1229 6700.0 142.1584 2600.0 147.1169 11000.0 149.0237 9400.0 149.8577 2700.0 150.027 8600.0 151.1121 4900.0 152.1078 3200.0 154.1228 60000.0 156.1378 3900.0 156.1747 27000.0 161.1768 2300.0 163.1478 3700.0 165.1277 3900.0 165.1643 8800.0 167.1303 5900.0 168.1385 27000.0 173.5283 54000.0 173.5459 9400.0 179.18 4900.0 182.1543 15000.0 189.1635 7100.0 196.17 6300.0 206.1906 9200.0 207.1754 19000.0 212.2376 7500.0 219.0575 20000.0 220.0606 38000.0 224.2012 130000.0 238.2545 4200.0 252.271 2600.0 280.0972 42000.0 280.2639 340000.0 280.3002 5700.0 END IONS BEGIN IONS SCANS=722 PEPMASS=772.4765 CHARGE=1 COLLISION_ENERGY=0.0 73.6295 2400.0 78.5708 2600.0 79.0539 20000.0 81.0696 150000.0 82.4153 2400.0 83.0488 10000.0 83.0852 34000.0 83.0898 2600.0 83.1949 2000.0 85.0645 2400.0 85.2318 2500.0 86.0962 42000.0 89.5505 2400.0 91.0539 3600.0 92.4673 2800.0 93.0696 37000.0 95.0793 3300.0 95.0852 120000.0 97.0646 10000.0 97.1009 15000.0 98.7095 2900.0 101.0957 3600.0 105.0699 10000.0 107.0853 38000.0 108.1426 2800.0 109.0645 8300.0 109.1008 74000.0 111.0437 200000.0 111.08 6800.0 111.1168 2700.0 113.0594 4200.0 119.0852 27000.0 121.1008 62000.0 123.0806 8200.0 123.1165 58000.0 124.9997 11000.0 125.0595 45000.0 131.0856 7200.0 133.1009 53000.0 135.0805 16000.0 135.1166 88000.0 136.8667 2400.0 137.0594 1000000.0 137.0734 16000.0 137.096 3100.0 137.1321 65000.0 139.075 3300.0 143.0854 2400.0 145.1008 5400.0 147.1165 94000.0 149.0958 61000.0 149.1321 40000.0 151.0749 19000.0 151.1118 8300.0 151.148 2500.0 157.1015 5100.0 157.3416 2400.0 159.1166 7100.0 160.3781 2800.0 161.0959 66000.0 161.1323 47000.0 163.1115 49000.0 163.148 24000.0 165.0909 45000.0 165.1273 3600.0 167.107 19000.0 171.1168 6300.0 173.1329 3200.0 173.5209 29000.0 173.5369 160000.0 175.1116 72000.0 175.1482 31000.0 177.0903 7100.0 177.1276 10000.0 179.1065 63000.0 181.1222 19000.0 184.0544 5200.0 184.0732 520000.0 184.0881 2800.0 185.1335 2300.0 189.1273 21000.0 189.1633 6800.0 193.1223 49000.0 195.14 2800.0 197.132 2800.0 203.1462 3400.0 203.1794 200000.0 205.1952 34000.0 207.1377 6700.0 213.1299 5600.0 213.1637 75000.0 221.1902 74000.0 223.1479 22000.0 231.1743 390000.0 231.1942 2800.0 234.5591 3000.0 238.3631 3300.0 241.159 48000.0 245.2235 3200.0 249.1848 420000.0 259.1677 4700.0 263.2373 25000.0 277.1802 1600000.0 280.2178 2500.0 282.3394 2500.0 288.8931 2600.0 295.1907 180000.0 302.2141 3500.0 306.2796 37000.0 320.1806 2500.0 320.2225 150000.0 337.274 210000.0 338.2307 6200.0 346.9124 2400.0 351.2167 100000.0 395.4741 2600.0 401.5396 2600.0 402.6352 2800.0 470.1282 2600.0 508.1571 2500.0 520.8134 2800.0 527.717 2200.0 593.2844 2500.0 612.5421 2500.0 613.4466 210000.0 629.6804 3400.0 656.4883 4100.0 753.8434 2700.0 767.0106 2600.0 END IONS BEGIN IONS SCANS=723 PEPMASS=613.2663 CHARGE=1 COLLISION_ENERGY=0.0 67.0541 9100.0 81.0697 16000.0 83.0853 3000.0 93.0699 7400.0 95.0852 13000.0 105.07 2700.0 107.0852 7300.0 109.101 11000.0 111.2536 2400.0 119.0857 5700.0 121.101 9300.0 121.5874 2500.0 123.1167 2400.0 126.2126 2300.0 126.2297 2700.0 131.0855 3100.0 133.1012 8900.0 135.1168 8100.0 161.1324 7200.0 164.0391 2600.0 173.5231 27000.0 173.5373 61000.0 175.1488 2900.0 187.1487 3000.0 187.8981 2700.0 189.1643 3300.0 210.3876 2600.0 218.0825 3200.0 219.6296 2900.0 237.4446 2500.0 261.2219 2900.0 289.3985 2200.0 304.7243 2600.0 305.2454 2500.0 318.16 15000.0 326.3276 2400.0 330.3634 3200.0 335.2598 3200.0 353.3979 2300.0 384.876 2800.0 404.0742 2700.0 409.2026 9100.0 411.2197 9900.0 412.2282 11000.0 423.2187 23000.0 424.2261 40000.0 425.1981 46000.0 437.2339 24000.0 439.2138 54000.0 440.2214 100000.0 449.2266 3100.0 451.2513 2500.0 453.2289 26000.0 454.2358 17000.0 456.2124 8000.0 467.2462 13000.0 469.224 19000.0 481.2234 24000.0 482.2337 13000.0 483.2377 100000.0 484.2469 82000.0 494.2275 4500.0 495.2387 41000.0 496.2464 48000.0 497.2212 56000.0 498.2293 25000.0 509.2532 25000.0 510.2446 16000.0 511.2333 40000.0 512.2424 89000.0 526.2531 15000.0 527.2651 310000.0 527.3356 2300.0 537.2491 48000.0 542.2169 15000.0 543.2596 20000.0 554.2533 3500.0 555.2237 2900.0 569.276 140000.0 570.2478 270000.0 571.1747 5200.0 571.2554 1300000.0 572.261 3900.0 585.2696 17000.0 613.2662 27000.0 613.4761 5000.0 END IONS BEGIN IONS SCANS=724 PEPMASS=429.3732 CHARGE=1 COLLISION_ENERGY=0.0 55.054 18000.0 56.9776 2700.0 57.0696 280000.0 57.7199 2500.0 57.9822 2300.0 58.2166 2100.0 59.166 2700.0 60.0086 2200.0 61.7031 2500.0 63.0868 2300.0 63.7733 2100.0 64.5739 2200.0 66.189 2200.0 66.9556 2300.0 67.0541 24000.0 68.5734 2400.0 69.0244 2300.0 69.0695 70000.0 69.474 2500.0 69.6397 2300.0 71.0852 220000.0 72.7274 2100.0 73.5622 2200.0 73.85 2500.0 75.886 2500.0 76.2575 2900.0 77.4349 2300.0 78.5784 2500.0 80.7051 2100.0 80.7339 2500.0 81.0696 100000.0 81.3096 2500.0 81.8294 2300.0 83.0853 57000.0 84.3015 2500.0 84.6298 2300.0 84.9105 2100.0 85.1009 120000.0 91.3622 2100.0 93.0694 2300.0 94.2575 2100.0 95.0851 110000.0 97.1009 39000.0 99.7175 2200.0 100.392 2300.0 102.6119 2500.0 104.2407 2500.0 104.8397 2300.0 106.1606 2700.0 107.5243 2300.0 108.9211 2400.0 109.101 64000.0 111.0042 2400.0 111.1165 8500.0 119.2663 2400.0 121.0649 2700.0 121.1006 3100.0 123.1167 16000.0 125.6844 2600.0 126.7167 2700.0 131.5797 2500.0 131.753 2700.0 133.5743 2400.0 135.0801 22000.0 135.1165 11000.0 137.0599 2500.0 137.0958 46000.0 137.1323 7100.0 137.8811 2800.0 137.9741 2400.0 139.0751 42000.0 145.1015 3300.0 148.1783 2400.0 148.3443 2400.0 149.0959 190000.0 149.6812 3600.0 149.6919 4900.0 151.0753 2500.0 152.1655 2400.0 152.9917 2400.0 159.1168 29000.0 161.0964 3500.0 163.0748 5600.0 163.1117 330000.0 165.091 1900000.0 171.1159 2400.0 173.0961 13000.0 173.1329 38000.0 173.521 4500.0 173.5297 130000.0 173.5417 74000.0 175.1118 120000.0 177.091 250000.0 177.1072 7200.0 177.1276 47000.0 179.1066 36000.0 181.4649 2900.0 184.1444 2800.0 187.1117 59000.0 187.1487 5500.0 189.1274 56000.0 190.0984 3000.0 191.1067 270000.0 191.1449 2700.0 193.1755 2600.0 195.5267 2300.0 195.7909 2300.0 201.1277 72000.0 201.6438 2500.0 203.1071 2800.0 203.1433 15000.0 205.1226 250000.0 205.4408 2400.0 207.8233 2400.0 215.1435 37000.0 217.7231 2700.0 219.1383 130000.0 229.1597 5400.0 232.3619 2200.0 233.1539 59000.0 247.1697 27000.0 253.7988 2800.0 255.0557 2400.0 258.1124 2200.0 261.1851 10000.0 264.1908 2400.0 275.2007 11000.0 283.4357 2400.0 288.105 2800.0 289.2185 2500.0 297.0427 2600.0 297.954 2700.0 303.2324 3400.0 308.8483 2800.0 315.1501 2300.0 346.5037 2300.0 350.9571 2300.0 353.3543 2500.0 353.4807 3000.0 359.2973 2500.0 376.7278 2400.0 390.7038 3200.0 394.1142 2700.0 394.8616 2500.0 401.0728 2400.0 401.341 4000.0 426.685 2700.0 429.3204 190000.0 429.3769 32000.0 433.147 2600.0 END IONS BEGIN IONS SCANS=725 PEPMASS=600.4179 CHARGE=1 COLLISION_ENERGY=0.0 65.0516 2600.0 67.0541 27000.0 68.0335 2400.0 69.0334 24000.0 69.0697 30000.0 69.905 2400.0 71.0488 2600.0 73.0285 2700.0 73.7771 3100.0 74.7737 2800.0 76.4162 2200.0 78.15 2300.0 79.0542 37000.0 81.0698 88000.0 82.363 2200.0 83.049 49000.0 83.0854 22000.0 84.8273 2300.0 85.0646 17000.0 87.0437 8900.0 89.0596 130000.0 90.5192 2400.0 91.0541 36000.0 92.0628 2400.0 93.0697 150000.0 95.049 63000.0 95.0854 110000.0 96.1084 2200.0 97.0649 41000.0 100.955 2300.0 102.9296 2300.0 105.0698 130000.0 106.078 7400.0 107.0491 2700.0 107.0773 3500.0 107.0854 170000.0 107.0934 4700.0 109.0647 59000.0 109.1011 74000.0 111.0804 19000.0 113.0962 7700.0 117.07 27000.0 117.0915 2300.0 119.0497 2900.0 119.0854 210000.0 120.0935 7700.0 121.0648 29000.0 121.1011 220000.0 121.1104 6100.0 123.0804 100000.0 123.1166 24000.0 125.0597 60000.0 125.0959 35000.0 129.0698 21000.0 129.0967 2300.0 130.0774 5000.0 130.8648 2200.0 131.0854 91000.0 132.0931 12000.0 133.0648 21000.0 133.0859 64000.0 133.1011 160000.0 134.073 3700.0 134.1085 6200.0 135.0804 83000.0 135.1168 70000.0 136.0864 3200.0 137.0596 15000.0 137.096 60000.0 139.0754 35000.0 139.1114 22000.0 141.0706 2800.0 142.0777 18000.0 143.0854 120000.0 144.0931 49000.0 145.0654 7000.0 145.1011 250000.0 146.1089 11000.0 146.2811 2600.0 147.0803 120000.0 147.1167 73000.0 148.0876 8400.0 149.096 71000.0 149.1318 5300.0 150.1037 3100.0 151.0753 110000.0 151.1113 13000.0 153.091 19000.0 153.1286 4000.0 155.0853 23000.0 155.1061 3700.0 156.0933 20000.0 157.1011 290000.0 157.1127 2300.0 158.1084 40000.0 159.0806 53000.0 159.1167 170000.0 160.0882 22000.0 160.1247 3400.0 161.096 120000.0 161.1325 56000.0 162.1036 5700.0 163.0753 3700.0 163.1117 140000.0 165.091 380000.0 165.1255 2700.0 166.0944 5800.0 167.0886 8400.0 167.1067 73000.0 168.093 4300.0 169.1013 74000.0 170.1092 32000.0 171.0808 14000.0 171.1169 170000.0 172.0882 3400.0 172.1244 43000.0 173.0961 56000.0 173.1168 2300.0 173.1326 95000.0 173.5241 34000.0 173.5331 50000.0 173.5439 23000.0 174.1042 3600.0 175.1118 110000.0 175.1482 36000.0 176.1203 30000.0 177.0908 16000.0 177.1114 4300.0 177.1276 32000.0 178.0994 15000.0 179.0876 6100.0 179.1066 38000.0 180.1145 18000.0 181.0854 9100.0 181.1017 40000.0 181.1225 62000.0 182.109 6800.0 183.117 99000.0 184.124 25000.0 185.0961 20000.0 185.1327 140000.0 186.1044 8800.0 186.1402 15000.0 187.1118 47000.0 187.1481 35000.0 188.1205 7400.0 189.1276 83000.0 190.1352 71000.0 191.1064 30000.0 191.1431 39000.0 193.1015 23000.0 193.1225 57000.0 194.1087 13000.0 195.1169 100000.0 195.1375 21000.0 196.1246 22000.0 197.0967 13000.0 197.1152 6200.0 197.1326 110000.0 198.1034 9100.0 198.1394 15000.0 199.1118 45000.0 199.1485 58000.0 200.1177 5000.0 200.1533 3700.0 201.1273 50000.0 203.1094 4000.0 203.1432 220000.0 203.1646 10000.0 205.1225 15000.0 205.1569 2700.0 207.1167 55000.0 207.1383 120000.0 207.817 2800.0 208.1249 18000.0 208.1453 15000.0 209.1325 96000.0 209.1538 18000.0 210.14 20000.0 211.1119 32000.0 211.1482 64000.0 212.12 10000.0 212.1568 4200.0 213.1279 61000.0 213.1645 22000.0 214.1358 4500.0 215.1064 9400.0 215.1434 37000.0 216.1515 10000.0 217.1229 12000.0 217.1588 13000.0 218.1316 3600.0 218.1674 3300.0 219.1169 16000.0 219.1381 51000.0 221.1322 50000.0 221.1539 370000.0 222.1382 4100.0 222.1599 3000.0 223.1115 10000.0 223.1483 72000.0 225.1273 47000.0 225.1639 51000.0 226.1351 3600.0 227.1439 36000.0 227.1795 4600.0 229.1228 11000.0 229.1589 21000.0 230.1302 11000.0 231.1386 15000.0 232.1227 4000.0 233.1318 28000.0 233.1539 130000.0 234.1375 5200.0 234.1614 49000.0 235.1479 48000.0 235.1702 10000.0 236.1556 9600.0 237.1256 15000.0 237.1491 91000.0 239.1429 26000.0 239.1798 14000.0 241.1588 26000.0 243.1373 8500.0 243.1754 5500.0 245.1311 8100.0 245.1552 5200.0 246.1384 8900.0 247.1464 24000.0 247.1697 53000.0 248.1547 5000.0 249.1637 50000.0 251.1431 29000.0 251.1791 27000.0 253.1586 50000.0 253.1871 3700.0 255.142 10000.0 255.1742 110000.0 257.1537 16000.0 257.1891 12000.0 259.1441 11000.0 259.1701 24000.0 261.1631 51000.0 262.1695 8500.0 263.1422 5800.0 263.1785 32000.0 264.1865 2500.0 264.5416 2500.0 265.1584 14000.0 265.1933 16000.0 267.1743 25000.0 268.1829 9500.0 268.3292 2700.0 269.1563 10000.0 269.1895 28000.0 270.1946 3800.0 271.1698 55000.0 273.1583 7900.0 273.1868 24000.0 274.1931 26000.0 275.1781 13000.0 277.1609 2700.0 277.1955 17000.0 279.1746 53000.0 279.2675 2500.0 281.1902 50000.0 282.1963 7200.0 283.1709 7000.0 283.2053 4200.0 285.1853 40000.0 286.1927 99000.0 287.2004 40000.0 289.1948 18000.0 291.1761 12000.0 291.2091 11000.0 293.1897 9700.0 294.1984 13000.0 295.1716 4200.0 295.206 34000.0 297.185 42000.0 298.1933 4900.0 299.2006 50000.0 301.1922 5500.0 303.1958 120000.0 305.1906 3700.0 307.2057 17000.0 309.1846 26000.0 309.2205 10000.0 310.1925 19000.0 311.2003 30000.0 312.2083 23000.0 313.2169 39000.0 314.1985 2800.0 315.2099 4000.0 319.205 22000.0 322.2294 4900.0 323.1996 8000.0 325.2162 100000.0 333.2214 9800.0 337.2162 73000.0 339.2339 4500.0 341.2296 4400.0 347.2366 18000.0 349.2188 3000.0 351.2308 10000.0 352.2395 170000.0 353.246 5700.0 359.2358 11000.0 363.2317 4500.0 365.2473 180000.0 373.252 2500.0 377.2481 17000.0 378.2537 3300.0 387.2702 11000.0 391.2659 4600.0 391.465 3600.0 401.2816 3200.0 405.2813 3300.0 419.2953 3800.0 421.2725 3600.0 437.2997 3500.0 487.3197 36000.0 489.335 3600.0 502.3433 4000.0 503.3517 49000.0 505.331 27000.0 507.3461 38000.0 520.3536 15000.0 524.4359 2800.0 524.5599 2700.0 567.3817 5400.0 585.3911 7800.0 600.2161 2500.0 602.913 2800.0 END IONS BEGIN IONS SCANS=726 PEPMASS=669.2923 CHARGE=1 COLLISION_ENERGY=0.0 66.5855 3700.0 66.5888 3000.0 67.0326 2400.0 75.6804 2500.0 79.0838 2200.0 82.3261 2500.0 84.0345 2200.0 85.5446 2100.0 88.5288 2200.0 103.5557 2500.0 134.8097 3400.0 173.5243 53000.0 173.5432 33000.0 220.7018 2700.0 222.1268 3400.0 223.137 3100.0 224.1314 4100.0 226.1467 5900.0 237.1388 3200.0 239.1539 32000.0 240.1622 5900.0 253.132 5000.0 265.1333 13000.0 267.1497 21000.0 313.1194 9600.0 356.8283 2800.0 378.1671 2500.0 403.1657 2800.0 405.2858 2600.0 406.1788 8800.0 418.2455 3000.0 420.1956 19000.0 421.2008 18000.0 438.2039 4800.0 439.2117 13000.0 444.2286 37000.0 445.2357 4800.0 446.2442 2900.0 463.1884 17000.0 475.2139 17000.0 479.2079 8200.0 493.2248 29000.0 503.2046 5300.0 504.2275 8500.0 511.267 33000.0 521.2531 130000.0 522.24 23000.0 524.2443 29000.0 532.2221 17000.0 535.2336 33000.0 538.2638 3300.0 539.0739 4000.0 539.2655 2000000.0 546.5566 2500.0 549.2501 160000.0 550.2355 28000.0 552.2366 16000.0 563.2627 4300.0 564.2499 82000.0 566.2506 13000.0 567.2607 540000.0 574.2343 12000.0 576.2745 5600.0 581.2762 300000.0 584.2617 9500.0 591.2604 21000.0 592.248 3100.0 599.2868 260000.0 606.263 2800.0 609.2704 26000.0 623.2871 20000.0 626.2729 19000.0 636.2927 13000.0 641.2983 12000.0 651.2816 6100.0 END IONS BEGIN IONS SCANS=727 PEPMASS=600.4172 CHARGE=1 COLLISION_ENERGY=0.0 63.7358 2300.0 64.0582 2400.0 67.054 40000.0 67.3874 2400.0 69.0334 37000.0 69.0697 45000.0 71.0491 6300.0 73.0897 2300.0 76.0396 2600.0 78.9513 2100.0 79.0541 55000.0 80.1129 2200.0 81.0697 140000.0 83.0489 59000.0 83.0853 37000.0 85.0647 27000.0 87.0438 19000.0 88.9352 2100.0 89.0594 170000.0 89.6751 2100.0 91.0541 59000.0 93.0697 230000.0 95.049 83000.0 95.0853 170000.0 97.0646 63000.0 105.0697 210000.0 106.0779 2400.0 107.0495 5100.0 107.0853 250000.0 109.0646 78000.0 109.1009 120000.0 111.044 6000.0 111.0803 45000.0 113.0959 13000.0 117.0699 30000.0 117.0906 2500.0 119.0489 3000.0 119.0853 310000.0 119.7189 2500.0 120.0932 14000.0 121.0646 42000.0 121.1009 310000.0 121.2566 2200.0 122.1044 6200.0 123.0802 140000.0 123.1165 31000.0 125.0595 42000.0 125.0959 58000.0 129.0697 29000.0 131.0854 130000.0 132.0932 13000.0 132.7888 2400.0 133.0645 37000.0 133.0858 85000.0 133.101 250000.0 134.1076 6300.0 134.3022 2700.0 134.8381 2600.0 135.0803 120000.0 135.1167 100000.0 137.0597 16000.0 137.0958 86000.0 139.0751 33000.0 139.1112 20000.0 141.0703 7100.0 142.0779 19000.0 143.0853 170000.0 144.0931 59000.0 145.064 3100.0 145.101 310000.0 145.8097 2200.0 146.1072 13000.0 147.0802 160000.0 147.1165 100000.0 148.0873 13000.0 149.0959 100000.0 149.1328 13000.0 150.1037 3600.0 151.0751 130000.0 151.1112 17000.0 152.0811 2600.0 153.0908 21000.0 155.0853 37000.0 155.1068 11000.0 156.0931 38000.0 157.1009 370000.0 157.1163 2800.0 158.1085 51000.0 159.0803 66000.0 159.1167 230000.0 160.0878 45000.0 160.1224 5000.0 161.0959 140000.0 161.1324 73000.0 162.1036 7600.0 163.0752 7000.0 163.1115 140000.0 165.0909 440000.0 166.0943 27000.0 167.0853 2800.0 167.089 9200.0 167.1066 110000.0 168.094 5600.0 168.1099 2400.0 169.1012 110000.0 170.1081 36000.0 171.0798 12000.0 171.1168 240000.0 172.0881 7100.0 172.1243 72000.0 173.0962 69000.0 173.1324 140000.0 173.5238 64000.0 173.5424 73000.0 174.1032 3500.0 174.1382 7800.0 175.1118 130000.0 175.148 52000.0 176.1192 3100.0 177.091 25000.0 177.1111 11000.0 177.1274 41000.0 178.0992 13000.0 179.0882 5500.0 179.1066 48000.0 179.1429 6600.0 180.0946 3000.0 180.1146 24000.0 181.0857 14000.0 181.1014 55000.0 181.1222 60000.0 182.1088 19000.0 183.1167 150000.0 184.124 38000.0 185.096 26000.0 185.1324 190000.0 186.1051 2500.0 186.1394 23000.0 187.1115 69000.0 187.148 55000.0 188.1191 11000.0 189.1273 100000.0 190.1348 85000.0 191.1062 28000.0 191.1427 50000.0 193.1011 33000.0 193.1222 75000.0 194.1088 19000.0 195.1166 130000.0 195.1366 18000.0 195.5387 2600.0 195.6942 2800.0 196.1238 32000.0 197.0964 18000.0 197.1161 7800.0 197.1325 150000.0 198.1041 12000.0 198.1392 23000.0 199.1115 58000.0 199.1481 81000.0 200.1201 4000.0 201.1272 58000.0 201.1631 16000.0 202.1331 2900.0 203.1088 8000.0 203.143 270000.0 204.1468 7700.0 205.1226 16000.0 206.1097 3100.0 206.1296 3200.0 207.1166 61000.0 207.138 120000.0 208.1241 28000.0 208.1453 27000.0 209.1323 130000.0 209.1533 23000.0 210.1392 34000.0 211.1117 43000.0 211.1482 110000.0 212.1194 16000.0 212.1552 12000.0 213.1273 77000.0 213.1639 34000.0 214.1329 11000.0 215.107 16000.0 215.143 44000.0 216.1506 13000.0 217.1225 16000.0 217.1586 25000.0 219.1165 16000.0 219.1382 63000.0 220.1246 17000.0 221.1323 69000.0 221.1537 450000.0 222.1378 15000.0 222.1588 16000.0 223.1108 16000.0 223.1481 100000.0 224.1536 11000.0 225.1273 59000.0 225.1637 74000.0 226.1336 6600.0 227.1428 40000.0 227.1801 11000.0 227.2801 2500.0 228.1503 5800.0 229.1223 21000.0 229.1584 25000.0 230.1296 3500.0 231.1156 3500.0 231.1382 18000.0 231.1747 3700.0 233.1318 26000.0 233.1539 160000.0 234.137 8500.0 234.1604 55000.0 235.148 78000.0 235.171 3300.0 236.1554 14000.0 237.1254 22000.0 237.1487 98000.0 237.1662 8400.0 238.1677 3100.0 239.1432 32000.0 239.179 27000.0 240.1522 5400.0 241.1587 32000.0 243.1379 12000.0 243.1738 11000.0 245.1301 10000.0 245.1547 9400.0 246.1396 9800.0 247.1462 24000.0 247.1699 54000.0 249.1309 6800.0 249.1635 64000.0 250.1713 5500.0 251.1424 22000.0 251.1794 41000.0 252.1497 3400.0 253.1309 6300.0 253.1582 61000.0 253.1919 13000.0 255.1738 150000.0 255.2948 2500.0 256.1811 3000.0 257.1551 17000.0 257.1894 13000.0 259.1442 5000.0 259.1693 35000.0 260.1558 3800.0 261.163 72000.0 263.1428 13000.0 263.1788 44000.0 264.1843 5300.0 265.159 17000.0 265.1946 24000.0 267.1742 28000.0 268.1819 11000.0 269.1554 16000.0 269.1898 34000.0 270.1975 13000.0 271.169 52000.0 273.1592 4900.0 273.1863 23000.0 274.1928 55000.0 275.1791 8000.0 277.1609 11000.0 277.1949 29000.0 279.1745 53000.0 279.2054 3400.0 280.1824 3200.0 281.1899 59000.0 282.1954 5600.0 283.1719 4600.0 283.2053 15000.0 285.1852 54000.0 286.1925 85000.0 287.2008 65000.0 289.1579 3100.0 289.1953 24000.0 291.175 16000.0 291.2104 12000.0 293.1902 18000.0 294.1979 21000.0 295.1714 2900.0 295.2056 54000.0 297.1844 43000.0 298.1926 11000.0 299.2004 63000.0 300.2084 8500.0 301.1941 13000.0 303.1957 180000.0 305.1893 7100.0 305.2241 3000.0 307.2054 22000.0 309.1832 18000.0 309.2203 15000.0 310.1912 12000.0 311.2005 29000.0 312.2074 25000.0 313.2157 67000.0 315.2115 3900.0 319.2054 28000.0 321.2204 4000.0 322.2273 9500.0 323.199 5600.0 325.2157 53000.0 333.2216 9200.0 337.2158 97000.0 345.2221 6100.0 347.2371 14000.0 349.2143 6500.0 349.2568 3400.0 351.2315 3400.0 352.2391 260000.0 359.2344 11000.0 363.232 6600.0 365.2465 120000.0 366.2518 2700.0 368.794 2600.0 377.2472 22000.0 387.2681 12000.0 391.2624 2900.0 397.2561 2600.0 405.277 4200.0 419.2912 3800.0 437.3058 6200.0 463.2672 2500.0 469.3103 4200.0 487.3191 46000.0 487.3287 2800.0 490.3365 2700.0 502.3422 11000.0 503.3505 69000.0 505.3299 31000.0 507.3468 11000.0 508.3534 6600.0 520.353 23000.0 567.3788 5500.0 569.0071 2700.0 585.3939 4800.0 594.4513 2600.0 600.4103 3400.0 END IONS BEGIN IONS SCANS=728 PEPMASS=583.415 CHARGE=1 COLLISION_ENERGY=0.0 63.8847 2100.0 67.0539 12000.0 69.0331 3900.0 69.0694 16000.0 74.1413 2400.0 79.0539 9400.0 81.0694 30000.0 83.0487 7800.0 83.0853 9200.0 85.0646 3000.0 88.9646 2400.0 91.0541 11000.0 93.0694 52000.0 94.0966 2200.0 95.0487 7900.0 95.085 47000.0 97.0645 5100.0 105.0694 41000.0 106.0719 2600.0 107.085 54000.0 109.0641 7900.0 109.1007 29000.0 117.0693 3200.0 117.6647 2300.0 119.085 77000.0 121.1006 93000.0 123.0801 13000.0 123.1164 10000.0 125.0962 6800.0 129.069 2500.0 131.0849 29000.0 132.3567 2500.0 132.5556 2500.0 133.1006 57000.0 135.0798 4400.0 135.1163 27000.0 137.0957 19000.0 139.1113 6000.0 143.0852 30000.0 145.1006 68000.0 147.0798 19000.0 147.1164 22000.0 149.0957 16000.0 149.6811 4000.0 149.6917 5000.0 151.0752 25000.0 151.9601 2600.0 155.0851 4300.0 157.1007 60000.0 159.08 4500.0 159.1164 44000.0 161.0957 14000.0 161.1323 13000.0 163.1109 3700.0 165.0906 58000.0 167.0849 2500.0 167.0912 2500.0 167.1062 51000.0 169.1007 18000.0 170.1075 2900.0 171.1163 34000.0 171.1307 2600.0 173.096 3300.0 173.132 32000.0 173.5263 4200.0 173.5346 54000.0 175.1478 19000.0 180.3471 2500.0 181.1013 7000.0 183.1164 25000.0 185.1321 35000.0 187.1108 3000.0 187.1478 19000.0 189.1272 7100.0 191.1427 6500.0 195.1163 22000.0 196.1225 3900.0 197.1321 29000.0 199.1109 2700.0 199.1481 17000.0 200.1551 2600.0 203.1431 32000.0 207.1166 15000.0 207.1375 11000.0 208.1243 3200.0 209.132 33000.0 211.1476 20000.0 213.1632 2800.0 215.1438 6700.0 219.1163 2600.0 221.1319 15000.0 221.1536 79000.0 223.1475 21000.0 223.9696 2500.0 225.1632 7300.0 231.172 2600.0 233.1311 6800.0 233.1539 29000.0 235.1467 9500.0 237.1632 11000.0 247.1455 2900.0 249.1634 3100.0 253.6053 2200.0 261.1618 4100.0 263.1803 3100.0 273.1591 2700.0 275.1803 2200.0 281.2951 75000.0 282.2793 280000.0 283.2825 290000.0 285.1859 3100.0 286.1924 3000.0 287.2033 3100.0 295.2077 6500.0 297.2198 6800.0 299.3057 88000.0 300.3092 79000.0 327.8639 2500.0 349.2509 2700.0 375.2693 5100.0 403.3006 12000.0 503.3529 6500.0 520.5292 2300.0 538.5456 3500.0 565.4035 6200.0 583.409 19000.0 END IONS BEGIN IONS SCANS=729 PEPMASS=584.4225 CHARGE=1 COLLISION_ENERGY=0.0 64.1565 5000.0 67.0541 86000.0 69.0334 31000.0 69.0698 130000.0 71.0491 19000.0 72.6569 2900.0 77.0393 3300.0 79.0541 120000.0 80.3637 2600.0 81.0698 300000.0 83.0491 66000.0 83.0854 92000.0 85.0647 49000.0 87.0439 14000.0 88.3451 5500.0 89.0596 32000.0 91.0542 130000.0 91.7761 3000.0 93.0698 430000.0 93.0768 7900.0 95.0491 90000.0 95.0854 350000.0 97.0647 67000.0 97.1012 16000.0 97.4181 2900.0 99.0804 3600.0 103.0392 3600.0 105.0698 390000.0 106.0774 10000.0 107.0491 9900.0 107.0772 11000.0 107.0855 560000.0 108.0936 4000.0 109.0647 75000.0 109.1011 310000.0 111.0803 34000.0 113.096 16000.0 115.0534 3300.0 117.0698 80000.0 119.0755 23000.0 119.0855 800000.0 119.0955 18000.0 120.0932 53000.0 121.0648 53000.0 121.091 16000.0 121.1011 530000.0 121.1114 5000.0 122.1055 4200.0 123.0803 58000.0 123.1167 120000.0 125.096 57000.0 128.0622 12000.0 129.0698 53000.0 130.078 25000.0 131.0855 340000.0 132.0931 38000.0 133.0646 26000.0 133.0877 15000.0 133.1011 600000.0 133.1128 17000.0 134.0731 3300.0 134.1085 26000.0 135.0805 150000.0 135.1168 260000.0 135.1283 4300.0 137.0961 63000.0 137.1325 3900.0 139.1117 42000.0 141.0699 10000.0 142.0776 45000.0 143.0855 320000.0 144.0933 86000.0 144.1981 2900.0 145.0652 10000.0 145.0899 14000.0 145.1012 750000.0 146.1084 37000.0 147.0804 75000.0 147.1168 270000.0 148.0877 17000.0 148.1237 3000.0 149.0961 150000.0 149.1325 66000.0 151.1118 28000.0 151.1482 13000.0 153.0691 3500.0 155.0855 79000.0 155.1067 16000.0 156.0933 68000.0 157.0863 6000.0 157.1012 570000.0 158.1088 69000.0 159.0805 200000.0 159.1168 520000.0 160.0882 32000.0 160.1242 32000.0 161.0962 210000.0 161.1325 130000.0 162.1039 7300.0 163.1118 70000.0 163.1481 30000.0 165.09 3600.0 165.1271 6800.0 165.6156 3100.0 167.086 36000.0 167.1067 110000.0 168.0932 21000.0 168.109 8100.0 169.1014 230000.0 170.109 71000.0 171.0811 24000.0 171.117 410000.0 172.0888 7800.0 172.1245 59000.0 173.0962 85000.0 173.1148 2800.0 173.1327 470000.0 173.5241 37000.0 173.5379 69000.0 174.1035 8200.0 174.1399 28000.0 175.1119 120000.0 175.1483 280000.0 177.1276 55000.0 179.0858 31000.0 179.1442 3200.0 180.0935 11000.0 181.1014 120000.0 182.109 53000.0 183.117 350000.0 184.1246 54000.0 185.0962 34000.0 185.1326 300000.0 185.1515 4100.0 186.1041 18000.0 186.1404 55000.0 187.1119 66000.0 187.1483 240000.0 188.1189 15000.0 189.1276 66000.0 189.1639 21000.0 190.1353 24000.0 191.1433 77000.0 192.0944 5800.0 193.1014 83000.0 193.1203 19000.0 193.1592 5800.0 194.1091 68000.0 195.1169 280000.0 196.1245 76000.0 197.0966 35000.0 197.1326 420000.0 198.1401 42000.0 199.1122 74000.0 199.1482 240000.0 200.1551 15000.0 201.1277 77000.0 201.1639 130000.0 203.1433 82000.0 205.101 4900.0 205.1592 27000.0 206.1093 20000.0 207.1171 150000.0 208.1249 59000.0 209.0974 24000.0 209.1327 310000.0 210.1404 54000.0 211.112 48000.0 211.1484 260000.0 211.1712 4300.0 212.1195 23000.0 212.1559 28000.0 213.1277 100000.0 213.1642 99000.0 214.1349 7800.0 215.1435 53000.0 215.1796 4500.0 217.123 12000.0 217.1592 64000.0 218.1088 3500.0 218.1663 17000.0 219.1172 46000.0 219.1752 5700.0 220.1248 37000.0 221.1329 140000.0 221.1547 17000.0 222.1407 41000.0 223.1114 31000.0 223.1485 230000.0 224.1564 49000.0 225.1276 84000.0 225.1641 140000.0 226.136 4100.0 226.1714 9900.0 227.1432 64000.0 227.1797 32000.0 228.1473 6200.0 229.1591 33000.0 231.1169 11000.0 231.1748 17000.0 232.1247 11000.0 233.1317 56000.0 233.1541 320000.0 234.1396 29000.0 235.1484 150000.0 236.156 34000.0 237.128 27000.0 237.1324 9800.0 237.1639 160000.0 238.1729 10000.0 239.1436 41000.0 239.1796 100000.0 240.186 2900.0 241.1588 46000.0 241.1948 35000.0 243.1746 26000.0 245.132 40000.0 246.1401 33000.0 246.1641 11000.0 247.1482 78000.0 248.1556 27000.0 249.1298 12000.0 249.1638 120000.0 250.1715 27000.0 251.1454 21000.0 251.1793 85000.0 252.1868 20000.0 253.1587 79000.0 253.1954 53000.0 255.1445 5600.0 255.1743 500000.0 257.1901 52000.0 258.1404 11000.0 258.1964 3600.0 259.1474 39000.0 259.2051 4500.0 260.1553 32000.0 261.1638 120000.0 262.1714 16000.0 263.1462 10000.0 263.1795 87000.0 264.1875 17000.0 265.1614 23000.0 265.1951 61000.0 267.1746 38000.0 267.2092 28000.0 268.1828 23000.0 269.1907 44000.0 270.1984 21000.0 271.1457 5600.0 271.172 19000.0 271.2036 21000.0 273.1634 50000.0 273.189 19000.0 274.1715 15000.0 275.1797 69000.0 276.1873 16000.0 277.1613 17000.0 277.1955 43000.0 278.1994 3400.0 279.1751 49000.0 279.2099 24000.0 281.1904 49000.0 282.1965 3700.0 282.2778 11000.0 283.2057 41000.0 283.2828 29000.0 284.2141 8400.0 284.2867 14000.0 285.1598 4700.0 285.189 18000.0 285.2211 27000.0 287.1794 42000.0 289.1592 8800.0 289.1955 38000.0 291.1756 12000.0 291.2114 29000.0 293.1911 26000.0 293.2265 7000.0 295.2062 43000.0 297.1871 19000.0 297.2215 27000.0 299.2054 5700.0 299.3055 7500.0 300.3081 9100.0 301.1956 42000.0 301.3135 3400.0 303.174 3300.0 303.2111 23000.0 305.1907 11000.0 307.2055 24000.0 308.2159 3700.0 309.2222 4100.0 311.2382 3900.0 313.1941 11000.0 315.2106 19000.0 317.1917 8200.0 319.2058 23000.0 321.2222 7700.0 323.2392 8800.0 327.2111 21000.0 329.2266 22000.0 330.7422 3100.0 331.2423 7900.0 333.2214 12000.0 334.2319 7100.0 335.2367 9000.0 337.2537 4200.0 341.2276 3400.0 345.2213 55000.0 347.2365 23000.0 349.2522 23000.0 357.2198 4100.0 359.2383 3100.0 360.2452 21000.0 365.2462 14000.0 373.2532 4500.0 385.2541 6400.0 387.2714 3700.0 398.2594 6200.0 400.1882 5700.0 413.2867 11000.0 441.3078 3200.0 459.3242 14000.0 551.3879 8500.0 END IONS BEGIN IONS SCANS=730 PEPMASS=415.3 CHARGE=1 COLLISION_ENERGY=0.0 55.054 47000.0 55.0825 2300.0 55.1355 2400.0 57.0332 3100.0 57.0697 14000.0 65.0387 2500.0 66.9246 2500.0 67.0506 2900.0 67.0539 110000.0 69.0332 17000.0 69.0696 74000.0 71.0488 15000.0 76.1315 2300.0 77.0384 7300.0 79.0539 100000.0 81.0647 3400.0 81.0696 180000.0 83.0853 19000.0 86.3626 2700.0 91.0483 3900.0 91.0539 140000.0 91.0604 2200.0 93.0696 370000.0 93.0767 5000.0 95.0489 61000.0 95.0852 240000.0 97.0645 18000.0 99.9946 2400.0 103.054 8800.0 104.9436 2500.0 105.0449 2300.0 105.0616 8700.0 105.0696 350000.0 105.0781 5000.0 107.0488 3500.0 107.0852 320000.0 109.0646 34000.0 109.1009 190000.0 111.0798 3400.0 115.0544 5300.0 116.0617 9000.0 117.0697 59000.0 119.0756 10000.0 119.0853 430000.0 119.0935 3100.0 119.0955 8600.0 119.2118 2700.0 120.0931 4000.0 121.0646 20000.0 121.091 8400.0 121.101 400000.0 121.1095 2700.0 123.0803 41000.0 123.1166 32000.0 128.0617 17000.0 129.0698 39000.0 130.0775 23000.0 131.0748 4300.0 131.0854 320000.0 131.0968 5700.0 132.0933 13000.0 133.101 280000.0 133.1127 4600.0 135.0803 53000.0 135.1167 100000.0 141.0696 8000.0 142.0775 41000.0 143.0854 160000.0 144.0932 37000.0 145.0655 2900.0 145.1011 390000.0 145.1144 5300.0 146.0726 6200.0 146.1089 7900.0 147.0803 23000.0 147.1167 91000.0 149.0961 52000.0 149.1315 3000.0 154.0791 3400.0 155.0854 46000.0 156.0933 41000.0 157.0865 3100.0 157.1011 230000.0 158.1089 31000.0 159.0806 20000.0 159.1168 150000.0 161.0961 91000.0 161.1325 33000.0 163.1122 6000.0 165.0701 6900.0 167.0855 19000.0 168.0941 11000.0 168.4669 2600.0 169.1014 93000.0 170.1091 31000.0 171.1169 110000.0 172.1247 19000.0 173.0965 20000.0 173.1327 110000.0 173.5244 42000.0 173.542 32000.0 175.112 8900.0 175.1483 51000.0 179.0855 30000.0 180.0938 15000.0 181.1012 47000.0 182.1091 36000.0 183.1171 90000.0 184.1248 18000.0 185.0955 13000.0 185.1327 57000.0 186.1406 2800.0 187.1119 3700.0 187.1483 53000.0 189.1277 3000.0 193.1013 25000.0 194.1091 45000.0 195.117 71000.0 196.1249 22000.0 197.1327 91000.0 197.1653 2400.0 198.1403 9100.0 199.1125 8600.0 199.1483 48000.0 201.1273 8700.0 201.1639 14000.0 206.1097 8700.0 207.1171 25000.0 208.125 16000.0 209.1329 72000.0 210.1405 13000.0 211.1486 41000.0 213.1269 8800.0 213.1641 15000.0 213.8824 2400.0 215.1432 8200.0 219.117 7100.0 220.1252 10000.0 221.1328 24000.0 222.1403 7000.0 223.1486 39000.0 224.1255 2400.0 225.1641 13000.0 231.1171 5700.0 233.1326 9900.0 234.141 3600.0 235.1487 14000.0 237.1295 2600.0 237.1639 8200.0 239.1802 3600.0 245.1304 2500.0 247.1488 4400.0 249.1637 3600.0 251.1797 18000.0 253.1944 3400.0 261.1629 7000.0 263.1815 2800.0 266.2031 3800.0 266.5362 2800.0 267.2093 5600.0 295.5512 2500.0 306.2795 7200.0 347.9008 2600.0 383.5614 3000.0 415.305 7500.0 END IONS BEGIN IONS SCANS=731 PEPMASS=783.5729 CHARGE=1 COLLISION_ENERGY=0.0 71.0728 11000.0 71.6283 2300.0 72.2661 2700.0 72.5206 2700.0 72.556 2600.0 76.242 2300.0 78.0604 2200.0 86.096 290000.0 87.0994 33000.0 94.6484 2800.0 98.9841 17000.0 101.4443 2300.0 101.9942 2300.0 102.3007 2400.0 104.1066 30000.0 105.6145 2300.0 108.0719 2300.0 111.4163 2400.0 117.8776 2700.0 118.4527 2400.0 121.8189 2300.0 124.9995 150000.0 152.3177 2500.0 153.5339 2700.0 173.5198 8200.0 173.5284 120000.0 173.5392 39000.0 173.547 10000.0 174.5632 2400.0 184.0351 7900.0 184.0733 2900000.0 185.0766 370000.0 195.0612 2700.0 231.5514 2700.0 255.9224 2400.0 288.7493 2300.0 293.8051 2700.0 296.8878 2400.0 312.017 2800.0 362.6276 3000.0 397.1547 2400.0 410.4938 2700.0 418.3673 2700.0 448.5591 2600.0 533.2141 2600.0 726.6108 2800.0 728.2039 2700.0 757.7662 2600.0 END IONS BEGIN IONS SCANS=732 PEPMASS=932.6307 CHARGE=1 COLLISION_ENERGY=0.0 77.0387 25000.0 78.2512 2200.0 78.316 16000.0 78.5889 2300.0 79.054 750000.0 79.7012 2200.0 80.2603 2300.0 81.0333 49000.0 81.0697 3000000.0 81.0778 3500.0 81.4995 2500.0 82.1719 3700.0 83.0489 55000.0 83.0853 1100000.0 83.0941 2800.0 83.8118 2500.0 85.0225 5200.0 85.0281 1300000.0 85.0646 120000.0 85.101 910000.0 85.8777 4400.0 87.0435 6000.0 88.7723 3300.0 89.0595 100000.0 91.0326 4000.0 91.0388 900000.0 91.054 440000.0 92.9571 4600.0 93.0697 1200000.0 94.8754 2400.0 95.049 82000.0 95.0854 3600000.0 95.0923 4400.0 96.0443 35000.0 96.0963 4300.0 97.0214 4300.0 97.0282 710000.0 97.0646 130000.0 97.101 680000.0 99.0439 81000.0 99.0802 120000.0 99.1169 15000.0 100.2664 3100.0 101.0232 5600.0 101.0594 30000.0 102.9653 2200.0 103.0751 110000.0 105.0446 8000.0 105.0696 520000.0 107.0772 17000.0 107.0853 1100000.0 109.0281 52000.0 109.0646 44000.0 109.0927 4400.0 109.101 2300000.0 109.1094 8400.0 111.0803 94000.0 111.1166 190000.0 113.0959 53000.0 115.0388 53000.0 115.0544 2700.0 116.3553 4000.0 117.0546 3900.0 117.0697 210000.0 117.0907 48000.0 119.0756 3600.0 119.0853 680000.0 121.091 45000.0 121.1009 1500000.0 121.1099 2500.0 121.1107 6400.0 121.2039 2600.0 123.0802 68000.0 123.1069 5000.0 123.1166 1200000.0 125.0959 81000.0 125.1322 76000.0 127.0388 400000.0 127.0751 3000.0 129.0545 11000.0 129.3946 2300.0 131.0747 14000.0 131.0853 600000.0 131.1064 3900.0 133.101 790000.0 135.0803 11000.0 135.1056 8400.0 135.1166 1500000.0 135.1277 17000.0 137.0957 78000.0 137.1323 510000.0 139.1115 85000.0 139.1482 12000.0 141.0698 2900.0 143.0864 6000.0 144.0653 38000.0 145.0493 420000.0 145.101 620000.0 145.1214 7900.0 147.1038 5000.0 147.1166 720000.0 147.1297 5000.0 149.0957 42000.0 149.1183 14000.0 149.1323 1100000.0 149.1463 16000.0 151.1117 63000.0 151.1479 180000.0 153.1272 70000.0 156.8404 2300.0 157.1012 12000.0 157.486 4200.0 159.1024 21000.0 159.1167 700000.0 159.1325 5700.0 159.1382 5100.0 161.1183 6500.0 161.1323 710000.0 161.2345 2500.0 161.4302 2200.0 162.0766 3100.0 162.5862 2700.0 163.0599 110000.0 163.1121 48000.0 163.148 680000.0 164.4245 2600.0 165.1271 54000.0 165.1638 86000.0 167.143 17000.0 169.1017 6800.0 170.1716 3400.0 171.1169 41000.0 173.1325 810000.0 173.1498 11000.0 173.5203 7200.0 173.533 430000.0 173.5459 20000.0 175.1481 300000.0 175.1635 2500.0 177.1272 58000.0 177.1636 240000.0 178.1757 2400.0 179.1431 64000.0 179.1788 3100.0 181.1593 3400.0 183.1162 2500.0 185.1325 25000.0 186.8375 2400.0 187.148 470000.0 187.1665 9500.0 189.1637 58000.0 191.143 48000.0 191.1798 3100.0 193.1587 7300.0 193.8677 3000.0 195.1371 9900.0 199.1486 28000.0 201.1637 170000.0 201.1821 3700.0 203.1798 9700.0 205.1588 58000.0 206.1452 3600.0 206.8744 3800.0 209.154 6900.0 211.1479 3200.0 215.1794 60000.0 215.2 3500.0 217.1942 16000.0 219.1749 73000.0 219.2105 3000.0 221.2265 110000.0 223.1683 13000.0 225.5071 2500.0 233.2263 200000.0 235.1708 2400.0 237.1852 3400.0 237.2217 3100.0 239.2368 570000.0 239.9236 2400.0 241.1955 7700.0 243.2105 1100000.0 245.2258 4700.0 247.1716 4000.0 249.9734 2400.0 257.2472 710000.0 259.2055 44000.0 261.2209 4000000.0 261.2456 5400.0 261.2546 4400.0 272.2914 2400.0 275.2021 13000.0 277.2163 62000.0 279.1989 18000.0 279.232 110000.0 287.6415 2800.0 290.1893 2600.0 291.2316 70000.0 299.2372 57000.0 299.4754 2900.0 301.2176 2400.0 303.03 2400.0 305.249 3100.0 311.255 3200.0 313.1896 13000.0 313.2737 11000000.0 313.3571 6300.0 314.2876 2700.0 317.0869 2400.0 317.2476 510000.0 333.2417 17000.0 335.2214 9400.0 335.2579 6800000.0 336.2603 3200.0 345.9736 2400.0 353.2651 4700.0 374.1974 2400.0 383.0246 2700.0 383.564 2500.0 394.8692 2200.0 403.5456 2700.0 412.2527 3000.0 452.7477 2700.0 453.9497 2400.0 459.3342 3300.0 474.751 4500.0 477.9419 2500.0 481.4437 10000.0 490.2188 2600.0 499.4494 90000.0 519.4103 2300.0 558.6247 2700.0 572.8602 2600.0 573.4871 1400000.0 573.5901 4900.0 574.113 2500.0 591.5016 2500.0 607.3811 4500.0 624.3607 2500.0 626.3514 2900.0 641.8248 5300.0 697.0721 2600.0 699.7314 2900.0 753.0384 2600.0 776.2699 3100.0 803.2523 3100.0 817.1208 2900.0 860.8926 3700.0 895.9207 2400.0 END IONS BEGIN IONS SCANS=733 PEPMASS=583.415 CHARGE=1 COLLISION_ENERGY=0.0 67.0542 3200.0 68.2352 2300.0 69.0695 2800.0 69.8261 2400.0 73.363 2400.0 81.0695 12000.0 83.0852 12000.0 84.2525 2300.0 88.8651 2400.0 93.0695 17000.0 95.0486 2800.0 95.085 17000.0 96.7823 2200.0 96.9053 2200.0 97.0644 9200.0 103.6424 2400.0 105.0437 2700.0 105.0693 18000.0 107.085 24000.0 109.1007 9900.0 112.3704 2400.0 113.0958 4700.0 119.0851 26000.0 121.1008 28000.0 123.0799 6800.0 131.0851 9900.0 133.1008 17000.0 135.1165 10000.0 137.0948 3200.0 139.1111 5100.0 143.0851 4800.0 145.1007 23000.0 147.0802 4200.0 147.1164 13000.0 151.0747 8700.0 157.1009 18000.0 159.1166 13000.0 161.1326 4200.0 163.1126 3100.0 165.0909 29000.0 169.1018 7900.0 171.1169 15000.0 173.1323 11000.0 173.5201 12000.0 173.5381 49000.0 175.1481 3500.0 181.1013 2900.0 183.1163 11000.0 185.1323 11000.0 187.1477 3300.0 189.127 3000.0 195.1165 4700.0 197.1319 11000.0 199.1484 3800.0 203.1428 12000.0 207.1372 3100.0 209.1325 14000.0 211.1468 6900.0 221.1536 34000.0 223.1494 3700.0 237.1632 2700.0 249.1635 3900.0 250.4106 2800.0 265.1948 2700.0 267.1139 2400.0 275.1811 2800.0 281.2954 39000.0 282.2796 120000.0 283.2826 150000.0 295.2022 2600.0 299.3058 36000.0 300.3092 43000.0 403.2992 2600.0 454.4863 2800.0 503.3521 3900.0 583.411 6700.0 END IONS BEGIN IONS SCANS=734 PEPMASS=600.4171 CHARGE=1 COLLISION_ENERGY=0.0 67.0541 39000.0 69.0334 31000.0 69.0698 38000.0 71.0492 9200.0 74.2891 2600.0 76.5739 2400.0 77.0386 5500.0 78.2688 2300.0 79.0542 37000.0 80.0623 2400.0 81.0698 110000.0 83.0491 51000.0 83.0854 37000.0 85.0647 22000.0 87.0439 14000.0 87.3015 2600.0 89.0595 140000.0 91.0542 47000.0 93.0697 190000.0 93.0768 4400.0 95.0491 71000.0 95.0855 160000.0 96.0889 8100.0 96.5307 2400.0 97.0647 61000.0 97.101 3800.0 102.3664 2400.0 105.0619 3600.0 105.0698 160000.0 106.0781 4000.0 106.9701 2400.0 107.0498 3400.0 107.0853 210000.0 107.0934 5200.0 109.0647 62000.0 109.1011 89000.0 111.0441 6700.0 111.0805 34000.0 113.0958 22000.0 113.3097 2400.0 115.0543 3000.0 117.0699 30000.0 119.0497 4900.0 119.0854 250000.0 119.0956 3300.0 120.0928 13000.0 121.0648 39000.0 121.091 3400.0 121.1011 260000.0 121.1105 5000.0 122.0721 2900.0 122.1043 12000.0 123.0436 4200.0 123.0803 120000.0 123.1168 26000.0 125.0596 38000.0 125.0961 53000.0 128.0626 6900.0 129.0697 24000.0 130.0781 5400.0 131.0854 110000.0 132.0932 14000.0 133.0291 2600.0 133.0646 29000.0 133.0858 77000.0 133.1011 200000.0 133.1127 3900.0 134.1079 4500.0 134.3132 2700.0 135.0803 100000.0 135.1167 89000.0 135.1459 2300.0 136.0842 2500.0 137.0598 16000.0 137.096 75000.0 139.0755 23000.0 139.1118 35000.0 141.0703 3100.0 142.0778 21000.0 143.0854 140000.0 144.093 52000.0 145.065 8200.0 145.0893 2700.0 145.1011 270000.0 145.1142 4600.0 146.108 16000.0 147.0804 140000.0 147.1168 83000.0 148.0878 7500.0 149.096 73000.0 149.1324 6000.0 150.1031 6400.0 151.0753 130000.0 151.1117 21000.0 152.0812 4300.0 153.0911 16000.0 155.0856 30000.0 155.107 12000.0 156.0932 27000.0 157.086 5400.0 157.1011 320000.0 158.108 47000.0 159.0805 51000.0 159.1167 190000.0 160.0882 53000.0 160.1225 11000.0 161.0961 130000.0 161.1324 61000.0 162.1027 6800.0 163.0755 5000.0 163.1116 120000.0 164.1173 8100.0 165.0681 3700.0 165.0911 390000.0 165.1258 3500.0 166.0946 27000.0 167.0883 12000.0 167.1068 83000.0 169.1012 92000.0 170.1088 38000.0 171.0809 12000.0 171.1169 200000.0 172.0885 5900.0 172.1238 57000.0 173.0963 63000.0 173.1325 110000.0 173.5103 3000.0 173.531 99000.0 173.5395 26000.0 174.1038 5200.0 174.14 3600.0 175.1119 110000.0 175.1483 50000.0 176.1186 6100.0 177.0909 24000.0 177.1115 7400.0 177.1275 36000.0 178.0993 13000.0 179.0874 7200.0 179.1071 40000.0 179.1431 13000.0 180.097 4100.0 180.1148 21000.0 180.1476 2300.0 181.0853 8300.0 181.1016 43000.0 181.1222 56000.0 182.1088 17000.0 182.1264 3400.0 183.0804 2800.0 183.1169 120000.0 184.1233 27000.0 185.0963 24000.0 185.1326 150000.0 186.1037 7000.0 186.1401 25000.0 187.112 49000.0 187.1478 41000.0 188.1194 7100.0 189.0912 3600.0 189.1274 93000.0 190.135 67000.0 191.1069 25000.0 191.1429 45000.0 193.1017 34000.0 193.1224 66000.0 194.1088 9900.0 195.1168 110000.0 195.1385 16000.0 196.1237 29000.0 197.0967 16000.0 197.1152 3500.0 197.1326 140000.0 198.1044 12000.0 198.1383 20000.0 199.1118 51000.0 199.1482 59000.0 200.1191 5800.0 201.1277 51000.0 201.1631 4200.0 202.1339 2800.0 203.1089 2900.0 203.1432 240000.0 203.165 5100.0 204.147 22000.0 205.102 3400.0 205.1226 13000.0 205.1604 3100.0 206.1095 3200.0 206.1301 3700.0 207.1169 53000.0 207.1384 100000.0 208.1244 28000.0 208.1454 29000.0 209.0972 4600.0 209.1325 100000.0 209.1538 14000.0 210.1045 3200.0 210.1393 29000.0 211.1118 37000.0 211.1482 84000.0 212.1193 10000.0 212.1543 7600.0 213.1274 67000.0 213.1641 28000.0 214.1332 11000.0 215.1067 15000.0 215.1432 36000.0 216.1508 10000.0 217.1222 16000.0 217.1593 17000.0 218.13 6700.0 218.1659 4200.0 219.1169 13000.0 219.1385 54000.0 220.1242 8800.0 220.1463 5800.0 221.1324 57000.0 221.1539 430000.0 222.1371 5200.0 222.1575 31000.0 223.1121 13000.0 223.1483 88000.0 224.1546 12000.0 225.1276 44000.0 225.1641 54000.0 227.1433 37000.0 227.1808 6800.0 228.1501 3400.0 229.1226 15000.0 229.1591 25000.0 230.1313 5500.0 230.165 2600.0 231.1387 12000.0 231.1746 6500.0 232.1238 6200.0 233.1315 24000.0 233.1541 140000.0 234.1375 2900.0 234.1607 56000.0 235.148 55000.0 235.1708 3800.0 236.1549 9600.0 237.1257 13000.0 237.1492 72000.0 237.1661 3400.0 238.1348 3500.0 238.1709 9700.0 239.1432 24000.0 239.1791 22000.0 240.1509 4100.0 241.1588 24000.0 243.1385 12000.0 243.1752 5300.0 245.1304 10000.0 245.1546 12000.0 246.1383 6000.0 246.1618 7800.0 247.1313 2700.0 247.1454 19000.0 247.17 58000.0 248.1529 3900.0 249.1294 4800.0 249.1638 53000.0 250.1601 7300.0 251.1437 13000.0 251.1795 29000.0 252.1848 6800.0 253.1585 43000.0 253.1923 9600.0 254.1671 3100.0 255.1432 4800.0 255.1744 120000.0 256.1827 4400.0 257.1539 10000.0 257.1914 10000.0 259.1449 11000.0 259.1697 29000.0 261.1632 67000.0 262.1703 5500.0 263.1422 7600.0 263.1793 30000.0 265.1585 16000.0 265.1942 21000.0 267.1431 3700.0 267.1749 30000.0 267.2029 2700.0 268.1813 15000.0 269.1544 7900.0 269.1901 30000.0 270.1969 10000.0 271.1695 46000.0 272.1795 5100.0 273.1863 18000.0 274.1657 2900.0 274.1934 47000.0 275.1498 2900.0 275.1792 16000.0 276.1864 3900.0 277.1603 9500.0 277.1949 28000.0 278.1714 3100.0 279.1746 55000.0 279.2087 8200.0 280.1823 3400.0 281.1571 9700.0 281.1904 46000.0 282.1986 4100.0 283.1717 9800.0 283.207 4900.0 285.1856 51000.0 286.193 83000.0 287.2011 64000.0 289.0227 2600.0 289.195 17000.0 290.1997 2600.0 291.174 11000.0 291.2091 11000.0 293.1898 15000.0 294.1982 15000.0 295.1702 5800.0 295.2066 39000.0 296.1732 3000.0 297.1856 44000.0 298.1939 3800.0 299.2012 63000.0 300.2087 5300.0 301.1948 11000.0 303.1961 150000.0 305.1907 8900.0 306.235 2800.0 307.2065 15000.0 309.1845 20000.0 309.2229 11000.0 309.3401 2500.0 310.1926 15000.0 311.2022 15000.0 312.2089 19000.0 313.1857 2800.0 313.2165 59000.0 315.2105 7200.0 317.2269 4000.0 319.2056 30000.0 321.2221 3600.0 322.2299 6900.0 323.2003 8700.0 325.2167 43000.0 329.2301 3700.0 331.2062 3400.0 332.2139 2900.0 333.2217 7500.0 334.2313 2700.0 336.5795 2700.0 337.2166 92000.0 338.2222 3300.0 339.2321 6600.0 341.2288 3000.0 347.2369 16000.0 349.2158 8000.0 350.2186 3700.0 351.2331 13000.0 352.2394 210000.0 359.2372 7800.0 363.2323 11000.0 364.2377 3400.0 365.2477 110000.0 373.2551 3300.0 375.2738 3400.0 377.2482 19000.0 379.2622 3800.0 381.2429 3800.0 383.2619 3000.0 387.2682 6000.0 391.2627 4900.0 397.2725 3300.0 403.2595 4000.0 405.2825 6200.0 419.2962 4500.0 421.2733 5400.0 428.7787 2600.0 437.3062 4500.0 469.3078 6900.0 487.32 43000.0 502.3429 6000.0 503.3516 55000.0 505.3311 32000.0 507.3471 18000.0 508.3454 7200.0 520.3546 25000.0 567.381 3900.0 585.3961 6400.0 589.3093 3000.0 600.4176 3300.0 END IONS BEGIN IONS SCANS=735 PEPMASS=599.4101 CHARGE=1 COLLISION_ENERGY=0.0 64.2178 2500.0 65.2061 2500.0 67.054 17000.0 69.0334 10000.0 69.0698 11000.0 71.0492 2900.0 76.7699 2700.0 79.054 12000.0 81.0697 35000.0 83.049 17000.0 83.0854 20000.0 85.0646 10000.0 87.0436 2600.0 91.0541 8200.0 93.0697 55000.0 93.0762 4100.0 94.5737 2300.0 95.0489 20000.0 95.0853 42000.0 97.0646 36000.0 97.101 3300.0 105.0697 35000.0 107.0853 61000.0 109.065 13000.0 109.1011 24000.0 111.0801 10000.0 113.0959 23000.0 117.0696 2800.0 119.0853 61000.0 121.0649 13000.0 121.0921 3500.0 121.101 84000.0 123.0803 29000.0 123.1162 8400.0 125.0597 11000.0 125.0959 18000.0 129.0695 2600.0 131.0854 29000.0 133.0648 6900.0 133.1011 45000.0 135.0804 25000.0 135.1167 24000.0 137.096 31000.0 139.1116 24000.0 143.0855 37000.0 144.093 8800.0 145.1011 69000.0 147.0802 52000.0 147.1167 18000.0 149.096 18000.0 149.6863 5100.0 149.7075 2900.0 151.0751 46000.0 151.1111 2500.0 153.0909 3600.0 153.1275 8100.0 155.0857 9100.0 155.1062 9600.0 156.0931 3600.0 157.101 64000.0 158.1091 2500.0 159.0801 13000.0 159.1167 38000.0 159.2739 2400.0 161.0961 23000.0 161.1325 23000.0 162.6475 2400.0 163.1117 30000.0 165.091 190000.0 167.1066 30000.0 169.1012 27000.0 170.1092 3400.0 171.1169 43000.0 173.0958 11000.0 173.1328 26000.0 173.5287 35000.0 173.537 4100.0 173.5469 4300.0 175.1119 14000.0 175.1475 9800.0 177.0904 2900.0 177.1267 3200.0 179.143 12000.0 181.1023 11000.0 181.1224 30000.0 183.1169 32000.0 185.096 8100.0 185.1327 26000.0 187.1113 12000.0 187.1488 11000.0 189.1275 21000.0 190.1347 2800.0 191.1071 6700.0 191.1432 12000.0 193.1014 9500.0 193.1222 3300.0 194.1087 3300.0 195.1168 24000.0 195.1365 8700.0 197.1325 37000.0 199.1114 9500.0 199.1478 12000.0 201.1271 12000.0 201.1641 3700.0 203.1432 84000.0 205.1579 3100.0 207.1168 12000.0 207.1383 29000.0 208.1248 3900.0 209.1327 30000.0 211.1113 5700.0 211.1486 23000.0 213.1282 9400.0 213.1643 3200.0 215.1432 11000.0 219.1171 3500.0 221.1322 18000.0 221.1539 150000.0 222.1401 3600.0 223.1482 27000.0 224.5936 2400.0 225.1271 4600.0 225.1634 9800.0 227.1433 8600.0 227.5593 2600.0 229.121 3400.0 229.1591 8900.0 231.139 6500.0 233.1306 9000.0 233.154 62000.0 235.1481 15000.0 237.1665 3800.0 239.1434 5100.0 239.1804 4600.0 241.1566 2600.0 247.1447 5100.0 247.1696 20000.0 249.164 4800.0 251.1795 11000.0 253.1587 3000.0 255.1748 5800.0 257.189 2500.0 259.1482 3300.0 259.1721 4100.0 261.1636 5200.0 263.1801 13000.0 265.1946 6800.0 269.1899 12000.0 273.1869 6200.0 275.1797 4100.0 281.1904 15000.0 285.1865 9100.0 286.1925 11000.0 287.2012 24000.0 289.0461 2600.0 289.1984 2500.0 291.1743 4800.0 293.189 2900.0 295.2069 4700.0 298.1947 4800.0 299.2006 20000.0 311.2016 5300.0 312.2077 8600.0 313.2179 4900.0 349.2158 2800.0 364.2397 5800.0 365.2463 5500.0 378.6661 2500.0 391.2626 3000.0 413.2724 8400.0 439.9656 2400.0 507.344 14000.0 597.8586 2500.0 599.4095 10000.0 END IONS BEGIN IONS SCANS=736 PEPMASS=638.4397 CHARGE=1 COLLISION_ENERGY=0.0 65.6192 2200.0 65.8431 2500.0 67.0538 80000.0 68.3273 2100.0 69.0694 190000.0 69.9961 2900.0 71.0488 20000.0 71.0851 140000.0 73.0817 2300.0 75.2534 2400.0 76.6423 2600.0 79.0539 21000.0 81.0694 180000.0 83.0488 17000.0 83.085 310000.0 85.0645 20000.0 85.1007 120000.0 88.7498 2600.0 92.5293 2200.0 93.0693 81000.0 95.085 230000.0 97.0643 69000.0 97.1006 120000.0 97.2648 2400.0 99.0801 4200.0 99.1171 2600.0 99.2286 2400.0 99.9862 2600.0 100.5685 2400.0 101.0592 17000.0 104.7981 2300.0 107.0849 84000.0 109.1006 160000.0 111.0799 78000.0 111.1165 16000.0 115.0748 24000.0 121.1006 54000.0 123.1163 83000.0 125.0954 39000.0 125.1319 30000.0 125.6453 2500.0 127.3475 2800.0 129.0907 8300.0 134.4819 2400.0 137.1321 28000.0 143.1432 2500.0 146.9069 2600.0 148.4062 2600.0 149.1183 2700.0 149.1319 440000.0 149.1462 7000.0 149.6798 3400.0 149.6903 4700.0 149.9888 2400.0 151.1477 6100.0 153.8578 2400.0 154.5159 2100.0 155.0096 39000.0 167.1277 9700.0 167.1426 260000.0 173.5271 86000.0 173.5401 44000.0 185.1531 45000.0 185.2496 2500.0 186.0203 2900.0 195.5706 2100.0 196.8069 2500.0 202.945 2400.0 218.7561 2800.0 221.2257 20000.0 222.9452 2800.0 224.6627 2400.0 228.1955 86000.0 239.2365 95000.0 241.1794 230000.0 245.873 2500.0 257.2466 11000.0 259.1899 62000.0 282.2794 19000.0 284.8126 2700.0 309.879 2400.0 310.313 3000.0 313.2737 110000.0 393.2403 2600.0 496.4989 2700.0 497.3347 3400.0 497.4196 540000.0 497.5051 6400.0 578.2835 6700.0 END IONS BEGIN IONS SCANS=737 PEPMASS=721.4524 CHARGE=1 COLLISION_ENERGY=0.0 69.0696 15000.0 77.0384 2500.0 78.0284 2700.0 79.0539 97000.0 81.0331 2500.0 81.0696 90000.0 83.0489 9900.0 83.0851 19000.0 84.7962 2600.0 91.0539 53000.0 93.0695 130000.0 95.0488 18000.0 95.0852 76000.0 97.028 2400.0 97.0646 8000.0 97.1006 6100.0 105.0696 61000.0 107.0852 52000.0 109.0642 2500.0 109.1008 31000.0 109.1088 2400.0 117.0694 7600.0 119.0852 41000.0 121.1009 42000.0 123.0804 15000.0 123.1165 7500.0 129.0695 23000.0 131.0853 17000.0 133.1009 30000.0 135.1165 29000.0 143.0855 16000.0 145.0141 2700.0 145.1008 28000.0 147.1165 110000.0 148.9977 3200.0 149.132 19000.0 159.1164 5500.0 161.096 9500.0 161.1326 38000.0 167.2289 2200.0 169.1271 2800.0 171.1167 66000.0 173.1327 6900.0 173.5289 62000.0 173.5452 4800.0 177.7426 2400.0 189.1274 30000.0 199.1476 2500.0 207.1382 38000.0 224.6724 2400.0 243.2096 3800.0 261.2215 21000.0 281.1752 74000.0 292.166 2600.0 293.1803 3000.0 313.6723 2400.0 320.7377 2500.0 335.2586 52000.0 336.415 2600.0 389.2046 2400.0 441.2132 3300.0 478.3005 2600.0 521.3103 5000.0 541.3895 33000.0 574.2256 2800.0 585.745 2900.0 721.4508 14000.0 END IONS BEGIN IONS SCANS=738 PEPMASS=743.4345 CHARGE=1 COLLISION_ENERGY=0.0 69.033 30000.0 69.0369 4100.0 69.0695 10000.0 71.0489 3200.0 71.9037 2200.0 72.4671 2200.0 72.754 2200.0 73.0279 48000.0 73.7785 2200.0 79.0536 52000.0 80.2464 2200.0 80.5758 2500.0 81.033 22000.0 81.0692 100000.0 82.0726 2200.0 82.6033 82000.0 82.6066 17000.0 83.0851 16000.0 85.0278 92000.0 87.0436 2400.0 89.4949 2700.0 89.6259 2200.0 90.666 2200.0 91.0384 87000.0 91.0536 30000.0 93.0692 84000.0 95.0485 2600.0 95.0848 93000.0 97.0226 2500.0 97.0277 80000.0 97.1005 6500.0 99.0433 13000.0 101.0227 31000.0 102.3812 2500.0 103.0384 8900.0 105.0692 30000.0 107.0849 46000.0 109.0278 15000.0 109.1005 52000.0 111.042 2400.0 111.08 3000.0 115.0379 2500.0 116.6971 4700.0 117.4516 2500.0 119.0847 22000.0 119.096 5000.0 120.738 2800.0 121.1005 53000.0 123.1161 27000.0 124.7129 2300.0 127.0383 56000.0 129.07 3300.0 131.085 11000.0 133.1005 27000.0 135.1163 40000.0 137.1325 2600.0 140.1479 2600.0 141.4803 2300.0 142.037 2900.0 143.1348 2200.0 145.0488 16000.0 145.1004 14000.0 147.1162 53000.0 147.9259 2700.0 149.1314 18000.0 154.3751 3300.0 159.1165 6700.0 159.233 2500.0 161.0963 2300.0 161.1321 32000.0 163.148 2300.0 171.1004 2500.0 171.1161 42000.0 173.1318 8500.0 173.5176 3000.0 173.5322 180000.0 173.5455 9400.0 175.1475 3400.0 183.0646 3100.0 184.0726 6300.0 185.0415 48000.0 187.1489 3700.0 189.1268 8300.0 195.8407 2400.0 201.0751 2900.0 203.0523 21000.0 207.1376 34000.0 209.0569 2400.0 211.7025 2800.0 241.0692 3400.0 243.0831 95000.0 247.1296 130000.0 260.6 2400.0 261.2204 24000.0 275.6565 2400.0 278.9564 2500.0 281.1744 46000.0 301.2136 5900.0 303.1563 30000.0 309.1696 3400.0 325.134 2500.0 335.2575 130000.0 363.2511 4600.0 371.0277 2600.0 403.6929 3000.0 439.9418 3000.0 465.1302 2300.0 465.2091 1400000.0 465.2853 5100.0 467.3095 2800.0 497.31 10000.0 503.0266 3300.0 519.1995 3700.0 519.2924 1500000.0 519.3819 5700.0 524.1138 2500.0 563.3735 6400.0 581.3812 84000.0 602.5196 8400.0 602.5319 3100.0 606.1254 2900.0 730.8585 2500.0 743.2748 9100.0 743.4335 2300000.0 743.744 5600.0 END IONS BEGIN IONS SCANS=739 PEPMASS=631.2529 CHARGE=1 COLLISION_ENERGY=0.0 67.834 2200.0 67.8388 2000.0 70.6416 2100.0 74.2991 2200.0 80.6717 2200.0 85.6791 2800.0 90.5069 2100.0 93.3465 2300.0 99.0351 2900.0 100.0689 2300.0 107.2915 2500.0 111.5953 2300.0 149.133 2300.0 173.5207 5700.0 173.5316 54000.0 173.5393 18000.0 193.087 2500.0 194.7345 2500.0 204.9403 2600.0 215.007 2500.0 268.2389 2800.0 274.4606 2400.0 352.5226 2500.0 360.5081 2400.0 455.2159 2900.0 460.2223 2400.0 477.6374 2500.0 482.2106 4700.0 491.2413 11000.0 498.2014 2900.0 499.2101 13000.0 509.2301 15000.0 511.2472 17000.0 513.2242 3400.0 514.2364 3800.0 522.1988 8100.0 526.199 2500.0 531.2372 3000.0 533.2544 31000.0 537.2258 200000.0 540.213 19000.0 543.2714 20000.0 553.2202 7700.0 555.2364 100000.0 557.2152 3700.0 558.2238 12000.0 565.0618 2900.0 569.2532 7600.0 571.2327 16000.0 572.2382 46000.0 581.2158 320000.0 581.3212 5300.0 585.5312 3200.0 587.2634 59000.0 599.2249 7900.0 613.2423 17000.0 631.252 61000.0 END IONS BEGIN IONS SCANS=740 PEPMASS=738.4788 CHARGE=1 COLLISION_ENERGY=0.0 69.0695 54000.0 71.0491 3600.0 73.0647 3000.0 79.0538 310000.0 80.1794 2500.0 80.9479 2500.0 81.0332 10000.0 81.0694 300000.0 83.0488 36000.0 83.085 61000.0 84.8164 2100.0 85.0645 14000.0 90.1346 2200.0 91.0483 4300.0 91.0536 170000.0 92.9095 2400.0 93.063 3200.0 93.0694 420000.0 93.0766 4800.0 95.0488 61000.0 95.0784 2700.0 95.085 270000.0 95.0926 3600.0 96.8559 2200.0 96.9044 2200.0 97.0645 29000.0 97.1007 38000.0 98.1589 2500.0 99.0802 12000.0 105.0445 7200.0 105.0693 170000.0 107.0489 20000.0 107.0773 2700.0 107.085 180000.0 109.0644 36000.0 109.1007 110000.0 109.7612 3000.0 111.0799 19000.0 111.1162 2500.0 113.0956 3000.0 114.4468 2400.0 117.0696 36000.0 119.0766 2800.0 119.085 130000.0 120.9656 34000.0 121.0643 13000.0 121.0924 6100.0 121.1007 170000.0 121.4601 3100.0 123.0799 48000.0 123.1163 46000.0 125.0958 6200.0 127.0753 13000.0 129.0694 74000.0 129.5272 2300.0 131.085 47000.0 131.6505 2600.0 133.0919 2200.0 133.1007 110000.0 135.0799 2400.0 135.1163 110000.0 137.0956 6300.0 137.1322 18000.0 141.0908 7100.0 143.0852 39000.0 145.1008 100000.0 147.0802 16000.0 147.1039 4500.0 147.1163 350000.0 149.1321 63000.0 151.1477 2500.0 156.8594 2800.0 157.1001 2900.0 159.1164 53000.0 161.0959 35000.0 161.1321 160000.0 162.9525 2800.0 163.1111 13000.0 163.1475 24000.0 164.0078 29000.0 169.1008 3500.0 171.1033 2400.0 171.1164 260000.0 172.0172 2700.0 173.1322 34000.0 173.5234 47000.0 173.5384 63000.0 173.5439 11000.0 175.1479 21000.0 177.1278 2900.0 177.1628 3600.0 179.1429 12000.0 187.1138 3700.0 187.1478 17000.0 189.1269 120000.0 207.1377 190000.0 220.7003 2200.0 225.1484 5400.0 242.7141 2200.0 243.2102 31000.0 261.221 89000.0 263.2374 3300.0 281.1749 400000.0 281.2101 4300.0 304.2643 7700.0 306.2785 9700.0 317.2473 6000.0 335.2581 350000.0 337.2708 2300.0 348.101 2500.0 352.7203 2300.0 366.125 2400.0 420.7449 2300.0 446.1389 2800.0 467.8197 2300.0 527.5475 2500.0 541.3886 200000.0 541.4742 4400.0 575.5016 16000.0 597.4875 56000.0 END IONS BEGIN IONS SCANS=741 PEPMASS=609.2712 CHARGE=1 COLLISION_ENERGY=0.0 64.1375 34000.0 64.1395 12000.0 65.6931 24000.0 65.6959 87000.0 67.6941 42000.0 67.6976 150000.0 68.2793 7200.0 74.9322 6600.0 101.8527 4800.0 115.2147 5100.0 141.4365 7600.0 144.9567 5300.0 173.521 49000.0 173.5373 180000.0 200.2934 4100.0 237.1387 6600.0 238.1454 4900.0 239.154 47000.0 251.1521 9700.0 257.5132 6200.0 263.5922 4900.0 353.7094 8400.0 407.2232 50000.0 420.2294 56000.0 421.237 82000.0 422.2464 44000.0 428.6642 8200.0 434.2459 9400.0 444.2311 8900.0 447.1762 4900.0 448.2207 5100.0 449.2306 7900.0 457.2356 51000.0 459.2174 280000.0 460.2259 65000.0 461.1885 19000.0 461.1985 36000.0 462.2048 18000.0 463.2124 61000.0 472.2261 41000.0 473.2324 27000.0 474.2428 7600.0 475.2137 280000.0 476.2215 380000.0 477.2299 230000.0 478.2352 64000.0 485.2329 960000.0 486.2052 320000.0 487.2178 26000.0 487.2449 67000.0 488.2197 23000.0 489.2275 150000.0 490.2362 6100.0 493.2224 48000.0 494.2665 150000.0 497.2336 79000.0 499.2127 510000.0 499.2962 5900.0 500.2188 120000.0 502.237 37000.0 503.1584 8800.0 503.2434 1000000.0 504.227 110000.0 504.2428 120000.0 505.2275 140000.0 507.2245 5800.0 507.2361 14000.0 513.228 240000.0 514.2393 27000.0 515.2437 1400000.0 517.2228 430000.0 518.2307 130000.0 519.2405 33000.0 521.2516 640000.0 522.2563 52000.0 531.2383 3900000.0 532.2434 36000.0 533.2534 150000.0 534.2266 6000.0 535.2337 97000.0 536.24 40000.0 541.1302 5800.0 541.2228 390000.0 544.2084 8000.0 545.2532 24000.0 548.2415 110000.0 549.2493 990000.0 549.3468 8900.0 550.1584 41000.0 550.2571 1600000.0 550.3557 9500.0 559.0248 7100.0 559.2338 2600000.0 560.2489 5800.0 563.2649 640000.0 573.2518 15000.0 577.1387 7400.0 577.2442 880000.0 577.3497 4800.0 578.2533 5300.0 581.2743 120000.0 591.2601 3000000.0 594.246 49000.0 609.2704 4600000.0 END IONS BEGIN IONS SCANS=742 PEPMASS=625.2662 CHARGE=1 COLLISION_ENERGY=0.0 64.5764 2400.0 78.2475 2400.0 80.7709 2800.0 96.9383 2700.0 120.0803 2200.0 138.1702 2600.0 138.6883 2100.0 141.1236 2500.0 173.529 98000.0 173.5444 14000.0 221.7414 2200.0 241.9817 2300.0 244.5065 2500.0 280.5939 2600.0 283.4216 2300.0 310.9354 2700.0 364.8816 2800.0 371.4784 2300.0 405.2091 30000.0 406.2193 6600.0 419.2247 17000.0 420.2313 740000.0 421.2393 30000.0 424.226 31000.0 433.2395 40000.0 434.2472 91000.0 445.2022 4300.0 447.2154 9200.0 448.2262 110000.0 449.1281 3000.0 449.2339 210000.0 449.2999 3100.0 451.2127 36000.0 452.2212 250000.0 459.2188 120000.0 460.2261 340000.0 461.1978 3600.0 461.2386 8900.0 462.2057 97000.0 463.2131 52000.0 464.2231 3500.0 465.229 190000.0 466.2365 14000.0 475.2135 330000.0 476.2209 150000.0 477.2289 1000000.0 477.3095 9100.0 478.2355 19000.0 479.2451 32000.0 480.2547 10000.0 487.2134 16000.0 488.2191 15000.0 489.2274 25000.0 490.2355 4400.0 491.2127 40000.0 491.2398 12000.0 492.252 360000.0 493.2572 110000.0 501.2289 30000.0 502.2355 28000.0 503.1116 3000.0 503.2438 230000.0 503.3077 2500.0 504.2503 23000.0 505.2249 4100.0 505.2379 2700.0 507.2376 27000.0 508.2528 4900.0 509.2196 46000.0 518.2314 120000.0 519.2372 20000.0 520.2148 6600.0 521.2213 520000.0 523.1509 2100.0 523.2342 110000.0 531.2386 4700.0 533.2192 62000.0 534.2261 22000.0 535.2345 260000.0 536.2419 300000.0 536.3171 2500.0 537.2497 54000.0 538.2583 46000.0 547.2342 100000.0 548.2416 41000.0 549.2502 180000.0 563.2658 50000.0 565.2457 99000.0 567.3711 16000.0 579.2527 19000.0 580.2641 3300.0 593.241 60000.0 595.2632 3200.0 598.6135 3000.0 607.2543 7100.0 608.2635 110000.0 625.4158 6700.0 END IONS BEGIN IONS SCANS=743 PEPMASS=829.5075 CHARGE=1 COLLISION_ENERGY=0.0 107.0848 2700.0 126.0614 2700.0 141.0222 2500.0 173.5285 35000.0 180.621 2400.0 184.8832 2700.0 258.715 2700.0 333.2035 17000.0 387.0541 2700.0 519.2922 27000.0 551.2819 48000.0 551.3734 2500.0 605.9703 2500.0 667.4565 4600.0 829.5056 81000.0 END IONS BEGIN IONS SCANS=744 PEPMASS=236.1678 CHARGE=1 COLLISION_ENERGY=0.0 43.7559 2300.0 43.8184 2100.0 43.8465 2000.0 44.1413 2400.0 44.1554 2100.0 44.883 2200.0 44.9133 2500.0 45.0333 3000.0 45.0644 2800.0 45.8128 2300.0 45.8823 2200.0 46.1469 2200.0 46.3958 2200.0 46.4975 2300.0 46.5933 2400.0 46.8924 2100.0 47.1646 2800.0 47.1931 2000.0 47.2422 2300.0 47.5324 2600.0 47.914 2200.0 48.9568 2400.0 49.0071 2700.0 49.6248 2600.0 49.6697 2700.0 49.9838 2300.0 50.142 2100.0 50.2411 2200.0 50.4009 2200.0 51.3215 2300.0 51.7844 2300.0 52.1679 2500.0 52.2473 2200.0 52.2863 2500.0 53.0126 2200.0 53.1093 2700.0 54.2976 2300.0 54.5844 2600.0 54.6606 2200.0 54.8618 2400.0 55.0956 2200.0 55.5568 2100.0 56.0492 1700000.0 56.3058 2400.0 56.6249 2200.0 56.8806 2200.0 57.0002 2600.0 57.0333 200000.0 57.0697 110000.0 57.589 2100.0 57.779 2400.0 57.9107 4600.0 58.0649 2200.0 58.073 22000.0 58.2979 2500.0 59.0308 11000.0 60.7266 2200.0 61.1255 2700.0 61.3539 2600.0 61.5829 2300.0 61.7035 2300.0 61.7351 2300.0 61.7935 2200.0 62.3781 2400.0 62.9895 7200.0 63.6625 2400.0 64.2031 2100.0 64.3768 2400.0 64.9039 2100.0 65.1275 2300.0 65.7358 2200.0 66.5251 2900.0 67.057 2700.0 67.3467 2200.0 67.4466 2500.0 67.9337 4400.0 67.9891 2300.0 68.1699 2400.0 68.8938 2400.0 69.0329 3600.0 69.7334 2500.0 69.8905 2100.0 70.2058 2300.0 70.5696 2200.0 72.6497 2300.0 73.0281 120000.0 73.1923 2500.0 73.9087 2300.0 74.0598 67000.0 75.0303 9700.0 75.2997 2600.0 75.5218 2100.0 75.7677 2300.0 75.9329 2700.0 76.3485 2200.0 76.5846 2200.0 77.0414 73000.0 77.1791 2500.0 77.3816 2300.0 77.9948 2300.0 78.6272 2400.0 78.7815 2400.0 78.9022 2100.0 80.1515 2300.0 80.3838 2200.0 80.3971 2500.0 81.5548 2800.0 81.7058 2000.0 81.9578 2200.0 82.1035 2200.0 82.2444 2300.0 84.8037 2300.0 84.8305 2100.0 86.0599 5300.0 86.33 2600.0 87.0622 170000.0 88.1862 2200.0 89.1212 2600.0 89.3785 2200.0 89.7009 2400.0 90.4253 2200.0 91.0548 2200.0 91.0715 2700.0 91.1676 2200.0 91.2284 2400.0 92.4028 2500.0 92.5876 2100.0 92.9481 2100.0 93.0363 64000.0 94.8568 2300.0 95.0153 6600.0 95.0867 2300.0 95.2698 2500.0 96.8446 2600.0 97.4091 2600.0 97.7099 2200.0 98.7703 2800.0 98.8604 2400.0 99.4347 2200.0 99.9525 2900.0 101.7115 2500.0 101.802 2400.0 103.0572 5400.0 103.8251 2100.0 104.0703 520000.0 105.0726 850000.0 105.3623 2300.0 105.6791 2300.0 106.6215 2600.0 106.8669 2700.0 107.0519 310000.0 107.293 2500.0 109.0312 38000.0 111.0096 2600.0 112.0843 2600.0 112.299 2800.0 113.8172 2700.0 113.8994 2800.0 114.2594 2700.0 114.347 2200.0 114.3659 2400.0 114.8552 2500.0 115.0935 220000.0 115.1061 2400.0 115.2253 2200.0 115.2914 2900.0 115.9107 2200.0 117.0728 15000.0 118.1821 2300.0 118.7693 2800.0 120.0708 2700.0 120.701 2500.0 120.9904 2500.0 121.0677 14000.0 124.4113 2400.0 124.7383 4900.0 129.842 2200.0 130.9582 2700.0 130.9844 2400.0 133.104 490000.0 133.1927 2400.0 134.2042 2800.0 135.0832 290000.0 136.2301 2200.0 136.3107 2500.0 137.2013 2300.0 137.6454 2300.0 139.21 2800.0 141.2943 2100.0 142.9583 2600.0 143.0884 30000.0 143.3672 2500.0 144.507 2200.0 145.368 2500.0 145.9099 2500.0 146.4943 3000.0 147.9745 2400.0 148.4533 2500.0 149.681 13000.0 149.6909 25000.0 150.6639 2300.0 154.3653 2600.0 157.1808 2300.0 157.6281 2400.0 164.1862 2200.0 164.3328 2200.0 166.4925 2600.0 166.6615 2700.0 167.169 2600.0 167.466 2300.0 168.8895 2300.0 168.9681 2700.0 169.4993 2300.0 170.231 2500.0 171.1205 11000.0 171.6895 2300.0 172.8082 2700.0 173.1716 2500.0 173.5236 120000.0 173.5362 410000.0 173.549 5000.0 174.4364 2300.0 175.9072 2300.0 178.1217 2800.0 179.0715 3000.0 179.7948 2300.0 180.1102 3900.0 181.9027 3000.0 184.0347 2500.0 184.1105 2300.0 188.5522 2300.0 190.284 2100.0 193.9139 2500.0 194.221 2600.0 194.8533 2500.0 199.6916 2400.0 201.3898 2800.0 202.4043 2900.0 204.4026 2500.0 213.0787 2500.0 228.4653 2300.0 230.7708 2600.0 233.091 3200.0 235.8972 2400.0 240.7742 2400.0 241.3473 2600.0 245.4602 2600.0 246.8131 2800.0 END IONS BEGIN IONS SCANS=745 PEPMASS=357.2427 CHARGE=1 COLLISION_ENERGY=0.0 51.031 2500.0 51.1941 5400.0 52.8802 2600.0 53.0022 47000.0 53.0387 58000.0 54.3602 5300.0 54.9852 2400.0 55.0542 1400000.0 57.0698 720000.0 57.4306 4300.0 59.0137 12000.0 62.1392 2300.0 63.2204 3000.0 64.4374 5700.0 65.0387 21000.0 67.0501 4800.0 67.0542 1500000.0 68.9757 2200.0 69.0699 5800000.0 69.0733 7800.0 69.4984 4500.0 69.9149 4600.0 70.2272 2100.0 70.6614 8900.0 70.7663 2600.0 70.8153 3800.0 71.0855 120000.0 72.8109 3000.0 74.8509 4300.0 77.0393 50000.0 78.0481 3000.0 79.0542 500000.0 81.0699 7400000.0 81.0742 14000.0 82.6882 2000.0 83.0855 1500000.0 83.0913 4700.0 83.5111 5900.0 85.1012 70000.0 85.233 2300.0 86.3657 2400.0 91.0543 240000.0 93.0698 930000.0 94.0425 2600.0 95.0495 79000.0 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930000.0 235.133 410000.0 237.129 4500.0 241.1224 450000.0 241.1583 110000.0 243.1381 420000.0 245.1174 470000.0 247.1329 400000.0 249.1479 79000.0 249.1767 3200.0 251.1433 18000.0 255.138 260000.0 257.1535 110000.0 259.1329 360000.0 261.1484 880000.0 269.1539 240000.0 273.1486 410000.0 275.1357 3000.0 275.1644 380000.0 281.7283 5900.0 283.1691 57000.0 287.1645 170000.0 289.1804 140000.0 297.2217 45000.0 301.18 140000.0 307.206 33000.0 315.1964 39000.0 325.1812 3200.0 325.2164 1700000.0 325.2594 13000.0 357.1888 5400.0 357.2423 7900000.0 357.3155 8600.0 357.3453 5000.0 END IONS BEGIN IONS SCANS=746 PEPMASS=625.2662 CHARGE=1 COLLISION_ENERGY=0.0 64.5847 6900.0 66.4383 2600.0 67.4709 5500.0 69.4722 7900.0 69.4758 5700.0 73.2122 4100.0 77.2787 4000.0 79.6861 6200.0 82.8434 2300.0 85.3998 2600.0 90.577 2300.0 90.5889 2400.0 129.9458 2400.0 166.4727 2300.0 168.1945 2300.0 173.5265 28000.0 173.5354 140000.0 173.5454 10000.0 174.3545 2400.0 177.7279 2400.0 179.1002 3100.0 188.9941 5200.0 197.7994 5400.0 200.1777 2800.0 203.7645 4400.0 232.1306 3800.0 237.1391 3300.0 239.1555 6900.0 244.0315 2500.0 248.0787 2700.0 268.1217 6100.0 269.1278 5500.0 281.1277 17000.0 287.2703 2800.0 293.6461 4400.0 302.5005 3700.0 357.1435 8900.0 364.1578 2600.0 368.1746 7900.0 370.1964 4400.0 375.1948 7000.0 386.1895 5700.0 388.2031 48000.0 400.2055 36000.0 405.2108 4500.0 407.2228 84000.0 412.1645 5400.0 419.2244 7700.0 420.2309 240000.0 421.2389 150000.0 422.2472 110000.0 433.2392 14000.0 434.2483 30000.0 435.2543 14000.0 447.2332 5400.0 448.2289 2600.0 448.2623 49000.0 449.2694 110000.0 451.2128 700000.0 451.2679 3100.0 451.281 4900.0 452.2203 54000.0 459.2542 18000.0 460.2248 16000.0 461.2326 53000.0 462.2398 7100.0 463.2446 11000.0 464.2185 30000.0 465.1522 16000.0 465.2284 920000.0 465.3054 14000.0 466.1704 2500.0 466.2359 740000.0 474.2036 18000.0 475.2052 5000.0 475.2187 11000.0 475.2467 98000.0 476.2545 58000.0 476.2628 6600.0 477.194 16000.0 477.2367 18000.0 477.264 220000.0 478.2363 20000.0 479.2442 130000.0 487.2097 13000.0 488.219 50000.0 491.21 110000.0 492.2179 560000.0 493.2594 1300000.0 494.2671 510000.0 501.2272 40000.0 502.2353 43000.0 502.762 3200.0 503.1591 4000.0 503.2436 910000.0 503.3076 8900.0 504.2477 220000.0 505.225 52000.0 506.2312 34000.0 507.2367 3500.0 509.2183 290000.0 509.2924 7200.0 511.2314 10000.0 519.2375 63000.0 520.2454 36000.0 521.1603 15000.0 521.2544 1500000.0 521.3285 2100.0 522.2609 120000.0 523.1448 16000.0 523.2336 640000.0 523.3026 3500.0 524.2352 7100.0 526.2574 110000.0 529.2219 4300.0 531.2412 11000.0 534.227 56000.0 535.2319 7900.0 535.2738 14000.0 536.2413 19000.0 537.2493 660000.0 538.2573 4200000.0 547.1361 4300.0 547.2338 610000.0 548.2411 110000.0 549.2501 81000.0 550.2209 23000.0 551.2279 14000.0 563.2653 29000.0 565.1399 14000.0 565.245 2200000.0 566.2522 310000.0 566.3439 5900.0 567.3702 15000.0 575.2331 11000.0 579.2598 120000.0 581.2763 510000.0 589.2447 10000.0 593.2383 7600.0 597.2568 6500.0 607.2551 390000.0 610.2321 7800.0 625.2657 740000.0 625.3906 11000.0 END IONS BEGIN IONS SCANS=747 PEPMASS=667.2765 CHARGE=1 COLLISION_ENERGY=0.0 67.4708 16000.0 67.4744 5400.0 68.3508 5500.0 69.0289 40000.0 69.032 13000.0 72.1383 12000.0 72.142 36000.0 74.1392 3000.0 74.678 5200.0 75.581 5500.0 92.2523 2700.0 93.8141 2400.0 95.151 6800.0 96.224 2400.0 102.737 2400.0 113.849 2900.0 124.328 2600.0 125.1165 6400.0 129.0708 5900.0 138.6369 5400.0 144.4602 2500.0 173.5221 24000.0 173.5328 65000.0 173.5414 30000.0 174.3476 5200.0 192.1009 2900.0 193.7881 2400.0 197.7945 5200.0 212.0979 5400.0 242.0622 2700.0 242.2051 6400.0 289.0856 3100.0 330.16 4400.0 344.9021 6600.0 358.7556 2700.0 370.1552 52000.0 374.1551 7500.0 382.1545 12000.0 407.2227 38000.0 414.1459 91000.0 420.1933 14000.0 420.5626 6000.0 421.2027 78000.0 424.2021 9600.0 426.1458 15000.0 434.2112 93000.0 435.2187 280000.0 435.2846 8500.0 436.2262 180000.0 442.2179 7200.0 446.2137 5800.0 447.2182 68000.0 448.2201 5200.0 449.2351 7700.0 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552.2695 62000.0 557.2184 15000.0 561.2421 310000.0 562.2538 77000.0 562.3737 2900.0 563.266 2000000.0 564.2707 29000.0 565.2458 270000.0 571.2314 34000.0 573.2495 38000.0 575.2298 24000.0 578.2499 36000.0 579.2594 210000.0 580.1568 20000.0 580.1882 4300.0 580.2688 1500000.0 581.2744 6300.0 585.2081 3300.0 588.2386 5500.0 589.2452 1800000.0 590.1406 3300.0 590.1676 2400.0 590.2533 510000.0 590.3602 14000.0 591.2605 22000.0 593.2659 70000.0 595.2927 22000.0 603.227 41000.0 605.2763 41000.0 606.2495 12000.0 607.2557 480000.0 608.2563 4200.0 611.2726 7300.0 617.2405 62000.0 621.271 1300000.0 623.288 77000.0 631.255 72000.0 634.2438 6800.0 639.2819 47000.0 649.1652 6700.0 649.266 1200000.0 667.2765 51000.0 END IONS BEGIN IONS SCANS=748 PEPMASS=689.2584 CHARGE=1 COLLISION_ENERGY=0.0 83.2148 2900.0 84.0708 2500.0 86.277 2600.0 88.4959 2900.0 89.0592 7900.0 95.085 3000.0 114.1186 2800.0 126.3895 2600.0 133.0853 3400.0 157.4471 2600.0 173.5294 56000.0 173.5457 5000.0 201.1456 3100.0 274.9046 2800.0 280.0904 2300.0 369.9138 2300.0 407.2233 14000.0 420.1949 6600.0 434.2082 25000.0 435.2171 52000.0 448.2209 2200.0 456.1863 2600.0 463.249 16000.0 489.2284 10000.0 491.2398 4700.0 495.2156 4300.0 501.187 9500.0 511.2098 12000.0 512.1806 25000.0 517.2224 320000.0 517.314 3600.0 535.2366 25000.0 539.2046 9100.0 557.2513 19000.0 558.2569 3500.0 563.2645 1400000.0 567.2303 3200.0 581.2755 12000.0 585.2461 140000.0 601.2412 5600.0 602.2479 24000.0 612.2363 5900.0 613.2427 33000.0 615.2222 6000.0 629.2372 8100.0 630.2449 45000.0 645.2666 14000.0 END IONS BEGIN IONS SCANS=749 PEPMASS=448.3639 CHARGE=1 COLLISION_ENERGY=0.0 56.1302 2300.0 56.1387 2500.0 57.9214 2300.0 58.6192 2200.0 58.8512 2400.0 59.7031 2300.0 60.0278 2200.0 63.8521 2200.0 65.6 2500.0 66.3655 2000.0 66.7877 2200.0 70.7099 2400.0 76.001 2300.0 76.8103 2200.0 80.8778 2600.0 81.7383 2300.0 88.1315 2700.0 95.1567 2100.0 96.0153 2200.0 99.7379 2200.0 102.179 2100.0 105.9304 2400.0 106.3966 2400.0 107.7024 2500.0 118.4405 2600.0 149.8973 2600.0 151.3147 2400.0 151.5465 2500.0 155.9779 2600.0 169.0854 2500.0 171.1378 63000.0 171.1824 2500.0 173.5236 46000.0 173.5403 56000.0 173.9365 2400.0 180.1935 2400.0 188.0222 2200.0 196.7169 2500.0 197.0462 2900.0 198.7172 2200.0 216.3722 2300.0 234.7831 2500.0 258.3748 2500.0 269.4903 2500.0 435.8618 3000.0 458.4554 2500.0 END IONS BEGIN IONS SCANS=750 PEPMASS=600.4173 CHARGE=1 COLLISION_ENERGY=0.0 63.8156 2200.0 64.6578 2800.0 65.7149 2500.0 65.9186 2300.0 67.054 60000.0 67.1023 2300.0 69.0333 62000.0 69.0697 65000.0 71.0491 11000.0 71.8718 2300.0 72.4525 2300.0 74.055 2500.0 74.8355 2400.0 76.2235 2300.0 78.0466 2500.0 79.054 75000.0 80.0553 2200.0 81.0696 210000.0 82.387 2300.0 83.0488 100000.0 83.0852 80000.0 84.6463 2200.0 85.0646 45000.0 86.8268 3000.0 87.0438 32000.0 87.4927 2300.0 89.0593 320000.0 91.054 87000.0 93.0695 360000.0 93.6496 2300.0 95.0488 140000.0 95.0852 270000.0 95.3265 2200.0 96.0888 3000.0 97.0645 100000.0 97.1011 6300.0 98.8688 2300.0 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250.1571 3400.0 250.1685 3100.0 251.1431 37000.0 251.1785 59000.0 252.1497 10000.0 252.1837 7600.0 253.1585 100000.0 253.1916 19000.0 255.1443 2900.0 255.1739 240000.0 256.1802 6400.0 257.1544 22000.0 257.1888 20000.0 258.1385 3800.0 258.162 4200.0 259.1442 13000.0 259.1697 60000.0 260.1545 4300.0 261.1629 130000.0 262.1705 4000.0 263.143 15000.0 263.179 70000.0 264.1839 10000.0 265.1588 32000.0 265.194 31000.0 267.1745 55000.0 268.1821 32000.0 269.1555 13000.0 269.1897 56000.0 270.1964 20000.0 271.1694 92000.0 271.2 2800.0 272.178 3400.0 273.1583 7700.0 273.1872 47000.0 274.1927 66000.0 275.1447 2800.0 275.179 36000.0 277.1602 18000.0 277.1947 50000.0 278.1681 3600.0 279.1746 100000.0 279.2061 3200.0 280.1788 4000.0 281.1568 6800.0 281.1899 97000.0 282.195 8500.0 283.1698 15000.0 283.2059 11000.0 285.1851 94000.0 286.1677 2400.0 286.1927 170000.0 287.2008 130000.0 289.1943 28000.0 290.1982 2600.0 291.1759 14000.0 291.2108 22000.0 293.1899 20000.0 294.1982 32000.0 295.1703 9100.0 295.2061 82000.0 297.1849 91000.0 298.1938 12000.0 299.2004 130000.0 300.2054 15000.0 301.1935 18000.0 303.1961 340000.0 305.1897 6500.0 305.2273 4100.0 307.1685 2800.0 307.2056 35000.0 309.1843 39000.0 309.2215 9000.0 310.1921 25000.0 311.2004 42000.0 312.208 45000.0 313.2161 100000.0 315.2109 8300.0 319.2059 58000.0 321.2223 3900.0 322.2293 23000.0 323.2001 8900.0 325.2162 100000.0 331.206 8500.0 333.2213 3300.0 334.2271 4400.0 335.1976 3500.0 337.2161 180000.0 339.2314 3800.0 341.2252 2900.0 347.2368 29000.0 349.2146 3300.0 351.232 10000.0 352.2395 480000.0 353.2454 12000.0 359.237 9600.0 363.2302 14000.0 365.2471 220000.0 366.2537 3200.0 373.2519 2500.0 377.2473 42000.0 378.2531 4200.0 379.2666 2800.0 383.2581 2800.0 387.271 12000.0 397.2743 3000.0 399.2548 3900.0 403.265 2700.0 408.4413 2400.0 415.2754 3400.0 419.2928 3300.0 425.0023 2400.0 425.2719 3800.0 426.1522 2400.0 437.3026 5800.0 441.6528 2800.0 469.3129 10000.0 487.3216 88000.0 502.3433 7700.0 503.3516 120000.0 505.3314 67000.0 507.3469 42000.0 508.3508 30000.0 520.3548 59000.0 521.3512 2700.0 550.6197 2600.0 573.2586 2700.0 585.3969 11000.0 600.4128 13000.0 END IONS BEGIN IONS SCANS=751 PEPMASS=583.4151 CHARGE=1 COLLISION_ENERGY=0.0 66.3625 2700.0 67.0539 19000.0 69.0696 16000.0 74.6697 2100.0 75.82 2200.0 77.6879 2400.0 78.9904 2100.0 79.0539 23000.0 81.0696 55000.0 81.6367 2400.0 83.049 17000.0 83.0851 45000.0 85.0641 2600.0 88.35 2100.0 90.5245 2200.0 90.8449 2600.0 91.0539 27000.0 93.0695 70000.0 95.0488 15000.0 95.0852 61000.0 97.0644 37000.0 104.9213 2800.0 105.0695 71000.0 107.0852 93000.0 109.0647 5100.0 109.1008 45000.0 111.0801 2600.0 113.096 19000.0 117.0697 3300.0 119.0768 2700.0 119.0851 130000.0 121.1008 97000.0 123.0801 22000.0 123.1165 8600.0 125.096 12000.0 129.0691 7900.0 131.0852 48000.0 133.1008 76000.0 135.0802 5700.0 135.1166 31000.0 137.0956 14000.0 139.1113 35000.0 142.0766 2800.0 143.0853 38000.0 144.0925 2800.0 145.1009 100000.0 147.0803 17000.0 147.1166 56000.0 149.0966 7100.0 149.1328 5200.0 149.6845 5300.0 149.6945 3400.0 149.7704 2300.0 151.0749 3000.0 153.1262 5900.0 155.0851 18000.0 156.0935 4100.0 157.1008 96000.0 158.1083 6500.0 158.6223 2500.0 159.1165 53000.0 161.1318 17000.0 163.1113 9800.0 165.0911 34000.0 167.0858 2800.0 167.1064 10000.0 169.1011 33000.0 171.1166 55000.0 173.1325 47000.0 173.5339 66000.0 175.148 22000.0 179.0857 2700.0 179.141 2800.0 180.0937 2600.0 181.1015 18000.0 181.1214 18000.0 183.1169 44000.0 184.1248 3300.0 184.7695 2500.0 185.1323 34000.0 187.1477 17000.0 189.1287 2300.0 191.1436 9700.0 193.1014 3400.0 194.109 7100.0 195.1166 28000.0 196.124 7900.0 197.1321 44000.0 199.1481 28000.0 201.1262 2600.0 201.1632 6600.0 203.143 15000.0 205.1574 2600.0 207.1167 22000.0 207.1378 4300.0 208.1241 3300.0 209.1324 53000.0 210.14 3100.0 211.1128 2700.0 211.1485 24000.0 219.1168 2900.0 221.132 22000.0 221.1539 33000.0 223.1475 26000.0 225.1638 11000.0 233.1321 12000.0 233.1564 3000.0 235.1485 17000.0 237.1637 6500.0 245.1321 4200.0 246.1409 3200.0 247.1466 8700.0 249.1637 13000.0 251.1785 3600.0 259.1465 2900.0 261.1632 12000.0 263.1787 7700.0 265.1944 7100.0 267.0296 2700.0 267.1751 2700.0 269.1894 3100.0 273.1609 2500.0 275.1795 16000.0 281.1895 2800.0 281.2956 66000.0 282.2796 240000.0 283.2829 250000.0 285.1859 9000.0 291.7259 2500.0 299.2008 2700.0 299.3059 75000.0 300.3088 78000.0 385.7383 2600.0 394.7108 2500.0 435.7137 2600.0 449.8352 2200.0 491.3491 2700.0 494.7494 2700.0 532.9865 2500.0 540.6093 2800.0 583.4113 3000.0 END IONS BEGIN IONS SCANS=752 PEPMASS=279.0938 CHARGE=1 COLLISION_ENERGY=0.0 46.0109 2100.0 47.8154 2200.0 49.6179 2700.0 50.6342 2300.0 50.874 2400.0 55.0541 2800.0 56.6318 2300.0 57.0697 44000.0 57.8113 2700.0 59.5411 2300.0 61.9027 2100.0 61.963 2100.0 62.5264 2400.0 62.7185 2300.0 62.7435 2100.0 64.3886 2400.0 65.4462 2200.0 65.8514 2200.0 67.008 2200.0 67.0541 15000.0 69.5827 2100.0 70.2664 2200.0 70.9935 2000.0 73.0648 2400.0 75.0596 2200.0 75.8577 2500.0 78.409 2400.0 79.4665 2200.0 81.0698 22000.0 81.9555 2300.0 87.2893 2300.0 91.5051 2700.0 93.0691 2500.0 93.1294 3500.0 95.0495 2800.0 95.0854 12000.0 102.8576 2300.0 103.4901 2500.0 104.4013 2600.0 105.9643 2800.0 107.0857 3800.0 107.7931 2400.0 109.1013 6800.0 118.5942 2400.0 118.6064 2300.0 121.1005 3600.0 123.7465 2400.0 126.1238 2400.0 132.479 2200.0 137.6475 2500.0 141.5025 2900.0 143.699 2400.0 146.6905 2700.0 149.0232 490000.0 149.6899 5400.0 149.819 3000.0 151.0753 79000.0 156.5567 2500.0 157.8894 2500.0 159.8458 2500.0 164.1842 3000.0 167.6663 2500.0 169.4897 2200.0 173.0514 38000.0 173.5249 34000.0 173.5346 160000.0 173.5458 10000.0 182.8965 2600.0 184.1688 2300.0 187.0472 2400.0 191.0308 2500.0 201.0464 340000.0 203.6826 2300.0 206.0535 7600.0 219.0319 6300.0 219.0571 1900000.0 219.0819 40000.0 219.3651 2400.0 220.2932 2700.0 231.2909 2600.0 239.6154 3000.0 255.4837 2300.0 262.7467 2600.0 279.0579 22000.0 279.0935 1400000.0 279.127 13000.0 279.171 3300.0 279.2296 3100.0 279.6489 2900.0 END IONS BEGIN IONS SCANS=753 PEPMASS=282.2796 CHARGE=1 COLLISION_ENERGY=0.0 46.7356 2100.0 49.5396 2200.0 53.0386 5700.0 53.5536 2200.0 55.0176 42000.0 55.054 600000.0 55.0571 4800.0 57.0333 24000.0 57.0697 620000.0 58.0649 21000.0 60.0444 3600.0 64.1141 2300.0 67.0539 180000.0 67.59 2100.0 69.0331 12000.0 69.0696 960000.0 69.0738 6500.0 69.0761 4600.0 69.7969 2500.0 70.0649 9300.0 71.0489 20000.0 71.0852 270000.0 72.0441 36000.0 72.0805 78000.0 72.2822 2900.0 73.1104 2100.0 79.0539 92000.0 79.6614 2200.0 81.0695 310000.0 83.0488 47000.0 83.0852 670000.0 83.0909 3500.0 84.0805 15000.0 85.0644 12000.0 85.1008 97000.0 86.0597 130000.0 86.0961 39000.0 89.5764 3000.0 91.0538 5300.0 91.6289 2600.0 92.0749 2400.0 93.0696 200000.0 95.0852 300000.0 96.0809 2700.0 97.0582 3500.0 97.0644 180000.0 97.0901 3000.0 97.1008 470000.0 97.3978 2300.0 99.0801 4500.0 100.0601 2500.0 100.0753 210000.0 100.1117 7900.0 101.9611 2300.0 104.1128 2200.0 107.0852 170000.0 109.1009 150000.0 110.096 2300.0 111.0801 140000.0 111.1165 120000.0 111.1251 4700.0 113.3624 2300.0 114.091 140000.0 114.1275 3400.0 121.1009 190000.0 121.2168 2400.0 123.1165 37000.0 125.0959 77000.0 125.1322 9800.0 125.2704 2600.0 128.1067 54000.0 134.096 78000.0 135.1055 3900.0 135.1166 160000.0 137.1324 5700.0 139.1114 41000.0 142.1229 15000.0 149.1322 84000.0 151.1492 4900.0 153.1269 19000.0 155.0221 2400.0 156.1384 7000.0 158.1068 2400.0 163.148 33000.0 164.6706 2300.0 167.1421 6000.0 170.155 3400.0 173.5281 110000.0 173.5383 17000.0 173.5466 13000.0 177.1636 11000.0 191.1788 4300.0 195.1559 2900.0 205.1954 3100.0 207.8865 3900.0 210.1294 3700.0 211.135 21000.0 214.3465 2400.0 217.8709 3100.0 234.0793 2500.0 240.2689 31000.0 247.243 14000.0 265.2528 12000.0 278.9111 3000.0 282.1877 4000.0 282.2218 200000.0 282.277 13000.0 285.0625 2400.0 END IONS BEGIN IONS SCANS=754 PEPMASS=651.2819 CHARGE=1 COLLISION_ENERGY=0.0 66.8044 210000.0 66.8066 37000.0 67.2507 3600.0 70.3627 74000.0 74.1198 16000.0 100.9083 21000.0 104.5612 3300.0 110.9619 16000.0 131.2165 23000.0 137.3996 3100.0 138.2153 9100.0 143.3065 65000.0 143.3182 63000.0 146.6814 11000.0 173.5301 640000.0 173.5409 23000.0 228.9932 3400.0 289.8691 3600.0 359.1573 10000.0 393.205 4500.0 407.2247 4900.0 415.1892 42000.0 421.2027 12000.0 429.2113 78000.0 430.2167 4200.0 431.218 12000.0 435.2159 68000.0 436.2266 36000.0 443.2254 77000.0 444.1954 260000.0 445.1998 68000.0 455.2275 3500.0 456.2026 18000.0 457.2027 140000.0 458.21 240000.0 459.2173 150000.0 461.2266 13000.0 462.2443 9100.0 471.2175 360000.0 472.224 290000.0 473.1978 1300000.0 474.2067 6600.0 475.2109 20000.0 483.2166 4200.0 485.1979 180000.0 486.2051 550000.0 487.1495 4900.0 487.2125 5500000.0 488.2199 18000.0 489.2254 180000.0 490.1902 12000.0 490.2078 16000.0 491.2067 6200.0 498.2063 5500.0 499.2127 1900000.0 499.2954 4800.0 500.2147 360000.0 501.2274 520000.0 502.2075 4900.0 502.227 17000.0 503.2078 50000.0 505.2286 16000.0 511.2145 22000.0 513.1916 330000.0 514.201 110000.0 515.2001 4000.0 516.2166 120000.0 517.2252 980000.0 518.223 94000.0 519.2045 24000.0 527.2075 980000.0 528.136 21000.0 528.2162 260000.0 529.2232 800000.0 529.3157 4000.0 530.2272 4300.0 531.2065 54000.0 531.2347 130000.0 532.2131 6600.0 533.224 56000.0 535.2725 6100.0 536.2776 8100.0 544.2333 30000.0 544.2452 10000.0 545.2371 2100000.0 549.248 7200.0 555.2068 110000.0 557.2549 380000.0 558.2267 70000.0 559.2354 56000.0 563.2646 390000.0 564.2707 67000.0 573.0379 170000.0 573.0818 130000.0 573.2497 41000000.0 573.4197 72000.0 573.4628 280000.0 574.2536 120000.0 575.2604 79000.0 577.2509 4200.0 587.239 5400.0 589.2445 22000.0 590.2523 11000.0 591.258 18000.0 592.2717 29000.0 601.2445 6400000.0 605.2624 310000.0 619.2546 60000.0 623.2847 9800.0 633.1503 17000.0 633.2704 1900000.0 633.3628 17000.0 651.2838 110000.0 END IONS BEGIN IONS SCANS=755 PEPMASS=673.2638 CHARGE=1 COLLISION_ENERGY=0.0 67.9408 5800.0 68.1375 230000.0 68.1402 30000.0 68.2513 2800.0 69.5572 11000.0 71.2462 18000.0 71.2492 140000.0 72.8036 2600.0 72.8059 43000.0 74.8067 420000.0 74.8095 34000.0 76.3529 9800.0 76.9671 3800.0 78.2675 6800.0 80.6373 10000.0 80.8087 7100.0 80.894 9700.0 81.7671 6000.0 87.0434 12000.0 87.7444 2100.0 89.035 6400.0 89.0591 290000.0 89.1145 2300.0 90.0623 24000.0 91.1724 9200.0 92.857 13000.0 102.9216 5900.0 103.8786 6200.0 114.3276 2400.0 122.7554 8900.0 123.7045 12000.0 125.553 10000.0 130.8816 10000.0 133.0852 130000.0 134.0873 6300.0 141.752 3600.0 145.0731 6900.0 158.4293 6100.0 160.2413 12000.0 168.3094 2400.0 168.3235 2600.0 173.5324 500000.0 173.5458 26000.0 175.1846 11000.0 175.5126 2400.0 178.1142 6000.0 180.3284 11000.0 189.5905 2400.0 189.9128 13000.0 196.466 10000.0 204.521 2400.0 211.7305 6200.0 213.3717 6600.0 225.0673 5400.0 261.0767 6500.0 294.8493 5800.0 336.0174 6600.0 359.3191 12000.0 372.2763 11000.0 393.7952 3800.0 403.559 6800.0 434.0812 6900.0 443.184 3500.0 444.8248 7600.0 457.1998 89000.0 458.208 57000.0 484.2207 4200.0 486.2354 4300.0 496.1853 47000.0 497.1928 40000.0 510.2056 9800.0 512.1821 31000.0 513.1894 95000.0 514.1975 97000.0 522.1642 38000.0 523.0624 9900.0 523.1871 31000.0 523.2037 30000.0 524.2211 11000.0 525.2223 10000.0 527.2123 2700.0 529.2208 14000.0 529.5708 3600.0 531.2025 91000.0 535.1733 200000.0 536.1795 8000.0 538.0699 6000.0 540.1767 220000.0 541.1827 10000.0 549.1786 5900.0 550.2 66000.0 551.205 1800000.0 551.3012 8100.0 552.2126 130000.0 552.9803 4100.0 553.185 390000.0 554.1917 170000.0 555.2041 96000.0 557.1741 31000.0 557.2594 19000.0 565.2191 11000.0 567.1946 15000.0 567.2121 2900.0 569.2484 190000.0 572.2006 23000.0 573.2501 100000.0 575.2652 150000.0 577.1849 49000.0 579.2367 8800.0 583.2303 20000.0 585.2124 22000.0 585.2222 120000.0 595.2162 260000.0 597.2471 820000.0 597.353 12000.0 597.6241 12000.0 599.2213 30000.0 601.2452 69000.0 609.2091 11000.0 613.2415 6600000.0 614.2498 990000.0 614.3651 4200.0 615.2544 19000.0 623.2259 350000.0 627.2224 3100.0 627.2369 7500.0 629.2725 440000.0 633.2718 95000.0 641.1119 41000.0 641.2366 4200000.0 642.2427 10000.0 645.2415 14000.0 645.2475 90000.0 655.1347 19000.0 655.1534 5200.0 655.2523 1300000.0 655.3785 6400.0 656.2614 55000.0 658.2443 2900.0 673.2623 11000000.0 673.5272 8300.0 674.2676 5400.0 END IONS BEGIN IONS SCANS=756 PEPMASS=689.2377 CHARGE=1 COLLISION_ENERGY=0.0 71.0714 2400.0 76.0237 2500.0 78.8226 2300.0 79.6567 2500.0 79.7287 2400.0 87.3416 2300.0 89.0595 21000.0 91.576 2800.0 98.7787 2400.0 104.7122 2500.0 108.5038 2300.0 111.7977 2500.0 114.3449 2600.0 115.9974 2300.0 133.0859 5100.0 163.1384 2400.0 169.964 2700.0 173.5247 17000.0 173.5339 92000.0 173.5434 10000.0 224.2589 2400.0 228.9642 2700.0 307.8921 2800.0 353.6892 2500.0 370.4028 2700.0 388.2347 2300.0 391.3879 2600.0 428.3987 2200.0 436.0749 2500.0 462.2109 2400.0 485.2538 3000.0 537.231 3200.0 543.1336 10000.0 559.2087 7100.0 563.2621 3200.0 577.2197 2800.0 585.2506 3600.0 593.21 5700.0 602.2531 4900.0 603.1989 7500.0 629.1693 8300.0 641.327 2800.0 END IONS BEGIN IONS 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234.7103 2400.0 238.5956 2600.0 240.4817 2400.0 241.1828 2200.0 244.9577 2300.0 248.1368 2700.0 248.7583 2900.0 251.5211 2700.0 253.951 2900.0 256.0269 2700.0 256.4026 2800.0 256.9247 2400.0 263.2366 3000.0 266.0683 2800.0 267.4118 2600.0 267.9314 3100.0 275.611 2400.0 278.1642 2100.0 287.7996 2600.0 291.7987 2600.0 294.9874 2700.0 295.825 2400.0 302.4054 2500.0 305.8598 2400.0 305.8795 3300.0 314.3692 3000.0 319.2086 2700.0 320.9272 2300.0 340.6665 2600.0 346.517 2500.0 346.5389 2400.0 348.674 2400.0 352.0481 2700.0 367.6254 2900.0 370.3127 2600.0 376.3138 2400.0 382.413 3000.0 382.4683 2500.0 384.5884 2400.0 405.1566 2800.0 408.5906 2700.0 413.441 2300.0 416.2304 2600.0 424.3359 2400.0 433.1103 2500.0 438.8775 2700.0 441.2372 2400.0 441.2464 2800.0 442.7159 2600.0 443.2568 6000.0 465.24 26000.0 466.4083 2400.0 483.8034 2800.0 490.8473 2400.0 500.3166 13000.0 502.3284 33000.0 507.2908 2500.0 508.912 2800.0 528.9943 2500.0 532.3139 2500.0 550.2344 2600.0 550.942 2300.0 573.2486 3200.0 575.5048 170000.0 584.586 2400.0 586.7496 2800.0 592.3725 2700.0 592.4824 2600.0 594.159 2800.0 595.3376 2400.0 597.4878 240000.0 604.0056 2800.0 615.0386 2500.0 652.2268 11000.0 657.2272 2800.0 669.6068 2700.0 670.9802 2600.0 673.0823 2800.0 715.2656 3200.0 727.975 2700.0 754.9731 2500.0 758.1958 2900.0 761.2 2500.0 779.7233 2500.0 780.859 2600.0 END IONS BEGIN IONS SCANS=758 PEPMASS=840.5465 CHARGE=1 COLLISION_ENERGY=0.0 78.4662 2300.0 78.8519 2300.0 79.0539 76000.0 80.0423 2100.0 80.1137 2200.0 81.0333 3400.0 81.0695 140000.0 81.2331 2500.0 81.7258 2200.0 83.049 4400.0 83.0852 33000.0 85.0645 3200.0 86.0961 18000.0 89.4776 2200.0 91.0539 59000.0 93.0695 110000.0 95.0489 13000.0 95.0852 130000.0 95.3056 2400.0 97.0645 35000.0 97.1009 20000.0 98.0979 2500.0 98.6686 2400.0 99.0804 2600.0 100.7639 2300.0 104.1062 6200.0 104.2612 2400.0 105.0695 63000.0 107.0851 78000.0 109.0646 5000.0 109.1008 95000.0 111.0803 5800.0 117.0694 16000.0 119.0851 66000.0 120.7673 2700.0 121.0647 3700.0 121.1008 75000.0 122.2951 2500.0 123.0797 3100.0 123.1167 17000.0 124.9995 8800.0 125.0957 9000.0 126.4547 2200.0 131.0852 33000.0 133.1009 62000.0 135.0802 3100.0 135.1166 47000.0 137.0958 13000.0 137.1324 5400.0 143.8062 2500.0 145.1008 44000.0 147.1164 54000.0 149.0958 35000.0 149.1321 23000.0 149.6703 2800.0 149.682 4200.0 149.6918 19000.0 149.7122 3600.0 157.1014 5900.0 159.1164 41000.0 161.1323 28000.0 163.1113 12000.0 163.1482 3600.0 170.8729 2800.0 171.116 6200.0 173.1321 27000.0 173.5193 6300.0 173.5337 120000.0 175.1486 7100.0 179.1431 8500.0 184.0731 240000.0 185.1324 5700.0 193.4155 2400.0 193.7545 2200.0 203.181 2800.0 203.8941 2300.0 209.5186 2300.0 219.3247 3000.0 227.1284 7200.0 240.3658 2400.0 247.2064 7400.0 257.19 19000.0 261.2216 7300.0 275.2004 74000.0 291.1974 5300.0 298.0662 2700.0 335.2586 110000.0 344.2574 2600.0 349.2381 17000.0 353.2691 2900.0 364.2545 2400.0 400.3654 2700.0 456.8634 3000.0 471.2944 2700.0 525.6053 2800.0 565.1072 2500.0 584.2589 3100.0 590.379 2600.0 635.4553 2900.0 691.1631 2800.0 759.2472 2500.0 806.5645 2900.0 821.411 2700.0 840.4965 3200.0 END IONS BEGIN IONS SCANS=759 PEPMASS=609.2714 CHARGE=1 COLLISION_ENERGY=0.0 64.1371 56000.0 64.1399 28000.0 65.6941 260000.0 65.6977 69000.0 66.2399 10000.0 67.6953 260000.0 67.6989 65000.0 68.9546 12000.0 87.2943 5000.0 89.7408 5000.0 107.817 5100.0 108.2459 17000.0 118.3361 13000.0 132.8152 25000.0 134.7775 5500.0 137.639 10000.0 147.2798 15000.0 173.5286 330000.0 173.5422 110000.0 189.0253 16000.0 192.2954 18000.0 219.3464 16000.0 224.131 7800.0 237.1384 8400.0 238.1463 11000.0 239.1548 90000.0 243.3606 11000.0 251.1542 42000.0 263.5247 5700.0 266.8346 5100.0 404.2147 6900.0 405.2068 6900.0 407.2234 160000.0 420.231 150000.0 421.2382 230000.0 422.2462 120000.0 429.2086 8000.0 430.2187 51000.0 433.242 21000.0 434.2467 11000.0 444.2317 83000.0 446.2449 5700.0 447.1825 58000.0 448.2192 25000.0 448.2668 11000.0 449.2346 97000.0 456.1937 6100.0 457.2392 200000.0 458.2056 5500.0 458.249 6600.0 459.2186 1000000.0 460.226 180000.0 461.2002 140000.0 462.2045 44000.0 463.2143 140000.0 470.2127 32000.0 472.225 160000.0 473.2334 97000.0 474.2392 31000.0 475.2149 580000.0 476.2226 970000.0 477.2299 580000.0 478.2363 180000.0 479.2419 56000.0 485.2335 3300000.0 485.3498 24000.0 486.2055 960000.0 487.2449 240000.0 488.223 58000.0 489.2282 380000.0 490.233 8400.0 491.2435 54000.0 492.2535 40000.0 493.2278 26000.0 493.2409 33000.0 493.2557 39000.0 494.2679 440000.0 497.2335 220000.0 499.2136 660000.0 500.2211 350000.0 501.227 84000.0 502.2367 180000.0 503.2437 1500000.0 504.244 590000.0 505.2542 140000.0 507.2165 12000.0 507.2344 74000.0 513.2286 810000.0 514.2353 74000.0 515.2442 4600000.0 516.2148 45000.0 517.2234 310000.0 518.2308 250000.0 519.2392 120000.0 520.2101 31000.0 521.2521 1300000.0 522.2519 190000.0 526.2598 27000.0 530.1953 25000.0 531.0509 100000.0 531.2389 14000000.0 532.2434 99000.0 533.2548 340000.0 534.2245 61000.0 535.2351 180000.0 536.2402 96000.0 541.1286 36000.0 541.2233 1300000.0 544.2104 60000.0 545.2538 44000.0 547.2727 10000.0 548.2423 430000.0 549.1774 14000.0 549.2501 2000000.0 549.3469 20000.0 550.1569 36000.0 550.2577 3400000.0 550.3564 33000.0 553.2834 5900.0 559.2345 8700000.0 563.2653 310000.0 573.2531 28000.0 576.2412 24000.0 577.0902 16000.0 577.1381 35000.0 577.2451 1800000.0 577.3521 11000.0 579.2269 7400.0 580.2322 42000.0 581.2766 210000.0 591.2606 8100000.0 594.2471 170000.0 609.271 8200000.0 END IONS BEGIN IONS SCANS=760 PEPMASS=608.2634 CHARGE=1 COLLISION_ENERGY=0.0 87.2365 2700.0 89.0593 7400.0 102.9268 2300.0 103.11 2600.0 103.9615 2200.0 117.0904 3100.0 134.3581 2300.0 138.7508 2400.0 154.0553 2300.0 173.5191 2900.0 173.5346 71000.0 185.4912 2200.0 200.8907 2200.0 267.6403 2400.0 367.5969 2600.0 419.217 2800.0 420.2308 120000.0 421.2366 6300.0 433.2403 3800.0 434.244 10000.0 445.2425 3500.0 446.2461 5700.0 447.2175 22000.0 448.2201 9300.0 448.2294 3100.0 449.2335 30000.0 452.2215 31000.0 459.2106 4500.0 459.2209 15000.0 460.2254 48000.0 462.2055 14000.0 465.2275 11000.0 473.2004 2800.0 474.2409 37000.0 475.2128 460000.0 476.2203 100000.0 477.23 140000.0 478.2301 3700.0 484.2272 2700.0 485.2346 15000.0 487.2188 15000.0 488.2202 24000.0 489.2275 32000.0 491.2371 3300.0 492.2501 48000.0 493.2195 2300.0 499.2128 7700.0 501.228 18000.0 502.2355 98000.0 503.2438 960000.0 504.2476 65000.0 515.2429 21000.0 516.2125 2700.0 517.2234 26000.0 518.2296 19000.0 519.2347 6200.0 520.2397 8700.0 520.2473 4600.0 521.2526 400000.0 530.2281 14000.0 531.238 63000.0 533.219 17000.0 534.2273 3100.0 535.2333 55000.0 536.242 31000.0 547.2356 16000.0 548.2398 130000.0 549.2497 370000.0 549.3469 10000.0 550.2578 18000.0 558.2274 4600.0 559.2344 41000.0 563.2679 5300.0 565.247 15000.0 577.2451 6300.0 580.2632 14000.0 591.2614 41000.0 593.2407 17000.0 608.2608 33000.0 609.2719 34000.0 END IONS BEGIN IONS SCANS=761 PEPMASS=631.2532 CHARGE=1 COLLISION_ENERGY=0.0 73.1387 2400.0 75.8011 2300.0 84.965 2500.0 89.0594 4600.0 107.4227 2300.0 133.0852 2800.0 134.3011 2700.0 134.3112 2500.0 173.5298 27000.0 205.1536 2400.0 217.1681 2700.0 249.1118 4400.0 447.2525 3900.0 455.2191 5000.0 461.2782 2900.0 469.2348 13000.0 470.2445 8600.0 482.2096 4800.0 483.2503 12000.0 491.2424 6800.0 496.2206 6800.0 497.2323 5200.0 499.2052 5900.0 507.1881 2500.0 508.1871 8400.0 509.2289 11000.0 511.2464 76000.0 513.225 5500.0 514.2371 8100.0 515.2424 13000.0 522.2017 23000.0 527.241 13000.0 531.2452 3000.0 533.2545 38000.0 536.2134 3800.0 537.2256 960000.0 540.214 12000.0 541.2496 4400.0 543.2706 12000.0 553.2189 9100.0 555.2365 110000.0 557.2115 4500.0 558.2202 5500.0 569.2523 18000.0 570.2297 2800.0 571.2322 13000.0 572.2399 21000.0 581.1339 4600.0 581.2159 230000.0 585.5349 4800.0 587.2628 56000.0 591.2631 5700.0 599.2313 3500.0 613.2398 17000.0 631.253 27000.0 END IONS BEGIN IONS SCANS=762 PEPMASS=986.6051 CHARGE=1 COLLISION_ENERGY=0.0 79.0539 100000.0 79.8474 2100.0 81.0332 14000.0 81.0696 180000.0 83.0488 20000.0 83.0852 22000.0 85.028 41000.0 85.0645 3000.0 85.1428 2300.0 91.0386 20000.0 91.0539 88000.0 92.2631 2600.0 93.0639 3200.0 93.0695 150000.0 95.0488 16000.0 95.0793 3700.0 95.0852 150000.0 97.028 25000.0 97.0646 16000.0 97.1009 13000.0 100.3437 2400.0 102.2173 2400.0 105.0695 93000.0 107.0851 110000.0 108.0725 2400.0 109.0641 3300.0 109.1008 110000.0 111.0801 7100.0 111.1169 3400.0 117.0695 43000.0 118.3768 2600.0 119.0851 98000.0 121.0644 5000.0 121.1008 120000.0 123.0797 9300.0 123.1164 23000.0 125.096 2800.0 127.0386 15000.0 129.0543 5200.0 129.0695 14000.0 129.5932 2700.0 131.0852 85000.0 133.1008 130000.0 135.0801 2400.0 135.1073 2400.0 135.1165 93000.0 137.096 6900.0 141.9649 2500.0 142.1985 2400.0 143.0852 15000.0 143.4181 2500.0 145.0493 8500.0 145.062 2400.0 145.1008 76000.0 147.1165 100000.0 149.0958 8000.0 149.1321 48000.0 157.1009 20000.0 159.1166 83000.0 161.1322 67000.0 163.1108 5300.0 163.1482 14000.0 169.1023 2600.0 171.1164 34000.0 173.1325 55000.0 173.5256 71000.0 173.536 100000.0 173.5452 20000.0 175.1312 2300.0 175.1479 23000.0 177.1268 2900.0 183.1166 7300.0 185.1324 22000.0 187.1477 16000.0 189.1649 2900.0 197.1318 5900.0 197.747 2400.0 199.1482 21000.0 201.1077 2500.0 201.1643 2800.0 203.1429 3100.0 211.8674 3000.0 231.2098 4500.0 239.1788 9100.0 241.1952 41000.0 243.2098 6300.0 253.6027 2800.0 257.1895 9500.0 259.2054 130000.0 261.2205 27000.0 275.2007 17000.0 276.2472 3000.0 277.2173 3300.0 293.2112 13000.0 315.2326 10000.0 333.2429 63000.0 335.2584 160000.0 336.253 2800.0 396.2238 2600.0 411.3658 2600.0 425.1259 2300.0 435.85 2500.0 490.1713 2800.0 559.7965 2300.0 597.0234 2500.0 612.9799 2500.0 618.2137 2500.0 640.1785 2900.0 703.845 2900.0 782.0909 2400.0 794.093 2900.0 813.8112 2700.0 826.7396 2600.0 833.9926 3000.0 839.7541 2800.0 873.6842 2400.0 937.8972 2600.0 954.306 2700.0 985.3211 2500.0 END IONS BEGIN IONS SCANS=763 PEPMASS=748.4763 CHARGE=1 COLLISION_ENERGY=0.0 69.0696 15000.0 71.0851 22000.0 71.3412 2500.0 75.7024 2400.0 79.0538 2800.0 81.0694 46000.0 83.0849 28000.0 85.1008 18000.0 87.9954 2500.0 95.085 47000.0 97.1007 9100.0 104.5097 2200.0 107.0849 10000.0 109.1006 35000.0 111.0436 93000.0 111.0801 2900.0 111.116 3000.0 119.0845 4900.0 121.1007 24000.0 123.1164 25000.0 125.0593 23000.0 133.1009 17000.0 135.0803 3200.0 135.1162 33000.0 137.0592 470000.0 137.07 2100.0 137.0772 3200.0 137.132 28000.0 139.4205 2700.0 140.0677 51000.0 147.1163 36000.0 149.0957 28000.0 149.1321 14000.0 149.6881 5100.0 149.7083 3500.0 151.1118 9400.0 159.4804 2600.0 160.7429 2200.0 161.0959 36000.0 161.132 18000.0 162.9172 2300.0 163.1113 26000.0 163.1467 3900.0 165.0906 19000.0 165.1266 2900.0 167.106 7000.0 173.5282 78000.0 173.5414 30000.0 175.1113 28000.0 175.1477 7900.0 177.1271 6500.0 179.1063 33000.0 181.1214 7100.0 189.1265 3000.0 191.8291 2300.0 193.1218 29000.0 193.8934 2100.0 203.1791 99000.0 205.1945 9800.0 207.1373 2900.0 213.0795 2700.0 213.1635 36000.0 221.1897 40000.0 231.1741 200000.0 239.2363 3100.0 241.1585 21000.0 249.1567 4100.0 249.1845 230000.0 259.1655 2400.0 259.9731 2600.0 269.4054 2600.0 273.0797 2400.0 277.1798 820000.0 282.2791 21000.0 295.1907 92000.0 313.2737 150000.0 320.2217 72000.0 340.1655 3100.0 351.2165 57000.0 423.4271 2400.0 507.1234 3000.0 589.447 130000.0 593.5206 2700.0 670.1998 2400.0 742.7817 2900.0 END IONS BEGIN IONS SCANS=764 PEPMASS=657.2921 CHARGE=1 COLLISION_ENERGY=0.0 81.9826 2300.0 98.14 2900.0 99.3093 2400.0 109.0493 2400.0 114.4907 2400.0 129.6068 2400.0 136.9167 2600.0 151.3469 2200.0 152.5498 2600.0 173.5267 60000.0 173.5416 26000.0 203.1183 5200.0 225.8352 2500.0 253.1685 6100.0 295.1784 3100.0 300.7368 2900.0 309.5676 2500.0 311.1748 4300.0 318.1596 10000.0 320.1746 3200.0 332.1762 8700.0 351.1698 22000.0 390.1829 16000.0 409.1947 2800.0 409.203 5600.0 410.2075 9000.0 411.194 9200.0 418.1729 3000.0 422.2165 5100.0 424.2253 14000.0 425.2341 22000.0 430.2532 3200.0 437.2354 14000.0 450.2033 26000.0 451.2134 7100.0 452.2116 5900.0 452.2213 10000.0 453.2277 5900.0 455.2556 3400.0 457.2362 100000.0 464.222 13000.0 465.2302 12000.0 466.2478 6100.0 469.2259 12000.0 470.2509 2800.0 479.2441 16000.0 480.2386 21000.0 481.258 3800.0 482.272 18000.0 483.2726 30000.0 484.2791 24000.0 493.2539 23000.0 494.2422 4900.0 495.2391 17000.0 497.2558 26000.0 498.2676 13000.0 507.2275 3200.0 507.2379 12000.0 508.2586 24000.0 509.2877 19000.0 510.2623 130000.0 511.2703 84000.0 517.257 59000.0 521.2523 4300.0 522.2643 11000.0 523.2403 12000.0 524.2614 3800.0 524.2771 13000.0 525.2833 170000.0 526.2903 100000.0 527.263 42000.0 528.2567 15000.0 529.2486 2800.0 535.2689 21000.0 536.2541 32000.0 537.2531 4300.0 538.2566 41000.0 539.2666 14000.0 541.2807 55000.0 551.2646 27000.0 552.2749 3300.0 553.2805 220000.0 554.2548 13000.0 555.2581 28000.0 563.269 3700.0 565.252 8700.0 567.2599 15000.0 568.2517 7200.0 569.2754 6000.0 570.2832 13000.0 571.2912 26000.0 581.2755 27000.0 585.2719 18000.0 589.2844 3100.0 595.2907 15000.0 596.275 13000.0 597.2602 3200.0 598.2768 8600.0 613.3033 47000.0 614.2747 3000.0 615.2829 22000.0 651.3504 2500.0 657.2747 3200.0 END IONS BEGIN IONS SCANS=765 PEPMASS=584.4224 CHARGE=1 COLLISION_ENERGY=0.0 63.4052 2400.0 66.5135 2800.0 67.054 16000.0 68.5751 2200.0 69.0334 6300.0 69.0696 36000.0 71.0854 19000.0 73.0283 23000.0 73.0645 22000.0 73.9862 2600.0 76.5861 2300.0 79.0539 27000.0 81.0695 84000.0 83.0487 6500.0 83.0852 31000.0 85.0645 7900.0 85.1009 13000.0 85.9083 2300.0 87.0438 80000.0 89.0594 1800000.0 89.0682 18000.0 90.432 2200.0 91.0539 33000.0 93.0695 110000.0 95.0489 27000.0 95.0852 99000.0 95.2474 2100.0 96.0883 3200.0 96.231 2600.0 97.0644 21000.0 98.8385 2500.0 105.0696 100000.0 107.0702 7800.0 107.0852 140000.0 109.0646 16000.0 109.1008 72000.0 111.0804 3700.0 117.0695 16000.0 117.0908 5800.0 119.0768 7700.0 119.0852 210000.0 120.0924 13000.0 121.0646 15000.0 121.1008 140000.0 123.0799 27000.0 123.1164 28000.0 125.096 19000.0 129.0697 10000.0 129.2428 2700.0 131.0699 21000.0 131.0852 92000.0 132.0926 6800.0 133.0741 15000.0 133.0856 960000.0 133.1005 140000.0 134.1078 3000.0 134.4802 2300.0 135.0801 34000.0 135.1164 71000.0 137.0956 17000.0 139.1113 10000.0 142.0773 12000.0 143.0851 84000.0 144.0929 22000.0 145.1009 200000.0 146.1072 10000.0 147.08 20000.0 147.1164 73000.0 149.0957 34000.0 149.1322 8100.0 155.0852 23000.0 156.0928 11000.0 156.914 2600.0 157.1008 150000.0 158.1079 24000.0 159.0801 41000.0 159.1166 140000.0 160.0886 5700.0 160.1232 3800.0 161.0958 49000.0 161.1324 33000.0 163.1114 15000.0 165.0908 20000.0 167.1068 21000.0 169.101 56000.0 170.1082 13000.0 171.1167 100000.0 172.1243 16000.0 173.0958 15000.0 173.1324 110000.0 173.5285 91000.0 173.5424 25000.0 174.1375 3100.0 175.1117 30000.0 175.148 67000.0 177.1119 140000.0 177.1278 18000.0 179.0852 2400.0 180.1148 2800.0 181.1008 33000.0 181.1183 2500.0 182.1093 9000.0 183.1167 84000.0 184.1239 17000.0 185.0958 4000.0 185.1323 73000.0 186.14 11000.0 187.1119 13000.0 187.1288 2400.0 187.148 51000.0 189.1269 15000.0 190.1355 5900.0 191.1429 15000.0 191.9968 2600.0 193.101 16000.0 193.1206 4000.0 194.1088 9900.0 195.1171 64000.0 196.1241 14000.0 197.0976 8000.0 197.1323 100000.0 198.138 13000.0 199.1118 18000.0 199.1478 55000.0 200.1551 2900.0 201.1279 14000.0 201.1632 25000.0 203.1429 36000.0 207.1169 29000.0 207.1373 4100.0 208.1238 13000.0 208.1454 3100.0 209.1325 74000.0 210.1382 6200.0 211.1117 8600.0 211.1482 58000.0 212.1544 2600.0 213.1259 15000.0 213.1641 27000.0 215.1425 18000.0 216.1503 2500.0 217.1584 9800.0 219.1167 3500.0 221.1328 42000.0 221.154 27000.0 222.1399 13000.0 222.3696 2900.0 223.1113 3400.0 223.1481 55000.0 224.1536 6300.0 225.1274 19000.0 225.1639 32000.0 227.143 8900.0 227.5597 3100.0 229.1593 2700.0 231.4148 2400.0 233.1312 10000.0 233.1538 63000.0 234.1396 3200.0 234.1637 3000.0 235.148 38000.0 236.1537 2800.0 237.1295 2900.0 237.1635 37000.0 239.1463 16000.0 239.179 23000.0 241.1586 5200.0 241.1957 4700.0 247.1473 16000.0 247.1703 3800.0 248.1557 12000.0 249.1635 29000.0 250.1718 5800.0 251.1451 3000.0 251.1785 15000.0 253.1587 16000.0 253.1943 9400.0 255.1744 93000.0 257.1888 9100.0 259.1462 6700.0 259.17 3700.0 261.1632 20000.0 263.1792 22000.0 265.162 3300.0 265.1946 13000.0 266.2052 3200.0 267.1758 9400.0 267.2109 3600.0 267.6358 2300.0 269.1909 8000.0 271.2068 2900.0 273.189 3700.0 274.1921 4200.0 275.179 12000.0 277.1946 7700.0 279.1753 6900.0 279.2101 3300.0 281.1913 7200.0 282.2776 12000.0 283.176 3500.0 283.2062 6700.0 283.2828 30000.0 284.2862 13000.0 287.0411 2300.0 287.1764 2600.0 287.2023 5600.0 289.198 3200.0 297.1854 3300.0 299.2018 7600.0 299.3098 3100.0 300.3089 9400.0 327.2029 12000.0 337.2168 5600.0 339.2278 2600.0 345.2184 3900.0 350.0861 2700.0 351.2332 3500.0 352.2401 10000.0 353.2462 5500.0 360.2413 2700.0 365.2474 8300.0 366.2545 4500.0 367.2565 2300.0 371.2264 11000.0 442.8611 2500.0 450.9619 2800.0 502.3092 2500.0 504.3631 8400.0 551.3864 2700.0 END IONS BEGIN IONS SCANS=766 PEPMASS=591.2607 CHARGE=1 COLLISION_ENERGY=0.0 65.6949 250000.0 65.6976 68000.0 71.0851 2400.0 74.3811 2500.0 76.6178 2200.0 77.6136 2700.0 77.9612 2800.0 80.3847 2400.0 95.9042 2500.0 103.2774 2200.0 106.5952 2700.0 112.7473 2300.0 116.7795 2600.0 126.8429 2300.0 147.808 13000.0 147.822 12000.0 154.3024 2800.0 173.5222 27000.0 173.5324 38000.0 173.5413 38000.0 208.7007 2400.0 226.9857 2800.0 240.0339 2800.0 249.5225 2500.0 296.1861 2900.0 301.0438 2600.0 313.2737 4600.0 412.9143 3100.0 415.1892 3500.0 429.2062 9700.0 431.2235 2600.0 444.2306 19000.0 445.2391 22000.0 446.2452 10000.0 448.2617 35000.0 457.2351 3100.0 458.2456 13000.0 459.2178 34000.0 459.2565 23000.0 460.2191 2800.0 461.2383 3600.0 472.2254 49000.0 472.6832 3100.0 473.233 130000.0 474.2406 78000.0 475.2481 29000.0 476.2451 2900.0 485.233 51000.0 486.2379 11000.0 486.2536 4700.0 487.2487 510000.0 488.2543 15000.0 489.2273 44000.0 490.236 17000.0 496.4072 3500.0 500.2202 9700.0 501.2315 3800.0 502.2406 3000.0 503.2414 73000.0 504.2487 16000.0 505.2568 2900.0 513.2279 8800.0 515.2433 91000.0 517.2239 17000.0 518.2308 65000.0 519.2712 19000.0 531.0496 3900.0 531.2382 1500000.0 532.2462 590000.0 547.27 22000.0 548.2471 3300.0 549.2505 11000.0 559.2337 42000.0 563.2642 45000.0 576.2376 32000.0 590.2579 7000.0 591.0352 40000.0 591.2596 7700000.0 591.4326 18000.0 591.4833 37000.0 591.6028 4000.0 592.2572 9800.0 END IONS BEGIN IONS SCANS=767 PEPMASS=589.2453 CHARGE=1 COLLISION_ENERGY=0.0 65.469 23000.0 65.4721 120000.0 65.4905 2200.0 75.843 2600.0 82.1746 2300.0 90.8842 2100.0 91.6451 2000.0 95.5011 2600.0 98.87 2400.0 118.4966 3100.0 119.4494 2400.0 127.9686 2300.0 137.2718 2200.0 140.5991 2500.0 147.3057 9100.0 159.7553 2500.0 163.1587 2300.0 173.5311 75000.0 173.5447 5700.0 187.4626 2400.0 192.541 2300.0 214.1005 2500.0 222.2911 2800.0 236.1759 2600.0 272.3448 2300.0 325.3731 3600.0 331.9691 2500.0 442.2161 19000.0 443.2219 19000.0 444.2277 3200.0 446.2449 18000.0 456.2312 12000.0 457.1973 20000.0 457.2456 9300.0 469.1999 3400.0 470.2097 33000.0 471.217 79000.0 472.2252 43000.0 473.2327 26000.0 483.217 44000.0 484.2278 12000.0 485.2329 320000.0 486.2416 12000.0 487.2128 38000.0 488.2176 14000.0 498.207 3000.0 501.2271 53000.0 502.2327 18000.0 513.2282 52000.0 515.2077 7000.0 516.2135 34000.0 517.2635 11000.0 529.2225 960000.0 530.1394 5200.0 530.2305 330000.0 530.3247 6000.0 539.2117 3700.0 545.2551 14000.0 547.2278 2800.0 557.2169 25000.0 561.249 30000.0 589.2442 3600000.0 589.425 200000.0 END IONS BEGIN IONS SCANS=768 PEPMASS=824.5519 CHARGE=1 COLLISION_ENERGY=0.0 72.5281 2100.0 73.0281 2900.0 75.159 2200.0 77.0384 13000.0 79.0537 400000.0 81.0331 89000.0 81.0694 820000.0 81.0964 2300.0 81.656 2200.0 83.0487 96000.0 83.0804 2600.0 83.085 160000.0 83.1632 2200.0 85.0279 53000.0 85.0644 47000.0 91.0377 2400.0 91.0537 270000.0 93.063 3600.0 93.0693 630000.0 95.0486 73000.0 95.085 640000.0 97.0279 40000.0 97.0643 140000.0 97.1006 84000.0 97.499 2500.0 99.0437 12000.0 99.0799 46000.0 99.0869 2300.0 99.6097 2300.0 102.0857 2700.0 105.0444 3000.0 105.0693 250000.0 107.0488 28000.0 107.085 470000.0 107.3413 2600.0 109.0282 22000.0 109.0643 58000.0 109.1006 380000.0 111.0437 7200.0 111.0799 81000.0 113.0959 16000.0 114.0343 2500.0 114.7527 2300.0 116.2247 2300.0 117.0694 140000.0 119.0766 17000.0 119.085 320000.0 121.0643 35000.0 121.0913 2500.0 121.1006 470000.0 123.0801 50000.0 123.1163 150000.0 125.0955 58000.0 127.0387 41000.0 129.0543 9600.0 129.0694 36000.0 131.0748 3000.0 131.085 240000.0 133.0642 3200.0 133.0905 3800.0 133.1006 390000.0 135.08 47000.0 135.1057 11000.0 135.1163 420000.0 137.0956 55000.0 137.1319 29000.0 139.111 25000.0 141.0692 7600.0 143.0851 49000.0 145.0493 2400.0 145.0889 3600.0 145.1006 250000.0 147.0803 13000.0 147.1163 250000.0 149.0956 130000.0 149.12 3100.0 149.1319 340000.0 151.1113 46000.0 151.1477 6300.0 153.126 2900.0 155.0847 13000.0 155.1059 13000.0 157.0646 2300.0 157.1007 71000.0 159.0816 3000.0 159.1026 3000.0 159.1164 300000.0 160.7279 2300.0 161.0959 6500.0 161.132 130000.0 162.4591 2300.0 163.1112 99000.0 163.1475 60000.0 165.1271 33000.0 169.1006 20000.0 171.1012 8100.0 171.1164 64000.0 173.045 6900.0 173.1167 7100.0 173.132 160000.0 173.5198 5000.0 173.5291 180000.0 173.5414 70000.0 174.7771 2700.0 175.1105 11000.0 175.1479 60000.0 177.1267 79000.0 177.1438 2500.0 177.1638 8600.0 179.1426 30000.0 181.1219 20000.0 183.1163 38000.0 184.0727 2300.0 185.132 53000.0 187.112 9100.0 187.1475 66000.0 187.9499 2500.0 189.1122 3100.0 189.1637 16000.0 190.679 2400.0 191.143 10000.0 193.1567 2600.0 195.1191 5600.0 195.1374 91000.0 197.1322 31000.0 199.1482 30000.0 201.1258 2900.0 201.1637 32000.0 203.1426 11000.0 205.376 2600.0 208.5806 2400.0 209.1318 2700.0 211.1479 9300.0 213.1643 7700.0 215.1786 5300.0 215.7406 2500.0 217.1228 2600.0 217.1594 4000.0 219.138 3200.0 219.174 17000.0 227.1272 22000.0 228.7699 2300.0 229.1425 15000.0 229.1949 27000.0 235.1694 6600.0 239.1792 45000.0 241.195 4700.0 243.2101 50000.0 247.205 30000.0 255.1586 77000.0 257.1894 99000.0 259.2052 11000.0 261.2207 160000.0 267.1587 8800.0 269.1743 170000.0 275.2003 270000.0 277.1497 2600.0 278.2367 2500.0 291.1958 8200.0 292.1987 3900.0 304.4644 2400.0 309.2055 13000.0 314.2397 2300.0 317.2476 14000.0 331.2237 3700.0 335.2579 930000.0 337.2738 17000.0 349.2372 68000.0 360.6524 2400.0 363.5677 2300.0 365.3052 16000.0 367.2501 2800.0 379.9044 2300.0 398.6815 2600.0 433.663 2400.0 434.9537 2400.0 455.0991 2800.0 489.3567 3000.0 515.3719 61000.0 529.3887 210000.0 550.7359 2700.0 569.4207 6200.0 597.1699 2600.0 609.4522 11000.0 645.6032 2700.0 669.8094 2700.0 END IONS BEGIN IONS SCANS=769 PEPMASS=829.5073 CHARGE=1 COLLISION_ENERGY=0.0 73.028 60000.0 73.748 2300.0 79.0538 53000.0 80.2586 2600.0 81.0331 31000.0 81.0694 120000.0 83.0489 3800.0 83.0852 12000.0 85.0279 130000.0 85.4293 2200.0 87.0437 6700.0 91.0385 110000.0 91.0538 32000.0 92.1666 160000.0 92.1711 24000.0 93.0694 73000.0 94.1514 2400.0 95.0485 6500.0 95.085 120000.0 95.8113 2700.0 97.0279 120000.0 97.0646 8900.0 97.1007 2900.0 98.7878 2600.0 99.0435 18000.0 99.0803 2200.0 101.0228 54000.0 103.0385 19000.0 103.7241 2200.0 105.0695 22000.0 107.0849 61000.0 109.0281 32000.0 109.0643 3000.0 109.1006 57000.0 110.8192 2400.0 111.0802 2600.0 115.0383 13000.0 117.0691 13000.0 119.085 42000.0 121.0634 2300.0 121.1006 71000.0 123.0804 3700.0 123.1161 21000.0 127.0386 69000.0 129.0537 3900.0 131.085 21000.0 133.1005 45000.0 135.1164 61000.0 135.3026 2300.0 137.0955 4100.0 145.0493 20000.0 145.1006 28000.0 145.8727 2800.0 147.0811 3400.0 147.1163 33000.0 149.1319 33000.0 149.6718 3200.0 149.6823 4800.0 149.6932 5400.0 157.1008 2900.0 159.1165 29000.0 161.1324 14000.0 163.1476 11000.0 173.132 23000.0 173.528 120000.0 173.5455 15000.0 183.0647 9600.0 184.0722 2400.0 184.6671 2300.0 185.0417 78000.0 187.1476 5900.0 203.0524 25000.0 219.5743 2300.0 223.3848 2300.0 224.3772 2300.0 227.0916 2600.0 234.0645 2500.0 234.892 2300.0 235.1296 3200.0 241.0684 8000.0 243.0835 150000.0 251.1241 3500.0 259.0775 5700.0 261.2208 43000.0 275.2 5700.0 298.0102 3200.0 301.216 2500.0 303.1941 9800.0 307.5274 2500.0 333.2035 790000.0 333.2488 8200.0 335.258 170000.0 336.8306 2300.0 341.7664 2500.0 359.5538 2700.0 363.2519 4100.0 389.2293 57000.0 392.5123 2500.0 413.1755 3400.0 428.0931 2500.0 439.1942 100000.0 453.2095 180000.0 465.2072 2800.0 466.9966 2400.0 469.203 21000.0 479.2252 4300.0 493.2399 11000.0 497.311 24000.0 519.2002 5000.0 519.2253 16000.0 519.2928 3000000.0 519.4749 4900.0 521.3076 25000.0 549.3397 14000.0 551.1851 8000.0 551.2826 1800000.0 551.3812 3000.0 551.478 3700.0 552.2816 3700.0 552.2941 2600.0 568.5945 2700.0 569.3848 3400.0 591.3207 2700.0 607.189 2600.0 641.5445 2800.0 649.4444 43000.0 657.6707 2800.0 667.4538 160000.0 717.4179 150000.0 731.4334 210000.0 747.4286 37000.0 757.4444 3200.0 763.1093 2900.0 771.4635 17000.0 829.5065 4100000.0 830.5122 3400.0 END IONS BEGIN IONS SCANS=770 PEPMASS=685.2867 CHARGE=1 COLLISION_ENERGY=0.0 68.2426 2200.0 76.8089 2400.0 79.3565 2200.0 81.4219 2500.0 82.1998 2300.0 85.1594 2300.0 85.7182 2300.0 85.8657 2500.0 97.8785 2900.0 101.5865 2800.0 101.6324 2300.0 105.4419 2400.0 106.9284 2300.0 108.8175 2500.0 109.6264 2300.0 115.4255 2900.0 121.3259 2600.0 129.081 2500.0 130.1757 2200.0 133.1284 2500.0 134.3678 2500.0 135.1511 2300.0 146.7283 2400.0 149.0545 2700.0 149.6785 2900.0 149.6893 6500.0 149.6998 2700.0 150.5961 2700.0 153.0339 2500.0 156.9906 2100.0 158.751 2500.0 166.8512 2300.0 173.528 94000.0 173.5395 39000.0 181.2508 2400.0 201.0292 3000.0 203.0307 2500.0 210.2559 2600.0 211.6935 2600.0 214.6929 2400.0 220.3445 2300.0 223.4283 2500.0 224.4972 2800.0 240.6496 2200.0 243.9904 2200.0 245.2283 2700.0 257.6508 2800.0 261.2387 2500.0 267.0532 2600.0 284.5462 2400.0 305.4597 2500.0 306.9187 2400.0 307.2252 2400.0 321.2508 2500.0 333.3622 2400.0 362.193 2600.0 375.1714 2400.0 410.2089 16000.0 411.2181 33000.0 423.2192 3100.0 424.2237 5000.0 425.2305 14000.0 437.2344 7100.0 452.2103 2600.0 453.2302 5500.0 465.2251 7900.0 466.2349 16000.0 479.3913 2700.0 494.2674 20000.0 495.2748 3500.0 497.2194 9300.0 498.2186 3800.0 507.2365 3500.0 509.2568 5700.0 510.2625 95000.0 511.2695 120000.0 512.278 430000.0 517.2567 6500.0 521.2531 19000.0 522.2527 2700.0 525.2821 34000.0 526.2912 85000.0 536.2576 3100.0 537.2647 4600.0 537.2801 12000.0 538.2565 66000.0 539.2655 100000.0 540.24 2900.0 542.2833 7500.0 544.2702 2700.0 553.2807 120000.0 554.2882 150000.0 564.2581 3300.0 567.2554 7100.0 580.2737 4300.0 581.2762 110000.0 582.2819 3800.0 583.2486 2700.0 595.261 2700.0 598.2785 27000.0 599.2863 3000.0 605.2779 7100.0 613.2996 39000.0 623.2852 11000.0 641.2973 31000.0 642.0474 2600.0 647.7911 2700.0 685.4411 12000.0 END IONS BEGIN IONS SCANS=771 PEPMASS=234.0974 CHARGE=1 COLLISION_ENERGY=0.0 43.5936 2100.0 43.6072 2000.0 43.8978 2800.0 44.084 2300.0 44.3361 2500.0 44.4058 2300.0 44.4673 2200.0 44.9024 2300.0 45.0333 1400000.0 45.0769 2500.0 45.3837 2300.0 46.0234 2000.0 46.4489 2400.0 46.4703 2200.0 46.7762 2300.0 46.9275 2600.0 47.3347 2400.0 47.4555 2300.0 47.5159 5200.0 48.0617 2100.0 49.039 2600.0 49.0919 2300.0 49.2304 4700.0 49.4819 2300.0 49.6818 2500.0 50.062 2100.0 50.2725 2300.0 50.5716 2200.0 50.65 2200.0 50.7952 2500.0 51.2143 2300.0 51.5802 2500.0 51.6271 2400.0 52.1293 2100.0 52.1919 2100.0 53.1111 2300.0 53.6295 2100.0 54.0537 2400.0 54.4973 4900.0 54.7008 2400.0 54.7886 2500.0 56.038 2500.0 56.3851 2200.0 56.7047 2300.0 56.7137 2300.0 56.8773 2400.0 56.9165 2100.0 56.9289 2200.0 57.6172 2300.0 57.6205 2400.0 58.0645 2900.0 58.3743 2100.0 58.7998 2300.0 59.1142 2200.0 59.5004 2400.0 59.7065 2700.0 60.1683 2300.0 60.2233 2100.0 60.3937 2300.0 61.4006 2300.0 61.73 2200.0 61.7992 2500.0 61.9618 2100.0 62.1722 2100.0 62.4272 2300.0 62.9868 2100.0 63.1159 2200.0 63.4183 2400.0 63.5365 2600.0 63.8494 2400.0 63.9014 2500.0 64.1286 2400.0 64.1831 2300.0 64.3351 2200.0 64.535 2300.0 67.2241 2500.0 67.6951 2200.0 68.1597 2600.0 68.3623 2100.0 68.7391 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173.5212 6100.0 173.5232 230000.0 173.5365 580000.0 173.5594 5400.0 174.6743 2400.0 177.2602 2200.0 178.5467 2200.0 180.0951 2600.0 181.1352 2900.0 181.7435 2600.0 181.8094 2400.0 182.2763 2200.0 182.5031 3000.0 186.2472 3200.0 186.2903 2500.0 186.4216 2300.0 187.8069 2300.0 187.8833 3000.0 188.0915 390000.0 188.4407 3200.0 191.0748 2400.0 191.147 2400.0 191.3901 2400.0 195.6563 2300.0 197.612 2300.0 198.4651 2300.0 200.0633 2700.0 203.8323 2400.0 205.3594 2600.0 209.7142 2300.0 210.4689 2700.0 213.1956 2500.0 213.625 2400.0 214.3223 2900.0 214.8626 3100.0 215.3881 2300.0 218.3433 2400.0 218.8001 2700.0 218.9747 2300.0 219.4967 2300.0 221.7699 2300.0 227.9492 3100.0 229.3735 2600.0 231.8981 2400.0 233.9773 2900.0 234.2215 56000.0 238.6894 2700.0 241.4608 2500.0 END IONS BEGIN IONS SCANS=772 PEPMASS=615.2582 CHARGE=1 COLLISION_ENERGY=0.0 67.5215 3300.0 74.6301 3200.0 88.2261 4900.0 89.0592 53000.0 91.3362 4000.0 91.5351 3200.0 100.0811 3400.0 103.9146 4000.0 107.1733 4900.0 113.6381 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76.8791 2300.0 84.6892 2800.0 84.8587 2400.0 118.2784 2300.0 121.3246 2600.0 134.3031 2500.0 148.4318 2300.0 149.6877 5300.0 173.5227 41000.0 173.5417 53000.0 200.6866 2300.0 202.8106 2600.0 208.5774 2400.0 211.4388 2400.0 214.6309 2600.0 238.1476 2400.0 381.485 2900.0 413.3244 960000.0 423.5662 2400.0 END IONS BEGIN IONS SCANS=774 PEPMASS=591.2609 CHARGE=1 COLLISION_ENERGY=0.0 65.6948 54000.0 65.6977 10000.0 71.9076 2300.0 78.7387 2900.0 97.3638 2300.0 105.296 2400.0 106.806 7200.0 125.8065 5800.0 125.8156 3700.0 132.3514 2400.0 133.0852 2700.0 173.5293 84000.0 173.5378 18000.0 174.1629 2400.0 213.35 2300.0 247.0325 2200.0 420.2318 8900.0 429.2075 2700.0 430.2187 7200.0 433.2375 2700.0 444.2314 26000.0 445.2381 16000.0 447.2584 8700.0 457.2373 28000.0 458.2105 6700.0 458.2479 13000.0 459.1581 26000.0 459.2186 2300000.0 460.2267 43000.0 460.2659 14000.0 461.2343 12000.0 469.2386 5100.0 472.2269 48000.0 473.232 31000.0 474.2405 53000.0 475.2165 36000.0 475.2468 26000.0 476.2229 67000.0 477.2304 17000.0 485.234 260000.0 486.207 48000.0 487.2492 280000.0 488.2245 75000.0 489.2282 60000.0 490.236 14000.0 491.2451 36000.0 492.2533 13000.0 496.476 2800.0 497.2329 9100.0 499.2144 8500.0 500.2209 22000.0 501.2294 8900.0 502.2392 11000.0 503.0725 7500.0 503.2445 2900000.0 504.2505 130000.0 505.2258 3800.0 513.2286 42000.0 515.1567 5200.0 515.2446 280000.0 517.2271 16000.0 518.2334 44000.0 519.2429 130000.0 521.2159 2700.0 531.2393 1600000.0 531.4279 4600.0 532.2472 180000.0 533.2543 98000.0 535.237 42000.0 541.2232 39000.0 547.2711 36000.0 549.2521 12000.0 559.2349 240000.0 563.2636 40000.0 577.2424 9600.0 591.2609 1500000.0 591.4323 9400.0 592.2692 43000.0 593.2835 3100.0 END IONS BEGIN IONS SCANS=775 PEPMASS=592.2685 CHARGE=1 COLLISION_ENERGY=0.0 64.1365 38000.0 64.1397 34000.0 65.805 99000.0 65.8094 99000.0 81.3716 21000.0 99.4788 21000.0 105.3635 19000.0 132.7303 26000.0 133.309 24000.0 133.3181 30000.0 134.4323 23000.0 151.7208 24000.0 163.2912 19000.0 173.5186 48000.0 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473.233 7800000.0 474.2412 1600000.0 476.2577 3200000.0 477.2301 1300000.0 477.2462 160000.0 478.2383 280000.0 487.2475 5200000.0 488.2439 750000.0 489.26 2200000.0 491.2089 500000.0 491.2426 1500000.0 492.2503 9700000.0 493.2578 2300000.0 503.243 790000.0 504.2143 680000.0 505.224 19000000.0 506.2242 190000.0 515.2438 3500000.0 517.254 760000.0 518.2291 3400000.0 519.2392 3300000.0 520.2438 5700000.0 533.0663 470000.0 533.2539 330000000.0 533.4006 800000.0 533.4387 1300000.0 534.2578 15000000.0 547.2698 4300000.0 549.2362 250000.0 549.2504 190000.0 550.2544 1500000.0 551.2643 1500000.0 561.2487 8000000.0 563.2281 400000.0 564.2367 14000000.0 565.2793 15000000.0 575.2651 7500000.0 578.2494 5400000.0 592.9285 410000.0 592.9885 650000.0 593.0519 4600000.0 593.0969 3600000.0 593.2749 750000000.0 593.4497 3800000.0 593.4985 5300000.0 593.5625 1400000.0 594.2779 700000.0 END IONS BEGIN IONS SCANS=777 PEPMASS=501.3762 CHARGE=1 COLLISION_ENERGY=0.0 59.6915 2200.0 70.0432 2200.0 70.0608 2200.0 77.2015 2200.0 83.0591 2500.0 85.2982 2300.0 100.8441 2400.0 111.4132 2500.0 141.7552 2300.0 148.5643 2300.0 173.5252 45000.0 173.543 18000.0 183.3521 3200.0 231.6503 2900.0 270.8022 2500.0 290.0879 2400.0 291.0823 2600.0 304.677 3000.0 305.1568 3200.0 338.2215 2600.0 501.2872 12000.0 501.3761 1400000.0 END IONS BEGIN IONS SCANS=778 PEPMASS=578.2533 CHARGE=1 COLLISION_ENERGY=0.0 73.8219 2500.0 75.5637 2400.0 82.5382 2200.0 83.4738 2500.0 85.8224 2300.0 87.4384 2800.0 88.43 2800.0 89.3932 2100.0 92.504 2500.0 101.6191 2200.0 110.6565 2300.0 129.2876 2600.0 143.869 2500.0 149.6817 5600.0 149.6932 5500.0 160.4792 2200.0 173.5317 61000.0 173.9039 2200.0 236.7776 2400.0 259.7413 2400.0 269.089 2600.0 296.2509 2500.0 346.0334 2700.0 397.8845 2500.0 500.8141 2400.0 END IONS BEGIN IONS SCANS=779 PEPMASS=625.2653 CHARGE=1 COLLISION_ENERGY=0.0 65.9148 6500.0 65.9169 3600.0 67.5947 2300.0 77.8735 2400.0 83.6681 2500.0 84.3653 2500.0 86.6204 2400.0 100.6792 2300.0 103.6446 2200.0 107.8302 2700.0 120.427 3100.0 124.191 2400.0 134.205 2400.0 135.8625 2400.0 154.8921 2400.0 173.5273 32000.0 173.5356 47000.0 173.5576 2300.0 181.7323 2900.0 182.3555 2400.0 203.1153 2200.0 204.0667 2600.0 206.2206 2400.0 210.6753 2100.0 213.8833 2700.0 214.9532 3100.0 220.3722 2400.0 223.9444 2500.0 225.1374 7400.0 239.1541 13000.0 247.0663 2700.0 253.1327 12000.0 263.9424 2400.0 265.1306 3700.0 267.1491 3900.0 269.1288 3000.0 281.1326 3000.0 301.8343 2400.0 308.1744 3900.0 380.1804 2600.0 386.1851 2900.0 420.2315 80000.0 422.6134 2800.0 430.176 4400.0 433.1324 2600.0 434.247 9300.0 447.2153 11000.0 448.2251 18000.0 449.2356 15000.0 452.221 20000.0 454.1765 4300.0 458.1713 12000.0 459.2195 20000.0 460.2246 39000.0 461.2141 2700.0 462.2038 17000.0 463.2065 13000.0 465.2276 24000.0 473.192 3300.0 474.2068 2700.0 475.2136 64000.0 476.2215 28000.0 477.2283 130000.0 479.2472 4400.0 489.2282 22000.0 490.1978 12000.0 491.1951 9700.0 491.2493 14000.0 492.2495 33000.0 493.2593 19000.0 501.2263 9100.0 501.2358 3300.0 503.2366 41000.0 504.2323 4400.0 505.2207 46000.0 506.2224 8000.0 507.2371 30000.0 509.2185 2900.0 515.2046 4400.0 517.2235 23000.0 518.2292 15000.0 518.2391 2900.0 519.2388 400000.0 519.3292 2800.0 520.2122 13000.0 520.2242 7500.0 521.2241 99000.0 522.2252 21000.0 523.2301 24000.0 524.2325 2800.0 529.2217 14000.0 531.2385 25000.0 532.2409 30000.0 533.2187 87000.0 534.226 31000.0 535.1389 4000.0 535.2339 400000.0 536.2418 39000.0 537.2494 51000.0 538.2588 8000.0 547.2337 170000.0 548.2388 30000.0 549.2499 190000.0 550.2203 17000.0 551.2246 20000.0 561.2173 8800.0 563.1878 4200.0 563.2701 13000.0 565.2452 110000.0 573.43 2600.0 575.2277 81000.0 578.2132 16000.0 579.2373 15000.0 580.2586 12000.0 581.272 3600.0 582.2402 3800.0 592.2692 3200.0 593.2395 340000.0 597.2729 23000.0 607.2542 69000.0 608.2628 31000.0 625.2685 28000.0 633.6635 2500.0 END IONS BEGIN IONS SCANS=780 PEPMASS=637.2655 CHARGE=1 COLLISION_ENERGY=0.0 65.3227 2700.0 65.697 5400.0 67.6958 9000.0 81.0697 2900.0 83.0849 2600.0 95.0851 2200.0 122.2129 2500.0 149.6798 2800.0 149.6899 11000.0 149.6999 3000.0 152.4704 2600.0 173.5326 32000.0 181.0462 2400.0 181.0852 2600.0 185.1998 2800.0 231.2725 2700.0 239.1546 6600.0 284.5981 2400.0 323.1042 2500.0 457.2364 3000.0 459.159 2600.0 459.2182 630000.0 460.2267 3800.0 473.2319 6800.0 474.2421 6900.0 475.2141 22000.0 476.2216 24000.0 477.2296 22000.0 480.3864 2800.0 485.2337 82000.0 486.2065 20000.0 487.2483 61000.0 488.2194 7000.0 488.2357 3300.0 489.2268 15000.0 490.238 2900.0 491.2452 11000.0 496.4073 17000.0 497.2367 3300.0 500.223 6500.0 503.2441 760000.0 504.2479 31000.0 505.2414 3200.0 506.2279 19000.0 507.2369 6700.0 513.2278 14000.0 515.2444 120000.0 518.2291 17000.0 519.2463 32000.0 520.2433 3400.0 521.2478 24000.0 531.1468 5500.0 531.239 390000.0 532.2463 35000.0 533.2531 34000.0 534.1412 2700.0 534.2236 27000.0 535.2352 21000.0 536.2416 8700.0 541.2244 24000.0 547.2714 19000.0 548.2403 3800.0 549.2499 180000.0 550.2554 21000.0 559.2349 170000.0 561.2239 200000.0 562.2187 13000.0 563.2628 20000.0 566.2462 6300.0 566.6882 3100.0 567.2647 12000.0 577.2465 56000.0 581.2754 17000.0 591.1536 5500.0 591.2608 300000.0 592.2681 41000.0 593.2739 18000.0 594.2433 29000.0 608.2632 12000.0 609.1079 2900.0 609.2713 300000.0 628.4839 2500.0 637.2668 120000.0 END IONS BEGIN IONS SCANS=781 PEPMASS=595.2822 CHARGE=1 COLLISION_ENERGY=0.0 66.1398 310000.0 66.1443 370000.0 99.5247 28000.0 128.5897 26000.0 148.8148 28000.0 148.8252 28000.0 173.5357 270000.0 222.1614 26000.0 381.0846 28000.0 421.224 26000.0 432.1874 42000.0 433.1914 51000.0 435.2441 87000.0 447.2113 91000.0 448.2191 110000.0 449.2244 170000.0 459.2187 30000.0 460.2225 160000.0 461.227 370000.0 462.2319 590000.0 463.239 380000.0 464.2453 52000.0 474.2346 39000.0 475.2382 140000.0 478.2633 62000.0 487.2461 29000.0 489.2559 130000.0 492.2535 37000.0 493.2484 94000.0 494.2575 180000.0 495.2618 44000.0 506.2247 120000.0 507.2303 370000.0 517.2513 82000.0 520.2363 54000.0 521.2483 70000.0 522.2509 90000.0 533.254 420000.0 534.2573 840000.0 535.2603 7000000.0 536.2634 150000.0 549.2767 100000.0 552.2625 54000.0 553.2747 36000.0 553.4649 28000.0 563.2546 190000.0 565.235 63000.0 566.2432 310000.0 567.2866 280000.0 577.2719 180000.0 580.2591 93000.0 595.0591 110000.0 595.2814 17000000.0 595.4606 73000.0 595.5071 130000.0 END IONS BEGIN IONS SCANS=782 PEPMASS=623.25 CHARGE=1 COLLISION_ENERGY=0.0 67.5744 2300.0 67.8524 2700.0 69.1024 2200.0 70.407 2500.0 73.7704 2600.0 74.9809 2900.0 82.5834 2200.0 96.557 2200.0 121.2898 2200.0 125.7642 2400.0 134.1648 2500.0 147.4514 2700.0 173.528 56000.0 173.5413 16000.0 197.2913 2700.0 198.782 2500.0 200.1799 2300.0 214.088 2400.0 253.1341 3900.0 255.4918 2800.0 264.1485 8200.0 276.1504 17000.0 307.1096 2600.0 345.5237 2300.0 383.1893 11000.0 398.1843 5900.0 426.1818 2900.0 447.2169 2700.0 459.2159 2800.0 461.198 66000.0 462.2033 12000.0 463.2124 29000.0 474.1612 2900.0 474.171 3700.0 475.2144 13000.0 477.2298 5600.0 488.187 8400.0 489.1928 180000.0 490.1982 8600.0 495.2325 2900.0 501.2299 3000.0 501.8893 2700.0 503.2082 67000.0 505.224 36000.0 507.2009 3500.0 516.1798 12000.0 517.2253 17000.0 518.1923 5900.0 519.2284 14000.0 520.2047 3700.0 521.2174 45000.0 523.2326 22000.0 529.2266 3500.0 531.2124 180000.0 532.2079 3200.0 533.182 6900.0 534.1886 15000.0 535.2322 18000.0 543.1603 3200.0 545.2179 34000.0 547.2308 14000.0 548.2053 17000.0 549.2149 93000.0 551.1941 11000.0 558.1886 3600.0 561.1787 20000.0 563.2592 140000.0 566.2163 6600.0 573.2137 95000.0 576.2002 19000.0 577.245 4000.0 581.2397 51000.0 590.2095 3900.0 590.2247 3500.0 591.2262 120000.0 593.2045 15000.0 595.2562 5400.0 595.2818 7100.0 595.294 2500.0 605.239 14000.0 608.2405 3300.0 623.2831 89000.0 END IONS BEGIN IONS SCANS=783 PEPMASS=497.4244 CHARGE=1 COLLISION_ENERGY=0.0 65.4131 2100.0 70.2722 2200.0 87.0439 2700.0 89.0535 5200.0 89.0593 120000.0 90.0628 20000.0 95.5473 2600.0 114.308 2400.0 114.7369 2400.0 133.0856 65000.0 134.0891 16000.0 143.2634 2300.0 173.5202 11000.0 173.5391 28000.0 177.1123 4800.0 178.1174 3300.0 197.0791 2300.0 204.7163 2200.0 211.0822 2800.0 231.4864 2500.0 282.9391 2500.0 283.1761 5000.0 497.3945 5200.0 END IONS BEGIN IONS SCANS=784 PEPMASS=609.2704 CHARGE=1 COLLISION_ENERGY=0.0 64.1362 2600.0 67.6946 2600.0 67.6969 18000.0 73.1962 2200.0 74.6638 3000.0 91.6817 2200.0 99.4273 2300.0 107.0852 2500.0 108.1346 2800.0 115.0622 2400.0 118.783 2800.0 119.1282 2600.0 149.6839 11000.0 149.6946 8200.0 149.7056 6800.0 173.5226 8800.0 173.5323 5300.0 173.5362 37000.0 284.3261 2400.0 292.1808 19000.0 305.0201 2800.0 309.5731 2600.0 337.2962 2400.0 421.2393 5400.0 433.2406 6900.0 449.2295 6400.0 459.2184 74000.0 460.2258 18000.0 461.2362 7300.0 462.2057 3000.0 463.2136 160000.0 465.2382 2800.0 473.2318 2700.0 475.214 31000.0 476.2151 43000.0 477.2301 48000.0 480.251 25000.0 481.2613 36000.0 485.2333 62000.0 486.2037 9500.0 487.2491 20000.0 489.2257 11000.0 490.2274 3700.0 491.2452 33000.0 492.2514 25000.0 499.2114 7000.0 500.2197 3100.0 503.2436 110000.0 504.2147 3000.0 504.2331 8700.0 505.2553 21000.0 506.225 11000.0 507.2371 7500.0 508.2402 12000.0 509.2539 23000.0 513.2266 6800.0 515.244 110000.0 517.2234 28000.0 518.2307 22000.0 519.2449 3400.0 519.2565 2500.0 520.2128 2700.0 520.2403 3000.0 521.2494 55000.0 522.2578 4000.0 531.1461 9100.0 531.2392 380000.0 532.2467 19000.0 533.2544 210000.0 534.223 38000.0 535.2346 260000.0 536.2421 160000.0 541.2234 21000.0 547.1953 4500.0 548.2394 14000.0 549.2496 260000.0 550.2578 100000.0 559.2347 170000.0 562.2185 32000.0 563.2659 23000.0 565.2809 52000.0 566.2504 12000.0 569.0058 2600.0 577.2448 210000.0 579.2208 3100.0 580.2299 3400.0 581.2712 19000.0 591.2607 270000.0 594.2451 58000.0 609.271 450000.0 END IONS BEGIN IONS SCANS=785 PEPMASS=607.2552 CHARGE=1 COLLISION_ENERGY=0.0 65.4047 2300.0 67.5244 2200.0 72.393 2600.0 107.2053 2600.0 111.3005 2300.0 173.5205 14000.0 173.5383 50000.0 222.5515 2500.0 237.1385 3400.0 251.1214 3400.0 328.3976 2500.0 355.9943 2200.0 380.8912 2300.0 436.7724 2400.0 446.2091 2600.0 447.219 3900.0 454.1742 11000.0 458.2139 2900.0 459.2282 2500.0 461.2332 2800.0 473.2322 4200.0 474.2025 7800.0 475.2153 4700.0 475.2308 2500.0 485.1931 3100.0 487.2084 6800.0 488.2215 3800.0 489.2234 7400.0 491.2057 4600.0 501.2269 18000.0 502.2029 7500.0 503.2443 27000.0 504.2184 2900.0 505.2195 8200.0 515.208 6500.0 516.2183 2800.0 519.2371 27000.0 529.2231 17000.0 531.239 16000.0 532.2118 2800.0 533.2165 4000.0 534.2288 11000.0 537.0652 2700.0 547.2343 140000.0 548.2416 41000.0 557.2191 8400.0 563.2626 3400.0 575.2296 39000.0 579.261 15000.0 589.2427 3700.0 607.2556 77000.0 607.4212 2900.0 END IONS BEGIN IONS SCANS=786 PEPMASS=457.3502 CHARGE=1 COLLISION_ENERGY=0.0 56.6645 2600.0 56.7749 2400.0 57.3326 2300.0 57.5543 2400.0 58.1712 2100.0 58.5091 2300.0 62.0315 2300.0 62.8535 2200.0 63.1053 2400.0 70.2726 2200.0 73.6565 2300.0 75.1079 2300.0 75.2746 2400.0 75.735 2200.0 76.0191 2400.0 77.6431 2200.0 77.7481 2600.0 78.0257 2600.0 78.9745 2300.0 79.3041 2300.0 88.434 2300.0 91.066 2300.0 92.2829 2500.0 94.1445 2400.0 95.6813 2600.0 96.2724 2100.0 99.1671 2400.0 99.6224 2300.0 103.1683 2300.0 113.2175 2500.0 139.2465 3100.0 141.8824 2200.0 145.8263 2300.0 148.469 2700.0 149.6702 2900.0 149.681 4500.0 149.6908 11000.0 151.5893 2500.0 165.7539 3100.0 173.5231 31000.0 173.5318 26000.0 173.5402 56000.0 181.6564 2800.0 186.5734 2500.0 187.5005 2300.0 261.1302 13000.0 282.0934 2500.0 284.529 2800.0 291.9035 2600.0 295.8712 3000.0 338.6106 2900.0 388.8661 2600.0 390.4782 2400.0 453.39 2600.0 457.2736 19000.0 457.35 2400000.0 END IONS BEGIN IONS SCANS=787 PEPMASS=453.3983 CHARGE=1 COLLISION_ENERGY=0.0 57.0697 3600.0 59.6754 2800.0 67.6426 2500.0 71.0853 3000.0 87.0437 3900.0 89.0592 180000.0 89.0655 3800.0 90.0577 2700.0 90.0626 38000.0 103.5073 2600.0 104.4422 2200.0 107.0702 3800.0 133.0854 81000.0 134.089 24000.0 151.0961 5500.0 173.5203 3800.0 173.5385 15000.0 177.1117 8000.0 195.1226 4900.0 196.1248 3200.0 239.1485 11000.0 240.1521 6400.0 319.2003 2500.0 347.3362 2300.0 END IONS BEGIN IONS SCANS=788 PEPMASS=759.573 CHARGE=1 COLLISION_ENERGY=0.0 71.0728 4200.0 86.0961 190000.0 86.1025 4300.0 87.0994 25000.0 95.0851 2600.0 98.9839 8400.0 104.1066 18000.0 124.9995 92000.0 126.0026 2700.0 135.9316 2500.0 144.927 2600.0 153.4008 2400.0 173.5249 18000.0 173.5396 23000.0 180.2381 2300.0 184.0352 9200.0 184.0733 2100000.0 184.103 5300.0 184.1121 9800.0 185.0505 2600.0 185.0766 290000.0 245.7511 2500.0 312.9821 2300.0 416.5186 2500.0 431.5018 2400.0 759.4279 2800.0 END IONS BEGIN IONS SCANS=789 PEPMASS=758.5695 CHARGE=1 COLLISION_ENERGY=0.0 70.7941 2200.0 70.9921 2200.0 71.0726 190000.0 71.8643 2300.0 72.659 2600.0 72.8933 2400.0 72.908 4600.0 73.0465 15000.0 75.5635 2300.0 75.5719 2300.0 75.6984 2300.0 76.2334 4400.0 76.6828 2300.0 76.7043 2500.0 77.2408 2200.0 77.6998 2600.0 77.7398 2700.0 77.7538 2700.0 79.2652 2200.0 79.797 2400.0 80.8623 2400.0 81.0698 5000.0 81.1035 2200.0 81.3055 3600.0 81.4327 2500.0 81.494 2600.0 81.5289 4500.0 84.324 2400.0 84.8248 2100.0 85.7006 2400.0 86.096 3900000.0 86.1023 3700.0 89.6351 2200.0 91.0569 14000.0 91.2906 2400.0 91.8669 2300.0 92.6688 2400.0 94.5236 2700.0 95.0732 2500.0 95.0853 9100.0 96.373 2300.0 96.6262 2200.0 97.6419 2600.0 97.8722 2400.0 98.4669 2400.0 98.7162 2300.0 98.9839 180000.0 100.224 4400.0 100.524 2100.0 100.9746 2400.0 101.0596 2300.0 102.0075 2400.0 102.6227 2400.0 104.0074 2600.0 104.1066 400000.0 108.8944 2300.0 109.9063 2500.0 111.0485 2400.0 112.4777 2400.0 113.1067 2300.0 113.2161 2700.0 113.3916 2800.0 116.346 2600.0 116.3916 2500.0 117.685 2500.0 118.5122 2500.0 119.1391 2200.0 120.6973 2800.0 123.4145 2700.0 124.2269 2600.0 124.3044 3100.0 124.9897 22000.0 124.9995 1800000.0 125.0103 14000.0 125.1987 2500.0 125.3793 2100.0 126.7447 2600.0 126.8694 2200.0 132.7459 2700.0 138.3851 2100.0 140.3654 2300.0 142.6834 2500.0 145.9642 2700.0 147.2624 2100.0 149.0103 2400.0 149.0449 12000.0 149.6883 5000.0 150.3425 2200.0 151.3696 2500.0 152.3595 2300.0 153.1212 2500.0 154.6342 2300.0 155.5982 3400.0 156.4575 2300.0 157.5243 2400.0 157.7558 2500.0 158.5651 2400.0 160.4346 2400.0 160.6052 2200.0 160.8972 2300.0 163.6245 2600.0 165.4177 2500.0 166.0264 2300.0 167.0553 8400.0 171.379 2300.0 172.1232 2300.0 173.5241 370000.0 173.5383 560000.0 173.9842 2500.0 175.1709 2200.0 176.7903 2600.0 180.0883 2400.0 181.9297 2900.0 183.9487 2300.0 184.0136 7300.0 184.024 6400.0 184.035 240000.0 184.0425 19000.0 184.0732 41000000.0 184.1031 100000.0 184.1121 180000.0 184.123 35000.0 184.145 9900.0 184.7319 2400.0 185.0767 140000.0 185.1197 2500.0 186.0776 35000.0 190.0332 2400.0 191.5498 2200.0 192.8828 2400.0 194.227 2400.0 195.5092 2800.0 196.1825 2600.0 197.3054 2400.0 198.9149 2500.0 199.5731 2500.0 200.1978 2600.0 200.5831 2500.0 201.0338 2300.0 202.1187 2500.0 203.8069 2300.0 206.5892 2700.0 206.6091 2300.0 211.4036 2500.0 212.7793 2200.0 215.1229 2500.0 215.3143 2600.0 216.4641 2300.0 218.8786 2400.0 219.2489 2800.0 219.4895 2900.0 220.1756 2100.0 221.02 2700.0 223.5563 2300.0 225.0432 9900.0 225.1216 2300.0 230.653 2400.0 236.6143 2700.0 239.0959 9400.0 239.5944 2700.0 242.4921 2400.0 246.1961 2800.0 247.6134 2400.0 249.5196 2300.0 251.4678 2400.0 252.7056 2400.0 254.5832 2400.0 255.0598 2700.0 258.0122 3100.0 268.0721 2400.0 270.5685 2600.0 281.0848 2600.0 282.4843 2700.0 284.3668 2500.0 285.0092 2600.0 287.1337 2700.0 288.8817 2300.0 299.0625 53000.0 300.6722 2400.0 301.8999 2800.0 308.3896 2600.0 312.4662 2200.0 312.489 2600.0 313.716 2600.0 316.6418 3000.0 317.8825 2400.0 318.2357 2500.0 339.85 2500.0 340.2777 2500.0 344.9734 5400.0 349.7533 2500.0 351.3725 2300.0 351.8616 2700.0 352.3801 2800.0 353.2968 2600.0 355.0708 5500.0 359.0292 29000.0 378.9215 2600.0 400.1996 3100.0 401.6791 2300.0 402.0132 2500.0 414.8456 2700.0 418.4522 2900.0 418.8665 2800.0 424.1663 2400.0 431.693 2500.0 436.752 2700.0 443.0634 3000.0 445.9784 2500.0 446.363 2400.0 454.5396 2700.0 458.0302 2800.0 475.2258 2400.0 475.5357 2600.0 478.3284 17000.0 480.1482 2900.0 489.0585 2700.0 494.7827 2400.0 496.3422 2500.0 498.2758 2500.0 502.3335 3200.0 518.4486 2600.0 527.5348 2400.0 530.0026 2500.0 530.4404 3100.0 540.9172 2900.0 548.5548 2700.0 552.8876 2900.0 553.3553 2500.0 572.0468 2600.0 585.3878 2700.0 588.6595 3000.0 597.2927 2900.0 608.7272 3100.0 647.7231 2500.0 651.3852 2400.0 652.3825 3200.0 671.1947 3200.0 674.2781 2300.0 680.7303 2700.0 714.9096 5600.0 720.7181 2400.0 737.5146 2500.0 757.9864 2700.0 758.7286 2500.0 761.2037 2600.0 767.3091 2800.0 END IONS BEGIN IONS SCANS=790 PEPMASS=716.5224 CHARGE=1 COLLISION_ENERGY=0.0 67.9986 2400.0 68.1433 2300.0 68.2164 2300.0 68.7648 2300.0 68.872 2600.0 69.036 2300.0 69.0695 300000.0 69.7729 2600.0 70.6219 2200.0 70.6424 2300.0 71.0012 2300.0 71.0486 2300.0 71.0852 480000.0 71.1285 2200.0 72.7835 2300.0 73.0281 110000.0 73.0646 5200.0 74.5569 2600.0 74.7187 2500.0 75.0807 2300.0 75.369 2500.0 76.1862 2500.0 78.0078 2100.0 78.9707 2400.0 79.0539 160000.0 79.8508 2600.0 80.0831 2200.0 80.0993 2100.0 80.4092 2400.0 80.4768 2100.0 81.0153 2600.0 81.0695 1200000.0 81.3691 2200.0 82.0835 2700.0 83.0852 490000.0 83.1275 2200.0 83.2642 2200.0 83.5727 2500.0 83.8183 2000.0 84.3973 2600.0 85.0641 11000.0 85.1008 400000.0 85.1798 2300.0 86.0383 2800.0 86.3262 2300.0 87.0436 46000.0 87.9632 2600.0 88.5064 2300.0 89.0592 440000.0 90.5394 2400.0 91.0539 70000.0 91.2287 2700.0 91.4628 2300.0 91.8222 2000.0 93.0695 250000.0 93.0905 2800.0 93.2101 2200.0 93.36 2500.0 93.7127 2300.0 94.2202 2100.0 94.7366 2500.0 95.0082 2800.0 95.0851 1300000.0 96.1602 2100.0 96.3188 2400.0 97.0643 9100.0 97.1008 290000.0 97.6326 2400.0 99.0801 11000.0 99.7349 2500.0 100.4336 2700.0 100.6273 2600.0 101.9156 2200.0 102.2977 2400.0 102.4035 2300.0 104.2888 2300.0 105.0116 2300.0 105.0694 65000.0 105.5459 2500.0 105.8063 2100.0 105.8988 2400.0 106.4033 2300.0 107.0851 180000.0 107.1487 2400.0 107.5417 2800.0 108.0108 2400.0 108.3286 2800.0 108.8434 2300.0 109.1008 680000.0 110.6985 2400.0 110.7728 2400.0 111.0798 11000.0 111.1165 55000.0 111.9369 2500.0 113.0951 2400.0 113.8308 2500.0 114.2567 2200.0 116.5805 2500.0 117.3544 2800.0 119.0851 73000.0 120.3883 2800.0 121.1008 230000.0 121.1821 2300.0 122.2213 2200.0 123.1164 440000.0 124.453 2400.0 125.0956 2900.0 125.1321 8800.0 126.4057 2400.0 126.8982 2500.0 126.9127 2500.0 127.1104 2400.0 129.5272 2500.0 130.7688 2200.0 130.8589 2300.0 131.0701 5600.0 132.889 2700.0 133.0854 190000.0 133.1009 110000.0 135.099 2700.0 135.1165 150000.0 137.1321 180000.0 138.3481 2500.0 138.9494 2500.0 139.355 2100.0 143.0677 2600.0 143.8676 2100.0 143.887 2800.0 146.0079 2300.0 147.1164 91000.0 148.5191 2900.0 149.132 65000.0 149.6879 37000.0 149.6974 3200.0 149.8968 2500.0 150.7867 2700.0 151.1477 47000.0 151.7819 2200.0 153.1265 17000.0 153.1869 2700.0 155.0099 8600.0 156.1038 2900.0 158.1177 2600.0 161.1322 76000.0 162.7343 2300.0 163.1478 47000.0 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282.2793 51000.0 286.318 2600.0 290.6279 2600.0 301.7164 2600.0 306.2792 250000.0 307.5021 2500.0 307.5738 2600.0 311.5699 2900.0 313.274 120000.0 314.3589 2500.0 314.3831 2400.0 314.7646 2800.0 317.0927 2300.0 330.0018 2600.0 332.4828 2700.0 337.2734 94000.0 340.8206 2800.0 356.4203 2400.0 356.8652 2800.0 361.5662 2400.0 365.4274 2300.0 378.0869 2600.0 381.6018 2400.0 387.4032 2600.0 387.6505 2900.0 393.3732 2800.0 393.7509 2500.0 393.9296 2500.0 394.355 2400.0 401.7914 2400.0 404.642 2500.0 405.3759 2600.0 406.559 2500.0 406.8868 2800.0 407.0698 2600.0 412.4703 2700.0 413.2047 2500.0 416.5734 2700.0 422.8932 2500.0 437.5087 2300.0 438.4325 2300.0 439.697 2500.0 441.593 2400.0 455.6075 2700.0 463.3105 2800.0 475.9422 2600.0 492.1132 2800.0 493.4934 2800.0 494.3549 2300.0 497.3583 2500.0 503.5542 3000.0 516.6235 2700.0 528.4865 2400.0 536.754 2600.0 551.6639 2700.0 553.2613 2700.0 554.0922 2700.0 566.7211 2700.0 573.4891 74000.0 575.4055 7200.0 575.5034 1200000.0 575.6008 3800.0 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6300.0 549.2665 270000.0 571.0659 2700.0 656.6649 2500.0 665.4386 26000.0 827.3099 5600.0 827.4902 550000.0 827.6812 3500.0 END IONS BEGIN IONS SCANS=792 PEPMASS=822.5362 CHARGE=1 COLLISION_ENERGY=0.0 79.0539 100000.0 81.0331 6900.0 81.0695 200000.0 81.3746 2600.0 82.0312 2400.0 82.1476 2200.0 83.0486 3100.0 83.0852 45000.0 84.0829 3000.0 85.0648 2700.0 91.0539 58000.0 91.3192 2200.0 93.0638 3900.0 93.0695 140000.0 95.049 26000.0 95.0793 3700.0 95.0852 190000.0 97.0281 42000.0 97.0645 15000.0 97.1008 54000.0 99.0801 8300.0 105.0695 60000.0 107.049 12000.0 107.0851 130000.0 109.0645 23000.0 109.1008 120000.0 110.3442 2400.0 110.3632 2200.0 111.0804 12000.0 112.8509 2700.0 113.9884 2300.0 117.0695 34000.0 119.0851 86000.0 121.0647 3800.0 121.1008 110000.0 123.0803 21000.0 123.1165 31000.0 124.1286 2400.0 125.0956 60000.0 127.0749 27000.0 129.0697 6900.0 131.0852 61000.0 132.9174 2400.0 133.1009 69000.0 135.08 24000.0 135.1165 80000.0 137.0959 16000.0 143.0851 15000.0 145.1008 50000.0 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533.2198 2500000.0 534.222 4900.0 534.2361 21000.0 545.2315 39000.0 546.2249 4400.0 546.2479 50000.0 547.2465 280000.0 548.2747 6200.0 556.2091 26000.0 557.2358 2800.0 557.2529 3900.0 558.2629 6800.0 559.2349 190000.0 560.2418 29000.0 561.2497 50000.0 563.2603 32000.0 573.2481 71000.0 574.2576 600000.0 575.0568 22000.0 575.266 4100000.0 575.3472 4700.0 576.2467 3200.0 576.2619 8000.0 577.2483 8400.0 579.2646 4300.0 585.2485 27000.0 587.23 45000.0 588.238 7000.0 589.2442 9400.0 591.2599 190000.0 601.2452 26000.0 602.136 9900.0 602.2532 730000.0 602.3643 4500.0 603.2592 16000.0 605.2655 58000.0 606.274 28000.0 607.2864 85000.0 615.2563 3400.0 616.2674 12000.0 617.2773 28000.0 619.2556 260000.0 619.3665 4800.0 633.2722 16000.0 634.2791 380000.0 634.4604 31000.0 635.2868 200000.0 END IONS BEGIN IONS SCANS=795 PEPMASS=657.269 CHARGE=1 COLLISION_ENERGY=0.0 66.4833 2800.0 66.8185 3000.0 70.6332 2400.0 71.4522 3700.0 72.9184 3300.0 73.0293 160000.0 73.0322 16000.0 73.2594 3300.0 75.9832 3100.0 76.4532 2800.0 77.162 2200.0 77.4737 2500.0 78.3045 3300.0 78.6336 2800.0 82.0261 2500.0 87.7355 3400.0 88.0602 3400.0 90.397 2800.0 94.4505 2700.0 103.0163 4600.0 106.2551 2400.0 119.4118 3200.0 139.3704 2800.0 163.0514 2900.0 164.3244 2800.0 166.601 3000.0 173.5253 110000.0 173.5441 68000.0 173.6723 2400.0 238.6155 2900.0 245.1155 3200.0 269.2126 2900.0 274.6851 2800.0 311.4817 4600.0 342.9514 2400.0 397.7065 2200.0 449.4338 3000.0 501.053 3100.0 515.4762 3000.0 517.2548 4200.0 525.2233 6200.0 541.1776 3200.0 552.2107 6900.0 553.2206 160000.0 557.2089 3500.0 559.3325 4700.0 597.248 3400.0 625.2453 31000.0 642.2252 3100.0 657.0093 13000.0 657.2676 4100000.0 657.5271 19000.0 658.2709 3800.0 END IONS BEGIN IONS SCANS=796 PEPMASS=673.2426 CHARGE=1 COLLISION_ENERGY=0.0 83.7105 2100.0 89.0593 36000.0 93.553 2400.0 101.156 2600.0 109.3214 2200.0 126.1972 2200.0 133.0856 19000.0 133.2585 2600.0 173.525 38000.0 173.5434 42000.0 174.1083 2400.0 257.7571 2300.0 260.8362 2500.0 275.6751 2400.0 330.6683 2400.0 376.2023 2300.0 397.0511 2300.0 402.1538 2300.0 497.3895 2700.0 515.3527 2800.0 577.683 2500.0 607.0112 2500.0 END IONS BEGIN IONS SCANS=797 PEPMASS=431.3525 CHARGE=1 COLLISION_ENERGY=0.0 55.0542 160000.0 55.8832 2200.0 57.0334 62000.0 57.0699 1100000.0 60.1943 2300.0 60.3574 2100.0 60.9687 2400.0 67.0541 100000.0 67.989 2200.0 69.0334 3600.0 69.0698 470000.0 71.049 35000.0 71.0854 1000000.0 74.4236 2500.0 76.5654 2500.0 78.5491 2800.0 79.0542 25000.0 81.0697 430000.0 83.0491 120000.0 83.0854 390000.0 84.3186 2800.0 84.6616 2200.0 85.0648 22000.0 85.101 570000.0 91.0543 9100.0 93.0697 65000.0 95.0503 2700.0 95.0854 480000.0 95.0929 4600.0 97.0649 12000.0 97.1011 300000.0 99.0444 5300.0 99.0806 5500.0 105.0704 11000.0 107.0854 41000.0 108.3732 2400.0 109.0648 30000.0 109.1011 290000.0 109.8921 2200.0 111.044 25000.0 111.0805 6800.0 111.1167 130000.0 113.0595 2900.0 117.0701 2500.0 119.0487 2400.0 119.0854 32000.0 121.0648 19000.0 121.1011 18000.0 123.0803 47000.0 123.1167 130000.0 125.0599 13000.0 125.1323 24000.0 127.0386 11000.0 131.0856 20000.0 133.0646 31000.0 133.1011 29000.0 135.0804 74000.0 135.1167 18000.0 137.0596 350000.0 137.0961 9500.0 137.1325 61000.0 138.0672 2900.0 139.0389 53000.0 139.0753 86000.0 143.0855 30000.0 145.1015 32000.0 146.788 2400.0 147.0804 92000.0 147.1165 30000.0 148.0786 2500.0 149.0596 59000.0 149.096 41000.0 149.1325 12000.0 151.0632 15000.0 151.0753 1800000.0 151.1118 21000.0 151.1483 36000.0 153.0549 4500.0 157.101 63000.0 159.0805 130000.0 159.1168 23000.0 160.6048 2700.0 161.0597 230000.0 161.0961 120000.0 161.1322 29000.0 163.0753 55000.0 163.1119 12000.0 163.1481 3400.0 165.0547 820000.0 165.0911 680000.0 165.1269 20000.0 165.1638 23000.0 167.0271 4500.0 167.0372 11000.0 167.0439 7200.0 167.0703 5800000.0 167.0819 12000.0 167.0973 5000.0 167.1036 28000.0 170.4522 2600.0 171.0804 25000.0 171.1169 42000.0 173.0961 57000.0 173.1321 6800.0 173.5211 22000.0 173.5353 160000.0 173.5468 5000.0 174.0685 3400.0 175.0755 280000.0 175.0923 3300.0 175.1119 150000.0 175.1483 9400.0 177.0911 400000.0 177.1079 4700.0 177.1273 6900.0 178.0628 9900.0 179.0535 7500.0 179.0704 510000.0 179.1068 330000.0 179.1428 15000.0 181.086 330000.0 185.0962 67000.0 185.1325 10000.0 187.1118 28000.0 188.0834 49000.0 189.0734 6500.0 189.0912 550000.0 189.1275 130000.0 191.0713 19000.0 191.1067 170000.0 191.1433 2800.0 192.0782 60000.0 193.0653 16000.0 193.0861 870000.0 193.1219 72000.0 193.1968 2300.0 195.1016 110000.0 199.1117 47000.0 199.1485 4400.0 201.1277 11000.0 202.0992 21000.0 203.1069 500000.0 203.1426 46000.0 205.1225 100000.0 206.0937 33000.0 207.0835 2000.0 207.1018 900000.0 207.1382 57000.0 207.1759 3100.0 213.1279 24000.0 215.143 11000.0 217.1226 320000.0 217.1581 11000.0 219.1383 28000.0 220.109 2600.0 221.1174 360000.0 221.1543 23000.0 227.143 5400.0 231.1382 120000.0 231.1634 2900.0 231.1758 7900.0 233.1539 3700.0 235.133 180000.0 235.1599 3400.0 235.1709 2700.0 241.1588 5100.0 245.1538 45000.0 245.191 4400.0 249.1486 69000.0 259.1691 23000.0 261.1801 2700.0 263.1641 39000.0 269.1932 3100.0 273.1855 18000.0 277.1802 41000.0 277.2133 6600.0 283.9964 3200.0 287.2004 13000.0 291.1959 36000.0 291.3027 3100.0 301.2155 10000.0 305.2109 37000.0 319.2263 29000.0 333.2413 3900.0 347.2595 2600.0 361.2716 11000.0 375.2912 20000.0 375.3589 3500.0 385.3465 47000.0 389.3427 3300.0 402.3112 6100.0 403.3601 14000.0 413.3417 46000.0 416.3281 28000.0 431.3521 160000.0 END IONS BEGIN IONS SCANS=798 PEPMASS=822.5365 CHARGE=1 COLLISION_ENERGY=0.0 74.5333 2300.0 79.0538 16000.0 81.0694 29000.0 83.0489 2900.0 83.085 8400.0 91.0538 9000.0 93.0694 26000.0 95.0484 2700.0 95.0795 2200.0 95.085 30000.0 97.0278 6800.0 97.1008 10000.0 105.0694 8200.0 107.0486 2700.0 107.0851 20000.0 109.1006 22000.0 117.0689 3400.0 119.085 8800.0 121.1008 18000.0 123.0805 2900.0 123.1169 4300.0 125.0955 11000.0 131.0851 7600.0 133.1007 8700.0 135.1166 10000.0 137.1325 2300.0 145.1007 10000.0 147.0796 4300.0 147.1159 9100.0 149.0953 3100.0 149.1318 9400.0 157.7185 2900.0 159.1164 7800.0 161.1319 3600.0 163.1486 3200.0 165.0904 3100.0 171.1011 3100.0 173.1319 5600.0 173.5368 34000.0 175.1136 3000.0 189.1115 4000.0 223.1328 25000.0 243.2115 3200.0 261.2211 8100.0 273.1849 17000.0 291.1575 3300.0 291.1955 160000.0 335.2583 51000.0 365.2327 11000.0 625.449 11000.0 656.7913 2800.0 811.713 2500.0 END IONS BEGIN IONS SCANS=799 PEPMASS=681.3289 CHARGE=1 COLLISION_ENERGY=0.0 69.9239 2300.0 70.6281 2400.0 71.6818 2300.0 94.0767 2600.0 109.0634 2500.0 139.8509 2300.0 151.2516 2500.0 173.5188 4500.0 173.5372 59000.0 225.1392 5700.0 226.1458 4200.0 239.1537 5500.0 290.1378 2800.0 294.9744 2400.0 422.1484 2900.0 446.2116 5600.0 447.2183 4500.0 451.2829 5200.0 454.1767 9600.0 459.2194 5500.0 472.1845 3700.0 473.2264 3100.0 474.2043 10000.0 475.2201 3300.0 487.2121 34000.0 489.2257 6500.0 501.2273 15000.0 502.2028 15000.0 515.2077 26000.0 519.2388 16000.0 529.2236 43000.0 533.2535 8800.0 534.2271 14000.0 547.2407 32000.0 561.2488 3100.0 575.2651 720000.0 576.2719 4000.0 583.9219 3100.0 603.2604 54000.0 607.2833 4200.0 635.2862 79000.0 646.9149 3200.0 END IONS BEGIN IONS SCANS=800 PEPMASS=615.2582 CHARGE=1 COLLISION_ENERGY=0.0 68.4896 2200.0 81.0695 3700.0 89.0592 70000.0 90.1715 2200.0 93.0692 9300.0 95.0488 12000.0 95.0851 14000.0 95.1576 2500.0 97.0641 2700.0 105.0693 2300.0 107.085 11000.0 107.2692 2700.0 109.1003 2900.0 119.0851 16000.0 121.1007 14000.0 123.08 12000.0 125.0591 31000.0 133.0854 29000.0 133.1003 13000.0 134.8042 14000.0 134.8162 12000.0 135.0796 4000.0 136.577 2200.0 137.0954 2900.0 143.0843 7700.0 145.101 18000.0 147.0802 12000.0 150.2494 3000.0 151.0747 32000.0 157.1009 11000.0 159.1166 9600.0 161.0953 8800.0 161.1324 2900.0 163.1114 57000.0 165.0904 56000.0 171.1169 14000.0 173.1323 4900.0 173.5262 49000.0 173.5413 53000.0 179.1063 2800.0 181.1217 81000.0 183.1172 2500.0 185.1326 3200.0 189.128 12000.0 191.1425 3300.0 197.1328 5100.0 198.3016 2900.0 199.1123 9400.0 203.1429 26000.0 207.1376 18000.0 211.1465 5800.0 217.6695 2400.0 221.1533 78000.0 227.1417 7500.0 233.1523 6000.0 243.1389 3000.0 245.813 2600.0 247.1697 10000.0 271.1707 3000.0 285.1849 3000.0 286.1914 12000.0 287.2004 11000.0 297.1835 2400.0 300.2108 7400.0 312.2077 27000.0 349.1802 2400.0 352.2386 2800.0 407.2569 14000.0 494.3347 2800.0 495.2533 9000.0 509.1962 3700.0 510.1129 2800.0 510.2026 360000.0 510.2889 5100.0 511.2457 6000.0 523.218 3300.0 524.2185 140000.0 537.2301 10000.0 538.2323 8700.0 539.048 46000.0 539.0868 31000.0 539.2411 7400000.0 539.394 23000.0 539.4356 39000.0 539.4905 16000.0 540.2431 9100.0 571.2647 23000.0 581.0372 3000.0 583.2274 9400.0 615.4037 16000.0 END IONS BEGIN IONS SCANS=801 PEPMASS=592.2685 CHARGE=1 COLLISION_ENERGY=0.0 64.4444 2300.0 65.805 4600.0 65.8092 21000.0 66.0303 2500.0 72.0936 2100.0 73.0282 3500.0 77.9784 2200.0 91.0714 2300.0 91.2528 2100.0 91.4325 2200.0 96.0359 2700.0 96.7253 2300.0 101.0329 2800.0 111.536 2400.0 112.3027 2200.0 116.0702 6000.0 128.16 2300.0 141.8264 2800.0 155.3744 2600.0 162.0758 12000.0 164.6237 2600.0 167.0704 11000.0 173.5222 28000.0 173.5327 36000.0 173.5409 40000.0 185.2935 2400.0 195.8635 2900.0 203.426 2900.0 205.5678 2400.0 255.4696 2700.0 262.3892 2300.0 321.3161 2500.0 325.2555 2500.0 333.2571 2800.0 354.5404 2400.0 373.1799 7300.0 388.204 6800.0 393.1474 2400.0 431.1914 2300.0 432.233 2700.0 432.9573 2300.0 433.2406 18000.0 434.2437 4300.0 444.1961 2800.0 445.2003 3200.0 446.2113 3300.0 449.2303 3200.0 458.6775 3100.0 459.218 1200000.0 460.2248 320000.0 461.2334 130000.0 473.2328 46000.0 474.2402 12000.0 475.2495 2800.0 476.2553 11000.0 477.2224 2400.0 477.235 2800.0 477.2622 3100.0 486.24 5800.0 487.1251 2700.0 487.2467 51000.0 488.2504 36000.0 489.2275 7300.0 490.2357 4100.0 491.2439 110000.0 492.2523 110000.0 501.2282 17000.0 503.2421 8800.0 504.2469 96000.0 505.2268 96000.0 506.2668 14000.0 516.2498 13000.0 517.2231 95000.0 518.2318 9300.0 519.1481 4000.0 519.2392 310000.0 520.249 28000.0 521.2508 7200.0 531.2338 3400.0 532.2453 200000.0 532.3378 3900.0 533.2545 1600000.0 545.2187 4200.0 548.276 8000.0 549.2493 61000.0 560.2422 69000.0 562.2229 34000.0 563.2293 21000.0 564.2663 26000.0 565.2807 6000.0 577.2451 170000.0 577.3502 3300.0 592.2671 670000.0 593.2761 160000.0 END IONS BEGIN IONS SCANS=802 PEPMASS=593.2767 CHARGE=1 COLLISION_ENERGY=0.0 64.5444 21000.0 65.9167 360000.0 65.9208 1300000.0 66.7092 8200.0 71.399 17000.0 81.9419 17000.0 86.2625 18000.0 87.9132 7500.0 98.2098 21000.0 110.5297 21000.0 133.3074 55000.0 133.3193 130000.0 134.4801 23000.0 148.3123 88000.0 148.325 80000.0 173.5247 190000.0 173.538 330000.0 194.3828 9100.0 214.721 8600.0 294.0371 8700.0 415.5414 8100.0 417.2072 41000.0 419.2322 8900.0 431.1865 440000.0 432.193 61000.0 433.2382 590000.0 434.247 140000.0 445.2023 240000.0 446.211 310000.0 447.2173 660000.0 447.2734 20000.0 449.2371 35000.0 459.2181 670000.0 460.1504 18000.0 460.2248 2800000.0 461.1599 48000.0 461.2331 2700000.0 462.2407 210000.0 463.2158 54000.0 473.2332 690000.0 474.2402 170000.0 475.2567 25000.0 476.2567 370000.0 477.2636 210000.0 487.248 600000.0 488.257 80000.0 489.2622 240000.0 491.2407 250000.0 492.2515 760000.0 493.258 110000.0 503.2441 130000.0 504.2374 10000.0 504.2479 62000.0 505.2249 1200000.0 506.2559 25000.0 507.2764 22000.0 515.244 380000.0 517.2569 130000.0 518.2311 240000.0 519.2397 260000.0 520.2447 240000.0 531.2508 9500.0 532.9608 29000.0 533.0638 360000.0 533.1025 160000.0 533.2543 58000000.0 533.4012 230000.0 533.4463 330000.0 533.4987 82000.0 533.5542 48000.0 534.2588 600000.0 543.2383 37000.0 547.2705 690000.0 549.2267 19000.0 549.2465 34000.0 549.26 11000.0 550.2578 120000.0 551.2652 27000.0 558.158 9900.0 561.2493 530000.0 563.2303 25000.0 564.2371 770000.0 564.3244 12000.0 565.2806 1800000.0 568.585 22000.0 575.265 990000.0 578.2525 190000.0 593.0539 270000.0 593.0975 200000.0 593.2756 40000000.0 593.4533 150000.0 593.4998 280000.0 END IONS BEGIN IONS 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113.3862 2400.0 115.0539 3800.0 116.4538 2300.0 117.0697 76000.0 117.3846 2200.0 118.0776 3000.0 119.0487 9100.0 119.0758 14000.0 119.0854 880000.0 119.0954 5500.0 120.0918 71000.0 121.0646 87000.0 121.0911 5200.0 121.101 650000.0 121.1093 2100.0 122.0725 11000.0 122.1043 44000.0 123.0803 320000.0 123.1167 58000.0 124.0842 13000.0 125.0491 4300.0 125.0595 440000.0 125.0958 8500.0 125.6301 2700.0 126.0623 9500.0 128.062 6500.0 129.0699 60000.0 130.0778 6100.0 131.0854 290000.0 132.0931 99000.0 133.0649 51000.0 133.086 110000.0 133.1011 540000.0 134.1082 92000.0 135.0803 320000.0 135.1167 250000.0 136.0847 21000.0 136.12 3400.0 137.0598 32000.0 137.096 300000.0 137.132 3200.0 137.2213 3300.0 138.1001 35000.0 139.0752 120000.0 139.1117 31000.0 140.0786 2800.0 141.0694 12000.0 142.0777 49000.0 143.0854 300000.0 144.0929 120000.0 145.0646 6200.0 145.1011 890000.0 145.1143 21000.0 146.0723 8900.0 146.1068 76000.0 146.9372 2700.0 147.0803 580000.0 147.0933 3700.0 147.1166 190000.0 148.0844 79000.0 148.122 16000.0 149.096 230000.0 149.1321 10000.0 150.1033 34000.0 151.0752 340000.0 151.1119 38000.0 152.0804 47000.0 153.0907 25000.0 155.0853 110000.0 156.0931 74000.0 157.1011 700000.0 158.1078 170000.0 159.0804 130000.0 159.1168 540000.0 160.088 34000.0 160.1233 92000.0 161.0961 250000.0 161.1324 240000.0 161.1461 2800.0 162.1021 33000.0 162.1359 46000.0 163.0761 19000.0 163.1117 900000.0 163.127 3200.0 164.1161 55000.0 165.0771 4500.0 165.091 2600000.0 165.1095 9400.0 166.0795 5100.0 166.0945 430000.0 166.1105 6000.0 167.0861 24000.0 167.1066 21000.0 167.3969 3800.0 168.0933 13000.0 169.1012 250000.0 170.1082 99000.0 171.0809 28000.0 171.1169 500000.0 172.0893 8400.0 172.1234 160000.0 173.0962 190000.0 173.1326 240000.0 173.5225 22000.0 173.5331 230000.0 173.5431 11000.0 174.1018 19000.0 174.1378 16000.0 175.1117 260000.0 175.1483 130000.0 176.119 39000.0 176.1512 11000.0 177.0911 120000.0 177.1109 17000.0 177.1275 96000.0 178.0987 100000.0 179.0876 11000.0 179.1066 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209.1534 21000.0 210.1384 66000.0 211.112 69000.0 211.1483 300000.0 211.1684 2500.0 212.1177 26000.0 212.1544 110000.0 213.1273 130000.0 213.1639 69000.0 214.1337 32000.0 215.1071 22000.0 215.1435 110000.0 216.1507 100000.0 217.1225 35000.0 217.1593 29000.0 218.1293 9900.0 219.1157 9500.0 219.1381 230000.0 220.1245 9200.0 220.1468 14000.0 221.1341 85000.0 221.1538 2800000.0 222.1572 630000.0 223.1117 35000.0 223.1482 130000.0 224.1183 6100.0 224.1539 25000.0 225.1273 110000.0 225.1641 140000.0 226.1344 17000.0 226.1698 23000.0 227.1432 100000.0 227.18 52000.0 228.1486 11000.0 228.1844 4200.0 229.1221 27000.0 229.1587 150000.0 230.1307 8800.0 230.1635 36000.0 231.1383 88000.0 231.1751 13000.0 232.1445 35000.0 232.1774 2900.0 233.1314 42000.0 233.1539 180000.0 234.1399 20000.0 234.1614 460000.0 235.1477 63000.0 235.1705 36000.0 236.1531 7500.0 237.1277 66000.0 237.1637 77000.0 238.1339 17000.0 238.17 23000.0 239.1434 75000.0 239.1793 85000.0 240.1505 25000.0 240.1869 170000.0 241.1236 20000.0 241.1588 82000.0 242.1675 3800.0 243.1382 89000.0 243.1723 9000.0 244.1431 8100.0 245.1544 70000.0 246.162 7300.0 247.1444 7100.0 247.1694 760000.0 247.1993 4400.0 248.1744 220000.0 249.132 13000.0 249.1634 67000.0 250.1688 7200.0 251.1429 70000.0 251.1787 73000.0 252.1489 8300.0 253.1302 4400.0 253.1585 94000.0 253.1939 27000.0 254.1638 4700.0 255.1395 24000.0 255.174 57000.0 256.1456 16000.0 256.1801 30000.0 257.1533 51000.0 257.1865 15000.0 258.1571 4500.0 259.1446 3400.0 259.1692 140000.0 260.1506 5200.0 260.177 84000.0 261.1578 9900.0 261.1852 96000.0 263.1479 4300.0 263.1788 67000.0 264.1845 10000.0 265.1581 46000.0 265.1934 44000.0 266.1663 9100.0 267.1421 3100.0 267.174 68000.0 268.1815 7600.0 269.1542 74000.0 269.1891 67000.0 270.1606 3200.0 270.194 19000.0 271.1695 120000.0 272.1769 26000.0 273.1857 78000.0 274.193 370000.0 275.1769 15000.0 277.1596 8300.0 277.1938 33000.0 279.1743 88000.0 279.2092 28000.0 280.1818 5700.0 281.1524 3200.0 281.1902 140000.0 282.1957 26000.0 283.1699 38000.0 283.2045 9500.0 284.1766 21000.0 285.1849 110000.0 286.1925 190000.0 287.167 8000.0 287.2008 530000.0 288.204 130000.0 289.1953 31000.0 291.1749 26000.0 291.21 18000.0 292.1802 7700.0 293.1902 50000.0 294.1952 23000.0 295.1721 5000.0 295.2065 39000.0 297.1849 140000.0 297.2199 25000.0 298.1922 18000.0 299.2007 530000.0 300.2078 110000.0 301.2184 6800.0 305.1912 6400.0 307.2056 80000.0 309.1845 52000.0 309.2217 26000.0 310.1927 63000.0 311.2004 150000.0 312.2083 220000.0 313.2163 480000.0 314.2199 52000.0 315.2076 3900.0 318.2003 4700.0 319.2055 52000.0 321.2208 9200.0 322.2282 12000.0 323.1998 26000.0 324.2071 11000.0 325.2163 590000.0 326.2224 72000.0 327.1979 4000.0 327.232 200000.0 328.2355 70000.0 333.2219 5900.0 334.2287 9900.0 336.2039 4400.0 337.216 180000.0 338.2212 4900.0 338.2612 8400.0 339.2319 160000.0 340.169 3800.0 340.1953 4500.0 340.2396 1200000.0 347.2365 9700.0 348.242 4700.0 349.2132 3500.0 351.2318 59000.0 352.2396 550000.0 353.2467 13000.0 363.2319 22000.0 365.2471 300000.0 366.2521 64000.0 374.2526 2800.0 376.2343 3000.0 377.2476 43000.0 378.2545 4700.0 379.2627 63000.0 385.2362 22000.0 387.2563 52000.0 391.264 90000.0 392.2673 68000.0 395.0955 2500.0 402.2848 3400.0 405.2787 88000.0 411.2525 56000.0 413.269 200000.0 414.1276 4400.0 414.2719 51000.0 419.2942 93000.0 420.3 130000.0 425.2025 4200.0 425.2684 650000.0 425.33 4300.0 426.2764 110000.0 427.2844 550000.0 427.3501 5800.0 428.2874 130000.0 428.6857 2700.0 429.2822 4400.0 439.282 14000.0 440.2918 930000.0 440.3466 3200.0 440.3584 4200.0 453.2984 16000.0 454.3027 34000.0 487.3195 35000.0 493.3307 23000.0 505.3289 75000.0 505.406 4000.0 507.3459 26000.0 508.3481 26000.0 516.9064 2800.0 519.345 3400.0 520.3522 140000.0 535.8594 2800.0 545.1984 3000.0 554.4011 2600.0 567.3805 14000.0 581.111 4500.0 582.4059 3100.0 585.3927 78000.0 600.4129 76000.0 605.4372 3900.0 609.4781 2800.0 END IONS BEGIN IONS SCANS=804 PEPMASS=599.4101 CHARGE=1 COLLISION_ENERGY=0.0 67.054 4200.0 69.0334 4400.0 69.0695 6000.0 69.7538 2400.0 75.2282 2300.0 79.0542 2900.0 81.0696 15000.0 83.0489 3700.0 83.0854 5100.0 85.0646 3500.0 90.493 2600.0 91.0541 5000.0 93.0695 22000.0 95.049 7700.0 95.0852 20000.0 97.0646 7700.0 105.0696 19000.0 107.0852 22000.0 109.0646 7100.0 109.1008 7600.0 113.0961 2600.0 117.0693 3200.0 119.0852 31000.0 121.0645 3600.0 121.1009 34000.0 123.0801 18000.0 123.1165 4400.0 125.0593 12000.0 131.0851 10000.0 133.0641 3000.0 133.1009 20000.0 135.08 16000.0 135.1166 12000.0 137.0606 3400.0 137.0958 22000.0 139.075 7500.0 143.0854 13000.0 145.101 27000.0 147.0801 47000.0 147.1164 6600.0 149.096 10000.0 151.0751 23000.0 153.0906 3000.0 155.0848 6600.0 156.093 4700.0 157.1009 39000.0 159.0808 4400.0 159.1166 18000.0 161.096 11000.0 161.1322 19000.0 163.1115 31000.0 165.0909 230000.0 165.1036 2400.0 167.1061 2900.0 169.1009 13000.0 170.1087 3100.0 171.1167 32000.0 173.0961 10000.0 173.1325 10000.0 173.5345 26000.0 175.1117 5800.0 175.1487 7400.0 177.0907 5600.0 177.127 3900.0 179.1073 3300.0 179.1427 4700.0 181.1024 3500.0 181.1224 12000.0 183.1169 29000.0 185.1324 24000.0 187.1477 7100.0 189.1274 14000.0 191.1066 15000.0 191.1437 4700.0 195.1165 9100.0 195.1363 5300.0 196.1263 2400.0 197.0979 3200.0 197.1324 15000.0 199.1117 5300.0 199.1477 4600.0 201.1273 5100.0 203.143 97000.0 207.1165 6000.0 207.1382 14000.0 209.1324 13000.0 211.1124 4900.0 211.1482 17000.0 213.1284 4900.0 215.1441 5900.0 221.1346 7100.0 221.1537 230000.0 223.1488 4800.0 225.1272 6300.0 225.1642 4900.0 227.1424 3600.0 227.1798 4400.0 229.1232 3700.0 229.1583 9200.0 231.1388 6500.0 233.1546 5100.0 235.1478 3900.0 237.1273 3400.0 237.1642 4700.0 239.1782 2500.0 247.1438 2700.0 247.1692 49000.0 249.1638 3200.0 251.1432 4400.0 251.1781 2500.0 263.179 5100.0 263.8222 2300.0 265.1582 2900.0 267.173 3400.0 269.1901 4700.0 271.1707 4200.0 281.1908 3900.0 285.1854 4500.0 286.1922 3900.0 287.2012 38000.0 293.1904 4300.0 295.2077 4200.0 299.2011 12000.0 309.1862 3600.0 310.1919 2800.0 311.2012 9600.0 313.2179 12000.0 325.2176 7900.0 327.2328 14000.0 335.2045 2800.0 365.2483 13000.0 391.2635 8100.0 413.2704 9500.0 419.2956 14000.0 427.2855 25000.0 453.2996 6500.0 507.3503 2500.0 519.3483 7600.0 599.4095 8100.0 END IONS BEGIN IONS SCANS=805 PEPMASS=434.2819 CHARGE=1 COLLISION_ENERGY=0.0 57.0697 24000.0 59.049 10000.0 67.0541 5100.0 68.667 2500.0 69.0331 2700.0 69.0696 5500.0 79.054 3400.0 81.0696 33000.0 85.0646 13000.0 89.0341 2200.0 91.0541 9800.0 93.0696 33000.0 94.7147 2200.0 95.0488 17000.0 95.0851 20000.0 95.3232 2300.0 96.755 2400.0 97.0643 6600.0 105.0627 4000.0 105.0696 120000.0 107.0852 26000.0 108.3976 2500.0 109.0645 67000.0 109.1009 8300.0 111.0803 3800.0 117.0693 5600.0 119.0852 140000.0 121.0645 11000.0 121.1008 38000.0 123.0802 40000.0 125.0594 18000.0 129.0701 3500.0 130.3509 2300.0 131.0853 37000.0 133.0648 7100.0 133.1008 48000.0 135.0801 52000.0 135.1166 11000.0 137.0599 7500.0 137.0959 31000.0 142.0765 2500.0 143.0853 36000.0 144.0936 3100.0 145.1009 67000.0 147.0802 110000.0 147.1164 11000.0 148.0876 7000.0 149.0959 38000.0 149.6819 5500.0 149.6934 5300.0 150.1035 3000.0 151.0752 45000.0 155.0851 18000.0 156.0931 12000.0 157.1009 66000.0 159.0802 18000.0 159.1166 48000.0 161.096 38000.0 161.1323 22000.0 162.1037 7200.0 163.0744 3100.0 163.1119 29000.0 164.1204 2400.0 165.0909 220000.0 167.0861 6200.0 168.0937 11000.0 169.1012 35000.0 170.1092 13000.0 171.1169 62000.0 173.0961 24000.0 173.1324 16000.0 173.5267 11000.0 173.5352 23000.0 175.1117 47000.0 175.1479 3200.0 177.0911 26000.0 177.1289 3100.0 178.0989 13000.0 179.1067 2900.0 181.1014 16000.0 181.1221 7700.0 182.1075 3000.0 183.1169 130000.0 184.1238 3900.0 185.0962 4700.0 185.1325 24000.0 187.1118 28000.0 187.1483 15000.0 188.1205 3200.0 189.1274 24000.0 190.1352 30000.0 191.1069 37000.0 191.1438 2500.0 193.1028 9500.0 193.1224 28000.0 195.1169 29000.0 196.1244 11000.0 197.0966 3500.0 197.1324 29000.0 199.112 28000.0 201.1272 29000.0 202.1338 2800.0 203.1433 73000.0 207.1171 15000.0 207.1384 28000.0 209.1323 26000.0 210.1392 2700.0 211.112 18000.0 211.1485 56000.0 213.1273 31000.0 214.134 2600.0 215.1075 3200.0 215.143 13000.0 216.1517 6200.0 219.1382 32000.0 221.1323 14000.0 221.154 99000.0 222.1401 2700.0 223.1127 3700.0 223.1486 8000.0 225.1272 23000.0 225.1641 26000.0 227.1441 9900.0 229.1226 8800.0 229.1588 18000.0 230.1305 33000.0 233.1314 3300.0 233.1544 11000.0 234.1615 19000.0 235.1491 7500.0 237.1261 3000.0 237.164 8000.0 239.1436 21000.0 239.1789 6000.0 240.1515 7200.0 241.159 2700.0 243.1386 19000.0 247.1694 28000.0 249.1638 3400.0 251.1446 3600.0 251.1794 3000.0 253.1596 17000.0 255.1379 4600.0 259.1693 8700.0 265.1575 2500.0 267.1731 2900.0 268.182 20000.0 270.4082 2700.0 271.1698 20000.0 273.1617 4100.0 275.1785 3500.0 281.1899 18000.0 285.1857 4200.0 286.1933 100000.0 287.2015 13000.0 291.1755 3400.0 295.2043 2700.0 297.1849 9500.0 299.2011 33000.0 309.1826 2800.0 311.2005 14000.0 312.2089 15000.0 313.217 24000.0 315.2103 3000.0 327.1966 7100.0 335.2011 15000.0 337.2176 8200.0 355.2278 31000.0 373.2531 12000.0 391.2643 81000.0 391.3138 3700.0 397.0024 2600.0 419.2598 4500.0 END IONS BEGIN IONS SCANS=806 PEPMASS=761.1888 CHARGE=1 COLLISION_ENERGY=0.0 70.6448 2200.0 80.7479 2200.0 86.0962 4600.0 89.0592 3800.0 91.913 2500.0 99.7762 2500.0 116.7568 2400.0 121.0503 2300.0 143.9239 2700.0 148.3262 2700.0 149.6865 11000.0 149.6973 7600.0 173.5227 14000.0 173.5327 12000.0 173.5422 17000.0 184.073 63000.0 185.077 13000.0 186.0775 7300.0 235.0194 2600.0 279.6432 2500.0 327.2959 2600.0 335.1139 2700.0 343.0356 2500.0 387.1494 2700.0 417.7068 2500.0 433.2405 11000.0 447.2199 3800.0 459.2176 21000.0 460.2257 35000.0 461.2337 37000.0 468.6784 2800.0 473.2328 3700.0 476.2599 3200.0 477.2639 2500.0 487.2491 8100.0 492.2535 15000.0 505.2263 15000.0 515.2421 6200.0 533.2542 1700000.0 534.2592 5700.0 547.2711 19000.0 561.2501 12000.0 564.2353 11000.0 565.2808 62000.0 575.2653 32000.0 592.2677 25000.0 593.054 12000.0 593.2753 2600000.0 595.2793 11000.0 650.1749 3000.0 END IONS BEGIN IONS SCANS=807 PEPMASS=641.2969 CHARGE=1 COLLISION_ENERGY=0.0 66.4751 34000.0 66.4772 13000.0 66.5864 180000.0 66.5896 52000.0 66.9797 7000.0 70.858 5100.0 76.5184 4300.0 81.2928 4600.0 95.879 4000.0 96.2914 5300.0 106.8136 7300.0 110.9986 5500.0 112.328 4000.0 112.3498 6200.0 137.2184 4300.0 147.3331 3700.0 149.8153 14000.0 173.5209 11000.0 173.5286 100000.0 173.5411 36000.0 239.1543 10000.0 246.112 32000.0 261.3122 6700.0 264.731 4200.0 278.1647 6600.0 304.1438 4600.0 316.7363 6200.0 318.1597 80000.0 332.1778 4500.0 381.206 10000.0 397.2081 27000.0 409.2016 55000.0 410.2125 16000.0 411.2184 62000.0 412.2255 76000.0 421.2001 8700.0 422.2086 39000.0 423.2183 190000.0 424.2233 500000.0 425.1981 250000.0 435.2167 17000.0 436.2247 17000.0 437.233 120000.0 438.2029 35000.0 439.2132 270000.0 440.1602 3700.0 440.2209 540000.0 449.6644 5100.0 450.2037 22000.0 451.245 5600.0 452.2173 42000.0 453.2279 140000.0 454.2351 55000.0 455.2466 7100.0 464.2193 43000.0 465.2223 13000.0 465.2355 11000.0 466.247 7200.0 467.2492 32000.0 468.2587 24000.0 469.2235 73000.0 477.2295 27000.0 481.2249 100000.0 482.2319 91000.0 483.2003 15000.0 483.2784 26000.0 484.2475 64000.0 491.2438 8700.0 494.2475 5000.0 494.258 33000.0 495.2468 86000.0 496.2468 280000.0 497.2219 380000.0 498.2264 71000.0 501.2655 21000.0 505.2583 5400.0 508.235 6300.0 508.252 10000.0 509.2539 75000.0 510.2575 71000.0 511.2694 720000.0 512.2777 360000.0 519.2374 9000.0 521.2604 7900.0 522.257 63000.0 523.2684 190000.0 524.2749 170000.0 525.2537 88000.0 526.2624 38000.0 527.2668 94000.0 528.2854 7300.0 537.2732 110000.0 538.2549 380000.0 539.2646 220000.0 540.2734 290000.0 543.2933 10000.0 547.2669 14000.0 550.2572 6200.0 551.2637 17000.0 553.274 72000.0 554.2854 160000.0 555.2192 11000.0 555.2972 1300000.0 555.4411 6800.0 565.2813 230000.0 566.2491 62000.0 567.2624 6400.0 568.2674 6900.0 569.2793 62000.0 570.2506 110000.0 571.2764 190000.0 576.2865 5200.0 582.2837 60000.0 583.2564 56000.0 584.2639 28000.0 597.3073 460000.0 597.4141 9300.0 598.1939 18000.0 598.2788 1500000.0 599.0654 17000.0 599.287 5700000.0 613.3018 71000.0 641.2967 75000.0 END IONS BEGIN IONS SCANS=808 PEPMASS=663.2793 CHARGE=1 COLLISION_ENERGY=0.0 79.8468 2400.0 89.4507 2400.0 113.1271 2600.0 118.6758 2400.0 118.8608 2500.0 119.0849 2400.0 121.0997 4300.0 125.0588 7200.0 132.3129 2500.0 133.0995 3100.0 134.784 2500.0 141.7642 2300.0 142.966 2700.0 145.1003 2800.0 147.0797 3200.0 163.111 10000.0 165.0898 6000.0 173.535 80000.0 176.5329 2100.0 180.5347 2400.0 181.1212 5100.0 182.1246 3400.0 183.1163 2700.0 207.1382 3200.0 221.1531 5500.0 269.2261 2500.0 286.1908 2400.0 310.2124 2700.0 318.1594 13000.0 334.9964 2500.0 341.1498 65000.0 346.9832 2300.0 355.22 3500.0 381.369 2800.0 407.2546 7400.0 423.2184 100000.0 431.1838 10000.0 434.4071 2500.0 439.2027 7200.0 445.1999 77000.0 446.2083 66000.0 449.234 18000.0 450.2382 2900.0 458.2084 18000.0 459.2155 250000.0 459.2847 7600.0 460.2227 29000.0 463.2505 14000.0 471.2164 16000.0 472.2235 11000.0 473.2312 20000.0 477.2261 3600.0 477.265 2600.0 482.2121 5900.0 485.2313 88000.0 486.2373 55000.0 487.2107 22000.0 489.1625 4000.0 491.2463 3400.0 491.5969 2600.0 492.5615 3100.0 495.2547 33000.0 497.2314 78000.0 499.2399 8000.0 500.2546 61000.0 503.2809 9900.0 504.2136 37000.0 509.2568 2500.0 513.2253 24000.0 514.2341 29000.0 515.2399 9100.0 517.2194 15000.0 518.2289 470000.0 519.1472 5200.0 519.237 330000.0 522.2579 3900.0 523.2711 76000.0 528.2503 19000.0 531.2354 7300.0 536.2401 2800.0 541.2213 160000.0 543.2695 20000.0 545.2524 96000.0 546.26 32000.0 547.2668 4200.0 551.2649 39000.0 558.2265 26000.0 559.259 3200.0 560.2745 4200.0 565.2813 93000.0 569.2582 3000.0 573.1431 3600.0 573.2477 280000.0 573.3513 9300.0 587.2634 190000.0 589.1769 6900.0 619.2896 72000.0 663.4657 23000.0 END IONS BEGIN IONS SCANS=809 PEPMASS=299.2011 CHARGE=1 COLLISION_ENERGY=0.0 67.0542 6500.0 67.3104 2300.0 68.5184 2400.0 69.0329 2400.0 71.8842 2500.0 73.0282 8400.0 79.0539 12000.0 81.0696 57000.0 85.0645 46000.0 91.0542 13000.0 93.0191 2300.0 93.0697 25000.0 95.0852 16000.0 95.1508 2600.0 96.4148 2800.0 97.0273 2300.0 97.0646 3600.0 101.3111 2400.0 103.3844 2600.0 105.0697 36000.0 106.313 2500.0 107.0853 32000.0 109.0647 22000.0 111.0439 3400.0 117.0693 3300.0 119.0852 66000.0 121.0648 5400.0 121.1009 12000.0 121.1776 2700.0 123.0803 24000.0 129.0697 5600.0 131.0851 28000.0 133.0642 6200.0 133.101 47000.0 135.0803 34000.0 135.1173 3100.0 135.7467 2200.0 137.0594 24000.0 137.0959 7800.0 143.0853 29000.0 144.0931 12000.0 145.1008 38000.0 146.0725 6900.0 147.08 46000.0 147.1157 2800.0 148.0268 2300.0 148.088 5000.0 149.0959 21000.0 149.6902 5600.0 150.9515 2800.0 151.0751 100000.0 152.9865 2700.0 155.0851 6000.0 156.0929 6300.0 156.3131 2200.0 157.101 52000.0 158.1074 3500.0 159.0805 15000.0 159.0991 2900.0 159.1166 31000.0 160.0891 2200.0 160.1054 3500.0 161.0959 22000.0 165.0909 40000.0 168.8618 2500.0 169.1012 26000.0 170.1088 2600.0 171.1165 35000.0 173.0958 19000.0 173.1323 13000.0 173.268 2200.0 173.5214 7400.0 173.5324 110000.0 173.5467 5100.0 175.1121 18000.0 177.0911 41000.0 181.115 2900.0 182.108 3200.0 182.6514 2500.0 183.117 33000.0 184.1246 2800.0 186.1042 3200.0 187.1117 12000.0 188.1201 5400.0 189.1284 6900.0 191.1075 2900.0 193.1012 3300.0 194.108 3200.0 195.1158 32000.0 196.1234 6000.0 197.0951 5300.0 197.1322 27000.0 199.1121 30000.0 200.1187 9900.0 201.0926 2400.0 201.1271 23000.0 203.1429 8400.0 207.1169 6800.0 209.1328 15000.0 210.1374 2700.0 211.1121 3100.0 211.1486 2700.0 213.1274 37000.0 214.1356 6700.0 218.1294 2800.0 219.8236 2600.0 221.1292 10000.0 221.6279 8900.0 222.1328 2700.0 223.1476 7700.0 225.1263 13000.0 227.1038 2400.0 227.1429 7000.0 228.1322 26000.0 229.1221 16000.0 231.1368 2800.0 233.6343 2400.0 234.1334 7900.0 234.636 15000.0 235.1471 3000.0 237.1635 2900.0 239.1414 2500.0 241.1237 5100.0 241.1578 7400.0 243.1381 87000.0 243.6397 7500.0 247.1501 5600.0 249.1649 2700.0 251.1429 2600.0 253.1593 4000.0 255.1359 5600.0 257.1544 2800.0 260.4546 2600.0 262.1649 14000.0 271.1702 5000.0 281.1526 2800.0 282.2799 10000.0 285.1869 2500.0 291.8777 2500.0 299.0909 37000.0 299.1257 5100.0 299.1627 9700.0 299.2015 30000.0 299.2378 42000.0 313.9702 2500.0 333.2265 2600.0 334.1867 2300.0 347.9002 2500.0 388.3049 2300.0 422.168 2600.0 450.2637 2500.0 473.4591 2800.0 560.5996 2800.0 565.5994 2600.0 END IONS BEGIN IONS SCANS=810 PEPMASS=607.2921 CHARGE=1 COLLISION_ENERGY=0.0 67.4741 89000.0 67.4777 240000.0 76.8958 2400.0 91.7807 2700.0 96.5214 2100.0 97.4884 2200.0 102.4482 2600.0 102.5471 10000.0 116.5331 2800.0 142.8804 11000.0 145.049 2400.0 151.817 29000.0 151.8288 23000.0 152.0752 2500.0 163.0316 2600.0 164.9449 2900.0 169.3143 2700.0 173.5199 4100.0 173.5342 160000.0 182.2766 2400.0 188.2295 2800.0 317.5583 2700.0 405.2095 3100.0 431.1861 37000.0 432.1936 3400.0 433.2398 43000.0 434.2469 50000.0 435.2542 16000.0 445.2033 4500.0 446.2094 37000.0 447.2174 150000.0 459.2177 95000.0 460.2241 380000.0 461.2328 260000.0 462.2402 73000.0 473.2331 99000.0 474.2304 3400.0 474.2424 5400.0 476.2554 30000.0 477.2701 3100.0 478.2317 4000.0 487.249 82000.0 489.2636 95000.0 491.2422 24000.0 492.2481 23000.0 504.2124 4500.0 505.2259 86000.0 506.2388 56000.0 506.2538 8700.0 507.2738 72000.0 515.2456 34000.0 517.2585 94000.0 518.231 26000.0 519.1623 3500.0 519.239 94000.0 520.2442 24000.0 532.2074 2900.0 533.2543 3900000.0 534.2581 290000.0 535.2699 2000000.0 547.2355 4600.0 550.2534 3700.0 561.2542 100000.0 563.3061 28000.0 565.2815 20000.0 578.2514 120000.0 579.2939 110000.0 589.2815 44000.0 592.267 61000.0 607.0625 48000.0 607.2913 7900000.0 607.4695 7300.0 607.5245 14000.0 END IONS BEGIN IONS SCANS=811 PEPMASS=653.2974 CHARGE=1 COLLISION_ENERGY=0.0 74.8839 2300.0 87.3715 2400.0 93.5774 2400.0 108.9735 3300.0 116.0944 2800.0 141.305 2400.0 156.9287 2400.0 171.1291 2500.0 173.5262 34000.0 173.5428 9300.0 213.7589 2500.0 218.7256 2700.0 220.4082 2400.0 245.8504 2200.0 266.2087 2600.0 420.2316 8000.0 465.2184 3000.0 477.2663 12000.0 479.244 20000.0 491.2085 8000.0 492.2129 30000.0 493.2598 10000.0 494.2679 15000.0 503.2437 160000.0 504.2473 67000.0 505.2237 3700.0 505.2339 2700.0 519.2299 2200.0 520.1314 30000.0 521.2541 100000.0 522.2576 14000.0 534.2294 4400.0 537.25 19000.0 547.2332 53000.0 548.2415 7000.0 563.2675 2900.0 565.2444 1600000.0 566.2507 20000.0 575.2325 3100.0 579.2601 22000.0 594.2807 35000.0 607.2556 53000.0 653.1834 9400.0 653.2955 47000.0 END IONS BEGIN IONS SCANS=812 PEPMASS=657.2691 CHARGE=1 COLLISION_ENERGY=0.0 71.33 2500.0 71.4537 2600.0 72.3462 2300.0 73.0281 43000.0 73.0322 10000.0 74.0468 2400.0 77.455 2500.0 79.2686 2300.0 93.7712 2400.0 100.9274 2200.0 113.3579 2500.0 123.2959 2200.0 128.489 2800.0 150.5723 2400.0 173.5239 21000.0 173.5358 57000.0 173.5441 7700.0 246.8581 2600.0 276.4243 2800.0 280.5375 2500.0 317.2854 2900.0 337.8051 2700.0 439.0823 2400.0 466.9698 3000.0 493.7986 2800.0 498.1982 5400.0 541.1833 3100.0 553.2213 43000.0 597.2511 14000.0 643.1121 2500.0 653.2824 2400.0 656.7162 2400.0 657.2677 1200000.0 END IONS BEGIN IONS SCANS=813 PEPMASS=635.287 CHARGE=1 COLLISION_ENERGY=0.0 65.4697 3900.0 67.4749 4300.0 67.4783 4500.0 70.585 6600.0 70.5895 5500.0 95.0431 2300.0 101.3141 12000.0 110.2588 12000.0 140.8576 2300.0 141.6648 2300.0 143.8099 37000.0 143.8233 32000.0 173.5373 160000.0 177.1967 2400.0 195.6899 2900.0 215.567 2500.0 226.6592 2500.0 417.1684 4500.0 417.2135 16000.0 419.2237 76000.0 431.1813 22000.0 432.1949 4100.0 433.2005 4100.0 442.1751 5300.0 445.2025 62000.0 446.2105 120000.0 447.2191 380000.0 448.226 3200.0 459.2164 58000.0 460.2195 16000.0 461.1989 24000.0 473.1997 160000.0 474.2053 570000.0 475.2138 1200000.0 476.2176 9100.0 478.2321 4400.0 487.2136 460000.0 488.2212 87000.0 489.2313 3800.0 491.2449 19000.0 501.2291 420000.0 502.2366 35000.0 503.2413 46000.0 506.2335 62000.0 507.2395 4200.0 515.2026 6200.0 517.2251 100000.0 518.2309 20000.0 519.2428 150000.0 529.2244 220000.0 530.2314 23000.0 531.2412 210000.0 532.2312 3900.0 533.249 61000.0 534.2278 150000.0 545.2237 25000.0 546.2375 21000.0 547.2627 1300000.0 548.2386 4600.0 557.2215 7300.0 560.2417 69000.0 561.2508 610000.0 574.9953 31000.0 575.0545 120000.0 575.1814 190000.0 575.2662 17000000.0 575.4318 18000.0 575.4803 24000.0 576.1596 2900.0 576.2691 250000.0 579.27 86000.0 589.2461 390000.0 592.2622 4100.0 603.259 120000.0 606.2775 4300.0 607.2911 710000.0 620.2603 7300.0 635.1602 2700.0 635.1904 11000.0 635.2874 1100000.0 END IONS BEGIN IONS SCANS=814 PEPMASS=634.2796 CHARGE=1 COLLISION_ENERGY=0.0 71.8055 2400.0 73.4399 2500.0 109.3131 2600.0 129.1769 2400.0 129.9301 2100.0 168.2073 2800.0 173.525 35000.0 173.5436 19000.0 204.066 3500.0 208.5326 2500.0 222.3264 2700.0 237.1039 2700.0 270.4842 2800.0 296.7384 2300.0 383.1642 3000.0 412.1304 3200.0 430.8851 2500.0 438.1461 13000.0 441.1693 30000.0 445.203 30000.0 446.2089 3800.0 447.2184 14000.0 454.1781 14000.0 459.2157 3500.0 461.2335 2700.0 462.6381 2800.0 473.135 2200.0 473.1978 340000.0 474.2064 68000.0 475.2136 61000.0 487.2128 40000.0 500.2193 8200.0 501.1981 65000.0 502.2354 30000.0 505.2254 22000.0 506.233 12000.0 514.2032 3400.0 515.209 24000.0 517.2205 4600.0 519.222 5800.0 529.2259 16000.0 530.2322 4900.0 531.2379 15000.0 533.1365 3400.0 533.2201 410000.0 534.2625 2900.0 535.9294 2700.0 546.2513 3400.0 546.2623 2400.0 547.2414 41000.0 556.2154 3200.0 559.234 31000.0 560.2516 3000.0 561.2499 4100.0 563.2568 4500.0 573.2458 9000.0 574.2575 83000.0 575.266 620000.0 587.2288 4200.0 591.2592 33000.0 601.2515 3900.0 602.2537 110000.0 602.3542 4500.0 605.2777 13000.0 619.2548 46000.0 634.2793 64000.0 635.2911 3500.0 END IONS BEGIN IONS SCANS=815 PEPMASS=600.4177 CHARGE=1 COLLISION_ENERGY=0.0 67.0539 51000.0 67.5758 2200.0 69.0333 28000.0 69.0696 46000.0 71.013 2700.0 71.049 12000.0 73.0645 2800.0 77.0388 2800.0 79.0539 81000.0 80.0618 16000.0 81.0645 3900.0 81.0695 210000.0 81.1993 2100.0 81.6937 2400.0 83.0445 2500.0 83.0488 81000.0 83.0852 45000.0 85.0646 37000.0 87.0437 9700.0 89.0593 130000.0 91.0539 89000.0 92.062 10000.0 92.4242 2200.0 93.0695 260000.0 94.0779 5000.0 95.0427 2900.0 95.0488 140000.0 95.0795 3500.0 95.0851 180000.0 97.0644 79000.0 97.101 6000.0 98.7878 2500.0 99.0441 7800.0 101.0595 2300.0 105.0695 280000.0 106.0775 21000.0 107.0486 3600.0 107.0851 280000.0 108.0932 4700.0 109.0644 91000.0 109.0858 2400.0 109.1008 150000.0 110.0722 6500.0 111.0434 6800.0 111.0801 36000.0 113.0959 18000.0 113.1817 2200.0 114.0681 3300.0 117.0695 65000.0 118.0776 8000.0 119.0755 10000.0 119.0852 570000.0 119.0956 12000.0 120.093 50000.0 121.0646 40000.0 121.0922 3700.0 121.1008 290000.0 122.0723 4100.0 122.1051 2900.0 123.0801 180000.0 123.1164 38000.0 125.0503 4300.0 125.0593 180000.0 125.0958 31000.0 128.0622 10000.0 129.0697 39000.0 130.0774 15000.0 131.0748 5000.0 131.0852 220000.0 132.093 66000.0 133.0647 14000.0 133.0857 64000.0 133.1009 320000.0 134.1087 30000.0 135.0802 110000.0 135.1165 120000.0 136.0878 9900.0 137.0594 11000.0 137.0957 120000.0 138.1037 17000.0 139.075 21000.0 139.1115 36000.0 141.0696 7000.0 142.0775 30000.0 143.0852 200000.0 144.093 81000.0 145.065 14000.0 145.0889 8000.0 145.1009 590000.0 146.0707 2600.0 146.1082 41000.0 147.0801 140000.0 147.1165 150000.0 148.0882 2700.0 149.0959 86000.0 149.1323 19000.0 150.1036 11000.0 151.0752 67000.0 151.1117 21000.0 151.1478 2400.0 152.0802 2700.0 153.0904 20000.0 153.1256 2400.0 154.0654 2400.0 155.0853 55000.0 155.1064 21000.0 156.0929 59000.0 157.0837 7800.0 157.1009 390000.0 157.1124 2200.0 158.1085 83000.0 159.0802 57000.0 159.1024 5300.0 159.1166 310000.0 160.0878 59000.0 160.1236 23000.0 160.3652 2500.0 161.096 94000.0 161.1323 80000.0 162.1026 6800.0 163.1115 280000.0 165.0908 420000.0 166.0943 51000.0 167.0857 11000.0 167.1066 5000.0 168.0933 8600.0 169.1011 140000.0 169.3143 2300.0 170.1087 47000.0 171.0808 10000.0 171.1167 260000.0 172.1243 62000.0 173.0962 60000.0 173.1324 190000.0 173.5211 45000.0 173.5396 99000.0 174.1039 3100.0 174.1387 2800.0 175.1116 84000.0 175.1264 2500.0 175.1482 100000.0 176.1179 6100.0 176.6667 2700.0 177.0909 26000.0 177.1272 44000.0 178.0987 19000.0 179.087 12000.0 179.1064 20000.0 179.1429 11000.0 180.0937 5800.0 180.1142 26000.0 181.1016 59000.0 181.1222 190000.0 182.109 30000.0 183.1167 190000.0 184.1237 38000.0 185.0961 25000.0 185.1324 190000.0 185.151 2600.0 186.1397 29000.0 187.1116 49000.0 187.148 86000.0 189.1272 81000.0 189.1642 3200.0 190.135 77000.0 191.1068 35000.0 191.1429 68000.0 192.1511 3700.0 193.102 37000.0 193.1223 120000.0 194.1087 18000.0 195.1167 130000.0 195.1368 23000.0 196.1243 47000.0 197.0988 4300.0 197.1128 4300.0 197.1324 200000.0 198.1053 3100.0 198.1397 30000.0 199.1118 52000.0 199.148 78000.0 200.1182 9700.0 200.156 5800.0 201.1274 60000.0 201.1636 36000.0 203.1081 4600.0 203.143 210000.0 203.4512 2500.0 204.1472 30000.0 205.1234 2900.0 205.1586 10000.0 206.1101 5400.0 207.1167 59000.0 207.1381 78000.0 208.1245 21000.0 208.1454 33000.0 209.097 3400.0 209.1324 170000.0 209.1538 5300.0 210.1398 24000.0 211.1118 28000.0 211.1482 150000.0 212.1187 3100.0 212.1551 26000.0 213.1275 51000.0 213.1636 35000.0 214.1349 10000.0 215.1069 9500.0 215.1429 45000.0 216.1503 25000.0 217.1217 10000.0 217.1586 26000.0 219.1166 8500.0 219.1382 55000.0 220.1245 5300.0 220.1453 2900.0 221.1322 60000.0 221.1537 460000.0 221.1784 5000.0 222.1573 63000.0 223.1118 7500.0 223.1481 98000.0 224.1563 14000.0 225.1274 36000.0 225.1638 66000.0 226.1359 6600.0 226.1713 4900.0 227.1429 34000.0 227.1797 9200.0 228.1499 4100.0 229.1584 34000.0 229.191 2700.0 230.1641 2900.0 231.1385 24000.0 231.1736 7500.0 233.1143 3900.0 233.1331 3400.0 233.1543 37000.0 234.1396 3500.0 234.1614 98000.0 235.1482 55000.0 236.1551 2800.0 237.1269 22000.0 237.1639 64000.0 238.1714 8900.0 239.1434 19000.0 239.1792 47000.0 240.1874 23000.0 241.159 18000.0 241.1957 6500.0 243.1384 14000.0 243.1731 7900.0 245.1545 9500.0 247.1476 16000.0 247.1695 120000.0 248.1763 20000.0 249.164 41000.0 250.1719 3600.0 251.1423 10000.0 251.1796 33000.0 252.1868 3200.0 253.1582 29000.0 253.1952 9900.0 255.1738 10000.0 257.1532 6900.0 257.1884 9300.0 259.1699 32000.0 259.2044 9000.0 260.1763 3500.0 261.1613 17000.0 261.1881 8400.0 263.1471 7500.0 263.1794 40000.0 264.1852 3300.0 265.1606 13000.0 265.195 30000.0 266.2028 2600.0 267.1747 22000.0 267.2113 8700.0 269.1558 15000.0 269.1889 21000.0 270.1977 4500.0 271.1693 31000.0 271.2061 6200.0 273.1867 19000.0 274.1933 74000.0 275.179 19000.0 277.1586 3100.0 277.1958 19000.0 279.1743 22000.0 279.2098 9700.0 281.1902 32000.0 283.1693 6600.0 283.2059 8300.0 285.1865 29000.0 285.2209 9800.0 286.1929 45000.0 287.2005 90000.0 288.2043 6000.0 289.1969 7700.0 291.2096 6000.0 293.1905 4100.0 294.5488 3000.0 296.2124 3400.0 297.1855 30000.0 297.2213 15000.0 298.1942 4400.0 299.2009 110000.0 300.2093 19000.0 303.2093 9000.0 304.2011 2300.0 305.2258 4900.0 307.2055 13000.0 309.1838 6300.0 310.1917 3700.0 311.2009 26000.0 312.2081 41000.0 313.2159 83000.0 319.2066 6300.0 323.199 2800.0 323.2382 23000.0 325.2165 97000.0 326.2228 3400.0 327.2329 24000.0 329.224 3400.0 337.2164 51000.0 338.2614 69000.0 339.2315 34000.0 340.2399 170000.0 347.2384 2700.0 351.2306 3400.0 352.2397 120000.0 353.2436 3900.0 363.562 3400.0 365.2476 59000.0 377.2446 5100.0 379.2637 10000.0 387.2533 9200.0 391.2652 7400.0 405.2777 6400.0 413.2699 29000.0 419.2948 7900.0 420.3027 15000.0 425.2692 110000.0 426.2764 16000.0 427.2856 92000.0 430.3243 30000.0 440.2928 170000.0 470.675 3000.0 476.3657 14000.0 487.3156 2700.0 505.3325 13000.0 507.3471 3200.0 508.35 11000.0 520.3531 20000.0 564.3828 2800.0 568.4301 20000.0 585.3954 6800.0 600.4187 7400.0 END IONS BEGIN IONS SCANS=816 PEPMASS=653.2973 CHARGE=1 COLLISION_ENERGY=0.0 75.1234 2300.0 112.768 2300.0 166.0646 2600.0 173.5212 8800.0 173.5399 19000.0 175.2823 2500.0 185.4997 2300.0 217.401 2300.0 405.2144 3400.0 420.231 86000.0 421.2401 7400.0 424.2262 5200.0 433.2418 5700.0 434.2447 9400.0 447.2161 3200.0 448.2205 7700.0 449.2344 21000.0 452.2194 25000.0 459.2187 15000.0 460.2254 37000.0 461.2398 3500.0 462.2047 11000.0 463.2115 2800.0 465.2278 20000.0 475.2135 30000.0 476.2206 19000.0 477.1487 3900.0 477.2282 110000.0 488.222 2900.0 489.2325 4600.0 491.2304 2700.0 492.251 43000.0 501.2244 5300.0 502.2311 9000.0 503.2422 19000.0 504.2556 3200.0 507.241 2800.0 518.2313 14000.0 521.2178 57000.0 521.2929 7800.0 535.2332 30000.0 536.2415 40000.0 537.2475 4400.0 547.2507 3500.0 549.2852 27000.0 551.2629 7500.0 561.2513 3200.0 563.2695 6400.0 575.2646 9100.0 576.2689 16000.0 577.2791 17000.0 593.2742 6000.0 607.2888 5100.0 608.2955 7700.0 621.2689 4400.0 636.2927 10000.0 END IONS BEGIN IONS SCANS=817 PEPMASS=824.5523 CHARGE=1 COLLISION_ENERGY=0.0 73.0282 3600.0 73.5804 4300.0 74.4899 2800.0 75.1705 2600.0 77.0384 11000.0 79.0538 450000.0 81.0332 51000.0 81.0695 680000.0 83.0488 69000.0 83.0852 130000.0 85.0282 52000.0 85.0646 39000.0 86.5343 2300.0 87.0436 2200.0 88.7152 2800.0 90.1631 2100.0 91.0388 9000.0 91.0485 3100.0 91.0539 310000.0 93.0695 600000.0 95.0489 69000.0 95.0852 600000.0 95.6265 2400.0 97.028 49000.0 97.0645 75000.0 97.1009 62000.0 98.6786 2600.0 99.0436 4000.0 99.0802 35000.0 99.1511 2800.0 100.473 2400.0 103.138 2400.0 103.1704 2300.0 105.0695 320000.0 107.0487 20000.0 107.0852 410000.0 109.0645 39000.0 109.0928 3600.0 109.1008 350000.0 111.0431 3200.0 111.0802 38000.0 111.9063 2200.0 113.0964 3700.0 115.0543 4100.0 117.0618 2600.0 117.0695 150000.0 119.0757 2800.0 119.0852 380000.0 121.0642 13000.0 121.0914 12000.0 121.1008 440000.0 122.3534 2700.0 123.08 38000.0 123.1165 100000.0 125.0958 33000.0 125.1957 2300.0 127.0386 28000.0 129.0542 16000.0 129.0696 61000.0 131.0749 3100.0 131.0852 260000.0 132.1246 2400.0 133.0645 8100.0 133.0905 4600.0 133.1009 450000.0 133.1128 4900.0 135.0802 37000.0 135.1166 310000.0 137.0958 40000.0 137.1322 17000.0 137.7774 2400.0 138.9001 2400.0 139.1116 18000.0 139.6448 2400.0 141.0695 6100.0 143.0854 61000.0 145.1009 260000.0 145.1633 2300.0 147.0803 6200.0 147.1041 2600.0 147.1165 340000.0 149.0958 47000.0 149.1322 200000.0 151.1118 20000.0 155.0841 5800.0 155.1063 10000.0 157.1008 100000.0 158.2993 2300.0 159.0811 2600.0 159.1166 290000.0 161.0966 11000.0 161.1323 220000.0 163.1118 30000.0 163.1478 53000.0 165.1273 5800.0 169.1009 20000.0 169.2522 2500.0 171.1018 2500.0 171.1167 120000.0 173.1178 3200.0 173.1324 180000.0 173.5191 22000.0 173.5332 230000.0 173.5462 7600.0 174.8505 2500.0 175.1121 3400.0 175.148 80000.0 177.1276 23000.0 179.1428 5400.0 183.1169 38000.0 185.1325 100000.0 187.1479 67000.0 189.1636 10000.0 191.1427 4200.0 193.6879 2300.0 195.1383 6700.0 197.1325 27000.0 199.148 73000.0 201.164 32000.0 202.2376 2900.0 203.143 8000.0 205.1576 2800.0 211.1486 10000.0 213.1638 31000.0 217.1581 10000.0 219.1744 9400.0 224.3697 2400.0 229.1959 7500.0 231.1728 2400.0 231.2105 29000.0 234.4676 2300.0 235.1711 3900.0 239.1787 16000.0 241.195 140000.0 243.2109 25000.0 257.1898 43000.0 259.2054 410000.0 261.221 83000.0 271.7361 2800.0 275.2012 70000.0 277.2163 12000.0 277.6296 2900.0 277.6394 3200.0 289.2147 2500.0 293.2118 87000.0 294.8957 2700.0 296.7598 2500.0 307.2671 2600.0 310.244 2500.0 315.232 25000.0 323.0296 2500.0 323.542 2600.0 333.2425 190000.0 335.2582 460000.0 336.2625 2700.0 337.2651 3500.0 349.2361 3100.0 412.6738 2700.0 416.8531 2700.0 471.0158 2300.0 480.1902 2500.0 525.7731 2300.0 535.6514 2500.0 539.4589 2700.0 559.2403 2400.0 569.414 3400.0 611.4657 14000.0 632.2296 3100.0 651.0586 2800.0 728.5739 2600.0 751.9543 3000.0 771.8162 2900.0 END IONS BEGIN IONS SCANS=818 PEPMASS=829.5074 CHARGE=1 COLLISION_ENERGY=0.0 73.0281 22000.0 73.791 2100.0 73.8952 2400.0 78.1534 3900.0 78.1579 4700.0 78.9919 2500.0 79.0538 21000.0 81.033 13000.0 81.0694 56000.0 81.2717 2300.0 82.6008 3600.0 82.6044 26000.0 83.0852 5100.0 83.3959 2200.0 85.0278 45000.0 85.1593 2100.0 87.0508 26000.0 87.0539 3500.0 87.9795 2800.0 89.3932 2200.0 90.3843 2400.0 90.9158 2800.0 91.0385 41000.0 91.054 8600.0 93.0694 32000.0 94.9855 2300.0 95.085 39000.0 97.0281 57000.0 97.0892 2800.0 99.0435 3200.0 101.0227 11000.0 101.8608 2800.0 103.0382 3600.0 105.0696 14000.0 105.3823 2200.0 106.1081 2300.0 106.9072 2400.0 106.9316 2600.0 107.0852 19000.0 107.5678 2500.0 108.4579 2400.0 109.0279 2700.0 109.1008 25000.0 109.7366 2400.0 114.1872 2300.0 118.1819 2100.0 119.0848 2600.0 120.8695 2200.0 121.1003 25000.0 123.1172 9100.0 127.0384 22000.0 127.2187 2500.0 133.1009 3200.0 135.1159 14000.0 145.1014 2700.0 147.116 8200.0 147.649 2500.0 149.1327 9200.0 149.6815 7000.0 149.6915 10000.0 153.3261 2400.0 154.1302 2900.0 159.0654 2500.0 159.1162 3700.0 161.1325 5500.0 161.5265 2600.0 163.5646 2100.0 167.1063 2300.0 171.1158 2800.0 173.1319 3100.0 173.5234 34000.0 173.5342 180000.0 173.5434 12000.0 173.9438 2500.0 181.3383 2400.0 183.6372 2500.0 185.0418 74000.0 190.0449 2300.0 201.0358 13000.0 203.0517 7400.0 220.5653 2400.0 226.8842 2500.0 227.1288 2500.0 241.0677 10000.0 243.0835 94000.0 247.1299 25000.0 259.8218 2900.0 261.2203 10000.0 287.1619 21000.0 301.0893 68000.0 306.7919 2500.0 313.0902 2900.0 315.1049 51000.0 315.1925 2700.0 327.1032 3000.0 327.2281 2800.0 331.1879 9000.0 333.203 58000.0 335.2575 61000.0 339.616 2700.0 343.1406 3300.0 351.0359 2300.0 355.1361 3500.0 357.1514 5300.0 359.9273 2600.0 369.1506 11000.0 371.1676 69000.0 373.1107 58000.0 379.3342 2800.0 383.1678 10000.0 385.1833 36000.0 387.1264 9400.0 413.1801 5400.0 415.0974 2600.0 423.1993 27000.0 425.1782 110000.0 425.2166 17000.0 429.173 25000.0 430.6182 3000.0 435.7151 2300.0 439.1857 2600.0 443.1895 13000.0 453.2063 4200.0 454.7294 2800.0 457.2053 12000.0 463.2259 9500.0 465.2096 190000.0 469.2035 16000.0 469.3326 2300.0 470.9035 2400.0 473.8995 2700.0 475.23 2900.0 483.2172 10000.0 483.3445 3300.0 493.2339 3400.0 497.2359 6200.0 497.3106 4500.0 505.2406 120000.0 509.2357 16000.0 519.2927 1000000.0 520.2959 18000.0 521.298 21000.0 523.2532 5700.0 523.3491 2500.0 533.2706 65000.0 534.0808 2500.0 537.2618 8300.0 541.3558 4400.0 549.2687 7500.0 551.2822 120000.0 553.297 9900.0 563.2772 3200.0 563.3713 4000.0 581.3815 10000.0 591.3149 200000.0 593.326 10000.0 597.4636 2600.0 605.3298 48000.0 607.3502 2800.0 613.4908 2600.0 619.3459 26000.0 626.5969 2400.0 633.3588 58000.0 636.8063 2900.0 639.3459 2500.0 647.3745 67000.0 649.4414 2400.0 661.3913 55000.0 673.381 7400.0 687.3987 7400.0 691.4053 6000.0 701.4223 110000.0 703.2628 5100.0 703.4022 500000.0 713.4209 15000.0 715.4464 3200.0 726.4763 2700.0 731.4275 16000.0 741.453 26000.0 743.2746 3600.0 743.4331 820000.0 743.5887 4800.0 744.4056 3000.0 749.4306 2900.0 755.4679 21000.0 783.2975 4200.0 783.4639 570000.0 811.496 73000.0 829.5039 170000.0 END IONS BEGIN IONS SCANS=819 PEPMASS=599.4103 CHARGE=1 COLLISION_ENERGY=0.0 67.054 14000.0 69.0333 10000.0 69.0696 9500.0 70.3302 2200.0 71.049 5200.0 71.9338 2200.0 79.054 16000.0 81.0696 44000.0 81.802 2100.0 83.0488 10000.0 83.0853 20000.0 84.623 2300.0 85.0645 11000.0 85.3098 2200.0 87.0437 4900.0 89.0596 2500.0 91.054 12000.0 93.0695 78000.0 95.0488 21000.0 95.0852 58000.0 95.9713 2400.0 97.0645 44000.0 105.0695 48000.0 107.0852 74000.0 109.0646 23000.0 109.1009 36000.0 111.0803 12000.0 113.0957 22000.0 117.0697 8400.0 119.0852 92000.0 121.0644 12000.0 121.1009 96000.0 123.0801 51000.0 123.1165 5400.0 125.0596 21000.0 125.096 15000.0 129.069 6100.0 131.0853 35000.0 133.0645 2900.0 133.1009 59000.0 134.7551 2500.0 135.0802 34000.0 135.1165 34000.0 137.0596 6000.0 137.0957 50000.0 139.0753 11000.0 139.1113 23000.0 141.4513 2400.0 143.0853 36000.0 144.0935 3700.0 145.1009 98000.0 147.0802 83000.0 147.1163 33000.0 149.0957 19000.0 151.0751 62000.0 151.1113 7500.0 153.09 2900.0 153.127 9200.0 155.0853 14000.0 155.1063 14000.0 156.0931 8100.0 157.1009 97000.0 158.1087 3500.0 159.08 6600.0 159.1166 63000.0 161.096 31000.0 161.1323 31000.0 163.1116 50000.0 164.9971 2300.0 165.0909 340000.0 167.1067 14000.0 169.101 34000.0 170.109 7800.0 171.0797 2900.0 171.1167 66000.0 172.2615 2500.0 173.0962 18000.0 173.1326 35000.0 173.5281 43000.0 173.5451 9000.0 175.1113 20000.0 175.1479 22000.0 177.0906 8300.0 177.1268 12000.0 179.143 14000.0 181.1017 13000.0 181.1223 38000.0 182.1078 3300.0 183.1167 53000.0 185.0963 2900.0 185.1323 50000.0 187.1112 14000.0 187.1479 18000.0 189.1275 29000.0 191.1062 14000.0 191.1425 7400.0 193.1017 6700.0 193.1219 3200.0 195.1167 33000.0 195.1376 15000.0 196.125 7400.0 197.1325 50000.0 199.1116 9700.0 199.1484 12000.0 201.1276 11000.0 203.1431 150000.0 203.1644 3700.0 205.1584 7100.0 207.117 17000.0 207.1381 37000.0 208.1249 9000.0 209.1325 37000.0 211.1124 8500.0 211.1484 34000.0 213.1276 11000.0 213.1637 3800.0 215.1436 10000.0 217.1236 4900.0 219.3885 2500.0 220.1245 3300.0 221.1333 14000.0 221.1537 330000.0 222.1404 4000.0 223.1484 25000.0 225.1277 4900.0 225.1642 11000.0 227.1426 7000.0 227.1804 3200.0 229.1221 6200.0 229.1587 15000.0 231.1395 3100.0 233.1306 3600.0 233.1539 14000.0 235.1481 18000.0 237.127 6800.0 237.1644 13000.0 239.1411 4600.0 241.1585 6600.0 243.1742 3700.0 245.1542 3500.0 247.1455 2600.0 247.1693 57000.0 248.1538 3100.0 249.165 8100.0 251.1445 4500.0 251.179 8700.0 255.1384 2600.0 261.1609 3300.0 261.1881 3200.0 263.1804 4300.0 265.1954 3100.0 267.1746 3700.0 269.191 5400.0 271.1707 4100.0 275.1786 4000.0 279.1754 3200.0 281.1904 8300.0 283.1716 2900.0 285.1847 19000.0 286.1936 21000.0 287.2008 50000.0 289.1955 4300.0 291.1773 3500.0 293.1915 2600.0 297.1843 3100.0 298.1937 8400.0 299.2009 30000.0 311.202 9200.0 312.207 8800.0 313.2163 15000.0 325.2171 10000.0 327.2323 15000.0 347.2357 3400.0 347.5928 2700.0 364.2396 6100.0 365.2481 16000.0 387.2586 2800.0 391.2625 8600.0 413.2706 17000.0 419.2966 8500.0 426.8123 2500.0 427.2846 17000.0 441.9625 2300.0 453.2972 2700.0 507.3472 48000.0 519.3478 4800.0 527.4471 2700.0 599.4109 12000.0 END IONS BEGIN IONS SCANS=820 PEPMASS=780.5537 CHARGE=1 COLLISION_ENERGY=0.0 71.0726 7500.0 71.324 2300.0 71.3817 2200.0 73.5277 2200.0 73.8543 2500.0 77.6908 2200.0 81.0694 11000.0 82.0327 2300.0 82.2619 2300.0 82.4598 2900.0 85.6959 2400.0 86.0961 280000.0 87.8644 2300.0 91.3257 2700.0 95.0853 3900.0 97.061 2300.0 98.9839 7700.0 101.7824 2600.0 104.1068 24000.0 104.8966 2500.0 124.6083 2300.0 124.9996 110000.0 146.9815 120000.0 173.5206 13000.0 173.5319 140000.0 180.3097 2700.0 184.0352 3800.0 184.0733 2300000.0 195.366 2400.0 201.5991 2400.0 216.8859 2500.0 217.5763 2100.0 220.3674 3100.0 231.4682 2300.0 232.0138 2500.0 235.3181 2300.0 262.2534 15000.0 278.8469 2300.0 299.3138 2500.0 326.5239 2700.0 359.0281 3400.0 374.674 2900.0 476.1272 2500.0 490.6158 2600.0 553.6021 2900.0 575.5035 14000.0 597.4869 28000.0 648.0811 2500.0 700.4622 2900.0 END IONS BEGIN IONS SCANS=821 PEPMASS=535.2705 CHARGE=1 COLLISION_ENERGY=0.0 69.7821 2200.0 121.5463 2700.0 138.5106 2500.0 173.5165 2600.0 173.5294 66000.0 173.546 8100.0 208.6768 3000.0 213.7012 2300.0 240.2592 3400.0 279.2464 2400.0 280.2612 2600.0 294.9753 2400.0 304.3607 2200.0 405.2065 2900.0 433.2012 13000.0 434.2452 35000.0 435.2542 98000.0 447.2175 74000.0 448.221 18000.0 461.2329 28000.0 462.2362 81000.0 463.2853 19000.0 489.2556 3000.0 489.2666 3400.0 500.492 3100.0 506.2311 45000.0 507.2747 240000.0 517.2604 17000.0 520.2452 18000.0 535.2695 1800000.0 535.5164 3600.0 END IONS BEGIN IONS SCANS=822 PEPMASS=827.4919 CHARGE=1 COLLISION_ENERGY=0.0 73.0279 13000.0 75.5852 2200.0 79.0539 29000.0 81.0331 7900.0 81.0694 63000.0 82.9281 2800.0 82.9868 2100.0 83.0492 2700.0 83.0852 14000.0 85.0279 35000.0 87.0437 2400.0 90.1687 2300.0 91.0385 24000.0 91.0537 15000.0 93.0694 37000.0 95.0851 58000.0 97.028 31000.0 97.064 3400.0 98.659 2400.0 99.0436 3000.0 102.4414 2500.0 105.0693 15000.0 107.085 26000.0 109.0277 3100.0 109.064 3200.0 109.1006 31000.0 117.0694 4200.0 119.0851 18000.0 121.1008 30000.0 121.6664 2400.0 123.1161 6400.0 125.0957 2500.0 127.0384 18000.0 131.0853 12000.0 133.1008 31000.0 135.1165 22000.0 145.1008 3500.0 147.1162 17000.0 149.132 13000.0 149.6832 5600.0 149.6936 4500.0 159.1161 6300.0 161.1321 3600.0 167.6153 2600.0 173.1321 8000.0 173.537 100000.0 175.6691 2600.0 179.5064 2900.0 183.46 2400.0 184.0732 2800.0 185.0423 21000.0 188.5969 2500.0 193.1215 8100.0 195.5787 2800.0 213.329 2300.0 217.5463 3200.0 237.0455 2400.0 243.0838 42000.0 260.2089 2900.0 261.2241 2900.0 270.1804 3300.0 273.1794 3000.0 275.2011 2800.0 313.1769 73000.0 331.1878 210000.0 335.2583 35000.0 337.2732 28000.0 338.276 14000.0 386.3588 2300.0 387.2142 2900.0 397.8145 2600.0 451.1938 57000.0 488.2908 2700.0 491.2221 6800.0 495.4072 2400.0 506.8096 2400.0 519.2925 560000.0 519.3824 4400.0 531.2561 150000.0 532.4124 3500.0 549.2668 140000.0 591.314 39000.0 595.6996 2600.0 633.3608 2800.0 646.989 3200.0 647.4229 6900.0 665.4358 9500.0 691.6677 3000.0 715.4 15000.0 729.4162 99000.0 757.4139 3200.0 759.566 2800.0 769.4483 6800.0 799.4988 3200.0 809.48 230000.0 827.4891 230000.0 END IONS BEGIN IONS SCANS=823 PEPMASS=870.5657 CHARGE=1 COLLISION_ENERGY=0.0 78.3716 2200.0 81.643 2700.0 173.5312 32000.0 191.6997 3300.0 459.2176 40000.0 460.2249 20000.0 461.2341 3200.0 491.2462 3700.0 492.2509 17000.0 503.2417 5400.0 505.2239 8000.0 516.2503 6500.0 519.2379 53000.0 520.2463 16000.0 531.238 68000.0 532.2462 13000.0 533.2537 57000.0 548.266 4500.0 560.2392 7700.0 577.2419 8900.0 591.26 37000.0 592.1577 4100.0 592.2673 90000.0 593.2762 8400.0 832.4004 2700.0 870.5668 6700.0 END IONS BEGIN IONS SCANS=824 PEPMASS=584.4224 CHARGE=1 COLLISION_ENERGY=0.0 63.2037 2300.0 65.0387 3100.0 65.5617 2200.0 65.8456 2400.0 66.2403 2600.0 67.0541 32000.0 69.0334 18000.0 69.0697 45000.0 73.0281 10000.0 79.054 50000.0 80.062 24000.0 81.0697 160000.0 83.0489 29000.0 83.0854 28000.0 85.0646 20000.0 87.0438 14000.0 89.0594 270000.0 90.9764 2300.0 91.0541 55000.0 91.8154 2500.0 92.062 4400.0 93.0696 210000.0 94.078 11000.0 95.049 60000.0 95.0853 150000.0 96.0886 3600.0 97.0647 29000.0 105.0696 220000.0 106.0776 30000.0 107.0853 210000.0 108.0882 2700.0 109.0646 49000.0 109.1009 110000.0 111.0802 16000.0 115.8673 2400.0 117.0697 45000.0 118.0772 4100.0 119.0756 7300.0 119.0853 420000.0 120.0931 31000.0 121.0646 22000.0 121.0917 8800.0 121.1009 280000.0 122.072 2900.0 122.1044 8300.0 122.4726 2700.0 123.0802 150000.0 123.1166 33000.0 125.0596 43000.0 125.096 3800.0 129.0696 31000.0 131.0853 180000.0 132.0931 54000.0 133.065 6800.0 133.0858 130000.0 133.101 280000.0 134.1076 17000.0 135.0802 81000.0 135.1166 110000.0 136.0878 4100.0 136.1205 2400.0 137.0602 6600.0 137.0959 91000.0 138.1038 28000.0 139.0752 30000.0 139.1115 16000.0 142.0776 23000.0 143.0853 170000.0 144.0929 73000.0 145.0887 4400.0 145.101 540000.0 145.1203 3500.0 146.1072 41000.0 147.0802 130000.0 147.1166 140000.0 148.088 8400.0 148.1211 3600.0 149.096 67000.0 149.1323 17000.0 150.1023 3100.0 151.0752 85000.0 151.0893 2300.0 151.1117 31000.0 152.0815 2800.0 153.0905 13000.0 154.5883 2500.0 155.0854 38000.0 156.0931 43000.0 157.1009 400000.0 157.1165 2800.0 158.1086 130000.0 159.0803 33000.0 159.1167 320000.0 160.123 29000.0 161.0959 77000.0 161.1323 96000.0 162.1033 8300.0 163.1116 130000.0 164.1175 3600.0 165.0909 480000.0 166.0943 21000.0 167.0857 6500.0 167.1068 31000.0 168.0932 3800.0 169.1011 100000.0 170.1085 49000.0 171.1168 250000.0 172.1242 81000.0 173.096 42000.0 173.1325 180000.0 173.5287 120000.0 173.5399 28000.0 173.7299 2700.0 174.1389 33000.0 175.1117 85000.0 175.148 100000.0 176.1192 13000.0 177.0911 24000.0 177.1115 21000.0 177.1276 39000.0 177.4812 3000.0 178.0983 19000.0 179.0856 2800.0 179.1064 5900.0 180.1144 50000.0 181.1012 50000.0 181.1222 84000.0 182.1079 20000.0 182.1417 2500.0 183.1168 160000.0 184.1239 33000.0 185.0958 18000.0 185.1148 4300.0 185.1324 180000.0 186.1037 3600.0 186.1389 37000.0 187.1118 45000.0 187.148 92000.0 188.1189 6500.0 189.1273 87000.0 190.1351 110000.0 191.1065 42000.0 191.143 66000.0 193.1021 26000.0 193.1223 78000.0 194.1089 11000.0 195.1168 110000.0 195.1366 20000.0 196.1235 38000.0 197.097 8600.0 197.1323 160000.0 198.1038 11000.0 198.1388 38000.0 199.1121 42000.0 199.1478 66000.0 200.1193 2800.0 200.1551 7100.0 201.1274 50000.0 201.1637 42000.0 203.1095 4500.0 203.143 290000.0 204.147 19000.0 205.1228 3900.0 207.1164 47000.0 207.1382 100000.0 208.1239 24000.0 208.1455 58000.0 209.1325 140000.0 209.1529 13000.0 210.139 37000.0 211.112 29000.0 211.1482 120000.0 212.1199 4100.0 212.1546 20000.0 213.1274 38000.0 213.1642 40000.0 214.1338 7300.0 214.1713 2500.0 215.1431 27000.0 216.1509 13000.0 217.1221 3600.0 217.1588 20000.0 219.1169 7300.0 219.1381 44000.0 220.1476 2800.0 221.1328 50000.0 221.1538 570000.0 222.137 8600.0 222.1586 15000.0 223.1481 100000.0 224.1174 2500.0 224.1541 19000.0 225.1276 33000.0 225.1638 66000.0 226.1714 5900.0 227.1435 33000.0 227.1789 22000.0 229.122 3100.0 229.1589 28000.0 231.1377 15000.0 233.1312 16000.0 233.1545 30000.0 234.1384 6000.0 234.1612 91000.0 235.148 44000.0 236.154 13000.0 237.1272 34000.0 237.1635 57000.0 238.1694 23000.0 239.1434 21000.0 239.1796 35000.0 239.8537 2400.0 241.1583 26000.0 241.1953 10000.0 243.139 9100.0 243.1727 3100.0 244.1446 2900.0 245.1545 24000.0 247.1453 14000.0 247.1694 110000.0 248.1541 4000.0 249.1633 47000.0 250.1695 4100.0 251.1444 17000.0 251.179 46000.0 252.1479 5500.0 252.1848 2600.0 253.1588 30000.0 253.1927 12000.0 255.174 18000.0 256.1798 3100.0 257.1537 3700.0 257.1895 2500.0 259.145 3100.0 259.1692 89000.0 259.2012 3400.0 260.1776 16000.0 261.1612 12000.0 261.1859 13000.0 263.1438 9400.0 263.1788 39000.0 264.1541 2800.0 264.1856 2800.0 265.1589 14000.0 265.1948 34000.0 266.2027 69000.0 267.1741 27000.0 268.1802 6800.0 269.1561 11000.0 269.1896 18000.0 271.1693 33000.0 272.1775 10000.0 273.1859 29000.0 274.193 71000.0 275.1789 12000.0 277.1602 9300.0 277.1944 14000.0 279.1752 18000.0 279.2101 11000.0 281.1904 34000.0 283.2059 11000.0 283.2825 2600.0 285.1852 46000.0 286.1924 70000.0 287.2006 190000.0 289.1967 10000.0 291.1742 5300.0 291.2103 12000.0 293.1897 9400.0 295.1695 3200.0 296.1776 3200.0 296.2144 3800.0 297.1848 34000.0 297.2217 11000.0 298.1915 3000.0 299.2006 74000.0 300.2078 35000.0 307.2004 3100.0 308.491 2700.0 309.1851 25000.0 309.2219 18000.0 310.1927 20000.0 311.2012 26000.0 312.2081 22000.0 312.2471 7600.0 313.2164 25000.0 315.2087 3000.0 319.2063 28000.0 323.1999 7100.0 325.216 59000.0 326.2253 2800.0 333.2188 5000.0 334.2277 3600.0 335.2366 3000.0 337.2164 130000.0 338.2224 3300.0 339.2315 19000.0 347.2373 7900.0 348.2456 3600.0 349.2138 3900.0 350.2251 2800.0 351.2313 34000.0 352.2397 280000.0 353.247 74000.0 354.2522 17000.0 363.2318 3600.0 364.2379 6500.0 365.2472 180000.0 366.2559 54000.0 375.9521 2700.0 383.2578 12000.0 391.2652 3400.0 397.2737 29000.0 398.2822 16000.0 404.3077 26000.0 411.2886 12000.0 412.2978 29000.0 423.2883 3000.0 425.3054 25000.0 431.2873 3300.0 438.3102 11000.0 448.2971 13000.0 453.3182 2600.0 474.3482 2800.0 477.331 3000.0 489.3357 23000.0 491.3518 75000.0 492.3548 81000.0 504.3597 180000.0 512.4713 3000.0 569.3982 6800.0 584.4206 19000.0 END IONS BEGIN IONS SCANS=825 PEPMASS=813.5126 CHARGE=1 COLLISION_ENERGY=0.0 73.0278 63000.0 73.6361 2500.0 74.5853 2100.0 75.5078 2200.0 75.6305 2100.0 76.068 2300.0 76.1769 2500.0 79.0265 2500.0 79.0536 59000.0 80.8688 2600.0 81.0329 35000.0 81.0692 120000.0 82.6324 2400.0 83.0487 8900.0 83.0849 24000.0 85.0276 150000.0 85.1009 3300.0 87.0436 12000.0 90.3893 140000.0 90.3936 19000.0 91.0382 130000.0 91.0535 34000.0 92.3049 2300.0 93.0691 100000.0 93.1803 2300.0 95.0483 2300.0 95.0847 120000.0 97.0276 140000.0 97.1004 4300.0 99.0436 28000.0 101.0226 61000.0 101.1153 2300.0 101.6404 2400.0 103.0385 17000.0 103.4049 2200.0 103.9869 2500.0 104.4308 2200.0 105.0692 40000.0 107.0847 78000.0 107.3553 2300.0 108.6217 2700.0 109.0277 24000.0 109.0645 2500.0 109.1004 73000.0 115.0384 10000.0 116.2851 2200.0 117.0694 5000.0 119.0847 62000.0 121.1004 86000.0 123.1159 24000.0 127.0381 87000.0 129.0539 9200.0 129.8301 2200.0 131.0849 36000.0 133.1003 65000.0 135.116 81000.0 137.1316 2500.0 138.92 2300.0 143.0839 3000.0 145.0489 19000.0 145.1003 31000.0 146.6958 2900.0 147.116 49000.0 148.0025 2600.0 149.1317 39000.0 153.282 2700.0 157.1001 3100.0 159.116 38000.0 161.1316 39000.0 163.1478 11000.0 171.117 4100.0 173.1318 26000.0 173.5282 190000.0 173.5441 35000.0 174.9842 2200.0 175.1473 15000.0 183.065 4000.0 184.0727 30000.0 185.0412 100000.0 185.0749 2600.0 185.1307 3700.0 185.1561 2400.0 187.1476 6800.0 192.1287 2400.0 199.1445 2500.0 201.0363 7800.0 201.0749 2700.0 203.0518 37000.0 203.3698 2900.0 231.2103 2700.0 235.6669 2300.0 241.0685 13000.0 241.1953 3200.0 243.0831 200000.0 243.2103 4700.0 256.3856 2600.0 259.2052 56000.0 261.2204 49000.0 287.2032 2300.0 299.1976 25000.0 301.0887 32000.0 301.2142 6000.0 313.0873 2900.0 313.274 35000.0 314.2764 25000.0 315.1038 22000.0 317.2079 210000.0 323.2897 2700.0 333.2421 40000.0 335.2573 200000.0 339.8165 2500.0 341.1228 2700.0 357.2408 2700.0 363.254 3900.0 371.1669 11000.0 373.1102 25000.0 373.2344 35000.0 377.8758 2600.0 385.1844 12000.0 397.1805 2600.0 399.2545 3100.0 401.7305 2800.0 419.5729 2500.0 425.2131 17000.0 428.3698 2700.0 429.1721 15000.0 439.2228 2500.0 465.2092 51000.0 467.2234 2600.0 469.2062 9000.0 470.994 2500.0 483.2176 4600.0 486.9359 2600.0 497.3104 25000.0 516.4214 2700.0 517.2777 22000.0 519.2006 3800.0 519.2924 3100000.0 520.2888 3500.0 523.249 4000.0 535.1926 11000.0 535.2872 2100000.0 535.3818 15000.0 552.5071 4900.0 563.2827 3100.0 578.3056 8800.0 591.3144 94000.0 605.3271 21000.0 619.3442 26000.0 633.3517 19000.0 633.4554 20000.0 647.3522 13000.0 647.3715 7600.0 651.4596 110000.0 661.3937 20000.0 665.0187 2800.0 666.8761 2600.0 675.405 33000.0 701.422 13000.0 703.4402 14000.0 715.4343 26000.0 742.7803 3000.0 743.4353 100000.0 743.7706 2500.0 795.4973 10000.0 813.1603 5800.0 813.5116 3600000.0 END IONS BEGIN IONS SCANS=826 PEPMASS=611.4676 CHARGE=1 COLLISION_ENERGY=0.0 65.3547 2400.0 67.0539 220000.0 68.7324 2300.0 69.0696 84000.0 71.0494 2900.0 71.0852 6200.0 79.0495 3300.0 79.0539 150000.0 80.5932 2100.0 81.0695 310000.0 81.1553 2300.0 83.0489 5800.0 83.0852 65000.0 85.0646 13000.0 91.0539 110000.0 91.7549 2800.0 93.0694 260000.0 95.0004 2500.0 95.0489 12000.0 95.0852 290000.0 97.0644 19000.0 97.1009 37000.0 99.08 6800.0 100.6933 2500.0 101.1184 2500.0 104.4202 2800.0 105.0695 150000.0 107.0775 3000.0 107.0852 180000.0 108.6559 2300.0 109.0645 12000.0 109.1008 160000.0 111.0802 12000.0 113.9388 2400.0 117.0696 66000.0 118.1925 2400.0 119.0852 190000.0 121.1008 200000.0 123.0803 8200.0 123.1164 52000.0 125.0958 8700.0 129.0697 32000.0 131.0853 130000.0 133.1008 210000.0 133.6644 2800.0 135.1055 7000.0 135.1165 160000.0 137.0951 3400.0 137.1322 13000.0 139.1112 6100.0 143.0852 50000.0 145.1009 150000.0 147.1165 210000.0 149.0959 3700.0 149.1321 97000.0 149.6852 4600.0 149.6952 3900.0 151.1116 7100.0 155.0856 12000.0 157.1009 79000.0 159.0792 2600.0 159.1166 170000.0 159.1312 3000.0 161.1322 150000.0 163.1123 6200.0 163.1478 33000.0 167.8018 2300.0 168.7478 2400.0 169.1008 23000.0 171.1167 110000.0 171.7483 2700.0 173.1324 130000.0 173.5239 31000.0 173.5354 120000.0 175.1119 3200.0 175.1481 70000.0 177.1258 3700.0 177.1646 4400.0 181.1013 3900.0 183.1168 47000.0 185.1324 94000.0 185.1495 3800.0 187.1481 57000.0 189.1278 5600.0 189.164 21000.0 190.1067 2500.0 195.1171 14000.0 197.1323 41000.0 198.7604 3000.0 199.148 78000.0 200.1591 2400.0 201.1638 38000.0 207.7198 2400.0 209.1324 15000.0 211.1481 32000.0 213.1637 42000.0 215.1792 23000.0 217.1941 4900.0 221.1317 6600.0 223.1481 13000.0 225.1638 18000.0 227.1792 15000.0 229.1947 12000.0 231.2105 19000.0 237.1644 2800.0 239.1793 16000.0 241.1951 82000.0 243.2095 11000.0 252.0994 2200.0 253.1967 6900.0 257.1887 19000.0 259.175 4200.0 259.2054 210000.0 259.2361 2900.0 261.2214 35000.0 264.056 2700.0 267.2101 3000.0 271.2085 2800.0 273.2216 2500.0 275.2006 6200.0 283.2812 2700.0 285.2213 3400.0 287.2373 2900.0 297.2208 6700.0 299.2362 9900.0 311.2366 9800.0 313.2531 4200.0 315.233 3500.0 317.2495 2600.0 325.2536 3900.0 333.2428 48000.0 335.2582 91000.0 337.2532 3900.0 339.2688 10000.0 349.0735 2100.0 351.4283 2700.0 353.2849 12000.0 367.2981 6900.0 371.2998 3000.0 394.2626 2600.0 405.26 2600.0 449.3426 2800.0 519.4191 46000.0 529.3964 3000.0 537.4299 9300.0 541.3914 3600.0 542.6165 2600.0 544.9203 3200.0 593.4541 10000.0 611.4679 140000.0 END IONS BEGIN IONS SCANS=827 PEPMASS=653.2975 CHARGE=1 COLLISION_ENERGY=0.0 67.9945 2300.0 70.1427 2700.0 73.1621 2400.0 81.5497 2700.0 88.0977 2700.0 106.4932 2200.0 110.4182 2500.0 116.8133 2100.0 125.8747 2500.0 125.9981 2300.0 126.6553 2600.0 128.5506 2600.0 133.8872 3000.0 161.554 2600.0 166.7035 2700.0 173.5218 10000.0 173.5343 79000.0 197.3633 2400.0 211.1201 2500.0 228.1462 2600.0 297.1235 2700.0 318.3719 2400.0 321.5282 2400.0 328.3874 2200.0 391.1923 10000.0 405.2077 32000.0 406.215 7400.0 419.2249 20000.0 420.1647 5100.0 420.2313 960000.0 421.2393 54000.0 424.226 36000.0 426.8539 2600.0 432.2354 3200.0 433.2393 83000.0 434.2469 120000.0 446.2521 3700.0 447.2523 7100.0 447.2615 11000.0 448.2278 120000.0 448.2786 5400.0 449.2341 260000.0 451.2149 7000.0 452.2213 320000.0 459.2187 150000.0 460.2259 400000.0 461.2322 29000.0 462.2059 110000.0 463.2133 65000.0 465.2289 250000.0 474.2375 12000.0 474.2456 3600.0 475.2135 350000.0 476.2206 170000.0 477.1471 4900.0 477.2289 1300000.0 477.3076 6500.0 478.2382 11000.0 479.2449 24000.0 480.2556 3800.0 487.2134 40000.0 488.2188 18000.0 489.2284 32000.0 490.2356 4100.0 491.2137 16000.0 491.239 21000.0 492.252 460000.0 493.225 28000.0 493.2471 3800.0 501.2287 68000.0 502.2358 59000.0 503.2437 230000.0 504.2497 33000.0 505.2556 3300.0 507.2398 18000.0 518.2315 160000.0 519.2386 3800.0 519.2478 10000.0 520.1359 6000.0 520.2819 3900.0 521.2184 690000.0 521.2925 84000.0 522.3028 10000.0 523.2344 4300.0 533.2521 4600.0 534.2294 13000.0 535.1649 2100.0 535.2344 330000.0 535.3283 3200.0 536.2421 440000.0 537.2499 51000.0 545.2592 3600.0 547.247 37000.0 547.2619 10000.0 548.2794 3700.0 549.2855 290000.0 551.2662 120000.0 559.2714 13000.0 561.2503 59000.0 562.2602 7700.0 563.2654 77000.0 564.2709 6200.0 565.2762 54000.0 566.2897 43000.0 575.2652 110000.0 576.2717 69000.0 577.2814 150000.0 593.2753 73000.0 603.2635 3100.0 607.288 41000.0 608.2941 9500.0 621.2715 59000.0 635.2856 8600.0 636.2934 88000.0 END IONS BEGIN IONS SCANS=828 PEPMASS=600.4174 CHARGE=1 COLLISION_ENERGY=0.0 67.0541 19000.0 69.0334 37000.0 69.0698 39000.0 69.2396 4200.0 76.3387 9200.0 79.054 45000.0 81.0698 150000.0 83.049 60000.0 83.0854 18000.0 85.0646 45000.0 87.0443 2900.0 87.319 7200.0 87.9228 7700.0 89.0596 58000.0 91.0541 78000.0 92.0621 3000.0 93.0638 5500.0 93.0697 240000.0 93.3756 2600.0 94.0727 4900.0 95.049 74000.0 95.0793 5200.0 95.0854 180000.0 96.0571 2900.0 96.0889 11000.0 97.0648 45000.0 101.2342 4700.0 101.2418 4300.0 102.2934 2300.0 104.76 8300.0 105.0697 260000.0 106.0775 18000.0 107.0494 2800.0 107.0854 210000.0 108.0884 10000.0 108.9954 3400.0 109.0646 88000.0 109.101 84000.0 111.0803 31000.0 113.0962 7400.0 115.0543 3700.0 115.3073 2400.0 117.0698 37000.0 119.0492 9100.0 119.0755 2600.0 119.0854 470000.0 119.0956 9600.0 120.0917 36000.0 121.0647 46000.0 121.101 350000.0 122.1043 31000.0 123.0803 180000.0 123.1168 32000.0 124.084 5500.0 125.0595 270000.0 125.0966 7700.0 126.0627 3000.0 128.0625 3800.0 129.0698 28000.0 130.0776 3800.0 131.0854 140000.0 132.0932 52000.0 133.0645 40000.0 133.0861 34000.0 133.1011 270000.0 134.1083 49000.0 135.0803 190000.0 135.1167 130000.0 136.0841 3200.0 136.1203 5800.0 137.0594 29000.0 137.0961 180000.0 138.0996 13000.0 139.0751 72000.0 139.1118 8600.0 141.0707 3700.0 142.0782 12000.0 143.0855 160000.0 144.0928 66000.0 145.065 3900.0 145.0906 3200.0 145.1011 440000.0 145.1143 5200.0 146.1066 44000.0 147.0803 370000.0 147.1168 98000.0 148.0844 62000.0 148.1213 9900.0 149.0961 140000.0 150.1038 26000.0 151.0752 230000.0 151.1115 10000.0 152.0802 24000.0 153.0907 18000.0 155.085 58000.0 156.0928 42000.0 157.101 420000.0 157.1122 4000.0 158.1075 110000.0 159.0803 83000.0 159.1168 330000.0 159.1316 6300.0 160.0876 14000.0 160.1232 55000.0 161.096 140000.0 161.1324 170000.0 162.1013 13000.0 162.136 20000.0 163.0766 2500.0 163.1117 600000.0 164.0826 2800.0 164.1159 39000.0 165.091 1700000.0 165.1037 9200.0 165.1247 3600.0 165.4994 2400.0 166.0944 270000.0 167.0855 9900.0 168.0938 6700.0 169.1012 140000.0 170.1082 54000.0 171.0807 4700.0 171.1168 280000.0 172.1233 110000.0 173.0962 130000.0 173.1123 4500.0 173.1155 4700.0 173.1325 130000.0 173.5228 75000.0 173.5418 88000.0 174.1016 17000.0 174.1369 9900.0 175.1118 170000.0 175.1481 56000.0 176.1193 18000.0 176.1514 5400.0 177.0908 77000.0 177.1069 3600.0 177.1276 55000.0 178.0985 81000.0 178.1314 11000.0 179.0892 8300.0 179.1068 53000.0 179.1432 13000.0 180.0971 4900.0 180.1143 80000.0 181.1026 35000.0 181.1223 610000.0 181.1368 3300.0 182.1083 28000.0 182.1254 24000.0 183.1168 240000.0 184.1225 69000.0 185.096 26000.0 185.1325 230000.0 186.1036 20000.0 186.1375 46000.0 187.1118 100000.0 187.1482 85000.0 188.1181 15000.0 188.1501 3200.0 189.0909 9700.0 189.1274 170000.0 190.1349 230000.0 191.1066 150000.0 191.1431 51000.0 192.1125 12000.0 192.1475 3900.0 193.1023 15000.0 193.1224 180000.0 194.1089 8300.0 195.1168 110000.0 195.1383 60000.0 196.1236 44000.0 196.1423 3000.0 197.0973 20000.0 197.1324 180000.0 198.1037 13000.0 198.138 25000.0 199.112 88000.0 199.1481 59000.0 200.1186 5600.0 200.1536 2700.0 200.6958 8600.0 201.1274 120000.0 201.1642 12000.0 202.1335 6000.0 203.1431 760000.0 203.1644 14000.0 203.1748 4000.0 204.1144 7400.0 204.1465 160000.0 205.1224 19000.0 206.1299 6100.0 207.1171 55000.0 207.1383 240000.0 208.1241 25000.0 208.145 130000.0 209.1325 120000.0 209.1529 27000.0 210.139 40000.0 211.1119 48000.0 211.1482 170000.0 212.1193 12000.0 212.1543 65000.0 213.1275 94000.0 213.1636 50000.0 214.1342 17000.0 215.108 13000.0 215.1431 82000.0 216.1508 80000.0 217.1217 27000.0 217.1593 11000.0 218.1297 13000.0 219.1165 11000.0 219.1381 170000.0 220.1457 14000.0 221.0733 7600.0 221.1341 42000.0 221.1537 1900000.0 222.1352 20000.0 222.1572 400000.0 223.1112 26000.0 223.1483 80000.0 224.1192 5800.0 224.1526 21000.0 225.1276 71000.0 225.1639 82000.0 226.1336 13000.0 226.1695 13000.0 227.1432 54000.0 227.1799 28000.0 228.1485 5000.0 228.1827 3200.0 229.1222 32000.0 229.159 94000.0 230.1284 5600.0 230.1636 30000.0 231.1381 66000.0 231.1757 4000.0 232.1442 26000.0 233.1311 33000.0 233.154 110000.0 234.1391 5100.0 234.1613 340000.0 235.1469 38000.0 235.1705 34000.0 236.1526 9600.0 237.1275 50000.0 237.1638 48000.0 238.1347 5000.0 238.1706 23000.0 239.1432 43000.0 239.1801 61000.0 240.1506 10000.0 240.1599 5000.0 240.1869 110000.0 241.1218 11000.0 241.1583 45000.0 242.1642 5000.0 243.1376 57000.0 243.175 11000.0 245.154 44000.0 246.1613 6100.0 247.1693 520000.0 247.199 12000.0 248.1506 4200.0 248.1745 140000.0 249.1635 39000.0 250.1357 6300.0 250.1706 8900.0 251.1429 45000.0 251.1787 40000.0 252.1501 5400.0 253.1276 2500.0 253.1582 60000.0 253.1929 4600.0 254.1662 11000.0 255.1378 28000.0 255.1735 31000.0 256.1815 7300.0 257.1541 45000.0 257.1863 5300.0 258.1588 5100.0 259.1694 92000.0 260.1182 2400.0 260.1766 70000.0 261.1591 12000.0 261.1851 60000.0 263.1443 10000.0 263.1785 35000.0 264.1877 4100.0 265.1587 38000.0 265.1941 13000.0 266.1654 13000.0 266.199 2700.0 267.1436 3000.0 267.1742 45000.0 268.1817 4800.0 269.1537 49000.0 269.1896 52000.0 270.1941 12000.0 271.1696 78000.0 272.1761 18000.0 273.1852 55000.0 274.1929 250000.0 275.1777 6100.0 277.1587 5700.0 277.1953 10000.0 279.1748 54000.0 279.2092 11000.0 280.1815 6100.0 281.1539 15000.0 281.1902 78000.0 282.1944 23000.0 283.1701 26000.0 283.2023 5600.0 284.176 4500.0 285.1852 74000.0 286.1926 140000.0 287.2007 350000.0 288.2038 80000.0 289.1939 21000.0 291.1747 16000.0 291.2095 12000.0 293.1901 31000.0 294.1968 17000.0 295.1708 11000.0 295.2056 31000.0 296.1777 4000.0 297.1851 93000.0 297.2199 25000.0 298.1932 26000.0 299.2008 380000.0 300.2071 77000.0 305.1909 10000.0 306.1971 3500.0 306.5211 3000.0 307.2062 58000.0 309.1848 38000.0 309.2211 26000.0 310.192 45000.0 311.2003 100000.0 312.2077 150000.0 313.179 12000.0 313.2162 330000.0 314.2198 35000.0 319.2065 30000.0 321.2217 4200.0 323.2007 24000.0 324.2057 8800.0 325.2161 390000.0 326.2225 47000.0 327.2325 120000.0 328.2355 39000.0 333.2205 4300.0 335.1986 11000.0 335.2383 5000.0 336.2008 3800.0 337.2165 120000.0 339.2315 120000.0 340.2039 4400.0 340.2396 790000.0 340.2868 11000.0 345.2185 2900.0 347.2379 11000.0 349.2135 3900.0 351.2329 41000.0 352.2395 370000.0 353.2463 13000.0 359.2354 3600.0 363.2307 15000.0 364.2383 9500.0 365.247 180000.0 366.2521 44000.0 367.2242 3800.0 373.2522 3800.0 375.2353 3300.0 377.246 27000.0 379.2635 43000.0 385.2353 26000.0 387.2544 45000.0 390.2535 2800.0 391.2636 65000.0 392.2684 49000.0 395.263 3100.0 397.271 3300.0 400.2619 11000.0 403.2635 2500.0 405.279 54000.0 407.2582 3200.0 411.2535 49000.0 413.2686 140000.0 414.2701 33000.0 419.2944 69000.0 420.2987 75000.0 425.2683 420000.0 426.2765 76000.0 427.2844 360000.0 428.287 80000.0 439.2826 9500.0 440.2316 3600.0 440.2919 630000.0 440.3462 3800.0 453.2992 16000.0 454.3044 26000.0 487.3176 15000.0 493.3266 13000.0 505.3329 47000.0 507.3465 12000.0 508.3499 16000.0 520.352 99000.0 567.3805 3700.0 585.3928 51000.0 594.8237 5200.0 600.411 46000.0 END IONS BEGIN IONS SCANS=829 PEPMASS=808.5572 CHARGE=1 COLLISION_ENERGY=0.0 72.9563 2300.0 77.0388 15000.0 78.8987 2200.0 79.0541 430000.0 80.8625 2300.0 81.0697 830000.0 81.0743 2200.0 83.0491 26000.0 83.0854 160000.0 85.0283 22000.0 85.0648 42000.0 86.0963 3100.0 88.4877 2600.0 90.5499 2800.0 91.0393 8900.0 91.0541 320000.0 93.0631 3900.0 93.0698 700000.0 93.0769 5700.0 94.4776 2800.0 95.049 51000.0 95.0786 4600.0 95.0854 820000.0 97.0285 3300.0 97.0647 63000.0 97.101 83000.0 99.0803 42000.0 103.0397 3400.0 105.0444 4000.0 105.0617 3500.0 105.0697 430000.0 107.049 12000.0 107.0854 530000.0 107.0921 2200.0 109.0647 29000.0 109.0927 4900.0 109.101 460000.0 110.4408 2400.0 111.0804 46000.0 111.1168 10000.0 112.43 2400.0 112.5164 2300.0 113.096 9700.0 113.38 2500.0 117.0698 190000.0 119.0755 9800.0 119.0854 570000.0 119.0956 4100.0 121.0645 7200.0 121.091 15000.0 121.101 620000.0 121.1115 3500.0 123.0804 41000.0 123.1167 160000.0 125.096 26000.0 129.0545 14000.0 129.0699 71000.0 129.9221 2400.0 131.0747 4900.0 131.0854 360000.0 131.1434 2500.0 133.0647 3200.0 133.0907 10000.0 133.1011 690000.0 133.1149 8600.0 135.0804 23000.0 135.1055 3700.0 135.1167 540000.0 135.1286 5700.0 137.096 36000.0 137.1325 38000.0 139.0747 2200.0 139.1116 21000.0 140.9382 2300.0 141.0701 7200.0 143.0855 100000.0 145.1011 430000.0 145.1141 3800.0 146.9815 13000.0 147.0808 11000.0 147.1056 2200.0 147.1167 680000.0 149.0959 49000.0 149.1324 320000.0 149.1447 4500.0 149.6622 2400.0 151.1116 17000.0 151.1489 6400.0 153.1275 5800.0 155.0721 2200.0 155.0856 25000.0 157.1011 150000.0 159.1168 450000.0 161.0966 10000.0 161.1325 490000.0 161.1478 3600.0 163.1116 37000.0 163.148 110000.0 163.5795 3100.0 164.6411 2300.0 165.1276 17000.0 169.1013 45000.0 171.1004 3800.0 171.1169 240000.0 173.0964 2700.0 173.1326 330000.0 173.5234 15000.0 173.5347 190000.0 173.544 16000.0 175.112 21000.0 175.1482 210000.0 177.1274 30000.0 177.1639 23000.0 179.1442 2700.0 181.1015 10000.0 183.1169 53000.0 184.0733 29000.0 185.1325 220000.0 187.1124 9000.0 187.148 130000.0 189.1277 28000.0 189.1639 34000.0 191.1429 15000.0 195.1168 18000.0 195.8706 2500.0 197.1327 46000.0 199.114 5200.0 199.1483 140000.0 201.1278 3100.0 201.164 57000.0 203.1436 18000.0 203.1795 7300.0 205.1595 3100.0 207.853 2800.0 209.1329 20000.0 210.801 2400.0 211.1107 3100.0 211.1483 31000.0 213.164 70000.0 213.5597 2700.0 215.1796 35000.0 217.1594 11000.0 217.1951 13000.0 217.3083 2900.0 223.1478 7900.0 225.1282 2700.0 225.1636 16000.0 227.1805 14000.0 229.195 20000.0 231.1734 17000.0 231.1869 3100.0 231.2109 110000.0 235.1691 3300.0 237.164 8300.0 239.1791 37000.0 241.195 350000.0 243.2105 58000.0 244.9707 2400.0 247.1701 2600.0 253.1954 4100.0 253.261 2600.0 257.1897 71000.0 259.1804 6900.0 259.2054 1000000.0 261.2212 160000.0 263.2379 3700.0 271.206 12000.0 273.2205 13000.0 275.2009 33000.0 275.2323 2700.0 277.2164 38000.0 283.2053 6200.0 285.2208 8200.0 289.2169 21000.0 295.2066 2700.0 297.222 6900.0 299.2383 4800.0 301.2169 19000.0 303.2321 11000.0 313.2161 4000.0 315.2323 66000.0 325.2542 2800.0 327.2677 3700.0 333.2058 2700.0 333.2426 400000.0 333.2873 3000.0 335.2581 890000.0 336.2626 2600.0 337.2706 7200.0 339.2699 3400.0 340.6796 2800.0 349.2322 7800.0 351.2546 10000.0 367.2249 11000.0 379.2979 3200.0 426.3686 2700.0 449.9368 2400.0 519.4192 26000.0 541.3837 2600.0 593.4559 12000.0 611.4649 56000.0 614.6127 2600.0 END IONS BEGIN IONS SCANS=830 PEPMASS=599.4102 CHARGE=1 COLLISION_ENERGY=0.0 67.0539 10000.0 69.0334 2800.0 69.0695 5700.0 70.0093 2300.0 74.1282 2200.0 78.5765 2500.0 79.0542 2900.0 81.0695 27000.0 83.0488 8600.0 83.0853 12000.0 87.0444 2400.0 91.0538 8200.0 93.0694 44000.0 95.0488 11000.0 95.0851 40000.0 97.0646 17000.0 104.3414 2800.0 105.0695 32000.0 107.0851 39000.0 109.0643 13000.0 109.1007 23000.0 109.9317 2500.0 113.096 7200.0 117.0695 5300.0 119.0851 55000.0 121.0644 5500.0 121.1008 62000.0 123.0802 24000.0 123.1173 4700.0 125.0595 10000.0 125.0959 5400.0 131.0853 23000.0 133.1008 43000.0 135.0802 19000.0 135.1164 22000.0 137.0959 25000.0 137.1318 2300.0 139.0755 3300.0 139.1114 14000.0 143.0853 21000.0 145.1009 57000.0 147.0801 40000.0 147.1163 21000.0 149.0959 14000.0 151.0262 2500.0 151.0751 30000.0 151.1111 2900.0 153.0908 2800.0 155.0858 3400.0 157.1008 44000.0 159.0806 5500.0 159.1166 35000.0 161.096 15000.0 161.1321 22000.0 163.1116 31000.0 165.0908 170000.0 167.1065 28000.0 169.1008 19000.0 171.1166 40000.0 173.0961 9000.0 173.132 20000.0 173.5262 44000.0 173.5354 48000.0 173.5463 9200.0 175.1478 4000.0 177.0911 3400.0 177.1276 5700.0 179.143 4600.0 181.1221 18000.0 183.1166 28000.0 185.1326 25000.0 187.1113 7300.0 187.1485 3800.0 189.1273 20000.0 191.106 3600.0 193.0326 2200.0 195.1169 14000.0 195.1371 5500.0 196.1244 4500.0 197.1321 24000.0 199.112 3000.0 199.1483 6100.0 203.143 77000.0 207.1169 7100.0 207.1377 17000.0 208.1247 2900.0 209.1331 20000.0 211.1481 20000.0 212.3659 2500.0 213.1275 3500.0 215.1434 5600.0 221.1317 8400.0 221.1536 180000.0 223.1486 13000.0 225.1268 3800.0 225.162 3400.0 229.1593 3100.0 231.1388 2800.0 233.154 17000.0 234.1598 9600.0 235.1482 7600.0 237.1638 6200.0 247.1693 35000.0 249.165 2600.0 249.9474 2300.0 251.1789 7700.0 267.1744 2700.0 269.1892 2800.0 273.1861 3400.0 285.1862 10000.0 286.1937 21000.0 287.2012 26000.0 299.2007 18000.0 304.6459 2500.0 311.1998 4200.0 313.2174 8300.0 327.2304 3600.0 367.595 2500.0 404.7153 3200.0 413.2701 2600.0 419.2967 3400.0 427.2845 6800.0 434.6273 2800.0 507.3462 14000.0 562.8354 2700.0 599.4084 7000.0 END IONS BEGIN IONS SCANS=831 PEPMASS=434.2819 CHARGE=1 COLLISION_ENERGY=0.0 57.0697 9900.0 59.0489 3200.0 63.2782 2400.0 64.9456 2700.0 78.9056 2200.0 79.0539 2800.0 81.0695 15000.0 85.0645 7500.0 86.7228 2300.0 91.0542 2700.0 93.0696 15000.0 95.0489 4300.0 95.0852 10000.0 97.0648 3500.0 105.0626 2800.0 105.0695 58000.0 107.0851 13000.0 109.0644 41000.0 111.0802 3000.0 115.698 2600.0 117.0694 3200.0 119.0851 63000.0 121.0646 5400.0 121.1009 16000.0 123.08 16000.0 125.0594 6800.0 131.0854 16000.0 133.0639 2600.0 133.1007 26000.0 135.08 24000.0 135.1165 3500.0 137.0956 14000.0 143.0851 20000.0 145.1008 32000.0 147.0801 46000.0 147.1163 3400.0 148.1039 2400.0 149.0958 19000.0 149.6843 4200.0 150.9865 2400.0 151.0749 22000.0 155.0846 11000.0 157.1008 29000.0 159.0802 7900.0 159.1166 20000.0 161.0959 19000.0 161.1326 9300.0 163.1118 13000.0 165.0908 100000.0 169.1009 18000.0 170.1085 5400.0 171.1166 26000.0 173.0961 14000.0 173.1329 11000.0 173.5314 20000.0 175.1117 20000.0 177.0908 11000.0 180.1136 2500.0 181.1009 9000.0 182.1087 2900.0 183.1167 59000.0 185.0964 3300.0 185.1322 11000.0 187.1116 13000.0 187.1489 6600.0 189.1272 17000.0 189.6381 2400.0 190.1352 14000.0 191.1067 18000.0 193.1027 5000.0 193.1219 12000.0 194.1062 2500.0 195.1164 14000.0 196.1246 6900.0 197.1327 15000.0 199.112 13000.0 200.1189 3600.0 201.127 12000.0 203.143 40000.0 207.1174 8000.0 207.138 15000.0 209.1324 15000.0 211.112 8900.0 211.1482 27000.0 213.1277 13000.0 215.1434 4400.0 219.1384 16000.0 221.1328 4400.0 221.1536 49000.0 223.1479 5800.0 225.1262 3900.0 225.1638 13000.0 229.1237 2700.0 229.159 7100.0 230.1304 9800.0 231.1381 2900.0 233.1537 3700.0 234.1609 3600.0 235.1473 8000.0 237.1283 3000.0 239.142 3100.0 243.1376 9600.0 247.1449 3900.0 247.169 11000.0 253.1595 7300.0 259.1718 2700.0 268.1821 8400.0 271.1692 12000.0 275.1788 3200.0 279.1759 2800.0 281.1886 3400.0 285.1869 3200.0 286.1931 41000.0 287.2023 6300.0 299.201 16000.0 311.1982 3400.0 312.2076 6600.0 313.2159 9900.0 335.2 7200.0 354.2204 3600.0 355.227 13000.0 373.2541 3100.0 391.08 2600.0 391.2632 32000.0 419.2607 4400.0 END IONS BEGIN IONS SCANS=832 PEPMASS=435.2887 CHARGE=1 COLLISION_ENERGY=0.0 57.0697 4100.0 57.2699 2600.0 64.3367 2400.0 69.0696 3300.0 79.054 4500.0 81.0696 8800.0 85.0644 3600.0 89.0595 4400.0 91.0541 3100.0 93.0696 16000.0 95.0489 5200.0 95.0852 14000.0 105.0695 19000.0 107.0852 11000.0 109.0562 5600.0 109.0644 130000.0 109.1004 2900.0 111.0802 4700.0 117.069 2700.0 119.0851 21000.0 120.089 3600.0 121.065 3300.0 121.101 8600.0 123.08 11000.0 125.0585 2900.0 131.0853 12000.0 133.101 12000.0 135.0801 13000.0 135.1167 2600.0 137.0959 5900.0 143.0853 9000.0 145.1008 14000.0 147.0799 15000.0 147.1166 4800.0 149.0958 6800.0 151.075 29000.0 155.0851 3200.0 156.0925 3300.0 157.1007 16000.0 159.0801 3100.0 159.1168 8300.0 161.0955 8200.0 161.1327 3400.0 162.1009 2600.0 163.1114 4700.0 165.0908 25000.0 166.0945 9200.0 169.101 15000.0 171.1171 9500.0 173.0961 5000.0 173.1321 4000.0 173.5345 17000.0 175.1117 5600.0 177.0915 5100.0 181.1017 6200.0 182.1076 4000.0 183.1168 16000.0 184.1199 5700.0 185.1325 5600.0 187.1113 4900.0 189.1275 11000.0 193.102 2700.0 195.1167 8600.0 197.1319 11000.0 199.1115 3600.0 201.1269 6400.0 203.1432 11000.0 204.1459 2900.0 207.1181 4100.0 207.1379 9200.0 209.1321 5600.0 211.1479 5300.0 212.1537 6200.0 213.1265 4500.0 213.1625 3500.0 221.154 6700.0 227.1447 2800.0 229.1221 3800.0 230.1274 3800.0 231.1351 2500.0 271.1693 4200.0 286.1929 9000.0 287.1994 3700.0 309.1896 2600.0 312.2071 4100.0 392.2677 5300.0 409.642 2400.0 433.702 2400.0 END IONS BEGIN IONS SCANS=833 PEPMASS=583.4152 CHARGE=1 COLLISION_ENERGY=0.0 67.054 14000.0 69.0333 7800.0 69.0696 21000.0 71.0488 3200.0 71.9163 2300.0 78.1092 2200.0 78.6824 2100.0 79.0539 23000.0 79.8012 2500.0 81.0695 75000.0 83.0489 13000.0 83.0852 15000.0 85.1637 2500.0 91.0539 22000.0 93.0695 89000.0 93.2831 2700.0 95.0489 27000.0 95.0852 58000.0 96.8465 2600.0 97.0647 17000.0 104.3244 2300.0 105.0695 98000.0 107.0852 87000.0 109.0646 15000.0 109.1008 73000.0 111.0802 13000.0 112.6975 2500.0 114.3824 2600.0 117.0697 5200.0 119.0852 130000.0 121.0648 7400.0 121.1008 140000.0 123.0802 29000.0 123.1165 20000.0 123.9729 2400.0 125.0591 13000.0 129.0699 5400.0 131.0852 51000.0 133.1009 99000.0 135.0801 23000.0 135.1165 47000.0 137.0595 2600.0 137.0957 41000.0 139.0754 14000.0 139.1115 18000.0 143.0854 41000.0 144.0926 12000.0 145.0888 3800.0 145.1009 160000.0 147.0802 30000.0 147.1165 84000.0 149.0959 18000.0 149.132 5900.0 151.0752 51000.0 151.1115 12000.0 153.091 5300.0 155.0852 6700.0 156.0933 7000.0 157.1009 85000.0 158.1077 5700.0 159.0804 11000.0 159.1167 71000.0 161.096 23000.0 161.1322 26000.0 163.1114 39000.0 165.0908 120000.0 167.1063 3800.0 169.1012 56000.0 170.1088 6000.0 171.1167 64000.0 173.0964 13000.0 173.1323 65000.0 173.5221 21000.0 173.5322 11000.0 173.5407 35000.0 175.1121 14000.0 175.1483 25000.0 177.0905 5400.0 177.1273 9000.0 179.1058 2300.0 181.1009 17000.0 181.1218 13000.0 183.1169 44000.0 184.1237 5600.0 185.0961 3200.0 185.1325 39000.0 187.112 9000.0 187.1481 19000.0 189.1274 26000.0 191.1065 5900.0 191.1431 16000.0 194.1085 2400.0 195.1169 34000.0 196.1245 13000.0 197.1325 54000.0 199.1115 6900.0 199.1481 20000.0 201.1276 12000.0 201.1631 5600.0 203.143 51000.0 203.4109 2300.0 205.1244 2700.0 207.1175 15000.0 207.1382 42000.0 208.1258 2600.0 209.1324 53000.0 211.1133 9600.0 211.1483 48000.0 213.1268 7000.0 213.1642 3400.0 215.1061 2500.0 215.1438 3900.0 220.1248 2600.0 221.1324 15000.0 221.1537 94000.0 222.1411 3000.0 223.1134 3000.0 223.1481 27000.0 224.1195 2900.0 225.1278 6400.0 225.164 17000.0 227.1432 14000.0 227.1799 3100.0 229.1223 7200.0 231.1375 3400.0 233.1545 13000.0 235.1477 26000.0 237.1266 7400.0 237.1635 32000.0 239.1425 2600.0 247.1456 9000.0 247.1708 14000.0 249.1636 7000.0 251.1792 2700.0 255.1727 2600.0 261.1589 3400.0 261.1866 17000.0 263.1815 3400.0 265.1598 3900.0 265.195 7900.0 269.1896 6100.0 281.2943 3600.0 282.2793 41000.0 283.2827 38000.0 285.1846 25000.0 286.1939 10000.0 287.2012 26000.0 291.2105 3100.0 299.2022 13000.0 299.3063 12000.0 300.3084 3100.0 311.2016 11000.0 329.226 2400.0 335.2396 3100.0 337.2159 3200.0 340.781 2400.0 349.2162 10000.0 351.2299 4200.0 352.2393 6200.0 353.2478 57000.0 361.2648 2600.0 364.2404 24000.0 434.214 2900.0 436.527 2400.0 454.9714 2500.0 473.338 7700.0 491.3521 140000.0 504.3631 3000.0 583.4136 27000.0 END IONS BEGIN IONS SCANS=834 PEPMASS=584.4223 CHARGE=1 COLLISION_ENERGY=0.0 63.9463 2200.0 66.8634 2400.0 68.19 2300.0 69.3535 2300.0 69.9257 2600.0 71.0853 6000.0 72.2838 2700.0 73.0281 16000.0 75.5541 2500.0 75.6593 2900.0 81.0697 18000.0 87.0438 14000.0 88.9407 2500.0 89.0593 230000.0 89.4778 2200.0 91.0537 2300.0 91.7122 2800.0 92.7732 2100.0 93.0695 25000.0 95.0492 5600.0 95.0852 12000.0 97.5029 2300.0 101.3897 2300.0 105.0696 27000.0 107.085 21000.0 109.1009 14000.0 111.3318 2100.0 114.0829 2500.0 119.0853 46000.0 121.1009 25000.0 123.0802 12000.0 126.6077 2400.0 127.5037 2600.0 130.5206 2500.0 131.0851 11000.0 133.0856 140000.0 133.1004 34000.0 135.0801 7600.0 135.1168 9400.0 137.0956 2600.0 143.0852 19000.0 145.1009 61000.0 147.0803 9500.0 147.1165 20000.0 157.1008 39000.0 158.1091 11000.0 159.1168 27000.0 163.112 6500.0 165.091 43000.0 169.1016 6500.0 171.1168 25000.0 173.1323 20000.0 173.5238 32000.0 173.5398 55000.0 175.1118 3300.0 175.1488 7900.0 177.1118 18000.0 177.1287 2400.0 177.2065 2500.0 181.101 3000.0 183.1175 17000.0 185.1324 14000.0 191.1435 2400.0 193.1235 3000.0 197.1322 19000.0 203.1425 18000.0 207.1386 3300.0 209.1324 6200.0 210.4134 2500.0 211.1486 10000.0 213.1619 3100.0 221.1327 3000.0 221.154 43000.0 223.1481 7500.0 227.4021 2500.0 237.165 3300.0 257.1877 2800.0 259.1685 11000.0 265.1004 2600.0 266.2031 2600.0 287.2008 16000.0 332.3561 2800.0 337.2158 9500.0 352.2395 22000.0 353.2487 3800.0 365.2488 9300.0 385.9086 3300.0 395.0779 3000.0 504.3602 3300.0 539.1588 2600.0 559.4808 2500.0 END IONS BEGIN IONS SCANS=835 PEPMASS=613.266 CHARGE=1 COLLISION_ENERGY=0.0 64.9587 2700.0 66.0712 2100.0 67.0542 3900.0 68.9192 2200.0 70.5176 2200.0 73.028 15000.0 78.909 2200.0 79.0541 4500.0 81.0695 11000.0 83.0859 2500.0 89.0593 13000.0 93.0695 10000.0 93.2791 2500.0 95.0851 10000.0 96.0886 2700.0 99.1442 2600.0 100.3145 2500.0 105.0696 9600.0 107.0854 14000.0 109.101 12000.0 115.8543 2300.0 119.0853 22000.0 121.1012 14000.0 123.1169 2500.0 126.0751 2400.0 126.2021 2400.0 131.085 5500.0 133.1008 14000.0 134.1046 2500.0 135.1161 2900.0 143.0851 3000.0 145.1009 17000.0 146.1036 2700.0 147.1164 11000.0 148.1202 2800.0 149.6823 3200.0 149.6925 5200.0 149.7034 3500.0 157.1014 12000.0 159.1174 2500.0 160.1182 3400.0 166.5043 2500.0 171.1168 2800.0 172.1222 3200.0 173.1326 3800.0 173.5263 36000.0 173.5417 17000.0 185.1322 9700.0 195.1157 2700.0 197.133 3400.0 211.1504 3000.0 225.8105 3000.0 251.1183 2900.0 259.0667 3100.0 260.2082 2700.0 279.1494 39000.0 345.9432 2600.0 354.1831 2400.0 358.1925 14000.0 369.2072 63000.0 370.2148 4900.0 377.2006 2400.0 379.1929 5900.0 397.2028 46000.0 398.2109 12000.0 407.2238 5500.0 408.2283 8900.0 409.2029 3000.0 410.1678 2800.0 421.2026 7600.0 423.2213 11000.0 424.2296 7400.0 425.1289 6400.0 425.1449 7500.0 425.198 560000.0 426.2048 8000.0 433.2044 7000.0 435.2163 24000.0 436.2235 3700.0 437.1982 58000.0 438.2029 36000.0 439.2137 9000.0 440.2337 7000.0 441.19 4900.0 442.2399 3000.0 448.1902 31000.0 450.2037 15000.0 451.2127 480000.0 452.219 170000.0 453.1958 34000.0 453.2224 58000.0 458.2441 35000.0 461.1978 67000.0 462.131 2300.0 462.2052 200000.0 462.2801 2800.0 463.2129 48000.0 465.191 14000.0 467.2424 6100.0 469.2588 20000.0 470.2663 73000.0 476.1851 32000.0 479.2103 48000.0 480.2161 71000.0 481.254 52000.0 482.2578 13000.0 483.2405 18000.0 487.1495 2900.0 489.1928 52000.0 491.2093 21000.0 495.2389 16000.0 496.2103 13000.0 497.2507 73000.0 498.2622 300000.0 506.1936 11000.0 507.207 37000.0 508.2236 7100.0 509.2499 77000.0 510.2271 25000.0 511.2334 78000.0 512.2006 28000.0 521.2183 13000.0 522.2251 17000.0 524.2409 43000.0 525.2492 230000.0 526.2577 1500000.0 535.234 110000.0 536.2295 4400.0 537.2318 4900.0 537.2438 11000.0 538.2172 3500.0 539.2293 13000.0 540.246 9800.0 541.2773 3100.0 549.2203 5200.0 552.2373 6600.0 553.2449 1000000.0 554.2484 34000.0 557.2769 6600.0 567.2442 7100.0 567.2558 14000.0 568.2288 21000.0 568.246 5500.0 569.2762 36000.0 570.257 4700.0 580.2159 11000.0 581.2226 8000.0 585.2679 15000.0 595.2561 38000.0 596.2395 110000.0 598.2447 7300.0 613.2663 98000.0 END IONS BEGIN IONS SCANS=836 PEPMASS=870.5658 CHARGE=1 COLLISION_ENERGY=0.0 81.2567 2100.0 85.3848 2500.0 120.9391 3200.0 127.7096 2800.0 146.2695 2500.0 172.9718 2600.0 173.5197 8700.0 173.5376 55000.0 274.3145 2400.0 299.8331 2800.0 449.23 2800.0 459.2176 200000.0 460.2252 90000.0 461.2329 17000.0 464.3071 2300.0 473.2267 3800.0 485.2296 4100.0 486.2408 5400.0 487.2202 7800.0 488.258 5500.0 491.2437 22000.0 492.2515 79000.0 500.9707 2500.0 503.2443 29000.0 505.2237 37000.0 515.246 4500.0 516.2511 23000.0 517.2229 8100.0 518.2323 3900.0 519.2384 230000.0 520.2468 52000.0 531.2383 300000.0 532.2459 37000.0 533.1176 3700.0 533.2541 270000.0 534.2632 3500.0 547.2737 4600.0 548.2782 24000.0 549.252 9700.0 559.2321 14000.0 560.2405 49000.0 564.2681 6800.0 577.2441 36000.0 591.2599 150000.0 592.1581 4700.0 592.2672 400000.0 593.2749 29000.0 855.5472 3200.0 870.5647 28000.0 END IONS BEGIN IONS SCANS=837 PEPMASS=871.5729 CHARGE=1 COLLISION_ENERGY=0.0 78.6525 3100.0 82.249 3400.0 82.5761 2300.0 82.688 2400.0 83.0852 16000.0 84.6086 2600.0 85.1009 3200.0 85.9178 2600.0 88.9329 2400.0 89.0945 2500.0 89.2446 2800.0 89.356 2600.0 90.4627 2300.0 96.0311 2700.0 96.5366 2300.0 96.8458 2500.0 97.1008 4500.0 109.5882 2200.0 111.9992 2300.0 127.2768 2300.0 128.2437 2700.0 128.3452 2300.0 130.2389 2500.0 133.3081 2600.0 141.2296 2400.0 145.079 2900.0 148.3129 18000.0 148.3248 14000.0 153.3868 2500.0 153.4191 2500.0 156.3845 2400.0 165.0892 2400.0 173.5233 22000.0 173.5332 100000.0 173.5421 22000.0 181.1579 2500.0 192.3922 2200.0 203.4464 2900.0 210.9773 2800.0 216.8087 2600.0 230.3023 2900.0 230.7472 3200.0 237.5133 2900.0 263.7076 2600.0 320.7367 2800.0 334.3294 2800.0 342.5092 2400.0 362.3214 2400.0 415.1957 2300.0 420.4778 2300.0 431.1794 2900.0 437.606 2300.0 447.2169 2500.0 459.218 470000.0 460.2237 350000.0 460.2925 3400.0 461.2314 160000.0 462.2409 16000.0 471.3392 2600.0 473.2338 36000.0 474.2383 2600.0 476.2559 8800.0 477.2689 3900.0 487.2476 36000.0 488.2231 3000.0 488.2526 4900.0 489.2592 8800.0 489.266 2400.0 491.2435 71000.0 492.2514 160000.0 493.2543 62000.0 503.2411 8500.0 504.2479 25000.0 505.2243 95000.0 506.224 22000.0 515.2443 24000.0 516.2499 23000.0 517.244 43000.0 518.2309 21000.0 519.2386 310000.0 520.244 320000.0 521.2501 59000.0 531.2387 170000.0 531.3273 4500.0 532.2437 380000.0 533.0666 26000.0 533.2543 5200000.0 534.2574 230000.0 547.2713 20000.0 548.2758 37000.0 549.2621 15000.0 549.2763 7500.0 560.2414 120000.0 561.2473 120000.0 562.2188 4100.0 564.247 41000.0 565.2805 94000.0 575.2643 41000.0 577.2443 91000.0 578.2498 43000.0 591.2605 86000.0 592.0458 7100.0 592.2676 3500000.0 592.3795 6200.0 593.0536 32000.0 593.0972 11000.0 593.2752 7500000.0 593.4517 12000.0 593.4994 23000.0 594.277 27000.0 612.0107 3400.0 615.9713 3200.0 753.1719 2900.0 778.7983 3000.0 788.9424 2700.0 811.5292 6300.0 811.5495 3500.0 871.57 250000.0 871.7482 2500.0 878.252 2700.0 END IONS BEGIN IONS SCANS=838 PEPMASS=806.5417 CHARGE=1 COLLISION_ENERGY=0.0 73.0167 2400.0 77.0385 3100.0 79.0539 200000.0 81.0336 2800.0 81.0697 510000.0 83.049 39000.0 83.0854 82000.0 85.0647 28000.0 85.6263 2100.0 86.0959 2600.0 91.0541 230000.0 93.0697 290000.0 93.5541 2200.0 95.0127 18000.0 95.0489 36000.0 95.0854 380000.0 95.1852 2800.0 97.0646 220000.0 97.101 54000.0 97.74 2200.0 98.3402 2000.0 99.044 7400.0 99.0804 19000.0 101.0594 2900.0 103.0534 2700.0 105.0617 4700.0 105.0697 470000.0 105.0782 2600.0 107.049 59000.0 107.0853 200000.0 109.0647 54000.0 109.101 180000.0 109.2822 2200.0 110.5425 2300.0 111.0804 27000.0 111.1169 5400.0 113.0593 4200.0 113.096 5200.0 117.0697 76000.0 119.0476 2500.0 119.0755 3300.0 119.0854 360000.0 121.065 10000.0 121.101 210000.0 123.0441 3600.0 123.0803 42000.0 123.1167 68000.0 124.9887 2300.0 125.0961 30000.0 126.8236 2200.0 127.0758 3200.0 127.3204 2400.0 129.0698 17000.0 131.0854 230000.0 132.0218 2200.0 133.0655 3000.0 133.0924 2200.0 133.101 540000.0 133.1127 9000.0 135.0801 41000.0 135.1167 160000.0 137.096 43000.0 137.1327 16000.0 139.0751 16000.0 139.112 2800.0 141.0702 11000.0 143.0856 25000.0 145.065 8800.0 145.1011 240000.0 147.0809 4300.0 147.1167 260000.0 149.0959 92000.0 149.1323 110000.0 151.0746 3200.0 151.1114 25000.0 153.1271 9400.0 155.0854 16000.0 157.101 39000.0 158.6959 2700.0 159.1167 180000.0 161.0966 6700.0 161.118 4600.0 161.1325 110000.0 163.1117 43000.0 163.1477 32000.0 165.0907 26000.0 165.1275 15000.0 169.1017 26000.0 171.1169 45000.0 173.1326 89000.0 173.5238 86000.0 173.5413 90000.0 175.1121 12000.0 175.1482 30000.0 177.1276 55000.0 179.1251 2700.0 179.143 250000.0 179.8498 2300.0 180.1165 2600.0 183.1171 36000.0 184.0737 5300.0 185.1329 34000.0 187.1118 43000.0 187.1483 24000.0 189.1641 3600.0 191.1443 6800.0 191.482 2700.0 193.1225 8800.0 195.1382 10000.0 197.1322 30000.0 201.1279 2900.0 201.1638 40000.0 203.1435 12000.0 205.122 22000.0 207.1368 5900.0 209.1533 6900.0 211.148 7100.0 215.1434 2500.0 219.1377 7000.0 219.149 8100.0 219.1744 750000.0 219.1998 11000.0 223.1327 18000.0 229.1949 34000.0 233.1534 8300.0 239.1796 35000.0 243.21 9800.0 247.1717 6400.0 247.2052 60000.0 257.1898 110000.0 261.2211 48000.0 264.2108 3000.0 275.1658 5400.0 275.2008 940000.0 275.2264 2300.0 275.2361 4000.0 279.16 14000.0 285.549 2900.0 293.2108 27000.0 321.1307 2800.0 333.9424 2600.0 334.0114 2600.0 335.2582 1200000.0 349.2369 150000.0 371.7031 2700.0 443.9252 2400.0 481.0618 2500.0 515.559 2700.0 587.6212 2800.0 609.4503 220000.0 625.9579 2400.0 END IONS BEGIN IONS SCANS=839 PEPMASS=811.4971 CHARGE=1 COLLISION_ENERGY=0.0 73.028 28000.0 74.2056 2200.0 77.5314 2300.0 79.054 26000.0 79.3556 2400.0 81.0332 5500.0 81.0694 62000.0 82.2096 2700.0 83.0852 3000.0 85.0279 67000.0 87.0435 2400.0 90.1647 82000.0 90.1699 14000.0 90.2569 2300.0 91.0386 52000.0 91.0536 15000.0 91.0842 2600.0 93.0695 39000.0 95.0849 54000.0 97.0279 57000.0 97.0643 2600.0 97.1014 2500.0 98.2243 2500.0 99.0437 8300.0 101.0229 21000.0 105.0696 19000.0 107.0851 24000.0 109.0278 5500.0 109.1007 29000.0 115.0388 3400.0 115.5076 2700.0 115.5628 2700.0 117.0689 2800.0 118.7051 2400.0 119.0849 29000.0 121.1009 27000.0 123.1162 4200.0 124.6458 2300.0 125.1672 2400.0 127.0384 38000.0 131.0853 17000.0 133.1006 24000.0 135.1165 21000.0 142.1965 3000.0 142.9826 2400.0 145.0492 3900.0 145.1003 12000.0 147.1164 8000.0 149.0956 5500.0 149.1325 5400.0 151.4683 2700.0 152.7172 2500.0 159.1165 5500.0 161.1323 13000.0 162.1763 2500.0 173.1325 2800.0 173.5236 69000.0 173.5395 140000.0 177.87 2400.0 179.1423 16000.0 183.1169 2300.0 184.0728 15000.0 185.0417 41000.0 187.1461 2800.0 201.0742 2700.0 202.8868 2400.0 203.0526 11000.0 219.174 24000.0 221.2047 2600.0 223.2639 2200.0 241.0676 2900.0 243.0836 91000.0 259.6677 2400.0 261.2212 21000.0 269.7774 2400.0 275.2002 34000.0 285.1814 2800.0 301.2135 5000.0 315.1928 610000.0 334.0689 2300.0 335.2579 89000.0 335.2991 2700.0 336.4156 2400.0 349.239 3400.0 371.2189 55000.0 378.2071 2600.0 380.2767 2200.0 383.3644 2800.0 465.6983 2300.0 469.3661 2900.0 477.2029 2400.0 497.3159 7100.0 519.1146 3700.0 519.1984 5000.0 519.2241 11000.0 519.2924 1700000.0 521.8826 2800.0 533.1769 13000.0 533.2715 1200000.0 533.3667 8800.0 546.1979 2400.0 572.4286 2700.0 617.3507 2700.0 631.4348 31000.0 649.3344 2400.0 649.4444 97000.0 670.7371 2300.0 697.999 2600.0 767.282 2300.0 811.4954 2200000.0 811.6308 4100.0 END IONS BEGIN IONS SCANS=840 PEPMASS=789.5152 CHARGE=1 COLLISION_ENERGY=0.0 71.4054 2300.0 76.2854 2400.0 77.3838 2200.0 79.0539 38000.0 79.136 2200.0 80.71 2500.0 81.0695 100000.0 83.0487 6500.0 83.0853 15000.0 84.3345 2400.0 86.8329 2300.0 90.8822 2400.0 91.0539 48000.0 92.0596 2500.0 93.0695 70000.0 95.0126 3400.0 95.0851 78000.0 97.0644 47000.0 97.1012 3000.0 105.0695 92000.0 105.3429 2300.0 107.049 11000.0 107.0852 47000.0 109.0648 7300.0 109.1008 36000.0 111.0801 2400.0 117.0697 17000.0 119.0852 68000.0 121.1008 48000.0 123.08 2800.0 123.1166 9600.0 131.0852 36000.0 133.1009 110000.0 135.0803 3700.0 135.1164 32000.0 137.0963 2700.0 137.1319 2900.0 143.0861 3100.0 145.1008 41000.0 147.1164 57000.0 149.0953 15000.0 149.1322 17000.0 159.1165 30000.0 161.1325 18000.0 162.5415 2300.0 163.1117 4800.0 165.0902 3100.0 169.101 3000.0 171.1164 3000.0 173.0429 2300.0 173.1329 12000.0 173.5222 49000.0 173.5393 94000.0 173.5441 9100.0 175.1478 3400.0 177.1271 7800.0 179.1428 38000.0 180.7399 2500.0 182.2946 2400.0 183.1165 2600.0 184.0723 5700.0 185.4917 2500.0 187.1115 3900.0 205.1208 3200.0 211.7893 2400.0 213.6046 2300.0 217.4867 2300.0 219.1742 100000.0 232.3289 2600.0 246.3853 2200.0 246.9475 2700.0 247.2056 8100.0 257.1899 7900.0 259.1255 2200.0 261.2211 3000.0 263.9665 2400.0 275.2006 120000.0 283.6164 2300.0 298.6985 2500.0 309.0251 2300.0 315.9683 2500.0 319.0833 2800.0 333.1981 2600.0 335.2583 140000.0 345.38 2500.0 349.2381 15000.0 566.288 4100.0 609.4527 7200.0 693.9716 3000.0 706.5137 2500.0 750.8487 2800.0 END IONS BEGIN IONS SCANS=841 PEPMASS=568.4265 CHARGE=1 COLLISION_ENERGY=0.0 62.5747 3200.0 67.0539 80000.0 69.0332 16000.0 69.0696 100000.0 71.049 18000.0 71.0859 6000.0 73.028 9900.0 74.5578 3700.0 75.7032 3300.0 79.0539 110000.0 80.0619 15000.0 81.0696 350000.0 82.0729 31000.0 83.0489 49000.0 83.0852 52000.0 85.0645 32000.0 86.4591 3500.0 89.0592 5400.0 91.054 130000.0 92.0619 3800.0 93.0695 460000.0 94.0728 34000.0 95.0488 180000.0 95.0852 280000.0 96.0885 22000.0 97.0645 47000.0 97.1012 10000.0 103.0543 8100.0 104.3747 4000.0 105.0444 12000.0 105.0696 520000.0 106.0731 54000.0 106.59 6200.0 107.0852 440000.0 108.0881 29000.0 109.0645 44000.0 109.1009 290000.0 110.1045 32000.0 111.0802 56000.0 116.6631 3400.0 117.0697 69000.0 118.0778 20000.0 119.0757 18000.0 119.0853 920000.0 119.0944 14000.0 120.0902 67000.0 121.0644 9200.0 121.0911 4600.0 121.1009 490000.0 122.0728 6900.0 122.1045 63000.0 123.0802 130000.0 123.1166 78000.0 124.12 13000.0 125.0958 36000.0 128.0622 15000.0 129.0698 50000.0 130.0772 14000.0 131.0748 9500.0 131.0853 320000.0 132.0928 100000.0 133.101 630000.0 133.1127 14000.0 134.1052 76000.0 135.0802 65000.0 135.1167 240000.0 136.1202 35000.0 137.0959 120000.0 138.1031 35000.0 139.1116 35000.0 141.0689 12000.0 142.0779 37000.0 143.0854 280000.0 144.0927 99000.0 145.1011 910000.0 145.1143 16000.0 146.1061 100000.0 147.0803 33000.0 147.1167 380000.0 148.1203 59000.0 148.5787 4400.0 149.096 79000.0 149.1323 48000.0 151.1117 54000.0 151.149 9900.0 155.0854 77000.0 156.0931 79000.0 157.1011 490000.0 158.1075 120000.0 159.0806 17000.0 159.1168 430000.0 160.1215 61000.0 160.771 6400.0 161.096 79000.0 161.1324 100000.0 163.1117 42000.0 163.1478 20000.0 165.0915 6900.0 167.0855 23000.0 168.6966 3500.0 169.1013 230000.0 170.1076 75000.0 171.1169 390000.0 171.1331 13000.0 172.1227 73000.0 173.0963 32000.0 173.1327 350000.0 173.5272 63000.0 173.5378 70000.0 174.1373 34000.0 175.1115 21000.0 175.1483 250000.0 176.152 12000.0 177.1273 62000.0 179.085 20000.0 181.1014 97000.0 182.1084 55000.0 183.117 280000.0 184.1232 55000.0 185.0945 6900.0 185.1327 290000.0 186.1392 81000.0 187.1126 11000.0 187.1483 170000.0 188.1522 22000.0 189.1277 48000.0 189.164 5700.0 191.1433 110000.0 192.1482 7300.0 193.1011 50000.0 194.1089 51000.0 195.117 190000.0 196.1238 95000.0 197.1325 330000.0 197.1528 5000.0 198.1384 82000.0 199.1122 9400.0 199.1483 170000.0 200.1537 34000.0 201.1277 46000.0 201.1639 92000.0 203.1435 44000.0 205.1595 9500.0 206.1102 4100.0 207.117 95000.0 208.1241 51000.0 209.1328 300000.0 210.1385 53000.0 211.1486 250000.0 212.1536 53000.0 213.1281 20000.0 213.1643 62000.0 215.1441 17000.0 217.1593 57000.0 219.1175 12000.0 220.1251 14000.0 221.1329 110000.0 221.1519 6400.0 222.1388 38000.0 223.1487 160000.0 224.1549 60000.0 225.1641 85000.0 226.1701 18000.0 227.1442 5900.0 227.1799 15000.0 229.1584 20000.0 231.1744 24000.0 233.1323 29000.0 234.1378 21000.0 235.1484 90000.0 236.154 30000.0 236.1965 4400.0 237.1641 96000.0 238.1709 19000.0 239.1798 74000.0 241.1959 40000.0 243.175 7700.0 246.1404 12000.0 247.1482 42000.0 248.1538 26000.0 249.164 72000.0 250.1684 21000.0 251.1792 51000.0 252.1856 15000.0 253.1946 31000.0 255.174 28000.0 257.1903 26000.0 259.149 12000.0 259.2045 20000.0 260.1552 4700.0 261.1642 38000.0 262.1707 19000.0 263.18 54000.0 264.1842 14000.0 265.1955 57000.0 267.2111 25000.0 269.1906 6500.0 270.1972 3900.0 271.2057 12000.0 273.1623 6500.0 275.1788 28000.0 276.1857 11000.0 277.1957 49000.0 278.2028 15000.0 279.2109 25000.0 281.1907 20000.0 283.2067 34000.0 285.222 19000.0 287.1787 14000.0 291.2114 20000.0 295.207 4400.0 296.2136 6000.0 297.2223 18000.0 303.2139 7400.0 305.2277 27000.0 323.2383 60000.0 331.2423 4100.0 335.238 6400.0 338.2615 46000.0 347.2301 4300.0 349.2517 12000.0 351.2702 8500.0 378.5384 6600.0 415.3034 16000.0 430.3262 12000.0 454.1918 6600.0 473.2769 4200.0 547.12 4000.0 564.4832 7500.0 END IONS BEGIN IONS SCANS=842 PEPMASS=585.4275 CHARGE=1 COLLISION_ENERGY=0.0 67.054 3300.0 69.0698 5600.0 73.5641 2200.0 79.0542 5400.0 81.0697 14000.0 83.0487 3300.0 83.0854 3200.0 87.0436 2800.0 89.0596 11000.0 91.0541 6100.0 93.0697 20000.0 94.0727 3200.0 95.0489 3800.0 95.0853 8800.0 95.425 2500.0 97.0651 5200.0 105.0697 19000.0 107.0853 18000.0 109.1009 14000.0 109.1083 2200.0 117.0697 3500.0 119.0854 26000.0 120.089 6600.0 121.1009 24000.0 123.0803 11000.0 131.0853 10000.0 133.0854 3300.0 133.101 20000.0 134.105 3800.0 135.117 8600.0 137.0962 2900.0 139.1118 4100.0 143.0853 11000.0 144.0925 4100.0 145.101 34000.0 146.1049 6400.0 147.1167 13000.0 149.0957 4400.0 154.6168 2400.0 157.101 17000.0 158.1058 5600.0 159.1166 18000.0 160.0876 6300.0 161.0922 3000.0 161.1325 3100.0 167.1067 16000.0 169.1013 6100.0 170.1064 2400.0 171.1167 11000.0 171.5995 2500.0 172.1222 3500.0 173.1326 8400.0 173.5329 26000.0 175.149 5700.0 181.1014 2500.0 183.1166 5500.0 184.1206 2500.0 185.1326 8200.0 186.1359 3100.0 187.1484 5100.0 191.1428 3100.0 195.1165 6300.0 196.125 3100.0 197.1323 12000.0 199.1478 5900.0 207.1171 3500.0 209.1321 8000.0 211.1477 7700.0 221.1325 2800.0 221.1547 2700.0 223.1471 5100.0 225.1635 3100.0 226.1688 2700.0 509.043 2900.0 533.9009 2500.0 END IONS BEGIN IONS SCANS=843 PEPMASS=583.4152 CHARGE=1 COLLISION_ENERGY=0.0 65.0384 8000.0 67.0541 72000.0 68.1375 2200.0 69.0334 48000.0 69.0697 82000.0 71.0489 48000.0 74.0557 2300.0 76.9073 2900.0 77.0388 8300.0 79.0494 3100.0 79.0541 110000.0 81.0697 340000.0 83.0489 73000.0 83.0853 170000.0 85.008 3100.0 85.0286 6900.0 85.0646 25000.0 87.044 13000.0 91.0541 120000.0 93.0697 400000.0 95.049 97000.0 95.0853 310000.0 95.0925 2400.0 97.0647 280000.0 97.1011 12000.0 101.0596 2500.0 103.0545 7700.0 104.0614 4600.0 105.044 2700.0 105.0697 650000.0 105.0761 4000.0 107.0491 7700.0 107.0854 410000.0 109.0646 56000.0 109.101 260000.0 111.0803 60000.0 113.096 160000.0 115.0541 10000.0 117.0697 47000.0 119.0487 2500.0 119.0756 5800.0 119.0854 640000.0 119.0926 4400.0 119.0954 5200.0 120.0937 5500.0 121.0646 45000.0 121.101 510000.0 121.1086 2600.0 123.0803 140000.0 123.1166 70000.0 125.0596 14000.0 125.096 100000.0 128.0623 4200.0 129.0697 30000.0 130.0775 9300.0 131.0747 4400.0 131.0854 190000.0 132.0933 7400.0 133.0647 9000.0 133.1011 370000.0 133.1127 7200.0 135.0247 3800.0 135.0803 58000.0 135.1167 150000.0 137.0959 120000.0 139.0751 13000.0 139.1015 2800.0 139.1117 320000.0 141.0699 3900.0 142.0778 26000.0 143.0854 180000.0 144.0932 31000.0 145.0653 3900.0 145.0886 6800.0 145.1011 540000.0 145.1203 3200.0 146.109 3700.0 147.0804 59000.0 147.1167 550000.0 149.0961 51000.0 149.1325 28000.0 151.0752 51000.0 151.1115 47000.0 153.0911 21000.0 153.1273 75000.0 155.0854 64000.0 155.1065 58000.0 156.0935 36000.0 157.0864 6200.0 157.1011 350000.0 157.1168 4000.0 158.1085 23000.0 159.0806 31000.0 159.1168 230000.0 160.0882 4700.0 161.0961 61000.0 161.1324 76000.0 163.1117 86000.0 163.1469 7000.0 165.091 120000.0 165.1276 19000.0 167.0854 12000.0 167.1065 14000.0 167.1431 3900.0 168.0936 10000.0 169.1013 170000.0 169.1179 6000.0 170.1089 31000.0 171.0812 7100.0 171.1169 230000.0 172.1247 17000.0 173.096 42000.0 173.1326 160000.0 173.5224 20000.0 173.5325 25000.0 173.5411 33000.0 175.1121 32000.0 175.1482 86000.0 177.091 11000.0 177.1278 21000.0 179.0861 18000.0 179.1433 69000.0 180.0933 8000.0 181.1015 85000.0 181.1225 180000.0 182.1087 30000.0 183.117 170000.0 184.1249 19000.0 185.0959 32000.0 185.1326 150000.0 186.1406 7600.0 187.1116 33000.0 187.1482 79000.0 188.7135 2900.0 189.1276 40000.0 191.1064 2600.0 191.1431 41000.0 193.1014 39000.0 193.1204 5700.0 194.1092 32000.0 195.1169 140000.0 195.1381 48000.0 196.1248 68000.0 197.0992 7900.0 197.1326 210000.0 198.1407 11000.0 199.1124 20000.0 199.1483 98000.0 199.8557 2500.0 200.1555 3400.0 201.1278 24000.0 201.1639 42000.0 203.1432 87000.0 205.1589 57000.0 206.1089 14000.0 207.1169 72000.0 207.1385 56000.0 208.1247 34000.0 208.1451 8100.0 209.1102 3000.0 209.1327 240000.0 209.1516 2700.0 210.1405 22000.0 211.1126 15000.0 211.1484 170000.0 213.1277 20000.0 213.1642 26000.0 214.135 4900.0 215.1433 28000.0 215.1777 2900.0 217.1593 20000.0 219.1172 20000.0 219.1747 11000.0 220.1244 19000.0 221.1323 100000.0 221.1542 170000.0 222.1406 32000.0 223.1124 9400.0 223.1485 120000.0 224.1201 2500.0 224.1563 11000.0 225.1281 18000.0 225.164 52000.0 227.1435 31000.0 227.1811 4100.0 229.1593 15000.0 231.1163 4900.0 231.1739 4500.0 233.1325 27000.0 233.1546 24000.0 234.1399 14000.0 235.1484 87000.0 235.1706 2500.0 236.1553 6200.0 237.1273 19000.0 237.1642 71000.0 238.1363 5200.0 239.1435 13000.0 239.1794 20000.0 241.1593 17000.0 241.1945 5800.0 243.1753 28000.0 245.131 13000.0 245.1542 27000.0 245.1884 3200.0 246.1375 4900.0 246.1619 32000.0 247.1466 26000.0 247.1699 100000.0 248.1566 13000.0 249.1253 2700.0 249.1366 3300.0 249.1639 46000.0 251.1469 5100.0 251.1793 28000.0 253.1578 13000.0 253.1933 8000.0 255.1391 3100.0 255.1734 10000.0 257.1896 14000.0 259.1446 5200.0 259.1723 12000.0 260.1567 2800.0 260.179 9500.0 261.1632 28000.0 261.1888 14000.0 262.1715 14000.0 263.1472 3400.0 263.1793 44000.0 265.1607 11000.0 265.1952 26000.0 267.175 14000.0 267.2096 4700.0 269.1908 29000.0 271.1718 11000.0 272.1793 11000.0 273.1875 20000.0 275.1796 45000.0 276.1886 5500.0 277.1561 2600.0 277.1667 3900.0 277.196 38000.0 279.1761 4300.0 281.1905 11000.0 281.295 3200.0 282.2801 11000.0 283.171 8700.0 283.2052 16000.0 283.2827 12000.0 285.1857 120000.0 285.218 2600.0 286.194 18000.0 287.2014 41000.0 289.196 16000.0 291.175 4700.0 291.2098 10000.0 293.1907 11000.0 297.1857 16000.0 298.1936 35000.0 299.2013 81000.0 300.2085 3500.0 300.3076 3600.0 301.1953 4600.0 303.2135 9000.0 306.1966 4900.0 307.2065 4300.0 309.1853 13000.0 309.2242 4000.0 311.2011 46000.0 312.2073 8500.0 313.217 16000.0 321.2232 3800.0 324.2097 12000.0 325.2151 3600.0 335.2375 5900.0 337.219 6000.0 339.2337 8700.0 349.2163 31000.0 351.0088 2800.0 351.2318 14000.0 352.2412 9900.0 353.248 55000.0 363.2307 10000.0 364.2405 55000.0 365.2487 3700.0 375.2309 4500.0 377.2473 27000.0 390.2544 7400.0 415.3048 3100.0 417.2649 2600.0 425.3038 2600.0 427.2984 2700.0 445.31 13000.0 491.3523 130000.0 545.2259 2600.0 565.4034 5500.0 583.4152 37000.0 END IONS BEGIN IONS SCANS=844 PEPMASS=567.4202 CHARGE=1 COLLISION_ENERGY=0.0 63.9283 13000.0 65.0383 13000.0 67.0539 150000.0 69.0332 55000.0 69.0664 11000.0 69.0696 140000.0 71.0488 50000.0 79.0495 16000.0 79.0539 250000.0 79.4813 13000.0 81.0696 680000.0 83.0488 77000.0 83.0853 70000.0 83.6807 11000.0 85.0646 29000.0 91.0482 21000.0 91.0539 270000.0 93.0696 780000.0 93.0768 18000.0 95.0489 140000.0 95.0852 390000.0 97.0645 130000.0 97.1008 25000.0 103.0543 16000.0 105.0696 1100000.0 105.0769 16000.0 105.0782 26000.0 107.049 17000.0 107.0731 15000.0 107.0772 24000.0 107.0852 740000.0 109.0645 79000.0 109.0927 24000.0 109.1009 550000.0 110.5979 14000.0 111.0801 150000.0 115.0544 14000.0 117.0696 110000.0 119.0852 1300000.0 119.0935 20000.0 120.093 16000.0 121.0646 32000.0 121.1009 1100000.0 121.1094 16000.0 122.0733 17000.0 123.0801 89000.0 123.1165 140000.0 125.0958 86000.0 128.0622 27000.0 129.0695 63000.0 130.0776 29000.0 131.0853 400000.0 132.0926 15000.0 133.0652 16000.0 133.0763 18000.0 133.1009 1000000.0 133.111 20000.0 135.0803 72000.0 135.1166 420000.0 137.0958 310000.0 137.1074 11000.0 137.1328 21000.0 139.1116 80000.0 141.0699 25000.0 142.0775 40000.0 143.0852 360000.0 144.0931 72000.0 145.1009 1100000.0 145.1122 20000.0 146.1084 23000.0 147.0801 88000.0 147.1165 850000.0 147.1275 11000.0 149.0959 71000.0 149.1322 45000.0 151.1114 120000.0 155.0851 110000.0 156.0932 70000.0 157.1009 650000.0 157.1127 11000.0 158.1091 54000.0 159.0798 33000.0 159.1166 530000.0 160.1243 15000.0 161.0958 100000.0 161.1323 140000.0 163.1116 50000.0 163.1472 21000.0 165.0903 14000.0 165.127 13000.0 167.0857 47000.0 168.093 21000.0 169.1011 290000.0 170.1089 63000.0 171.0805 19000.0 171.1168 420000.0 172.1245 27000.0 173.096 48000.0 173.1324 330000.0 173.5314 140000.0 175.1116 35000.0 175.1482 200000.0 177.1269 16000.0 179.0858 56000.0 181.1011 110000.0 182.109 66000.0 183.1168 260000.0 184.1241 37000.0 185.1324 280000.0 186.1401 24000.0 187.1118 19000.0 187.1481 170000.0 189.1271 38000.0 189.1629 20000.0 191.1431 30000.0 192.0933 16000.0 193.1012 77000.0 194.1089 78000.0 195.1167 260000.0 196.1246 100000.0 197.1126 23000.0 197.1325 340000.0 198.1395 33000.0 199.1117 17000.0 199.1482 210000.0 201.1285 17000.0 201.1638 67000.0 203.1425 41000.0 205.1581 17000.0 206.1094 36000.0 207.117 130000.0 208.1249 64000.0 209.1324 310000.0 209.1509 8000.0 210.1407 48000.0 211.1482 290000.0 211.1708 14000.0 212.1563 24000.0 213.1275 37000.0 213.1643 42000.0 215.1427 22000.0 217.1586 15000.0 219.1171 16000.0 220.1238 31000.0 221.1325 180000.0 221.1551 9600.0 222.1401 46000.0 223.1484 200000.0 224.154 27000.0 225.1638 92000.0 225.1875 15000.0 227.1432 27000.0 227.1797 21000.0 229.1582 27000.0 231.1154 17000.0 232.1248 14000.0 233.1326 53000.0 234.1399 33000.0 235.1486 110000.0 236.1556 22000.0 237.164 91000.0 239.143 19000.0 239.1791 42000.0 241.195 20000.0 245.1317 27000.0 246.1405 25000.0 247.1477 73000.0 248.1554 34000.0 249.1637 70000.0 251.1797 60000.0 253.1603 14000.0 253.1951 31000.0 257.1319 13000.0 259.1478 38000.0 260.1559 25000.0 261.1638 60000.0 262.1711 26000.0 263.1802 59000.0 264.1858 13000.0 265.1942 43000.0 267.176 16000.0 267.2106 19000.0 269.1899 21000.0 273.163 26000.0 274.1712 20000.0 275.1799 53000.0 276.1856 14000.0 277.1953 56000.0 281.1919 13000.0 285.1658 16000.0 287.1793 16000.0 289.1952 37000.0 290.2049 13000.0 291.2119 17000.0 299.1783 19000.0 301.1944 22000.0 303.214 14000.0 315.2088 23000.0 317.2277 17000.0 341.2267 13000.0 343.2402 17000.0 355.2453 15000.0 411.305 20000.0 END IONS BEGIN IONS SCANS=845 PEPMASS=584.4218 CHARGE=1 COLLISION_ENERGY=0.0 67.0539 47000.0 69.0333 27000.0 69.0695 57000.0 70.3857 3300.0 71.0489 27000.0 71.0853 2800.0 73.028 3200.0 77.0384 6800.0 79.0539 81000.0 79.477 2300.0 80.0619 22000.0 81.0696 230000.0 81.6369 2200.0 82.073 12000.0 83.0488 41000.0 83.0852 72000.0 84.0885 6900.0 84.1596 2800.0 85.0645 20000.0 87.0437 15000.0 89.0594 150000.0 91.054 76000.0 92.062 4400.0 93.0695 310000.0 94.0729 10000.0 95.0489 100000.0 95.0852 180000.0 96.0885 10000.0 97.0645 120000.0 98.0678 10000.0 103.0545 3100.0 105.0447 2700.0 105.0696 350000.0 106.0728 21000.0 107.0488 7000.0 107.0852 290000.0 108.0563 2700.0 108.0881 14000.0 109.0645 42000.0 109.0928 2700.0 109.1009 210000.0 110.1042 11000.0 111.0801 37000.0 113.0959 62000.0 114.0996 3000.0 115.0544 3100.0 117.0695 50000.0 119.0754 4900.0 119.0852 470000.0 119.093 2800.0 119.0955 10000.0 120.0911 33000.0 121.0646 28000.0 121.091 4100.0 121.1009 320000.0 121.1097 2900.0 122.1044 29000.0 123.0802 200000.0 123.1165 44000.0 124.0837 3500.0 125.0596 3900.0 125.0958 54000.0 128.0624 7500.0 129.0695 33000.0 130.0776 16000.0 131.0853 200000.0 132.0928 47000.0 133.0646 6900.0 133.0858 65000.0 133.1009 330000.0 133.1128 6300.0 134.107 28000.0 135.0803 51000.0 135.1166 110000.0 136.086 4900.0 136.1201 7300.0 137.0959 77000.0 137.1333 4200.0 138.1033 31000.0 139.1115 110000.0 140.1149 17000.0 142.0773 21000.0 143.0853 200000.0 144.0926 60000.0 145.0647 22000.0 145.101 580000.0 145.1142 8600.0 145.6926 2600.0 146.0728 3400.0 146.1066 56000.0 147.0802 43000.0 147.1166 250000.0 148.12 42000.0 149.0958 47000.0 149.1322 26000.0 150.1022 3600.0 151.0752 11000.0 151.1116 31000.0 153.0902 4400.0 153.1274 18000.0 155.0852 55000.0 155.1061 46000.0 156.093 52000.0 157.1009 350000.0 158.1082 86000.0 159.0806 45000.0 159.1166 290000.0 160.0882 260000.0 160.1036 5700.0 160.1215 24000.0 161.0959 62000.0 161.1323 61000.0 162.1002 4700.0 163.1116 57000.0 163.1474 6200.0 163.3852 3100.0 164.1172 4100.0 165.091 57000.0 165.1268 6500.0 166.0946 3400.0 167.0856 13000.0 167.1066 59000.0 168.0926 8100.0 169.1011 140000.0 170.1079 44000.0 171.1008 3800.0 171.1168 250000.0 172.1233 35000.0 173.0963 27000.0 173.1324 150000.0 173.5229 15000.0 173.5318 89000.0 173.5433 23000.0 174.1371 19000.0 175.112 40000.0 175.1482 64000.0 176.1206 3000.0 176.1515 5200.0 177.1109 7500.0 177.1272 17000.0 179.0859 13000.0 179.1434 23000.0 180.0939 4600.0 180.1461 5100.0 181.1012 59000.0 181.1224 72000.0 182.1082 32000.0 182.1259 5200.0 183.1168 160000.0 184.1229 43000.0 185.0963 20000.0 185.1325 170000.0 186.1387 38000.0 187.112 28000.0 187.1481 67000.0 188.1181 4400.0 189.1276 44000.0 190.1334 7900.0 191.1431 44000.0 193.1011 32000.0 193.1208 11000.0 194.1086 25000.0 195.1167 140000.0 195.1371 25000.0 196.1237 47000.0 196.4696 2600.0 197.1324 230000.0 198.1386 41000.0 199.1124 18000.0 199.1482 99000.0 200.1535 15000.0 201.1277 25000.0 201.1637 27000.0 202.1335 4200.0 203.1431 57000.0 204.1476 7100.0 205.1591 15000.0 207.1167 59000.0 207.1372 27000.0 208.1238 27000.0 208.1449 5400.0 209.1325 160000.0 210.1385 46000.0 211.1133 18000.0 211.1483 140000.0 212.1541 25000.0 213.1274 26000.0 213.1636 46000.0 214.1335 3700.0 215.1429 14000.0 217.1588 9400.0 219.1158 3400.0 220.1256 10000.0 221.1323 67000.0 221.1541 91000.0 222.1379 24000.0 222.1577 8400.0 223.1483 110000.0 224.154 29000.0 225.1274 16000.0 225.1641 70000.0 226.1708 16000.0 227.1434 19000.0 227.1803 3200.0 229.1585 13000.0 231.1171 4000.0 231.1381 3300.0 231.1703 2900.0 233.1318 26000.0 233.1551 20000.0 234.1377 11000.0 234.16 2600.0 235.1483 57000.0 236.1542 16000.0 237.164 57000.0 238.1676 8500.0 239.1439 13000.0 239.1792 29000.0 241.1587 10000.0 243.1752 7300.0 245.131 3800.0 245.1544 3700.0 246.1612 33000.0 247.146 25000.0 247.1702 29000.0 248.1511 4100.0 248.1754 5100.0 249.1643 39000.0 250.1689 6900.0 251.1796 27000.0 251.352 2800.0 252.1849 3100.0 253.159 10000.0 253.1955 16000.0 255.1746 13000.0 257.1909 4100.0 258.1396 2800.0 259.1699 13000.0 260.1785 5000.0 261.1624 29000.0 263.1798 39000.0 264.1841 8300.0 265.1949 22000.0 266.201 12000.0 267.1763 8100.0 269.1895 5900.0 271.1705 20000.0 273.1863 9500.0 274.1936 3300.0 275.1785 25000.0 276.1836 6100.0 277.195 15000.0 278.1989 5400.0 279.2107 5200.0 281.1886 4000.0 283.2058 10000.0 285.1861 21000.0 286.1922 40000.0 287.2012 29000.0 289.1956 9700.0 291.2109 11000.0 297.1854 11000.0 298.1935 6500.0 299.1999 35000.0 300.206 9200.0 310.192 4200.0 311.2023 16000.0 312.2067 10000.0 321.2198 4000.0 325.2171 7200.0 337.2159 12000.0 339.2292 6100.0 345.2591 3300.0 352.2396 29000.0 353.248 13000.0 354.2518 6200.0 365.2456 31000.0 366.2566 6300.0 409.2767 3400.0 446.3151 3700.0 459.3012 3100.0 491.3615 4600.0 492.3582 20000.0 492.6389 2900.0 526.8341 3700.0 545.2681 2400.0 553.075 2300.0 584.4188 4200.0 END IONS BEGIN IONS SCANS=846 PEPMASS=613.4236 CHARGE=1 COLLISION_ENERGY=0.0 67.0539 27000.0 69.0333 4000.0 69.0696 40000.0 70.9707 2700.0 71.0491 2900.0 79.0539 53000.0 81.0695 140000.0 83.0489 22000.0 83.0852 22000.0 84.0317 2500.0 85.0646 3400.0 86.486 2600.0 87.2105 2200.0 89.4703 2300.0 91.0539 58000.0 93.0695 180000.0 94.0733 3300.0 95.0488 38000.0 95.0852 100000.0 97.0645 22000.0 97.1011 5600.0 99.0437 8400.0 105.0695 230000.0 106.0724 3100.0 107.0851 170000.0 109.0644 29000.0 109.1008 130000.0 111.0802 16000.0 117.0696 27000.0 119.076 9900.0 119.0852 310000.0 119.0951 8600.0 121.0645 8900.0 121.1008 220000.0 122.1043 7600.0 123.08 45000.0 123.1164 42000.0 125.0956 29000.0 129.0696 17000.0 131.0852 110000.0 132.0925 25000.0 133.1008 250000.0 133.1126 3300.0 134.1048 9900.0 135.0801 29000.0 135.1165 92000.0 136.1203 2700.0 137.0959 49000.0 138.1028 6700.0 139.1112 16000.0 142.0777 13000.0 142.4554 2400.0 143.0851 90000.0 144.0927 16000.0 145.0892 2800.0 145.1009 310000.0 146.1051 26000.0 147.0801 18000.0 147.1165 190000.0 149.0955 27000.0 149.1322 16000.0 151.1114 23000.0 155.0851 27000.0 156.0928 22000.0 157.1008 180000.0 158.1066 31000.0 159.0803 9300.0 159.1166 160000.0 159.9436 2500.0 160.1209 8100.0 161.0958 27000.0 161.1321 38000.0 163.1116 14000.0 163.148 12000.0 165.0697 3300.0 167.0855 7600.0 167.1067 2700.0 169.101 79000.0 170.1074 22000.0 171.0808 2700.0 171.1166 120000.0 172.1223 18000.0 173.0959 10000.0 173.1323 120000.0 173.5222 18000.0 173.5328 43000.0 173.542 16000.0 174.1359 8500.0 175.1116 16000.0 175.1481 67000.0 177.1272 3600.0 179.0845 4500.0 180.6527 2700.0 181.101 35000.0 182.1084 18000.0 183.1168 77000.0 184.1233 26000.0 185.1324 73000.0 186.1374 16000.0 187.1121 5800.0 187.1479 50000.0 188.1523 2300.0 189.1277 14000.0 191.1429 25000.0 193.1012 16000.0 194.1086 17000.0 195.1165 73000.0 196.1235 30000.0 197.1323 100000.0 198.1378 24000.0 199.1133 7700.0 199.1479 95000.0 200.1525 6900.0 201.128 7100.0 201.1637 28000.0 203.1412 9100.0 205.7311 2700.0 206.1104 3100.0 207.117 32000.0 208.1237 22000.0 209.1323 88000.0 210.1381 29000.0 211.148 91000.0 212.1527 20000.0 213.1275 11000.0 213.1637 24000.0 215.1427 7300.0 217.1587 31000.0 219.1175 7600.0 220.1252 7300.0 221.1325 49000.0 222.1385 14000.0 223.1479 67000.0 224.154 18000.0 225.1252 2600.0 225.1634 29000.0 226.1687 8000.0 227.1426 8100.0 227.1778 3000.0 228.15 3000.0 231.5155 3000.0 233.1318 16000.0 234.1391 8500.0 235.1481 37000.0 236.1546 12000.0 237.1637 37000.0 238.168 14000.0 239.1443 4000.0 239.1785 17000.0 241.194 3600.0 245.1321 7100.0 247.148 22000.0 248.1546 8700.0 249.1635 22000.0 250.1689 8700.0 251.1793 23000.0 252.186 9400.0 253.1933 15000.0 257.1891 2700.0 259.1486 5500.0 260.1551 7900.0 261.1628 19000.0 262.1717 8000.0 263.1792 25000.0 264.1838 7300.0 265.195 23000.0 269.1902 11000.0 271.2082 3700.0 273.1624 3100.0 274.1733 4300.0 275.1798 14000.0 276.1866 10000.0 277.1947 15000.0 281.1888 4300.0 283.2056 9600.0 287.1783 3500.0 289.1969 11000.0 291.211 6300.0 295.2058 9700.0 298.1914 3600.0 299.1952 5000.0 314.2034 2500.0 317.2267 3600.0 333.2219 3100.0 348.2462 3700.0 391.2589 2800.0 417.1725 2500.0 429.3153 3300.0 512.2758 3000.0 END IONS BEGIN IONS SCANS=847 PEPMASS=629.4198 CHARGE=1 COLLISION_ENERGY=0.0 65.1955 2300.0 67.054 16000.0 67.538 2800.0 69.0695 7400.0 69.1309 2300.0 70.8596 2600.0 79.0541 18000.0 81.0696 43000.0 81.1388 2500.0 83.0488 4500.0 83.0854 3700.0 89.0593 32000.0 91.0538 17000.0 93.0695 45000.0 93.2469 2300.0 95.0488 10000.0 95.0851 25000.0 97.0645 15000.0 97.2676 2300.0 100.138 2300.0 100.4685 2600.0 105.0695 53000.0 105.6171 2700.0 107.0851 48000.0 109.0644 14000.0 109.1009 48000.0 111.6779 2200.0 117.0701 6000.0 118.9178 2400.0 119.0852 70000.0 121.0247 2300.0 121.1008 64000.0 123.0803 9400.0 123.1167 10000.0 125.0956 8400.0 125.2557 2700.0 126.0329 2100.0 129.0689 3300.0 131.0852 32000.0 133.0855 14000.0 133.0893 3000.0 133.1009 68000.0 135.081 5000.0 135.1166 21000.0 137.0958 19000.0 139.1112 13000.0 143.0852 30000.0 144.0933 2500.0 145.101 79000.0 147.081 7400.0 147.1164 24000.0 151.076 3800.0 151.111 3700.0 156.093 3800.0 156.2626 2600.0 157.1008 52000.0 159.1167 34000.0 161.0959 11000.0 161.1319 9200.0 163.1116 13000.0 167.1078 3300.0 169.1011 29000.0 171.1167 30000.0 173.1326 22000.0 173.5285 47000.0 173.5384 27000.0 175.1118 3300.0 175.1479 13000.0 181.102 6900.0 183.1168 27000.0 185.1324 21000.0 186.9973 2500.0 187.1472 5000.0 189.1268 3200.0 191.1433 3400.0 191.9778 2700.0 193.0858 2500.0 195.1171 19000.0 196.1245 6200.0 197.1323 27000.0 199.1483 13000.0 201.1638 3300.0 207.1169 9200.0 209.1326 26000.0 211.1484 16000.0 221.1325 11000.0 223.1482 17000.0 223.9691 2700.0 225.1638 8400.0 235.1478 6900.0 237.1642 8900.0 249.1636 4000.0 259.1432 2300.0 261.1651 2700.0 263.1792 2700.0 275.1802 2400.0 300.0621 2900.0 376.125 2600.0 398.446 2500.0 402.0728 2700.0 412.0632 2500.0 507.4015 2600.0 553.2368 2800.0 598.4518 2400.0 635.7117 2800.0 END IONS BEGIN IONS SCANS=848 PEPMASS=630.4266 CHARGE=1 COLLISION_ENERGY=0.0 67.0538 3900.0 69.0696 3000.0 70.0772 2200.0 71.0489 3600.0 74.5191 2900.0 79.054 5600.0 81.0695 16000.0 83.0853 2500.0 89.0594 9200.0 91.054 2800.0 93.0696 23000.0 95.0489 6400.0 95.0852 11000.0 97.1414 2600.0 105.0695 23000.0 107.0851 22000.0 107.5158 2300.0 109.0647 9000.0 109.1008 18000.0 117.0693 4400.0 117.1773 2200.0 119.0851 39000.0 119.9619 2500.0 120.0887 2300.0 121.1007 21000.0 123.0799 12000.0 125.0593 2600.0 125.0962 4900.0 131.0853 15000.0 132.0933 3600.0 133.1007 29000.0 135.0806 6600.0 135.1165 9100.0 137.096 5000.0 143.0854 18000.0 144.092 3400.0 145.1008 44000.0 147.1165 15000.0 149.0955 6400.0 151.1104 3100.0 155.0848 4000.0 157.1008 19000.0 158.1069 6800.0 159.1162 16000.0 161.0962 3200.0 161.1329 3600.0 163.1107 6900.0 169.1012 11000.0 171.1165 14000.0 173.1324 13000.0 173.5315 44000.0 175.148 9300.0 181.1019 2800.0 181.1217 3300.0 183.1165 13000.0 185.1321 8500.0 187.1483 2700.0 190.6258 2600.0 190.6846 2400.0 191.1429 3700.0 195.1161 9000.0 197.1321 10000.0 199.1118 2600.0 199.1488 5300.0 201.128 3000.0 207.1161 3800.0 209.1328 7900.0 211.1484 6200.0 212.4924 2600.0 213.1625 6700.0 218.4745 2500.0 221.1331 3800.0 223.1476 5000.0 225.1634 2800.0 252.1838 2700.0 286.1885 2600.0 558.7722 2500.0 END IONS BEGIN IONS SCANS=849 PEPMASS=566.4117 CHARGE=1 COLLISION_ENERGY=0.0 63.2242 2200.0 67.054 13000.0 67.5864 2200.0 69.0697 11000.0 70.1956 2300.0 71.0491 5100.0 72.4141 2400.0 78.3476 2200.0 79.0539 17000.0 80.0617 6100.0 81.0696 38000.0 82.2681 2400.0 83.049 3600.0 83.0854 11000.0 87.1276 2500.0 91.0539 15000.0 93.0696 56000.0 95.0489 19000.0 95.0853 41000.0 97.0644 24000.0 105.0695 68000.0 105.4417 2400.0 107.0852 62000.0 109.0645 6700.0 109.1009 42000.0 110.1045 2500.0 111.0802 12000.0 113.0959 18000.0 113.9882 2700.0 117.0698 13000.0 119.0767 3000.0 119.0852 99000.0 121.0643 3200.0 121.1008 54000.0 123.0801 29000.0 123.1165 7600.0 125.0958 7400.0 130.0773 3200.0 131.0851 43000.0 132.0933 10000.0 133.1008 67000.0 135.0804 7600.0 135.1168 26000.0 137.0961 13000.0 139.1114 20000.0 143.0852 46000.0 144.0928 15000.0 145.1009 120000.0 146.1083 4000.0 147.0803 10000.0 147.1165 37000.0 149.095 3400.0 151.1122 3200.0 152.5439 2800.0 155.085 8300.0 155.1067 3100.0 156.0931 16000.0 157.1008 78000.0 158.1087 10000.0 159.0801 15000.0 159.1166 56000.0 160.0877 6500.0 161.0958 14000.0 161.1323 3400.0 162.0478 2400.0 167.0853 5700.0 169.1009 36000.0 170.1085 11000.0 171.0806 2700.0 171.1165 41000.0 173.0964 8200.0 173.1324 38000.0 173.5072 2900.0 173.53 65000.0 173.5438 9400.0 175.1103 2700.0 175.1478 16000.0 179.1428 7800.0 181.1016 20000.0 181.1217 16000.0 183.1166 46000.0 184.1234 10000.0 185.096 6400.0 185.1323 37000.0 187.1106 4400.0 187.1483 18000.0 189.1265 4200.0 191.1436 4300.0 192.5698 2600.0 193.1006 3500.0 194.1093 3400.0 195.1166 44000.0 196.1237 13000.0 197.1323 55000.0 198.1393 5700.0 199.1124 5800.0 199.1481 23000.0 200.1192 3400.0 201.1269 5700.0 203.143 15000.0 207.1169 22000.0 208.1251 5000.0 209.1326 36000.0 210.1393 7400.0 211.1123 2700.0 211.1481 30000.0 213.128 9600.0 213.1624 8600.0 215.1424 11000.0 219.1178 4100.0 221.1322 25000.0 221.1535 22000.0 222.1403 3300.0 223.1479 25000.0 225.128 13000.0 225.1641 12000.0 227.1437 6200.0 231.117 4200.0 233.1319 7700.0 235.1478 18000.0 237.1295 2600.0 237.163 11000.0 239.1417 2900.0 239.1791 2900.0 247.1472 14000.0 249.1632 13000.0 251.1475 2600.0 251.1793 9900.0 253.1589 3900.0 254.4491 2600.0 261.1632 16000.0 263.1776 9400.0 265.1944 2700.0 275.18 10000.0 279.2171 2300.0 281.1907 11000.0 282.2802 3300.0 283.2067 2600.0 283.283 3300.0 287.203 2600.0 298.1921 3900.0 299.2014 8300.0 310.308 5900.0 311.3165 3500.0 332.2477 2400.0 386.6606 2600.0 536.8918 2600.0 END IONS BEGIN IONS SCANS=850 PEPMASS=612.4175 CHARGE=1 COLLISION_ENERGY=0.0 64.493 2600.0 64.8053 2100.0 65.3313 2200.0 67.0537 12000.0 68.6482 2900.0 69.0697 13000.0 69.3136 2400.0 70.1481 2600.0 71.5235 2300.0 73.0281 13000.0 73.784 2300.0 74.3933 2400.0 76.5689 2100.0 79.0539 20000.0 80.0616 2800.0 80.6609 2500.0 81.0024 2600.0 81.0696 59000.0 81.0743 2400.0 83.0489 7800.0 83.0853 15000.0 84.1768 2400.0 84.3249 2500.0 84.7553 2200.0 89.0595 12000.0 90.9362 2300.0 91.054 25000.0 93.0202 2600.0 93.0695 74000.0 95.0489 46000.0 95.0851 36000.0 97.0644 8200.0 99.0437 34000.0 99.0814 2500.0 99.8256 2600.0 101.1928 2700.0 102.3823 2500.0 105.0695 100000.0 106.0776 2500.0 107.0852 100000.0 109.0408 2700.0 109.0644 13000.0 109.1008 43000.0 109.2047 2500.0 110.7815 2900.0 111.08 2800.0 117.0696 18000.0 119.0851 150000.0 120.0929 11000.0 121.0647 11000.0 121.1009 90000.0 122.1093 2500.0 122.2311 2400.0 123.0712 2200.0 123.0801 100000.0 123.1161 2900.0 125.0958 47000.0 129.0701 4000.0 129.8257 2800.0 131.0852 78000.0 132.093 54000.0 133.1009 150000.0 134.1085 5000.0 135.0799 10000.0 135.1166 26000.0 135.9643 2700.0 136.3532 2400.0 137.0957 26000.0 138.1036 23000.0 138.1827 2400.0 141.0691 3100.0 143.0852 81000.0 144.093 28000.0 145.0888 8200.0 145.1009 250000.0 146.1087 12000.0 146.4084 2400.0 147.0802 11000.0 147.1164 85000.0 149.0956 33000.0 151.1109 9900.0 155.0855 20000.0 156.0931 21000.0 157.0879 4100.0 157.1009 160000.0 158.1085 39000.0 159.0804 5700.0 159.1165 110000.0 160.1242 10000.0 161.0959 37000.0 161.1321 11000.0 163.1115 7600.0 169.101 78000.0 170.109 19000.0 171.1167 110000.0 172.1244 16000.0 173.0958 9900.0 173.1325 84000.0 173.528 93000.0 173.5405 41000.0 175.1122 9800.0 175.1483 13000.0 181.1008 25000.0 182.1097 3800.0 183.1167 77000.0 184.1246 18000.0 185.1324 90000.0 186.1404 6700.0 187.1113 7200.0 187.1479 24000.0 189.1272 22000.0 189.5451 2400.0 191.1428 45000.0 193.1007 11000.0 194.1085 14000.0 195.1165 81000.0 195.1365 2300.0 196.1241 28000.0 197.1323 120000.0 198.1401 18000.0 199.1121 6400.0 199.1481 76000.0 201.1288 6200.0 201.162 3000.0 203.1424 3000.0 203.1841 2600.0 207.1167 25000.0 208.1253 13000.0 209.1323 110000.0 210.1401 20000.0 211.1482 100000.0 213.1275 11000.0 213.1642 9700.0 215.1424 3700.0 217.1601 2700.0 220.1265 3000.0 221.1323 32000.0 222.14 10000.0 223.1481 69000.0 224.156 14000.0 225.1268 7000.0 225.1636 28000.0 227.1436 11000.0 229.1584 3100.0 233.1323 6200.0 233.1548 6600.0 233.752 2400.0 235.1481 21000.0 237.1638 73000.0 239.1422 11000.0 239.1781 2600.0 241.1621 2600.0 247.1488 11000.0 249.1635 22000.0 250.343 2500.0 251.1787 16000.0 252.1868 8600.0 253.1946 12000.0 261.1634 19000.0 263.1785 22000.0 265.1932 10000.0 273.1667 3000.0 275.1793 7200.0 276.1864 2800.0 277.195 12000.0 283.1693 3100.0 283.2072 3800.0 287.1818 3400.0 298.1931 44000.0 329.2259 5300.0 390.2551 28000.0 436.295 3000.0 446.8841 2900.0 528.3614 13000.0 538.3205 2600.0 615.9606 3400.0 END IONS BEGIN IONS SCANS=851 PEPMASS=600.4161 CHARGE=1 COLLISION_ENERGY=0.0 69.0332 3400.0 69.0695 3300.0 79.0206 2400.0 79.0538 5300.0 81.0697 23000.0 83.0492 4700.0 83.0853 4900.0 85.0647 3300.0 88.8461 2300.0 89.0594 42000.0 91.054 10000.0 93.0696 30000.0 95.0489 10000.0 95.0854 23000.0 96.4889 2100.0 97.0647 9200.0 105.0697 29000.0 107.0853 26000.0 109.0645 9800.0 109.1009 14000.0 111.0805 3500.0 112.2567 2900.0 113.4288 2200.0 117.0698 3600.0 119.0853 58000.0 121.0652 4200.0 121.1009 41000.0 122.1043 4700.0 123.0802 16000.0 123.1166 3000.0 125.0596 20000.0 131.0852 21000.0 132.0932 2200.0 133.064 2500.0 133.086 22000.0 133.1009 39000.0 134.1079 2500.0 134.6264 2300.0 135.0801 17000.0 135.1168 15000.0 137.096 19000.0 138.0988 2400.0 139.0754 3000.0 143.0851 22000.0 145.1009 53000.0 146.106 3400.0 147.0802 37000.0 147.1167 17000.0 148.0843 4300.0 149.096 13000.0 151.0752 20000.0 151.1124 2700.0 152.0795 2400.0 153.0926 4000.0 155.0857 5400.0 156.0921 4000.0 156.6785 2500.0 157.1011 43000.0 158.1051 9200.0 159.0804 3900.0 159.1167 33000.0 160.1213 2700.0 161.0959 11000.0 161.1323 16000.0 163.1116 47000.0 165.091 140000.0 166.0943 30000.0 168.0933 2300.0 169.101 17000.0 170.1079 4700.0 171.1167 35000.0 172.1223 8600.0 173.0958 7500.0 173.1322 16000.0 173.5201 5100.0 173.5364 43000.0 175.1115 11000.0 175.1486 8400.0 177.0914 5000.0 177.1283 4200.0 181.1035 5300.0 181.1222 40000.0 182.1261 4000.0 183.1168 26000.0 184.1213 7700.0 185.1324 22000.0 186.1364 4600.0 187.1119 11000.0 187.1472 5900.0 189.1274 13000.0 190.1349 13000.0 191.107 10000.0 191.1427 8100.0 193.1225 16000.0 194.1079 6700.0 195.1171 11000.0 196.1237 4000.0 197.132 21000.0 198.1377 3700.0 199.1107 4300.0 199.1475 3600.0 201.1275 11000.0 203.1431 59000.0 204.1462 18000.0 207.1176 4600.0 207.1375 17000.0 208.1441 8100.0 209.1327 14000.0 210.1389 3300.0 211.1118 6500.0 211.1483 16000.0 212.1522 5100.0 213.1277 8100.0 215.1419 4500.0 216.1495 3900.0 219.1385 8200.0 221.1325 8300.0 221.1537 150000.0 222.157 44000.0 223.1489 8500.0 225.1274 6900.0 225.1634 8000.0 227.1433 4600.0 229.1226 3800.0 229.1585 5600.0 233.1542 7000.0 234.1619 17000.0 235.1468 4600.0 237.1641 4700.0 239.1428 2900.0 239.1802 3200.0 240.1861 3600.0 241.1585 2500.0 247.1691 39000.0 248.1739 13000.0 249.1657 2700.0 251.1434 4000.0 251.1782 5500.0 253.1589 3400.0 255.5271 2600.0 259.17 4700.0 261.1865 3100.0 263.1785 2700.0 265.161 3800.0 267.1739 2700.0 271.1696 3500.0 273.1837 4000.0 274.193 10000.0 281.1897 7700.0 285.1864 2600.0 286.1937 11000.0 287.2005 31000.0 288.2022 7000.0 293.1895 2900.0 297.1855 4400.0 299.2008 24000.0 300.2064 4400.0 307.203 2900.0 309.2798 4700.0 311.201 4300.0 312.2061 7900.0 313.2155 19000.0 314.2224 3500.0 325.216 26000.0 326.2199 4100.0 327.2322 10000.0 328.2343 5800.0 337.2156 7400.0 339.231 3900.0 340.2394 42000.0 351.2304 2900.0 352.2394 22000.0 365.2462 13000.0 366.2523 3900.0 391.2643 4000.0 392.266 3500.0 406.3339 2600.0 413.2702 10000.0 420.2982 8300.0 425.2689 25000.0 427.284 23000.0 428.2877 6800.0 428.6165 2600.0 440.2925 33000.0 454.2995 3700.0 481.8927 3000.0 520.3521 5100.0 542.572 2400.0 600.4097 3700.0 END IONS BEGIN IONS SCANS=852 PEPMASS=599.41 CHARGE=1 COLLISION_ENERGY=0.0 63.3311 2300.0 67.0542 21000.0 69.0336 18000.0 69.0697 19000.0 71.0494 3100.0 79.0543 22000.0 81.0699 78000.0 81.9849 2400.0 83.0492 28000.0 83.0854 15000.0 85.0283 2400.0 85.0647 23000.0 87.0442 2500.0 91.0542 25000.0 93.0699 120000.0 95.0492 25000.0 95.0855 83000.0 97.0648 33000.0 105.0699 91000.0 107.0855 86000.0 109.0648 26000.0 109.1012 46000.0 111.0803 19000.0 113.0961 4000.0 117.0697 13000.0 119.0856 150000.0 121.0647 17000.0 121.1012 160000.0 123.0804 66000.0 123.117 19000.0 125.0597 44000.0 125.0961 12000.0 129.0701 7600.0 131.0856 52000.0 132.9713 2300.0 133.0645 6400.0 133.1012 110000.0 135.0804 74000.0 135.1168 54000.0 137.0961 86000.0 139.0755 28000.0 139.1112 17000.0 142.0775 7600.0 143.0855 53000.0 144.0931 3900.0 145.1012 140000.0 145.1141 3000.0 147.0805 180000.0 147.0934 5000.0 147.1168 43000.0 149.0962 35000.0 151.0754 96000.0 151.1115 12000.0 153.091 12000.0 153.1283 2900.0 155.0855 23000.0 156.0935 12000.0 157.1012 150000.0 158.1098 2600.0 159.0804 16000.0 159.1169 94000.0 160.126 3700.0 161.0962 54000.0 161.1327 77000.0 163.1118 110000.0 165.0783 11000.0 165.0912 870000.0 165.1251 2800.0 167.1073 3300.0 168.052 2500.0 168.0932 4700.0 169.1013 57000.0 170.1086 12000.0 171.117 130000.0 173.0963 42000.0 173.1328 45000.0 173.5271 34000.0 173.5407 30000.0 174.1037 2800.0 175.1118 20000.0 175.1482 33000.0 177.091 21000.0 177.128 21000.0 179.1068 9600.0 179.1241 2400.0 179.1429 13000.0 181.1018 20000.0 181.1225 55000.0 182.1094 3300.0 183.1171 120000.0 185.0961 5700.0 185.1328 100000.0 187.1121 23000.0 187.1482 36000.0 187.7612 2600.0 189.1276 51000.0 191.0884 3500.0 191.1069 57000.0 191.1425 17000.0 193.1021 8300.0 194.1092 3000.0 195.1169 41000.0 195.1382 20000.0 196.1244 12000.0 197.1327 58000.0 198.1405 2500.0 198.6922 2500.0 199.1121 21000.0 199.1484 17000.0 201.128 17000.0 201.1641 3100.0 203.1433 350000.0 203.1648 4400.0 205.1207 3300.0 207.1177 15000.0 207.1385 62000.0 208.1248 5200.0 209.1328 57000.0 211.1127 16000.0 211.1485 75000.0 212.1179 2400.0 213.128 21000.0 213.163 2700.0 215.1433 20000.0 217.158 5800.0 219.1389 3600.0 221.1338 26000.0 221.1539 850000.0 223.1121 2800.0 223.1484 26000.0 225.1277 17000.0 225.1642 21000.0 225.2357 2600.0 227.1434 18000.0 227.1796 12000.0 229.1226 10000.0 229.1586 34000.0 231.138 24000.0 233.1317 9400.0 233.1544 20000.0 234.1623 8300.0 235.1483 16000.0 236.1551 3500.0 237.1273 3800.0 237.1643 17000.0 239.1433 15000.0 239.1792 11000.0 243.14 6900.0 243.173 6800.0 245.1544 6400.0 247.1431 10000.0 247.1695 190000.0 248.1546 2600.0 249.1634 11000.0 251.1434 9300.0 251.179 7900.0 253.1587 7600.0 255.1382 5300.0 255.1761 3000.0 257.1547 11000.0 260.1534 2900.0 261.1609 8300.0 261.1872 6900.0 262.6438 2500.0 263.1784 20000.0 265.1578 6700.0 265.1963 7200.0 267.1743 3400.0 269.1534 2500.0 269.1903 20000.0 271.1712 13000.0 272.1773 6600.0 275.1799 5100.0 277.1962 6300.0 281.19 18000.0 283.1698 3600.0 285.1863 20000.0 286.1931 31000.0 287.2011 140000.0 289.1945 10000.0 291.1743 3900.0 293.19 13000.0 295.2064 7300.0 298.1926 9800.0 299.2013 49000.0 301.2169 3300.0 302.3251 2400.0 307.2062 3400.0 309.1848 5000.0 311.201 29000.0 312.2093 10000.0 313.2168 40000.0 324.2104 7400.0 325.2159 21000.0 327.2324 48000.0 335.2 5900.0 363.2316 2900.0 365.2477 38000.0 373.2521 6600.0 391.2117 2600.0 391.263 37000.0 405.0207 2900.0 413.2684 45000.0 419.295 40000.0 427.2843 92000.0 453.3002 19000.0 507.3506 9600.0 512.2527 2800.0 517.216 2600.0 519.3458 31000.0 527.0642 2700.0 545.0072 2500.0 581.399 5700.0 599.4094 26000.0 599.5038 3800.0 END IONS BEGIN IONS SCANS=853 PEPMASS=234.0973 CHARGE=1 COLLISION_ENERGY=0.0 43.0486 2200.0 43.4549 2000.0 43.5703 4200.0 43.6985 2100.0 44.2711 2300.0 44.9535 2200.0 45.0333 990000.0 45.1681 2200.0 45.337 2400.0 45.558 2800.0 45.6758 2300.0 46.0439 2400.0 47.3794 2700.0 48.0995 2600.0 50.0204 2800.0 50.8281 2100.0 51.0936 2100.0 51.1655 2200.0 51.8096 2300.0 52.0425 2400.0 52.0857 2500.0 52.4184 2100.0 52.7703 2300.0 53.0005 2300.0 53.045 2500.0 53.0502 2100.0 54.0852 2500.0 54.7347 2800.0 55.2201 2300.0 56.8061 2300.0 57.8555 2700.0 58.9757 2400.0 59.9872 2500.0 60.1293 2300.0 60.8268 2000.0 61.5923 2500.0 61.6895 2400.0 62.3602 2400.0 63.8582 2000.0 66.1895 2400.0 66.2393 2400.0 66.5204 2500.0 66.69 2100.0 66.8876 2400.0 67.1196 2400.0 67.2912 2500.0 67.4524 2200.0 67.7277 2400.0 68.0607 2500.0 68.2827 2700.0 68.4055 2100.0 68.791 2200.0 70.0649 82000.0 70.6443 2200.0 70.713 2100.0 71.8841 2300.0 72.6547 2400.0 72.7682 2400.0 72.9736 2200.0 73.0283 12000000.0 73.0351 20000.0 73.0353 9500.0 73.0379 4100.0 73.408 2200.0 76.6288 2400.0 77.1065 3100.0 77.929 2200.0 78.5417 2400.0 78.6268 2400.0 78.65 2300.0 78.818 2600.0 78.8956 2800.0 79.1328 2300.0 79.4824 2200.0 79.9686 2100.0 80.2132 2400.0 80.5634 2400.0 81.1706 2600.0 81.9889 2300.0 82.2332 2400.0 82.7117 2700.0 83.0922 2400.0 84.1186 2700.0 85.4515 2500.0 86.2875 2300.0 86.4427 2100.0 87.4483 2400.0 87.5292 2400.0 88.0752 5300.0 88.0989 2600.0 88.3001 2800.0 88.4454 2400.0 90.0288 2300.0 90.0557 2200.0 90.5152 2900.0 90.5632 2400.0 91.0574 2800.0 91.0753 2500.0 92.797 2300.0 93.5966 2400.0 95.2076 2200.0 95.6456 2500.0 98.8457 2300.0 98.8701 2200.0 101.4513 2200.0 103.4077 2400.0 103.989 2400.0 104.8282 2300.0 105.2384 2100.0 108.0557 2400.0 108.1604 2600.0 108.7373 2300.0 109.8841 2700.0 111.0582 2400.0 111.7187 2400.0 112.4897 2300.0 114.0911 47000.0 114.1665 2400.0 115.1837 2400.0 116.0703 340000.0 118.048 2600.0 118.1953 2500.0 118.9482 2200.0 120.1578 2200.0 120.5504 2400.0 121.3823 2700.0 121.6779 2300.0 123.0906 2300.0 125.1898 2500.0 125.3704 2300.0 127.1017 2500.0 127.4138 2400.0 129.275 2300.0 133.3313 2600.0 135.1661 2300.0 136.9979 2400.0 137.2906 2600.0 138.1629 2400.0 139.7137 2300.0 140.8808 2400.0 140.9544 2400.0 141.0175 2500.0 142.1369 2600.0 142.2185 2600.0 142.8779 2300.0 147.2 2600.0 149.6884 5700.0 149.6992 3600.0 149.7192 2600.0 151.0751 46000.0 152.0785 100000.0 155.8563 2200.0 157.7961 2500.0 162.3478 2500.0 164.9929 2200.0 168.3019 2300.0 170.0709 2500.0 171.5229 2200.0 173.4452 2800.0 173.5038 4300.0 173.5184 6100.0 173.5266 270000.0 173.541 220000.0 173.5701 4600.0 173.6608 2400.0 175.6172 2400.0 177.5785 2800.0 178.202 2500.0 178.892 2500.0 179.2704 2400.0 181.1216 2600.0 182.0463 2600.0 185.126 2300.0 187.8844 2500.0 188.0916 300000.0 189.2927 2600.0 190.3435 2400.0 190.7096 2500.0 191.8577 2200.0 192.0576 2200.0 193.7045 2400.0 194.8505 2800.0 196.1325 2600.0 202.4616 2300.0 204.0922 2200.0 204.791 2600.0 209.3129 2400.0 213.6014 2300.0 214.4439 2400.0 220.0561 2400.0 221.7136 2200.0 223.5273 2400.0 224.7023 2500.0 226.2804 2400.0 226.5024 2500.0 228.4837 2400.0 234.1864 2300.0 234.2211 30000.0 239.28 2500.0 243.787 2900.0 END IONS BEGIN IONS SCANS=854 PEPMASS=341.1385 CHARGE=1 COLLISION_ENERGY=0.0 55.0177 3900.0 55.0752 2700.0 55.3838 2100.0 57.069 2100.0 61.6717 2200.0 64.8917 2500.0 69.8435 2200.0 72.1129 2200.0 73.5907 2200.0 77.0386 2500.0 78.4698 2400.0 79.0539 14000.0 81.0334 3200.0 81.069 2300.0 86.0598 6900.0 91.0538 14000.0 93.7577 2500.0 95.0488 17000.0 95.0847 2500.0 96.6099 2400.0 99.7101 2200.0 103.0539 18000.0 105.0696 39000.0 106.041 2800.0 107.049 21000.0 109.0647 2600.0 110.9546 2600.0 115.0542 3900.0 117.0695 6800.0 119.0491 8600.0 121.0646 25000.0 121.909 2500.0 123.0437 23000.0 124.1235 2500.0 125.003 3100.0 129.0698 6900.0 131.0489 170000.0 133.054 4300.0 133.0646 230000.0 133.0764 5200.0 134.036 63000.0 135.0438 1100000.0 135.056 5300.0 137.0592 15000.0 143.0491 4800.0 143.085 8700.0 145.0644 41000.0 149.0462 2800.0 149.0595 160000.0 151.9119 2300.0 157.0646 14000.0 159.0441 3900.0 159.081 3400.0 160.0514 8700.0 161.0369 3200.0 161.0596 180000.0 161.0752 2500.0 163.0749 12000.0 169.0648 4800.0 171.0803 20000.0 173.0598 50000.0 173.5254 26000.0 173.5413 8100.0 174.066 3600.0 175.0755 11000.0 182.5873 3200.0 185.0594 12000.0 186.0675 15000.0 187.0753 56000.0 197.06 9900.0 199.0759 3500.0 201.0914 20000.0 203.0705 4200.0 207.0806 3100.0 207.1163 3400.0 209.0608 2600.0 209.0975 3300.0 211.076 3100.0 213.0925 3000.0 217.1027 3300.0 221.0976 3600.0 227.0694 3100.0 229.0861 13000.0 232.5334 3000.0 235.1127 17000.0 245.0971 6900.0 247.1112 2800.0 248.0836 2700.0 255.2136 2500.0 263.1068 11000.0 293.1168 5700.0 308.1059 20000.0 319.6915 2800.0 323.1286 20000.0 326.1161 23000.0 341.1394 120000.0 341.2833 3400.0 345.7422 2500.0 END IONS BEGIN IONS SCANS=855 PEPMASS=323.1282 CHARGE=1 COLLISION_ENERGY=0.0 51.0233 8000.0 53.0388 4400.0 55.0178 24000.0 55.3875 2300.0 56.8251 2500.0 66.6896 2500.0 69.0339 3000.0 69.2725 2500.0 71.9894 2500.0 73.0284 3200.0 76.9309 2700.0 77.0388 14000.0 79.054 49000.0 80.7791 2500.0 81.0333 3100.0 91.054 53000.0 93.0698 14000.0 95.0489 26000.0 103.054 150000.0 104.3586 2400.0 105.0332 12000.0 105.0446 4600.0 105.0697 230000.0 105.0767 2100.0 105.0781 3400.0 107.049 100000.0 115.0542 32000.0 117.0697 29000.0 119.0489 38000.0 120.0572 3500.0 121.0646 200000.0 123.0803 5500.0 128.0622 12000.0 129.0698 16000.0 131.0489 1200000.0 131.0581 6700.0 131.0608 3100.0 132.0568 18000.0 133.0646 1700000.0 133.0743 8400.0 135.0439 3400000.0 135.0536 18000.0 135.0632 13000.0 135.0679 21000.0 135.0751 3700.0 135.0815 4600.0 137.0598 16000.0 141.0692 2800.0 143.049 62000.0 143.0853 25000.0 144.0567 8700.0 145.0646 210000.0 148.0517 10000.0 149.0457 4600.0 149.0595 540000.0 149.0704 2500.0 151.0751 4600.0 156.0883 2300.0 157.0646 88000.0 159.044 28000.0 159.0809 2500.0 160.0518 62000.0 161.0595 1300000.0 161.0727 12000.0 163.0753 48000.0 169.0645 13000.0 171.0443 4800.0 171.0804 65000.0 172.052 12000.0 173.0597 220000.0 173.5254 21000.0 173.5425 15000.0 174.0675 14000.0 175.0754 47000.0 179.0855 3600.0 181.0656 3200.0 182.0734 2700.0 184.8954 2700.0 185.0598 110000.0 186.0676 130000.0 187.0754 170000.0 194.0741 3300.0 195.08 3400.0 199.0751 16000.0 201.091 47000.0 202.0783 8900.0 207.0805 14000.0 207.1169 24000.0 215.0858 2600.0 217.1011 39000.0 219.0804 3000.0 220.0883 27000.0 221.0968 8600.0 223.0749 3900.0 233.0964 14000.0 235.0744 8800.0 235.1119 150000.0 241.0826 3000.0 245.0961 81000.0 247.1112 4000.0 248.0832 36000.0 251.069 2900.0 261.0923 8500.0 263.1065 150000.0 265.0873 4600.0 265.122 9200.0 275.1065 4900.0 278.0945 17000.0 291.1006 4800.0 291.8394 2500.0 293.1175 86000.0 296.8578 2700.0 308.1046 240000.0 323.082 3000.0 323.1283 380000.0 326.1166 3100.0 END IONS BEGIN IONS SCANS=856 PEPMASS=653.297 CHARGE=1 COLLISION_ENERGY=0.0 67.4783 4400.0 70.5864 23000.0 70.589 9300.0 86.9937 3600.0 94.6703 3800.0 130.6677 3000.0 141.5775 3400.0 147.7201 6300.0 173.5193 17000.0 173.5372 100000.0 237.8998 7400.0 357.145 3700.0 368.1756 5300.0 405.2114 11000.0 407.2232 130000.0 412.1648 4800.0 416.2313 21000.0 420.2307 100000.0 421.2385 310000.0 422.2464 340000.0 428.2321 4200.0 433.2388 45000.0 434.2446 6600.0 435.2536 23000.0 446.2452 4000.0 447.2576 6200.0 448.2614 130000.0 449.2281 15000.0 449.2715 25000.0 450.2772 130000.0 451.2128 140000.0 452.2182 9100.0 459.2522 6000.0 461.234 40000.0 465.1519 6600.0 465.2282 660000.0 466.2352 110000.0 467.2549 3200.0 474.2399 4800.0 475.2183 28000.0 475.2472 21000.0 476.2548 47000.0 478.2357 7500.0 479.2444 30000.0 487.2114 42000.0 488.2194 29000.0 489.2275 22000.0 491.208 85000.0 492.2171 200000.0 493.2188 8800.0 493.2571 24000.0 494.2661 4900.0 501.2283 140000.0 501.3081 11000.0 502.2354 64000.0 503.2436 1000000.0 503.3333 6000.0 504.2474 490000.0 505.2238 28000.0 507.2732 39000.0 515.2191 7700.0 519.2544 4700.0 520.256 9700.0 520.2709 6700.0 521.29 560000.0 522.2978 350000.0 530.2306 26000.0 532.2593 8400.0 534.229 75000.0 535.2781 9500.0 537.2494 150000.0 538.2592 13000.0 547.2593 100000.0 548.2707 36000.0 549.2856 1500000.0 550.2897 210000.0 551.2651 330000.0 557.2565 8200.0 559.267 14000.0 564.2721 24000.0 565.2794 280000.0 566.2885 2100000.0 574.2587 5700.0 575.2653 850000.0 576.2724 220000.0 577.2805 29000.0 578.2461 5800.0 579.2771 28000.0 581.2874 7000.0 589.2535 16000.0 591.2966 21000.0 593.2756 720000.0 594.2801 230000.0 601.1774 7900.0 603.2597 39000.0 607.2903 370000.0 609.3064 240000.0 617.2759 42000.0 620.2632 4000.0 623.249 4300.0 635.2861 730000.0 635.406 16000.0 638.2684 6100.0 653.2961 210000.0 653.4182 7300.0 END IONS BEGIN IONS SCANS=857 PEPMASS=652.2897 CHARGE=1 COLLISION_ENERGY=0.0 72.0853 2300.0 102.2465 2500.0 151.2885 2200.0 173.538 24000.0 222.864 3100.0 259.7971 2600.0 348.6403 2800.0 406.2151 2900.0 420.2293 8100.0 421.24 4100.0 447.2571 3200.0 449.2682 5700.0 475.2473 11000.0 488.2211 8600.0 491.2067 3400.0 492.2162 10000.0 501.2282 4200.0 503.2432 560000.0 505.2266 8400.0 521.2877 16000.0 537.2479 7500.0 547.2662 4200.0 549.187 4700.0 549.2854 170000.0 565.2802 87000.0 575.264 5900.0 593.2753 210000.0 END IONS BEGIN IONS SCANS=858 PEPMASS=870.5657 CHARGE=1 COLLISION_ENERGY=0.0 117.8971 2300.0 127.0554 2300.0 173.5193 7100.0 173.5276 22000.0 173.5383 32000.0 221.4857 2600.0 287.385 2400.0 434.2449 3300.0 447.2537 3200.0 448.7699 2800.0 459.218 270000.0 460.2258 130000.0 461.2328 28000.0 473.2344 4300.0 486.2393 8200.0 487.2166 12000.0 487.2443 2800.0 488.254 13000.0 489.2374 3800.0 491.2437 28000.0 492.2518 92000.0 501.228 6400.0 503.2443 33000.0 505.2245 44000.0 506.275 3100.0 515.2461 12000.0 516.2517 35000.0 517.2267 18000.0 518.2319 4900.0 519.1458 5500.0 519.2392 320000.0 519.3324 4600.0 520.2476 83000.0 531.1461 4800.0 531.2389 410000.0 532.2467 54000.0 533.1626 5900.0 533.2546 370000.0 548.2771 32000.0 549.2483 8100.0 559.2337 21000.0 560.2414 64000.0 562.2153 4000.0 563.2604 4700.0 564.2759 4400.0 577.2453 39000.0 591.2608 200000.0 592.1579 4600.0 592.268 520000.0 593.2757 51000.0 625.4969 3300.0 838.5188 4200.0 838.54 5700.0 855.5471 3900.0 870.5662 40000.0 END IONS BEGIN IONS SCANS=859 PEPMASS=871.5726 CHARGE=1 COLLISION_ENERGY=0.0 76.5967 2800.0 78.2813 2600.0 79.318 2900.0 83.0851 18000.0 83.2026 3200.0 86.0344 2400.0 90.3064 2600.0 96.8407 9800.0 97.1008 17000.0 99.8987 2400.0 104.5295 2600.0 107.1317 2600.0 110.0171 2300.0 113.2686 2400.0 119.3253 2600.0 129.9708 2800.0 133.3089 12000.0 133.3182 13000.0 135.9726 2400.0 139.3855 3200.0 148.0608 8800.0 148.0726 4400.0 148.3123 9500.0 148.3255 25000.0 155.7028 2900.0 157.2782 2600.0 158.0006 2400.0 161.6117 2800.0 165.0796 3000.0 173.5266 110000.0 173.5423 52000.0 194.2691 3100.0 215.1328 3000.0 225.8965 2500.0 242.5596 2600.0 259.9907 3200.0 260.9164 2800.0 263.261 2700.0 296.361 2700.0 310.0641 2900.0 322.713 2400.0 328.8342 3100.0 407.2365 2700.0 431.1868 9500.0 433.2405 28000.0 434.2466 3100.0 445.2024 13000.0 446.2087 7400.0 447.2112 18000.0 456.0517 2600.0 459.1576 2600.0 459.2179 830000.0 460.1504 5000.0 460.2236 660000.0 461.231 300000.0 462.2376 36000.0 473.233 62000.0 474.24 10000.0 475.2493 2700.0 476.2549 24000.0 477.2544 3700.0 486.24 4200.0 487.2459 59000.0 488.2156 15000.0 488.2412 2300.0 488.2606 7200.0 489.2291 2700.0 489.256 19000.0 490.2619 3200.0 491.2431 120000.0 492.251 280000.0 493.2543 110000.0 501.2299 3500.0 502.2248 3200.0 503.2426 36000.0 504.2463 52000.0 505.2245 160000.0 506.2287 55000.0 515.2425 47000.0 516.25 43000.0 517.2391 69000.0 518.2291 47000.0 519.149 9000.0 519.2387 560000.0 520.1528 7600.0 520.2437 590000.0 521.2507 96000.0 531.2385 310000.0 532.2435 670000.0 532.3365 14000.0 533.0117 5100.0 533.0661 45000.0 533.2542 8800000.0 533.401 17000.0 533.4455 20000.0 534.2579 450000.0 546.243 2600.0 547.2709 29000.0 548.2771 61000.0 549.2564 7800.0 549.2706 50000.0 550.2537 18000.0 551.2617 2900.0 555.0651 2800.0 559.2373 11000.0 560.2412 220000.0 561.2476 200000.0 563.2313 22000.0 564.2495 95000.0 565.2799 170000.0 573.7711 2600.0 575.2649 74000.0 577.2445 160000.0 578.2503 80000.0 579.2494 3500.0 591.2602 170000.0 592.0477 33000.0 592.2676 5900000.0 592.4393 5000.0 592.491 11000.0 593.0533 84000.0 593.0972 46000.0 593.2752 13000000.0 593.4525 49000.0 593.499 88000.0 594.2787 45000.0 667.9307 2800.0 713.0066 2600.0 804.9289 3100.0 811.5564 14000.0 821.7227 3200.0 839.5339 6400.0 856.549 3200.0 871.5707 440000.0 END IONS BEGIN IONS SCANS=860 PEPMASS=610.6251 CHARGE=1 COLLISION_ENERGY=0.0 65.3032 2200.0 67.5251 2500.0 70.2853 2400.0 70.5353 2100.0 71.8035 2300.0 72.2232 2300.0 72.3739 2200.0 73.4896 2500.0 73.7188 2300.0 75.8 2500.0 75.9592 2300.0 79.4149 2300.0 81.2636 2500.0 81.8775 2300.0 82.6897 2400.0 84.1779 2500.0 86.194 2600.0 86.3926 2300.0 94.8892 2400.0 96.5846 2100.0 101.0184 2300.0 102.0772 2200.0 102.9965 2100.0 103.766 2400.0 104.3724 2300.0 105.7691 2600.0 105.9982 2100.0 106.275 2400.0 107.0591 2100.0 107.9136 2700.0 108.2279 2400.0 109.3833 2400.0 111.6054 2300.0 111.769 2900.0 112.7308 2600.0 112.8624 2700.0 115.0459 2500.0 116.1698 2300.0 120.3053 2600.0 121.3555 2400.0 124.0865 2800.0 125.0708 2600.0 128.8136 2500.0 129.7524 2200.0 130.346 2400.0 135.0901 2900.0 138.3564 2700.0 142.7481 2400.0 145.1729 2300.0 145.4664 2200.0 146.5238 2700.0 147.6664 2200.0 149.6877 14000.0 149.6961 3500.0 151.3288 2500.0 158.8325 3100.0 170.2855 2500.0 173.5224 24000.0 173.531 220000.0 173.5424 46000.0 179.6403 2300.0 209.7989 2200.0 215.8631 2500.0 221.6458 2300.0 223.3222 2700.0 225.4226 2500.0 226.3603 2400.0 245.1218 2700.0 249.4484 2800.0 255.3085 2600.0 274.5496 2600.0 275.2386 2300.0 281.2954 540000.0 282.2427 29000.0 282.2792 2300000.0 282.3162 23000.0 283.2865 2800.0 283.9033 2900.0 299.3058 520000.0 303.5646 2400.0 309.2882 10000.0 309.3267 570000.0 309.363 3600.0 310.2675 15000.0 310.2793 4400.0 310.3106 2300000.0 310.3518 13000.0 310.3703 3700.0 320.6311 2500.0 327.3369 470000.0 333.4936 2700.0 381.7379 2500.0 396.5428 2300.0 559.7508 2600.0 565.5683 6400.0 571.3445 2500.0 589.4516 2900.0 594.0964 2600.0 595.0941 2600.0 610.3439 8800.0 END IONS BEGIN IONS SCANS=861 PEPMASS=659.2843 CHARGE=1 COLLISION_ENERGY=0.0 66.5827 5200.0 66.5868 4600.0 69.6933 3400.0 69.6968 2900.0 73.2511 7100.0 73.2561 5900.0 89.0594 7900.0 133.0856 3500.0 173.5222 12000.0 173.5406 20000.0 288.7334 2500.0 293.6254 2300.0 482.2053 3700.0 483.2175 5600.0 498.2 3600.0 499.2131 7500.0 500.2194 3300.0 508.1897 4800.0 510.2393 5400.0 517.2205 5700.0 521.1926 13000.0 522.1987 4400.0 526.1959 10000.0 536.2155 6400.0 537.2252 71000.0 539.2046 19000.0 540.212 9200.0 541.2164 6700.0 543.2776 3400.0 555.2646 9000.0 559.2677 7200.0 561.2877 4400.0 581.233 8400.0 583.2675 44000.0 587.2651 7800.0 599.2621 190000.0 599.3742 5500.0 600.27 41000.0 601.2759 5700.0 609.2471 41000.0 615.2922 21000.0 619.2889 9800.0 627.2569 160000.0 628.2676 4500.0 641.273 83000.0 642.2748 3600.0 659.2833 330000.0 END IONS BEGIN IONS SCANS=862 PEPMASS=637.3014 CHARGE=1 COLLISION_ENERGY=0.0 65.2507 190000.0 65.2539 32000.0 68.8093 130000.0 68.8125 24000.0 70.8108 58000.0 70.8133 8300.0 76.4578 9200.0 82.5793 10000.0 87.1572 9500.0 89.5212 9400.0 90.1865 7100.0 100.6543 5800.0 139.8112 52000.0 139.8239 45000.0 140.0998 8600.0 140.4849 12000.0 147.2643 8700.0 172.3585 7000.0 173.5203 24000.0 173.5283 120000.0 173.5395 110000.0 173.5471 9000.0 239.1552 7900.0 247.442 5500.0 256.5115 7400.0 304.2236 8000.0 316.0206 7100.0 334.3954 7400.0 406.2146 23000.0 407.2235 250000.0 420.2311 120000.0 421.2373 400000.0 422.2467 350000.0 429.2057 24000.0 430.2216 14000.0 433.2393 37000.0 434.2445 72000.0 435.2524 51000.0 443.2198 12000.0 443.2307 7100.0 444.2309 81000.0 445.245 10000.0 447.2482 10000.0 448.2158 9800.0 448.2631 65000.0 449.2663 65000.0 450.2266 9400.0 450.2792 33000.0 453.2233 30000.0 457.2383 76000.0 458.2459 150000.0 459.2185 1200000.0 460.2247 130000.0 461.229 100000.0 462.2051 10000.0 463.212 71000.0 472.2262 280000.0 473.2337 2300000.0 474.2386 32000.0 475.2169 220000.0 476.2184 610000.0 477.2271 270000.0 478.2324 280000.0 485.2335 990000.0 486.2091 350000.0 487.247 260000.0 488.2233 64000.0 489.2274 130000.0 490.2336 52000.0 491.2441 35000.0 492.2512 37000.0 493.2543 94000.0 497.2345 56000.0 499.2133 570000.0 500.2213 140000.0 501.2278 39000.0 502.2356 120000.0 503.2435 1200000.0 504.246 740000.0 505.2256 95000.0 513.2287 590000.0 514.2364 240000.0 515.2444 720000.0 515.3282 16000.0 517.2251 330000.0 518.2304 140000.0 519.2389 140000.0 521.2196 45000.0 521.2844 14000.0 522.2217 130000.0 522.2986 92000.0 530.2338 21000.0 531.2443 930000.0 532.2448 53000.0 533.2534 8000.0 535.2623 26000.0 536.2391 110000.0 537.2439 62000.0 541.224 120000.0 543.2756 220000.0 544.2488 56000.0 545.2559 53000.0 547.2698 14000.0 548.2775 14000.0 549.2853 1300000.0 550.2892 1200000.0 559.0069 22000.0 559.0651 170000.0 559.2705 27000000.0 559.4288 38000.0 559.4772 110000.0 560.2753 77000.0 561.2849 86000.0 562.2539 13000.0 563.2682 51000.0 572.2411 47000.0 573.2514 12000.0 575.2657 58000.0 576.2729 190000.0 577.2795 350000.0 578.1819 13000.0 578.2865 890000.0 587.1826 25000.0 587.2658 5500000.0 591.2891 450000.0 605.2762 520000.0 609.2837 89000.0 619.2916 3700000.0 622.2753 44000.0 637.3025 1300000.0 END IONS BEGIN IONS SCANS=863 PEPMASS=636.2951 CHARGE=1 COLLISION_ENERGY=0.0 78.3759 2600.0 81.2896 2200.0 84.6031 2400.0 85.4538 2300.0 87.0436 10000.0 89.4551 2300.0 110.6308 2600.0 111.1917 2200.0 147.9388 2700.0 152.8977 2400.0 153.1293 2400.0 161.4364 2400.0 162.5115 2500.0 171.4568 2700.0 173.5192 8800.0 173.5366 86000.0 178.5023 2300.0 189.6493 2800.0 192.8577 2400.0 270.8943 2500.0 283.4525 2800.0 291.6269 2400.0 304.7704 2600.0 413.8291 2400.0 420.2308 100000.0 421.2384 9300.0 433.2388 21000.0 434.2482 13000.0 447.2179 16000.0 448.2612 28000.0 449.2332 24000.0 452.2201 29000.0 458.2463 6700.0 459.2185 15000.0 460.2253 40000.0 462.2041 17000.0 463.2067 2800.0 463.2185 3000.0 465.2286 3500.0 474.2416 31000.0 475.2129 230000.0 476.2203 60000.0 477.2281 130000.0 485.2356 2400.0 487.2112 6400.0 488.2206 6500.0 489.2297 12000.0 492.2513 47000.0 493.2231 4400.0 499.2044 3300.0 501.2248 11000.0 502.2362 86000.0 503.2436 310000.0 503.3321 2700.0 513.2292 6300.0 516.2184 3100.0 517.2208 15000.0 518.231 9700.0 521.2184 65000.0 530.2336 4100.0 535.2342 41000.0 536.2418 33000.0 548.2773 16000.0 549.2856 510000.0 559.267 2800.0 561.2506 6400.0 563.2675 5400.0 575.2666 9200.0 576.272 43000.0 577.281 200000.0 577.384 5500.0 586.2573 15000.0 611.1716 3300.0 621.2695 3600.0 636.285 6200.0 636.3015 3400.0 END IONS BEGIN IONS SCANS=864 PEPMASS=341.1386 CHARGE=1 COLLISION_ENERGY=0.0 51.0233 2600.0 51.7051 2600.0 55.0177 19000.0 55.2074 2500.0 55.7713 2400.0 59.5542 2500.0 69.0329 2300.0 77.0387 16000.0 77.8153 2300.0 79.054 43000.0 81.0331 9600.0 81.0696 10000.0 83.6819 2400.0 85.4748 2600.0 86.0597 11000.0 91.0539 34000.0 92.5178 2600.0 93.0698 10000.0 95.0488 47000.0 95.8603 2500.0 98.5491 2200.0 100.7132 2500.0 103.0539 72000.0 105.033 16000.0 105.0449 4100.0 105.0696 120000.0 106.0411 7000.0 107.0488 67000.0 108.3031 2400.0 109.0643 7000.0 111.0795 3200.0 115.0543 17000.0 117.0695 29000.0 119.0489 20000.0 121.0281 10000.0 121.0646 74000.0 123.0437 62000.0 125.0487 2200.0 128.0618 4200.0 128.6954 2500.0 129.0697 25000.0 130.0777 2800.0 131.0489 520000.0 131.0852 3100.0 132.0566 3800.0 133.0646 630000.0 133.0758 6900.0 133.1016 2600.0 134.036 170000.0 135.0439 3200000.0 135.0537 25000.0 135.0677 37000.0 135.0753 3400.0 135.0814 2800.0 136.8185 2500.0 137.0593 32000.0 137.2727 2600.0 143.049 16000.0 143.0851 29000.0 144.057 6400.0 145.0645 110000.0 148.0522 10000.0 149.0595 490000.0 157.0647 54000.0 159.0439 20000.0 159.0805 9500.0 160.0518 30000.0 161.0438 11000.0 161.0596 510000.0 161.0746 13000.0 161.0931 2200.0 163.0754 43000.0 165.0545 2500.0 169.0648 14000.0 171.0804 56000.0 173.0597 130000.0 173.5244 18000.0 173.536 35000.0 173.5432 4500.0 174.0668 25000.0 175.0754 44000.0 179.0859 2600.0 181.0647 6700.0 183.0796 8500.0 185.0596 41000.0 186.0674 50000.0 187.0753 160000.0 195.0805 4200.0 197.0595 31000.0 197.0943 3500.0 199.0754 14000.0 201.0909 56000.0 203.07 28000.0 204.6718 2900.0 207.0806 9600.0 207.1168 8600.0 209.0601 3300.0 211.0754 7500.0 212.7321 2600.0 213.0909 5000.0 217.1019 17000.0 220.0886 13000.0 221.0955 10000.0 222.8655 2600.0 223.0752 7800.0 225.0925 5500.0 227.0696 12000.0 229.086 38000.0 235.1117 54000.0 245.0958 31000.0 247.1111 7300.0 248.0829 8000.0 263.1064 50000.0 265.0862 2700.0 265.1198 4900.0 275.1039 3000.0 278.0931 3100.0 293.1166 29000.0 295.1343 3500.0 308.1049 51000.0 323.128 47000.0 326.1152 100000.0 341.1383 370000.0 341.1854 5000.0 347.0853 2500.0 END IONS BEGIN IONS SCANS=865 PEPMASS=323.1282 CHARGE=1 COLLISION_ENERGY=0.0 49.1179 2400.0 51.0234 15000.0 52.561 2200.0 53.0387 3600.0 53.2755 2200.0 55.0178 88000.0 57.6996 2500.0 61.031 2300.0 61.0556 4800.0 62.8005 2900.0 62.9767 2100.0 65.0387 4500.0 68.1439 3100.0 69.0336 2300.0 73.0284 3000.0 75.7381 2600.0 76.2307 2700.0 77.0389 39000.0 79.0541 160000.0 79.1002 2500.0 81.07 2600.0 82.4005 3300.0 82.6226 2600.0 83.3208 2700.0 84.8552 2400.0 88.2431 2500.0 91.0541 160000.0 92.4192 2900.0 93.0698 50000.0 95.049 91000.0 99.49 2700.0 103.054 480000.0 105.0335 38000.0 105.0443 21000.0 105.0697 730000.0 105.0758 4100.0 107.049 320000.0 111.4895 4900.0 115.0542 94000.0 117.0698 120000.0 119.049 120000.0 120.057 5200.0 121.0646 640000.0 122.6093 2400.0 123.0436 7100.0 123.0805 23000.0 128.0619 27000.0 129.0697 72000.0 131.0261 5500.0 131.049 3800000.0 131.0595 55000.0 132.0567 44000.0 133.0647 5400000.0 133.0745 24000.0 133.0901 16000.0 135.0212 37000.0 135.0315 2200.0 135.0439 11000000.0 135.053 36000.0 135.0679 96000.0 136.0521 4100.0 137.0596 50000.0 139.814 3600.0 141.0702 11000.0 143.049 210000.0 143.0854 81000.0 144.057 23000.0 145.0515 3200.0 145.0646 660000.0 147.8355 5100.0 148.0518 29000.0 149.046 9600.0 149.0596 1800000.0 149.071 2700.0 149.0722 13000.0 150.3292 2400.0 151.0752 27000.0 152.5498 2000.0 153.0695 12000.0 156.0572 5300.0 157.0647 280000.0 159.0438 100000.0 160.0519 200000.0 161.0191 2700.0 161.0294 5600.0 161.0438 7600.0 161.0596 4300000.0 161.073 14000.0 161.0912 19000.0 162.0681 5900.0 163.0754 170000.0 164.0326 2300.0 164.6451 2600.0 169.065 51000.0 171.0442 21000.0 171.0804 210000.0 172.0518 35000.0 173.0598 640000.0 173.5212 11000.0 173.5301 120000.0 173.5442 6800.0 174.0677 40000.0 175.0755 140000.0 179.0852 3500.0 185.0597 340000.0 186.0676 430000.0 187.0593 6700.0 187.0754 530000.0 192.094 14000.0 193.064 5500.0 193.1029 3300.0 193.4975 2400.0 194.073 13000.0 199.0759 42000.0 201.091 150000.0 202.078 25000.0 207.0807 61000.0 207.117 58000.0 210.2138 2500.0 217.1013 160000.0 217.8663 2700.0 219.0804 19000.0 220.0884 90000.0 221.0962 33000.0 223.0776 4400.0 227.5196 2500.0 229.1013 4000.0 231.081 3000.0 233.0963 46000.0 234.673 2500.0 235.0739 11000.0 235.0781 40000.0 235.1119 480000.0 237.0917 3000.0 241.4535 2600.0 241.4717 2600.0 245.07 6200.0 245.0962 270000.0 247.0741 4400.0 247.112 23000.0 248.058 2800.0 248.0833 100000.0 251.1056 3700.0 261.0907 17000.0 263.1066 490000.0 264.0756 5400.0 265.0873 7100.0 265.1223 10000.0 265.7325 2400.0 275.107 34000.0 278.0942 54000.0 289.0864 2600.0 291.1016 2900.0 293.1174 270000.0 305.1187 3400.0 308.0716 4100.0 308.1047 770000.0 317.7413 3300.0 321.5409 2400.0 323.0817 4700.0 323.1283 1200000.0 323.1644 2600.0 323.1724 22000.0 323.192 6400.0 326.1145 11000.0 END IONS BEGIN IONS SCANS=866 PEPMASS=871.5724 CHARGE=1 COLLISION_ENERGY=0.0 77.5552 2700.0 83.0848 18000.0 85.1007 2300.0 88.3047 2300.0 91.9641 2100.0 93.5334 2400.0 95.8813 3400.0 96.8426 9200.0 97.5206 2400.0 113.8275 4200.0 117.2932 2300.0 133.3083 7100.0 133.3183 12000.0 143.3039 2200.0 148.0615 2800.0 148.0726 3200.0 148.3127 13000.0 148.3243 13000.0 157.0075 2500.0 173.5274 51000.0 173.5365 47000.0 177.1161 2300.0 206.5068 2900.0 218.5299 2700.0 221.7522 2400.0 257.198 3700.0 344.0567 3300.0 348.136 2100.0 431.1821 2900.0 433.2395 16000.0 434.2416 3300.0 445.2057 6900.0 447.2131 15000.0 459.2174 600000.0 460.2227 540000.0 461.2301 240000.0 462.2387 33000.0 473.2323 39000.0 474.239 7500.0 475.2451 4900.0 476.2546 14000.0 477.2481 3300.0 478.3554 3100.0 485.232 2800.0 486.2402 19000.0 487.2437 44000.0 488.2209 24000.0 488.2501 4200.0 489.2586 20000.0 489.2699 4100.0 491.2435 82000.0 492.2505 210000.0 493.2545 110000.0 501.2281 6700.0 503.2428 29000.0 504.2465 51000.0 505.2239 99000.0 506.2281 47000.0 515.241 30000.0 516.2488 41000.0 517.247 57000.0 518.229 32000.0 519.1479 7000.0 519.2383 460000.0 519.3285 4300.0 520.1119 3400.0 520.151 4700.0 520.2428 520000.0 521.249 91000.0 531.2381 320000.0 532.1483 8500.0 532.2427 610000.0 532.3362 3900.0 533.0142 3700.0 533.0659 8200.0 533.2538 5400000.0 533.3527 3600.0 533.4451 11000.0 534.257 410000.0 547.2716 23000.0 548.2784 51000.0 549.2684 40000.0 550.2522 13000.0 559.233 15000.0 560.2402 140000.0 561.2468 140000.0 562.2278 9600.0 563.2339 12000.0 564.2484 60000.0 565.279 100000.0 575.2523 3700.0 575.2647 38000.0 577.2448 100000.0 578.2487 73000.0 591.26 150000.0 592.0467 6900.0 592.2672 3700000.0 592.3811 3900.0 592.4902 8300.0 593.0535 46000.0 593.0961 11000.0 593.2748 7700000.0 593.4477 34000.0 593.499 50000.0 593.5624 7200.0 594.2756 29000.0 697.5482 4500.0 811.5534 12000.0 839.5442 15000.0 856.5468 5800.0 871.5705 290000.0 END IONS BEGIN IONS SCANS=867 PEPMASS=870.566 CHARGE=1 COLLISION_ENERGY=0.0 88.0185 2300.0 92.7004 2100.0 93.5066 2300.0 96.1774 2100.0 102.4121 2300.0 108.1365 2300.0 110.0206 2200.0 112.0323 2200.0 113.9509 2500.0 113.96 2300.0 133.5384 2400.0 140.1817 2400.0 148.0751 2300.0 173.526 6500.0 173.5378 27000.0 183.8424 2400.0 188.6861 2700.0 259.3507 2400.0 328.9689 2600.0 367.1147 2600.0 433.2387 12000.0 434.2465 2900.0 447.2579 6600.0 459.2175 620000.0 460.1506 4000.0 460.225 280000.0 461.233 55000.0 464.8045 2400.0 472.973 3100.0 473.1938 3000.0 473.2395 4400.0 474.2407 4300.0 475.2513 5300.0 485.2349 9000.0 486.2408 29000.0 487.2166 39000.0 488.2521 32000.0 489.2625 7500.0 489.2682 2700.0 491.2429 67000.0 492.2514 220000.0 501.23 18000.0 503.2439 81000.0 504.2465 2800.0 505.2235 110000.0 515.2431 20000.0 516.2511 72000.0 517.2252 33000.0 518.2298 15000.0 519.1467 5400.0 519.2386 730000.0 519.3316 7900.0 520.2471 190000.0 531.2384 870000.0 532.2462 120000.0 533.2541 790000.0 547.2688 7000.0 548.2775 72000.0 549.2491 22000.0 553.0486 2700.0 559.234 44000.0 560.2414 140000.0 562.2241 6500.0 563.2667 4800.0 564.2722 16000.0 574.2588 2900.0 575.2652 3400.0 577.2442 100000.0 591.2601 450000.0 592.2675 1200000.0 592.3806 5600.0 593.2753 75000.0 838.5373 21000.0 855.5398 9900.0 870.5637 88000.0 END IONS BEGIN IONS SCANS=868 PEPMASS=205.1954 CHARGE=1 COLLISION_ENERGY=0.0 41.0385 100000.0 43.0178 5200.0 43.0541 63000.0 44.09 2100.0 46.7352 2400.0 48.8283 2600.0 49.9027 2000.0 50.3496 2600.0 51.5205 2700.0 52.571 2500.0 53.0385 33000.0 53.4747 2400.0 54.5975 2600.0 55.054 510000.0 56.3135 2600.0 57.0697 130000.0 58.8938 2300.0 59.5185 2300.0 60.1506 2400.0 60.6211 2400.0 60.6432 2600.0 61.9648 2300.0 62.5948 2500.0 63.4634 2400.0 64.2583 2900.0 65.0385 6200.0 65.5267 2400.0 67.0539 350000.0 68.6448 2200.0 69.0001 2300.0 69.0696 750000.0 69.0738 4600.0 69.5099 2400.0 71.0852 17000.0 72.937 21000.0 73.6236 2400.0 74.6709 2200.0 75.5923 2300.0 77.0386 28000.0 78.3217 2600.0 79.0539 590000.0 79.0595 5400.0 79.4892 2500.0 79.776 2600.0 80.0618 2700.0 81.0696 2400000.0 81.076 20000.0 81.0783 12000.0 83.0852 120000.0 85.5513 2400.0 88.872 2200.0 90.9475 15000.0 91.0539 280000.0 93.0696 2900000.0 93.0785 24000.0 93.0802 11000.0 93.0835 4800.0 93.0886 2100.0 95.0488 69000.0 95.0852 730000.0 95.0927 5400.0 95.3869 2700.0 97.1009 77000.0 103.0542 3400.0 105.0445 19000.0 105.0617 2600.0 105.0696 240000.0 106.0754 6200.0 107.0852 1000000.0 109.0644 16000.0 109.0928 7400.0 109.1009 420000.0 111.1162 2500.0 113.9635 50000.0 116.0769 2400.0 116.4163 2600.0 117.0697 38000.0 117.3531 2800.0 118.382 2400.0 119.0853 64000.0 119.6562 2300.0 121.1009 3800000.0 121.1097 65000.0 121.1215 16000.0 123.0801 260000.0 123.1165 190000.0 128.0616 3300.0 129.0696 120000.0 133.0756 5700.0 133.101 6400.0 135.044 4300.0 135.1166 270000.0 137.1325 18000.0 142.3638 2200.0 144.0572 6200.0 145.0645 100000.0 145.1016 2400.0 147.0799 12000.0 147.1162 6200.0 149.1199 3000.0 149.1323 500000.0 149.1464 3500.0 154.5445 2400.0 155.6734 2900.0 157.0647 60000.0 162.1357 6500.0 163.1483 47000.0 164.1372 2700.0 171.0087 2700.0 173.5224 31000.0 173.5379 99000.0 174.0676 28000.0 174.3111 2300.0 175.0752 26000.0 185.7244 2300.0 187.0752 66000.0 191.5091 2700.0 205.1581 3600.0 205.1955 11000.0 215.1617 2800.0 215.5778 2300.0 END IONS BEGIN IONS SCANS=869 PEPMASS=587.5493 CHARGE=1 COLLISION_ENERGY=0.0 63.0497 2300.0 65.2806 12000.0 65.2833 300000.0 65.4682 2400.0 67.6592 2900.0 67.7063 2400.0 68.1058 2000.0 68.8621 2200.0 69.1624 2300.0 70.6532 2900.0 71.0623 2100.0 71.5238 2500.0 72.625 2300.0 75.1931 2100.0 75.3643 2600.0 76.4018 2200.0 78.2489 2500.0 78.867 2500.0 79.136 2100.0 80.2177 2700.0 80.2401 2600.0 80.8455 2400.0 81.6002 2700.0 84.508 2400.0 84.6906 2600.0 85.1812 2400.0 86.6095 2400.0 88.3556 2100.0 88.5233 2200.0 88.9721 2400.0 89.0592 9100.0 89.1532 2200.0 92.3482 2900.0 97.9363 2500.0 98.1036 2400.0 102.2278 2300.0 104.1858 2600.0 107.085 2500.0 107.7846 2200.0 107.9433 2100.0 109.4618 2400.0 111.1113 2500.0 111.7721 2600.0 111.9851 2400.0 112.2157 2100.0 114.1166 2300.0 119.1166 2200.0 119.1502 2100.0 121.0983 2600.0 121.9562 2500.0 122.0663 3300.0 123.3239 2100.0 124.9643 2200.0 126.3375 2400.0 126.4117 2300.0 127.9355 2400.0 128.5217 2200.0 130.0336 2100.0 130.1643 2400.0 131.5112 3000.0 133.0855 3200.0 133.6817 2400.0 134.1949 2500.0 135.6698 2100.0 140.2132 2700.0 146.881 2600.0 146.8933 5500.0 149.681 7700.0 149.692 9700.0 165.9159 2300.0 168.1443 2400.0 172.8015 2500.0 172.855 2300.0 173.5221 9400.0 173.5337 340000.0 173.5491 2300.0 174.6872 2600.0 175.7675 2400.0 186.4324 2600.0 193.7831 2500.0 198.904 2300.0 199.2808 2200.0 202.9274 2600.0 203.8664 2700.0 204.3425 2300.0 205.1663 2500.0 205.4917 2400.0 232.2119 2800.0 239.507 2600.0 241.5218 2400.0 242.0416 2300.0 248.8316 2500.0 253.3494 2400.0 260.2709 2300.0 277.7798 2200.0 282.0877 2600.0 282.7912 2300.0 286.5987 2800.0 294.5876 2700.0 303.3437 2300.0 307.8511 2400.0 316.397 2400.0 334.5417 2600.0 336.836 2500.0 359.7122 2900.0 361.8897 2500.0 363.7084 3000.0 378.6411 2500.0 382.3721 2300.0 385.1583 2900.0 387.8464 2600.0 397.3838 2400.0 418.2571 2500.0 422.7269 2700.0 429.3858 5800.0 444.3644 2400.0 461.9099 2500.0 472.043 2600.0 478.7024 2400.0 485.8189 2500.0 530.7207 2800.0 547.0746 2700.0 566.3757 2600.0 587.3294 5900.0 587.4391 11000.0 587.5482 7700000.0 587.6588 6300.0 587.7696 3800.0 END IONS BEGIN IONS SCANS=870 PEPMASS=567.4201 CHARGE=1 COLLISION_ENERGY=0.0 65.358 2500.0 67.054 12000.0 69.0331 2900.0 69.0696 14000.0 73.0501 2400.0 73.2995 2200.0 79.0539 14000.0 79.5252 2200.0 81.0695 48000.0 83.0487 6500.0 83.0852 4400.0 85.0644 2700.0 91.0539 17000.0 92.5542 2600.0 93.0649 2100.0 93.0695 54000.0 95.0488 9500.0 95.0852 34000.0 97.0644 5100.0 100.4237 2400.0 105.0627 3600.0 105.0695 87000.0 107.0852 58000.0 109.0641 3000.0 109.1009 42000.0 111.0801 10000.0 117.0697 8600.0 119.0852 89000.0 121.1008 73000.0 123.0801 9200.0 123.1166 10000.0 124.4265 2400.0 125.0957 4300.0 130.077 2800.0 131.0853 24000.0 133.1009 80000.0 135.0799 3400.0 135.1165 33000.0 137.0958 24000.0 142.077 3000.0 143.0851 24000.0 145.1008 72000.0 147.0803 2500.0 147.1165 52000.0 151.1116 8100.0 155.0857 7300.0 156.0934 3600.0 157.101 44000.0 158.1091 2300.0 159.1165 37000.0 161.0957 5200.0 161.1329 6500.0 169.1009 23000.0 171.1164 28000.0 172.1226 2400.0 173.0313 2400.0 173.1324 31000.0 173.5249 16000.0 173.5338 22000.0 173.5449 11000.0 175.148 14000.0 179.0852 2800.0 181.1011 8200.0 182.1084 2800.0 183.1171 24000.0 185.1322 20000.0 187.1476 12000.0 193.1004 6000.0 195.1166 16000.0 196.125 2500.0 197.1323 23000.0 199.1478 17000.0 201.1635 2700.0 206.4726 2300.0 207.1168 9200.0 208.1249 4200.0 209.1326 20000.0 210.138 2700.0 211.1483 21000.0 219.117 2500.0 220.1242 6600.0 221.1326 13000.0 223.1484 15000.0 235.1485 4000.0 261.1661 3000.0 263.1772 6000.0 265.194 2400.0 282.2798 20000.0 283.2832 39000.0 284.2862 22000.0 299.3077 2700.0 300.3095 3100.0 309.3253 3000.0 310.3112 17000.0 311.3143 40000.0 312.3178 24000.0 328.3402 2700.0 337.2479 2800.0 352.3225 2500.0 366.2081 2400.0 454.4991 2400.0 502.4044 2500.0 567.2985 19000.0 END IONS BEGIN IONS SCANS=871 PEPMASS=610.6251 CHARGE=1 COLLISION_ENERGY=0.0 64.0861 2000.0 64.5863 2400.0 68.1971 2100.0 71.0849 2900.0 77.1743 2500.0 77.5749 2400.0 80.2557 2400.0 80.2865 2300.0 82.9121 3100.0 88.8642 2300.0 94.1545 2400.0 95.0854 13000.0 95.5215 2300.0 97.101 2400.0 99.0646 2100.0 100.6518 2400.0 105.1644 2600.0 106.8457 2500.0 107.5819 2000.0 109.1 2400.0 111.6787 2800.0 117.7187 2500.0 118.8408 2600.0 120.5925 2600.0 127.226 2100.0 128.7473 2400.0 131.7032 2200.0 147.2144 2200.0 149.6821 4100.0 149.6924 4400.0 151.6094 2300.0 162.4232 2300.0 170.5081 2300.0 173.5272 110000.0 173.5432 61000.0 174.4068 2400.0 181.2297 2300.0 185.5725 2600.0 195.2516 2400.0 199.1459 2900.0 217.0534 2300.0 242.2804 2400.0 250.7673 2400.0 260.6291 2700.0 262.1229 2800.0 276.4529 2300.0 281.2953 610000.0 281.3313 4400.0 282.2036 3400.0 282.2791 2600000.0 282.3159 16000.0 283.2825 12000.0 285.0103 2400.0 299.2685 5200.0 299.3057 570000.0 299.3447 11000.0 300.3098 2900.0 308.2953 14000.0 309.2902 14000.0 309.3266 600000.0 310.2675 11000.0 310.2795 8200.0 310.3105 2600000.0 313.2728 8000.0 322.6875 2400.0 327.3369 530000.0 337.274 8400.0 346.1705 2700.0 375.6155 2500.0 375.7675 2700.0 376.4943 2700.0 380.9055 2400.0 407.824 2700.0 437.75 3100.0 452.4535 2900.0 452.7443 2700.0 469.9238 2900.0 559.902 2700.0 565.5652 15000.0 END IONS BEGIN IONS SCANS=872 PEPMASS=565.5673 CHARGE=1 COLLISION_ENERGY=0.0 62.0756 2100.0 62.1571 2400.0 64.2286 2800.0 65.114 2200.0 65.2234 2200.0 65.3287 2700.0 67.0538 9600.0 67.1503 2200.0 69.0695 2700.0 69.1232 2600.0 70.5695 55000.0 70.5718 4600.0 71.0419 3000.0 71.0853 54000.0 72.3561 2200.0 72.7064 2900.0 72.9176 2300.0 73.0367 2100.0 73.301 2300.0 73.8513 2400.0 74.2083 2100.0 74.892 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2600.0 148.617 2300.0 155.4559 2600.0 156.2449 2700.0 156.8346 3500.0 167.2138 2400.0 168.6876 2600.0 173.5229 98000.0 173.5374 270000.0 187.3704 2400.0 193.088 2500.0 200.6896 2300.0 211.1946 2400.0 211.861 2700.0 218.1495 2200.0 230.8297 2400.0 231.0553 2500.0 239.6391 2300.0 241.0426 2700.0 243.3807 2500.0 245.9245 2500.0 257.2287 2800.0 267.4435 2400.0 276.9807 2800.0 278.5076 2400.0 281.2585 26000.0 281.2954 3400000.0 281.3311 13000.0 282.1856 7900.0 282.2065 120000.0 282.2205 46000.0 282.2426 4600.0 282.2791 19000000.0 282.3163 4300.0 282.3375 42000.0 282.3525 97000.0 298.7331 2800.0 299.2752 2200.0 299.3059 1700000.0 299.3444 5700.0 300.2658 2700.0 301.2866 2700.0 307.6499 2800.0 309.2845 32000.0 309.2966 4300.0 309.3267 3400000.0 309.368 19000.0 310.2261 97000.0 310.2458 70000.0 310.2797 48000.0 310.3106 19000000.0 310.3783 8100.0 310.3943 96000.0 310.418 13000.0 327.2924 20000.0 327.337 1500000.0 327.371 2600.0 331.8257 2300.0 335.0652 2500.0 349.9879 3300.0 361.1826 2400.0 366.6606 2700.0 373.8409 2500.0 390.6766 2900.0 391.502 3000.0 397.1122 2500.0 410.4055 2600.0 413.3027 2600.0 416.1871 3000.0 422.697 2600.0 447.8319 2700.0 465.729 2800.0 482.07 2400.0 493.7944 2600.0 554.4422 2700.0 565.6119 48000.0 END IONS BEGIN IONS SCANS=873 PEPMASS=566.5706 CHARGE=1 COLLISION_ENERGY=0.0 70.0633 2600.0 81.0692 3100.0 82.117 2700.0 85.5091 2300.0 93.0692 3900.0 95.0847 4600.0 97.774 2600.0 109.1004 2600.0 119.0852 4900.0 126.5598 2600.0 131.085 3400.0 133.101 3300.0 143.0846 3600.0 145.1007 4600.0 147.1155 4700.0 157.1006 5400.0 165.6931 2500.0 171.1167 3100.0 173.5228 12000.0 173.5299 27000.0 173.5419 14000.0 177.0547 2500.0 185.1323 4000.0 197.1305 3600.0 248.9904 2900.0 250.5687 2600.0 281.2956 41000.0 282.2794 220000.0 283.2827 240000.0 299.3051 16000.0 300.3092 15000.0 309.3269 40000.0 310.3113 200000.0 311.3139 270000.0 327.3379 17000.0 328.3407 20000.0 349.5651 2900.0 411.5236 2400.0 431.8867 2900.0 END IONS BEGIN IONS SCANS=874 PEPMASS=584.4217 CHARGE=1 COLLISION_ENERGY=0.0 67.0541 26000.0 67.2224 2300.0 68.4316 2200.0 69.0333 5800.0 69.0696 30000.0 71.0487 3000.0 71.0852 3500.0 73.0284 13000.0 75.1384 3000.0 79.0539 40000.0 80.0618 9900.0 81.0696 120000.0 83.049 18000.0 83.0852 19000.0 83.7399 2700.0 85.0649 2600.0 85.2516 2200.0 87.0438 16000.0 89.0594 260000.0 91.0539 42000.0 91.1452 2200.0 91.4817 2500.0 93.0694 160000.0 94.073 2300.0 95.0488 45000.0 95.0852 95000.0 97.0646 31000.0 105.0696 180000.0 106.0733 3400.0 107.0852 140000.0 108.0888 5500.0 109.0645 27000.0 109.1009 98000.0 111.08 16000.0 111.371 2400.0 113.0958 3600.0 114.6765 3200.0 115.2863 2100.0 117.0696 24000.0 119.0766 3700.0 119.0852 260000.0 120.088 3200.0 121.0639 3500.0 121.1008 180000.0 122.1042 17000.0 123.0801 93000.0 123.1168 23000.0 123.874 2400.0 125.0587 13000.0 125.0957 10000.0 126.73 2500.0 129.0699 10000.0 129.315 2700.0 131.0853 100000.0 132.0928 24000.0 133.0857 130000.0 133.1009 180000.0 134.1044 12000.0 135.0803 36000.0 135.1166 68000.0 137.0959 50000.0 138.1037 6400.0 139.1116 27000.0 141.1341 2400.0 142.0782 2800.0 143.0852 100000.0 144.0928 31000.0 145.0889 7200.0 145.1009 320000.0 146.1056 32000.0 147.0801 49000.0 147.1165 99000.0 148.1196 8900.0 149.0962 21000.0 149.1324 6600.0 151.0753 34000.0 151.1112 18000.0 152.1605 2600.0 155.0852 17000.0 156.0198 2600.0 156.0926 19000.0 157.1009 200000.0 158.1081 56000.0 159.0805 19000.0 159.1166 160000.0 160.0881 77000.0 160.123 5800.0 161.0961 41000.0 161.1323 38000.0 163.1114 52000.0 165.0908 170000.0 166.0947 9800.0 167.0853 2400.0 167.1064 35000.0 169.1011 75000.0 170.1073 16000.0 171.1167 140000.0 172.1235 26000.0 173.0958 18000.0 173.1325 96000.0 173.5244 32000.0 173.5361 120000.0 174.1376 15000.0 175.1113 26000.0 175.148 47000.0 176.1203 3000.0 177.0901 2700.0 177.1125 4100.0 177.1276 3200.0 180.1137 7100.0 181.101 33000.0 181.122 40000.0 182.1081 10000.0 182.5432 2900.0 183.1168 82000.0 184.1234 16000.0 185.1323 96000.0 186.1389 19000.0 187.1118 6200.0 187.1481 47000.0 189.1272 26000.0 190.1348 25000.0 191.1064 8800.0 191.143 29000.0 193.1015 15000.0 193.1219 19000.0 194.1083 9900.0 195.1167 68000.0 195.1352 3100.0 196.1233 21000.0 197.1324 110000.0 198.1384 17000.0 199.1117 8400.0 199.1481 37000.0 201.1267 14000.0 201.164 8100.0 203.143 81000.0 204.1479 5000.0 207.1173 24000.0 207.138 29000.0 208.1234 12000.0 208.1446 12000.0 209.1324 84000.0 210.1382 20000.0 211.1481 73000.0 212.1536 5600.0 213.1278 8100.0 213.1631 14000.0 215.1425 3900.0 216.1485 3000.0 217.1576 2500.0 219.139 2800.0 221.1321 33000.0 221.1538 160000.0 222.1388 2900.0 222.1566 5100.0 223.1485 57000.0 224.1535 3400.0 225.1639 38000.0 227.1434 4400.0 227.1785 3100.0 233.1314 3300.0 234.1614 19000.0 235.1479 34000.0 237.1292 3500.0 237.1639 36000.0 238.168 6600.0 239.1805 7100.0 241.1583 2800.0 247.1692 21000.0 248.1561 3100.0 249.164 8300.0 251.1784 19000.0 253.1588 3500.0 253.1922 3200.0 255.1759 2900.0 259.1699 31000.0 260.1769 2600.0 261.1604 3400.0 263.1787 15000.0 265.1939 9700.0 266.2031 21000.0 267.1744 5300.0 271.1691 3500.0 272.1767 2400.0 273.1855 2700.0 273.197 2500.0 274.1091 2700.0 274.1933 8000.0 275.1785 6100.0 281.1904 3000.0 283.2042 3400.0 283.2822 2900.0 286.1165 2700.0 286.1915 18000.0 287.201 55000.0 291.2107 3300.0 297.1847 3200.0 299.2015 18000.0 300.2079 10000.0 311.2004 2600.0 312.2091 2900.0 325.2175 2900.0 327.0812 2400.0 337.2153 20000.0 351.2307 3900.0 352.2393 61000.0 353.2464 31000.0 354.2515 7700.0 356.3028 2800.0 365.2472 50000.0 366.2543 12000.0 403.3059 2500.0 404.4293 2500.0 449.4476 2500.0 491.3511 26000.0 492.3557 69000.0 492.8877 2500.0 504.3598 37000.0 535.6949 2300.0 571.0925 2500.0 575.5451 2300.0 584.4216 3700.0 END IONS BEGIN IONS SCANS=875 PEPMASS=619.2921 CHARGE=1 COLLISION_ENERGY=0.0 65.4838 2400.0 66.3058 2900.0 68.8087 28000.0 68.812 4800.0 72.2267 2500.0 72.8781 2200.0 75.8253 2600.0 79.3595 2800.0 81.0701 2900.0 81.4734 2300.0 88.4358 2200.0 92.2592 2300.0 110.905 2800.0 119.4905 3300.0 157.2281 2800.0 172.8428 2700.0 173.5228 27000.0 173.5393 45000.0 209.841 2400.0 213.2377 2900.0 219.9874 2400.0 230.4471 2300.0 238.8281 2500.0 252.7262 2600.0 277.8203 2300.0 282.5424 2300.0 328.86 2300.0 341.3073 3800.0 360.228 2600.0 399.1661 2300.0 417.6016 2700.0 473.2338 26000.0 485.2331 12000.0 487.2494 40000.0 488.2572 21000.0 503.2441 12000.0 531.2395 25000.0 532.2467 7700.0 559.2702 200000.0 560.2782 31000.0 587.266 35000.0 591.2609 120000.0 591.3522 4000.0 619.2912 810000.0 619.4149 2900.0 END IONS BEGIN IONS SCANS=876 PEPMASS=323.1283 CHARGE=1 COLLISION_ENERGY=0.0 49.0797 2200.0 52.7735 2200.0 53.0383 2400.0 55.0176 12000.0 55.2539 2200.0 65.6078 2400.0 71.8018 2400.0 73.27 2500.0 77.0388 11000.0 79.054 22000.0 91.0539 30000.0 93.0696 8200.0 95.0183 2300.0 95.0489 20000.0 103.0539 78000.0 105.033 3800.0 105.0443 4300.0 105.0696 120000.0 107.0486 55000.0 115.0541 15000.0 117.0696 22000.0 119.0487 17000.0 121.0553 3200.0 121.0645 100000.0 128.0621 3500.0 129.0697 14000.0 131.0489 630000.0 131.0586 3600.0 131.0597 7000.0 132.0566 7000.0 133.0645 850000.0 133.0748 8500.0 135.0438 1700000.0 135.054 16000.0 135.0626 11000.0 137.0595 8900.0 141.0695 2900.0 143.0489 34000.0 143.0852 16000.0 144.0572 4200.0 145.0645 100000.0 148.0515 7000.0 149.046 11000.0 149.0594 270000.0 149.071 2900.0 151.0754 3100.0 157.0646 43000.0 159.044 16000.0 160.0517 33000.0 161.0595 690000.0 161.071 6600.0 161.0914 3000.0 163.0754 27000.0 169.0645 5900.0 171.0447 2600.0 171.0802 33000.0 172.0525 4500.0 173.0597 110000.0 173.5193 4100.0 173.5312 28000.0 174.0672 3900.0 175.0757 25000.0 179.0848 2700.0 185.0597 59000.0 186.0674 67000.0 187.0577 4300.0 187.0752 87000.0 187.0923 3300.0 193.1014 3000.0 194.0729 3000.0 199.0748 4300.0 201.0907 25000.0 207.0796 9200.0 207.1169 8200.0 217.1013 24000.0 220.0881 14000.0 221.0965 6200.0 229.2949 2600.0 233.0944 8300.0 235.0747 2900.0 235.0844 2900.0 235.1119 74000.0 245.0957 40000.0 247.112 3300.0 248.0833 20000.0 263.1067 73000.0 265.1243 2400.0 275.1073 6700.0 278.0944 4200.0 291.1009 3000.0 293.1173 44000.0 308.1048 130000.0 313.0815 2700.0 323.1285 180000.0 326.1156 3300.0 END IONS BEGIN IONS SCANS=877 PEPMASS=663.4545 CHARGE=1 COLLISION_ENERGY=0.0 68.6496 2400.0 72.8977 3100.0 73.6239 2200.0 74.2663 2500.0 74.3327 2400.0 75.3417 2600.0 76.2983 2400.0 78.9626 2100.0 81.1011 2600.0 86.3038 2600.0 86.5016 2500.0 87.0978 2100.0 87.4752 2400.0 88.6855 2500.0 89.588 2400.0 96.9248 2100.0 98.1925 2700.0 100.0521 2300.0 103.8366 2300.0 107.1305 2600.0 110.8743 2400.0 112.2924 2200.0 112.5982 2200.0 119.0838 2600.0 128.2009 2600.0 131.8036 2800.0 144.5446 2500.0 146.6585 2400.0 147.117 3300.0 149.2796 2100.0 149.6721 3300.0 149.6822 4300.0 149.7032 3500.0 153.875 2300.0 154.774 2400.0 157.4822 2600.0 160.091 2400.0 173.5238 90000.0 173.5424 120000.0 176.7992 2700.0 188.0861 2500.0 192.9053 2400.0 211.5136 2700.0 216.2829 2100.0 241.0785 2600.0 251.0467 9400.0 261.5096 2500.0 281.2764 2800.0 295.0612 2400.0 307.1097 15000.0 327.078 170000.0 339.5422 2700.0 363.172 13000.0 382.5083 2500.0 383.1409 640000.0 383.1978 14000.0 439.1022 3500.0 439.2031 2300000.0 481.9989 2700.0 483.0013 2700.0 483.096 2200.0 484.5492 2700.0 495.2005 3400.0 495.2651 4800000.0 496.2666 2900.0 526.2087 2700.0 534.6275 2400.0 551.3283 670000.0 551.4261 3700.0 607.3919 32000.0 621.7942 2700.0 645.3411 2800.0 END IONS BEGIN IONS SCANS=878 PEPMASS=680.481 CHARGE=1 COLLISION_ENERGY=0.0 67.0746 2200.0 68.9794 2300.0 69.7282 2300.0 73.5707 2400.0 73.7532 2500.0 76.2477 4800.0 78.4101 2400.0 79.6241 2200.0 80.1767 2400.0 82.9268 2200.0 84.3911 3000.0 86.3782 2300.0 88.3747 2600.0 90.6299 2400.0 92.2489 2600.0 95.5647 2300.0 96.3066 2600.0 99.3456 2500.0 108.2242 2100.0 109.7869 2400.0 111.2282 2300.0 116.0781 2200.0 124.6824 2500.0 126.6638 2700.0 135.9212 2200.0 138.6075 2100.0 139.5303 2300.0 149.6833 5100.0 149.6934 4300.0 164.6189 2400.0 169.8023 2200.0 173.3165 2600.0 173.5245 89000.0 173.5404 77000.0 182.1122 2300.0 188.2554 2700.0 195.6119 2400.0 209.1566 3000.0 211.9854 2600.0 223.706 2400.0 227.6562 2800.0 227.8689 2900.0 241.5627 2400.0 277.0699 2500.0 282.8149 2900.0 291.6202 2400.0 295.6397 2500.0 327.0777 21000.0 334.8299 2700.0 338.0374 2500.0 347.5876 2500.0 353.9821 2900.0 383.1407 130000.0 395.5779 2500.0 395.6216 2900.0 400.4029 2700.0 439.2031 680000.0 486.0945 2500.0 491.8739 2700.0 495.1451 4000.0 495.2654 2600000.0 531.841 2500.0 535.5344 2600.0 551.2277 2400.0 551.3284 950000.0 551.4253 4600.0 552.4612 3000.0 607.3904 150000.0 617.1117 2600.0 624.2827 2600.0 663.4559 3900.0 680.4286 2400.0 END IONS BEGIN IONS SCANS=879 PEPMASS=621.3069 CHARGE=1 COLLISION_ENERGY=0.0 65.4762 25000.0 65.9208 160000.0 66.776 5900.0 67.6761 34000.0 68.8302 25000.0 69.0337 1900000.0 69.0366 310000.0 77.7709 4100.0 85.2656 33000.0 89.0078 42000.0 101.5093 6100.0 102.7033 32000.0 105.8006 3900.0 126.059 34000.0 133.7634 32000.0 138.7319 33000.0 140.3156 82000.0 140.328 36000.0 147.5434 8600.0 151.4656 31000.0 155.3194 75000.0 155.3338 70000.0 161.0392 27000.0 173.5197 63000.0 173.5376 720000.0 176.2116 7800.0 181.7646 4300.0 193.8562 31000.0 240.6224 30000.0 252.9787 7500.0 264.0071 6600.0 268.9718 7300.0 283.1401 3900.0 315.1678 6700.0 360.783 4600.0 373.5623 9100.0 379.2455 36000.0 381.3627 4000.0 390.3597 7800.0 405.2082 7400.0 417.2071 42000.0 418.2168 9900.0 419.222 18000.0 431.1869 370000.0 432.1935 31000.0 433.2387 840000.0 434.2462 150000.0 445.2025 280000.0 446.2097 330000.0 447.2178 690000.0 449.2341 17000.0 452.9404 40000.0 453.7283 37000.0 459.218 1700000.0 460.1638 20000.0 460.224 4200000.0 461.2335 3800000.0 462.2384 320000.0 472.2244 10000.0 473.2335 1600000.0 473.2944 6700.0 474.2398 290000.0 475.2484 28000.0 476.2594 8800.0 477.2291 29000.0 487.2487 1100000.0 488.216 96000.0 488.2516 100000.0 489.2624 140000.0 491.2096 250000.0 492.2516 650000.0 493.2596 77000.0 499.2524 22000.0 501.2292 77000.0 502.2339 35000.0 503.2463 210000.0 504.2348 7500.0 505.2261 820000.0 506.2573 11000.0 515.2442 890000.0 516.2508 28000.0 517.261 370000.0 518.23 5700.0 518.2443 21000.0 519.2468 400000.0 520.2456 1500000.0 521.2806 7600.0 521.2913 5600.0 531.2427 21000.0 532.246 120000.0 533.2566 3100000.0 534.2619 96000.0 543.2383 51000.0 545.2715 7200.0 546.2617 390000.0 547.2709 920000.0 548.2701 14000.0 548.2831 6200.0 549.2526 4500.0 560.2476 210000.0 561.0209 28000.0 561.0798 240000.0 561.1275 34000.0 561.2865 47000000.0 561.4489 120000.0 561.4902 200000.0 561.55 35000.0 562.2898 2300000.0 563.2531 4600.0 564.2413 23000.0 565.2795 160000.0 572.2742 11000.0 574.2563 22000.0 575.1625 7800.0 575.2659 1500000.0 575.3455 6500.0 577.2468 21000.0 577.2748 7700.0 578.2852 190000.0 579.2958 30000.0 589.1701 10000.0 589.2802 1900000.0 589.3903 6900.0 591.2609 93000.0 592.2686 840000.0 593.2821 4500000.0 593.4856 8800.0 606.2814 550000.0 620.3019 26000.0 621.0658 270000.0 621.1206 88000.0 621.3073 54000000.0 621.4958 120000.0 621.545 250000.0 621.6168 35000.0 622.3063 25000.0 END IONS BEGIN IONS SCANS=880 PEPMASS=620.3005 CHARGE=1 COLLISION_ENERGY=0.0 64.0735 12000.0 64.992 5400.0 65.3633 81000.0 65.3655 12000.0 65.7621 3800.0 67.2506 8700.0 67.2533 30000.0 68.9212 100000.0 68.9244 20000.0 69.3283 11000.0 75.4846 2500.0 78.1664 9400.0 80.5955 5100.0 85.2502 5400.0 85.5787 9200.0 87.747 10000.0 94.1063 3700.0 94.4586 4200.0 104.5269 2400.0 114.8025 15000.0 114.8078 7300.0 119.264 2700.0 129.8049 2500.0 133.9677 4600.0 140.3169 7500.0 140.3269 6700.0 144.2314 3800.0 166.7575 4400.0 173.5263 150000.0 173.5408 120000.0 208.5152 2500.0 241.1063 2500.0 242.6782 5000.0 246.3869 12000.0 270.083 5800.0 277.1349 2400.0 296.1525 2900.0 299.6984 4200.0 325.0976 4100.0 355.1169 2500.0 388.2038 14000.0 400.2034 13000.0 401.2115 56000.0 414.2203 5000.0 416.2334 69000.0 419.2285 6800.0 431.1839 11000.0 432.2311 27000.0 433.2393 170000.0 434.2478 16000.0 444.1951 46000.0 445.1978 43000.0 445.2455 16000.0 446.2055 24000.0 447.2545 110000.0 449.2345 4000.0 459.0689 25000.0 459.1579 59000.0 459.2184 8400000.0 460.2263 940000.0 461.2339 760000.0 461.3031 4700.0 462.279 45000.0 471.2203 7200.0 472.2327 12000.0 473.2336 310000.0 474.2417 64000.0 475.2519 18000.0 476.2215 56000.0 477.2289 12000.0 486.2422 63000.0 487.2168 670000.0 488.2561 320000.0 489.2655 28000.0 491.2443 260000.0 492.2522 220000.0 498.2449 7200.0 500.2198 60000.0 501.2293 270000.0 503.2422 23000.0 505.2295 140000.0 514.236 32000.0 515.2452 130000.0 516.2519 52000.0 517.2561 96000.0 518.2368 29000.0 519.1584 13000.0 519.2409 5500000.0 520.1659 6400.0 520.2702 100000.0 531.2402 53000.0 532.2508 90000.0 533.2581 530000.0 534.2978 21000.0 542.2344 45000.0 544.284 4700.0 545.2556 650000.0 546.263 68000.0 547.2711 130000.0 548.2764 23000.0 549.2814 69000.0 559.2633 66000.0 560.2785 1200000.0 561.0796 30000.0 561.1286 21000.0 561.2103 22000.0 561.2868 8200000.0 561.4903 17000.0 563.254 6900.0 571.2718 94000.0 573.2512 100000.0 575.2382 5500.0 577.2783 370000.0 578.2891 23000.0 579.3021 3200.0 588.157 4500.0 588.1893 29000.0 588.2738 2000000.0 588.3801 25000.0 589.2813 30000.0 590.2532 250000.0 591.266 150000.0 592.2793 170000.0 593.2766 14000.0 602.2922 10000.0 605.1615 23000.0 605.2763 1300000.0 605.3892 23000.0 619.2907 60000.0 620.1321 17000.0 620.2998 2900000.0 621.308 220000.0 END IONS BEGIN IONS SCANS=881 PEPMASS=643.2895 CHARGE=1 COLLISION_ENERGY=0.0 65.9014 2400.0 68.1019 2300.0 68.974 2200.0 70.5754 2100.0 71.4738 5800.0 71.4768 110000.0 71.8092 2800.0 72.3223 2200.0 72.5395 2600.0 72.5576 2500.0 77.4464 2600.0 79.4961 2300.0 81.1161 2300.0 81.6053 3300.0 82.1822 2600.0 85.4327 2300.0 90.6753 2300.0 96.4303 2500.0 98.1846 2400.0 105.6301 3100.0 106.6309 2400.0 108.2921 2100.0 111.6072 2300.0 115.8292 2600.0 121.2638 2800.0 122.5383 2300.0 130.3238 2300.0 130.8413 2200.0 133.501 2400.0 135.9066 2600.0 140.3328 2500.0 146.7957 2200.0 150.0547 2500.0 160.8132 2600.0 163.8056 2700.0 164.7461 2500.0 168.6263 2300.0 169.0122 2400.0 173.5277 160000.0 173.5404 87000.0 175.9397 2400.0 181.2581 2300.0 189.6208 2500.0 194.4278 2300.0 211.3551 3200.0 216.6756 2400.0 223.1416 2500.0 231.6538 2700.0 232.9069 2700.0 257.8361 2400.0 266.2321 2900.0 289.8859 2300.0 304.1057 2500.0 316.0955 2300.0 334.3308 2600.0 342.7552 2700.0 371.1113 2700.0 375.1234 2900.0 390.0533 2500.0 434.8353 2800.0 452.8821 2500.0 467.861 2400.0 469.1967 9300.0 504.8311 2300.0 527.2018 3600.0 539.241 150000.0 541.6743 2700.0 561.8602 2900.0 583.2561 4100.0 583.2706 7400.0 589.2828 2800.0 611.2638 17000.0 643.2888 2900000.0 END IONS BEGIN IONS SCANS=882 PEPMASS=665.2969 CHARGE=1 COLLISION_ENERGY=0.0 70.8095 2400.0 82.9549 2500.0 86.4143 2400.0 91.8163 2400.0 99.1256 2400.0 119.3113 2200.0 149.6872 3600.0 161.4251 2400.0 173.5208 7700.0 173.5341 30000.0 173.5474 7900.0 174.0708 2400.0 190.5164 2500.0 226.1452 2500.0 227.8777 2300.0 261.2164 2500.0 275.1606 2400.0 325.1551 2800.0 351.1358 3200.0 376.6248 2600.0 417.4562 2600.0 458.2435 3900.0 459.2188 27000.0 460.2253 7200.0 472.2247 9000.0 473.2338 63000.0 475.2101 7800.0 476.2208 14000.0 477.2301 21000.0 485.2334 22000.0 487.2503 19000.0 488.2595 7000.0 489.2258 7500.0 496.2697 3300.0 497.2753 2900.0 503.2428 20000.0 513.2266 5700.0 515.2452 2800.0 518.2305 2400.0 519.2422 24000.0 531.2448 27000.0 532.248 2400.0 535.2425 4500.0 536.243 3700.0 545.2547 8100.0 549.276 14000.0 559.2708 380000.0 560.2782 22000.0 561.2865 50000.0 562.2555 3000.0 563.2662 4300.0 576.2725 10000.0 577.2814 230000.0 587.2652 28000.0 588.2731 12000.0 591.2883 69000.0 595.2929 5600.0 605.2766 78000.0 608.2733 3000.0 609.2859 8700.0 609.2982 6900.0 619.2917 98000.0 620.2998 57000.0 621.3059 9900.0 637.3027 160000.0 665.2977 44000.0 END IONS BEGIN IONS SCANS=883 PEPMASS=708.5119 CHARGE=1 COLLISION_ENERGY=0.0 72.6429 2700.0 73.7802 2400.0 74.4942 2400.0 75.8497 2600.0 75.955 2500.0 80.1409 2200.0 80.3507 2700.0 89.4888 2200.0 94.2998 2300.0 105.1873 2300.0 105.7072 2500.0 108.5198 2200.0 118.2974 2500.0 122.0777 2300.0 130.7858 2900.0 135.0125 2500.0 143.358 2500.0 149.657 2500.0 149.6876 4800.0 150.3964 2200.0 154.534 2600.0 157.5875 2400.0 160.4642 2700.0 160.7212 2300.0 166.0502 2400.0 171.8956 2400.0 173.5227 58000.0 173.5377 120000.0 178.1441 2600.0 184.6122 2700.0 189.5213 2700.0 190.1605 2500.0 197.9023 2400.0 205.2786 2700.0 223.3818 2600.0 234.974 2700.0 253.3808 2600.0 257.091 2300.0 270.2212 2500.0 271.6176 2300.0 299.3405 2400.0 310.4879 2600.0 327.078 22000.0 334.8044 2400.0 340.2769 2600.0 354.174 2900.0 383.1411 120000.0 439.2033 640000.0 439.6482 2500.0 466.7266 2800.0 495.2655 2700000.0 496.269 10000.0 497.2725 8200.0 526.6011 2500.0 551.2318 9000.0 551.254 4400.0 551.3285 1100000.0 551.4265 4700.0 552.3359 3500.0 553.3375 4000.0 578.0035 2900.0 607.3909 220000.0 638.7976 2700.0 663.4545 14000.0 END IONS BEGIN IONS SCANS=884 PEPMASS=470.3635 CHARGE=1 COLLISION_ENERGY=0.0 57.0697 8500.0 57.9036 2300.0 67.0539 32000.0 67.7362 3000.0 69.0695 85000.0 70.0748 2500.0 70.6352 2100.0 71.0852 4600.0 73.2845 2200.0 74.2491 2400.0 76.5481 2400.0 79.054 25000.0 79.0697 2300.0 81.0695 420000.0 81.0779 4100.0 83.0852 19000.0 89.0593 3900.0 90.2504 2400.0 90.2677 2300.0 93.0696 36000.0 95.0852 190000.0 97.1011 15000.0 100.4204 2300.0 100.9132 2400.0 105.0693 4900.0 107.0852 41000.0 109.1008 110000.0 111.1165 2500.0 115.0239 3300.0 118.2323 2800.0 119.0852 9500.0 121.1009 78000.0 123.1165 57000.0 133.1007 6500.0 135.1166 52000.0 137.1242 2000.0 137.1322 58000.0 137.9292 2500.0 141.0545 42000.0 147.117 9400.0 149.1323 67000.0 151.0751 20000.0 159.1169 12000.0 161.1316 2600.0 163.1481 17000.0 165.0546 15000.0 165.0909 6000.0 165.1626 2700.0 167.0554 4300.0 167.0703 270000.0 170.154 5500.0 171.0714 2500.0 173.5255 52000.0 173.5405 30000.0 175.0748 2600.0 175.148 4200.0 177.0914 3500.0 177.164 12000.0 179.0701 8500.0 179.1066 2500.0 181.0857 19000.0 187.1118 6200.0 189.1638 5600.0 191.0707 13000.0 191.1072 2900.0 193.0859 17000.0 203.1813 3100.0 205.0864 20000.0 205.1226 8300.0 207.1017 31000.0 215.107 21000.0 219.1018 12000.0 221.1178 12000.0 233.1177 10000.0 241.7877 2300.0 245.1185 3100.0 253.5385 2700.0 257.1526 2500.0 275.1649 3400.0 282.2795 16000.0 411.401 2600.0 419.1956 2700.0 435.8606 2500.0 END IONS BEGIN IONS SCANS=885 PEPMASS=447.2876 CHARGE=1 COLLISION_ENERGY=0.0 56.8179 2700.0 57.0696 2600.0 63.8934 2800.0 65.2935 2200.0 72.7603 2600.0 73.3351 2200.0 73.7617 2100.0 73.9982 2100.0 77.4312 2500.0 83.5177 2300.0 83.9849 2300.0 85.0668 2400.0 95.1618 2300.0 96.5051 2200.0 96.901 2500.0 100.0401 2900.0 119.0848 2200.0 124.6678 2600.0 125.7162 2400.0 127.7635 2300.0 134.4385 2300.0 136.824 2400.0 139.1762 2600.0 142.3381 2400.0 146.272 2300.0 155.5906 2700.0 172.2158 2600.0 173.3271 3000.0 173.5226 8600.0 173.5302 66000.0 173.5425 21000.0 173.5522 2500.0 180.3015 2800.0 187.017 6800.0 187.0365 2500000.0 189.0513 3400.0 205.047 11000.0 212.8032 2700.0 215.7319 2700.0 221.168 2300.0 228.0633 8600.0 251.7472 2600.0 269.8737 2400.0 272.3237 2500.0 296.9544 2700.0 296.9686 3000.0 300.3926 2400.0 307.7408 2400.0 319.3158 2700.0 330.8475 2400.0 343.2168 2700.0 347.7944 2200.0 354.892 2400.0 447.2912 18000.0 447.3944 29000.0 END IONS BEGIN IONS SCANS=886 PEPMASS=425.3056 CHARGE=1 COLLISION_ENERGY=0.0 55.0182 2900.0 55.054 240000.0 56.6663 2500.0 57.0336 2500.0 57.0697 140000.0 57.7544 2200.0 57.8815 2600.0 59.4719 2300.0 60.0342 2100.0 60.9908 2100.0 62.1793 2500.0 64.0953 2300.0 65.0385 18000.0 65.9399 2200.0 67.0178 27000.0 67.05 3700.0 67.0539 630000.0 69.0697 1100000.0 69.0735 3600.0 70.4438 2200.0 71.0491 2500.0 71.0853 50000.0 71.6465 2500.0 73.0328 2400.0 73.5628 2200.0 74.9793 2600.0 76.6236 2200.0 77.0386 7400.0 77.1099 2500.0 79.0539 400000.0 81.0698 5400000.0 81.0782 68000.0 81.0811 7700.0 82.485 2200.0 83.049 47000.0 83.0852 310000.0 85.0287 2500.0 89.0593 81000.0 89.2695 2600.0 90.0628 10000.0 91.054 120000.0 93.0631 5400.0 93.0696 870000.0 93.0767 5200.0 95.0489 73000.0 95.0854 2800000.0 97.1009 230000.0 100.5943 2600.0 105.0449 4700.0 105.0696 190000.0 107.0486 2500.0 107.0772 4500.0 107.0853 860000.0 107.0919 3500.0 109.0647 6400.0 109.0886 3500.0 109.101 1700000.0 109.1136 4100.0 110.3457 2400.0 110.9142 2300.0 111.0438 22000.0 111.0808 2300.0 111.1166 120000.0 111.7587 2400.0 113.0595 26000.0 113.879 2300.0 117.0694 13000.0 119.0491 27000.0 119.0853 250000.0 119.0946 4400.0 121.0647 39000.0 121.091 8900.0 121.101 1000000.0 123.044 8400.0 123.0804 16000.0 123.1069 12000.0 123.1166 750000.0 123.1253 2100.0 125.0597 4400.0 128.1014 2400.0 129.4497 2300.0 131.0855 48000.0 131.5289 2700.0 133.0648 20000.0 133.0866 27000.0 133.1011 190000.0 135.0804 56000.0 135.1056 4200.0 135.1167 680000.0 137.0595 140000.0 137.1204 4600.0 137.1323 480000.0 138.0674 8000.0 138.1797 2400.0 139.039 67000.0 139.0751 110000.0 141.0427 4600.0 141.0545 510000.0 141.0671 4700.0 143.0853 11000.0 143.5344 2500.0 145.1011 80000.0 146.5609 2200.0 147.0802 40000.0 147.1167 240000.0 149.0596 97000.0 149.0957 14000.0 149.1192 13000.0 149.1324 810000.0 149.1462 13000.0 151.0619 4900.0 151.0752 370000.0 151.1483 26000.0 151.9738 2800.0 153.0547 19000.0 155.2007 2300.0 157.1013 33000.0 159.0803 27000.0 159.1168 200000.0 160.0887 2400.0 161.0597 70000.0 161.0962 41000.0 161.1325 130000.0 161.7321 2400.0 163.0753 58000.0 163.1124 12000.0 163.1481 250000.0 165.0547 260000.0 165.0911 140000.0 167.0704 4800000.0 167.1035 6000.0 169.1015 12000.0 169.1699 22000.0 169.5178 2400.0 169.8862 2400.0 170.154 170000.0 171.0797 3800.0 171.1165 9900.0 172.0885 3100.0 173.0962 61000.0 173.1327 36000.0 173.5256 80000.0 173.5414 68000.0 174.1039 2900.0 175.0755 130000.0 175.1119 19000.0 175.1482 120000.0 177.0545 41000.0 177.0912 110000.0 177.1277 6800.0 177.1639 170000.0 178.0622 36000.0 179.0704 140000.0 179.0863 3300.0 179.092 2400.0 179.1069 100000.0 181.086 300000.0 181.1033 4500.0 183.1163 2400.0 185.096 10000.0 187.0756 27000.0 187.1118 110000.0 187.1483 11000.0 187.181 3000.0 188.0853 3000.0 189.0913 160000.0 189.1277 8600.0 189.1638 93000.0 189.478 2400.0 190.0987 2800.0 191.0704 250000.0 191.1067 73000.0 191.1796 51000.0 192.078 32000.0 193.0862 210000.0 193.1213 12000.0 195.101 11000.0 197.0959 5400.0 199.1116 15000.0 201.0915 91000.0 201.1273 6900.0 201.1638 22000.0 203.107 95000.0 203.1798 96000.0 204.0383 2300.0 205.0862 290000.0 205.1226 120000.0 205.1953 34000.0 206.0931 3100.0 207.1019 460000.0 211.1129 2500.0 211.1483 6800.0 213.0919 10000.0 213.1252 3100.0 214.0987 2600.0 215.107 230000.0 215.1791 3800.0 217.0857 17000.0 217.1225 34000.0 217.1956 17000.0 218.0948 3200.0 219.102 150000.0 219.1386 8600.0 221.1176 93000.0 221.6783 2600.0 227.1066 40000.0 229.123 46000.0 229.1591 9600.0 231.1021 42000.0 231.1393 10000.0 233.1176 120000.0 237.1267 2500.0 240.1136 2800.0 241.1234 18000.0 243.1387 13000.0 245.1174 71000.0 245.1416 3100.0 245.2264 29000.0 247.1335 41000.0 253.124 5300.0 254.1309 2700.0 255.1381 16000.0 257.1533 48000.0 259.1334 33000.0 259.242 53000.0 261.148 9700.0 269.1525 7300.0 271.1694 4000.0 273.1494 25000.0 275.1642 31000.0 281.2954 16000.0 282.2803 170000.0 283.1699 7600.0 287.1634 10000.0 301.1797 2700.0 310.8773 3500.0 338.357 3500.0 340.1745 2500.0 343.2319 2600.0 369.9068 2400.0 380.3418 2500.0 393.3571 2400.0 411.4879 2700.0 412.7444 2800.0 415.5596 2700.0 425.3041 28000.0 END IONS BEGIN IONS SCANS=887 PEPMASS=619.2919 CHARGE=1 COLLISION_ENERGY=0.0 68.8083 14000.0 68.8113 3400.0 74.5153 2300.0 74.6786 2300.0 78.8337 2400.0 78.909 2500.0 81.4614 2200.0 82.8791 2400.0 87.8254 2400.0 114.3 2300.0 124.4833 2600.0 129.3679 2300.0 145.6003 2500.0 154.8171 2300.0 168.5631 2400.0 173.5236 58000.0 173.5402 65000.0 204.2141 2300.0 225.2562 2400.0 302.0652 2500.0 302.2236 3000.0 343.2348 2500.0 351.9849 2700.0 376.2426 2600.0 396.894 2800.0 431.2225 12000.0 445.2025 3000.0 457.2026 22000.0 457.5622 2300.0 458.2076 74000.0 459.2186 98000.0 460.2217 6200.0 471.2177 26000.0 472.3056 2400.0 473.2323 13000.0 485.2326 22000.0 490.2287 3000.0 503.21 4700.0 513.2261 14000.0 518.2294 31000.0 519.2427 12000.0 521.8139 2900.0 531.241 43000.0 544.2447 2800.0 545.2569 8500.0 559.2701 700000.0 560.2755 43000.0 561.2844 34000.0 573.248 16000.0 587.2643 40000.0 591.267 53000.0 605.2751 4800.0 619.1743 10000.0 619.2906 490000.0 619.4112 4000.0 619.4407 8200.0 620.292 4700.0 END IONS BEGIN IONS SCANS=888 PEPMASS=643.2893 CHARGE=1 COLLISION_ENERGY=0.0 65.7348 2500.0 65.9516 2400.0 66.3471 2300.0 70.5919 2000.0 71.4757 57000.0 71.4788 12000.0 73.1333 2300.0 75.2584 2200.0 77.5602 2400.0 79.4135 2500.0 81.7168 2200.0 88.6314 2300.0 107.9206 2300.0 107.9725 2500.0 108.8737 2100.0 118.458 2500.0 120.1887 2100.0 122.3129 2300.0 129.3178 2300.0 156.9083 2100.0 157.3515 2600.0 163.814 2300.0 173.533 150000.0 173.5502 4700.0 173.5705 2800.0 183.253 2200.0 186.015 2500.0 190.0609 2600.0 196.4513 2300.0 244.3639 2500.0 292.0366 2600.0 309.0046 2900.0 309.9188 2500.0 317.1909 2500.0 362.566 2400.0 366.139 2500.0 404.4565 2300.0 447.6716 2600.0 469.1992 11000.0 483.2157 3400.0 507.0905 2600.0 514.4669 2900.0 527.2045 12000.0 536.5212 3200.0 537.225 3500.0 538.2271 2600.0 539.2404 86000.0 542.2311 7000.0 543.2354 3000.0 583.2661 25000.0 611.2657 17000.0 617.8308 2500.0 643.2888 1800000.0 END IONS BEGIN IONS SCANS=889 PEPMASS=621.3068 CHARGE=1 COLLISION_ENERGY=0.0 65.721 16000.0 65.9209 15000.0 69.0312 61000.0 69.035 370000.0 71.3075 21000.0 74.2613 14000.0 77.2839 14000.0 77.8764 18000.0 91.0264 17000.0 99.6694 8800.0 110.0459 10000.0 119.6691 8800.0 130.1258 19000.0 140.3165 29000.0 140.3264 57000.0 146.9892 9700.0 164.8265 18000.0 173.5211 63000.0 173.5357 430000.0 175.8194 10000.0 244.8217 20000.0 350.2942 18000.0 431.1855 89000.0 433.2382 410000.0 434.246 58000.0 445.1985 42000.0 446.2086 110000.0 447.2176 160000.0 449.9467 15000.0 459.2175 650000.0 460.2226 1800000.0 461.1585 32000.0 461.2326 1800000.0 462.2367 130000.0 473.2321 570000.0 474.2387 150000.0 475.2456 9900.0 487.248 460000.0 488.2122 57000.0 488.2231 31000.0 488.2535 53000.0 489.2589 64000.0 491.2128 34000.0 491.2239 11000.0 492.2504 200000.0 501.2253 9700.0 502.2323 14000.0 503.2444 77000.0 505.2254 200000.0 515.2426 330000.0 516.2461 13000.0 517.2601 180000.0 518.2351 12000.0 519.2444 130000.0 520.2442 680000.0 532.2485 39000.0 533.2562 1200000.0 534.2607 28000.0 543.2413 15000.0 546.2589 170000.0 547.27 590000.0 560.257 41000.0 561.0208 22000.0 561.0804 110000.0 561.1262 83000.0 561.2856 28000000.0 561.4885 190000.0 561.5485 36000.0 561.9056 12000.0 562.2891 1100000.0 565.2787 39000.0 572.2669 10000.0 575.2652 770000.0 578.2833 86000.0 588.277 22000.0 589.2779 470000.0 592.2695 180000.0 593.2912 1100000.0 606.2791 230000.0 621.3065 11000000.0 END IONS BEGIN IONS SCANS=890 PEPMASS=620.3004 CHARGE=1 COLLISION_ENERGY=0.0 64.1401 2500.0 65.3626 50000.0 65.3656 4900.0 67.2515 21000.0 67.2548 4800.0 68.709 4300.0 68.9209 53000.0 68.9244 8200.0 69.3127 2400.0 80.7185 4600.0 82.4499 4100.0 83.2196 2300.0 84.8509 4700.0 89.06 2700.0 89.6873 2500.0 105.6801 4200.0 108.1907 5000.0 111.0957 2400.0 114.8058 12000.0 114.8079 2700.0 116.4643 4600.0 117.5169 2900.0 128.9741 2500.0 133.0875 2800.0 136.5186 2300.0 140.3167 2400.0 140.3283 2300.0 146.5212 2200.0 156.6121 2800.0 163.0178 4400.0 165.588 2400.0 173.524 97000.0 173.5395 160000.0 194.8472 5800.0 221.8868 4900.0 241.9776 2800.0 251.3478 4600.0 256.9364 2300.0 268.2651 2500.0 268.3002 2500.0 277.1341 3400.0 297.0726 5700.0 322.7321 5400.0 385.9282 2400.0 388.2042 15000.0 391.7391 2800.0 400.2051 3200.0 401.212 20000.0 414.2181 7000.0 416.235 28000.0 421.8427 4500.0 424.1652 3000.0 431.1774 10000.0 432.2338 17000.0 433.2392 130000.0 434.246 4100.0 444.1947 25000.0 445.1985 16000.0 445.2434 7400.0 446.2064 3300.0 447.2549 65000.0 451.7973 4800.0 457.8624 5500.0 459.069 14000.0 459.1588 17000.0 459.2184 5500000.0 460.2262 640000.0 460.2937 9600.0 461.1582 5300.0 461.2339 500000.0 462.2755 21000.0 471.2192 3200.0 473.2336 230000.0 474.2412 30000.0 475.2419 2800.0 475.2527 3400.0 476.2203 33000.0 477.2281 10000.0 486.2408 51000.0 487.2167 430000.0 488.2559 200000.0 489.2612 3400.0 489.2712 4700.0 489.9861 4700.0 491.244 160000.0 492.252 140000.0 500.2201 40000.0 501.2286 160000.0 503.2423 17000.0 504.2177 4100.0 504.2435 4000.0 505.2277 71000.0 505.2574 5700.0 514.2356 30000.0 515.2447 76000.0 516.2512 25000.0 517.2567 61000.0 518.2317 9300.0 519.0042 3100.0 519.1621 4200.0 519.2408 3500000.0 520.2738 58000.0 520.3782 4700.0 524.3839 3300.0 531.2382 44000.0 532.2503 60000.0 532.6578 2700.0 533.2589 330000.0 534.2984 12000.0 542.2325 28000.0 544.2834 2800.0 545.2551 420000.0 546.2636 43000.0 547.2688 80000.0 548.2724 5400.0 549.2828 32000.0 559.2634 33000.0 560.2784 800000.0 561.0797 8500.0 561.2107 63000.0 561.2867 5300000.0 561.4897 7200.0 563.2545 5100.0 571.2703 65000.0 573.2503 48000.0 575.2472 4100.0 577.2777 260000.0 578.2885 20000.0 587.2672 3300.0 588.1917 2600.0 588.2738 1200000.0 589.2806 9200.0 590.2529 150000.0 591.264 83000.0 592.2802 110000.0 605.1616 5200.0 605.2763 840000.0 605.3904 4400.0 619.2906 34000.0 620.1842 9400.0 620.2997 1800000.0 621.3072 68000.0 END IONS BEGIN IONS SCANS=891 PEPMASS=796.5939 CHARGE=1 COLLISION_ENERGY=0.0 71.0488 50000.0 71.0851 130000.0 71.3874 2700.0 71.998 2100.0 72.862 4300.0 73.0279 9900.0 75.953 2300.0 77.2975 2600.0 79.0538 580000.0 79.4648 2600.0 79.5068 2100.0 80.875 2200.0 81.0694 3000000.0 81.0777 23000.0 82.7949 2800.0 83.0488 67000.0 83.085 1100000.0 85.0279 100000.0 85.0643 120000.0 85.1008 110000.0 87.5771 2400.0 89.6362 2600.0 90.0749 2600.0 90.7958 2300.0 91.0386 39000.0 91.0538 350000.0 93.0694 950000.0 93.5416 2200.0 95.0488 51000.0 95.075 2600.0 95.0851 3000000.0 95.568 2800.0 96.9925 3300.0 97.028 52000.0 97.0643 250000.0 97.1007 860000.0 97.4474 2300.0 98.9511 2800.0 99.08 170000.0 99.99 2500.0 101.0591 20000.0 102.9032 2100.0 102.983 2200.0 104.9241 2700.0 105.0694 420000.0 107.0775 5300.0 107.085 830000.0 107.2744 2300.0 107.4773 2800.0 109.0643 25000.0 109.1007 1800000.0 109.1377 2300.0 110.1134 2300.0 111.08 200000.0 111.1162 240000.0 112.327 2900.0 113.073 2200.0 113.0956 100000.0 115.0743 6200.0 116.543 2200.0 116.7333 2200.0 117.0694 52000.0 118.7096 2900.0 119.0767 9200.0 119.085 520000.0 119.3248 5700.0 121.0918 15000.0 121.1006 1100000.0 121.7474 2700.0 123.0802 69000.0 123.107 32000.0 123.1163 1000000.0 124.7649 2700.0 125.0955 140000.0 125.1322 23000.0 127.0381 3400.0 127.075 5500.0 127.1115 32000.0 130.3658 2700.0 130.8887 2700.0 131.085 200000.0 131.9193 2200.0 132.6467 2500.0 133.0905 25000.0 133.1006 690000.0 135.1056 7900.0 135.1163 820000.0 135.1285 5100.0 137.0956 100000.0 137.1222 8800.0 137.1319 470000.0 139.1113 120000.0 141.1269 8200.0 143.0847 6800.0 143.1181 2600.0 145.049 3200.0 145.1006 180000.0 147.1057 2900.0 147.1163 580000.0 148.1604 2500.0 149.096 11000.0 149.1199 22000.0 149.1319 650000.0 151.1111 89000.0 151.1477 270000.0 151.1894 2400.0 151.6128 3000.0 153.1268 100000.0 153.2122 2800.0 154.1496 2300.0 154.7342 2700.0 155.1423 2800.0 157.1012 11000.0 157.5455 2400.0 159.1163 170000.0 161.1183 4700.0 161.132 610000.0 161.3319 3100.0 163.1128 8900.0 163.1326 3500.0 163.1476 570000.0 165.1272 71000.0 165.1634 150000.0 167.1429 57000.0 171.1164 33000.0 173.1322 180000.0 173.52 9200.0 173.5301 470000.0 173.5444 80000.0 173.7505 2900.0 173.9792 2500.0 175.1479 460000.0 177.127 4200.0 177.1635 230000.0 179.1427 65000.0 179.179 68000.0 181.1583 49000.0 185.132 36000.0 187.1479 130000.0 189.1634 220000.0 191.1791 77000.0 193.1586 47000.0 195.1746 8300.0 197.1334 2800.0 199.1484 9400.0 201.1635 60000.0 201.5807 2600.0 203.1793 85000.0 205.1588 10000.0 205.195 34000.0 207.1742 39000.0 207.2104 3300.0 207.6523 2500.0 208.9484 3100.0 213.1654 2700.0 215.179 37000.0 215.657 2400.0 217.195 46000.0 219.1732 2600.0 219.2107 27000.0 221.1898 20000.0 221.2255 7100.0 223.1705 5200.0 227.1636 4100.0 229.1944 5600.0 231.173 2600.0 231.2112 9400.0 233.1904 5400.0 233.226 45000.0 235.2415 3000.0 235.4607 2600.0 236.8218 2600.0 243.2103 190000.0 245.226 510000.0 246.4839 2700.0 247.2408 44000.0 249.1849 5800.0 251.5373 2500.0 257.2246 6300.0 258.9561 2900.0 259.2026 2700.0 261.2208 310000.0 261.2518 10000.0 263.2038 18000.0 263.2364 820000.0 265.2528 10000.0 271.2406 3800.0 271.3033 3200.0 273.2559 3100.0 273.3317 2600.0 275.2364 73000.0 277.2171 5300.0 277.2479 5400.0 279.2305 9200.0 281.8064 3100.0 287.2387 2900.0 289.2148 2500.0 289.2529 55000.0 291.2325 2800.0 293.2479 11000.0 294.2795 4500.0 301.2527 11000.0 303.2301 3200.0 303.268 40000.0 305.2478 3100.0 310.5408 6100.0 315.1045 2600.0 317.2474 21000.0 317.2835 8200.0 319.2632 67000.0 321.2781 3200.0 326.6966 2800.0 331.261 6800.0 331.2996 6300.0 335.258 190000.0 337.2265 11000.0 337.2736 9000000.0 337.321 3000.0 337.369 3600.0 337.397 3500.0 339.2891 410000.0 347.2961 3400.0 349.2763 2900.0 359.3315 7900.0 365.264 2600.0 373.3458 14000.0 387.3647 18000.0 401.3772 5500.0 405.3769 2600.0 427.3549 2800.0 441.3667 6000.0 442.0201 5600.0 446.5235 2300.0 459.3871 2600.0 475.8719 2400.0 492.2736 2200.0 507.4565 6800.0 512.4795 3000.0 525.4655 140000.0 526.8559 5200.0 543.478 61000.0 591.5057 2500.0 596.9152 2500.0 599.4077 2100.0 599.5037 800000.0 599.6013 3200.0 617.514 66000.0 621.5573 4600.0 629.657 2800.0 727.3373 5300.0 743.4796 2500.0 748.693 2200.0 785.3446 2600.0 END IONS BEGIN IONS SCANS=892 PEPMASS=801.5494 CHARGE=1 COLLISION_ENERGY=0.0 72.109 2400.0 72.7714 2300.0 73.0278 82000.0 74.7756 2200.0 74.923 2400.0 75.4935 2300.0 75.956 2500.0 79.0537 17000.0 79.541 2400.0 80.6997 2100.0 81.0331 29000.0 81.0692 170000.0 83.085 52000.0 83.5915 2200.0 85.0277 200000.0 85.7257 2300.0 86.3228 2300.0 87.0437 9000.0 89.0571 9200.0 89.0613 140000.0 89.1001 2200.0 90.6385 2300.0 91.0382 170000.0 91.0537 5500.0 93.0694 26000.0 93.8461 2400.0 95.0848 170000.0 97.0277 180000.0 97.1005 34000.0 97.3843 2900.0 99.0434 33000.0 99.0801 2500.0 100.0667 2300.0 101.0225 70000.0 101.242 2100.0 101.3743 2400.0 101.8093 2500.0 103.0384 17000.0 103.7509 2500.0 105.0693 2400.0 106.3043 2400.0 107.0849 34000.0 107.3263 5300.0 107.8568 2400.0 109.0278 25000.0 109.1005 96000.0 109.8892 2200.0 110.1942 2200.0 111.3114 2300.0 113.5985 2300.0 115.0382 11000.0 115.4727 2800.0 117.5908 3000.0 119.085 8800.0 119.3898 2400.0 121.1004 38000.0 123.1161 57000.0 125.0507 2800.0 127.0382 120000.0 127.5055 3000.0 128.2069 2300.0 129.0533 2800.0 129.7838 2600.0 130.9809 2500.0 131.0056 2600.0 131.8177 2700.0 133.1005 26000.0 135.1162 21000.0 137.1317 21000.0 139.9716 2400.0 141.4321 2700.0 145.0488 31000.0 146.3627 2600.0 147.116 21000.0 149.1321 6800.0 149.6884 5400.0 150.0607 2400.0 150.6658 2300.0 155.172 2400.0 159.2484 2500.0 160.1483 2500.0 161.132 21000.0 161.1944 2500.0 161.4474 2200.0 163.1475 13000.0 167.7406 2300.0 167.813 2300.0 168.2527 2300.0 169.1961 2600.0 169.26 2400.0 171.6676 2600.0 173.4814 2800.0 173.5019 5000.0 173.5135 7400.0 173.5214 80000.0 173.5285 150000.0 173.5377 330000.0 173.5493 15000.0 174.5828 2500.0 174.9967 2200.0 175.1481 15000.0 183.0646 15000.0 185.0413 130000.0 189.1628 2800.0 191.714 2500.0 193.1586 2700.0 200.2559 2700.0 201.0737 2400.0 203.0522 74000.0 206.287 2300.0 215.7881 2600.0 218.8973 2300.0 220.175 3000.0 221.3977 2400.0 243.083 190000.0 245.2261 41000.0 248.631 2700.0 248.8231 2400.0 263.2361 110000.0 267.5798 2400.0 268.4493 2500.0 269.278 2300.0 277.6866 3100.0 280.4324 2400.0 286.46 3000.0 291.0696 2200.0 292.8412 2800.0 303.2303 3800.0 305.4133 2500.0 306.187 2400.0 306.735 2700.0 308.9026 2700.0 317.8103 2500.0 337.2729 430000.0 343.3186 2500.0 346.9401 2300.0 365.2676 16000.0 377.7772 2800.0 393.8593 2600.0 399.0658 2600.0 421.5227 2800.0 442.5502 2300.0 446.0921 2500.0 451.7335 2600.0 480.2709 2600.0 493.9192 2400.0 499.3267 44000.0 512.9623 2400.0 521.237 7800.0 521.308 5400000.0 521.3955 4700.0 528.5768 2600.0 534.6191 2900.0 542.6381 2600.0 549.1141 2500.0 557.7511 2600.0 577.9202 2500.0 607.1112 2500.0 626.2878 2900.0 639.4945 41000.0 643.6057 2800.0 651.2961 2800.0 701.5363 2500.0 732.0976 3200.0 738.7349 2800.0 763.4907 2800.0 766.5982 2800.0 776.0019 2600.0 801.3745 25000.0 801.5481 3700000.0 801.722 34000.0 808.9143 2500.0 END IONS BEGIN IONS SCANS=893 PEPMASS=635.3225 CHARGE=1 COLLISION_ENERGY=0.0 67.4781 2500.0 70.5885 120000.0 70.5925 280000.0 78.3703 2700.0 99.1407 14000.0 100.9383 15000.0 106.6228 2400.0 109.0046 2400.0 140.2811 8400.0 140.3156 2700.0 140.3261 3100.0 148.6977 15000.0 158.8238 22000.0 158.8373 23000.0 173.5244 210000.0 173.5415 180000.0 187.6907 14000.0 209.2881 7600.0 213.6689 17000.0 261.3384 9500.0 262.3392 17000.0 333.8257 2400.0 419.1833 16000.0 431.1876 49000.0 433.238 120000.0 434.2457 55000.0 435.2552 27000.0 445.1957 3200.0 446.2089 62000.0 447.2178 170000.0 448.2612 3500.0 451.9113 10000.0 459.2179 240000.0 460.2237 570000.0 461.1592 22000.0 461.2332 700000.0 462.2392 95000.0 473.2327 280000.0 474.2397 52000.0 475.2502 18000.0 480.5093 16000.0 487.2488 220000.0 488.2564 34000.0 489.2638 64000.0 491.2426 3400.0 501.2271 6800.0 502.2255 20000.0 505.2259 17000.0 505.2373 24000.0 506.2644 56000.0 507.2721 4700.0 515.2437 140000.0 516.2508 20000.0 517.2605 150000.0 519.2408 70000.0 520.2771 58000.0 529.2161 2600.0 532.2468 26000.0 533.2561 550000.0 534.2593 240000.0 535.2746 220000.0 546.2665 56000.0 547.2691 3600.0 548.2734 26000.0 560.2477 25000.0 561.286 9100000.0 561.4899 35000.0 562.2899 410000.0 563.1966 13000.0 563.3017 2100000.0 575.2652 40000.0 579.2913 3500.0 589.2805 530000.0 591.259 2800.0 593.3142 3100.0 605.273 3000.0 606.2823 97000.0 607.2958 740000.0 620.2991 79000.0 635.3223 9700000.0 635.5631 8100.0 END IONS BEGIN IONS SCANS=894 PEPMASS=567.42 CHARGE=1 COLLISION_ENERGY=0.0 65.0385 26000.0 65.748 3100.0 67.0541 270000.0 67.1603 3400.0 68.0264 2900.0 69.0334 92000.0 69.0698 260000.0 70.4077 5900.0 71.0491 69000.0 75.3013 3500.0 77.0388 27000.0 77.2161 3200.0 79.0542 390000.0 80.0045 3100.0 81.0619 7200.0 81.0698 1100000.0 81.0742 5500.0 82.0986 3600.0 82.1935 5700.0 83.0491 140000.0 83.0855 140000.0 85.0648 34000.0 86.4394 3300.0 91.0542 420000.0 91.059 3700.0 91.0607 6600.0 93.063 13000.0 93.0698 1300000.0 95.0491 200000.0 95.0785 5700.0 95.0855 720000.0 95.0927 7700.0 97.0648 200000.0 97.1013 22000.0 99.0297 3100.0 103.0544 35000.0 105.0444 21000.0 105.0698 1900000.0 105.0782 8700.0 106.0784 8200.0 106.2036 3400.0 107.0491 14000.0 107.0734 8000.0 107.0855 1200000.0 107.0929 15000.0 108.0407 3100.0 109.0647 120000.0 109.1011 930000.0 110.4826 3500.0 111.0803 280000.0 115.0545 34000.0 116.0622 7600.0 117.0698 190000.0 119.0495 3200.0 119.0603 3900.0 119.0651 4300.0 119.0855 2100000.0 120.0929 18000.0 121.0647 56000.0 121.1011 1900000.0 121.1114 6400.0 122.0727 15000.0 123.0803 160000.0 123.1167 260000.0 125.0961 120000.0 128.062 45000.0 129.0699 98000.0 130.0776 47000.0 131.0768 4500.0 131.0855 640000.0 131.0966 11000.0 132.093 35000.0 133.0643 24000.0 133.0771 8800.0 133.0892 20000.0 133.1011 1800000.0 134.1087 5900.0 135.0803 110000.0 135.1167 710000.0 135.1269 2700.0 137.096 550000.0 137.1057 4200.0 137.1325 21000.0 138.1044 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181.1012 220000.0 181.1195 9200.0 182.1091 110000.0 183.1169 470000.0 184.1244 63000.0 185.097 22000.0 185.1326 470000.0 185.1516 11000.0 186.1399 33000.0 187.1117 37000.0 187.1482 280000.0 189.1272 53000.0 189.1638 27000.0 191.1431 71000.0 192.0928 11000.0 193.1013 130000.0 193.1587 6400.0 194.109 120000.0 195.0965 7500.0 195.1168 410000.0 196.1245 160000.0 197.1325 620000.0 197.1629 4400.0 198.1402 57000.0 199.112 32000.0 199.1481 350000.0 200.156 15000.0 201.1276 33000.0 201.1638 110000.0 203.1431 53000.0 205.1019 19000.0 205.1589 12000.0 206.1092 63000.0 207.1169 210000.0 208.1247 120000.0 209.1099 7100.0 209.1326 530000.0 209.1504 2300.0 210.1404 95000.0 210.7117 3400.0 211.1126 22000.0 211.1483 450000.0 211.1716 7300.0 212.1556 35000.0 213.1275 70000.0 213.1637 99000.0 215.1435 32000.0 217.1588 24000.0 219.1172 54000.0 220.1245 61000.0 221.1326 290000.0 221.1547 18000.0 222.1407 71000.0 223.111 5200.0 223.1482 350000.0 224.1554 41000.0 225.1275 14000.0 225.1639 130000.0 225.4743 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286.1688 4100.0 287.1791 49000.0 288.188 7000.0 289.1952 59000.0 290.2044 4900.0 291.1767 5200.0 291.211 49000.0 292.1819 3700.0 293.1909 4600.0 295.2069 14000.0 299.1804 11000.0 301.1965 30000.0 302.202 5500.0 303.2104 15000.0 305.2261 13000.0 313.195 23000.0 315.211 39000.0 317.2259 35000.0 319.2045 4400.0 319.2415 23000.0 320.2522 4200.0 325.1955 4400.0 327.2111 5700.0 329.228 4900.0 330.2335 14000.0 331.2398 22000.0 333.2219 12000.0 335.2375 3500.0 341.2256 22000.0 343.2423 27000.0 348.243 22000.0 350.2577 4000.0 355.2434 5000.0 357.257 4400.0 361.2526 8500.0 369.2543 3800.0 411.3073 7100.0 452.6557 6200.0 464.9594 4200.0 495.7991 5600.0 END IONS BEGIN IONS SCANS=895 PEPMASS=566.4119 CHARGE=1 COLLISION_ENERGY=0.0 64.9202 2500.0 69.0698 2800.0 76.7149 2500.0 78.2498 2400.0 79.054 7400.0 81.0695 22000.0 83.0852 2500.0 84.9773 2400.0 91.0542 7200.0 91.4796 2400.0 92.2965 3000.0 93.0695 27000.0 95.049 10000.0 95.0852 25000.0 96.4002 2700.0 97.0644 19000.0 97.9607 2400.0 100.2876 2100.0 103.6328 2500.0 105.0695 35000.0 107.0852 35000.0 109.0643 2500.0 109.1007 22000.0 112.867 2500.0 113.0958 9600.0 119.0852 53000.0 120.0932 2700.0 121.1009 31000.0 123.0802 18000.0 123.1167 2900.0 131.0852 24000.0 133.1008 41000.0 135.1165 14000.0 137.0957 5000.0 139.1118 8700.0 143.0851 28000.0 144.093 4600.0 145.1008 74000.0 146.1086 2600.0 147.0806 3800.0 147.1164 22000.0 149.6839 4900.0 149.6943 5400.0 155.085 8300.0 155.5004 2600.0 156.0932 3300.0 157.1008 45000.0 158.1081 9000.0 159.1167 35000.0 160.089 4400.0 161.0958 9600.0 163.1114 3200.0 169.1009 24000.0 169.118 2500.0 170.1092 4500.0 171.1167 26000.0 173.1321 21000.0 173.5274 45000.0 173.5432 12000.0 175.148 8300.0 179.1428 9500.0 181.1013 16000.0 181.1217 6300.0 183.1163 25000.0 185.0961 2600.0 185.1324 15000.0 186.9882 2400.0 187.1481 8400.0 195.1168 24000.0 196.1248 5200.0 197.1325 28000.0 199.1123 3500.0 199.1482 14000.0 203.1435 2600.0 205.1598 2600.0 205.5273 2800.0 207.1167 15000.0 209.1323 30000.0 210.1399 3900.0 211.1133 3200.0 211.148 17000.0 219.1159 3100.0 221.1325 12000.0 221.1536 12000.0 223.1478 12000.0 225.1284 3600.0 225.1638 6500.0 227.1432 3000.0 233.1325 3000.0 235.1472 14000.0 237.163 7700.0 241.1583 3300.0 247.1478 5100.0 251.1805 4100.0 263.1795 4000.0 275.1784 3800.0 282.2795 16000.0 283.2828 17000.0 285.1852 2700.0 289.1979 2700.0 299.2031 3900.0 310.31 17000.0 311.3147 21000.0 341.9279 3000.0 504.7094 2400.0 552.4758 2400.0 END IONS BEGIN IONS SCANS=896 PEPMASS=584.4214 CHARGE=1 COLLISION_ENERGY=0.0 65.0776 2200.0 65.7599 2000.0 67.0539 53000.0 68.9518 2600.0 69.0331 15000.0 69.0696 57000.0 70.5442 2100.0 70.8409 2200.0 71.0489 18000.0 73.0281 2500.0 77.0386 2800.0 78.1465 2300.0 79.0539 82000.0 79.8558 2300.0 80.0619 26000.0 81.0695 220000.0 81.6004 2300.0 82.0728 5200.0 83.0488 41000.0 83.0852 49000.0 84.0888 3000.0 85.0645 10000.0 87.0437 10000.0 89.0593 150000.0 90.8272 2300.0 91.054 74000.0 91.8434 2500.0 93.0638 3700.0 93.0695 270000.0 93.4001 2400.0 93.5428 2500.0 94.0726 6800.0 95.0489 79000.0 95.0852 170000.0 96.0886 3100.0 97.0644 97000.0 98.0681 3500.0 100.5944 2500.0 105.0617 3100.0 105.0695 320000.0 106.0728 13000.0 107.0852 260000.0 108.0889 11000.0 109.0645 38000.0 109.1009 190000.0 110.1045 4700.0 111.0801 31000.0 111.1166 3100.0 113.0958 43000.0 114.0591 2300.0 117.0236 2600.0 117.0697 41000.0 119.0761 7400.0 119.0852 440000.0 119.0955 2600.0 120.0901 20000.0 120.0924 2500.0 120.7373 2500.0 121.0646 24000.0 121.0913 3000.0 121.1008 320000.0 122.1043 21000.0 122.4192 2400.0 123.0801 160000.0 123.1165 39000.0 124.4682 2300.0 125.0958 37000.0 127.0657 2700.0 128.0619 10000.0 129.0696 30000.0 130.0774 7800.0 131.0852 200000.0 131.0964 3300.0 132.0926 41000.0 133.0651 2800.0 133.0857 76000.0 133.1009 320000.0 134.1071 18000.0 135.0803 43000.0 135.1166 100000.0 137.0957 74000.0 138.1031 20000.0 139.1115 86000.0 140.1146 8900.0 141.0696 6000.0 142.0775 16000.0 143.0853 190000.0 144.0928 56000.0 145.0648 16000.0 145.089 3700.0 145.1009 520000.0 145.1144 5600.0 146.1066 46000.0 147.0801 41000.0 147.1165 210000.0 148.1199 31000.0 149.0957 43000.0 149.1322 18000.0 149.6775 3200.0 149.6883 6400.0 150.1042 2600.0 151.075 7600.0 151.1114 20000.0 153.1275 6100.0 154.1315 3100.0 155.0851 43000.0 155.1064 30000.0 156.0928 36000.0 156.2641 2700.0 157.0865 2700.0 157.1009 330000.0 158.1079 76000.0 159.0803 35000.0 159.1166 260000.0 160.0739 3800.0 160.088 230000.0 160.1213 13000.0 161.0961 55000.0 161.1322 57000.0 163.1113 38000.0 165.091 55000.0 165.1275 4100.0 166.0937 2600.0 167.0888 4400.0 167.1064 140000.0 168.092 2700.0 169.1011 130000.0 170.1081 40000.0 171.1167 230000.0 172.1228 27000.0 173.096 18000.0 173.1324 150000.0 173.5232 14000.0 173.5358 100000.0 174.1368 15000.0 175.1117 33000.0 175.1481 64000.0 177.112 3700.0 177.1278 10000.0 179.1426 9800.0 181.101 52000.0 181.122 53000.0 181.9293 3100.0 182.1084 23000.0 182.1261 7700.0 183.1167 150000.0 184.1236 31000.0 185.0955 12000.0 185.1324 160000.0 186.1391 27000.0 187.1114 19000.0 187.148 70000.0 188.1179 3100.0 189.1278 27000.0 189.1633 3000.0 190.1338 7400.0 191.1428 39000.0 193.1011 22000.0 193.1224 4900.0 194.1083 17000.0 195.1167 120000.0 195.1367 9900.0 196.1237 40000.0 197.1323 210000.0 198.1387 33000.0 199.1121 11000.0 199.148 100000.0 200.1535 12000.0 201.1276 23000.0 201.1638 26000.0 203.1432 56000.0 205.1593 12000.0 206.1098 3400.0 207.1167 52000.0 207.1382 11000.0 208.1238 27000.0 208.1445 7300.0 209.1324 150000.0 209.1513 3400.0 210.1391 43000.0 211.1483 130000.0 212.1531 21000.0 213.1278 25000.0 213.1638 42000.0 215.1428 18000.0 217.1592 7100.0 219.1165 9300.0 219.1376 3100.0 221.1322 55000.0 221.1541 75000.0 222.1373 12000.0 222.159 4300.0 223.1481 98000.0 224.1549 19000.0 225.1274 10000.0 225.1637 60000.0 226.1707 3000.0 227.1432 14000.0 227.1798 6800.0 228.151 2700.0 229.1581 8100.0 233.1319 18000.0 233.1559 8200.0 234.1393 5400.0 235.1482 56000.0 236.1532 7800.0 236.2048 2600.0 237.1638 56000.0 238.1676 3700.0 239.1424 6900.0 239.1793 24000.0 241.1589 3100.0 241.1944 7500.0 246.1615 20000.0 247.1468 18000.0 247.1707 12000.0 249.1639 40000.0 250.1696 6600.0 251.1789 25000.0 252.1509 2600.0 252.1872 2900.0 253.1601 2600.0 253.1945 14000.0 255.1731 5700.0 255.8519 3000.0 259.1703 9800.0 260.1534 5000.0 261.0308 2600.0 261.1629 25000.0 262.1684 3700.0 263.1787 26000.0 264.1855 2700.0 265.1956 21000.0 266.2025 6600.0 267.1742 6300.0 269.1905 11000.0 271.1704 8700.0 272.176 2700.0 273.1629 3200.0 274.1933 3400.0 275.18 14000.0 277.195 11000.0 278.3087 2900.0 279.176 4400.0 279.2105 4700.0 281.19 6700.0 283.2052 2600.0 285.1852 18000.0 286.1928 21000.0 287.2022 16000.0 289.1958 9400.0 291.2108 3800.0 296.8914 2700.0 297.1862 3500.0 299.201 25000.0 300.2073 5300.0 303.2108 5900.0 311.2014 7400.0 312.2063 3700.0 325.2136 6400.0 337.2172 6100.0 352.2396 20000.0 353.2483 6700.0 354.2545 2500.0 365.2475 29000.0 366.2583 3000.0 469.139 2800.0 492.3564 7400.0 509.9944 2600.0 521.1894 3000.0 528.0188 2500.0 536.2395 2600.0 549.8351 3000.0 END IONS BEGIN IONS SCANS=897 PEPMASS=613.4233 CHARGE=1 COLLISION_ENERGY=0.0 67.0542 4600.0 69.0696 6400.0 79.0539 8900.0 80.0615 2300.0 81.0696 17000.0 83.0853 3100.0 88.3874 2200.0 91.0541 5300.0 93.0696 22000.0 95.0489 4900.0 95.0851 14000.0 97.0645 3500.0 105.0695 30000.0 107.0852 26000.0 109.0646 4300.0 109.1008 18000.0 112.8976 2200.0 119.0851 43000.0 121.1009 32000.0 123.0803 7100.0 123.1164 4500.0 124.0839 3200.0 125.0961 5100.0 129.0695 2500.0 131.0853 17000.0 132.0923 3200.0 133.1009 33000.0 134.1037 4700.0 135.1165 9100.0 137.0957 4900.0 138.1032 2700.0 142.0778 4200.0 143.0851 14000.0 145.1008 43000.0 146.1046 4000.0 147.1165 21000.0 149.0955 3500.0 149.1315 3100.0 151.1112 3700.0 155.0845 3200.0 157.1009 27000.0 158.1058 5200.0 159.1164 24000.0 160.1216 3100.0 161.0953 5800.0 161.132 3300.0 169.1011 9800.0 170.1069 3600.0 171.1163 21000.0 172.121 6100.0 173.1324 21000.0 173.5244 17000.0 173.5432 11000.0 175.111 3000.0 175.148 11000.0 181.1015 4300.0 182.1068 5400.0 183.1164 11000.0 184.1229 5500.0 185.1321 10000.0 187.1475 5500.0 191.1427 3400.0 193.102 6000.0 195.117 11000.0 196.1227 6800.0 197.1322 16000.0 198.1369 5500.0 199.1476 14000.0 207.1167 5500.0 208.122 3200.0 209.1322 15000.0 210.1386 6600.0 211.1484 13000.0 212.1518 5100.0 217.1605 3800.0 221.1324 7300.0 222.1419 3300.0 223.1478 6700.0 224.1548 4200.0 225.1635 4800.0 233.1313 2700.0 235.1484 6300.0 237.1628 7300.0 238.1677 2900.0 247.1479 4900.0 249.1634 3300.0 251.1797 5000.0 261.1625 3700.0 263.1787 2700.0 264.1851 2700.0 295.2061 2900.0 388.3653 2300.0 549.9994 2400.0 END IONS BEGIN IONS SCANS=898 PEPMASS=612.4174 CHARGE=1 COLLISION_ENERGY=0.0 65.804 2400.0 66.3626 2800.0 66.5446 2300.0 67.054 5000.0 71.8813 2400.0 78.9624 2600.0 79.0542 9400.0 81.0695 39000.0 82.0768 2500.0 83.0488 8400.0 83.0854 8000.0 91.0539 17000.0 93.0695 54000.0 95.0489 26000.0 95.0852 29000.0 97.0642 7200.0 97.1492 2500.0 99.0437 17000.0 100.5189 2200.0 104.6006 2500.0 105.0695 62000.0 107.0851 63000.0 109.0645 11000.0 109.1009 29000.0 117.0697 11000.0 117.4156 2600.0 119.0851 100000.0 119.2731 2400.0 120.0929 7200.0 121.0645 2800.0 121.1008 57000.0 123.08 51000.0 125.0955 26000.0 129.0695 3600.0 130.078 2400.0 131.0853 47000.0 132.0929 31000.0 133.1008 92000.0 134.2142 2300.0 135.08 9200.0 135.1166 21000.0 137.0955 18000.0 138.1035 13000.0 143.0852 49000.0 144.093 20000.0 145.1008 150000.0 146.109 11000.0 147.0801 6800.0 147.1164 49000.0 149.0956 18000.0 155.0853 15000.0 156.0927 9400.0 157.1009 96000.0 158.1083 25000.0 159.1165 70000.0 160.1242 3100.0 161.0957 14000.0 161.1322 3300.0 163.1118 3500.0 167.0847 3200.0 169.101 45000.0 170.1088 9500.0 170.2861 2300.0 171.1166 71000.0 172.1242 7500.0 173.0961 11000.0 173.1323 45000.0 173.5288 47000.0 173.5399 38000.0 174.5016 2800.0 175.1112 2900.0 175.1492 4900.0 176.1201 2500.0 177.1278 2700.0 181.1011 20000.0 182.1091 2800.0 183.1166 50000.0 184.1238 12000.0 185.1321 52000.0 186.1412 2600.0 187.1475 6200.0 189.1273 11000.0 191.1426 24000.0 193.1001 4300.0 195.1166 45000.0 196.1247 14000.0 197.1324 65000.0 198.1402 8400.0 198.1652 2400.0 199.1129 6700.0 199.1481 43000.0 199.3868 2800.0 199.4339 2800.0 203.1425 3200.0 207.1165 21000.0 208.1257 7100.0 209.1324 68000.0 210.14 9500.0 211.1481 64000.0 211.1691 3400.0 213.1279 3400.0 213.1636 4000.0 215.1434 7100.0 217.1576 2900.0 220.1243 2500.0 221.1327 18000.0 223.148 36000.0 224.1562 6400.0 225.164 11000.0 233.1313 3400.0 233.1546 7000.0 235.1481 17000.0 236.1536 2700.0 237.1637 46000.0 239.1445 3100.0 239.1771 3000.0 247.1481 8200.0 249.1638 12000.0 250.1703 3300.0 251.178 7500.0 252.1869 9400.0 253.1963 3600.0 261.1628 9400.0 263.1778 9500.0 265.196 2800.0 275.1776 3400.0 276.1871 3700.0 277.1943 3900.0 298.1923 21000.0 302.1332 2400.0 303.2107 3100.0 326.1895 2800.0 329.2253 2700.0 390.2565 12000.0 436.2928 2700.0 442.9029 2600.0 474.308 3000.0 488.3394 2800.0 508.0648 2600.0 528.3597 3700.0 END IONS nf_output/clustering/spectra_filtered.mgf0000644000000000000000000574144614664572142020030 0ustar rootrootBEGIN IONS SCANS=1 PEPMASS=235.9524 CHARGE=1 COLLISION_ENERGY=0.0 43.5593 2300.0 43.9654 2600.0 44.256 2100.0 44.9044 2200.0 46.567 2100.0 48.4572 2300.0 48.6547 2700.0 48.8895 2600.0 50.486 2300.0 51.2272 2200.0 52.0672 2500.0 52.5885 2600.0 53.3828 2100.0 54.4275 2100.0 54.91 2600.0 55.9312 2200.0 61.1137 2400.0 61.9921 2400.0 64.2207 2100.0 65.9713 3200.0 70.7143 2300.0 73.0177 2600.0 77.0079 2500.0 77.8837 2100.0 77.9067 2500.0 84.9594 65000.0 85.9632 2300.0 90.6383 2300.0 91.259 2100.0 95.048 3000.0 98.8067 2300.0 100.0249 2400.0 102.9234 2300.0 110.202 2700.0 110.4236 2500.0 120.9262 3200.0 132.7252 2500.0 136.0747 2200.0 138.8332 2500.0 138.9359 10000.0 142.7536 2800.0 147.8078 2600.0 148.9201 6700.0 151.7258 2400.0 156.946 150000.0 158.6869 2600.0 166.9306 73000.0 167.02 2900.0 167.8346 2500.0 173.5263 45000.0 173.5395 23000.0 174.9567 640000.0 174.9743 4800.0 176.9606 6100.0 179.9319 8100.0 184.941 1500000.0 185.0304 2600.0 192.9674 60000.0 193.9466 3900.0 194.9247 17000.0 197.9429 8500.0 202.9517 940000.0 207.9557 2600.0 212.9128 4700.0 212.9362 490000.0 216.1402 2300.0 219.9713 2700.0 220.9625 13000.0 225.9664 2600.0 230.9473 30000.0 END IONS BEGIN IONS SCANS=2 PEPMASS=263.9472 CHARGE=1 COLLISION_ENERGY=0.0 47.0957 2200.0 47.7695 2400.0 48.6271 2100.0 50.2298 2400.0 50.3996 2400.0 51.5364 2100.0 52.1325 2400.0 53.1324 2100.0 54.9428 2600.0 54.9734 2700.0 55.3566 2600.0 55.3648 2100.0 56.8451 2200.0 59.7586 2100.0 60.0408 2300.0 60.1979 2500.0 61.214 2600.0 61.3243 2400.0 61.5577 2600.0 62.043 2400.0 63.0195 2300.0 63.1772 2300.0 66.8465 2400.0 71.1533 2500.0 72.967 2700.0 73.8366 2200.0 75.7267 2100.0 79.822 2400.0 82.0134 2100.0 82.5601 2800.0 86.9925 35000.0 87.056 2300.0 87.6401 2400.0 88.013 2300.0 88.0848 2800.0 90.4219 2300.0 92.2658 2500.0 93.581 2300.0 94.4739 2100.0 101.7689 2200.0 102.6104 2200.0 103.5928 2400.0 105.0031 46000.0 108.9028 2300.0 110.9832 2600.0 114.883 2500.0 120.9262 2300.0 121.5987 2800.0 122.6222 2600.0 124.335 2700.0 132.9978 11000.0 134.2612 2600.0 134.8756 2900.0 141.6246 2600.0 144.0744 2700.0 150.6184 2200.0 156.9461 69000.0 163.9585 2400.0 166.9306 75000.0 173.525 17000.0 173.5363 84000.0 174.9568 440000.0 184.9167 6000.0 184.9411 2100000.0 184.9565 6000.0 186.9454 2800.0 192.9674 49000.0 193.9864 2600.0 194.9257 81000.0 194.9838 24000.0 196.9273 22000.0 202.1332 2800.0 202.9301 5000.0 202.9518 2000000.0 202.9731 14000.0 203.9728 2500.0 204.9687 20000.0 207.9577 11000.0 208.6189 3000.0 209.0935 2400.0 212.9158 2600.0 212.9362 2800000.0 212.9607 14000.0 214.9397 16000.0 218.984 2700.0 220.9624 55000.0 221.9317 6800.0 221.984 3600.0 222.9324 34000.0 222.9795 60000.0 223.0883 2300.0 225.8245 2500.0 227.291 2400.0 228.9897 2500.0 230.053 2300.0 230.9468 330000.0 235.9504 6700.0 236.0102 2500.0 240.9311 92000.0 250.8875 2200.0 258.9425 3100.0 261.972 2800.0 END IONS BEGIN IONS SCANS=3 PEPMASS=249.926 CHARGE=1 COLLISION_ENERGY=0.0 44.1372 2200.0 45.5181 2100.0 48.8363 2300.0 49.8966 2500.0 49.9899 2000.0 53.244 2700.0 53.7629 2100.0 53.9947 2300.0 55.3587 2900.0 55.4572 3200.0 55.9341 34000.0 58.6335 2500.0 62.988 2400.0 65.6745 2200.0 80.9516 2200.0 84.55 3100.0 92.5438 2800.0 97.4573 2500.0 99.0327 2600.0 101.1441 2500.0 106.5987 2700.0 107.325 2300.0 114.0878 2300.0 137.521 2400.0 146.7141 2400.0 148.9375 7000.0 149.6795 3400.0 149.69 5700.0 149.7006 3700.0 157.6962 2400.0 159.9303 16000.0 161.9314 2200.0 163.9258 4300.0 164.9332 12000.0 165.9406 28000.0 171.5208 2400.0 173.5217 7200.0 173.5373 41000.0 175.9361 5900.0 176.9331 51000.0 177.9408 2800.0 181.9359 25000.0 182.9436 14000.0 183.9521 18000.0 184.1487 2600.0 185.9274 3300.0 187.9255 19000.0 188.9717 6400.0 190.4268 2700.0 191.9201 66000.0 193.9473 7100.0 194.9435 14000.0 198.5703 2600.0 198.9576 3900.0 203.4747 2600.0 203.9194 12000.0 203.9389 2800.0 204.9279 71000.0 205.9354 2500.0 209.9305 33000.0 219.9144 5300.0 221.9309 92000.0 222.9386 12000.0 224.3337 2400.0 END IONS BEGIN IONS SCANS=4 PEPMASS=244.9471 CHARGE=1 COLLISION_ENERGY=0.0 44.4631 2300.0 46.3288 2200.0 46.9387 2200.0 48.759 4600.0 48.9989 2300.0 49.6719 2200.0 49.9031 2200.0 51.3132 2300.0 51.5103 2300.0 52.249 2200.0 52.3312 2200.0 53.1602 2200.0 55.2373 2300.0 55.3285 2200.0 55.4657 2300.0 55.9344 270000.0 56.0811 2500.0 59.1862 2400.0 60.0906 2300.0 60.6917 3000.0 61.1935 2300.0 63.8319 2900.0 64.5645 2300.0 65.832 2300.0 66.9189 2800.0 67.9957 3100.0 69.7489 2100.0 72.9769 2500.0 75.2225 2700.0 77.1293 2600.0 79.2943 2300.0 82.2237 2500.0 83.4417 2900.0 85.9308 2400.0 86.9928 3600.0 87.6035 2400.0 87.7196 2100.0 88.9163 2400.0 92.639 2900.0 96.5193 3000.0 98.6941 2400.0 99.6545 2300.0 101.976 4100.0 102.1469 2400.0 105.0033 9100.0 107.3847 2300.0 109.8813 2400.0 111.5175 2600.0 111.9094 42000.0 118.3182 2500.0 118.8867 2500.0 118.9862 12000.0 119.9866 23000.0 125.4637 2400.0 127.9041 15000.0 128.9706 2200.0 129.2347 2400.0 129.92 31000.0 129.971 9700.0 131.9353 54000.0 136.0001 5500.0 136.9965 57000.0 137.9972 120000.0 140.1784 2300.0 141.2366 2200.0 141.9208 8400.0 145.9148 85000.0 145.9844 3400.0 146.9225 91000.0 146.9806 17000.0 147.9302 48000.0 147.9818 66000.0 148.9383 150000.0 149.6826 4500.0 149.6928 5500.0 149.9461 65000.0 155.0072 2600.0 156.0073 12000.0 156.6639 2300.0 156.9658 4700.0 157.9666 25000.0 158.4279 2200.0 159.9304 270000.0 162.7523 2300.0 163.6707 2600.0 163.9253 250000.0 163.94 3800.0 164.9332 270000.0 164.9915 50000.0 165.9256 3500.0 165.9411 510000.0 165.9925 150000.0 166.9488 79000.0 167.2271 2600.0 173.528 55000.0 173.5396 35000.0 173.9101 84000.0 173.9793 8700.0 174.9763 72000.0 175.9772 290000.0 177.9412 160000.0 178.8557 2700.0 181.936 460000.0 182.0459 2500.0 182.0711 2400.0 182.9438 350000.0 183.9516 350000.0 184.7391 2400.0 184.9613 3100.0 185.9099 10000.0 185.9616 24000.0 191.9008 5300.0 191.9203 1000000.0 191.9361 7200.0 191.9896 16000.0 192.9866 130000.0 193.9362 20000.0 193.9877 530000.0 202.9713 57000.0 203.8993 3900.0 203.9206 310000.0 203.9724 380000.0 204.0032 2800.0 204.776 2400.0 209.9076 7100.0 209.931 740000.0 209.954 9800.0 212.7159 2700.0 216.0887 2200.0 220.7064 2500.0 220.9818 82000.0 221.8788 3900.0 221.9309 3000000.0 221.9571 11000.0 221.983 470000.0 223.9347 12000.0 227.9418 14000.0 235.3344 2400.0 239.9413 48000.0 241.9969 2400.0 244.9487 3000.0 END IONS BEGIN IONS SCANS=5 PEPMASS=221.9313 CHARGE=1 COLLISION_ENERGY=0.0 43.536 2300.0 47.1735 2500.0 47.6819 2400.0 52.7669 2300.0 54.5471 2300.0 54.6997 2300.0 55.9342 41000.0 55.9567 2300.0 58.0651 6200.0 59.1568 2600.0 63.4673 2300.0 68.124 2200.0 69.8471 2600.0 70.4632 2800.0 73.3325 2300.0 74.6466 2500.0 75.3665 2400.0 80.5591 2200.0 84.8107 2400.0 85.5658 2400.0 91.0538 14000.0 119.0487 2600.0 119.9863 17000.0 125.4487 2300.0 129.8425 2200.0 129.9704 3200.0 130.8529 2400.0 131.9357 2300.0 135.0437 6100.0 135.9996 6800.0 136.9964 30000.0 137.997 100000.0 140.1405 2100.0 145.914 2400.0 146.9805 9200.0 147.9817 47000.0 148.9378 9200.0 149.9454 2800.0 151.2477 2800.0 154.3143 2400.0 155.1219 2400.0 156.0074 10000.0 157.9657 13000.0 159.9303 16000.0 163.9255 22000.0 163.9947 3400.0 164.9334 9100.0 164.9913 16000.0 165.9409 39000.0 165.9923 110000.0 166.949 3600.0 173.5239 15000.0 173.5362 44000.0 173.9804 2700.0 174.9767 4000.0 175.977 120000.0 177.9407 12000.0 181.9357 54000.0 182.944 15000.0 183.9516 15000.0 191.9201 59000.0 191.9898 5800.0 192.9862 13000.0 193.9874 230000.0 203.9724 72000.0 209.9307 38000.0 219.2902 2700.0 221.9308 78000.0 221.9828 99000.0 END IONS BEGIN IONS SCANS=6 PEPMASS=272.9423 CHARGE=1 COLLISION_ENERGY=0.0 46.2772 2300.0 48.8216 2100.0 49.6768 2500.0 49.7211 2200.0 53.7564 2500.0 54.9395 2800.0 55.1708 2400.0 55.3341 2200.0 55.5395 2200.0 55.9342 250000.0 55.9452 3100.0 56.4961 2400.0 58.056 2500.0 61.5151 2500.0 62.4029 2200.0 65.4889 2000.0 65.6388 2800.0 65.6815 2200.0 68.0352 2400.0 75.7279 2400.0 79.8329 2500.0 80.1364 2600.0 85.4859 2300.0 86.9924 6100.0 91.7684 2300.0 96.3038 2200.0 99.6888 2100.0 105.0031 6700.0 106.695 2200.0 110.504 2100.0 110.6316 2300.0 111.3822 2200.0 111.9094 12000.0 120.0916 2700.0 131.9353 20000.0 136.1769 2200.0 144.9228 2600.0 145.0409 2700.0 145.9144 40000.0 146.0304 2600.0 146.9224 51000.0 147.9301 20000.0 147.9414 2600.0 148.4328 2400.0 148.938 76000.0 149.9458 38000.0 152.8641 2500.0 155.8027 3000.0 158.9231 8200.0 159.9303 110000.0 162.992 2500.0 163.9252 110000.0 164.9331 130000.0 165.9408 290000.0 165.954 4900.0 166.9488 79000.0 167.9532 2400.0 169.915 8900.0 173.5249 4900.0 173.5338 73000.0 173.5423 5300.0 173.6501 2200.0 173.9096 39000.0 175.9367 64000.0 176.9331 370000.0 176.9506 2700.0 177.941 130000.0 181.5338 2300.0 181.9358 280000.0 182.9437 250000.0 183.9514 270000.0 186.9178 65000.0 187.9252 420000.0 188.1027 2300.0 191.9201 540000.0 191.9398 5100.0 192.9285 13000.0 193.934 17000.0 193.9472 51000.0 194.9436 240000.0 199.1201 2300.0 200.953 3200.0 201.904 11000.0 203.9208 120000.0 203.9347 4600.0 204.9056 4700.0 204.9279 1500000.0 204.9493 24000.0 205.9358 240000.0 209.9075 10000.0 209.9308 660000.0 209.9542 9900.0 210.9393 8300.0 219.9152 200000.0 221.9308 2900000.0 221.9567 11000.0 221.9817 13000.0 222.9135 19000.0 222.9385 730000.0 223.9342 6300.0 226.7182 3100.0 227.942 27000.0 231.926 15000.0 232.9236 8100.0 234.9645 21000.0 237.9254 53000.0 239.9413 100000.0 243.5209 2500.0 244.9475 25000.0 249.9267 49000.0 250.1465 2400.0 254.2738 2400.0 262.918 25000.0 262.9593 12000.0 276.1037 2700.0 END IONS BEGIN IONS SCANS=7 PEPMASS=336.9014 CHARGE=1 COLLISION_ENERGY=0.0 52.4581 2300.0 60.4387 2100.0 68.3728 2300.0 76.3385 2200.0 96.2359 3100.0 101.1362 2300.0 159.2096 2500.0 171.9507 2400.0 172.9774 2700.0 173.5271 7800.0 173.537 12000.0 190.9883 11000.0 200.9729 20000.0 209.6976 2300.0 212.936 4000.0 218.9837 31000.0 220.9821 8200.0 226.2951 2400.0 230.5443 2500.0 238.0503 2200.0 244.9078 6400.0 246.9183 2800.0 255.0513 2400.0 260.9412 3700.0 262.9193 11000.0 265.7062 3400.0 270.927 9800.0 272.9036 14000.0 273.9042 14000.0 280.9108 4200.0 290.9165 2700.0 291.9143 3400.0 298.9215 37000.0 316.9303 4600.0 343.7459 2800.0 END IONS BEGIN IONS SCANS=8 PEPMASS=260.0104 CHARGE=1 COLLISION_ENERGY=0.0 79.3252 2100.0 84.9596 20000.0 86.9558 2700.0 124.9869 2200.0 134.9989 20000.0 141.3143 2200.0 144.9834 6900.0 146.0298 3900.0 153.0092 3600.0 162.9938 28000.0 172.9784 29000.0 173.5379 19000.0 180.9305 4000.0 182.9634 5500.0 190.9576 2900.0 190.9685 4800.0 190.9887 150000.0 191.0089 2900.0 198.9406 6100.0 200.9732 68000.0 204.0206 12000.0 212.267 2400.0 214.0053 3800.0 215.0816 19000.0 218.9464 3900.0 218.9838 280000.0 231.9701 7300.0 232.0155 39000.0 241.9527 6000.0 242.0917 2600.0 247.0127 2600.0 249.979 4400.0 250.0713 2700.0 259.9653 5200.0 END IONS BEGIN IONS SCANS=9 PEPMASS=218.984 CHARGE=1 COLLISION_ENERGY=0.0 44.4118 2800.0 47.7459 3200.0 48.9832 2300.0 49.2307 2200.0 50.404 2500.0 51.066 2600.0 54.5881 2200.0 56.2209 2300.0 62.7547 2300.0 68.9822 16000.0 70.4684 2700.0 75.5198 2600.0 80.9675 9700.0 82.9827 16000.0 84.9596 41000.0 86.9927 56000.0 87.3321 2300.0 89.6031 2300.0 91.3671 2300.0 92.3268 2700.0 98.9777 170000.0 104.2269 2200.0 104.3814 2200.0 104.6796 2500.0 105.0032 63000.0 108.1228 2300.0 108.9631 23000.0 116.9882 470000.0 118.9925 2500.0 126.9728 130000.0 133.2961 2500.0 134.9988 1700000.0 135.0163 3600.0 136.1255 2200.0 137.003 8900.0 138.9729 13000.0 144.9715 6800.0 144.9832 1000000.0 150.747 2300.0 153.0094 250000.0 153.0231 3300.0 154.9679 240000.0 154.9821 3500.0 156.9719 2400.0 158.0151 4000.0 162.9712 3400.0 162.9938 1800000.0 163.0063 3700.0 164.9982 13000.0 172.9435 13000.0 172.9497 3800.0 172.9656 13000.0 172.9783 2100000.0 173.0133 7900.0 173.5264 8900.0 173.5371 35000.0 174.982 3300.0 177.9353 2900.0 180.9701 2600.0 181.0045 7200.0 182.9629 110000.0 186.0104 3400.0 186.5668 2400.0 190.9371 3900.0 190.9484 7200.0 190.9887 3100000.0 191.0033 10000.0 191.0202 5000.0 191.0296 10000.0 191.6455 2700.0 191.9909 2800.0 192.9931 18000.0 195.9944 4300.0 200.9732 1100000.0 200.9941 5100.0 203.1454 2700.0 212.0156 2700.0 214.0049 15000.0 218.9584 7500.0 218.9839 1300000.0 219.1743 14000.0 220.155 2700.0 223.9882 3100.0 END IONS BEGIN IONS SCANS=10 PEPMASS=270.9461 CHARGE=1 COLLISION_ENERGY=0.0 57.1852 2100.0 65.1515 2700.0 67.4107 2400.0 94.538 3400.0 94.7701 2000.0 116.6482 2200.0 120.2827 2700.0 149.6798 4400.0 149.6916 5400.0 163.9458 3500.0 173.5282 5100.0 173.9804 3500.0 174.9377 4100.0 185.93 6100.0 189.9243 6900.0 191.9898 4800.0 201.9249 3400.0 201.9746 4100.0 202.9327 21000.0 207.936 4400.0 213.9538 2300.0 214.956 5200.0 219.9357 28000.0 219.9857 5400.0 232.9673 19000.0 242.9523 12000.0 260.9625 7100.0 266.2681 2000.0 END IONS BEGIN IONS SCANS=11 PEPMASS=385.8763 CHARGE=1 COLLISION_ENERGY=0.0 66.3013 2000.0 72.5639 2300.0 89.8834 2500.0 93.4654 2500.0 112.7887 2400.0 116.0387 2600.0 165.7143 2500.0 173.5372 11000.0 226.6456 2300.0 240.953 9400.0 241.9524 3200.0 243.9513 3700.0 257.9005 7900.0 258.9651 7100.0 275.9044 4100.0 285.8962 74000.0 302.8991 6000.0 303.9072 14000.0 304.4391 2900.0 312.8836 7700.0 313.8909 28000.0 317.8857 3500.0 320.9082 4000.0 330.8935 29000.0 331.9003 6300.0 335.8987 5400.0 340.8797 4000.0 348.9038 5700.0 357.8812 33000.0 358.8883 20000.0 375.8921 2900.0 376.9012 3800.0 END IONS BEGIN IONS SCANS=12 PEPMASS=201.9743 CHARGE=1 COLLISION_ENERGY=0.0 51.0861 2200.0 51.7642 2400.0 55.9344 3100.0 82.4017 2300.0 86.9923 2500.0 95.9308 2300.0 114.1716 2100.0 117.9888 3100.0 133.9585 2700.0 135.9995 13000.0 144.985 2500.0 145.984 11000.0 163.9946 16000.0 173.5274 15000.0 173.5452 4400.0 173.979 6900.0 177.6848 3100.0 191.9898 11000.0 197.0051 2300.0 202.0758 2200.0 END IONS BEGIN IONS SCANS=13 PEPMASS=220.9816 CHARGE=1 COLLISION_ENERGY=0.0 56.2829 2500.0 100.9752 8100.0 105.003 2800.0 118.9857 20000.0 119.0493 3300.0 123.2931 2300.0 128.9703 3700.0 130.0412 4800.0 134.9987 5300.0 135.0435 3000.0 135.9993 3500.0 136.9962 91000.0 146.9806 41000.0 147.0436 8900.0 149.0609 2600.0 155.0065 19000.0 156.9653 8300.0 160.0524 2500.0 162.0669 7600.0 162.9938 4800.0 163.0389 15000.0 164.9912 110000.0 172.9789 2800.0 173.5315 9800.0 174.9579 5300.0 174.9758 76000.0 175.0397 8400.0 177.0545 2500.0 178.0627 9200.0 184.9601 3400.0 190.062 8900.0 190.9888 4100.0 191.034 5900.0 191.9881 2900.0 192.9864 210000.0 193.0852 4500.0 202.9711 36000.0 220.9817 92000.0 END IONS BEGIN IONS SCANS=14 PEPMASS=243.9975 CHARGE=1 COLLISION_ENERGY=0.0 48.2452 3300.0 48.2474 4000.0 50.7436 2800.0 55.2436 2900.0 67.6687 2100.0 84.98 5200.0 86.9924 6300.0 88.0227 2900.0 88.9523 3100.0 88.9901 5400.0 97.4662 2400.0 99.9782 3000.0 100.9752 36000.0 105.0028 4800.0 107.0009 5900.0 110.9531 2100.0 110.9609 8300.0 111.9683 3000.0 116.9879 7100.0 117.9891 5400.0 118.9858 96000.0 128.9703 28000.0 129.3957 2600.0 134.9987 23000.0 135.9995 25000.0 136.9964 410000.0 139.0006 2500.0 140.9704 5800.0 144.9831 10000.0 145.9838 9400.0 146.9809 230000.0 149.7509 2700.0 153.0087 2800.0 155.0071 56000.0 156.9654 100000.0 157.1405 2200.0 162.9938 20000.0 163.9946 18000.0 164.9916 420000.0 166.9954 4900.0 172.9782 25000.0 173.5353 9800.0 173.9792 30000.0 174.9762 900000.0 175.0117 4300.0 176.9802 3300.0 183.9623 2600.0 184.9609 76000.0 188.0077 3100.0 190.9888 31000.0 191.9898 41000.0 192.9339 3700.0 192.9868 1300000.0 193.0538 3300.0 193.9922 3000.0 194.9911 11000.0 197.9912 4300.0 200.9735 6900.0 201.9744 25000.0 202.9714 940000.0 203.0161 4100.0 203.882 2400.0 204.9764 2900.0 215.9589 3000.0 216.0028 5500.0 218.9839 6600.0 219.985 26000.0 220.9321 4200.0 220.9418 6700.0 220.9821 1000000.0 221.9834 3700.0 222.9862 3500.0 225.9866 4200.0 243.9988 5900.0 END IONS BEGIN IONS SCANS=15 PEPMASS=265.0159 CHARGE=1 COLLISION_ENERGY=0.0 47.391 2100.0 47.7467 39000.0 47.7483 3900.0 50.2424 31000.0 50.2446 7900.0 54.3586 2400.0 54.7454 47000.0 54.7475 8400.0 58.5121 2500.0 62.5281 2400.0 63.5575 2600.0 68.5156 2300.0 68.9825 18000.0 70.4228 2200.0 74.3953 2100.0 75.4429 2300.0 75.6608 2200.0 77.084 2500.0 79.0198 2200.0 80.9676 4300.0 82.983 19000.0 86.9927 67000.0 91.0079 2800.0 94.4168 2300.0 95.8831 2400.0 96.713 2200.0 98.7404 2200.0 98.9778 190000.0 102.402 2500.0 102.5301 2400.0 103.7264 2200.0 105.0032 76000.0 105.5531 2400.0 108.9637 65000.0 110.5262 2100.0 114.4533 2700.0 116.979 4900.0 116.9884 530000.0 125.6883 2300.0 126.9728 160000.0 127.9836 2700.0 134.9898 5200.0 134.9989 2000000.0 135.0087 4900.0 137.0035 14000.0 137.9667 17000.0 138.9733 44000.0 144.9833 1200000.0 144.9938 2800.0 145.0023 3600.0 149.6697 3600.0 149.6805 3600.0 149.6907 6200.0 153.0095 310000.0 153.0233 5800.0 154.9568 3400.0 154.9678 640000.0 154.9815 9000.0 158.0153 5500.0 162.9939 2300000.0 163.0057 6600.0 164.9985 9100.0 165.7555 2400.0 167.931 8800.0 172.9448 34000.0 172.9512 12000.0 172.9785 5500000.0 173.0068 8100.0 173.0136 30000.0 173.0236 5600.0 173.53 43000.0 173.5412 4200.0 174.9831 14000.0 175.9573 33000.0 181.0039 3500.0 182.9355 3100.0 182.9474 4900.0 182.9631 920000.0 182.9803 3400.0 184.9417 41000.0 185.942 190000.0 186.0098 7100.0 190.9365 7000.0 190.9498 82000.0 190.9567 24000.0 190.9889 9500000.0 191.0214 34000.0 191.0297 66000.0 191.0413 15000.0 191.0645 3500.0 191.9938 5300.0 192.9933 53000.0 194.8437 2500.0 195.9269 2400.0 195.994 22000.0 200.9294 59000.0 200.9563 28000.0 200.9734 11000000.0 201.0076 11000.0 201.018 37000.0 201.0306 12000.0 201.0539 4000.0 201.979 4700.0 202.9524 25000.0 202.9777 16000.0 203.9526 110000.0 205.0055 7400.0 208.9997 5100.0 210.066 2900.0 212.9361 33000.0 213.9372 240000.0 214.0052 53000.0 214.9902 5500.0 218.8915 3300.0 218.9058 6300.0 218.9196 27000.0 218.9338 110000.0 218.945 75000.0 218.9656 120000.0 218.984 14000000.0 219.024 67000.0 219.0338 90000.0 219.0489 22000.0 219.0618 9000.0 219.9895 18000.0 220.9883 57000.0 221.9319 3100.0 223.9285 9000.0 223.9897 51000.0 231.9473 8700.0 232.83 3000.0 232.9994 21000.0 241.9325 9100.0 242.0003 69000.0 END IONS BEGIN IONS SCANS=16 PEPMASS=200.9733 CHARGE=1 COLLISION_ENERGY=0.0 40.2668 2100.0 42.0337 6800.0 42.8274 2600.0 44.4054 2600.0 44.5527 2400.0 46.1446 3300.0 47.3785 4200.0 49.3462 2300.0 51.1805 2900.0 51.9398 13000.0 55.9342 59000.0 56.9369 33000.0 56.942 4200.0 62.8224 3100.0 67.9349 2300.0 72.9369 29000.0 73.6686 2400.0 74.9526 9300.0 79.2948 3600.0 85.6883 2400.0 85.9453 3000.0 86.9922 3500.0 90.9474 74000.0 96.9373 30000.0 98.4185 2400.0 98.9776 6400.0 100.8765 3200.0 102.948 12000.0 105.0032 5400.0 106.0318 3300.0 107.9502 9500.0 113.6128 3300.0 113.9634 23000.0 114.9479 85000.0 114.9712 2800.0 115.979 19000.0 116.9881 28000.0 118.9425 33000.0 121.2772 4000.0 126.9719 2900.0 128.9505 13000.0 129.9524 9700.0 130.9115 2700.0 131.9741 86000.0 132.9585 69000.0 134.9987 140000.0 135.9453 9500.0 136.9537 4100.0 137.0131 2500.0 137.964 40000.0 141.9592 5400.0 144.9832 44000.0 149.9845 7300.0 153.0094 38000.0 155.9747 46000.0 159.9455 7100.0 162.9783 5900.0 162.9938 190000.0 164.3964 3800.0 165.696 2300.0 172.9783 25000.0 173.525 13000.0 173.5383 18000.0 177.9564 15000.0 182.6409 2400.0 190.9889 98000.0 END IONS BEGIN IONS SCANS=17 PEPMASS=223.9894 CHARGE=1 COLLISION_ENERGY=0.0 42.0336 7400.0 42.3178 2000.0 42.4618 2000.0 44.9025 9100.0 46.6222 5300.0 47.0147 4000.0 49.2221 4600.0 49.3655 5000.0 50.8363 2900.0 51.3423 8800.0 51.9397 2900.0 53.7235 7300.0 57.4564 3500.0 58.3933 6700.0 58.6829 6000.0 61.3785 2900.0 63.1007 2100.0 64.3458 2500.0 67.6255 8000.0 68.9825 5400.0 73.1854 9300.0 78.6031 4800.0 78.9521 3800.0 83.305 4100.0 85.9455 6800.0 86.8608 5700.0 90.705 3200.0 92.7739 7700.0 92.8701 3700.0 93.1291 4400.0 94.2074 6900.0 95.2317 5700.0 96.9373 56000.0 98.9773 9500.0 100.0053 5100.0 100.3167 6500.0 102.2223 5900.0 102.948 45000.0 103.9682 7000.0 105.0027 3400.0 113.9634 41000.0 114.9479 190000.0 116.9881 200000.0 117.5337 6700.0 118.139 2500.0 118.9427 3400.0 119.1787 8300.0 121.1667 4600.0 124.5858 4900.0 126.9723 4800.0 131.7192 4800.0 132.9585 140000.0 134.9877 4700.0 134.9987 830000.0 135.2151 7300.0 137.9638 120000.0 138.5668 5000.0 141.959 4700.0 143.0904 2600.0 144.983 150000.0 149.0745 8500.0 153.0092 310000.0 154.967 9300.0 155.9745 330000.0 156.9825 4100.0 159.9455 52000.0 162.9937 1400000.0 171.8854 6900.0 172.9785 190000.0 173.5209 16000.0 173.5302 41000.0 173.5374 120000.0 177.9564 120000.0 181.0043 13000.0 182.9636 2600.0 190.9685 43000.0 190.9886 2000000.0 191.0084 18000.0 195.1494 6400.0 200.9729 71000.0 208.3358 3400.0 218.3919 3000.0 218.9309 6800.0 218.9838 700000.0 END IONS BEGIN IONS SCANS=18 PEPMASS=224.9906 CHARGE=1 COLLISION_ENERGY=0.0 55.6341 3200.0 77.5835 3300.0 78.4419 3600.0 79.4074 3300.0 79.8054 3200.0 83.667 3400.0 88.5534 3300.0 115.4137 3400.0 117.9888 18000.0 133.9588 4300.0 134.9985 18000.0 135.9993 75000.0 145.984 13000.0 153.0088 8700.0 153.4739 3400.0 154.0099 31000.0 162.9935 23000.0 163.9944 130000.0 170.8 3500.0 173.538 21000.0 173.9793 25000.0 190.9885 34000.0 191.9895 220000.0 192.0049 3500.0 192.0103 4900.0 201.9742 5600.0 218.9857 6000.0 219.9845 78000.0 END IONS BEGIN IONS SCANS=19 PEPMASS=241.9999 CHARGE=1 COLLISION_ENERGY=0.0 43.244 21000.0 43.2454 3500.0 45.6908 2600.0 46.8208 2900.0 47.7464 42000.0 47.7485 11000.0 49.7843 3900.0 49.9951 2000.0 50.2421 4100.0 50.2433 25000.0 51.0659 4000.0 51.0684 3400.0 52.6454 2400.0 54.7458 29000.0 54.7476 8900.0 58.0727 2200.0 59.9744 2400.0 60.7064 2800.0 68.9822 36000.0 70.334 2500.0 72.5081 2400.0 79.7936 2200.0 80.9677 14000.0 82.1644 2600.0 82.9827 30000.0 84.9596 78000.0 85.2779 2700.0 86.9926 97000.0 87.504 2400.0 90.8823 2400.0 94.8306 2800.0 95.4531 2400.0 96.9568 3400.0 98.9776 330000.0 102.9703 6200.0 105.0032 110000.0 108.357 2700.0 108.9633 73000.0 109.9714 9800.0 110.9789 2600.0 116.9883 960000.0 118.9928 2600.0 123.0133 3900.0 126.9727 240000.0 127.9813 2900.0 132.5779 3200.0 134.9988 3500000.0 135.0085 26000.0 135.0228 8500.0 136.0042 3600.0 137.0032 30000.0 137.9664 11000.0 138.4567 2600.0 138.9729 37000.0 141.8606 3100.0 144.9832 1800000.0 144.9939 16000.0 146.9881 9200.0 153.0093 550000.0 153.0234 5800.0 154.9526 11000.0 154.9676 750000.0 154.9821 6200.0 155.0148 3200.0 158.0148 17000.0 158.6784 2800.0 162.9617 17000.0 162.9938 4100000.0 163.006 21000.0 163.0187 8600.0 163.0263 13000.0 163.9982 3800.0 164.9985 33000.0 167.9982 3600.0 172.9433 24000.0 172.9504 9500.0 172.9782 6300000.0 173.0065 9200.0 173.0107 66000.0 173.0232 9500.0 173.5268 15000.0 173.5386 22000.0 173.9823 2500.0 174.9829 22000.0 177.0118 3100.0 180.0883 2900.0 180.7744 3200.0 181.0042 5300.0 182.9444 4800.0 182.9628 590000.0 182.9804 5000.0 186.0098 26000.0 186.9939 3800.0 188.9988 2400.0 190.9362 18000.0 190.9483 83000.0 190.9562 35000.0 190.9888 13000000.0 191.0034 60000.0 191.0208 68000.0 191.0295 85000.0 191.0414 31000.0 191.0525 9900.0 191.0756 5000.0 191.9925 21000.0 192.9933 70000.0 194.3332 2700.0 195.9943 24000.0 200.9288 12000.0 200.9732 6600000.0 201.0173 26000.0 202.9767 4500.0 205.0055 6900.0 208.9998 10000.0 213.9584 3800.0 214.0051 75000.0 214.9858 2700.0 218.9196 13000.0 218.9336 48000.0 218.944 22000.0 218.9839 9900000.0 219.0237 50000.0 219.0337 64000.0 219.0482 17000.0 219.062 6200.0 219.989 6700.0 220.9882 38000.0 223.9892 30000.0 231.9698 21000.0 232.9993 14000.0 241.9552 5700.0 241.9999 48000.0 251.8621 2400.0 END IONS BEGIN IONS SCANS=20 PEPMASS=268.9483 CHARGE=1 COLLISION_ENERGY=0.0 59.1 2200.0 59.4118 2500.0 68.7811 2200.0 76.5298 2700.0 84.6393 2400.0 102.9723 2800.0 109.9982 2200.0 118.3204 2700.0 120.9837 6500.0 126.4163 2400.0 130.1564 2400.0 130.4922 3000.0 136.9958 5900.0 137.9971 6200.0 138.9937 34000.0 147.9809 2600.0 148.9782 20000.0 157.004 2800.0 158.9628 15000.0 164.9906 8400.0 165.993 3800.0 166.9889 34000.0 173.524 18000.0 173.5418 16000.0 174.9759 5400.0 175.9769 12000.0 176.9333 16000.0 176.9736 98000.0 186.958 16000.0 190.9891 3300.0 192.9864 14000.0 193.9874 22000.0 194.946 7400.0 194.9843 150000.0 202.9728 4400.0 203.9723 27000.0 204.9285 11000.0 204.969 210000.0 205.0005 2600.0 212.9583 55000.0 217.892 2600.0 217.9371 6500.0 220.9828 8400.0 221.983 30000.0 222.9411 3300.0 222.9798 250000.0 223.0145 2800.0 230.9687 150000.0 230.9952 4900.0 235.9463 2500.0 240.9262 3500.0 240.9532 95000.0 246.9716 2500.0 248.9789 28000.0 258.9634 52000.0 END IONS BEGIN IONS SCANS=21 PEPMASS=286.9591 CHARGE=1 COLLISION_ENERGY=0.0 51.666 2000.0 55.1189 2500.0 64.5549 2400.0 79.7548 2200.0 82.9014 2500.0 87.5198 2300.0 94.3006 2200.0 103.2496 2300.0 129.4578 2400.0 135.0441 3900.0 135.9984 2500.0 136.047 4400.0 142.0597 2700.0 144.0525 4200.0 150.1429 2300.0 155.0739 2200.0 156.0587 2600.0 162.8864 2300.0 172.0482 2900.0 172.9778 8000.0 173.5231 15000.0 173.5322 35000.0 173.5418 14000.0 173.961 3000.0 174.0631 2800.0 176.9331 11000.0 178.4519 2400.0 178.9512 2600.0 187.9256 4500.0 190.9879 20000.0 192.9855 4300.0 194.9475 14000.0 195.0168 3000.0 197.2017 2200.0 201.055 8500.0 202.058 21000.0 202.9724 7300.0 204.9279 31000.0 204.9688 11000.0 205.9363 6100.0 212.9085 2800.0 212.9581 170000.0 217.9363 38000.0 218.9441 3000.0 220.9826 7800.0 221.9307 3400.0 221.9835 6800.0 222.8939 4000.0 222.9415 14000.0 222.98 14000.0 225.7995 2500.0 230.9405 3200.0 230.9687 490000.0 232.9231 2500.0 235.9467 60000.0 240.924 7600.0 240.953 910000.0 240.9816 5400.0 248.9791 110000.0 258.9634 520000.0 258.9949 5600.0 276.9742 14000.0 278.1335 2300.0 281.8661 2800.0 283.3996 2600.0 END IONS BEGIN IONS SCANS=22 PEPMASS=382.9291 CHARGE=1 COLLISION_ENERGY=0.0 59.1292 2200.0 69.5127 2500.0 92.9846 2100.0 94.3095 2300.0 97.3382 3100.0 136.5494 2300.0 149.682 10000.0 149.6929 10000.0 173.5335 11000.0 180.7524 2500.0 194.447 2600.0 202.9704 3400.0 212.9569 3800.0 218.9822 3100.0 220.9816 8000.0 221.983 2700.0 222.944 3100.0 222.9782 5000.0 230.969 8100.0 240.9529 150000.0 246.2632 2300.0 250.5887 2100.0 258.9634 110000.0 262.9159 2900.0 272.9036 7200.0 273.9049 6500.0 276.9742 3000.0 286.9193 2500.0 316.9537 6000.0 327.9662 2400.0 344.9468 4500.0 354.9332 12000.0 360.0296 3400.0 372.944 14000.0 END IONS BEGIN IONS SCANS=23 PEPMASS=400.9397 CHARGE=1 COLLISION_ENERGY=0.0 57.8472 2500.0 70.9126 2500.0 133.6789 2300.0 168.0534 2300.0 173.5296 17000.0 174.0152 2400.0 212.9576 6700.0 222.944 6900.0 230.9687 15000.0 240.9529 400000.0 244.9489 3300.0 248.9791 3800.0 258.9633 280000.0 276.9736 9900.0 298.9442 8800.0 312.1033 2400.0 316.9535 20000.0 326.9388 5300.0 336.9268 6200.0 344.95 10000.0 354.9334 89000.0 354.9835 3700.0 372.8896 5400.0 372.9438 130000.0 END IONS BEGIN IONS SCANS=24 PEPMASS=413.8713 CHARGE=1 COLLISION_ENERGY=0.0 62.0161 2200.0 149.4229 2100.0 173.533 10000.0 200.9722 3600.0 218.985 9800.0 219.9847 2900.0 240.9534 4400.0 272.9038 28000.0 272.933 2900.0 273.9128 8000.0 290.9152 11000.0 291.9236 3200.0 302.8613 2800.0 317.9022 15000.0 330.8948 8000.0 358.8885 6700.0 372.8991 3400.0 386.8842 8600.0 415.9439 2400.0 END IONS BEGIN IONS SCANS=25 PEPMASS=287.9601 CHARGE=1 COLLISION_ENERGY=0.0 52.0742 2600.0 63.609 2400.0 68.5033 2100.0 121.3142 2400.0 135.0439 9500.0 135.792 2200.0 151.4068 2600.0 173.5247 5600.0 173.5419 6100.0 174.2494 2700.0 208.8828 6900.0 213.9586 6800.0 226.8943 4100.0 231.9697 34000.0 236.9475 2900.0 241.9541 46000.0 248.9785 2500.0 249.9803 18000.0 259.9648 52000.0 277.9751 4800.0 END IONS BEGIN IONS SCANS=26 PEPMASS=337.9701 CHARGE=1 COLLISION_ENERGY=0.0 50.627 2200.0 56.2916 2300.0 108.2976 2500.0 118.6811 2300.0 157.4897 2800.0 162.9939 2800.0 172.978 7000.0 173.5321 18000.0 182.9627 4000.0 190.9888 14000.0 200.9731 57000.0 218.9837 74000.0 219.9853 3700.0 248.1794 2100.0 274.9025 3200.0 286.1201 2900.0 292.914 2600.0 299.9235 5600.0 END IONS BEGIN IONS SCANS=27 PEPMASS=232.9234 CHARGE=1 COLLISION_ENERGY=0.0 47.6269 2400.0 65.6772 2700.0 68.0142 2100.0 70.3493 2200.0 72.2663 2400.0 76.2091 2300.0 78.1546 2400.0 84.9596 3400.0 86.9921 2400.0 104.7952 2400.0 105.0034 3100.0 134.9989 8500.0 144.9834 3400.0 148.9378 2700.0 149.683 7500.0 149.6935 3900.0 149.7042 3100.0 156.9673 2400.0 158.9231 10000.0 162.9937 11000.0 166.8239 2500.0 172.9785 14000.0 173.5346 20000.0 176.9331 150000.0 176.9508 4600.0 177.0078 3800.0 178.7468 2300.0 181.9601 2800.0 189.0096 3200.0 190.9887 19000.0 194.9435 42000.0 200.973 6900.0 204.9289 4000.0 209.9565 3000.0 215.459 2300.0 217.8742 2900.0 218.9842 9200.0 232.9981 3400.0 238.7147 2600.0 END IONS BEGIN IONS SCANS=28 PEPMASS=255.9392 CHARGE=1 COLLISION_ENERGY=0.0 44.7156 2800.0 45.1169 2200.0 47.207 2200.0 47.8319 2600.0 48.035 2300.0 48.3423 2100.0 49.4703 2200.0 50.6951 2800.0 50.733 2300.0 50.9395 2200.0 52.7069 2300.0 53.7371 2300.0 54.0024 2600.0 54.9255 2500.0 57.07 10000.0 57.7954 2000.0 58.1122 2400.0 59.5149 2600.0 61.8092 2100.0 63.7898 2400.0 66.404 2300.0 68.1173 2300.0 68.5531 2300.0 68.9817 2700.0 71.8638 2800.0 72.4756 2800.0 73.0467 2200.0 74.9252 2100.0 76.2612 2400.0 76.7204 2300.0 77.3214 2500.0 79.3413 2400.0 79.3854 2800.0 81.1577 2300.0 82.0141 3000.0 85.5447 2600.0 86.9926 32000.0 87.6141 2400.0 89.4009 2500.0 89.4417 2300.0 90.4486 2200.0 91.1328 2400.0 91.2955 2700.0 91.5511 2400.0 92.0078 2600.0 94.9053 2300.0 96.283 2600.0 102.529 2200.0 105.0029 47000.0 107.2291 2500.0 113.4339 2200.0 113.557 2200.0 113.9158 2500.0 115.658 2600.0 127.5197 2500.0 134.9986 13000.0 140.9115 4400.0 144.9828 8100.0 148.3266 2600.0 148.5538 2300.0 148.938 40000.0 149.686 5300.0 151.3167 2500.0 156.8517 2500.0 158.9227 130000.0 160.0279 2500.0 162.9936 50000.0 163.5305 2800.0 165.9001 2300.0 166.8751 2600.0 166.9487 43000.0 166.9896 7500.0 167.8295 2400.0 171.5302 2500.0 172.9781 18000.0 173.5222 7300.0 173.5336 84000.0 173.5424 5200.0 176.9197 6500.0 176.9332 2200000.0 176.9502 8800.0 177.0095 11000.0 178.9376 3500.0 181.9606 5700.0 183.951 2700.0 186.9181 6300.0 186.9378 5500.0 186.9933 4200.0 189.0094 42000.0 189.4721 2400.0 190.9885 86000.0 191.006 3000.0 194.9436 1400000.0 194.9603 3400.0 196.9486 5400.0 199.9386 7600.0 200.9733 35000.0 201.4414 2400.0 204.928 260000.0 204.9485 23000.0 205.0042 44000.0 209.9554 33000.0 214.9335 11000.0 214.9889 31000.0 218.3925 2700.0 218.9837 100000.0 222.9389 130000.0 227.574 2500.0 232.9231 59000.0 232.9992 96000.0 244.5151 2600.0 250.9342 21000.0 251.3318 2500.0 256.2631 12000.0 END IONS BEGIN IONS SCANS=29 PEPMASS=320.8668 CHARGE=1 COLLISION_ENERGY=0.0 50.4709 2400.0 63.1042 2600.0 63.1247 3000.0 69.1382 2600.0 69.2773 2400.0 73.0307 2300.0 74.5823 2100.0 84.911 14000.0 86.0547 2400.0 89.1685 2100.0 103.0529 2400.0 122.9242 65000.0 123.4929 2600.0 130.4718 2800.0 130.7126 2000.0 143.1808 2300.0 143.9992 2500.0 156.1535 2600.0 163.5064 2400.0 173.5255 27000.0 173.5397 30000.0 183.2463 2500.0 186.4155 2400.0 209.3472 2600.0 216.8613 2300.0 256.1477 2600.0 256.1902 2500.0 271.4027 2600.0 312.8198 2600.0 END IONS BEGIN IONS SCANS=30 PEPMASS=352.8164 CHARGE=1 COLLISION_ENERGY=0.0 56.333 2500.0 62.8915 2400.0 66.122 2500.0 80.7956 2500.0 89.5988 2400.0 94.343 2300.0 99.8845 2200.0 103.0372 2700.0 113.968 2400.0 117.3787 2600.0 121.2038 2100.0 122.9241 90000.0 159.6263 2300.0 165.8527 2900.0 173.5232 5400.0 173.5342 48000.0 181.8199 2400.0 186.9726 2500.0 195.1283 2300.0 230.2904 2500.0 237.4402 2400.0 283.8911 2500.0 337.6373 2500.0 END IONS BEGIN IONS SCANS=31 PEPMASS=231.9889 CHARGE=1 COLLISION_ENERGY=0.0 43.7714 2400.0 48.1504 2200.0 55.547 2100.0 69.8936 2100.0 72.2129 2400.0 72.4896 2100.0 84.134 2300.0 84.7078 2500.0 86.5177 2600.0 87.3452 3100.0 92.2878 2500.0 96.1014 2300.0 97.1173 2400.0 121.0078 2400.0 169.7758 2700.0 173.5225 7900.0 173.5333 31000.0 173.5418 7500.0 183.1586 2300.0 188.9773 2200.0 196.5381 2400.0 211.5412 2100.0 END IONS BEGIN IONS SCANS=32 PEPMASS=526.758 CHARGE=1 COLLISION_ENERGY=0.0 65.0164 2600.0 122.9241 750000.0 122.933 11000.0 122.9403 7800.0 122.9443 5300.0 130.3848 2400.0 173.5227 8900.0 173.5417 8600.0 190.9118 47000.0 196.4842 2500.0 206.8859 160000.0 206.9085 5700.0 274.8734 8600.0 290.8484 3000.0 435.5496 2200.0 END IONS BEGIN IONS SCANS=33 PEPMASS=206.8862 CHARGE=1 COLLISION_ENERGY=0.0 49.2519 4000.0 59.2182 3700.0 60.0804 12000.0 72.2776 3000.0 73.2975 5100.0 74.0599 4100.0 94.5934 4400.0 99.091 3100.0 103.5103 4400.0 104.1066 280000.0 104.115 8600.0 107.7283 3900.0 111.6057 3000.0 122.9239 8900.0 173.5261 34000.0 173.5443 13000.0 211.6218 3400.0 END IONS BEGIN IONS SCANS=34 PEPMASS=290.8478 CHARGE=1 COLLISION_ENERGY=0.0 49.9037 7300.0 51.3589 6000.0 52.5731 5000.0 57.3114 6100.0 66.3692 6300.0 70.0648 5900.0 79.9639 5600.0 83.2782 5000.0 110.6243 5700.0 122.9241 3300000.0 122.9329 54000.0 122.945 24000.0 171.3706 7000.0 173.5217 28000.0 173.5392 62000.0 255.3135 7600.0 286.227 6900.0 END IONS BEGIN IONS SCANS=35 PEPMASS=292.8459 CHARGE=1 COLLISION_ENERGY=0.0 53.4614 2500.0 65.8662 2300.0 70.5944 2000.0 71.5144 2200.0 77.976 2300.0 86.5126 2200.0 92.3203 2200.0 94.5549 2200.0 95.1218 2200.0 122.9151 3600.0 122.924 57000.0 124.9125 3400.0 124.9222 52000.0 152.0474 2300.0 163.8323 2400.0 173.5282 8300.0 181.1534 2200.0 190.9615 5500.0 191.9456 13000.0 195.2946 2400.0 208.9722 32000.0 236.0148 2700.0 END IONS BEGIN IONS SCANS=36 PEPMASS=208.8843 CHARGE=1 COLLISION_ENERGY=0.0 48.9552 2500.0 65.5327 2300.0 71.8696 2300.0 94.9295 7000.0 102.294 2500.0 118.2385 2200.0 127.4034 2300.0 149.6839 4800.0 149.6941 4500.0 173.5344 6700.0 185.9216 3800.0 196.2629 2700.0 END IONS BEGIN IONS SCANS=37 PEPMASS=381.08 CHARGE=1 COLLISION_ENERGY=0.0 58.0699 3100.0 59.6669 2400.0 60.7059 3300.0 62.5679 2400.0 65.523 2900.0 69.1319 2500.0 72.9659 2300.0 82.0182 2300.0 98.9379 4600.0 98.9837 2800.0 111.3894 2400.0 115.055 2700.0 128.9867 15000.0 135.0868 2200.0 141.507 3300.0 143.1401 2300.0 156.7794 2300.0 160.8656 2300.0 171.922 3600.0 172.9769 4200.0 173.5292 47000.0 173.5454 3200.0 182.9982 3000.0 192.9166 2900.0 197.0129 3100.0 212.6304 3500.0 214.988 6200.0 218.9831 3900.0 249.9041 3700.0 251.8901 3200.0 267.8828 10000.0 268.8909 3500.0 272.0125 2400.0 279.2061 2300.0 285.8889 3000.0 291.0396 2700.0 293.8969 9800.0 312.057 2400.0 355.508 3000.0 364.807 2300.0 END IONS BEGIN IONS SCANS=38 PEPMASS=705.1858 CHARGE=1 COLLISION_ENERGY=0.0 68.5479 4100.0 78.3512 6200.0 78.3556 9200.0 80.9041 4400.0 89.8706 4200.0 99.7816 4100.0 102.1244 5000.0 128.4084 4400.0 132.2776 4500.0 134.7683 4400.0 144.0109 5400.0 173.5298 49000.0 173.5405 21000.0 198.1193 4500.0 217.8153 5400.0 238.0772 4600.0 276.3061 4700.0 379.038 4900.0 437.0384 5000.0 493.473 4500.0 525.1178 20000.0 543.0364 11000.0 543.1315 1600000.0 543.3257 5500.0 701.1425 4800.0 705.1836 470000.0 END IONS BEGIN IONS SCANS=39 PEPMASS=304.1508 CHARGE=1 COLLISION_ENERGY=0.0 54.1881 2400.0 56.0494 280000.0 56.2099 2600.0 58.0651 280000.0 68.0494 45000.0 70.0651 390000.0 72.0806 36000.0 74.0235 20000.0 74.0599 43000.0 82.065 47000.0 84.0443 19000.0 84.0806 58000.0 85.0284 14000.0 85.076 160000.0 85.6689 2200.0 86.0599 320000.0 86.096 2400.0 88.0393 26000.0 88.0601 2400.0 94.0651 7000.0 96.0445 12000.0 96.0807 29000.0 97.076 7400.0 98.0599 13000.0 98.0963 71000.0 99.0915 18000.0 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28000.0 185.1422 8400.0 186.057 3900.0 186.0762 330000.0 196.1082 75000.0 196.1431 11000.0 197.0922 22000.0 203.1028 230000.0 208.8829 3600.0 214.1188 70000.0 215.1028 48000.0 222.124 16000.0 233.484 2600.0 240.1344 89000.0 258.1443 11000.0 259.1286 2800.0 262.9821 2500.0 268.1287 13000.0 286.1404 62000.0 END IONS BEGIN IONS SCANS=40 PEPMASS=242.1026 CHARGE=1 COLLISION_ENERGY=0.0 45.0334 25000.0 48.7359 2500.0 49.6066 2100.0 52.7876 2600.0 53.0384 43000.0 53.0409 3500.0 55.0176 24000.0 57.0333 49000.0 59.0489 4000.0 61.025 4000.0 61.0281 110000.0 63.0357 2300.0 64.7745 2200.0 66.4671 2300.0 69.0332 150000.0 71.0488 18000.0 73.0281 40000.0 80.0434 8900.0 80.0492 4500000.0 80.0543 22000.0 80.0583 110000.0 80.06 20000.0 80.0666 4300.0 81.0332 71000.0 81.0445 6200.0 81.5906 2600.0 83.0124 3300.0 85.0281 390000.0 85.0339 2700.0 87.0437 21000.0 91.0386 14000.0 96.0447 2200.0 97.0281 110000.0 99.0437 18000.0 107.4457 2300.0 109.0282 42000.0 110.0711 10000.0 127.0386 39000.0 134.2751 2900.0 156.8615 2600.0 170.9149 9400.0 173.5317 50000.0 173.5454 7500.0 180.0596 2400.0 187.9191 2600.0 188.9258 3800.0 195.641 2200.0 205.3279 2500.0 216.4029 2700.0 218.6451 2600.0 END IONS BEGIN IONS SCANS=41 PEPMASS=203.1505 CHARGE=1 COLLISION_ENERGY=0.0 41.0386 4900.0 42.0337 3800.0 42.5625 2300.0 43.0289 7900.0 43.0541 6700.0 44.0493 76000.0 46.0651 3500000.0 46.0675 43000.0 46.0686 36000.0 46.0698 16000.0 46.0713 3700.0 46.0727 4000.0 47.7927 2600.0 51.0522 2200.0 55.029 6600.0 55.0541 4700.0 55.9342 140000.0 56.0366 3800.0 56.0493 100000.0 57.0334 2600.0 57.0445 65000.0 58.0647 3300.0 64.4256 2600.0 68.0492 26000.0 70.0597 20000.0 70.0649 12000000.0 70.0716 84000.0 70.0737 46000.0 70.0739 200000.0 70.0763 19000.0 70.0788 11000.0 70.0816 6800.0 71.0488 300000.0 71.0603 3600000.0 71.0644 32000.0 71.0671 25000.0 71.0692 12000.0 71.929 40000.0 72.0804 670000.0 72.9368 26000.0 73.9783 5000.0 74.0234 38000.0 74.0597 20000.0 82.0133 3700.0 84.0441 10000.0 85.0471 3500.0 85.0758 20000.0 85.1791 4700.0 86.0598 34000.0 87.0787 4200.0 88.0755 110000.0 88.0867 2700000.0 88.0937 28000.0 88.0965 18000.0 88.0991 10000.0 88.3686 2500.0 89.9396 64000.0 90.9475 10000.0 95.06 4200.0 96.9606 4000.0 97.0757 77000.0 98.0598 51000.0 98.3998 2300.0 98.5365 2900.0 101.0946 24000.0 102.0547 67000.0 107.9502 49000.0 112.0868 120000.0 113.0708 22000.0 113.9634 9700.0 114.0548 140000.0 114.1022 4900.0 114.9713 11000.0 115.0864 330000.0 115.1004 3500.0 116.0704 2500000.0 116.0794 39000.0 117.7391 2500.0 120.2574 2300.0 120.3684 2100.0 125.9611 11000.0 126.1025 120000.0 126.2599 2200.0 127.0865 4600.0 128.9505 55000.0 130.3882 5500.0 130.9663 47000.0 133.097 54000.0 134.063 2300.0 138.964 7900.0 141.0655 15000.0 142.05 3400.0 143.0529 6400.0 144.0658 3700.0 147.3542 2600.0 148.9774 27000.0 150.4143 3800.0 156.9747 120000.0 157.0973 7800.0 158.0925 100000.0 158.1288 1600000.0 160.0611 2700.0 161.0638 10000.0 161.9809 3600.0 163.4969 5400.0 172.1082 120000.0 173.5238 63000.0 173.5407 72000.0 173.7237 4100.0 174.9858 25000.0 179.9906 50000.0 186.1239 4900.0 191.2231 2500.0 203.0858 9100.0 203.1507 170000.0 END IONS BEGIN IONS SCANS=42 PEPMASS=684.2564 CHARGE=1 COLLISION_ENERGY=0.0 68.7167 2300.0 69.0331 160000.0 71.0488 15000.0 71.0756 2200.0 73.0281 210000.0 73.2037 2500.0 73.4729 2300.0 76.1077 2200.0 79.9383 2500.0 81.0332 37000.0 82.0885 2200.0 83.8124 2200.0 85.0281 3000000.0 85.0336 13000.0 85.0374 22000.0 87.0438 28000.0 87.8495 2100.0 90.2567 2300.0 90.9476 2200.0 91.0387 1600000.0 91.0447 7500.0 93.4812 2200.0 95.0638 3300.0 97.0281 1300000.0 97.0347 6500.0 98.9289 2300.0 99.0437 150000.0 101.0229 3800.0 101.4097 2500.0 102.4825 2400.0 103.0387 120000.0 104.068 2800.0 108.203 2400.0 109.0205 3500.0 109.028 160000.0 112.2835 2300.0 115.0387 120000.0 117.0544 49000.0 123.4915 2200.0 127.0387 2000000.0 127.0475 40000.0 130.0498 5500.0 133.1836 2400.0 138.4641 2300.0 139.0388 2500.0 142.0021 2100.0 145.0493 2600000.0 145.0596 40000.0 148.06 6500.0 149.6902 5300.0 157.2183 2700.0 163.0437 7600.0 163.0601 1600000.0 167.9391 2300.0 169.0496 4400.0 173.5191 2800.0 173.5345 110000.0 173.5486 2500.0 174.235 2400.0 182.2655 3300.0 211.0605 2700.0 229.0708 9900.0 241.0703 19000.0 247.1091 2400.0 248.6729 2800.0 249.2995 2400.0 251.7856 3000.0 256.7496 2500.0 259.4573 2300.0 271.0811 20000.0 289.0938 2300.0 289.9689 2600.0 292.956 2100.0 296.4577 2600.0 298.963 2400.0 302.7986 2300.0 325.1133 21000.0 342.2433 2500.0 361.3881 2400.0 402.7353 2500.0 470.6229 2400.0 508.5574 2600.0 510.1204 2800.0 603.5557 3500.0 END IONS BEGIN IONS SCANS=43 PEPMASS=543.1328 CHARGE=1 COLLISION_ENERGY=0.0 63.6624 2200.0 66.7671 2300.0 66.8164 2000.0 70.2643 2400.0 78.9006 2400.0 104.9882 2600.0 105.106 2500.0 111.4681 2500.0 124.2568 2100.0 146.7687 2300.0 149.6686 3000.0 149.6878 11000.0 149.6966 3700.0 162.9424 2400.0 173.5354 25000.0 184.0735 3400.0 196.1144 2400.0 196.4873 2600.0 197.9621 2700.0 210.0505 2600.0 212.1544 2300.0 236.8719 2300.0 259.0003 3000.0 260.9927 2400.0 261.9883 3000.0 272.1903 2500.0 291.0392 13000.0 294.0061 3500.0 334.6439 2400.0 381.0799 100000.0 389.4751 2900.0 474.2448 2600.0 496.651 2700.0 499.1695 3000.0 543.1325 91000.0 END IONS BEGIN IONS SCANS=44 PEPMASS=487.1663 CHARGE=1 COLLISION_ENERGY=0.0 61.0281 63000.0 62.8221 2500.0 69.0331 13000.0 72.8888 2800.0 73.0281 21000.0 84.0442 5400.0 85.0226 3900.0 85.0279 180000.0 88.2228 2400.0 89.0442 2400.0 91.0386 100000.0 97.0278 67000.0 99.0437 4700.0 101.5377 2800.0 109.0281 12000.0 115.0388 3600.0 116.4145 2200.0 116.6616 2400.0 117.3942 2400.0 127.0386 65000.0 129.0653 2400.0 130.0497 4600.0 138.364 2200.0 142.2638 2400.0 145.0493 57000.0 150.0538 2600.0 153.2968 2200.0 162.0019 2300.0 163.0601 13000.0 173.5275 31000.0 173.9597 2700.0 182.0268 21000.0 190.0309 2400.0 191.0165 9800.0 201.193 2700.0 208.0427 16000.0 208.9537 21000.0 215.9717 3000.0 216.9752 6700.0 228.9755 3600.0 250.6823 2400.0 275.9924 21000.0 276.9962 42000.0 279.9542 2600.0 294.0433 3400.0 384.1469 3200.0 END IONS BEGIN IONS SCANS=45 PEPMASS=505.1767 CHARGE=1 COLLISION_ENERGY=0.0 60.5755 2600.0 61.0281 120000.0 64.9057 2200.0 66.988 2200.0 69.0332 23000.0 73.0281 39000.0 76.7513 2400.0 82.0982 2900.0 83.5284 2300.0 85.028 370000.0 88.2153 2700.0 88.2334 2100.0 90.1782 2500.0 91.0326 3900.0 91.0386 230000.0 94.4126 2700.0 95.8801 2300.0 97.028 140000.0 99.0439 16000.0 102.3631 2600.0 109.028 19000.0 111.2539 2300.0 115.0389 12000.0 115.746 2300.0 117.0548 2800.0 118.816 2900.0 127.0386 140000.0 130.0497 8700.0 130.464 2400.0 133.0607 6600.0 134.6072 2800.0 141.9599 2500.0 145.0492 160000.0 145.2476 2800.0 147.136 2400.0 148.06 3400.0 149.6783 2700.0 149.6884 4800.0 157.0602 5600.0 163.0597 57000.0 173.5356 61000.0 199.0706 3000.0 203.9034 8500.0 208.8821 3200.0 322.091 2400.0 325.3924 2400.0 335.5798 2500.0 342.9617 2700.0 349.6082 2900.0 384.1264 2300.0 421.7951 2400.0 END IONS BEGIN IONS SCANS=46 PEPMASS=258.1102 CHARGE=1 COLLISION_ENERGY=0.0 45.0333 170000.0 55.7994 2800.0 56.0494 7800.0 57.0333 40000.0 58.0651 71000.0 59.073 10000.0 60.0806 1400000.0 60.084 12000.0 62.9021 2300.0 64.4529 2900.0 67.7674 2400.0 70.0651 2400.0 71.0726 220000.0 75.0438 17000.0 77.8912 2300.0 79.5246 3400.0 83.723 2900.0 85.0283 2700.0 86.0961 3100000.0 86.1021 15000.0 86.1054 38000.0 91.2532 2700.0 93.173 2600.0 97.028 11000.0 98.9838 260000.0 100.9227 2500.0 104.0975 42000.0 104.1067 14000000.0 104.1207 71000.0 104.1209 300000.0 104.1229 41000.0 104.1325 33000.0 124.9995 4300000.0 125.0083 76000.0 125.0206 22000.0 130.1949 2500.0 141.9003 5900.0 143.01 3300.0 158.0322 2400.0 158.0952 2400.0 169.0496 3200.0 173.5243 83000.0 173.5319 32000.0 173.5428 64000.0 181.0263 32000.0 184.0734 2400000.0 199.0356 2700.0 221.2243 5100.0 223.1987 3100.0 240.0991 15000.0 243.2221 5700.0 258.1105 44000.0 265.1429 6600.0 END IONS BEGIN IONS SCANS=47 PEPMASS=558.0887 CHARGE=1 COLLISION_ENERGY=0.0 61.0282 2800.0 64.6569 2400.0 65.9038 2500.0 66.047 2000.0 66.693 2200.0 67.3241 2200.0 67.8335 2700.0 70.6678 2400.0 71.4911 2000.0 74.0502 2200.0 75.9925 2200.0 77.5982 2100.0 85.0284 12000.0 87.2961 2100.0 91.0387 5800.0 92.4288 2300.0 95.1028 2500.0 96.9852 2600.0 97.0283 6700.0 103.3957 2400.0 103.8177 2700.0 112.5367 2400.0 113.1591 2700.0 113.3861 2700.0 113.9413 4400.0 116.3593 2300.0 117.8623 2600.0 120.4019 2400.0 130.4902 2500.0 131.0637 2500.0 131.3353 2400.0 131.9503 63000.0 143.9506 7500.0 144.9583 30000.0 145.966 27000.0 149.6766 2900.0 149.6854 17000.0 149.6954 11000.0 149.7073 3000.0 149.9607 6200.0 156.9797 2300.0 157.9661 35000.0 161.9615 30000.0 163.9769 9600.0 169.9668 15000.0 171.9216 3100.0 173.5264 79000.0 173.5399 60000.0 173.944 3500.0 173.9612 300000.0 174.9689 120000.0 174.9902 7500.0 175.9768 8800.0 181.9664 33000.0 183.9834 5600.0 185.9611 350000.0 186.9689 300000.0 187.9168 3600.0 187.9767 13000.0 192.7504 2400.0 195.9822 3800.0 197.9612 78000.0 198.969 77000.0 199.9767 190000.0 201.9571 3300.0 203.9489 10000.0 203.9717 950000.0 203.9939 8000.0 204.9796 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307.0113 130000.0 312.2621 2600.0 319.0111 15000.0 320.019 83000.0 323.0068 4700.0 325.9925 8900.0 336.0137 160000.0 337.0219 280000.0 338.03 21000.0 343.9586 3500.0 349.021 15000.0 366.1698 2400.0 378.0261 12000.0 378.977 8200.0 379.0324 620000.0 396.0349 250000.0 397.0433 97000.0 427.9508 2700.0 439.0531 77000.0 440.9495 2800.0 486.2583 2600.0 506.6147 2400.0 531.4609 2600.0 END IONS BEGIN IONS SCANS=48 PEPMASS=527.1586 CHARGE=1 COLLISION_ENERGY=0.0 71.6231 2500.0 79.5252 2100.0 86.2059 2200.0 107.6391 2300.0 139.0715 2300.0 141.6462 2500.0 149.6828 3900.0 149.6937 5600.0 173.5263 3800.0 185.0415 7000.0 203.0522 12000.0 210.6463 2300.0 347.0948 12000.0 365.1047 470000.0 527.1572 63000.0 END IONS BEGIN IONS SCANS=49 PEPMASS=522.2034 CHARGE=1 COLLISION_ENERGY=0.0 61.0281 590000.0 62.9801 2200.0 65.1656 2400.0 65.5097 2500.0 69.0332 280000.0 69.5968 2500.0 70.3159 2300.0 71.0489 26000.0 73.0281 250000.0 73.3892 2500.0 81.0332 44000.0 82.1732 2400.0 85.0281 3400000.0 85.0342 13000.0 85.0374 30000.0 85.04 12000.0 87.0437 22000.0 91.0387 1400000.0 91.0449 4900.0 92.8474 2600.0 97.0281 1300000.0 97.0348 6000.0 98.0074 2100.0 99.0438 150000.0 101.0233 17000.0 103.0387 84000.0 104.0706 2800.0 107.6199 2300.0 109.0206 3700.0 109.0281 210000.0 115.0387 110000.0 117.0544 38000.0 117.7202 2600.0 127.028 5500.0 127.0387 2100000.0 127.0474 39000.0 127.0602 4700.0 130.2876 2900.0 134.344 2500.0 145.0494 2300000.0 145.0596 42000.0 145.0756 5100.0 160.8831 2300.0 163.0601 1100000.0 163.7284 2300.0 166.1016 2500.0 173.5253 100000.0 173.5435 41000.0 176.213 2500.0 179.2782 2300.0 184.6613 2200.0 206.8352 2800.0 211.5701 3200.0 222.3943 2400.0 231.4136 2400.0 232.5923 3000.0 237.8654 2300.0 241.0714 14000.0 246.8499 2100.0 253.0725 2400.0 271.082 2700.0 278.2887 2300.0 298.3737 2700.0 325.1149 2300.0 457.4796 2300.0 463.0646 3100.0 466.6128 2600.0 470.9329 2700.0 474.9734 2600.0 END IONS BEGIN IONS SCANS=50 PEPMASS=490.177 CHARGE=1 COLLISION_ENERGY=0.0 58.9969 2400.0 65.9915 2700.0 66.1955 2300.0 68.2927 2100.0 69.0329 2300.0 72.0804 28000.0 72.7995 2200.0 73.397 2200.0 76.0019 2300.0 76.7716 2100.0 79.4446 2300.0 84.0441 1500000.0 84.0527 24000.0 84.0532 8200.0 85.0282 40000.0 88.1339 2200.0 91.3003 2100.0 93.4608 2200.0 95.8387 2500.0 102.0546 920000.0 102.0618 4600.0 102.0906 6700.0 105.6548 2700.0 111.7617 2200.0 112.0343 2400.0 116.6058 2500.0 127.0388 3800.0 130.0336 3200.0 130.0495 1900000.0 130.0591 23000.0 130.8713 2600.0 131.0338 22000.0 136.24 2300.0 137.8505 2400.0 137.9807 2300.0 139.5491 2500.0 148.0601 3400000.0 148.0712 62000.0 148.0888 7600.0 148.0946 33000.0 155.9381 2500.0 156.1931 2100.0 169.9293 6100.0 173.5322 96000.0 178.2268 2100.0 183.7029 2600.0 203.9831 8000.0 212.9361 14000.0 230.9466 6000.0 246.4849 2500.0 247.9835 12000.0 271.9844 6000.0 275.1957 2500.0 283.9857 2900.0 305.8323 2300.0 314.3346 2600.0 345.8247 3600.0 377.6254 2500.0 404.9819 2300.0 407.4335 2300.0 417.067 2600.0 495.6085 2700.0 495.9007 2900.0 END IONS BEGIN IONS SCANS=51 PEPMASS=261.0371 CHARGE=1 COLLISION_ENERGY=0.0 45.0334 9600.0 53.0385 11000.0 55.0177 7900.0 55.9342 2300.0 56.7413 2300.0 57.0333 30000.0 57.3165 2300.0 59.5699 2700.0 60.7272 2800.0 61.0281 44000.0 65.7232 2200.0 67.0085 2000.0 69.0331 78000.0 69.4195 2500.0 71.0489 9400.0 71.3299 3100.0 73.0281 12000.0 75.367 2300.0 76.5573 2300.0 81.0292 2300.0 81.0331 41000.0 84.044 9200.0 85.028 360000.0 85.0342 2400.0 85.9191 2900.0 87.044 9100.0 91.039 8400.0 97.0213 3500.0 97.0279 120000.0 98.9839 890000.0 98.9927 14000.0 99.0436 17000.0 105.7278 2300.0 109.0281 39000.0 127.0387 41000.0 134.1994 2300.0 145.0495 3600.0 157.0468 11000.0 165.358 2500.0 170.9138 5100.0 171.9217 4400.0 173.5307 38000.0 178.9231 2400.0 196.9769 12000.0 200.0464 2400.0 249.9807 2100.0 END IONS BEGIN IONS SCANS=52 PEPMASS=343.1239 CHARGE=1 COLLISION_ENERGY=0.0 50.4143 2500.0 51.1651 2100.0 51.473 2800.0 51.5205 2100.0 53.5112 2100.0 53.7342 2200.0 53.7943 2200.0 55.0177 31000.0 57.0332 33000.0 61.0281 140000.0 61.8155 2400.0 63.0266 2300.0 67.1742 2900.0 69.0331 140000.0 69.9013 2400.0 70.8352 2100.0 71.0488 8200.0 72.0559 2900.0 73.0281 56000.0 78.2266 2200.0 80.0498 2700.0 81.0332 30000.0 82.1571 2400.0 85.0279 560000.0 86.0315 4200.0 86.2455 2400.0 87.0436 2500.0 89.3726 2500.0 89.6925 2100.0 89.7088 2300.0 91.0386 110000.0 96.9791 2200.0 97.0214 3100.0 97.0281 160000.0 97.096 2300.0 97.8688 2300.0 98.9126 2600.0 99.0438 38000.0 101.023 11000.0 102.2965 2500.0 108.1261 2700.0 109.0281 55000.0 115.0388 15000.0 120.3658 2300.0 124.9997 2800.0 127.0386 220000.0 128.042 5600.0 130.4353 2800.0 140.1935 3000.0 142.3426 2500.0 145.0491 50000.0 149.672 3200.0 149.6821 8000.0 149.6927 10000.0 149.7039 3000.0 151.4154 2300.0 173.5287 70000.0 173.5432 15000.0 182.7668 2500.0 188.5412 2300.0 190.2748 2300.0 199.4857 2700.0 199.4977 2500.0 303.5098 2800.0 313.433 2400.0 313.7907 2400.0 326.7228 2700.0 END IONS BEGIN IONS SCANS=53 PEPMASS=325.1135 CHARGE=1 COLLISION_ENERGY=0.0 49.6054 2300.0 50.1282 2500.0 50.5862 2300.0 50.5959 2200.0 53.0384 23000.0 55.0176 94000.0 55.9343 10000.0 57.0333 140000.0 57.2996 2200.0 57.8988 2300.0 58.7266 2600.0 60.8404 2700.0 61.0281 720000.0 65.7981 2500.0 69.0332 400000.0 70.9611 2400.0 71.0126 2600.0 71.0488 21000.0 73.0281 260000.0 77.3991 2300.0 80.8212 2400.0 81.0332 74000.0 83.8827 2200.0 84.4645 2400.0 85.028 1400000.0 85.036 7000.0 86.0314 2500.0 87.0437 20000.0 90.5097 2300.0 90.5182 2500.0 90.9473 12000.0 91.0386 370000.0 91.1724 2200.0 92.4834 2500.0 93.4094 2200.0 94.4748 2200.0 96.2306 2400.0 97.0215 2900.0 97.028 510000.0 97.3674 2600.0 97.7035 2200.0 97.7679 2300.0 99.0437 110000.0 101.023 44000.0 103.0387 9100.0 107.109 2500.0 107.9505 2500.0 109.028 110000.0 112.4598 2400.0 115.0387 36000.0 117.7027 3300.0 122.9936 2400.0 124.7723 2400.0 125.021 2800.0 127.0285 8100.0 127.0386 410000.0 131.9504 13000.0 132.9583 11000.0 138.0543 6200.0 142.2259 2300.0 142.7735 2200.0 143.951 2200.0 144.045 2500.0 144.9577 24000.0 145.0072 11000.0 145.0492 81000.0 145.9611 7900.0 147.7819 2300.0 149.472 2500.0 149.6829 4500.0 149.6931 4000.0 154.6547 2400.0 157.9659 17000.0 158.9688 21000.0 161.9616 3300.0 162.9642 6500.0 166.9625 2300.0 167.3524 2300.0 169.679 2200.0 171.9226 2900.0 173.521 17000.0 173.5312 140000.0 173.5414 43000.0 173.9359 2300.0 173.9608 12000.0 174.9643 3100.0 175.9717 3500.0 176.106 2500.0 176.7 2600.0 178.5184 2300.0 180.5246 2300.0 181.1691 2300.0 181.2053 2400.0 185.9609 14000.0 186.966 49000.0 187.9719 12000.0 188.6366 2600.0 188.978 2700.0 192.9936 2900.0 195.2649 2300.0 198.9638 4800.0 202.3826 3000.0 204.5361 2500.0 204.9734 2600.0 206.8874 6800.0 207.6599 2500.0 211.5447 2300.0 214.9947 2500.0 216.9753 8000.0 220.9355 2300.0 222.9302 5700.0 224.8978 2600.0 233.076 3100.0 234.9878 14000.0 237.4854 3000.0 244.8742 20000.0 249.2081 2400.0 252.9968 5900.0 260.8547 2600.0 299.714 2500.0 306.7525 2300.0 316.385 2300.0 END IONS BEGIN IONS SCANS=54 PEPMASS=233.9826 CHARGE=1 COLLISION_ENERGY=0.0 46.1378 2100.0 55.9342 14000.0 67.0316 2300.0 67.5583 2400.0 71.9293 2700.0 72.937 3600.0 73.0281 10000.0 73.9452 2900.0 81.0336 2200.0 90.9476 8000.0 101.0094 2400.0 102.6025 2400.0 107.9505 3400.0 131.9502 33000.0 132.9579 5200.0 133.9657 4400.0 144.9578 19000.0 145.9657 6800.0 149.9606 7200.0 152.0703 4200.0 173.5359 21000.0 180.9359 2700.0 192.9377 4400.0 196.9332 4800.0 210.9481 3500.0 END IONS BEGIN IONS SCANS=55 PEPMASS=204.087 CHARGE=1 COLLISION_ENERGY=0.0 41.0385 4600.0 42.0337 13000.0 43.0177 21000.0 44.0494 8500.0 45.0334 7200.0 46.8886 2400.0 49.9228 2100.0 53.0383 4900.0 55.0177 6900.0 55.0541 3900.0 55.9341 83000.0 56.0493 9100.0 56.9346 23000.0 57.0333 10000.0 59.597 2200.0 60.0441 22000.0 61.0281 30000.0 68.0492 110000.0 69.0332 22000.0 70.0648 24000.0 71.0489 7400.0 71.929 18000.0 72.044 13000.0 72.9297 3900.0 72.9361 30000.0 73.0281 9200.0 73.5913 2200.0 76.05 2200.0 76.5386 2200.0 80.0492 12000.0 81.0332 13000.0 84.0441 130000.0 85.0281 15000.0 89.9395 20000.0 90.9465 27000.0 94.0646 3900.0 96.038 4100.0 96.044 120000.0 97.0279 130000.0 98.0597 32000.0 99.0434 3700.0 100.0388 3300.0 103.0389 4100.0 107.9502 26000.0 108.0442 3300.0 108.9508 9500.0 109.0281 12000.0 110.0598 26000.0 112.0755 12000.0 113.9635 14000.0 114.0476 3000.0 114.0547 47000.0 114.9713 6700.0 122.0599 4400.0 123.1784 2300.0 124.0395 5700.0 124.0752 24000.0 125.9609 10000.0 126.0455 3200.0 126.0544 76000.0 127.039 3900.0 128.9504 16000.0 129.9526 15000.0 130.9663 10000.0 131.9503 13000.0 131.9672 13000.0 138.0547 74000.0 140.0703 2900.0 144.0653 55000.0 144.9581 4800.0 149.9599 3100.0 149.979 2300.0 156.065 6000.0 158.0814 13000.0 168.0654 12000.0 173.5276 26000.0 173.5455 3700.0 175.6997 2300.0 180.8881 13000.0 186.0763 2900.0 204.0878 4300.0 204.1384 9900.0 END IONS BEGIN IONS SCANS=56 PEPMASS=353.952 CHARGE=1 COLLISION_ENERGY=0.0 55.4746 2200.0 55.9342 49000.0 56.8948 2500.0 56.942 2900.0 59.9813 2200.0 69.9497 3500.0 71.0125 3300.0 71.9291 8100.0 72.9368 24000.0 73.0284 2700.0 73.9447 17000.0 87.9604 7600.0 89.9396 8600.0 90.9473 56000.0 91.9551 12000.0 93.6787 2300.0 99.9593 2200.0 102.9475 19000.0 105.9345 15000.0 106.9422 8000.0 107.9501 25000.0 108.9581 6500.0 112.7161 2200.0 113.9395 12000.0 115.9553 14000.0 116.9632 3700.0 117.9707 3500.0 118.9423 6900.0 120.9581 5800.0 125.9607 12000.0 126.9475 3900.0 127.9552 92000.0 128.963 21000.0 129.9709 3800.0 130.9423 7300.0 131.9501 170000.0 132.9579 27000.0 133.9657 42000.0 142.9425 5100.0 143.9501 30000.0 144.9579 130000.0 145.9539 3600.0 145.9658 110000.0 149.9607 28000.0 151.9763 21000.0 155.9503 15000.0 157.5339 2500.0 157.9658 65000.0 159.945 12000.0 160.9528 9500.0 161.9606 40000.0 162.9684 15000.0 163.9768 5800.0 171.9451 55000.0 172.9532 5300.0 173.5246 9200.0 173.5361 16000.0 173.9609 100000.0 177.9562 13000.0 183.9452 50000.0 187.9401 18000.0 188.9479 18000.0 189.9557 120000.0 190.9637 17000.0 191.9714 5800.0 199.9413 4100.0 201.956 9300.0 203.9354 23000.0 204.9433 2500.0 217.951 23000.0 263.9573 3200.0 END IONS BEGIN IONS SCANS=57 PEPMASS=305.9676 CHARGE=1 COLLISION_ENERGY=0.0 48.2816 2900.0 50.2798 2100.0 51.459 2200.0 55.0176 16000.0 55.9342 160000.0 56.0255 4300.0 57.0333 22000.0 60.0443 3700.0 61.0283 27000.0 68.0255 13000.0 68.0912 2500.0 69.0334 16000.0 69.9498 16000.0 70.1212 2200.0 71.929 36000.0 72.9369 69000.0 73.0281 11000.0 73.9446 28000.0 74.9527 4300.0 81.0331 10000.0 81.9497 3000.0 84.0203 34000.0 84.0442 16000.0 85.0232 3800.0 85.0281 120000.0 87.9604 23000.0 89.9396 25000.0 90.9379 3000.0 90.9474 200000.0 91.9554 18000.0 97.028 6800.0 98.0598 9600.0 99.9603 13000.0 102.031 3400.0 102.9474 48000.0 105.9344 26000.0 106.0496 21000.0 107.9502 41000.0 108.958 18000.0 113.94 10000.0 115.9552 11000.0 116.9635 7300.0 117.9709 6500.0 118.2689 2200.0 118.9424 25000.0 120.9584 12000.0 123.9451 12000.0 124.3906 2200.0 125.9606 17000.0 126.9476 14000.0 127.9553 57000.0 128.9631 52000.0 129.9707 7900.0 130.05 3800.0 130.9424 3900.0 131.9391 4900.0 131.9502 200000.0 131.9875 2900.0 132.958 74000.0 133.9659 38000.0 135.9455 6400.0 136.953 11000.0 139.9556 9200.0 141.9707 11000.0 142.9425 8500.0 143.9503 32000.0 144.0413 19000.0 144.9449 3700.0 144.9581 320000.0 144.9718 5500.0 145.9659 75000.0 146.9735 11000.0 148.9532 19000.0 149.9609 84000.0 150.9687 19000.0 151.9764 28000.0 155.0808 3700.0 155.9502 62000.0 156.9581 49000.0 157.9659 280000.0 157.9783 2500.0 158.9738 9100.0 159.9452 40000.0 160.9531 18000.0 161.9607 77000.0 162.9688 40000.0 163.9765 3000.0 168.9583 25000.0 169.9661 65000.0 170.9748 2300.0 171.9453 34000.0 172.9532 4900.0 173.5244 19000.0 173.539 20000.0 173.961 210000.0 174.9688 34000.0 175.9767 96000.0 177.9559 25000.0 180.8589 2600.0 185.961 140000.0 186.2222 2400.0 186.9689 76000.0 187.9767 41000.0 191.9716 54000.0 193.9878 7600.0 197.961 37000.0 203.9718 41000.0 209.9607 8600.0 210.9323 9800.0 211.9772 7400.0 215.9719 75000.0 220.0366 20000.0 220.3303 2400.0 221.0809 13000.0 227.9718 18000.0 233.9823 28000.0 235.0601 27000.0 259.8308 2200.0 275.2459 2800.0 289.1467 2500.0 293.3437 2300.0 301.868 2200.0 END IONS BEGIN IONS SCANS=58 PEPMASS=323.9782 CHARGE=1 COLLISION_ENERGY=0.0 53.1308 2100.0 55.0177 3000.0 55.3832 2200.0 55.9342 57000.0 57.0334 2800.0 59.3204 2400.0 63.3699 2500.0 63.6756 2600.0 63.8586 2100.0 67.8879 2300.0 68.0254 13000.0 69.0333 5600.0 69.9499 4800.0 71.9291 13000.0 72.7821 2700.0 72.9369 25000.0 73.9447 6400.0 75.4104 2200.0 81.0331 3500.0 82.2139 2800.0 84.882 2300.0 85.0282 23000.0 85.1393 2300.0 87.9603 8100.0 89.9397 13000.0 90.9474 52000.0 91.9555 3400.0 97.0283 7100.0 100.8327 2600.0 102.9475 13000.0 103.9556 2800.0 104.9286 2600.0 105.9343 8200.0 107.9502 23000.0 108.9577 3200.0 113.9405 3500.0 114.9476 3200.0 115.9549 5600.0 116.9639 8800.0 118.9423 5300.0 125.9608 5100.0 126.948 3400.0 127.9554 17000.0 128.9631 16000.0 129.1199 2300.0 129.9715 2200.0 131.9502 100000.0 131.9862 2700.0 132.958 49000.0 133.9658 19000.0 135.9438 2700.0 136.9538 4800.0 139.9553 14000.0 141.3861 2500.0 141.9702 3600.0 142.9427 3700.0 143.9505 26000.0 144.0414 3400.0 144.9581 120000.0 145.9659 41000.0 147.7284 2500.0 149.961 38000.0 150.9685 2500.0 151.9763 5200.0 153.075 2400.0 155.9501 36000.0 156.9584 20000.0 157.9659 250000.0 159.9449 18000.0 160.9537 9200.0 161.961 58000.0 162.9689 10000.0 168.9584 6900.0 169.966 42000.0 171.9453 18000.0 173.5246 9700.0 173.5314 27000.0 173.5431 4800.0 173.961 110000.0 173.9772 4600.0 174.969 69000.0 175.9768 36000.0 177.9564 5500.0 181.9655 3300.0 183.9445 2500.0 185.9417 4400.0 185.9611 230000.0 186.9689 83000.0 187.9768 53000.0 191.9718 23000.0 192.9793 4000.0 193.9869 3000.0 197.9611 41000.0 203.9717 42000.0 209.9631 3700.0 211.9769 3400.0 215.9718 59000.0 227.9361 6400.0 227.9715 7900.0 229.9524 4000.0 233.9825 43000.0 241.775 2400.0 245.9451 2600.0 251.9929 25000.0 256.6271 2400.0 END IONS BEGIN IONS SCANS=59 PEPMASS=360.1504 CHARGE=1 COLLISION_ENERGY=0.0 53.0022 5500.0 53.0385 65000.0 54.5414 2400.0 54.7234 2300.0 55.0176 830000.0 57.0333 760000.0 57.0368 2300.0 57.6014 2600.0 59.049 2400.0 60.044 2400.0 60.456 2600.0 61.0282 460000.0 61.5144 2600.0 63.0712 2300.0 64.0223 2200.0 67.2843 2400.0 68.9776 2300.0 69.0333 3400000.0 69.0375 14000.0 69.0399 11000.0 69.0421 3700.0 70.9351 2500.0 71.0125 39000.0 71.0488 200000.0 72.0805 9300.0 73.028 530000.0 73.0331 4200.0 73.757 2400.0 74.2837 2500.0 75.2345 2300.0 79.6508 2100.0 80.6186 2700.0 80.8618 2300.0 81.0332 300000.0 81.6274 2200.0 83.0125 31000.0 83.071 2300.0 85.0217 7400.0 85.0281 9900000.0 85.034 17000.0 85.0378 220000.0 85.04 18000.0 85.0434 7800.0 85.0473 3800.0 85.7327 2500.0 87.0438 120000.0 88.4446 2900.0 91.0326 4300.0 91.0387 270000.0 94.3549 2200.0 94.642 2400.0 94.7766 2500.0 96.0072 2200.0 96.3305 2500.0 97.0281 3000000.0 97.0352 11000.0 98.4282 2400.0 99.0437 1000000.0 99.0507 4100.0 101.023 400000.0 103.0387 69000.0 103.3252 2500.0 108.5366 2300.0 109.0281 650000.0 109.0371 5400.0 111.0433 4900.0 115.0303 11000.0 115.0386 450000.0 115.0483 4100.0 117.0546 32000.0 119.1571 2500.0 122.7512 2300.0 122.8987 2700.0 123.0433 2700.0 127.0267 2000.0 127.0386 8600000.0 127.0478 130000.0 127.0582 35000.0 127.0607 15000.0 130.7706 2400.0 133.0493 67000.0 135.0437 3200.0 136.0744 2300.0 142.8199 2700.0 145.0365 8700.0 145.0493 1900000.0 145.0608 20000.0 145.0636 3900.0 149.6832 4900.0 149.6936 4500.0 151.0386 2900.0 154.5882 2300.0 157.5684 2500.0 159.1232 2400.0 162.075 3700.0 162.341 2300.0 163.0599 150000.0 168.3094 2500.0 169.0482 5500.0 169.5158 2200.0 169.9258 3400.0 171.9217 36000.0 173.5244 63000.0 173.5408 70000.0 175.0715 3100.0 175.325 2400.0 180.0863 34000.0 181.6697 2500.0 181.741 2500.0 185.9011 15000.0 187.9166 4700.0 195.9973 2400.0 199.9536 13000.0 203.9119 7000.0 204.4745 2300.0 208.3769 2400.0 211.9158 4700.0 231.3655 2300.0 238.7022 2800.0 243.3811 2400.0 245.1101 2500.0 246.0314 2400.0 269.6776 2400.0 279.8033 2300.0 291.0742 2800.0 293.3068 2700.0 302.4362 2700.0 315.3656 2200.0 319.5566 2300.0 330.2376 2900.0 338.028 2500.0 346.7327 2500.0 353.3468 3400.0 END IONS BEGIN IONS SCANS=60 PEPMASS=396.0357 CHARGE=1 COLLISION_ENERGY=0.0 54.2803 2300.0 55.0179 6600.0 55.9343 33000.0 56.1382 2200.0 60.3227 2300.0 61.0284 8800.0 61.5814 2200.0 63.5156 2300.0 65.0286 2300.0 65.1765 2300.0 66.4871 2200.0 67.1389 2100.0 69.0334 5000.0 69.0433 2400.0 69.1826 2400.0 69.8885 2300.0 71.6432 2300.0 71.9293 3100.0 72.0804 15000.0 72.9372 7800.0 73.0282 4800.0 75.0347 2600.0 75.7552 2900.0 76.9872 2300.0 77.6595 2400.0 78.1188 2700.0 79.3071 2500.0 81.0333 14000.0 84.4562 2200.0 85.0282 16000.0 86.4229 2600.0 87.2942 2600.0 90.9477 25000.0 91.0388 6800.0 91.1394 2400.0 92.6698 2100.0 94.391 2500.0 97.0283 42000.0 97.0854 2400.0 98.6971 2400.0 99.0435 6500.0 99.0708 2500.0 99.7163 2300.0 102.5296 2700.0 102.7065 2200.0 102.9476 6300.0 103.3815 2200.0 105.9345 2700.0 107.9502 2600.0 108.6726 2300.0 109.0283 19000.0 113.5429 2400.0 113.9408 14000.0 115.6151 2400.0 115.9559 2600.0 117.1949 2500.0 121.0235 2200.0 126.9494 3300.0 127.0387 25000.0 127.5956 2700.0 127.9144 2300.0 128.9643 2700.0 131.9502 210000.0 132.9581 19000.0 133.9662 13000.0 138.8849 2400.0 141.9712 12000.0 143.9395 2700.0 143.9504 61000.0 144.9581 150000.0 145.9658 38000.0 149.6687 3500.0 149.6895 5600.0 149.9609 60000.0 151.9768 3600.0 152.7973 2400.0 153.9711 14000.0 156.9584 28000.0 157.966 110000.0 157.9798 2500.0 158.9739 28000.0 159.9436 2400.0 159.9807 3700.0 161.392 2300.0 161.9608 210000.0 162.9687 13000.0 163.9767 12000.0 165.6132 2500.0 165.9534 2500.0 166.6507 2400.0 168.9585 4500.0 169.9508 3400.0 169.966 410000.0 169.9816 3600.0 169.9897 2600.0 170.9737 21000.0 171.9455 22000.0 171.9823 15000.0 173.5222 21000.0 173.5339 110000.0 173.5437 6600.0 173.9436 5100.0 173.9609 760000.0 174.9688 56000.0 175.9767 32000.0 177.1972 2600.0 179.9721 8700.0 181.966 84000.0 183.9451 20000.0 184.3781 2400.0 185.961 340000.0 186.9688 140000.0 187.9765 130000.0 189.9555 8400.0 191.9712 22000.0 195.9816 11000.0 197.961 130000.0 198.9689 110000.0 199.0917 2900.0 199.9766 320000.0 201.9563 6900.0 203.9716 160000.0 204.9905 3000.0 205.8978 2600.0 209.8571 2300.0 209.9612 230000.0 210.9688 47000.0 211.9767 110000.0 213.9557 3300.0 214.0667 2500.0 214.9624 3000.0 215.9717 280000.0 216.9795 83000.0 217.9872 63000.0 218.9576 2400.0 222.9686 12000.0 223.9762 13000.0 227.9716 410000.0 227.9978 3400.0 228.9141 2600.0 228.9791 6200.0 233.9821 100000.0 234.9898 120000.0 235.9979 7900.0 237.9519 2600.0 239.6389 2500.0 239.9716 69000.0 239.9969 2500.0 240.9787 5400.0 245.9822 18000.0 251.9944 4100.0 257.982 93000.0 269.9829 12000.0 275.9577 11000.0 275.9928 1300000.0 276.0278 16000.0 277.0008 100000.0 282.031 3000.0 283.8485 6300.0 287.9929 36000.0 288.3668 2400.0 288.9996 17000.0 306.0031 38000.0 317.3123 2600.0 322.2912 3300.0 342.5825 2600.0 344.6064 2600.0 391.015 2900.0 392.565 3000.0 END IONS BEGIN IONS SCANS=61 PEPMASS=331.8869 CHARGE=1 COLLISION_ENERGY=0.0 49.7363 2400.0 52.2542 2200.0 55.9343 140000.0 57.4261 2300.0 58.4167 2600.0 66.7369 2600.0 67.4251 2100.0 69.0333 11000.0 72.0806 2700.0 78.6509 2000.0 78.701 2600.0 90.9475 3100.0 104.5142 2700.0 107.7344 2500.0 113.9633 8500.0 117.0545 5000.0 126.3702 2900.0 131.95 7500.0 135.9009 7700.0 144.9588 2900.0 149.68 3700.0 149.6904 5200.0 153.9113 62000.0 157.966 4400.0 163.915 2300.0 164.0711 4100.0 169.9063 8800.0 170.9143 27000.0 171.9082 3000.0 171.9219 710000.0 172.8619 3200.0 173.5371 27000.0 173.9617 3300.0 180.8885 6700.0 181.9172 11000.0 183.9217 4300.0 184.8476 2400.0 185.4046 2500.0 185.9013 390000.0 185.9608 5700.0 186.9702 3100.0 187.9164 97000.0 188.9249 28000.0 190.8724 25000.0 196.8828 3200.0 203.9115 120000.0 205.9274 18000.0 208.8596 4800.0 208.8833 180000.0 211.9168 31000.0 215.9715 4500.0 218.8686 7100.0 223.9175 6600.0 224.9253 11000.0 225.2711 2300.0 226.8939 56000.0 229.928 12000.0 231.8993 41000.0 236.8783 6800.0 237.9323 2700.0 240.1646 2500.0 241.8836 6600.0 241.9285 2900.0 242.1564 2700.0 248.9251 3100.0 249.9096 6200.0 259.9021 6700.0 266.9354 11000.0 267.8846 6800.0 268.4376 2500.0 280.3827 2400.0 296.0828 2700.0 339.4205 2700.0 END IONS BEGIN IONS SCANS=62 PEPMASS=259.9017 CHARGE=1 COLLISION_ENERGY=0.0 47.7445 2400.0 49.4472 2400.0 50.097 2400.0 50.5832 2300.0 55.9342 85000.0 59.344 2500.0 59.6207 2100.0 65.782 2600.0 70.447 2200.0 71.0648 2100.0 83.9527 2200.0 86.0535 2500.0 86.0963 4200.0 88.2091 2600.0 101.531 2400.0 104.1065 5400.0 129.9329 2800.0 131.0496 5100.0 144.3818 2500.0 145.028 10000.0 149.6712 6900.0 149.6818 9700.0 149.6929 10000.0 153.9112 16000.0 163.0385 3600.0 170.9144 3100.0 171.9217 82000.0 173.5287 3800.0 173.5378 10000.0 175.039 40000.0 185.901 43000.0 187.9166 21000.0 188.9242 2600.0 189.4841 2600.0 203.9115 12000.0 236.9409 8300.0 260.1264 3000.0 END IONS BEGIN IONS SCANS=63 PEPMASS=210.9331 CHARGE=1 COLLISION_ENERGY=0.0 43.0175 3400.0 55.9341 8000.0 56.9645 9300.0 64.7324 2200.0 67.6013 2200.0 71.5691 2100.0 71.929 12000.0 72.9368 2500.0 78.3455 2100.0 89.9396 5500.0 100.9236 2400.0 107.9501 12000.0 124.1645 2500.0 125.9605 3500.0 128.5462 2700.0 130.2889 2400.0 130.9816 3100.0 151.075 4000.0 162.9269 9900.0 165.5062 2400.0 169.9061 23000.0 170.9136 3900.0 172.0138 2900.0 173.528 19000.0 173.5424 4800.0 178.9231 3400.0 180.9373 20000.0 187.9166 330000.0 188.9224 2800.0 192.9373 7700.0 196.9325 21000.0 205.9273 75000.0 210.948 28000.0 END IONS BEGIN IONS SCANS=64 PEPMASS=365.1057 CHARGE=1 COLLISION_ENERGY=0.0 51.9534 2600.0 54.2804 2500.0 55.0061 2200.0 55.0997 2500.0 55.7975 2300.0 57.3258 2200.0 58.7249 2800.0 61.2599 2400.0 61.8519 2500.0 62.5361 2500.0 66.0763 2200.0 66.6093 2300.0 66.968 2500.0 67.0722 2100.0 69.2571 2500.0 69.8223 2600.0 72.9369 2100.0 73.9954 2100.0 75.9804 2300.0 76.2764 2400.0 76.5379 2200.0 78.528 2300.0 79.8268 2400.0 80.3636 2600.0 81.577 2500.0 82.3638 2100.0 89.963 2600.0 96.8581 2600.0 97.2926 2600.0 99.843 2300.0 106.2056 2300.0 113.3472 2400.0 121.2627 2600.0 125.4686 2400.0 132.9692 5200.0 133.9764 2800.0 135.572 3100.0 139.164 2500.0 143.9765 2300.0 148.9637 3300.0 150.6254 3100.0 150.6463 2500.0 158.1618 2600.0 163.2906 2500.0 173.1577 2400.0 173.5276 110000.0 173.5442 22000.0 183.2253 2500.0 183.399 2800.0 185.0148 3300.0 185.042 800000.0 185.0587 10000.0 187.3024 2400.0 194.3857 2800.0 194.3938 2800.0 194.957 27000.0 196.933 3200.0 203.0294 2700.0 203.0527 2700000.0 203.0973 5200.0 208.6414 2700.0 208.8024 3300.0 210.3048 2700.0 212.9703 2700.0 213.9067 2500.0 236.0307 3400.0 256.765 2500.0 267.8829 8600.0 272.5621 2200.0 277.2651 2400.0 277.9981 2800.0 281.4192 2400.0 297.7086 2400.0 306.0945 2300.0 323.5245 2600.0 365.1058 350000.0 END IONS BEGIN IONS SCANS=65 PEPMASS=205.1186 CHARGE=1 COLLISION_ENERGY=0.0 42.0338 10000.0 42.3089 2400.0 43.0177 85000.0 44.0494 14000.0 46.5122 2200.0 47.8795 2200.0 50.7855 2400.0 51.2862 2300.0 53.0384 10000.0 53.3658 2600.0 53.8095 2300.0 54.7141 2400.0 55.054 680000.0 55.0572 9600.0 55.0587 7200.0 55.9342 46000.0 56.0492 290000.0 56.0524 4000.0 57.0333 8100.0 57.0556 2400.0 58.9522 2700.0 60.0441 150000.0 60.5654 2500.0 61.1665 2200.0 63.3154 2300.0 63.8468 2400.0 64.5478 2400.0 65.0383 12000.0 67.0414 23000.0 67.054 24000.0 70.0648 69000.0 70.2633 2200.0 70.428 2200.0 71.9043 2400.0 71.9612 2100.0 72.044 19000.0 72.0804 7300.0 72.937 6500.0 73.0642 2800.0 74.0233 710000.0 74.028 5500.0 74.0597 23000.0 76.5562 2300.0 80.0492 50000.0 82.0648 3600000.0 82.0735 21000.0 82.0744 88000.0 82.0761 16000.0 82.0799 4100.0 83.0488 51000.0 84.0441 16000.0 84.0805 77000.0 85.0473 5300.0 86.9173 2900.0 86.9923 3100.0 89.5014 2200.0 90.9474 11000.0 93.2181 2300.0 95.012 2700.0 96.0803 7200.0 97.0479 2700.0 98.0598 20000.0 99.0915 540000.0 99.0983 4400.0 100.0393 12000.0 100.0753 560000.0 100.0823 3100.0 101.0592 5200.0 103.0228 2800.0 107.0637 2200.0 107.9502 6900.0 110.0597 23000.0 111.0436 3200.0 113.0789 3400.0 113.1069 8100.0 113.9636 12000.0 114.0911 21000.0 114.9711 10000.0 115.0237 2400.0 116.0704 43000.0 123.0079 6400.0 123.0914 430000.0 123.1002 2800.0 124.0754 180000.0 124.0853 2500.0 127.0864 7900.0 128.0593 5500.0 128.0703 1200000.0 128.0795 8200.0 128.0921 3800.0 128.9506 16000.0 135.9446 4200.0 139.0584 4200.0 141.0894 4700.0 141.102 690000.0 141.1129 2600.0 141.1153 3900.0 142.0733 8800.0 142.086 390000.0 142.0993 4300.0 145.097 60000.0 146.0808 25000.0 170.0812 250000.0 173.5284 23000.0 173.5428 5100.0 177.8413 2500.0 187.1078 34000.0 210.1382 2400.0 END IONS BEGIN IONS SCANS=66 PEPMASS=316.1397 CHARGE=1 COLLISION_ENERGY=0.0 49.8645 2400.0 55.0179 16000.0 55.3117 2300.0 57.0334 61000.0 61.0283 110000.0 63.3203 2200.0 67.4811 2300.0 69.0334 31000.0 71.3434 2100.0 72.0806 10000.0 73.0245 2300.0 73.0283 49000.0 75.1735 2100.0 81.0334 30000.0 81.6805 2300.0 82.1708 2700.0 83.0493 2700.0 85.0283 240000.0 91.0388 21000.0 91.0541 21000.0 96.0447 3600.0 97.0283 67000.0 99.044 8300.0 99.0728 2400.0 103.0388 110000.0 103.0547 6800.0 105.0699 26000.0 106.7849 2100.0 108.018 2200.0 115.0543 21000.0 117.07 13000.0 118.065 4300.0 119.0347 3000.0 119.0491 15000.0 121.0646 14000.0 123.044 34000.0 127.0388 41000.0 128.9507 6100.0 129.0698 24000.0 130.9668 2900.0 131.0491 54000.0 132.0809 4200.0 133.0647 60000.0 137.0597 550000.0 143.0491 74000.0 144.066 9400.0 145.0648 44000.0 146.0602 26000.0 147.0442 18000.0 147.0803 8800.0 149.0457 5700.0 149.0597 370000.0 149.0738 6500.0 150.0911 5900.0 151.0753 530000.0 151.0892 4800.0 153.0697 5800.0 154.0863 28000.0 157.0647 68000.0 157.0774 3400.0 160.0524 7300.0 160.0755 26000.0 161.0441 7200.0 161.0597 390000.0 161.0754 10000.0 162.0549 11000.0 163.0394 8400.0 163.0754 56000.0 164.0481 2900.0 164.0706 310000.0 165.0549 32000.0 166.0864 59000.0 167.0506 3000.0 167.0705 17000.0 169.0651 13000.0 171.0803 13000.0 173.0598 61000.0 173.5228 12000.0 173.5346 32000.0 173.5424 4800.0 175.0393 3400.0 175.0596 7800.0 175.0755 170000.0 176.0709 22000.0 177.0548 56000.0 177.0785 27000.0 178.0864 790000.0 179.0441 3200.0 179.0704 610000.0 181.065 32000.0 184.0755 5500.0 185.0598 95000.0 187.0756 32000.0 187.0929 2800.0 188.0706 18000.0 189.0543 24000.0 189.0914 25000.0 190.0864 64000.0 191.0703 120000.0 192.0655 3100.0 192.1023 23000.0 193.0866 14000.0 194.0815 15000.0 195.0656 7300.0 196.0087 2300.0 196.0969 140000.0 197.0592 12000.0 197.9887 5800.0 198.5319 3300.0 199.0757 65000.0 201.0554 8300.0 202.0865 66000.0 203.0704 140000.0 203.0917 3100.0 203.883 6600.0 204.1017 8300.0 205.0859 17000.0 207.0659 10000.0 208.0971 53000.0 209.0608 7500.0 209.0809 18000.0 212.9277 4500.0 214.0862 15000.0 215.0705 34000.0 216.1023 41000.0 217.0863 51000.0 218.0814 92000.0 219.0661 14000.0 219.0895 39000.0 220.0971 180000.0 221.0812 65000.0 225.0523 2600.0 226.0864 3000.0 227.0705 46000.0 232.0969 32000.0 233.0811 20000.0 234.0768 22000.0 234.1126 49000.0 243.8786 5300.0 244.097 56000.0 245.0809 56000.0 250.1074 41000.0 251.8329 2300.0 258.8885 15000.0 262.1075 76000.0 263.091 36000.0 276.8987 6700.0 280.1184 130000.0 292.8959 4900.0 294.8744 2900.0 298.1291 82000.0 316.0966 10000.0 316.1393 340000.0 322.4838 2600.0 END IONS BEGIN IONS SCANS=67 PEPMASS=507.8386 CHARGE=1 COLLISION_ENERGY=0.0 62.8567 2200.0 62.9682 2400.0 64.499 2100.0 68.0754 3000.0 69.9884 2200.0 90.0503 2700.0 90.9473 7000.0 93.1724 2400.0 94.9614 2400.0 103.5829 2600.0 113.9635 14000.0 118.2782 2300.0 131.0645 2900.0 132.8412 2600.0 143.0314 22000.0 149.6891 19000.0 162.8777 19000.0 168.209 3100.0 170.8556 2700.0 173.5231 5500.0 173.5354 16000.0 180.888 170000.0 185.042 3300.0 185.8936 22000.0 195.9428 16000.0 198.8987 5700.0 203.9042 500000.0 213.0005 3000.0 216.9065 2800.0 218.6366 2500.0 219.8979 4100.0 220.4959 2600.0 221.9158 3900.0 225.9164 5000.0 226.9252 4900.0 231.355 2400.0 234.8628 17000.0 237.9108 6800.0 249.9187 4600.0 252.873 29000.0 256.8141 2700.0 257.8502 4300.0 257.8782 84000.0 267.9277 28000.0 275.8895 33000.0 302.8576 2700.0 321.6351 2700.0 324.8954 2600.0 341.4314 2300.0 342.7529 2600.0 377.1262 2600.0 END IONS BEGIN IONS SCANS=68 PEPMASS=274.9364 CHARGE=1 COLLISION_ENERGY=0.0 47.2129 2000.0 47.5967 2700.0 47.9414 2500.0 51.5947 2200.0 53.4577 2400.0 54.4515 2200.0 55.9342 470000.0 56.2256 2600.0 57.1356 2200.0 57.1677 2200.0 66.351 2200.0 70.9576 5800.0 71.929 37000.0 72.9369 46000.0 73.7576 2500.0 73.9447 61000.0 84.0287 2300.0 84.7706 2400.0 87.3127 2200.0 88.9682 34000.0 89.9396 120000.0 90.9474 47000.0 91.9553 26000.0 92.4929 2400.0 96.9607 55000.0 100.0753 2300.0 105.3704 2300.0 105.9346 36000.0 107.9501 200000.0 112.9555 13000.0 113.9634 97000.0 114.9712 200000.0 118.086 41000.0 123.945 6400.0 125.9607 72000.0 128.9383 12000.0 128.9505 500000.0 128.9619 10000.0 130.9556 3500.0 130.9662 500000.0 130.9776 5200.0 131.9504 24000.0 131.9739 17000.0 138.0547 26000.0 143.9743 2500.0 144.958 22000.0 145.9659 3900.0 146.9611 89000.0 148.9635 4600.0 148.9767 240000.0 149.6837 5400.0 149.6942 4100.0 154.3228 2500.0 157.966 33000.0 159.5883 2300.0 159.9455 2400.0 167.9184 2300.0 171.1208 2300.0 173.521 5300.0 173.5324 44000.0 173.5406 16000.0 182.2921 2400.0 185.9611 14000.0 186.9691 7100.0 192.8134 2400.0 203.1913 2500.0 211.6517 2500.0 212.6013 2600.0 216.7854 2300.0 222.441 2500.0 223.9964 2700.0 244.1376 2800.0 244.2275 2400.0 253.7108 2700.0 256.8972 3100.0 265.2171 2400.0 END IONS BEGIN IONS SCANS=69 PEPMASS=240.0717 CHARGE=1 COLLISION_ENERGY=0.0 43.0177 14000.0 45.0333 5400.0 45.6393 2200.0 46.065 37000.0 47.4611 2100.0 47.8486 2900.0 48.2942 2400.0 48.8041 2400.0 49.6114 2200.0 50.3935 2500.0 53.4101 2100.0 54.4782 2400.0 54.5401 2400.0 55.9342 8000.0 55.9431 2200.0 56.6787 2700.0 56.8837 2400.0 56.9843 2200.0 57.4339 2100.0 58.8417 2900.0 60.0442 7200.0 60.5487 2300.0 61.7009 2300.0 62.4537 2200.0 63.8649 2200.0 65.158 2700.0 65.6776 2500.0 67.7079 2400.0 67.722 2100.0 69.0332 18000.0 70.3815 2300.0 71.0126 18000.0 71.0242 2200.0 72.0437 5500.0 72.2038 2600.0 72.4978 2500.0 72.8947 2300.0 73.0281 2600.0 73.4209 2600.0 73.4573 2300.0 73.6569 2300.0 74.185 2200.0 75.4506 2200.0 75.9434 2500.0 80.5211 2300.0 80.7201 2300.0 81.019 2200.0 81.0444 12000.0 81.185 2600.0 81.3423 2200.0 82.9554 2400.0 83.4316 2200.0 84.6665 2300.0 85.0281 28000.0 87.7135 2600.0 88.0391 9700.0 89.0231 4700.0 90.9473 2700.0 93.0453 2300.0 94.7061 2200.0 95.0125 150000.0 97.0282 14000.0 99.0072 16000.0 104.9805 8800.0 106.7515 2700.0 107.3012 2500.0 109.5129 2500.0 113.014 8200.0 113.023 910000.0 113.0323 2000.0 113.7525 2200.0 113.8758 2500.0 114.995 2300.0 115.0023 120000.0 116.9658 11000.0 119.8739 2300.0 121.6358 2500.0 122.8652 2600.0 122.9987 2700.0 123.0074 430000.0 124.9043 2200.0 125.6126 2500.0 129.3778 2900.0 130.9817 14000.0 131.0337 48000.0 132.0661 5500.0 134.9201 7000.0 140.9659 11000.0 141.0035 6100.0 141.0181 460000.0 141.0294 3700.0 144.9968 2500.0 145.9324 2500.0 149.6816 3100.0 149.6921 5700.0 151.0614 34000.0 151.0735 2400.0 151.1813 2700.0 164.0918 2500.0 164.367 2200.0 168.9965 7300.0 169.0132 1500000.0 169.0301 28000.0 170.9144 32000.0 171.9215 3000.0 173.5316 76000.0 173.538 9100.0 173.5462 2600.0 177.0402 31000.0 182.4298 2300.0 184.6277 2500.0 186.6575 2400.0 187.9169 8600.0 188.9241 22000.0 193.9303 2800.0 194.0675 78000.0 194.4558 2600.0 194.4796 2900.0 195.0511 2700.0 196.2924 2600.0 197.4452 2300.0 202.6908 2400.0 220.6354 2700.0 236.754 2100.0 238.3508 2500.0 246.7675 2300.0 END IONS BEGIN IONS SCANS=70 PEPMASS=202.9515 CHARGE=1 COLLISION_ENERGY=0.0 41.6382 2100.0 43.0177 3500.0 43.3103 2300.0 45.1655 2100.0 46.065 51000.0 49.5124 2500.0 49.5335 2500.0 49.7554 2300.0 50.6031 2700.0 50.9942 2100.0 52.3806 2300.0 52.7286 2300.0 54.1008 2200.0 55.9343 3200000.0 55.9373 18000.0 55.939 14000.0 55.9406 7400.0 56.0493 4800.0 57.8231 2900.0 66.8123 2500.0 67.0747 2500.0 70.0648 240000.0 70.393 2400.0 70.9575 40000.0 71.0489 11000.0 71.0601 74000.0 71.786 2300.0 71.9194 3400.0 71.929 830000.0 72.0802 8700.0 72.9368 530000.0 73.1637 2200.0 73.9447 79000.0 74.0233 6400.0 74.0601 3400.0 74.525 2500.0 78.6584 2600.0 82.0136 3100.0 82.7963 2100.0 83.5659 2500.0 84.0441 2800.0 88.0866 43000.0 88.9681 78000.0 89.9303 3200.0 89.9396 1000000.0 89.9478 11000.0 90.3894 2400.0 90.7394 2300.0 90.9474 350000.0 91.0779 2300.0 91.9551 29000.0 96.9606 130000.0 98.0598 43000.0 100.024 11000.0 102.0548 2900.0 105.9345 40000.0 107.9502 1500000.0 107.9603 14000.0 108.9581 23000.0 109.1865 2200.0 111.2256 2500.0 112.9555 71000.0 113.9634 250000.0 114.0544 3300.0 114.963 13000.0 114.9712 460000.0 114.9807 2800.0 115.9539 4000.0 116.0702 43000.0 119.0852 2500.0 121.0767 2400.0 124.967 4100.0 125.9501 2700.0 125.9606 550000.0 125.9715 3700.0 128.9396 2900.0 128.9504 1200000.0 128.96 3500.0 128.9614 32000.0 130.9661 1200000.0 130.9804 18000.0 131.974 32000.0 133.9641 3200.0 135.0143 2100.0 140.0712 6600.0 142.0498 2700.0 143.0529 4200.0 144.0648 11000.0 145.7249 2500.0 146.9611 200000.0 148.9635 4700.0 148.9767 600000.0 150.0623 2600.0 152.7845 2300.0 156.9743 42000.0 158.1286 24000.0 171.9914 3100.0 173.5227 6400.0 173.5323 61000.0 173.5423 15000.0 174.9855 7000.0 175.8926 2400.0 179.9907 12000.0 202.0769 3300.0 203.0857 40000.0 END IONS BEGIN IONS SCANS=71 PEPMASS=238.0924 CHARGE=1 COLLISION_ENERGY=0.0 43.0177 65000.0 44.0494 22000.0 55.0176 58000.0 55.9344 2900.0 56.0493 9700.0 57.0333 37000.0 57.2571 2600.0 58.0285 13000.0 58.9948 37000.0 59.0489 2800.0 60.0441 350000.0 61.0281 18000.0 68.0458 3000.0 68.0492 98000.0 69.0332 70000.0 70.0285 21000.0 70.0647 5500.0 71.0127 5900.0 72.0441 250000.0 73.0281 110000.0 74.0056 29000.0 74.0233 130000.0 74.9897 12000.0 76.0214 3700.0 80.0493 17000.0 81.0331 7200.0 84.044 60000.0 85.0103 19000.0 85.0281 110000.0 86.0055 20000.0 86.0597 43000.0 86.9896 38000.0 87.0437 12000.0 88.039 28000.0 94.4431 2300.0 95.0126 15000.0 96.0441 150000.0 96.0513 4200.0 97.0281 91000.0 98.0597 45000.0 99.0074 19000.0 100.0216 3100.0 100.053 2200.0 102.0547 3200.0 102.9845 200000.0 104.0341 12000.0 105.0001 25000.0 107.8243 2400.0 112.039 78000.0 113.023 64000.0 113.463 2600.0 114.0005 51000.0 114.0547 380000.0 114.0634 9100.0 115.0318 2400.0 115.0387 62000.0 116.0703 12000.0 120.9951 160000.0 124.039 60000.0 125.0231 38000.0 126.0551 7500.0 128.0161 20000.0 131.0154 5700.0 132.011 62000.0 132.0653 580000.0 132.0786 6700.0 132.9949 24000.0 133.0493 44000.0 135.9891 2900.0 138.0006 35000.0 138.0552 2900.0 140.4556 3000.0 142.0497 88000.0 143.033 6700.0 148.9901 35000.0 150.0759 73000.0 156.0111 47000.0 156.0658 4200.0 160.0604 38000.0 173.5349 31000.0 174.0219 51000.0 178.0711 47000.0 184.0063 77000.0 196.0816 110000.0 196.9304 4100.0 199.7475 2700.0 202.0174 16000.0 END IONS BEGIN IONS SCANS=72 PEPMASS=206.1026 CHARGE=1 COLLISION_ENERGY=0.0 41.0386 4800.0 45.0333 13000.0 45.9334 2600.0 53.0902 2200.0 54.4564 2300.0 55.0541 8100.0 55.9342 3100.0 56.0469 2200.0 56.0493 49000.0 57.5261 2900.0 58.0649 83000.0 59.0489 6100.0 59.9578 2200.0 60.044 2500.0 68.0492 29000.0 68.3053 2900.0 69.0696 14000.0 70.0648 10000.0 71.0682 2600.0 73.0279 97000.0 74.0232 8800.0 75.0268 3500.0 76.0755 6900.0 78.5796 2400.0 81.0695 2700.0 82.0648 26000.0 83.0625 3000.0 83.0681 37000.0 84.0165 2400.0 84.044 270000.0 85.0234 2200.0 85.0281 45000.0 88.0755 12000.0 94.0649 2500.0 96.0805 380000.0 96.0875 4200.0 102.0546 10000.0 114.0914 6600.0 124.0753 190000.0 124.0922 2800.0 125.0789 3700.0 129.074 4200.0 131.9507 2800.0 142.0859 120000.0 142.105 5300.0 160.0964 52000.0 170.0812 24000.0 173.5329 29000.0 187.9174 3100.0 198.1349 2400.0 END IONS BEGIN IONS SCANS=73 PEPMASS=337.0942 CHARGE=1 COLLISION_ENERGY=0.0 69.3936 2400.0 70.0284 13000.0 71.2045 2200.0 73.389 2400.0 74.0055 25000.0 76.0211 58000.0 76.2526 2300.0 84.044 900000.0 84.0509 11000.0 84.0527 4300.0 85.0476 7500.0 88.0389 74000.0 88.4823 2300.0 88.8594 2400.0 92.0163 22000.0 96.0446 3100.0 98.0597 15000.0 102.0547 22000.0 103.3134 2200.0 106.0419 4700.0 106.0494 410000.0 107.993 18000.0 109.0517 2900.0 109.0761 3100.0 112.0214 6000.0 114.0552 2900.0 114.1284 2500.0 116.0338 35000.0 126.0546 33000.0 129.0654 16000.0 130.0387 4400.0 130.0495 470000.0 131.0535 2200.0 131.5446 2200.0 131.9932 31000.0 135.0439 6100.0 136.0398 6500.0 140.0161 45000.0 142.0315 4300.0 142.0495 61000.0 143.0447 5000.0 145.1256 2400.0 146.0268 10000.0 153.0658 20000.0 154.0487 2700.0 155.0808 33000.0 157.0605 66000.0 160.0602 45000.0 161.0392 4800.0 161.055 16000.0 172.0602 8600.0 173.5212 5900.0 173.5339 53000.0 174.022 14000.0 175.0718 2400.0 177.9988 8500.0 181.0606 24000.0 185.0378 65000.0 185.0561 6800.0 187.0551 2700.0 189.033 12000.0 190.0166 27000.0 191.0481 21000.0 192.0321 52000.0 193.0374 3000.0 199.0713 63000.0 203.2344 2600.0 207.0435 110000.0 209.0592 140000.0 212.9624 2400.0 213.869 2400.0 219.0256 13000.0 223.0714 35000.0 231.0435 540000.0 231.0706 4100.0 232.0476 19000.0 233.0591 85000.0 239.0189 3500.0 241.031 22000.0 241.0812 8800.0 247.0206 40000.0 255.0439 3200.0 256.9089 6700.0 257.0584 36000.0 264.0198 2600.0 265.0311 170000.0 267.0658 3500.0 267.8838 35000.0 268.0923 10000.0 273.055 20000.0 274.2019 2600.0 275.0699 4000.0 277.1391 2800.0 285.8928 6400.0 287.0874 41000.0 289.0869 6900.0 318.077 6100.0 320.0886 3000.0 321.0753 21000.0 328.0637 11000.0 338.1027 59000.0 353.0477 2400.0 582.3258 3100.0 664.4089 2500.0 666.348 2900.0 END IONS BEGIN IONS SCANS=74 PEPMASS=300.1448 CHARGE=1 COLLISION_ENERGY=0.0 51.1375 2200.0 54.3237 2000.0 55.0177 3000.0 57.0333 100000.0 57.0363 3500.0 60.1055 2400.0 61.0281 56000.0 61.0428 2200.0 64.4522 2300.0 66.2416 2100.0 66.6463 2100.0 67.6425 2400.0 69.0331 42000.0 71.0125 7000.0 71.0489 9800.0 71.6794 2700.0 73.028 22000.0 75.0437 38000.0 76.0288 2300.0 77.0385 2600.0 81.0332 3800.0 82.1958 2500.0 85.0281 150000.0 85.5938 3000.0 87.0437 18000.0 88.0964 2200.0 91.0386 24000.0 91.054 35000.0 93.0543 23000.0 93.0695 100000.0 94.024 2100.0 95.0491 9800.0 96.0439 3100.0 97.0281 69000.0 99.0074 7600.0 99.0439 16000.0 103.0385 74000.0 103.0539 43000.0 103.3822 2400.0 106.2869 2700.0 108.691 2600.0 113.023 9700.0 116.312 2400.0 117.2483 2200.0 120.9336 2600.0 121.0645 3100000.0 121.0732 49000.0 121.0814 19000.0 121.0845 8900.0 121.9757 2500.0 124.8792 2200.0 127.0386 21000.0 131.0342 3200.0 137.0594 30000.0 138.0909 30000.0 141.7133 2400.0 141.7592 2400.0 148.1389 2300.0 149.0594 25000.0 151.0749 30000.0 161.0594 25000.0 163.0754 9400.0 164.0704 9500.0 169.0485 2700.0 171.4586 2400.0 171.9218 3000.0 173.0607 5600.0 173.5247 3600.0 173.5329 44000.0 173.5418 5500.0 175.0753 5100.0 177.0554 6400.0 178.0864 32000.0 179.0701 23000.0 185.0601 3000.0 187.9165 8100.0 188.9255 2900.0 191.0702 2900.0 192.5296 2400.0 196.9322 17000.0 199.0744 2300.0 199.7322 2500.0 201.053 2400.0 201.0924 2300.0 204.9055 2400.0 205.9268 2800.0 209.8248 2400.0 218.0811 6400.0 219.0655 7800.0 220.0968 7700.0 222.8015 2200.0 229.9275 5100.0 239.9116 11000.0 257.9211 5300.0 258.8879 26000.0 276.8974 3400.0 300.1031 2200.0 300.1451 6900.0 END IONS BEGIN IONS SCANS=75 PEPMASS=303.1346 CHARGE=1 COLLISION_ENERGY=0.0 48.4663 2400.0 48.917 2100.0 71.5782 2600.0 90.9477 2500.0 91.054 2900.0 93.0065 2600.0 99.0328 2400.0 106.9829 2500.0 109.4212 2400.0 110.0598 33000.0 119.0497 3100.0 123.0441 3600.0 130.8545 2600.0 134.0599 14000.0 135.044 3100.0 136.0762 3000.0 137.0596 26000.0 140.0704 1000000.0 149.0711 16000.0 150.0549 35000.0 152.0575 3300.0 152.0705 92000.0 161.072 3300.0 162.0789 10000.0 163.0636 4000.0 163.0869 7300.0 164.0706 580000.0 173.5307 30000.0 173.5448 2300.0 186.9244 4300.0 196.6083 2400.0 210.0919 3900.0 213.0784 2700.0 219.7345 2200.0 238.0869 3300.0 240.1016 4400.0 242.0809 10000.0 256.0974 85000.0 257.0807 5100.0 267.1131 7800.0 268.097 28000.0 285.1245 35000.0 286.1085 52000.0 303.1353 24000.0 END IONS BEGIN IONS SCANS=76 PEPMASS=316.1397 CHARGE=1 COLLISION_ENERGY=0.0 49.7642 2800.0 53.0385 7700.0 55.054 25000.0 55.4827 2500.0 57.0335 9000.0 59.049 8600.0 59.2969 2300.0 61.0252 4300.0 61.028 120000.0 61.0822 2200.0 62.8942 2100.0 64.4356 2200.0 65.0387 2500.0 65.9079 2400.0 69.0332 21000.0 71.0489 30000.0 71.492 2700.0 72.9128 2600.0 73.0282 33000.0 81.0333 3800.0 83.0488 55000.0 85.0233 3100.0 85.0281 110000.0 87.0435 2300.0 87.5242 2200.0 87.6829 3000.0 90.8527 2400.0 91.0387 62000.0 91.0538 130000.0 97.0225 2300.0 97.0281 52000.0 99.0437 5900.0 100.605 2400.0 101.0594 240000.0 106.7491 2500.0 109.0282 3800.0 109.0645 12000.0 114.8267 2300.0 115.0385 3300.0 119.0404 4100.0 119.0489 100000.0 123.1123 2400.0 127.0387 23000.0 137.0594 2200000.0 137.0695 33000.0 137.0837 18000.0 145.049 7100.0 154.0861 53000.0 160.723 2600.0 166.0862 16000.0 167.0897 17000.0 173.5226 5300.0 173.54 15000.0 203.8833 26000.0 205.8986 12000.0 221.8942 7500.0 231.8778 6100.0 233.8943 3200.0 243.8775 17000.0 249.8892 8400.0 257.0021 3200.0 289.5569 3000.0 313.3922 2500.0 END IONS BEGIN IONS SCANS=77 PEPMASS=277.9362 CHARGE=1 COLLISION_ENERGY=0.0 49.045 2100.0 50.6048 2100.0 51.44 4500.0 53.7089 2400.0 55.9341 290000.0 59.4542 2100.0 59.7045 2200.0 60.7851 2400.0 61.0437 2200.0 61.5503 2600.0 63.6088 2500.0 64.3625 2500.0 68.0091 2500.0 68.2967 2300.0 68.5317 2600.0 69.2747 2200.0 69.9497 63000.0 70.0649 3300.0 71.929 54000.0 72.0491 2200.0 72.0772 6300.0 72.9369 120000.0 73.9447 68000.0 74.0105 2200.0 74.9525 12000.0 77.7121 2200.0 81.4947 2500.0 81.8025 2300.0 83.0757 2700.0 84.1305 2400.0 85.0282 11000.0 87.9602 120000.0 89.9396 180000.0 90.6391 2800.0 90.9474 390000.0 91.1059 2700.0 91.9552 44000.0 95.6782 2600.0 98.0597 43000.0 99.9604 3500.0 101.0987 2200.0 102.8187 2600.0 102.9473 15000.0 105.9346 45000.0 105.9707 9600.0 107.9423 4700.0 107.9501 880000.0 108.9581 29000.0 110.723 2600.0 112.9298 2400.0 115.9552 220000.0 115.9637 4700.0 116.0702 130000.0 116.9632 37000.0 117.9712 5300.0 118.5384 2300.0 118.9422 14000.0 120.1721 2900.0 120.7993 2600.0 121.1254 2400.0 125.707 2200.0 125.9514 4000.0 125.9606 400000.0 128.9847 2400.0 129.7433 2500.0 131.9504 21000.0 131.9867 8300.0 133.9658 820000.0 133.9758 5900.0 134.9733 3000.0 135.9451 13000.0 136.9532 2800.0 141.9345 2700.0 143.9502 66000.0 144.8935 2500.0 144.9581 25000.0 146.217 2300.0 147.9452 2800.0 151.6139 2600.0 151.9763 610000.0 153.3494 2300.0 156.8022 2200.0 159.9451 700000.0 159.9582 2400.0 159.9677 3400.0 160.9531 35000.0 161.9609 110000.0 162.9682 12000.0 164.0703 8100.0 167.3544 2400.0 173.5254 39000.0 173.5399 42000.0 175.0387 4000.0 175.1203 2900.0 175.9401 23000.0 177.1412 2400.0 177.4502 2400.0 177.9559 2800000.0 179.0717 3100.0 180.886 2800.0 187.9765 15000.0 190.0264 20000.0 192.4793 2600.0 195.9666 17000.0 200.9731 11000.0 203.9718 32000.0 204.0087 2300.0 205.0499 38000.0 205.9499 3000.0 208.8838 12000.0 226.8929 5700.0 251.8793 2500.0 253.8641 2500.0 263.7711 2800.0 271.7873 2400.0 277.8486 2500.0 END IONS BEGIN IONS SCANS=78 PEPMASS=205.9512 CHARGE=1 COLLISION_ENERGY=0.0 41.2572 2300.0 41.6607 2300.0 45.0333 19000.0 45.7113 2300.0 45.764 2400.0 47.0983 2900.0 52.919 2000.0 53.6139 2300.0 55.2604 2500.0 55.9341 140000.0 56.1094 2500.0 56.3679 2200.0 61.8503 2600.0 64.6278 2600.0 65.5218 2200.0 66.1034 2200.0 69.9498 28000.0 70.0664 7800.0 71.929 28000.0 72.9368 68000.0 73.0281 150000.0 73.9447 39000.0 74.0185 2500.0 75.1173 2600.0 77.3932 2400.0 78.5967 3000.0 80.5046 2400.0 87.5312 2200.0 87.8617 2100.0 87.9602 48000.0 88.0754 17000.0 89.9395 51000.0 90.9473 130000.0 91.9553 22000.0 96.7857 2400.0 103.2347 2400.0 105.9344 28000.0 105.9711 2200.0 106.6772 2300.0 107.9425 3900.0 107.9501 200000.0 108.9581 3700.0 112.8424 2200.0 114.037 3500.0 114.0904 2500.0 114.6381 2200.0 115.9552 23000.0 115.9638 2600.0 125.9606 74000.0 126.5752 2500.0 128.9866 2200.0 133.9658 65000.0 136.8154 2200.0 146.7609 2500.0 148.0103 2700.0 151.9764 39000.0 159.945 51000.0 160.0954 2800.0 173.5236 11000.0 173.535 52000.0 173.6291 2400.0 177.9558 110000.0 177.9709 3000.0 189.5422 2400.0 189.7609 2300.0 END IONS BEGIN IONS SCANS=79 PEPMASS=222.0612 CHARGE=1 COLLISION_ENERGY=0.0 42.5716 2600.0 43.8096 4200.0 43.8558 4600.0 44.5721 3000.0 44.6944 3800.0 44.8427 2800.0 44.9321 6200.0 47.0292 3700.0 47.7754 3300.0 48.3051 3700.0 48.7414 3700.0 51.9394 2600.0 52.0877 4300.0 52.1411 3100.0 52.6626 6900.0 53.2483 3400.0 53.2717 3600.0 54.0906 3600.0 54.2601 5300.0 55.0177 17000.0 56.0494 3200.0 56.6377 6600.0 57.0333 74000.0 58.0059 4700.0 58.0649 100000.0 58.4841 2700.0 59.3088 2600.0 59.3884 4100.0 63.9294 6200.0 65.2311 4000.0 65.634 4800.0 66.1461 2700.0 68.6636 4900.0 69.0295 5800.0 69.0331 460000.0 70.0649 8800.0 73.2255 5400.0 75.3585 3400.0 76.0971 4300.0 83.1289 2800.0 83.139 3600.0 83.5692 6100.0 85.0281 340000.0 87.3825 5200.0 89.5096 4400.0 91.0539 93000.0 95.0124 690000.0 95.1723 6900.0 97.0281 1600000.0 97.0349 4200.0 99.0075 7000.0 101.266 4400.0 103.3914 4300.0 103.5198 4300.0 104.4799 6000.0 107.0487 4700.0 108.1999 7200.0 111.7108 5200.0 113.0048 3100.0 113.023 750000.0 113.1269 3200.0 118.0414 7000.0 119.0488 84000.0 122.9972 13000.0 123.0073 1400000.0 123.016 4400.0 123.0182 23000.0 125.023 270000.0 131.4856 4900.0 131.8929 4100.0 135.0439 100000.0 141.0179 1100000.0 141.0303 16000.0 141.7221 3000.0 143.0217 3800.0 143.0336 220000.0 144.0653 13000.0 144.2459 2700.0 149.9802 3800.0 153.5885 6500.0 156.7622 3200.0 159.0285 7300.0 163.038 8800.0 168.9982 7700.0 169.013 530000.0 173.5248 19000.0 173.5373 130000.0 176.3185 3700.0 179.5215 6200.0 187.0235 93000.0 188.8426 5700.0 195.0504 16000.0 196.3829 3000.0 200.9212 4600.0 205.0688 10000.0 229.4987 5000.0 END IONS BEGIN IONS SCANS=80 PEPMASS=227.0166 CHARGE=1 COLLISION_ENERGY=0.0 47.4478 2600.0 47.7035 2200.0 48.2739 2500.0 48.5883 2200.0 53.6793 2500.0 54.0181 2200.0 54.8091 2400.0 55.9343 2900.0 56.7126 2500.0 59.3088 2100.0 59.4921 2200.0 60.4458 2200.0 61.3487 2000.0 61.6544 2600.0 62.3732 2100.0 63.2787 2400.0 64.6907 4600.0 64.7721 2500.0 65.6102 2300.0 66.3747 2300.0 70.052 2300.0 72.9368 110000.0 74.0898 2100.0 74.3079 2300.0 78.1563 2400.0 80.7704 2600.0 82.7183 2600.0 83.7449 2100.0 85.7166 2300.0 90.9474 68000.0 93.2516 2500.0 101.5617 2400.0 102.0317 2400.0 103.4525 2300.0 103.8515 2300.0 109.3915 2200.0 109.9056 2400.0 112.5057 2200.0 113.008 2500.0 113.9634 180000.0 115.2744 2300.0 123.9433 2700.0 125.7509 2300.0 126.0536 3300.0 128.113 2300.0 131.6383 2200.0 131.9734 5900.0 135.8453 2500.0 137.2073 2600.0 139.4766 2400.0 148.1718 2600.0 154.6762 2400.0 157.9923 2600.0 167.0703 12000.0 168.5906 2500.0 173.5284 87000.0 173.5414 11000.0 174.3059 2700.0 185.9278 29000.0 191.7124 2200.0 198.0076 2600.0 199.64 2300.0 200.139 2400.0 203.938 5300.0 212.2258 2800.0 227.018 2800.0 227.1175 2600.0 233.5006 3100.0 END IONS BEGIN IONS SCANS=81 PEPMASS=316.1396 CHARGE=1 COLLISION_ENERGY=0.0 50.5909 2600.0 50.8515 2400.0 51.0875 2200.0 55.0543 3400.0 55.5225 2500.0 57.654 2300.0 59.0489 2300.0 59.8715 2500.0 60.9703 2300.0 61.0282 3300.0 62.332 2200.0 65.1656 2300.0 67.5065 2300.0 69.0332 14000.0 71.0489 4600.0 73.0278 5000.0 81.8502 2500.0 83.0488 9800.0 84.1005 2400.0 85.028 49000.0 87.969 2200.0 91.0539 40000.0 96.0441 10000.0 97.0282 20000.0 98.6343 2600.0 99.0443 2300.0 101.0593 39000.0 103.934 2300.0 119.0489 32000.0 127.0387 13000.0 131.0482 2900.0 133.1609 2300.0 133.6475 2300.0 135.0441 2600.0 136.0614 3700.0 137.0594 650000.0 137.0698 5900.0 140.0714 3000.0 143.9694 2300.0 144.0653 23000.0 149.0593 12000.0 151.0745 2900.0 152.391 2700.0 153.0537 3700.0 154.086 13000.0 161.0587 3100.0 162.075 21000.0 164.0705 20000.0 164.9998 9400.0 166.0862 41000.0 167.0895 21000.0 168.2882 2400.0 173.5243 10000.0 173.5339 26000.0 173.5428 4800.0 176.9999 2700.0 177.0549 6700.0 178.0861 46000.0 179.0155 8600.0 179.0705 5800.0 188.0834 2400.0 194.0025 5000.0 197.0268 4400.0 202.0877 3200.0 203.0707 3600.0 203.8834 8400.0 205.8987 4400.0 208.0961 3000.0 209.0267 98000.0 209.0491 2800.0 218.0817 4400.0 220.0969 15000.0 232.098 4300.0 243.8782 2900.0 253.067 2800.0 262.9922 2300.0 280.1184 21000.0 281.0654 2900.0 298.129 36000.0 302.0815 2500.0 316.14 5100.0 END IONS BEGIN IONS SCANS=82 PEPMASS=358.1135 CHARGE=1 COLLISION_ENERGY=0.0 52.6621 2200.0 53.4544 2300.0 54.7126 2900.0 58.7192 2800.0 59.3171 2100.0 59.6779 3000.0 61.5689 2400.0 64.785 2600.0 65.0385 72000.0 66.0238 2500.0 71.2 2800.0 72.0406 2200.0 74.0623 2700.0 74.0914 3100.0 75.3361 2200.0 78.8112 2100.0 81.0697 29000.0 84.9156 2300.0 85.2142 2600.0 85.8614 2400.0 91.0541 1800000.0 91.0614 11000.0 92.2812 2200.0 93.1714 2900.0 93.7509 2300.0 93.8149 2200.0 97.8172 2400.0 100.2304 2400.0 109.0646 110000.0 109.252 2800.0 113.0237 5400.0 119.0391 19000.0 119.049 1000000.0 119.0584 8900.0 128.2177 2100.0 132.8016 3700.0 136.9996 3900.0 137.0205 4100.0 137.0596 28000000.0 137.0692 81000.0 137.0791 38000.0 137.0844 290000.0 137.0943 33000.0 137.1004 14000.0 154.0653 3300.0 154.0862 2300000.0 161.0602 8800.0 169.0125 2800.0 169.8739 2400.0 173.5316 110000.0 173.5453 4000.0 178.0864 38000.0 182.0275 2600.0 192.978 25000.0 196.0997 2300.0 201.0783 2400.0 203.0716 3400.0 205.9861 2800.0 206.9948 29000.0 208.0421 5600.0 208.0613 16000.0 208.7292 3300.0 219.0897 9700.0 222.9927 6200.0 224.0934 3100.0 225.0032 3000.0 236.0922 46000.0 236.9724 11000.0 258.0778 2600.0 266.1022 16000.0 294.0981 37000.0 300.2876 3200.0 308.8163 2600.0 311.0216 240000.0 312.0088 13000.0 312.1086 330000.0 312.1496 4100.0 324.0291 92000.0 328.0476 22000.0 339.0376 3000.0 340.108 2600.0 341.0353 22000.0 358.1131 13000.0 366.7817 2400.0 END IONS BEGIN IONS SCANS=83 PEPMASS=248.0245 CHARGE=1 COLLISION_ENERGY=0.0 44.0494 7300.0 44.4877 2400.0 47.676 2300.0 48.9885 2500.0 49.1804 2500.0 49.7524 2100.0 52.359 2300.0 53.2407 2100.0 55.9342 64000.0 58.3446 2400.0 58.6538 2300.0 60.0932 2300.0 61.7984 2900.0 62.0599 19000.0 68.0263 2200.0 70.0094 2200.0 70.0649 2500.0 70.727 2200.0 71.1049 2500.0 72.9369 2700.0 73.0281 85000.0 73.038 2100.0 74.3856 2300.0 84.044 11000.0 85.0281 5500.0 86.0964 6600.0 86.5997 2900.0 87.0551 12000.0 87.0993 6600.0 90.9473 6100.0 91.7931 2300.0 92.1756 2100.0 96.5194 2400.0 97.6849 2400.0 104.7894 2600.0 106.3894 2400.0 108.5487 2300.0 111.3559 2400.0 113.0701 8400.0 123.4077 2300.0 123.5555 2700.0 128.9518 2400.0 128.9632 5400.0 130.0493 3300.0 133.2921 2900.0 138.0546 12000.0 138.9837 15000.0 139.927 2100.0 149.9769 2400.0 151.5276 2400.0 153.9711 22000.0 155.6058 2200.0 157.2041 2200.0 166.9792 3400.0 167.987 14000.0 171.2622 2800.0 173.5252 62000.0 173.5392 39000.0 175.0394 4400.0 176.9639 100000.0 177.9714 56000.0 179.9874 8800.0 181.3136 2600.0 181.9664 3400.0 194.9326 3600.0 194.9738 4200000.0 194.9893 13000.0 195.9621 9300.0 195.9817 330000.0 203.9815 2700.0 204.9694 37000.0 205.9899 160000.0 206.9973 17000.0 208.9532 2700.0 209.9613 54000.0 212.9846 520000.0 213.0082 4600.0 213.8195 2600.0 213.9921 63000.0 215.9921 2600.0 216.7696 2500.0 216.9976 30000.0 217.99 340000.0 224.927 2500.0 228.9019 2800.0 231.0131 6400.0 234.772 2600.0 236.0003 3400.0 241.9579 2300.0 248.0909 6800.0 253.5217 2700.0 258.0361 2700.0 END IONS BEGIN IONS SCANS=84 PEPMASS=303.1345 CHARGE=1 COLLISION_ENERGY=0.0 50.9957 2200.0 63.1976 2200.0 64.2545 2700.0 75.8193 2400.0 76.388 2300.0 86.0596 9500.0 91.0538 15000.0 91.1779 2300.0 94.0647 8500.0 119.0488 9800.0 121.0645 32000.0 122.0598 37000.0 124.7588 2300.0 137.0595 100000.0 138.0547 25000.0 140.0704 61000.0 146.0596 7200.0 149.6843 5600.0 149.6958 4600.0 150.0548 190000.0 152.0708 6900.0 152.504 3100.0 152.6157 2400.0 154.086 2700.0 164.0706 51000.0 166.0496 18000.0 173.5291 21000.0 173.5386 5300.0 185.5884 2300.0 221.9658 2900.0 230.0812 4400.0 256.0978 3100.0 263.2882 2800.0 267.0771 18000.0 274.1078 3800.0 285.0883 3800.0 298.8957 2300.0 303.0984 3600.0 END IONS BEGIN IONS SCANS=85 PEPMASS=245.0864 CHARGE=1 COLLISION_ENERGY=0.0 44.0495 6000.0 55.0178 6600.0 56.0494 11000.0 58.065 11000.0 60.0442 370000.0 66.6221 2400.0 68.0493 10000.0 69.0333 3500.0 70.0286 35000.0 70.065 56000.0 71.0487 3300.0 71.414 2500.0 72.0447 2600.0 73.0734 2600.0 74.0058 19000.0 74.0234 81000.0 76.0214 9500.0 77.1229 2400.0 79.0543 3100.0 80.0493 15000.0 81.0332 2700.0 82.0652 2600.0 83.0602 30000.0 83.5522 5600.0 83.8748 2600.0 83.9643 2900.0 84.0442 1600000.0 84.0507 13000.0 84.0531 3100.0 84.0805 6300.0 85.0282 24000.0 85.0474 10000.0 86.0965 3800.0 87.294 2500.0 88.039 110000.0 88.0754 96000.0 90.9473 5700.0 92.0163 2300.0 96.0442 26000.0 97.5496 32000.0 98.0599 46000.0 99.0437 6900.0 99.055 2800.0 100.0392 2600.0 102.0547 69000.0 105.1285 2500.0 106.0496 120000.0 106.555 23000.0 107.0489 27000.0 107.0604 16000.0 108.0442 47000.0 109.0522 4800.0 109.0756 6600.0 110.0599 26000.0 111.0552 16000.0 112.0391 19000.0 112.8666 2100.0 113.0341 19000.0 113.5362 2800.0 114.0547 69000.0 115.0085 2600.0 115.0856 2900.0 116.0339 18000.0 116.0703 300000.0 118.8548 2100.0 120.5523 19000.0 121.0105 2400.0 122.0182 4100.0 122.5408 32000.0 123.0261 90000.0 123.0431 3700.0 123.3368 2500.0 123.9938 2100.0 124.0393 3600.0 124.0753 25000.0 124.5402 16000.0 125.0708 20000.0 126.0547 45000.0 129.0656 79000.0 130.0496 510000.0 130.0588 4300.0 131.0493 10000.0 132.0655 5900.0 135.0438 40000.0 135.0547 11000.0 136.0391 120000.0 136.0517 130000.0 136.0758 12000.0 136.5383 12000.0 137.0593 12000.0 137.8487 2600.0 138.0456 2700.0 138.5379 55000.0 139.0205 8800.0 142.0497 92000.0 146.0451 5900.0 147.026 66000.0 147.051 31000.0 147.0629 2800.0 148.0515 2700.0 149.0053 30000.0 149.0594 3000.0 149.071 21000.0 149.6923 4300.0 149.9615 2700.0 150.013 9400.0 151.021 270000.0 151.0351 5400.0 151.0624 6300.0 153.0656 71000.0 154.0495 40000.0 154.0861 19000.0 155.0158 60000.0 155.0815 15000.0 156.0656 18000.0 157.0607 37000.0 158.0444 20000.0 160.0603 79000.0 161.0489 5800.0 163.0206 12000.0 165.0372 7200.0 167.0161 93000.0 167.0815 6700.0 168.0239 210000.0 168.0556 6300.0 169.0316 510000.0 169.0448 4500.0 170.0346 2800.0 171.0764 24000.0 172.0599 11000.0 173.0925 8000.0 173.5279 19000.0 173.536 15000.0 173.544 3600.0 174.3162 2800.0 175.0213 120000.0 175.0716 7100.0 177.0658 40000.0 178.0628 7300.0 178.9096 2600.0 179.1138 2900.0 181.0318 28000.0 181.0605 33000.0 182.0532 13000.0 182.0811 140000.0 190.0168 18000.0 192.0476 11000.0 193.0318 530000.0 193.052 5300.0 194.0348 19000.0 195.0764 57000.0 199.0711 39000.0 203.0158 2900.0 205.7985 2500.0 210.058 61000.0 210.0768 39000.0 216.9795 2800.0 216.9975 81000.0 218.0594 2400.0 220.0431 4200.0 221.0266 11000.0 222.0881 7400.0 223.0713 82000.0 228.0867 35000.0 235.0082 12000.0 239.0371 15000.0 241.0818 20000.0 245.1124 3200.0 246.0602 3100.0 268.0926 18000.0 276.0691 26000.0 280.0615 2500.0 303.0816 2800.0 326.069 21000.0 364.6182 2200.0 417.9692 2500.0 439.8545 2600.0 465.1558 2400.0 END IONS BEGIN IONS SCANS=86 PEPMASS=215.0167 CHARGE=1 COLLISION_ENERGY=0.0 44.0492 2100.0 47.0316 2000.0 51.3939 2400.0 53.5638 2100.0 55.9342 7200.0 56.0494 2700.0 57.4785 2200.0 58.0647 2300.0 59.6762 2100.0 61.5765 2500.0 63.377 2900.0 66.3082 2500.0 67.3769 2200.0 69.1618 2200.0 70.0649 12000.0 72.0221 2200.0 72.0805 690000.0 90.9475 19000.0 96.8205 2300.0 106.8511 2400.0 111.2464 2700.0 115.1003 2200.0 118.3394 2400.0 127.4809 2300.0 132.9586 2700.0 142.364 2300.0 173.5212 7100.0 173.5295 23000.0 173.5399 18000.0 185.6008 2700.0 195.5532 2300.0 201.3015 2600.0 215.1396 12000.0 END IONS BEGIN IONS SCANS=87 PEPMASS=438.9798 CHARGE=1 COLLISION_ENERGY=0.0 55.9345 27000.0 56.935 2600.0 66.4708 2400.0 69.95 7600.0 70.958 23000.0 71.9293 15000.0 72.9373 53000.0 73.9375 3800.0 73.9452 10000.0 79.424 2800.0 87.9606 15000.0 88.963 2200.0 88.9685 19000.0 89.94 28000.0 90.9412 4600.0 90.9477 170000.0 90.9544 3400.0 91.9483 6100.0 91.9538 14000.0 95.8642 2300.0 98.2336 2300.0 101.9763 9600.0 102.9477 20000.0 105.9347 17000.0 106.9427 3600.0 107.9505 33000.0 108.9575 21000.0 112.9689 3600.0 114.4248 2400.0 114.9487 12000.0 114.9839 7200.0 115.9554 9900.0 116.9633 25000.0 117.9347 3100.0 123.9451 6600.0 125.961 10000.0 126.9477 2200.0 126.9846 3500.0 127.9555 13000.0 128.9637 16000.0 128.9999 76000.0 129.9714 4100.0 130.9791 370000.0 130.9922 8300.0 131.9505 54000.0 132.9583 190000.0 133.9659 12000.0 137.0595 12000.0 140.964 13000.0 143.9504 33000.0 143.9868 29000.0 144.9529 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19000.0 213.9929 7800.0 214.5464 3000.0 214.9993 69000.0 216.9785 8700.0 217.016 20000.0 218.9951 10000.0 219.9668 160000.0 220.9701 170000.0 224.9847 56000.0 226.9642 49000.0 227.0004 76000.0 228.9431 16000.0 228.9795 23000.0 230.9586 7400.0 240.9785 7600.0 242.9946 31000.0 244.9741 26000.0 245.0083 4800.0 246.9536 110000.0 252.9793 54000.0 254.9588 16000.0 263.9565 2700.0 264.9641 87000.0 268.974 15000.0 270.9542 3400.0 270.9893 12000.0 279.4735 2900.0 286.9839 3600.0 334.9722 3700.0 404.0551 2500.0 END IONS BEGIN IONS SCANS=88 PEPMASS=282.0978 CHARGE=1 COLLISION_ENERGY=0.0 48.2292 2200.0 54.5216 2400.0 55.0538 2500.0 55.9345 3200.0 57.0698 7600.0 59.0212 2400.0 60.1997 2300.0 60.6639 2500.0 62.3817 2400.0 62.7028 2400.0 63.5489 2900.0 64.4875 2700.0 67.1773 2200.0 68.6118 2300.0 69.0697 10000.0 73.0281 6500.0 73.3337 2200.0 74.492 2600.0 75.4466 2600.0 76.8384 2300.0 80.6672 2600.0 81.0691 3000.0 83.0852 9500.0 84.1391 2700.0 85.0281 18000.0 86.2987 2400.0 91.054 91000.0 91.2994 2500.0 95.596 2600.0 102.7231 2600.0 104.0074 2700.0 109.0649 6700.0 115.9439 2300.0 117.4694 2300.0 119.0489 71000.0 121.0645 10000.0 122.0607 3900.0 134.0963 47000.0 134.8005 2300.0 136.0624 13000.0 137.0595 1300000.0 137.0694 10000.0 144.9101 2400.0 146.0443 8800.0 146.6448 2300.0 150.0547 46000.0 151.075 11000.0 157.0649 2700.0 161.0456 2500.0 161.0597 34000.0 162.0549 26000.0 163.0628 2900.0 164.0706 39000.0 168.2791 2200.0 170.0719 2800.0 172.0756 3200.0 172.8346 2600.0 173.0598 78000.0 173.5231 22000.0 173.5372 47000.0 175.0753 18000.0 176.0705 52000.0 183.8555 2500.0 184.3159 2500.0 189.0545 65000.0 190.0863 86000.0 191.0706 40000.0 192.0656 61000.0 193.0318 8000.0 196.4578 2600.0 200.0707 24000.0 201.0549 55000.0 201.074 3000.0 202.0849 3200.0 203.0691 3000.0 206.0814 3400.0 209.3841 2700.0 211.1355 14000.0 218.0318 4700.0 218.0812 3700000.0 219.0296 12000.0 219.0653 140000.0 219.0887 3900.0 220.0969 33000.0 222.0759 40000.0 223.0796 2600.0 226.5713 2400.0 236.0364 3500.0 236.0918 3200000.0 236.149 5000.0 237.0757 16000.0 246.0757 13000.0 251.327 2500.0 255.7474 2700.0 264.0866 210000.0 264.1165 3000.0 266.5247 2500.0 268.6202 2500.0 273.7513 3100.0 276.6951 2800.0 281.7846 2400.0 282.0975 120000.0 282.2219 130000.0 291.4858 2300.0 END IONS BEGIN IONS SCANS=89 PEPMASS=287.9808 CHARGE=1 COLLISION_ENERGY=0.0 49.049 2400.0 55.934 2700.0 58.9047 2300.0 58.9132 2400.0 64.0712 2200.0 70.9576 54000.0 72.9369 110000.0 86.0964 7200.0 88.9681 45000.0 90.0069 2300.0 90.9411 3600.0 90.9473 270000.0 97.4168 2700.0 102.9475 3800.0 107.8185 2400.0 108.958 28000.0 109.9685 25000.0 110.4356 2400.0 111.9841 56000.0 112.9682 36000.0 113.9549 3900.0 113.9634 840000.0 113.9715 8100.0 114.9474 9700.0 116.9633 7100.0 121.0645 17000.0 122.0594 3400.0 122.0681 6500.0 123.0634 3400.0 128.9631 3800.0 130.9788 140000.0 131.9739 89000.0 132.4171 2400.0 132.958 330000.0 132.9685 2700.0 135.0439 20000.0 140.9638 3800.0 142.9421 3000.0 148.9894 19000.0 149.6878 12000.0 149.6985 4000.0 150.0547 19000.0 150.9687 120000.0 151.0581 20000.0 155.9742 33000.0 156.9582 66000.0 158.9737 200000.0 160.3156 2500.0 160.9531 59000.0 167.034 3300.0 172.0056 24000.0 173.5309 22000.0 173.5426 4900.0 174.9689 70000.0 176.9844 24000.0 178.9648 6300.0 181.9901 30000.0 183.9691 11000.0 184.9533 18000.0 186.9326 7200.0 189.9821 2600.0 191.0696 6400.0 192.9794 19000.0 197.985 39000.0 202.9636 22000.0 203.0602 2800.0 204.944 6900.0 208.8829 17000.0 226.8942 2500.0 266.9602 2300.0 END IONS BEGIN IONS SCANS=90 PEPMASS=312.1083 CHARGE=1 COLLISION_ENERGY=0.0 48.3874 2000.0 49.5658 2900.0 53.0384 9000.0 55.0176 8500.0 57.0333 16000.0 59.049 2400.0 61.0251 2700.0 61.0281 52000.0 62.9044 2700.0 65.271 2300.0 69.0332 64000.0 70.8145 2200.0 71.0489 8600.0 72.1964 2500.0 73.0281 18000.0 73.6469 2300.0 75.2388 2100.0 81.0331 29000.0 82.8148 2400.0 84.673 2700.0 85.0281 180000.0 87.0437 17000.0 91.0387 11000.0 94.0652 5600.0 97.0282 62000.0 99.0438 9100.0 103.0388 12000.0 104.0492 3200.0 109.0282 23000.0 122.0598 79000.0 123.0434 2700.0 126.5524 2400.0 127.0388 29000.0 132.0442 60000.0 136.0754 6300.0 137.0597 4700.0 139.6684 2900.0 145.0498 3800.0 150.0268 8400.0 150.0548 1300000.0 150.0912 35000.0 161.0599 3900.0 163.0624 3300.0 164.0706 99000.0 167.0341 8000.0 173.5251 10000.0 173.5382 21000.0 177.0783 9300.0 178.0863 100000.0 180.9801 4200.0 190.0321 15000.0 190.086 19000.0 201.0781 9000.0 202.0859 12000.0 203.0711 3800.0 204.0657 3800.0 204.1021 6800.0 206.0814 37000.0 208.0426 17000.0 214.0844 2700.0 218.0809 10000.0 219.0894 24000.0 220.0967 9100.0 222.0763 8700.0 224.7175 2500.0 230.0806 8700.0 232.0979 4600.0 236.0647 5300.0 236.0919 110000.0 248.0918 7900.0 250.1074 13000.0 257.0885 2800.0 258.0766 5500.0 266.1024 36000.0 267.9897 2900.0 294.0976 29000.0 294.4809 2600.0 294.9759 11000.0 295.4422 2700.0 312.1082 130000.0 312.1489 3500.0 END IONS BEGIN IONS SCANS=91 PEPMASS=229.155 CHARGE=1 COLLISION_ENERGY=0.0 43.9377 2200.0 44.0493 29000.0 44.4252 2400.0 49.6355 2200.0 52.7414 2200.0 53.275 2100.0 55.0177 35000.0 57.0333 18000.0 57.8181 2100.0 58.0648 690000.0 58.0699 4500.0 59.0726 150000.0 60.0805 960000.0 60.084 8700.0 62.0833 2200.0 65.0281 2200.0 66.4169 2600.0 68.0491 72000.0 69.0581 3100.0 70.0649 3700000.0 70.0706 42000.0 70.0715 24000.0 70.0737 9400.0 70.0766 3800.0 71.6704 2500.0 72.0805 26000.0 73.0282 8500.0 77.8232 2500.0 79.1737 2300.0 79.9768 2500.0 80.9448 5200.0 83.3419 2400.0 84.0806 9300.0 85.0841 3000.0 87.8738 2700.0 96.0804 76000.0 98.0596 70000.0 98.9554 2500.0 101.325 2300.0 107.6665 2500.0 108.2066 2300.0 108.2835 2200.0 111.0204 2500.0 114.0545 450000.0 114.0639 5400.0 114.0909 140000.0 115.8305 2300.0 115.9637 15000.0 116.0702 88000.0 116.9658 67000.0 124.0655 4800.0 124.0753 460000.0 124.2049 2400.0 125.1157 5200.0 126.0909 90000.0 129.4479 2400.0 132.1014 5100.0 142.0735 5600.0 142.0859 3800000.0 142.0967 57000.0 143.4738 2300.0 143.5369 2600.0 149.6762 2900.0 149.6869 6200.0 149.7079 4200.0 150.9163 2800.0 156.9976 21000.0 157.6922 2600.0 170.0812 120000.0 173.5235 12000.0 173.5372 52000.0 182.9773 11000.0 187.9159 6100.0 229.1012 6400.0 229.1546 2900000.0 229.1809 4600.0 229.2084 6900.0 END IONS BEGIN IONS SCANS=92 PEPMASS=331.0931 CHARGE=1 COLLISION_ENERGY=0.0 52.2543 2200.0 53.5698 2200.0 55.6356 2500.0 57.0699 2500.0 63.0444 2500.0 96.7498 2600.0 123.0441 11000.0 144.3038 2100.0 163.2307 2300.0 173.5217 4200.0 173.5375 20000.0 178.2903 2400.0 212.0707 74000.0 213.0547 28000.0 214.8889 2700.0 222.0555 16000.0 225.0532 5400.0 230.0815 18000.0 240.0655 190000.0 241.0498 44000.0 243.0645 3400.0 250.0498 110000.0 258.0759 140000.0 266.0451 3800.0 267.0774 8000.0 268.0273 4700.0 268.0604 190000.0 277.0626 11000.0 278.045 72000.0 284.0572 4900.0 285.0875 8400.0 286.0713 74000.0 295.0715 39000.0 296.0556 130000.0 313.0823 27000.0 314.0659 28000.0 END IONS BEGIN IONS SCANS=93 PEPMASS=437.9734 CHARGE=1 COLLISION_ENERGY=0.0 55.9344 74000.0 56.9423 4400.0 69.95 25000.0 71.9292 55000.0 72.9324 3800.0 72.9371 110000.0 73.945 44000.0 74.6489 2200.0 74.9527 7400.0 77.5614 2200.0 85.9452 5300.0 87.9548 4300.0 87.9606 58000.0 88.9324 2600.0 89.9332 2900.0 89.9398 100000.0 89.9463 4900.0 90.9411 5600.0 90.9476 180000.0 90.9528 3600.0 91.9554 42000.0 99.9607 5500.0 101.9762 29000.0 102.9476 26000.0 103.9555 8300.0 105.9347 63000.0 105.9427 3500.0 105.9711 10000.0 106.9426 21000.0 107.9504 92000.0 108.9582 20000.0 111.9605 8100.0 113.9398 4300.0 113.9635 3400.0 113.977 2400.0 114.9484 5600.0 115.9555 38000.0 116.9274 2300.0 116.9633 14000.0 117.9348 14000.0 117.9709 8300.0 118.9425 15000.0 120.9581 3300.0 121.0646 3500.0 121.5089 2600.0 123.9453 21000.0 124.9527 5700.0 125.961 37000.0 127.9556 45000.0 127.9914 3800.0 128.9631 2700.0 129.9712 31000.0 130.9792 22000.0 131.9504 160000.0 131.9868 17000.0 132.9583 120000.0 133.966 52000.0 134.9733 3200.0 135.9452 6400.0 136.9529 5600.0 137.0598 11000.0 140.0467 3100.0 142.0071 6100.0 142.9426 3600.0 143.9504 140000.0 143.9634 5100.0 143.9868 150000.0 144.9582 3300.0 145.9661 610000.0 146.0015 4000.0 146.9378 5300.0 147.9453 16000.0 147.9817 150000.0 147.9955 3900.0 148.9893 6700.0 149.9466 3900.0 149.961 290000.0 150.9688 51000.0 151.9646 3700.0 151.9767 32000.0 153.0404 5100.0 154.0055 2800.0 154.0876 3500.0 154.9786 3200.0 155.9504 12000.0 157.966 33000.0 157.9784 4200.0 158.0025 7700.0 158.938 3800.0 158.974 9300.0 159.9455 22000.0 160.0186 3300.0 160.9533 6200.0 161.961 320000.0 161.9973 20000.0 163.9413 4600.0 163.961 5200.0 163.9767 100000.0 164.9479 7300.0 165.9568 5700.0 165.9924 150000.0 167.9717 42000.0 169.9661 8600.0 170.0025 50000.0 171.9455 18000.0 171.982 8700.0 173.5326 25000.0 173.9611 210000.0 175.977 25000.0 177.956 14000.0 179.9716 10000.0 183.9819 3300.0 185.9976 23000.0 187.9404 250000.0 187.9603 4700.0 187.9706 4300.0 187.979 3300.0 188.0127 4500.0 189.956 36000.0 189.993 4000.0 191.9716 350000.0 195.9821 10000.0 197.9977 8200.0 200.9854 7000.0 201.9562 160000.0 201.9903 4600.0 202.9626 3000.0 204.0084 5400.0 205.951 160000.0 206.0235 20000.0 207.9661 3800.0 209.9823 19000.0 213.9926 78000.0 215.9357 6800.0 215.9717 5500.0 216.0087 4800.0 217.9508 4900.0 217.9878 4000.0 219.9666 940000.0 221.9702 3200.0 223.9779 7300.0 229.9866 4800.0 232.0028 7000.0 233.9816 4400.0 235.961 3100.0 237.9402 3100.0 239.9719 11000.0 241.9876 7200.0 242.9833 8000.0 243.9661 3900.0 245.9459 15000.0 257.9819 14000.0 263.9568 8500.0 264.9654 3400.0 267.9662 9000.0 269.9448 2800.0 283.9589 3000.0 285.9768 5100.0 301.9716 6000.0 303.989 3800.0 329.968 12000.0 352.1554 2700.0 END IONS BEGIN IONS SCANS=94 PEPMASS=462.2128 CHARGE=1 COLLISION_ENERGY=0.0 58.065 920000.0 58.0683 9200.0 58.0699 6700.0 72.0805 8300.0 73.0287 2300.0 82.9064 2200.0 85.0281 24000.0 87.5083 2300.0 91.8152 2600.0 93.8284 2300.0 97.0277 5300.0 99.0441 2600.0 107.0489 88000.0 116.0636 2000.0 116.3218 2600.0 116.6603 2200.0 119.0493 2600.0 121.0645 51000.0 123.0438 19000.0 127.0389 5900.0 131.0652 2400.0 135.0442 2500.0 137.0594 35000.0 143.0484 3400.0 145.0645 19000.0 147.0804 11000.0 149.4366 2400.0 152.8922 2300.0 154.086 6100.0 161.0595 41000.0 161.8863 2300.0 163.0753 6900.0 173.5228 14000.0 173.5383 36000.0 209.0965 2500.0 237.0907 3800.0 239.1058 6200.0 250.4778 2400.0 255.1013 230000.0 255.1327 4000.0 257.1171 84000.0 278.1894 2600.0 300.1024 3800.0 300.1596 450000.0 300.1915 2200.0 306.8652 2600.0 309.2583 2900.0 406.1834 2300.0 462.2119 830000.0 END IONS BEGIN IONS SCANS=95 PEPMASS=254.1614 CHARGE=1 COLLISION_ENERGY=0.0 48.7765 7400.0 48.7785 38000.0 49.6994 2300.0 56.6969 2500.0 58.3817 2400.0 60.0554 32000.0 61.4624 2300.0 64.6683 2400.0 65.138 2700.0 69.0335 10000.0 69.2378 2500.0 70.065 770000.0 70.0689 3000.0 70.0714 3700.0 70.7498 2500.0 71.0492 16000.0 75.7881 2900.0 82.065 17000.0 82.55 2600.0 87.044 17000.0 87.0635 3200.0 88.0756 22000.0 91.0542 10000.0 92.0768 2700.0 97.0759 88000.0 98.0599 630000.0 98.0706 4500.0 99.0677 2800.0 100.0757 3100.0 105.8544 3000.0 112.0868 69000.0 115.0867 7200.0 116.0704 6600.0 122.0963 65000.0 125.0708 1000000.0 125.0796 5200.0 125.9648 2700.0 130.148 2800.0 137.0597 36000.0 140.0815 12000.0 149.1074 6400.0 150.0911 13000.0 153.0657 22000.0 154.0734 28000.0 156.4306 3200.0 157.5716 2700.0 164.1189 6900.0 166.134 170000.0 166.9792 14000.0 167.1179 1900000.0 173.533 35000.0 177.1027 13000.0 178.9791 9200.0 185.1036 31000.0 192.1139 2800.0 193.0971 23000.0 194.1289 770000.0 194.9738 28000.0 195.0583 8000.0 195.0704 75000.0 195.0801 51000.0 195.1128 11000000.0 195.1463 45000.0 195.1548 73000.0 195.1675 21000.0 195.1782 11000.0 196.9894 13000.0 205.9894 6900.0 206.0809 4100.0 208.0974 2800.0 208.9897 69000.0 209.1198 2800.0 209.1402 32000.0 212.1394 34000.0 212.9835 3500.0 217.5218 2600.0 220.1083 55000.0 224.0009 25000.0 226.0161 81000.0 226.9999 17000.0 237.1348 110000.0 247.141 2700.0 254.1164 4000.0 254.1612 520000.0 END IONS BEGIN IONS SCANS=96 PEPMASS=241.1549 CHARGE=1 COLLISION_ENERGY=0.0 43.0177 6300.0 43.5438 2100.0 45.248 2300.0 47.0687 2100.0 48.3308 2400.0 49.2312 2500.0 49.8285 2500.0 50.1119 2200.0 50.2211 2200.0 53.9387 27000.0 55.9342 5300.0 56.2748 2200.0 58.0648 200000.0 58.8158 2300.0 62.1238 2200.0 62.4405 2200.0 67.9544 5400.0 69.9336 12000.0 70.0648 22000.0 70.9413 27000.0 71.9492 3500.0 72.8355 2200.0 73.8687 2400.0 76.4263 2600.0 78.801 2600.0 78.9362 2400.0 81.0332 2600.0 81.0445 2500.0 84.0803 88000.0 85.9647 8200.0 87.9441 14000.0 88.9128 2700.0 88.9519 41000.0 89.9597 2600.0 98.0959 12000.0 100.1111 3000.0 103.9393 8700.0 105.9546 15000.0 110.071 2700.0 116.9474 2500.0 123.6785 2400.0 123.9658 3000.0 126.0911 2500.0 126.9233 2300.0 128.1066 67000.0 128.8087 2200.0 129.9547 20000.0 130.9628 9200.0 136.0744 2600.0 143.9701 18000.0 144.1019 18000.0 145.0778 2700.0 145.9868 6600.0 147.9652 32000.0 148.9747 2700.0 149.0953 2800.0 149.6871 16000.0 149.708 3200.0 156.1729 2600.0 161.0702 6200.0 165.9767 3000.0 166.9109 2300.0 168.1008 6700.0 171.966 8100.0 173.5296 17000.0 173.5381 3800.0 189.9762 11000.0 194.9429 13000.0 196.0965 93000.0 197.9973 13000.0 200.5061 2200.0 203.4803 2600.0 203.8833 6800.0 205.4919 2400.0 239.1345 2300.0 241.1545 720000.0 243.8376 2700.0 END IONS BEGIN IONS SCANS=97 PEPMASS=210.0612 CHARGE=1 COLLISION_ENERGY=0.0 43.0177 25000.0 44.5128 2400.0 52.5352 2500.0 55.162 2300.0 56.63 2200.0 57.978 2100.0 58.1545 2300.0 58.7639 2500.0 59.6194 2600.0 66.0408 2700.0 68.9968 23000.0 79.173 2500.0 83.8544 2200.0 84.1977 2300.0 87.0072 4300.0 91.0535 3000.0 96.067 2200.0 103.3024 2200.0 111.0072 27000.0 115.6297 2000.0 116.966 6000.0 117.9664 2600.0 129.0179 75000.0 137.0594 18000.0 139.0023 55000.0 139.0126 2500.0 149.6714 6500.0 149.6866 17000.0 149.6932 4500.0 157.0127 4100.0 173.5247 3000.0 173.5337 14000.0 174.0549 2900.0 184.6501 2500.0 192.0656 23000.0 END IONS BEGIN IONS SCANS=98 PEPMASS=393.9837 CHARGE=1 COLLISION_ENERGY=0.0 55.9342 47000.0 62.3632 2000.0 69.9499 14000.0 71.929 29000.0 72.552 2200.0 72.9368 52000.0 73.9446 20000.0 74.3905 2200.0 85.0281 11000.0 85.3851 2400.0 85.6291 3100.0 87.9603 28000.0 89.9395 49000.0 90.9474 91000.0 91.9554 15000.0 101.976 24000.0 103.955 2600.0 105.9344 36000.0 107.9501 61000.0 108.9582 2500.0 109.3602 2900.0 115.9553 20000.0 116.5575 2500.0 116.9628 3600.0 117.9345 9800.0 118.9421 6900.0 119.0487 18000.0 121.0645 8000.0 123.9454 2600.0 125.961 20000.0 127.9549 7200.0 129.9707 19000.0 130.9789 10000.0 131.9501 90000.0 132.958 64000.0 133.9658 29000.0 137.0481 3600.0 137.0594 140000.0 141.0005 6300.0 142.0053 3500.0 142.9959 12000.0 143.9502 42000.0 143.9865 73000.0 145.9537 4600.0 145.9658 290000.0 145.9793 8500.0 147.0314 2500.0 147.0437 89000.0 147.9813 99000.0 149.6648 3400.0 149.6855 6400.0 149.6964 3800.0 149.9607 170000.0 150.9687 24000.0 151.9763 18000.0 155.9507 9600.0 157.9662 13000.0 159.9458 3200.0 161.9609 78000.0 161.9969 5800.0 163.9765 40000.0 165.9921 61000.0 167.9715 13000.0 170.0024 23000.0 171.9468 3600.0 173.5313 41000.0 173.961 130000.0 175.9761 2900.0 176.1505 2400.0 179.0702 47000.0 185.9971 3600.0 187.9401 70000.0 189.956 6600.0 191.9714 140000.0 201.9559 140000.0 205.9508 36000.0 213.9926 18000.0 219.9422 3200.0 219.9666 210000.0 223.9783 2500.0 262.1714 2800.0 320.6375 2300.0 394.3459 9900.0 END IONS BEGIN IONS SCANS=99 PEPMASS=236.0921 CHARGE=1 COLLISION_ENERGY=0.0 43.4275 2100.0 43.9024 2800.0 47.807 2300.0 48.0619 2500.0 48.0945 2100.0 48.3284 2400.0 48.4554 2300.0 50.9638 2200.0 51.3509 2200.0 54.52 29000.0 54.5216 4900.0 55.0179 9600.0 55.9342 2500.0 60.1418 2100.0 60.2839 2600.0 61.7243 2100.0 62.2495 2700.0 66.1159 2600.0 66.3361 2000.0 69.0698 2400.0 71.0492 2300.0 73.0454 2100.0 74.1914 2100.0 75.862 2500.0 76.0731 2500.0 76.5983 2100.0 78.1114 2200.0 83.3433 2600.0 84.3505 2400.0 86.0966 2600.0 88.5016 2600.0 89.0386 3100.0 91.0542 12000.0 91.7544 2200.0 93.2829 2200.0 96.2139 2700.0 98.0598 3300.0 99.879 2200.0 106.0647 10000.0 106.8391 2400.0 109.8932 2100.0 115.0541 7700.0 116.0495 26000.0 117.0699 6100.0 117.1149 2400.0 119.0487 6700.0 129.0696 20000.0 131.0493 15000.0 132.6688 2300.0 134.06 82000.0 135.0441 60000.0 137.0596 130000.0 137.4177 2800.0 141.2733 2500.0 143.0493 6600.0 144.0807 91000.0 145.0648 29000.0 146.0594 5900.0 147.0439 28000.0 149.0598 27000.0 149.6818 5400.0 149.6928 4000.0 149.7034 3200.0 151.9046 2600.0 157.0652 7400.0 161.06 8900.0 162.055 770000.0 162.0912 41000.0 163.0628 96000.0 164.0706 6700.0 172.0758 120000.0 173.0604 18000.0 173.5282 51000.0 173.5429 21000.0 175.062 17000.0 175.0764 16000.0 176.0712 15000.0 177.0547 13000.0 189.0775 5500.0 190.0679 5000.0 190.0864 1100000.0 194.9737 3000.0 200.0705 56000.0 201.0792 15000.0 203.0582 9700.0 216.0649 2200.0 218.0038 8200.0 218.0178 18000.0 218.0316 71000.0 218.0416 49000.0 218.0812 12000000.0 218.1208 48000.0 218.1312 70000.0 218.1454 20000.0 218.9935 7700.0 219.0151 6200.0 223.7893 2800.0 236.0649 3400.0 236.0918 1500000.0 236.1213 5800.0 243.9864 2500.0 END IONS BEGIN IONS SCANS=100 PEPMASS=267.0979 CHARGE=1 COLLISION_ENERGY=0.0 55.1962 2100.0 64.8927 2300.0 66.4617 2400.0 67.054 11000.0 83.2674 2200.0 94.0585 3200.0 94.0649 66000.0 100.039 18000.0 101.0232 2700.0 103.1215 2700.0 106.0648 26000.0 122.0598 77000.0 140.2413 2500.0 149.67 3700.0 149.6824 9500.0 149.6918 15000.0 149.7028 6500.0 150.0267 5100.0 150.0548 1300000.0 162.055 23000.0 162.392 2500.0 168.0655 44000.0 173.5317 17000.0 178.6542 2400.0 180.0652 2900.0 192.3783 2300.0 195.9773 2600.0 208.0606 23000.0 END IONS BEGIN IONS SCANS=101 PEPMASS=300.1447 CHARGE=1 COLLISION_ENERGY=0.0 50.8989 2400.0 57.0333 130000.0 65.0385 2900.0 66.6101 2200.0 71.0489 4900.0 73.028 81000.0 75.0438 630000.0 75.0487 4400.0 75.0513 5700.0 83.049 9000.0 83.6183 2600.0 85.0281 54000.0 86.5131 2500.0 90.9479 6800.0 91.0483 4200.0 91.0539 130000.0 98.4725 2300.0 100.3406 2200.0 104.799 2800.0 109.0646 15000.0 111.044 5300.0 119.0405 3300.0 119.0488 96000.0 121.0648 8700.0 124.9678 2500.0 137.0594 1900000.0 137.0695 27000.0 137.0837 16000.0 144.9578 2500.0 148.825 2500.0 153.7004 2300.0 154.086 32000.0 156.2834 2400.0 158.7841 2500.0 167.267 2700.0 168.9579 2400.0 173.5214 13000.0 173.5397 29000.0 180.842 2900.0 187.7868 2400.0 193.0325 4300.0 197.8891 2700.0 200.0654 2500.0 END IONS BEGIN IONS SCANS=102 PEPMASS=242.9828 CHARGE=1 COLLISION_ENERGY=0.0 44.4431 2100.0 46.4163 2200.0 48.724 2700.0 51.0463 2100.0 51.4622 2200.0 51.6609 2400.0 52.9244 2300.0 55.0177 28000.0 55.4904 2200.0 55.9342 820000.0 55.9371 2400.0 56.942 41000.0 57.7797 2500.0 59.0736 2100.0 59.5853 3200.0 60.0931 2200.0 62.4588 2300.0 62.4817 2500.0 66.9674 2100.0 68.8185 2300.0 69.9497 280000.0 70.9577 11000.0 71.929 380000.0 71.9336 2400.0 72.9369 870000.0 72.9411 3300.0 73.2138 2400.0 73.9404 3200.0 73.9447 180000.0 74.9526 19000.0 76.7853 2500.0 78.3255 2500.0 81.95 5000.0 81.9762 2400.0 83.9655 44000.0 85.9448 20000.0 87.9603 420000.0 87.9668 5600.0 88.9685 2600.0 89.9396 460000.0 89.9455 2800.0 90.9475 1100000.0 90.9533 3700.0 90.9545 5100.0 91.9443 2400.0 91.9552 120000.0 95.0318 2600.0 99.9604 42000.0 100.1219 2200.0 100.9315 3000.0 101.9759 120000.0 102.9474 22000.0 102.9552 2200.0 103.9553 50000.0 105.9343 250000.0 105.9709 24000.0 107.9501 460000.0 107.9583 7400.0 108.9579 75000.0 111.9603 110000.0 113.9397 7200.0 113.9635 7800.0 114.8711 2400.0 114.9479 10000.0 115.9552 100000.0 116.9636 30000.0 117.9344 61000.0 117.9709 45000.0 118.9425 44000.0 121.966 2600.0 123.9451 75000.0 125.9607 150000.0 128.9505 27000.0 129.0178 16000.0 129.971 88000.0 130.9811 15000.0 131.9502 610000.0 131.9604 2800.0 132.1223 2700.0 132.958 350000.0 133.9549 3300.0 133.9659 150000.0 135.9451 23000.0 136.953 7500.0 141.7192 2400.0 143.9502 17000.0 145.952 3500.0 145.9658 540000.0 145.9808 9900.0 147.9679 3200.0 147.9814 250000.0 147.9943 2400.0 149.6856 5100.0 149.6957 3400.0 149.9467 5200.0 149.9608 1100000.0 149.9708 2500.0 149.9748 4900.0 150.9686 130000.0 151.9764 87000.0 154.485 2100.0 155.9501 54000.0 156.1101 3000.0 157.9661 13000.0 160.8403 2700.0 161.9605 33000.0 163.9765 70000.0 165.9921 180000.0 167.9715 120000.0 173.5331 42000.0 173.9437 5100.0 173.9609 310000.0 173.9754 2100.0 178.6438 2500.0 178.9217 14000.0 180.887 2400.0 187.9406 18000.0 191.9714 380000.0 191.9911 4900.0 196.9326 29000.0 197.8915 12000.0 201.956 37000.0 202.0077 2400.0 205.952 3100.0 209.9817 5600.0 212.2846 2700.0 218.0975 2300.0 219.9664 57000.0 230.405 2300.0 237.3806 2500.0 243.1599 4700.0 250.9589 2600.0 END IONS BEGIN IONS SCANS=103 PEPMASS=322.0776 CHARGE=1 COLLISION_ENERGY=0.0 49.4322 2100.0 50.3921 2300.0 52.6012 2200.0 53.4733 2500.0 54.5212 2700.0 55.3666 2700.0 55.8387 2100.0 56.0492 120000.0 57.0452 2600.0 61.4665 2300.0 62.091 2500.0 62.8946 2200.0 63.2738 2200.0 64.2634 2300.0 65.7157 2200.0 70.8952 2200.0 72.0806 12000.0 72.7155 2200.0 73.044 2200.0 77.9611 2800.0 78.6619 2300.0 78.9927 2000.0 79.1694 2300.0 79.4507 2600.0 80.9179 2300.0 83.52 2200.0 84.0441 760000.0 85.028 130000.0 87.7521 2600.0 88.3165 2500.0 93.3249 2800.0 96.035 2500.0 97.6726 2300.0 98.3347 2200.0 101.0227 2600.0 102.0546 220000.0 106.072 2500.0 111.0073 7500.0 115.8113 2000.0 128.0339 48000.0 129.018 88000.0 130.0496 330000.0 136.4759 2300.0 136.9599 2900.0 138.0183 81000.0 139.0023 19000.0 145.0285 7500.0 148.0601 7000.0 149.6924 2800.0 150.0546 3000.0 152.034 67000.0 152.0747 2700.0 156.0288 86000.0 158.8372 2200.0 161.5686 2300.0 166.0497 220000.0 170.5309 2800.0 170.9204 2800.0 173.5202 4900.0 173.5288 58000.0 173.5389 39000.0 174.0396 110000.0 174.6813 2500.0 175.0268 5500.0 176.0344 100000.0 177.0547 39000.0 180.0292 42000.0 183.2516 2500.0 183.4448 2400.0 184.0603 68000.0 193.6653 2500.0 194.0147 3200.0 194.0243 10000.0 194.0448 690000.0 194.0604 2300.0 194.0663 2300.0 196.6492 2400.0 198.0394 2800.0 204.0289 3100.0 212.0554 550000.0 212.0727 2300.0 216.9955 2500.0 222.04 71000.0 234.1117 11000.0 240.0506 44000.0 258.0596 3000.0 266.7544 2600.0 271.9769 2700.0 272.0714 3000.0 END IONS BEGIN IONS SCANS=104 PEPMASS=335.9418 CHARGE=1 COLLISION_ENERGY=0.0 50.7611 2500.0 51.5173 2100.0 51.7829 2400.0 53.9778 2400.0 55.9341 120000.0 56.0706 2400.0 58.2478 2400.0 59.9827 3200.0 65.2891 2400.0 69.9497 27000.0 71.5915 2600.0 71.929 59000.0 72.8747 2200.0 72.9368 150000.0 73.9447 47000.0 74.9125 2400.0 79.4275 2500.0 81.1788 2200.0 81.9497 2200.0 84.1278 2500.0 85.4755 2500.0 87.5721 2800.0 87.9601 52000.0 89.9395 110000.0 90.9412 2500.0 90.9473 200000.0 91.9552 33000.0 99.9602 16000.0 101.976 29000.0 103.9554 8400.0 105.9344 68000.0 107.9501 140000.0 108.1287 2400.0 108.9582 6300.0 110.6313 2200.0 111.9603 58000.0 114.3733 2500.0 115.6618 2300.0 115.9552 26000.0 116.9637 3800.0 117.9344 17000.0 118.9421 3700.0 123.9446 23000.0 125.9607 61000.0 129.9708 74000.0 131.9502 60000.0 132.9578 35000.0 133.9658 53000.0 137.0592 3500.0 145.9657 57000.0 147.9699 9800.0 147.9814 240000.0 147.9953 3500.0 148.446 2700.0 149.6825 5700.0 149.6931 4100.0 149.9608 97000.0 150.9687 9200.0 151.9764 33000.0 155.9503 28000.0 157.9659 64000.0 159.9447 6400.0 161.9605 8200.0 163.9763 2900.0 164.7773 2300.0 165.9922 180000.0 167.9718 8500.0 173.5348 60000.0 173.9609 230000.0 175.9775 5300.0 177.956 2800.0 183.9456 29000.0 185.925 6200.0 188.5371 2700.0 191.9714 620000.0 199.9401 43000.0 201.9558 31000.0 203.9352 170000.0 205.8995 4100.0 210.8537 2900.0 213.0181 2800.0 217.951 250000.0 219.9663 29000.0 221.945 4000.0 222.9927 6100.0 227.9354 58000.0 235.9618 39000.0 245.9458 140000.0 251.8321 2500.0 259.9705 2400.0 261.1246 2300.0 263.9556 10000.0 285.928 2300.0 END IONS BEGIN IONS SCANS=105 PEPMASS=254.1615 CHARGE=1 COLLISION_ENERGY=0.0 44.6134 2200.0 45.8878 2100.0 45.8969 2600.0 46.3508 2300.0 47.0146 2300.0 48.6111 2100.0 48.7777 29000.0 48.7793 5400.0 49.5702 2200.0 49.6558 2200.0 51.3546 2700.0 53.8371 2600.0 54.4726 2300.0 55.0191 2900.0 55.566 2200.0 57.713 2500.0 60.0555 23000.0 61.2521 2200.0 67.0777 2300.0 68.0495 2800.0 70.065 590000.0 70.0687 2600.0 71.0489 8900.0 74.37 2100.0 80.3625 2600.0 80.41 2400.0 82.0651 13000.0 88.0754 14000.0 89.7237 2400.0 97.076 58000.0 98.0599 490000.0 98.0674 5800.0 100.0755 4300.0 100.456 2100.0 103.9294 2500.0 107.0946 2100.0 112.0868 52000.0 120.5247 2500.0 122.0964 48000.0 124.2998 2400.0 125.0708 800000.0 125.0796 2600.0 140.0818 3600.0 143.0823 6000.0 149.1071 3800.0 150.091 8100.0 153.0656 21000.0 154.0738 17000.0 164.1185 6300.0 166.1338 120000.0 167.1178 1600000.0 173.5208 4800.0 173.53 47000.0 173.5392 8900.0 177.1028 14000.0 185.1034 16000.0 191.0468 2800.0 193.0973 18000.0 194.1288 640000.0 194.1452 2400.0 195.0704 50000.0 195.0804 26000.0 195.1128 9100000.0 195.1548 62000.0 195.1661 6200.0 195.1781 4300.0 204.8599 2700.0 209.1402 18000.0 212.1396 20000.0 214.3137 2400.0 220.108 45000.0 225.8973 2600.0 237.1347 97000.0 252.7655 2600.0 254.1612 440000.0 254.2077 2700.0 END IONS BEGIN IONS SCANS=106 PEPMASS=236.0922 CHARGE=1 COLLISION_ENERGY=0.0 44.4686 2700.0 45.8229 2500.0 46.2312 2300.0 46.2538 2300.0 46.7292 2400.0 47.5159 2200.0 48.4268 2200.0 48.6533 2200.0 49.1258 2500.0 49.2641 2300.0 49.5505 2500.0 50.0547 2200.0 50.1755 2200.0 50.3392 2200.0 50.5563 2400.0 50.6834 2200.0 51.2559 2200.0 51.499 2100.0 51.5666 2400.0 51.5863 2300.0 51.9651 2300.0 52.1052 2300.0 52.9581 2600.0 54.2603 2500.0 54.7672 2500.0 55.9342 12000.0 56.6135 2000.0 57.2419 2300.0 58.1489 2300.0 62.8777 2200.0 63.0197 2300.0 64.4555 2500.0 64.9477 2200.0 65.062 2700.0 65.5454 2600.0 65.6232 2100.0 66.2954 2100.0 67.1146 2300.0 70.0433 2100.0 70.4476 2200.0 70.8106 2600.0 70.9619 2300.0 71.0864 2600.0 71.3718 2300.0 71.5819 2600.0 72.7842 2600.0 73.1312 2600.0 74.9437 2500.0 75.0338 2200.0 76.2535 2400.0 77.4503 2200.0 78.099 2700.0 78.2361 2500.0 79.0467 2800.0 80.1444 2400.0 81.3244 2500.0 82.3071 2500.0 84.2717 2600.0 86.3787 2200.0 86.6861 2000.0 89.0099 2500.0 91.1087 2100.0 93.8861 2400.0 95.1676 2200.0 96.0596 2400.0 96.4917 2300.0 98.5591 2600.0 99.6687 2900.0 103.6728 2300.0 104.2693 2400.0 105.8849 2500.0 106.0643 3300.0 106.8476 2300.0 107.3581 2400.0 108.3716 2500.0 109.8878 2600.0 112.6172 2300.0 116.1279 2900.0 118.7166 2400.0 120.6768 2100.0 125.2968 2400.0 127.682 2300.0 127.8999 2300.0 128.1659 2400.0 132.7713 2500.0 134.0597 18000.0 135.0436 5300.0 137.0594 30000.0 140.3918 2300.0 141.5704 2300.0 142.476 2700.0 142.9509 2500.0 143.9078 2500.0 144.0809 17000.0 145.0643 2600.0 147.0443 3300.0 147.9089 2300.0 148.5612 2700.0 148.9478 2400.0 149.0593 3000.0 151.9261 2300.0 152.8678 2700.0 153.9522 2100.0 154.9212 2500.0 156.2955 2500.0 157.3939 2300.0 159.8256 2800.0 162.0548 270000.0 162.0909 2900.0 162.5342 2300.0 163.0624 12000.0 169.2432 2600.0 171.6146 2600.0 172.0756 29000.0 173.5253 110000.0 173.5398 81000.0 174.9569 2600.0 178.1599 2600.0 182.7554 2700.0 184.9414 19000.0 185.4211 2600.0 185.7648 2500.0 187.8861 2500.0 190.0862 370000.0 190.1059 3700.0 194.4625 2200.0 194.9437 22000.0 196.7 2300.0 198.7287 2500.0 200.0696 4900.0 202.9521 18000.0 204.1858 2200.0 213.839 2300.0 217.96 13000.0 218.0568 36000.0 218.0814 3800000.0 218.1064 19000.0 219.0134 21000.0 219.8723 2700.0 228.7002 2500.0 236.0648 4400.0 236.0919 530000.0 236.1174 4500.0 END IONS BEGIN IONS SCANS=107 PEPMASS=321.0852 CHARGE=1 COLLISION_ENERGY=0.0 49.0644 2500.0 49.9864 2300.0 51.2895 2400.0 52.5062 2300.0 53.3951 2400.0 55.9033 2200.0 60.5483 2600.0 60.6307 2400.0 61.0915 2500.0 61.7466 2200.0 62.9141 2600.0 64.1945 2600.0 64.4949 2300.0 64.8327 2300.0 66.1259 2300.0 66.6945 2200.0 67.107 2000.0 70.8383 2300.0 72.6841 2300.0 72.8408 2000.0 82.5688 2500.0 93.7182 2500.0 95.6617 2300.0 97.4101 2100.0 98.9638 2600.0 104.7906 2500.0 105.3221 2100.0 107.407 2400.0 107.8674 2500.0 108.7716 2800.0 110.6615 2400.0 115.7491 2600.0 116.9825 2500.0 126.1059 2300.0 131.049 5800.0 133.5513 2400.0 135.0435 3000.0 140.9063 2900.0 146.6924 2300.0 147.6235 2300.0 148.3833 2400.0 149.0598 30000.0 150.3327 2300.0 161.0596 22000.0 164.66 2500.0 165.488 2100.0 168.1406 3000.0 172.0022 10000.0 172.0195 6200.0 172.0368 5800000.0 172.0542 12000.0 172.0645 7400.0 172.0716 33000.0 173.0582 2700.0 173.5246 38000.0 173.5394 70000.0 173.6947 2400.0 173.9748 2000.0 175.2106 2300.0 194.0474 2500.0 195.0466 2400.0 196.0092 2800.0 198.3139 2400.0 198.4237 2600.0 203.2641 2700.0 212.0553 4800.0 212.8361 2300.0 218.586 2400.0 279.7158 2700.0 284.5151 2200.0 316.1362 2700.0 320.2665 2800.0 329.5608 2700.0 END IONS BEGIN IONS SCANS=108 PEPMASS=462.213 CHARGE=1 COLLISION_ENERGY=0.0 58.0648 270000.0 58.0683 3800.0 80.8918 2700.0 83.475 2200.0 85.0278 3100.0 91.8101 2200.0 100.2082 2600.0 107.0487 21000.0 121.0642 7200.0 123.0438 5000.0 131.0469 2300.0 137.0589 6500.0 145.0627 2600.0 147.0796 3100.0 148.8835 2200.0 161.0591 12000.0 173.5343 31000.0 177.7283 2700.0 224.7393 2600.0 234.9684 6600.0 243.0571 2500.0 251.9705 3100.0 255.101 71000.0 257.1167 23000.0 275.9705 8700.0 300.1593 130000.0 452.7038 2600.0 462.212 230000.0 466.1926 2600.0 END IONS BEGIN IONS SCANS=109 PEPMASS=284.1498 CHARGE=1 COLLISION_ENERGY=0.0 47.9821 2300.0 50.1538 2300.0 54.5484 2200.0 55.303 2400.0 55.607 2200.0 57.0332 36000.0 57.3363 2800.0 63.3368 2600.0 64.3273 2200.0 73.0281 19000.0 73.0547 2100.0 75.0437 160000.0 80.5652 2200.0 85.0282 5900.0 85.2184 2500.0 91.0539 25000.0 93.0695 59000.0 95.0489 17000.0 103.0538 28000.0 107.4551 2500.0 121.0644 1500000.0 121.0733 32000.0 151.4367 2200.0 173.5285 25000.0 173.5373 13000.0 198.6369 3000.0 200.5549 2300.0 231.1898 3300.0 284.295 15000.0 END IONS BEGIN IONS SCANS=110 PEPMASS=300.1449 CHARGE=1 COLLISION_ENERGY=0.0 47.57 2300.0 47.8905 2400.0 51.1296 2500.0 52.8392 2600.0 54.1116 2300.0 57.0332 210000.0 57.1592 2400.0 58.391 2100.0 64.8114 2200.0 66.369 2200.0 67.1147 2200.0 67.2187 2200.0 69.9804 2700.0 72.0806 3200.0 73.0281 130000.0 74.8762 2400.0 75.0438 1000000.0 75.0486 3300.0 79.1534 2500.0 83.049 5600.0 85.0281 71000.0 85.1082 2400.0 87.15 2400.0 91.0483 3000.0 91.0539 210000.0 92.5038 2900.0 92.5836 2200.0 98.0599 7300.0 98.4377 2200.0 106.4505 2500.0 109.0644 21000.0 111.0442 5400.0 117.1105 2500.0 119.0488 160000.0 121.8851 2200.0 127.6615 2400.0 129.21 2200.0 131.0488 2500.0 135.0438 25000.0 136.1827 3000.0 137.0594 3100000.0 137.0696 41000.0 138.0629 3000.0 143.888 2500.0 145.3701 2600.0 148.209 2700.0 151.4252 2200.0 152.7405 2600.0 154.086 51000.0 154.7116 2500.0 158.2307 2400.0 173.5283 75000.0 173.5405 25000.0 173.9238 2500.0 174.8284 2500.0 181.4727 2500.0 182.4376 2800.0 196.9346 2600.0 197.8903 22000.0 201.7589 2600.0 204.8919 2400.0 206.7183 2400.0 208.8863 3100.0 226.8992 2500.0 242.1752 2400.0 248.8819 3100.0 263.6756 2800.0 298.4416 2300.0 304.4622 2500.0 END IONS BEGIN IONS SCANS=111 PEPMASS=476.2286 CHARGE=1 COLLISION_ENERGY=0.0 57.0611 2200.0 57.1469 2400.0 58.065 1900000.0 58.0682 6100.0 60.0632 2000.0 62.1288 2400.0 62.2391 2400.0 63.7863 2800.0 65.1219 2600.0 65.2901 2500.0 66.1994 2400.0 66.3614 2400.0 67.2298 2600.0 69.0334 9400.0 70.2423 2100.0 70.951 2000.0 71.4147 2200.0 73.7031 2300.0 75.6312 2100.0 79.6327 2200.0 80.3783 2400.0 81.3204 2200.0 82.1988 2100.0 84.5571 2100.0 84.8006 2200.0 85.0282 31000.0 87.6228 2100.0 87.8283 2500.0 89.8753 2200.0 91.1024 2400.0 91.5647 2700.0 91.6498 2100.0 93.2016 2100.0 94.371 2600.0 95.6208 2400.0 96.6212 2100.0 98.1822 2100.0 98.2809 2500.0 102.6806 2300.0 104.7349 2500.0 105.3834 2600.0 105.7384 2300.0 106.0568 2400.0 106.8082 2600.0 107.0488 210000.0 107.3943 2800.0 109.0737 2500.0 109.656 2500.0 121.0645 73000.0 123.4296 2400.0 125.6312 2700.0 125.9122 2400.0 127.0384 2500.0 128.2295 2200.0 128.3814 2100.0 134.752 2500.0 137.0597 37000.0 142.3803 2300.0 145.0648 44000.0 147.08 21000.0 151.075 26000.0 153.7722 2300.0 157.5156 2300.0 159.2332 2300.0 162.0883 2400.0 173.5228 11000.0 173.5329 220000.0 173.5426 9900.0 175.0751 91000.0 177.0913 14000.0 182.7444 2600.0 183.0342 2200.0 190.2927 2300.0 194.8149 2300.0 198.369 2900.0 199.3685 2400.0 199.6036 2300.0 207.4219 2300.0 209.0956 5300.0 211.0736 2700.0 212.5123 2500.0 214.2957 2300.0 232.0537 2500.0 234.2265 2400.0 237.0908 71000.0 239.1067 19000.0 248.3815 2700.0 249.2491 2400.0 266.9042 2300.0 269.085 5200.0 269.117 760000.0 269.9685 2800.0 270.1053 2700.0 270.551 2700.0 271.1329 150000.0 282.7407 2400.0 301.9409 2900.0 303.4472 2300.0 311.8617 2300.0 314.1333 7600.0 314.1751 770000.0 320.7054 2400.0 327.7605 2600.0 328.1054 2500.0 336.3939 2700.0 350.1326 2300.0 353.5902 2400.0 358.1818 2500.0 369.7838 2400.0 379.5793 2300.0 382.4526 2300.0 388.0038 2400.0 393.7761 2300.0 405.7729 2600.0 425.1706 3300.0 456.6952 2400.0 469.6065 2400.0 476.2276 1400000.0 476.3406 3200.0 484.7595 2800.0 END IONS BEGIN IONS SCANS=112 PEPMASS=514.1385 CHARGE=1 COLLISION_ENERGY=0.0 59.4041 2500.0 63.9756 2400.0 64.1328 2200.0 65.7265 2200.0 66.3855 2300.0 68.668 2200.0 68.8571 2300.0 69.0332 7800.0 70.8251 2500.0 72.3793 2800.0 75.8677 2400.0 78.9846 3000.0 80.3275 2300.0 83.4437 2500.0 84.1407 2500.0 84.2268 2600.0 84.6291 2300.0 85.0282 63000.0 86.3059 2500.0 86.3514 2500.0 87.0436 6100.0 88.6844 2400.0 90.7024 2400.0 90.7172 2700.0 90.9195 2200.0 92.516 2400.0 93.1064 2400.0 94.3591 2700.0 97.0281 14000.0 98.5343 2200.0 98.6813 2200.0 102.6397 2500.0 104.1835 2600.0 106.7225 2500.0 107.0489 310000.0 107.0574 2600.0 107.3665 2200.0 108.3515 2600.0 109.5305 2200.0 114.7291 2200.0 116.2461 2300.0 118.2193 2600.0 120.2727 2400.0 120.8011 2300.0 123.0439 60000.0 127.0385 17000.0 128.4145 2500.0 135.5871 2300.0 137.2753 2200.0 141.1191 2600.0 143.049 17000.0 145.0499 3500.0 145.0645 43000.0 147.0443 2900.0 149.0586 2700.0 150.2321 2400.0 161.0594 160000.0 164.0705 77000.0 170.7755 2800.0 170.8949 2800.0 173.5265 120000.0 173.5402 68000.0 175.1635 2300.0 180.9707 2200.0 183.8235 2400.0 185.0636 2300.0 190.0253 2300.0 190.4391 2500.0 204.8162 2500.0 205.9256 2200.0 208.1477 2600.0 209.0962 2900.0 220.7204 2900.0 231.2102 2700.0 237.0909 9400.0 242.4989 2700.0 242.5405 2400.0 246.7422 2300.0 247.0078 2200.0 250.419 2200.0 255.0699 10000.0 255.0786 4300.0 255.1013 1100000.0 255.132 14000.0 256.5428 3100.0 268.9097 2500.0 270.8559 2400.0 272.1281 1200000.0 275.1496 2500.0 280.5091 2500.0 293.0682 2300.0 298.1156 2400.0 299.3896 2400.0 302.6125 2600.0 307.4678 2400.0 320.7115 2400.0 340.2664 2600.0 353.1187 2400.0 354.1335 2300.0 377.6311 2600.0 385.7667 2500.0 408.1603 2800.0 417.1604 2900.0 430.7695 2300.0 431.5673 2300.0 434.1115 4600.0 434.1807 1700000.0 434.251 4100.0 454.7706 2400.0 466.8594 2800.0 470.5595 2500.0 483.2468 2900.0 513.901 2400.0 END IONS BEGIN IONS SCANS=113 PEPMASS=379.0642 CHARGE=1 COLLISION_ENERGY=0.0 52.8068 2200.0 54.0381 2100.0 54.5907 2100.0 55.4361 2300.0 55.5977 2200.0 58.4361 2300.0 60.3292 2300.0 61.1467 2700.0 61.2807 2600.0 62.3638 2300.0 66.3836 2300.0 68.078 2300.0 68.7474 2200.0 68.9245 2600.0 71.2128 2300.0 73.7011 2200.0 74.539 2200.0 75.3483 2200.0 75.6097 2300.0 82.7795 2300.0 87.2338 2300.0 89.0616 2700.0 90.7077 2600.0 91.0539 3100.0 92.0495 2600.0 93.2767 2500.0 98.8562 2500.0 98.9206 2200.0 100.2854 2300.0 101.0304 2300.0 101.9649 2400.0 103.3486 2300.0 103.8037 2400.0 104.4729 2400.0 105.2743 2400.0 110.654 2600.0 113.2696 2500.0 119.0488 60000.0 127.12 2200.0 147.0437 810000.0 147.0549 2300.0 158.0568 2600.0 164.4783 2300.0 165.9894 2600.0 169.0258 170000.0 172.7929 2800.0 173.5326 140000.0 173.5447 5600.0 176.0829 2300.0 188.3801 2700.0 190.7406 2700.0 196.3984 2300.0 201.6423 2400.0 201.9554 2300.0 212.3073 2500.0 215.0146 7200.0 233.0267 580000.0 233.0516 4500.0 240.7657 2300.0 243.996 2900.0 265.6335 2600.0 269.4393 2500.0 277.6136 2300.0 280.9063 2600.0 287.3417 3200.0 294.008 2400.0 328.113 2400.0 372.0388 2600.0 385.326 2800.0 END IONS BEGIN IONS SCANS=114 PEPMASS=455.9992 CHARGE=1 COLLISION_ENERGY=0.0 59.2929 2500.0 61.7288 2300.0 65.5049 2500.0 66.6363 2200.0 66.9306 2000.0 71.2395 2400.0 73.6842 2300.0 74.0951 2400.0 82.8514 2100.0 84.0031 2200.0 91.0539 60000.0 95.0737 2600.0 97.2366 2500.0 98.1085 2500.0 99.4948 2500.0 99.754 2800.0 101.2168 2200.0 102.3462 2600.0 107.3143 2400.0 111.5436 2200.0 113.6893 3200.0 114.2993 2600.0 119.0488 180000.0 131.9496 2900.0 144.9578 12000.0 145.7516 2500.0 147.0437 1900000.0 147.0549 26000.0 152.9509 2700.0 157.9656 45000.0 158.1081 2800.0 163.7219 2100.0 167.906 2700.0 173.5203 5000.0 173.5336 110000.0 173.5449 3700.0 173.8401 2600.0 173.9624 2600.0 175.8048 2100.0 181.7727 2700.0 188.9397 2400.0 191.9865 25000.0 201.9725 3300.0 211.6345 2800.0 217.9659 20000.0 218.9741 57000.0 219.9816 79000.0 233.9609 27000.0 234.9682 6800.0 235.9766 36000.0 241.2513 2400.0 245.997 42000.0 253.9865 3400.0 259.977 81000.0 271.6462 2500.0 272.9844 33000.0 275.9722 58000.0 277.9881 2600.0 285.9925 48000.0 309.8249 2500.0 317.9177 2500.0 389.2852 2700.0 401.6758 2700.0 426.265 2600.0 END IONS BEGIN IONS SCANS=115 PEPMASS=220.1184 CHARGE=1 COLLISION_ENERGY=0.0 42.6139 2200.0 42.7965 2500.0 43.0177 450000.0 43.0261 2400.0 43.0687 2200.0 45.0333 130000.0 45.5663 2100.0 46.2977 2200.0 46.7814 2400.0 48.3415 2500.0 49.1896 2200.0 50.8689 2400.0 51.4459 2300.0 52.2773 2400.0 52.3577 2400.0 52.7825 2300.0 53.1982 2200.0 54.3848 2800.0 54.4416 2300.0 55.0177 41000.0 55.054 25000.0 55.3762 2000.0 55.7403 2500.0 55.9342 22000.0 56.013 3200.0 56.0782 2400.0 56.1428 2400.0 56.4542 2300.0 56.5513 2900.0 57.0696 350000.0 57.6857 2500.0 58.1396 2700.0 58.2801 2600.0 58.4781 2100.0 59.0489 240000.0 60.2851 2400.0 61.0283 2600.0 61.9385 2900.0 62.096 2300.0 65.2799 2100.0 65.8072 2500.0 66.0051 2600.0 66.3929 2000.0 66.6575 2200.0 67.0539 260000.0 68.08 2400.0 69.0696 170000.0 69.3282 2600.0 70.0284 330000.0 71.6823 2400.0 72.0041 3000.0 72.044 370000.0 72.9369 3200.0 73.0281 150000.0 74.0234 55000.0 75.6128 2400.0 76.0309 2200.0 79.0538 2500.0 79.671 2400.0 79.9346 2500.0 80.7651 2200.0 81.0691 2300.0 83.0488 40000.0 84.3369 2400.0 85.0645 390000.0 86.0961 58000.0 87.0801 11000.0 89.3533 2500.0 90.0546 1900000.0 91.2067 2200.0 91.4662 2100.0 91.9832 2500.0 92.2462 2400.0 92.9905 2300.0 94.5696 2300.0 95.0488 240000.0 95.7613 2300.0 96.0804 73000.0 96.3525 2200.0 97.6722 2700.0 98.0233 460000.0 98.0306 3300.0 99.883 2400.0 100.021 3300.0 100.039 34000.0 100.1293 2200.0 103.0751 110000.0 108.8239 2700.0 112.0745 4700.0 112.5418 2400.0 113.0593 60000.0 113.4349 2500.0 116.0339 260000.0 122.3342 2400.0 124.0659 12000.0 124.0753 700000.0 125.3129 2500.0 126.255 2400.0 129.2084 2400.0 130.0853 3500.0 130.9326 2300.0 131.0081 2800.0 131.0704 8600.0 133.8045 2700.0 138.3274 2500.0 138.9535 2500.0 139.3533 2600.0 142.086 200000.0 143.0831 2300.0 144.5236 2400.0 146.4959 2400.0 152.7723 2300.0 154.7325 2200.0 160.0968 19000.0 161.3271 2300.0 166.0857 15000.0 167.9486 2500.0 170.1884 3000.0 173.5254 63000.0 173.5371 130000.0 174.3849 2600.0 176.977 2300.0 178.9283 2600.0 179.263 2200.0 184.0968 110000.0 189.0088 2500.0 196.9042 40000.0 196.9365 170000.0 198.5285 2600.0 202.1074 90000.0 207.0372 2300.0 END IONS BEGIN IONS SCANS=116 PEPMASS=318.1553 CHARGE=1 COLLISION_ENERGY=0.0 49.7607 2500.0 50.3415 2200.0 50.619 2500.0 52.1038 2600.0 52.7783 2400.0 53.0384 35000.0 53.2283 2400.0 53.3443 3800.0 54.5538 2400.0 54.9369 2400.0 55.0176 55000.0 57.0332 86000.0 58.97 2400.0 60.9849 2200.0 61.0281 210000.0 67.8083 2500.0 69.0331 290000.0 69.4635 2500.0 71.0488 54000.0 72.065 2200.0 73.028 70000.0 78.8692 2200.0 78.9656 2200.0 81.0332 120000.0 83.0123 6300.0 85.0281 1900000.0 85.0352 10000.0 87.0437 50000.0 88.6712 2300.0 90.7238 2600.0 91.0386 95000.0 91.0536 9400.0 93.0697 21000.0 97.0213 3200.0 97.028 470000.0 98.0596 2900.0 99.0437 97000.0 102.5949 2400.0 103.0382 6100.0 103.0538 7000.0 109.028 150000.0 110.5374 2500.0 110.6428 2500.0 115.0387 18000.0 121.0645 940000.0 121.0735 15000.0 126.4669 2200.0 127.0386 320000.0 133.0632 2400.0 137.3173 2500.0 144.0651 3300.0 145.0492 150000.0 145.0631 28000.0 151.0755 6200.0 152.1154 2500.0 157.0644 9400.0 159.0802 54000.0 162.067 22000.0 163.0384 2500.0 163.0761 2500.0 169.0639 6500.0 171.0803 2600.0 173.5241 7900.0 173.5334 84000.0 173.8421 2400.0 174.0098 2700.0 175.0372 2400.0 175.0753 13000.0 177.6588 2600.0 178.0623 13000.0 179.0706 2900.0 183.0814 3400.0 184.1635 2500.0 187.0753 110000.0 189.0561 2400.0 190.0623 120000.0 191.0342 26000.0 191.0709 3300.0 193.0859 85000.0 205.086 26000.0 206.0572 38000.0 215.4327 2600.0 217.0862 2900.0 221.0568 3000.0 221.0809 270000.0 228.5034 3000.0 232.5453 2400.0 249.4901 2300.0 252.2563 2800.0 293.3369 2900.0 298.0812 2500.0 314.7082 2600.0 END IONS BEGIN IONS SCANS=117 PEPMASS=332.1347 CHARGE=1 COLLISION_ENERGY=0.0 53.0386 3700.0 53.2987 2600.0 55.0177 9900.0 56.9611 2600.0 57.0333 22000.0 58.065 3600.0 61.0282 49000.0 62.1347 2600.0 67.5939 3100.0 69.0332 68000.0 71.0489 11000.0 72.2208 2300.0 73.0282 14000.0 81.0332 27000.0 85.0226 4200.0 85.028 460000.0 85.0373 3400.0 87.0437 13000.0 87.1937 2300.0 91.0386 22000.0 96.8356 2200.0 97.028 120000.0 99.0438 30000.0 99.3575 2400.0 100.8398 2500.0 107.0487 140000.0 109.0281 35000.0 113.6302 2200.0 127.0387 89000.0 134.7345 3100.0 142.9828 2600.0 145.0493 40000.0 153.055 7900.0 173.0602 6300.0 173.5228 12000.0 173.5362 55000.0 187.5746 2500.0 191.7807 2300.0 204.8888 3000.0 204.9828 7400.0 205.9846 12000.0 207.7166 2400.0 208.8814 3200.0 214.8735 2800.0 218.8691 3500.0 222.9921 3400.0 226.8936 2700.0 257.4684 2600.0 285.853 5600.0 308.9003 23000.0 END IONS BEGIN IONS SCANS=118 PEPMASS=289.999 CHARGE=1 COLLISION_ENERGY=0.0 47.2764 2300.0 51.2268 2300.0 54.6686 4300.0 55.5013 2100.0 55.9342 16000.0 56.4266 4700.0 56.7709 2400.0 65.4772 2800.0 70.5472 2300.0 73.317 2400.0 77.6606 2400.0 79.9382 2800.0 85.1678 2600.0 85.5865 2400.0 86.7885 2500.0 107.8252 2200.0 113.9735 3100.0 117.0968 2300.0 125.5887 2400.0 137.3151 2200.0 138.609 2300.0 138.9319 2200.0 143.6419 2100.0 147.5096 2300.0 156.7626 2400.0 164.9867 3000.0 168.0778 3100.0 173.5241 26000.0 173.5412 30000.0 176.9866 3700.0 183.731 2700.0 197.5738 2600.0 204.9819 100000.0 214.5766 2400.0 221.9848 39000.0 222.9926 24000.0 230.545 2500.0 232.0084 3400.0 253.0202 2400.0 254.1427 2400.0 257.9881 2400.0 END IONS BEGIN IONS SCANS=119 PEPMASS=388.0882 CHARGE=1 COLLISION_ENERGY=0.0 53.7739 2300.0 55.0176 8400.0 59.5773 2300.0 61.9399 2200.0 67.789 2500.0 69.0332 32000.0 70.9946 2800.0 73.0281 90000.0 76.0108 2900.0 77.0385 24000.0 77.4187 2500.0 79.0543 2600.0 82.8957 2500.0 83.0124 50000.0 84.527 2500.0 85.0282 26000.0 85.1164 2500.0 85.4682 2600.0 86.0959 2400.0 92.1037 2100.0 93.9881 2300.0 95.0124 5800.0 95.0488 26000.0 95.9213 2300.0 99.466 2300.0 101.0174 2600.0 101.023 170000.0 104.7981 2600.0 105.0332 100000.0 106.8192 2800.0 106.8376 2700.0 107.0488 100000.0 111.0074 63000.0 111.0446 2400.0 113.0231 21000.0 115.5873 2300.0 117.9883 2600.0 119.0337 2500.0 121.5265 2700.0 123.0337 24000.0 123.0438 870000.0 123.0525 2500.0 123.054 9400.0 129.018 62000.0 133.0166 3000.0 133.0282 870000.0 133.0397 12000.0 133.1313 2400.0 135.044 50000.0 135.6367 2900.0 144.6921 2500.0 147.0278 3300.0 149.0612 3300.0 150.055 9100.0 151.0388 150000.0 153.0524 3600.0 155.0336 3100.0 157.0133 2800.0 161.0232 290000.0 163.0389 27000.0 165.0547 3400.0 173.0603 2700.0 173.5289 67000.0 173.5389 28000.0 175.0391 3000.0 179.0079 3600.0 179.034 1100000.0 183.2426 2500.0 184.0031 2300.0 187.0388 9200.0 189.0545 27000.0 199.0388 2800.0 203.4542 2800.0 205.0488 2800.0 208.4712 2500.0 215.0338 3200.0 222.8016 2300.0 233.0444 6600.0 244.8303 2400.0 270.7755 2600.0 279.0511 2800.0 280.3824 2300.0 367.9058 2400.0 375.797 2500.0 END IONS BEGIN IONS SCANS=120 PEPMASS=432.9889 CHARGE=1 COLLISION_ENERGY=0.0 57.6082 2300.0 63.0544 2200.0 72.2661 2600.0 73.6137 2700.0 75.7783 2100.0 77.0384 17000.0 78.2393 2400.0 80.531 2200.0 86.572 2600.0 90.9476 2200.0 94.9811 2600.0 100.3523 2300.0 105.0332 41000.0 116.9658 63000.0 120.831 2400.0 123.0438 15000.0 126.6104 2600.0 132.5314 2400.0 133.0281 320000.0 134.7337 2600.0 152.9657 24000.0 154.9818 12000.0 163.0391 17000.0 164.0425 5300.0 164.9662 2600.0 173.5289 72000.0 173.5443 5200.0 177.1738 2600.0 180.9602 8500.0 182.9767 31000.0 208.9559 16000.0 211.2744 2400.0 214.9819 92000.0 220.0873 2600.0 226.9821 24000.0 228.9978 15000.0 230.9774 2700.0 234.9685 13000.0 235.9732 31000.0 236.979 10000.0 238.9821 53000.0 240.9974 21000.0 242.9767 78000.0 244.9921 7400.0 247.6881 2400.0 248.9876 32000.0 252.9752 7300.0 253.9832 3600.0 254.9771 6300.0 256.2274 2800.0 256.9925 93000.0 258.9719 2500.0 260.9859 25000.0 266.9771 100000.0 268.9929 39000.0 272.6606 2900.0 272.9873 64000.0 275.0032 5100.0 275.9724 4000.0 276.9772 11000.0 278.9775 2900.0 282.9722 4800.0 284.988 98000.0 287.0036 37000.0 296.9874 34000.0 299.003 2900.0 300.9828 100000.0 312.9825 23000.0 314.9979 21000.0 318.2919 2500.0 318.9931 3500.0 324.8443 2500.0 328.9781 8000.0 340.1812 2600.0 END IONS BEGIN IONS SCANS=121 PEPMASS=474.1739 CHARGE=1 COLLISION_ENERGY=0.0 57.793 2200.0 58.2833 2100.0 59.353 2300.0 60.9748 2200.0 63.214 2300.0 63.2442 2200.0 64.2753 2300.0 68.1266 2400.0 73.3182 2600.0 76.0154 2100.0 77.0382 3000.0 79.8332 2500.0 79.8827 2300.0 88.3338 2300.0 89.7207 2300.0 91.965 2200.0 93.4423 2400.0 99.0919 2200.0 103.2436 2100.0 105.0331 20000.0 108.9374 2300.0 116.7961 2400.0 116.9658 42000.0 124.7476 2700.0 129.5165 2500.0 132.0439 79000.0 133.018 7600.0 133.0279 280000.0 134.0597 3400.0 136.1497 2300.0 145.086 2500.0 146.9638 2400.0 152.9657 11000.0 158.3633 2300.0 160.0496 2500.0 163.038 2600.0 164.9662 3200.0 173.5232 9900.0 173.5289 87000.0 173.5423 17000.0 174.4346 2300.0 181.9939 2400.0 182.9763 38000.0 187.0103 2800.0 189.1806 2700.0 190.9471 2600.0 193.0218 2500.0 193.2861 2500.0 194.0673 3500.0 196.2442 2600.0 199.8794 2400.0 203.9166 2200.0 208.9554 15000.0 210.5106 2600.0 214.9815 77000.0 224.5572 2800.0 226.983 2700.0 228.9985 7600.0 230.9766 2500.0 236.5009 2300.0 238.9816 44000.0 240.9972 12000.0 242.0921 23000.0 242.9764 75000.0 248.9856 22000.0 251.306 2300.0 252.9962 3100.0 254.9751 3600.0 256.9918 85000.0 259.009 2500.0 259.1182 120000.0 260.9869 21000.0 266.9761 92000.0 268.9921 48000.0 272.9869 48000.0 275.0021 2800.0 275.7156 2400.0 278.9758 2800.0 279.0004 3700.0 280.9919 3500.0 282.9725 4800.0 284.1142 89000.0 284.9873 130000.0 286.968 2700.0 287.0027 29000.0 296.987 50000.0 299.0033 18000.0 300.9823 220000.0 302.1248 110000.0 302.9976 4300.0 304.8932 2600.0 310.9661 2800.0 312.9822 27000.0 314.9984 42000.0 318.9934 19000.0 320.2482 2700.0 320.7362 2600.0 324.9829 3000.0 327.1205 170000.0 328.976 10000.0 330.065 2600.0 340.9775 8400.0 342.9934 9200.0 345.1302 3000000.0 358.9891 11000.0 386.9874 2400.0 END IONS BEGIN IONS SCANS=122 PEPMASS=371.0614 CHARGE=1 COLLISION_ENERGY=0.0 54.38 2100.0 54.557 2400.0 55.0177 17000.0 55.0543 2300.0 56.0647 2300.0 56.8438 2200.0 57.0334 2700.0 57.0696 3000.0 58.4002 2500.0 59.2818 2100.0 61.0282 2700.0 65.6817 2500.0 68.3454 2300.0 68.9967 2100.0 69.0332 57000.0 71.0121 4500.0 71.0851 3500.0 73.0281 39000.0 75.3824 2300.0 77.4692 2400.0 81.845 2200.0 83.0124 46000.0 85.0281 24000.0 85.2584 2300.0 89.1625 2400.0 92.287 2200.0 92.4858 2300.0 92.6813 2500.0 95.0125 18000.0 95.0489 18000.0 101.023 60000.0 101.0594 37000.0 105.0331 7100.0 107.0487 40000.0 111.0074 39000.0 111.0437 38000.0 113.023 29000.0 118.9356 2400.0 122.102 2400.0 122.3186 2300.0 123.0336 4300.0 123.0437 360000.0 124.1198 2300.0 129.0179 24000.0 129.0543 18000.0 133.0281 150000.0 135.0438 64000.0 137.6404 2400.0 138.6 2400.0 143.0486 3000.0 147.0437 18000.0 149.0231 19000.0 149.0599 5900.0 149.2999 2300.0 150.0311 26000.0 151.0387 130000.0 153.0543 13000.0 159.0436 2500.0 159.3945 2600.0 161.0231 300000.0 161.0596 33000.0 162.0298 3100.0 162.4431 2400.0 163.0388 33000.0 173.0599 16000.0 173.5226 22000.0 173.5356 74000.0 173.5426 8100.0 175.0385 15000.0 177.0184 24000.0 177.0548 19000.0 179.0078 4100.0 179.0339 1000000.0 183.7551 2600.0 187.0389 26000.0 189.0184 3400.0 189.0548 57000.0 191.0345 3800.0 193.0489 7400.0 194.2065 2200.0 197.0441 2600.0 199.0392 11000.0 205.0499 14000.0 205.9101 2200.0 207.0286 4000.0 215.0341 22000.0 217.0493 13000.0 219.0291 4000.0 221.0449 18000.0 233.0443 30000.0 245.0446 21000.0 261.0394 11000.0 273.9449 2500.0 279.0497 3100.0 297.111 2600.0 318.5153 2500.0 325.3133 2900.0 333.7463 2300.0 347.7396 2400.0 371.1681 3500.0 END IONS BEGIN IONS SCANS=123 PEPMASS=300.16 CHARGE=1 COLLISION_ENERGY=0.0 47.2133 22000.0 47.5508 22000.0 47.808 23000.0 50.0161 22000.0 50.7396 24000.0 55.0179 24000.0 56.0494 420000.0 56.375 24000.0 57.0572 150000.0 58.0582 210000.0 58.0652 130000000.0 58.0704 340000.0 58.0718 270000.0 58.0739 110000.0 58.074 990000.0 58.0757 60000.0 71.0027 24000.0 71.0728 860000.0 72.0807 1000000.0 74.9082 14000.0 79.0543 40000.0 86.0602 19000.0 86.1535 12000.0 91.0541 340000.0 93.0697 180000.0 95.0491 280000.0 103.0542 90000.0 104.5431 23000.0 105.0449 18000.0 105.0697 43000.0 107.0319 33000.0 107.0491 33000000.0 107.0661 180000.0 108.3089 13000.0 115.0542 530000.0 116.8881 14000.0 117.0698 370000.0 119.0489 1100000.0 119.0857 81000.0 121.0647 5200000.0 121.0733 26000.0 123.0337 48000.0 123.0439 3900000.0 124.6929 14000.0 131.0492 220000.0 133.0646 490000.0 135.044 630000.0 135.0806 68000.0 137.0596 2600000.0 138.2385 12000.0 143.0362 20000.0 143.0491 3000000.0 145.0515 21000.0 145.0647 4200000.0 145.0746 23000.0 145.0769 45000.0 146.073 16000.0 146.2313 25000.0 147.0445 14000.0 147.0803 1900000.0 148.0518 160000.0 149.0596 1000000.0 150.3153 13000.0 151.0753 120000.0 155.0598 57000.0 157.0645 41000.0 161.0439 58000.0 161.0596 11000000.0 161.0755 130000.0 162.0674 16000.0 163.0753 1800000.0 163.091 20000.0 173.0598 13000.0 173.5224 210000.0 173.5385 340000.0 175.0755 56000.0 178.0862 360000.0 179.094 710000.0 179.7273 13000.0 180.102 700000.0 181.0641 68000.0 181.1019 130000.0 183.0797 47000.0 186.7968 12000.0 191.0857 150000.0 191.5103 26000.0 192.1015 51000.0 193.1094 600000.0 194.0726 60000.0 201.3298 14000.0 206.1175 68000.0 209.0962 1100000.0 210.0666 17000.0 211.0762 63000.0 211.112 870000.0 219.0809 240000.0 221.0957 140000.0 222.0675 13000.0 226.062 320000.0 227.0449 13000.0 227.0704 130000.0 227.1074 41000.0 227.5192 15000.0 228.078 190000.0 229.1238 40000.0 237.091 2100000.0 239.1067 850000.0 240.0779 220000.0 255.0698 100000.0 255.1015 9000000.0 255.1323 29000.0 257.117 3000000.0 257.1481 24000.0 274.5282 23000.0 282.1491 120000.0 285.1392 50000.0 300.1595 22000000.0 300.1898 92000.0 END IONS BEGIN IONS SCANS=124 PEPMASS=301.1628 CHARGE=1 COLLISION_ENERGY=0.0 55.0178 8100.0 56.0494 48000.0 57.0574 8000.0 58.0333 5400.0 58.0651 17000000.0 58.0696 160000.0 58.0703 69000.0 58.0718 54000.0 58.0737 22000.0 59.0592 9900.0 59.0621 120000.0 59.0681 3700000.0 59.0714 49000.0 67.6929 3800.0 71.0728 120000.0 72.0765 10000.0 72.0801 150000.0 73.084 41000.0 83.0342 5600.0 91.0541 37000.0 92.0574 20000.0 93.0698 5500.0 93.7173 3800.0 94.3194 3600.0 95.049 31000.0 104.2979 3300.0 107.049 3300000.0 108.0524 2000000.0 108.3199 6800.0 115.0543 46000.0 116.0576 32000.0 117.0698 32000.0 118.0553 5200.0 118.0731 33000.0 119.049 97000.0 120.0524 75000.0 120.0874 6500.0 121.0552 13000.0 121.0646 500000.0 122.068 380000.0 123.0338 5800.0 123.0439 410000.0 124.0473 250000.0 125.813 4700.0 126.4077 4100.0 132.0526 16000.0 133.0647 39000.0 134.068 39000.0 135.0439 47000.0 135.0804 6400.0 136.0474 33000.0 137.0596 270000.0 138.063 180000.0 141.2455 5900.0 143.049 220000.0 144.0524 270000.0 145.0646 310000.0 146.0546 5500.0 146.0681 390000.0 147.0801 140000.0 148.0514 7500.0 148.0837 180000.0 149.0593 94000.0 149.4054 6400.0 150.0628 76000.0 151.0744 6000.0 158.066 6500.0 160.4071 6200.0 161.044 10000.0 161.0596 820000.0 161.0751 7500.0 161.8606 5800.0 162.0469 6700.0 162.0631 1000000.0 162.0789 15000.0 163.0751 140000.0 164.0788 170000.0 165.4117 3800.0 173.5211 12000.0 173.5323 69000.0 173.5397 29000.0 176.0786 9200.0 176.1063 7000.0 178.0869 19000.0 179.0926 66000.0 180.0996 89000.0 181.1052 68000.0 191.0863 6800.0 192.0884 11000.0 193.1092 46000.0 194.113 62000.0 195.0772 11000.0 207.0844 6000.0 209.0963 38000.0 210.0997 140000.0 211.0714 9200.0 211.1116 14000.0 212.079 14000.0 212.1154 120000.0 220.0839 41000.0 221.0926 6800.0 222.1001 9000.0 226.0625 6300.0 227.0668 44000.0 228.075 27000.0 229.0814 32000.0 237.091 46000.0 238.0944 300000.0 239.107 7700.0 240.0839 7700.0 240.1101 110000.0 241.0812 36000.0 243.0995 7500.0 255.1014 180000.0 256.0738 23000.0 256.1048 1300000.0 256.1273 4700.0 256.137 26000.0 257.1173 65000.0 258.1205 430000.0 270.1214 9400.0 270.7256 4600.0 280.1153 4200.0 282.5012 6600.0 283.1553 13000.0 301.1628 3400000.0 END IONS BEGIN IONS SCANS=125 PEPMASS=298.1446 CHARGE=1 COLLISION_ENERGY=0.0 48.2608 2700.0 48.282 2200.0 50.0408 2500.0 52.0995 2400.0 55.239 3200.0 56.508 2200.0 56.9469 2400.0 58.0652 2700000.0 58.0683 13000.0 58.07 12000.0 58.9005 2100.0 58.9388 2300.0 61.0104 8100.0 61.3529 2600.0 62.8808 2100.0 63.757 2600.0 65.9844 2700.0 67.2448 2600.0 71.1364 2400.0 72.0442 29000.0 72.0808 2500.0 72.4379 2600.0 72.6113 3000.0 72.9583 2100.0 73.1977 2300.0 75.026 5400.0 76.2543 2600.0 77.6819 2500.0 83.4556 2400.0 83.9648 2400.0 90.097 2200.0 90.6216 2000.0 97.4576 2900.0 99.8238 2400.0 103.0213 2400.0 107.0488 160000.0 108.911 2300.0 110.8113 2200.0 111.3669 2300.0 117.3148 2500.0 120.0801 2100.0 121.0639 2900.0 122.0956 3300.0 128.4593 2800.0 131.0484 2800.0 136.0615 180000.0 136.0714 2300.0 136.0741 3800.0 146.0955 3100.0 148.0757 26000.0 149.0594 24000.0 149.3642 2500.0 150.0912 3300.0 151.1598 2300.0 152.8129 2200.0 153.9549 2200.0 162.0917 9800.0 163.099 34000.0 164.1067 36000.0 166.0496 4500.0 170.6225 2300.0 172.2174 2600.0 173.5312 53000.0 173.5391 21000.0 174.6423 2200.0 176.0715 2800.0 177.0783 140000.0 178.0859 2500.0 181.0647 6500.0 190.8975 2600.0 191.094 74000.0 192.1017 73000.0 194.2608 2500.0 197.0954 7100.0 202.8964 6900.0 203.0052 2600.0 207.0795 6200.0 208.9053 2900.0 218.8892 17000.0 225.0906 7800.0 233.629 2600.0 238.2515 2200.0 246.8847 13000.0 270.1492 44000.0 271.713 2500.0 280.5306 3300.0 282.3848 2400.0 283.1207 25000.0 298.1438 44000.0 300.5406 2800.0 END IONS BEGIN IONS SCANS=126 PEPMASS=330.1705 CHARGE=1 COLLISION_ENERGY=0.0 49.8453 2100.0 49.9345 2300.0 52.2671 2600.0 53.4833 2300.0 54.3826 2400.0 54.4477 2100.0 56.7281 2500.0 58.0612 2400.0 58.0651 1500000.0 58.0683 9400.0 58.0699 7000.0 58.1775 2200.0 62.002 2300.0 62.6134 2400.0 65.5732 2300.0 65.7285 2300.0 77.1816 2400.0 77.5294 2200.0 78.1929 3100.0 79.5152 2100.0 80.1913 2600.0 81.086 2700.0 84.1419 2500.0 91.0541 2700.0 91.4948 2600.0 105.1628 2600.0 106.5564 2600.0 107.0489 35000.0 115.0539 3900.0 121.0646 2700.0 123.0437 180000.0 137.0594 100000.0 138.3257 2600.0 143.0488 77000.0 145.0645 2700.0 151.075 20000.0 157.3334 2600.0 161.0593 25000.0 163.0754 26000.0 164.0542 2900.0 173.5293 62000.0 173.5418 6300.0 175.0753 120000.0 177.0908 9500.0 191.0702 7300.0 192.1015 9100.0 193.1096 17000.0 194.1164 3300.0 205.1095 33000.0 206.1169 2700.0 207.0809 6100.0 209.0958 2500.0 218.9568 2400.0 221.1965 2300.0 225.091 17000.0 233.0886 2800.0 233.2538 2600.0 235.0753 24000.0 253.0853 41000.0 255.1023 3500.0 257.1177 3300.0 267.1018 18000.0 269.1161 2700.0 285.1124 130000.0 285.1443 3600.0 287.1286 20000.0 298.1454 3300.0 320.0464 2500.0 330.1703 210000.0 END IONS BEGIN IONS SCANS=127 PEPMASS=298.0978 CHARGE=1 COLLISION_ENERGY=0.0 54.3891 2100.0 56.2246 2500.0 58.0649 150000.0 60.1044 2300.0 60.2785 2200.0 61.0104 80000.0 69.0332 2500.0 75.026 32000.0 76.2648 2400.0 81.2564 2300.0 88.7948 2400.0 89.1903 2200.0 95.9871 2200.0 97.0282 24000.0 100.0146 2500.0 100.6127 2200.0 107.0488 7200.0 117.1221 2400.0 118.4566 2200.0 125.7218 2400.0 128.5045 2400.0 131.6581 2300.0 136.0615 1300000.0 136.0713 21000.0 145.0318 8400.0 149.059 3300.0 167.6104 2300.0 171.9438 2500.0 173.5337 36000.0 177.0785 5500.0 190.8973 5300.0 203.905 2500.0 218.8896 8200.0 224.9014 6600.0 246.8855 9300.0 280.7253 2200.0 END IONS BEGIN IONS SCANS=128 PEPMASS=374.1087 CHARGE=1 COLLISION_ENERGY=0.0 52.9719 2400.0 55.6992 2100.0 55.8772 2300.0 57.0491 2100.0 58.1135 2400.0 58.2171 2400.0 58.8506 2200.0 61.0735 2300.0 61.151 2500.0 65.0385 7700.0 65.7879 2800.0 67.2398 2500.0 67.2748 2300.0 68.0884 2300.0 74.9998 2400.0 87.0438 2800.0 89.8725 2400.0 91.0539 110000.0 106.5331 2100.0 108.5842 2300.0 109.5944 2100.0 115.2151 2600.0 119.0396 10000.0 119.0488 380000.0 121.128 2300.0 128.0582 2900.0 140.6 2700.0 147.0437 4200000.0 147.0548 56000.0 147.0709 25000.0 150.4952 2200.0 167.6767 2700.0 173.529 57000.0 173.5408 14000.0 189.4784 2400.0 200.7619 2400.0 227.0948 7800.0 229.6645 2200.0 241.2841 2200.0 251.7835 2800.0 292.2429 2700.0 347.8947 2400.0 357.5909 2600.0 END IONS BEGIN IONS SCANS=129 PEPMASS=446.218 CHARGE=1 COLLISION_ENERGY=0.0 56.4549 2300.0 58.0648 330000.0 58.0683 5200.0 67.5211 2800.0 72.3408 2600.0 75.0436 11000.0 87.2454 2400.0 91.8197 2300.0 92.4206 2300.0 107.0487 25000.0 116.6708 2500.0 121.064 6700.0 123.0441 3700.0 123.2575 2600.0 125.5892 2300.0 142.5015 2400.0 161.0597 6100.0 165.8627 2700.0 173.5254 6600.0 173.5351 40000.0 193.0182 2500.0 206.6638 3600.0 251.4383 2400.0 255.1014 71000.0 257.1173 22000.0 286.9715 2800.0 300.1596 490000.0 314.1737 8900.0 323.213 2900.0 388.9652 2600.0 411.0041 2700.0 428.5437 2500.0 446.2179 130000.0 END IONS BEGIN IONS SCANS=130 PEPMASS=272.1285 CHARGE=1 COLLISION_ENERGY=0.0 52.5676 2400.0 53.0387 2200.0 53.5439 2200.0 54.4205 2200.0 54.9866 2400.0 55.0178 12000.0 61.3444 2300.0 62.8792 2600.0 64.3096 2300.0 64.8024 2200.0 65.412 2500.0 76.4942 2500.0 79.054 14000.0 91.0541 37000.0 94.6357 2700.0 95.049 26000.0 96.5633 2100.0 98.1319 2400.0 103.0542 3100.0 105.0332 3200.0 105.045 2900.0 105.07 10000.0 107.0318 8400.0 107.049 4700000.0 107.0557 31000.0 107.0622 14000.0 107.066 53000.0 107.0703 4100.0 115.0541 140000.0 117.0697 35000.0 119.0492 15000.0 121.0646 75000.0 123.0337 8000.0 123.0439 400000.0 126.4756 3000.0 131.0491 35000.0 131.8128 2700.0 133.0646 66000.0 135.0444 3300.0 136.0755 16000.0 137.0597 49000.0 143.0362 4900.0 143.049 490000.0 143.0587 2500.0 144.0565 2600.0 145.0515 8400.0 145.0647 400000.0 145.0748 2700.0 146.0727 11000.0 146.5916 2200.0 147.0436 3000.0 149.0596 81000.0 155.0605 13000.0 161.0596 1100000.0 161.0726 14000.0 162.0679 8500.0 164.0707 54000.0 173.5254 13000.0 173.534 26000.0 173.5427 4900.0 181.0645 19000.0 181.1011 20000.0 191.0854 44000.0 194.0728 38000.0 195.081 10000.0 195.8375 2800.0 203.7991 2500.0 203.8833 49000.0 205.8991 7300.0 209.0962 170000.0 216.8916 6800.0 219.0804 45000.0 221.8947 6800.0 222.0674 8000.0 225.0895 3000.0 226.0628 43000.0 227.0697 14000.0 227.1057 4300.0 229.3236 2800.0 237.0493 3600.0 237.091 260000.0 240.0779 43000.0 255.1015 370000.0 255.1327 4300.0 272.0967 7000.0 272.128 40000.0 END IONS BEGIN IONS SCANS=131 PEPMASS=318.1553 CHARGE=1 COLLISION_ENERGY=0.0 53.0385 15000.0 53.2748 2300.0 55.0176 26000.0 57.0332 40000.0 61.0281 91000.0 69.0332 120000.0 71.0488 18000.0 71.0808 2400.0 73.0281 34000.0 76.6648 2400.0 80.0175 2100.0 81.0331 49000.0 85.0281 850000.0 85.0338 4900.0 87.0438 27000.0 91.0386 40000.0 91.0541 13000.0 93.0695 14000.0 95.0492 2700.0 96.0974 2600.0 97.0281 200000.0 99.0437 37000.0 99.1149 2500.0 103.0387 6800.0 103.0541 10000.0 109.028 76000.0 113.3654 2400.0 115.0387 3300.0 121.0645 500000.0 121.0736 5500.0 127.0386 140000.0 131.0853 7400.0 142.9237 2400.0 145.0493 60000.0 145.0642 19000.0 147.0428 3000.0 151.0751 8000.0 155.0857 2400.0 157.0647 14000.0 159.0801 45000.0 162.0671 9300.0 163.0378 3300.0 163.075 4500.0 169.0652 7000.0 169.237 2600.0 171.0806 5300.0 173.5213 11000.0 173.5391 32000.0 175.0752 20000.0 178.0625 5800.0 179.0703 2900.0 183.0805 2900.0 185.0598 4000.0 187.0753 92000.0 190.0622 44000.0 191.0338 11000.0 191.0701 2700.0 193.0855 37000.0 201.0922 6200.0 205.086 18000.0 206.0568 17000.0 210.7606 2800.0 217.087 10000.0 221.0808 120000.0 229.0856 5600.0 296.0244 2700.0 END IONS BEGIN IONS SCANS=132 PEPMASS=205.0975 CHARGE=1 COLLISION_ENERGY=0.0 42.8472 2400.0 43.0179 11000.0 44.3326 2100.0 46.243 2100.0 46.7507 2200.0 51.0235 2600.0 51.1528 2400.0 51.4106 2800.0 53.0022 2300.0 53.28 2200.0 54.2785 2400.0 54.3391 2400.0 55.0031 2200.0 55.0177 8900.0 55.1412 2700.0 55.9343 180000.0 58.5695 2400.0 60.7027 2300.0 60.7537 2300.0 61.012 2000.0 62.0974 2500.0 64.8414 2600.0 65.0388 3700.0 69.2637 2300.0 70.0849 2500.0 70.4781 2400.0 71.6282 2400.0 72.8557 2700.0 72.9369 18000.0 73.9448 2600.0 74.0235 440000.0 74.9526 2900.0 75.5549 2200.0 89.0393 9700.0 90.9476 51000.0 91.0541 230000.0 95.0477 2500.0 103.0543 25000.0 105.0701 19000.0 105.9347 3900.0 105.9886 2200.0 107.9502 4100.0 109.0775 2400.0 113.9639 9200.0 114.971 23000.0 115.0452 4700.0 115.0541 460000.0 116.0493 13000.0 116.0624 6200.0 116.7927 2500.0 116.9659 19000.0 117.0573 240000.0 117.0697 670000.0 117.9658 3100.0 118.0456 17000.0 118.0486 22000.0 118.065 11000000.0 118.0735 65000.0 118.0817 120000.0 118.0843 23000.0 118.0922 13000.0 118.9424 23000.0 119.1152 2400.0 127.0538 13000.0 128.0495 17000.0 128.0616 12000.0 128.9506 66000.0 130.065 770000.0 130.0755 6300.0 131.0729 30000.0 132.0439 15000.0 132.0806 2500000.0 132.0902 17000.0 135.945 26000.0 142.0539 8000.0 142.065 1100000.0 142.0759 2300.0 143.06 9800.0 143.0728 1400000.0 143.0837 3800.0 143.0853 18000.0 143.2509 2900.0 144.0446 170000.0 144.0806 5100000.0 144.0917 31000.0 144.1069 11000.0 145.0526 3500.0 145.0647 140000.0 146.01 3900.0 146.0247 11000.0 146.0329 92000.0 146.0404 48000.0 146.0598 19000000.0 146.0705 190000.0 146.0847 220000.0 146.0869 36000.0 146.0948 14000.0 146.0988 38000.0 146.9614 2900.0 147.5636 2900.0 155.0602 130000.0 158.9771 5900.0 159.0765 9300.0 159.0916 1700000.0 159.1038 4600.0 159.1056 9100.0 160.0611 4700.0 160.0756 410000.0 160.0906 5000.0 170.0433 9700.0 170.06 1900000.0 170.073 20000.0 173.5232 4600.0 173.5311 47000.0 173.5415 18000.0 188.051 7000.0 188.0706 1700000.0 188.0903 3400.0 194.9444 9700.0 205.7604 2900.0 END IONS BEGIN IONS SCANS=133 PEPMASS=286.1444 CHARGE=1 COLLISION_ENERGY=0.0 48.9276 2400.0 53.3122 2300.0 57.4892 2300.0 58.0649 6500.0 61.7438 2700.0 62.1258 2600.0 84.1629 2200.0 91.0539 11000.0 97.5042 2700.0 104.9792 2900.0 105.0698 5500.0 107.0489 820000.0 107.0566 4800.0 107.0762 3000.0 114.8333 2200.0 115.0541 17000.0 117.0688 2600.0 119.049 26000.0 121.0646 58000.0 121.6981 2400.0 123.0438 110000.0 131.0495 8000.0 133.0646 27000.0 135.0439 11000.0 137.0596 19000.0 143.049 87000.0 145.0646 83000.0 147.0808 2700.0 148.0682 2600.0 149.0595 32000.0 161.0444 2300.0 161.0597 240000.0 163.0752 6200.0 166.0865 6300.0 173.5295 11000.0 173.5393 18000.0 175.0767 2300.0 178.0867 21000.0 181.1023 3400.0 184.8441 2600.0 197.0964 25000.0 201.0541 7900.0 203.8842 3100.0 209.0967 28000.0 216.8914 3100.0 219.0819 3600.0 225.0916 10000.0 226.0638 3100.0 227.0711 3500.0 237.0916 49000.0 239.0728 3300.0 243.1019 30000.0 255.102 150000.0 257.1178 4000.0 280.643 2800.0 286.1447 110000.0 END IONS BEGIN IONS SCANS=134 PEPMASS=330.1706 CHARGE=1 COLLISION_ENERGY=0.0 51.1767 2500.0 56.0494 74000.0 57.0782 8100.0 58.0353 3100.0 58.054 15000.0 58.0652 27000000.0 58.0705 90000.0 58.0719 89000.0 58.0741 38000.0 58.0741 190000.0 58.0757 25000.0 66.8059 2500.0 70.065 9300.0 71.0728 46000.0 71.3091 5700.0 72.0808 46000.0 72.9875 2900.0 76.817 5400.0 84.3129 8100.0 84.4385 5900.0 85.3945 5500.0 86.0598 15000.0 87.0286 2600.0 87.2591 5800.0 88.3992 5900.0 88.4773 2400.0 91.0542 80000.0 93.5271 3100.0 95.0488 25000.0 100.3957 5900.0 101.7052 2400.0 107.0491 36000.0 109.0646 30000.0 111.0439 23000.0 115.0542 190000.0 115.9383 3000.0 116.9204 2600.0 117.07 69000.0 119.0491 89000.0 121.0647 20000.0 121.5705 3400.0 123.044 6000000.0 123.0547 3500.0 123.4464 6400.0 125.0599 34000.0 125.476 2200.0 131.0492 130000.0 133.0648 38000.0 133.5042 2900.0 135.044 180000.0 137.0424 8600.0 137.0596 2400000.0 143.049 2500000.0 143.0588 13000.0 144.0569 9100.0 144.403 3100.0 145.0646 250000.0 147.0438 30000.0 147.0805 51000.0 149.0596 240000.0 149.0959 4700.0 150.0676 32000.0 151.0752 890000.0 153.0911 3900.0 157.0658 12000.0 160.0518 160000.0 160.0757 9400.0 161.0596 740000.0 161.0828 37000.0 162.0678 50000.0 162.0909 15000.0 162.8171 2900.0 163.0754 630000.0 165.0912 69000.0 173.5257 33000.0 173.5374 88000.0 174.0917 48000.0 175.0396 5000.0 175.0576 4300.0 175.0754 4400000.0 175.101 46000.0 175.103 19000.0 176.0831 180000.0 176.1071 170000.0 177.0911 230000.0 178.0849 3400.0 179.0857 57000.0 181.0648 12000.0 181.1022 28000.0 183.0816 3600.0 188.1061 4000.0 192.0817 6700.0 192.1019 650000.0 193.1097 620000.0 194.1176 310000.0 195.0796 3400.0 197.0941 3100.0 199.0745 8800.0 201.2339 2800.0 205.1094 3900.0 206.1178 75000.0 207.0807 300000.0 207.1257 110000.0 208.1333 6800.0 209.0598 30000.0 209.0962 150000.0 211.0745 7900.0 213.0547 3600.0 213.0913 13000.0 219.0809 6900.0 225.0911 550000.0 226.062 17000.0 227.0702 89000.0 227.1069 320000.0 235.0753 270000.0 237.0911 210000.0 237.7826 2700.0 239.1069 65000.0 240.0789 3300.0 241.0858 19000.0 241.1225 120000.0 251.1062 26000.0 252.0726 7800.0 253.0561 17000.0 253.0857 930000.0 254.0937 43000.0 255.1015 400000.0 256.0734 32000.0 257.084 4200.0 257.1156 28000.0 258.0887 60000.0 259.1311 11000.0 267.1019 67000.0 269.117 150000.0 270.0884 180000.0 270.1489 26000.0 272.1047 11000.0 285.0741 6300.0 285.0849 15000.0 285.1122 2600000.0 287.128 840000.0 287.1646 17000.0 291.0028 6500.0 298.1439 310000.0 299.1501 13000.0 315.1471 97000.0 330.17 5100000.0 END IONS BEGIN IONS SCANS=135 PEPMASS=328.1552 CHARGE=1 COLLISION_ENERGY=0.0 50.502 2900.0 56.4347 2300.0 57.03 2300.0 57.7432 2300.0 58.065 1500000.0 58.0682 21000.0 58.07 15000.0 58.0716 10000.0 62.1567 2700.0 62.87 2500.0 64.183 2100.0 64.4472 2300.0 67.7519 2200.0 74.6924 2300.0 92.9117 2500.0 93.0994 2700.0 99.2369 2400.0 103.1457 2200.0 121.8644 2900.0 122.144 2400.0 124.1363 2300.0 127.6635 2400.0 130.3235 2100.0 131.0491 3900.0 145.3741 2300.0 146.0963 20000.0 155.4042 2300.0 161.0597 3000.0 163.0752 60000.0 173.5242 8500.0 173.538 32000.0 174.0914 54000.0 175.0993 25000.0 184.6503 2800.0 190.0866 3700.0 191.0941 27000.0 192.1023 8600.0 204.1016 6400.0 206.1176 120000.0 223.0757 6400.0 225.0924 4500.0 233.0602 4500.0 249.4511 2400.0 251.0705 64000.0 255.1008 3800.0 274.8135 2400.0 276.2813 2400.0 283.0969 40000.0 300.1604 4900.0 328.1551 8000.0 END IONS BEGIN IONS SCANS=136 PEPMASS=247.0604 CHARGE=1 COLLISION_ENERGY=0.0 45.0329 2500.0 47.3639 2300.0 54.106 2300.0 55.0177 8400.0 61.8512 2600.0 64.2838 2500.0 65.0384 5400.0 65.9296 2200.0 67.0176 12000.0 69.0334 5400.0 71.0127 6000.0 76.7266 2500.0 88.2459 2500.0 92.9818 3000.0 93.1829 2500.0 95.8409 2400.0 104.0116 2600.0 111.0439 6000.0 117.0182 2300.0 117.4246 2900.0 121.0181 12000.0 121.0282 450000.0 121.0386 23000.0 129.0182 3200.0 140.4652 2200.0 152.9971 3400.0 153.0181 800000.0 171.0289 3400.0 173.528 23000.0 173.5407 4300.0 209.7004 2900.0 216.9195 2200.0 219.6589 2700.0 225.0783 2400.0 END IONS BEGIN IONS SCANS=137 PEPMASS=350.0696 CHARGE=1 COLLISION_ENERGY=0.0 52.2576 2200.0 54.1941 2300.0 56.8027 2400.0 57.8327 2500.0 59.6511 2300.0 61.5609 2600.0 67.0584 2300.0 70.0645 2300.0 70.8683 2300.0 71.6915 2400.0 74.0421 2700.0 74.5263 2400.0 74.7578 2100.0 77.2691 2400.0 78.5898 2500.0 81.9539 2400.0 87.7533 2300.0 97.8177 2300.0 98.5643 2700.0 99.7236 2500.0 103.0541 2500.0 104.0436 2500.0 105.0697 2900.0 105.7177 2300.0 107.0488 1400000.0 107.0572 28000.0 119.0489 24000.0 120.0801 2500.0 120.2718 2900.0 121.0294 2500.0 121.064 12000.0 122.0598 53000.0 126.8781 2500.0 127.4651 2400.0 130.0651 32000.0 131.0491 16000.0 132.0442 2800.0 134.0597 51000.0 135.0337 3600.0 135.0437 29000.0 135.0678 42000.0 136.0757 39000.0 143.727 2400.0 146.0598 120000.0 147.044 15000.0 148.0757 30000.0 157.0647 5800.0 158.0598 35000.0 162.0549 31000.0 163.0497 2400.0 163.0627 110000.0 164.0548 8700.0 164.0705 1900000.0 164.0935 3200.0 167.0857 7600.0 168.2476 3000.0 173.5222 3400.0 173.5357 73000.0 173.5406 7400.0 176.0703 2700.0 179.0853 32000.0 181.0649 6000.0 182.0727 2400.0 185.0959 5400.0 187.006 150000.0 187.3931 2300.0 188.0323 6700.0 188.4687 2400.0 193.934 2400.0 194.0738 2400.0 195.0809 26000.0 197.0964 74000.0 199.0763 2700.0 199.1118 2600.0 200.1077 11000.0 207.0807 41000.0 209.0963 3800.0 213.0915 62000.0 214.1227 3000.0 221.5927 2600.0 223.0771 2500.0 224.1075 35000.0 225.0913 47000.0 234.0911 3000.0 235.0759 5900.0 235.1213 2900.0 241.0863 8400.0 242.118 91000.0 244.0033 2800.0 244.0285 21000.0 252.1023 82000.0 253.0872 6900.0 267.3625 2600.0 270.1131 80000.0 275.9124 2600.0 END IONS BEGIN IONS SCANS=138 PEPMASS=298.1444 CHARGE=1 COLLISION_ENERGY=0.0 50.8187 2300.0 52.8336 2200.0 53.6397 3100.0 57.455 2100.0 58.0648 67000.0 60.1614 3200.0 65.5489 2500.0 89.4847 2600.0 91.0927 3000.0 93.0697 4100.0 107.0488 130000.0 110.7834 2400.0 121.0645 130000.0 121.3872 2200.0 123.4372 2400.0 130.5219 2200.0 145.0888 3100.0 146.036 8300.0 146.0961 17000.0 148.0518 2900.0 149.0611 2900.0 153.739 2800.0 160.0753 3300.0 161.06 13000.0 173.0834 14000.0 173.5253 31000.0 173.5403 37000.0 174.0762 2100.0 174.0914 81000.0 176.0707 140000.0 176.6713 2100.0 177.0785 100000.0 178.0863 58000.0 184.2398 2700.0 189.0785 11000.0 190.0864 56000.0 191.0533 7800.0 191.0739 6600.0 191.0941 2700000.0 192.102 190000.0 202.0881 2500.0 204.1022 11000.0 206.891 3100.0 207.0802 12000.0 217.5037 2600.0 218.8901 9700.0 224.9026 3000.0 235.0761 10000.0 246.8856 6900.0 253.0842 4400.0 262.025 2600.0 263.0873 2500.0 270.0934 3700.0 296.1287 4700.0 296.662 2700.0 298.1439 27000.0 301.3236 2900.0 END IONS BEGIN IONS SCANS=139 PEPMASS=460.2335 CHARGE=1 COLLISION_ENERGY=0.0 58.065 600000.0 58.0683 5900.0 58.2563 2400.0 58.3131 2600.0 59.1586 2300.0 62.6259 2500.0 75.0439 22000.0 82.3494 2400.0 83.3245 2300.0 91.054 3200.0 92.7165 2300.0 93.6953 2300.0 107.0488 61000.0 109.0702 2400.0 119.0488 18000.0 121.0644 23000.0 127.4205 2200.0 134.7741 2500.0 137.0595 17000.0 139.5308 2500.0 143.049 7500.0 145.0643 6800.0 147.0437 330000.0 148.0478 7100.0 173.5284 59000.0 173.5449 5200.0 175.0754 25000.0 175.6354 2500.0 177.0919 3100.0 191.1406 2400.0 237.0915 19000.0 239.1071 14000.0 244.993 6700.0 247.1284 2500.0 265.0092 2500.0 268.9923 7000.0 269.1171 240000.0 269.1496 4900.0 271.1328 51000.0 286.4923 2600.0 287.0031 24000.0 290.4689 2300.0 295.0073 2900.0 314.1751 980000.0 320.9091 2400.0 327.0429 3000.0 344.4362 2400.0 346.2252 2700.0 388.8398 2500.0 415.1795 3100.0 460.2329 250000.0 END IONS BEGIN IONS SCANS=140 PEPMASS=247.0604 CHARGE=1 COLLISION_ENERGY=0.0 49.9011 2100.0 49.9553 2000.0 50.2612 2200.0 52.1954 2600.0 52.9391 2400.0 55.0177 11000.0 58.4649 2300.0 58.8902 2400.0 63.9749 2700.0 65.0357 2300.0 65.0383 74000.0 67.0175 88000.0 68.9969 44000.0 69.0332 43000.0 71.9196 2500.0 72.55 3000.0 73.0282 8100.0 81.0335 2800.0 83.0126 12000.0 93.0333 13000.0 97.0281 35000.0 97.0633 2600.0 111.0072 6700.0 111.0438 100000.0 121.0077 24000.0 121.0282 4500000.0 121.0389 250000.0 121.045 9500.0 121.049 39000.0 122.5356 2700.0 125.0239 4400.0 135.1947 2800.0 149.9378 2400.0 152.9889 50000.0 153.0181 8100000.0 153.0406 12000.0 153.0458 82000.0 153.0559 16000.0 171.029 52000.0 173.0596 2600.0 173.5275 38000.0 173.5421 13000.0 205.0501 7700.0 212.6734 2600.0 218.5984 3200.0 229.05 24000.0 240.3851 2500.0 247.0337 3300.0 247.0607 68000.0 END IONS BEGIN IONS SCANS=141 PEPMASS=409.1136 CHARGE=1 COLLISION_ENERGY=0.0 58.6885 2100.0 60.103 2600.0 61.0285 2100.0 64.4554 2700.0 66.5476 2100.0 69.0336 7100.0 85.0283 41000.0 97.0282 14000.0 99.2551 2100.0 121.0283 160000.0 127.0383 6100.0 147.044 14000.0 150.8861 2400.0 153.0181 240000.0 165.018 14000.0 168.2879 2100.0 171.0288 5700.0 173.5301 23000.0 177.0181 9300.0 177.0545 7500.0 183.0291 8100.0 191.034 7900.0 195.0287 52000.0 201.7989 2600.0 218.9709 2700.0 219.0289 26000.0 231.0289 32000.0 233.0246 3800.0 247.0599 240000.0 249.0384 3000.0 259.0594 4300.0 261.0395 9700.0 271.0605 7200.0 303.8534 2500.0 313.0708 8600.0 325.0741 3700.0 329.8231 2900.0 END IONS BEGIN IONS SCANS=142 PEPMASS=409.9937 CHARGE=1 COLLISION_ENERGY=0.0 54.2007 2300.0 54.9968 2300.0 55.313 2200.0 55.6421 2100.0 55.9342 17000.0 61.1968 2400.0 66.9844 2300.0 68.7011 2200.0 70.4178 2100.0 83.8696 2100.0 85.7303 2600.0 87.3365 2200.0 91.0543 5200.0 102.585 2700.0 112.7082 2700.0 119.0489 23000.0 121.0283 3700.0 139.9025 2700.0 142.7917 2400.0 144.9578 14000.0 145.7456 2400.0 147.0311 3700.0 147.0438 200000.0 153.018 10000.0 154.0208 2800.0 157.9658 18000.0 173.5285 47000.0 173.537 15000.0 173.5455 7900.0 183.245 2700.0 191.9865 33000.0 195.0294 3100.0 205.9662 3200.0 217.966 25000.0 218.974 99000.0 219.9819 85000.0 233.9611 31000.0 233.9948 2300.0 235.9767 21000.0 236.9845 7600.0 238.3704 2500.0 245.9967 6800.0 248.0632 11000.0 253.9875 8100.0 259.9774 3400.0 260.4922 2400.0 272.9838 9500.0 275.3158 2200.0 275.9712 5900.0 277.4247 2400.0 280.3449 2800.0 300.4684 2800.0 387.9157 2600.0 END IONS BEGIN IONS SCANS=143 PEPMASS=419.0095 CHARGE=1 COLLISION_ENERGY=0.0 57.0697 7400.0 59.321 2400.0 65.0383 10000.0 66.8657 2300.0 69.058 2600.0 71.0852 21000.0 79.8206 2500.0 80.278 2200.0 85.1008 8200.0 91.0539 62000.0 92.4205 2400.0 97.8815 2400.0 116.9658 14000.0 117.4883 2200.0 119.0392 3300.0 119.0488 210000.0 120.7906 2400.0 138.2088 2200.0 140.992 2200.0 147.0437 2200000.0 147.0547 30000.0 147.0709 10000.0 148.0471 24000.0 149.023 37000.0 173.5279 29000.0 173.5404 20000.0 219.0127 17000.0 244.9923 60000.0 263.0027 7000.0 268.9927 63000.0 276.9979 3000.0 280.9929 2500.0 287.0034 100000.0 295.0086 27000.0 301.0217 7000.0 310.3882 2300.0 363.0409 2600.0 365.7575 2800.0 END IONS BEGIN IONS SCANS=144 PEPMASS=455.999 CHARGE=1 COLLISION_ENERGY=0.0 57.0023 2200.0 58.4594 2200.0 59.5752 2700.0 65.0385 6400.0 70.8279 2400.0 71.7365 2800.0 79.0255 2500.0 88.9674 2100.0 91.0539 55000.0 92.9269 2100.0 107.2258 2400.0 113.0487 2200.0 116.3643 2400.0 118.4306 2300.0 119.0488 180000.0 121.6823 3200.0 123.2154 2400.0 125.754 2400.0 126.5184 2500.0 131.9499 3300.0 138.2978 2300.0 144.958 17000.0 146.0345 2500.0 147.0437 1800000.0 147.0549 26000.0 147.071 3500.0 157.9659 48000.0 165.9696 2800.0 166.8077 2500.0 173.5225 4700.0 173.5291 48000.0 173.5436 15000.0 173.9605 6300.0 190.0522 2700.0 191.9866 34000.0 196.9908 8700.0 197.1947 2400.0 205.9672 5500.0 209.9972 2800.0 217.966 35000.0 218.9741 66000.0 219.9818 80000.0 223.005 2800.0 223.9781 7700.0 233.9609 34000.0 234.968 12000.0 235.9767 43000.0 236.9842 3000.0 245.9968 25000.0 253.9872 9900.0 256.1036 2600.0 259.9766 77000.0 263.0544 15000.0 272.9845 35000.0 275.9715 65000.0 277.9872 5300.0 285.9925 54000.0 300.0637 2500.0 320.5389 2800.0 362.7065 2600.0 379.3559 2200.0 454.9697 2200.0 456.1576 16000.0 END IONS BEGIN IONS SCANS=145 PEPMASS=757.0732 CHARGE=1 COLLISION_ENERGY=0.0 76.4324 2500.0 76.9254 2300.0 81.5516 2200.0 81.5862 2300.0 89.6715 2400.0 91.0539 29000.0 92.667 2200.0 93.7016 2300.0 108.9948 2300.0 118.9713 14000.0 119.0488 71000.0 123.6739 2300.0 125.0155 2200.0 141.1255 2400.0 147.0437 910000.0 147.055 14000.0 147.0635 3900.0 148.0471 13000.0 166.9838 2300.0 173.5243 11000.0 173.5348 60000.0 173.5431 4700.0 176.0181 2900.0 193.3879 3100.0 194.711 3000.0 202.1222 2300.0 209.0187 12000.0 221.6067 2200.0 224.9895 3300.0 231.1089 2500.0 234.972 3700.0 236.7049 2500.0 244.993 3000.0 259.8249 2700.0 263.002 3400.0 268.9767 15000.0 287.003 36000.0 291.0224 2800.0 296.9727 9800.0 307.4218 2400.0 311.0044 6500.0 314.9809 5900.0 328.8299 2500.0 329.0129 3400.0 336.3464 3000.0 373.0042 9600.0 397.0037 6400.0 415.0159 4600.0 425.0004 2800.0 443.0093 15000.0 444.95 2400.0 465.9662 2400.0 544.9235 2600.0 624.1885 3400.0 708.6534 2600.0 758.9238 3000.0 END IONS BEGIN IONS SCANS=146 PEPMASS=339.0714 CHARGE=1 COLLISION_ENERGY=0.0 51.7273 2600.0 54.9461 2500.0 58.703 2500.0 58.7851 2500.0 60.4448 2600.0 64.3486 2300.0 65.0384 7800.0 67.879 2300.0 68.6594 2200.0 70.1907 2200.0 71.9698 2300.0 77.0277 2200.0 77.1608 2500.0 83.0125 5500.0 90.2458 2100.0 91.0539 110000.0 111.0067 2400.0 119.0393 14000.0 119.0488 420000.0 119.0572 2300.0 119.0591 5600.0 127.0919 2300.0 131.6525 2600.0 138.9929 2300.0 145.2647 2600.0 147.0437 2600000.0 147.0547 39000.0 147.0708 20000.0 149.688 6000.0 162.4716 2400.0 165.5731 2500.0 168.9438 2300.0 173.5204 2600.0 173.5287 47000.0 173.5464 7200.0 175.4473 2200.0 190.0921 2600.0 256.2758 2400.0 260.6013 2600.0 266.6696 2600.0 278.8934 2500.0 303.395 2600.0 344.827 2300.0 END IONS BEGIN IONS SCANS=147 PEPMASS=379.064 CHARGE=1 COLLISION_ENERGY=0.0 63.6985 2500.0 66.289 2800.0 72.2081 2300.0 82.9731 2500.0 91.0542 12000.0 99.3719 2500.0 119.0489 69000.0 136.3909 2300.0 147.0439 1100000.0 149.2044 2500.0 164.4899 2800.0 169.0116 3000.0 169.026 180000.0 169.0424 4400.0 173.5296 17000.0 173.5397 10000.0 175.6143 2500.0 178.5082 2200.0 179.5828 2400.0 187.0208 8600.0 190.4418 2100.0 215.0161 16000.0 222.3203 2300.0 224.9386 2700.0 233.0267 790000.0 233.6636 2800.0 247.6314 2700.0 336.4727 2400.0 END IONS BEGIN IONS SCANS=148 PEPMASS=735.1381 CHARGE=1 COLLISION_ENERGY=0.0 70.9072 2600.0 101.9177 2100.0 107.1544 2300.0 108.7593 2300.0 114.3647 2400.0 116.0261 2200.0 119.0489 4200.0 119.8148 2300.0 141.0531 2200.0 147.031 8800.0 147.0437 220000.0 149.6807 4100.0 149.6909 4000.0 169.0104 7600.0 169.0258 170000.0 173.5254 46000.0 173.5419 27000.0 215.0164 26000.0 227.2467 2400.0 233.0267 740000.0 233.0544 9100.0 247.046 6400.0 259.0466 2500.0 265.0558 11000.0 280.57 2500.0 304.6193 2900.0 351.0688 6700.0 361.05 12000.0 379.0641 150000.0 396.026 2600.0 461.163 2700.0 487.7682 2800.0 519.9175 2400.0 END IONS BEGIN IONS SCANS=149 PEPMASS=766.068 CHARGE=1 COLLISION_ENERGY=0.0 74.1167 2600.0 78.8428 2100.0 90.9472 2600.0 91.0539 22000.0 95.0244 2400.0 95.9446 2600.0 98.0821 2500.0 108.3395 2400.0 109.9575 2600.0 111.4339 2200.0 119.0488 52000.0 127.9549 4700.0 131.9504 16000.0 138.5656 2700.0 139.9569 2400.0 144.9581 21000.0 145.9658 4500.0 147.0437 890000.0 147.0549 7700.0 149.6817 3500.0 149.692 5400.0 157.9532 2400.0 157.9658 39000.0 172.5994 2700.0 173.5286 49000.0 173.5367 7300.0 173.5459 4300.0 173.9611 19000.0 174.9692 3000.0 175.5166 2700.0 179.3316 2800.0 187.9393 3000.0 189.9558 23000.0 191.9867 23000.0 197.9616 5700.0 201.955 8600.0 217.9504 8600.0 218.9741 35000.0 219.9818 41000.0 222.9292 2600.0 233.961 18000.0 234.9686 19000.0 235.9761 15000.0 245.997 36000.0 253.9875 9300.0 259.9764 150000.0 260.9845 44000.0 261.9934 5800.0 263.9559 7500.0 272.9845 110000.0 273.9929 3400.0 275.9717 89000.0 277.987 45000.0 278.9951 17000.0 285.9926 130000.0 287.4592 2400.0 287.8995 2400.0 288.9788 7000.0 290.9967 3200.0 295.9964 3900.0 300.0316 2400.0 301.9851 3200.0 305.9691 16000.0 320.0021 2500.0 323.9794 2600.0 327.5147 2700.0 339.9642 2300.0 346.7404 2400.0 364.0036 3900.0 365.0104 10000.0 372.6197 2500.0 374.9796 17000.0 382.0119 9300.0 392.9902 15000.0 411.0014 14000.0 452.9138 2500.0 529.9904 2400.0 573.0873 2500.0 769.1277 2700.0 END IONS BEGIN IONS SCANS=150 PEPMASS=357.0819 CHARGE=1 COLLISION_ENERGY=0.0 53.8413 2500.0 54.0694 2300.0 54.2185 2300.0 57.7908 2600.0 65.0382 24000.0 71.5396 2600.0 73.5526 2300.0 73.8249 2300.0 76.8088 2500.0 79.5113 2100.0 81.4052 2500.0 91.0539 200000.0 98.071 2300.0 98.4463 2300.0 119.0392 3600.0 119.0488 350000.0 119.0591 5800.0 131.4403 2700.0 134.5612 2400.0 147.0437 1500000.0 147.0548 20000.0 148.0471 5900.0 149.2217 2200.0 158.5787 2700.0 158.9215 2500.0 173.528 37000.0 173.5424 5600.0 175.0169 2200.0 185.0201 2200.0 185.0337 2300.0 208.3489 2300.0 224.6458 2800.0 231.876 2500.0 268.0177 2500.0 284.8706 2600.0 307.5044 2500.0 331.7935 2600.0 END IONS BEGIN IONS SCANS=151 PEPMASS=450.1978 CHARGE=1 COLLISION_ENERGY=0.0 57.0333 48000.0 59.0491 13000.0 60.0441 8000.0 61.0282 6700.0 61.3166 2300.0 68.0204 2200.0 69.0332 340000.0 72.0662 2300.0 73.0276 2900.0 74.5459 2500.0 75.0437 3000.0 81.0333 12000.0 85.0225 3400.0 85.028 320000.0 87.0437 410000.0 91.0389 8300.0 97.0281 480000.0 99.0437 15000.0 101.2126 2400.0 103.0385 3300.0 107.0487 3400.0 109.0282 14000.0 111.0446 3000.0 112.5754 2600.0 114.8633 2300.0 115.0306 3200.0 115.0386 540000.0 115.0495 13000.0 115.0529 3600.0 117.0696 7200.0 117.3617 2300.0 121.0645 150000.0 122.0665 2300.0 124.5725 2200.0 125.2111 3000.0 127.0385 60000.0 132.0596 2300.0 133.0492 240000.0 135.0806 7000.0 139.0388 3300.0 141.2839 2400.0 145.0494 67000.0 145.0645 180000.0 145.8905 2800.0 147.044 14000.0 149.6808 3300.0 149.6912 4300.0 150.0758 55000.0 153.8347 2800.0 156.7647 2700.0 159.08 18000.0 163.0752 120000.0 169.0496 8200.0 171.0823 2700.0 173.526 53000.0 173.5362 5100.0 173.5443 10000.0 175.0604 2900.0 175.0753 100000.0 177.0545 3700.0 182.8376 2200.0 187.0753 65000.0 187.5555 3100.0 200.138 2700.0 201.0922 2900.0 205.0863 31000.0 205.7985 3100.0 217.0862 130000.0 222.1994 2300.0 229.0854 3100.0 229.2977 2600.0 235.0963 3300.0 237.9204 2500.0 246.3482 2500.0 258.9294 2400.0 258.9884 5700.0 271.0973 17000.0 277.0886 5500.0 288.1234 20000.0 361.715 2500.0 386.8173 2300.0 421.9012 3000.0 433.2141 2600.0 END IONS BEGIN IONS SCANS=152 PEPMASS=265.1549 CHARGE=1 COLLISION_ENERGY=0.0 48.7784 4200.0 49.1123 2500.0 49.6232 5200.0 51.4317 3800.0 53.8498 3300.0 55.0541 44000.0 55.0871 4300.0 55.1018 2700.0 60.1038 3600.0 60.1913 4600.0 60.812 2100.0 62.0159 4300.0 63.0235 35000.0 63.5681 4400.0 68.5801 3100.0 69.3965 2400.0 70.0653 5200.0 72.0806 1800000.0 72.0851 13000.0 72.0873 7500.0 73.8397 2400.0 78.0463 14000.0 78.7731 5200.0 78.7939 5300.0 87.1961 3600.0 89.0326 9900.0 89.0384 390000.0 89.107 420000.0 91.0542 15000.0 95.049 3800.0 98.0598 170000.0 100.4994 5300.0 101.3165 5000.0 103.0546 7000.0 103.5708 4800.0 106.0408 18000.0 114.0913 27000.0 115.0864 62000.0 117.0238 4500.0 117.0333 2000000.0 117.0417 7000.0 117.0426 17000.0 119.0491 21000.0 120.1591 4900.0 124.0522 5500.0 129.0446 12000.0 134.0363 96000.0 135.0439 120000.0 145.0282 18000000.0 145.0389 240000.0 145.0551 140000.0 145.063 48000.0 147.0439 33000.0 149.046 23000.0 149.0596 1000000.0 149.0706 6300.0 149.0739 16000.0 152.0703 20000.0 154.4987 6400.0 162.0312 35000.0 163.039 160000.0 173.5251 28000.0 173.5374 45000.0 177.0075 16000.0 177.018 150000.0 177.0263 99000.0 177.0547 25000000.0 177.0836 53000.0 177.091 220000.0 177.1018 64000.0 177.1109 9300.0 186.055 110000.0 206.1173 30000.0 214.2516 6000.0 248.1287 250000.0 END IONS BEGIN IONS SCANS=153 PEPMASS=300.1599 CHARGE=1 COLLISION_ENERGY=0.0 55.0179 18000.0 56.0495 28000.0 57.0573 13000.0 57.1189 4200.0 58.0652 7200000.0 58.0679 52000.0 58.0718 27000.0 58.0739 7100.0 65.2691 2500.0 68.3006 5400.0 70.0654 9200.0 70.7689 5800.0 71.0728 160000.0 72.0807 140000.0 75.0374 9400.0 75.0417 5100.0 77.0386 11000.0 79.0541 25000.0 80.5819 4800.0 82.1859 4500.0 85.4854 3900.0 89.0595 14000.0 91.0541 58000.0 93.0697 29000.0 95.0491 72000.0 103.0542 7100.0 105.0439 2900.0 105.0698 24000.0 107.0319 55000.0 107.049 8600000.0 107.0576 110000.0 107.0626 27000.0 107.066 83000.0 115.0542 330000.0 117.0698 70000.0 119.049 200000.0 121.0283 31000.0 121.0647 860000.0 121.0757 8800.0 123.0439 1100000.0 123.0533 17000.0 123.0806 5200.0 131.0489 68000.0 131.8578 2600.0 133.0647 140000.0 135.044 170000.0 135.0808 13000.0 136.0515 24000.0 137.0596 350000.0 138.9093 2500.0 140.5527 5400.0 143.049 1800000.0 145.0647 1100000.0 145.0744 8100.0 145.0784 20000.0 146.0725 33000.0 147.0439 39000.0 147.0803 220000.0 148.0515 29000.0 149.0595 160000.0 149.0834 47000.0 151.0754 46000.0 155.0604 5000.0 157.0646 37000.0 161.0596 1800000.0 162.0674 15000.0 163.0753 360000.0 166.0784 5100.0 171.0808 5800.0 173.5259 40000.0 173.5409 24000.0 175.0753 25000.0 176.1069 38000.0 178.0861 110000.0 179.0941 160000.0 180.1019 210000.0 181.0646 25000.0 181.1015 37000.0 182.3112 2700.0 183.0806 19000.0 191.0858 54000.0 192.1016 10000.0 193.1096 190000.0 194.0728 48000.0 194.1179 5200.0 195.0804 24000.0 199.0755 7700.0 199.1128 6100.0 202.9053 5800.0 206.1177 53000.0 209.06 35000.0 209.0962 340000.0 210.0679 11000.0 211.0756 23000.0 211.1119 130000.0 219.0802 75000.0 221.0951 19000.0 226.0624 86000.0 227.0704 30000.0 227.1068 56000.0 228.0779 15000.0 229.1223 6100.0 237.0695 4300.0 237.0909 590000.0 239.1066 110000.0 240.078 74000.0 251.1051 12000.0 253.084 9600.0 253.1223 6100.0 255.1014 3200000.0 257.117 510000.0 257.1477 10000.0 267.4334 4400.0 269.1166 37000.0 271.1328 15000.0 282.15 28000.0 285.1362 18000.0 300.1594 5300000.0 300.238 23000.0 END IONS BEGIN IONS SCANS=154 PEPMASS=298.1444 CHARGE=1 COLLISION_ENERGY=0.0 48.4474 2700.0 51.9305 2400.0 56.0495 2800.0 58.0611 4800.0 58.065 2200000.0 58.0683 24000.0 58.07 19000.0 58.0716 10000.0 62.6779 2500.0 65.2786 2500.0 80.3027 2200.0 88.8632 2300.0 92.5283 2200.0 99.5976 2300.0 101.3016 2700.0 107.0488 20000.0 110.3571 2300.0 121.2076 2700.0 132.0998 2300.0 160.8352 3200.0 166.8 2400.0 173.5305 37000.0 174.9025 3100.0 191.0937 25000.0 192.1028 3200.0 218.8908 2600.0 229.3101 3000.0 241.9635 3000.0 243.0233 2600.0 246.7669 2400.0 246.8861 3600.0 253.0867 2600.0 260.0946 2400.0 271.9649 2600.0 282.4151 2400.0 298.1443 2900.0 END IONS BEGIN IONS SCANS=155 PEPMASS=290.1028 CHARGE=1 COLLISION_ENERGY=0.0 47.0323 2600.0 52.238 2500.0 55.1975 2200.0 56.43 2200.0 60.2955 2800.0 61.1839 2200.0 67.4965 2200.0 68.0821 2500.0 73.3916 2700.0 74.2333 2400.0 81.0333 22000.0 91.0539 93000.0 109.0285 9700.0 109.0645 8800.0 116.4243 2700.0 119.042 2400.0 119.0488 68000.0 127.0386 20000.0 131.7611 3100.0 134.8543 2400.0 137.0231 1100000.0 137.0335 19000.0 137.0594 1100000.0 137.0696 16000.0 138.0259 2400.0 149.1252 2300.0 154.0497 16000.0 154.0859 55000.0 173.5247 8800.0 173.5384 25000.0 184.1827 2500.0 190.0264 3800.0 193.2626 2300.0 197.0521 2500.0 205.05 5100.0 215.9494 2200.0 219.5845 2100.0 229.0266 2400.0 230.5338 2400.0 281.6719 2300.0 294.1178 2700.0 END IONS BEGIN IONS SCANS=156 PEPMASS=355.1024 CHARGE=1 COLLISION_ENERGY=0.0 58.7283 2200.0 58.764 2600.0 67.0539 4600.0 67.3909 2500.0 78.3452 2500.0 79.0539 16000.0 80.763 2400.0 81.348 2300.0 83.0489 19000.0 85.0281 2600.0 89.0382 120000.0 93.0334 2900.0 95.0489 12000.0 98.6424 2600.0 104.7165 2300.0 107.0488 37000.0 111.0437 21000.0 115.8552 2900.0 116.2621 2300.0 117.0332 120000.0 117.8352 2300.0 129.0432 3100.0 131.8802 2500.0 134.035 2800.0 135.0439 350000.0 135.0558 6900.0 145.0282 480000.0 145.0388 3000.0 150.5358 2800.0 163.0071 30000.0 163.0388 4600000.0 163.0634 7400.0 163.0696 44000.0 173.5233 8200.0 173.5333 31000.0 173.5417 9500.0 175.965 2700.0 181.05 9300.0 219.6584 2300.0 258.8632 3200.0 308.9009 15000.0 336.325 3100.0 351.9253 2700.0 362.1186 2600.0 END IONS BEGIN IONS SCANS=157 PEPMASS=613.1765 CHARGE=1 COLLISION_ENERGY=0.0 70.1609 2100.0 76.5092 2600.0 79.0791 2300.0 79.3535 2200.0 81.5201 2700.0 82.3366 2100.0 83.3419 2600.0 85.028 7300.0 85.5958 2400.0 86.1233 2200.0 86.358 2300.0 86.9135 2700.0 87.022 2300.0 88.5295 2200.0 90.7855 2300.0 90.9606 2400.0 91.145 2200.0 91.7711 2100.0 101.6179 2200.0 101.9209 2200.0 114.8699 2300.0 121.0187 7000.0 121.028 360000.0 121.0377 2500.0 124.3878 2400.0 128.2175 2300.0 129.2276 2400.0 131.5656 2500.0 134.3294 2800.0 136.2231 2300.0 137.719 2400.0 138.2733 2800.0 147.0444 3100.0 155.2007 2300.0 163.0387 100000.0 169.7392 2200.0 173.5273 74000.0 173.542 12000.0 175.0387 6900.0 177.0188 2900.0 181.0492 3600.0 181.2068 2400.0 193.0487 7100.0 195.0285 5700.0 205.0495 31000.0 207.0284 21000.0 217.0492 46000.0 217.4559 2300.0 219.0285 38000.0 224.2575 2600.0 229.0494 13000.0 231.0288 39000.0 233.0441 3100.0 235.06 13000.0 237.0397 11000.0 241.0492 8500.0 243.0285 16000.0 245.0425 3700.0 247.0606 37000.0 249.0386 17000.0 255.0639 2600.0 255.1827 2500.0 259.0297 2600.0 259.0595 51000.0 261.0389 94000.0 261.2297 2300.0 265.0708 4400.0 269.0879 2600.0 271.0604 37000.0 273.0397 46000.0 273.0708 2600.0 274.2708 2400.0 277.0701 6800.0 279.0502 9300.0 283.0608 13000.0 285.0399 61000.0 285.0717 5800.0 291.0502 67000.0 295.06 30000.0 297.0379 4100.0 301.0705 31000.0 303.05 47000.0 307.0603 22000.0 309.0615 13000.0 313.0712 41000.0 315.0505 30000.0 319.0804 2700.0 321.0608 35000.0 325.0706 67000.0 327.0504 61000.0 331.0814 11000.0 337.0706 64000.0 339.0697 46000.0 343.0811 9800.0 345.0606 61000.0 349.072 40000.0 355.0814 29000.0 357.0613 19000.0 361.0706 14000.0 363.0728 30000.0 367.0803 10000.0 369.0617 6900.0 375.0734 36000.0 379.0822 66000.0 385.5396 2600.0 387.0714 17000.0 391.0821 44000.0 393.0827 27000.0 403.0821 21000.0 405.0832 35000.0 409.0916 38000.0 421.0928 17000.0 423.0918 23000.0 427.1014 9300.0 433.0918 8800.0 437.8033 2400.0 439.1016 12000.0 441.1034 3900.0 445.0936 8200.0 457.1072 17000.0 460.6629 2600.0 463.1004 7400.0 481.1116 3200.0 493.3654 2600.0 512.2781 2400.0 517.6235 2500.0 541.7327 2800.0 END IONS BEGIN IONS SCANS=158 PEPMASS=326.1396 CHARGE=1 COLLISION_ENERGY=0.0 51.985 2500.0 53.0657 2700.0 56.0493 30000.0 57.4488 2600.0 58.0611 20000.0 58.0652 12000000.0 58.0701 72000.0 58.0717 35000.0 58.0736 130000.0 58.0737 19000.0 58.0757 8100.0 58.0816 4000.0 58.5126 2600.0 63.5846 2300.0 70.1742 2200.0 75.1392 2600.0 75.507 2500.0 78.9271 2600.0 81.5284 2400.0 89.2209 2800.0 90.8023 2300.0 101.2247 2500.0 106.074 2600.0 109.3327 2300.0 110.9441 2500.0 139.7337 2400.0 141.94 2400.0 147.7599 3400.0 156.0029 2100.0 173.5277 60000.0 173.5424 11000.0 174.6651 2400.0 176.1559 2400.0 179.6946 2500.0 183.0811 3200.0 195.0805 3300.0 209.073 2100.0 216.9817 2600.0 223.076 19000.0 224.0818 2600.0 224.5067 2100.0 225.091 14000.0 226.0636 12000.0 227.1068 18000.0 240.079 9300.0 253.086 65000.0 255.1015 260000.0 255.1299 6800.0 266.1171 3200.0 274.8801 5200.0 283.0968 74000.0 298.1053 10000.0 298.1441 380000.0 311.116 30000.0 311.9157 2500.0 326.1389 220000.0 326.1762 3000.0 END IONS BEGIN IONS SCANS=159 PEPMASS=327.1434 CHARGE=1 COLLISION_ENERGY=0.0 49.8031 2400.0 54.3538 2400.0 56.0494 2600.0 58.065 2600000.0 58.0683 22000.0 58.0701 17000.0 58.0718 7200.0 59.0619 15000.0 59.068 460000.0 59.0716 4400.0 62.1013 2500.0 63.9267 2300.0 64.4848 2200.0 66.7707 2300.0 67.2163 2100.0 67.2387 2300.0 76.2363 2300.0 78.0897 2500.0 85.9901 2700.0 89.5487 2300.0 94.6932 2200.0 97.0286 2800.0 99.8364 2400.0 105.5844 2500.0 108.9413 2500.0 133.8522 3100.0 134.5565 2900.0 137.6632 2600.0 141.7628 2500.0 156.8802 2700.0 164.0332 4600.0 168.5974 2400.0 172.2004 2200.0 173.5238 7900.0 173.5354 56000.0 175.8678 2400.0 176.9032 2400.0 190.2055 2300.0 211.7594 2600.0 219.8968 2800.0 221.6019 2700.0 223.075 3000.0 231.8956 2400.0 233.3861 2600.0 239.0702 20000.0 250.0622 2700.0 251.0702 32000.0 253.0604 5500.0 254.0921 26000.0 255.1007 6600.0 256.1053 53000.0 265.4041 2600.0 281.0561 7600.0 282.0864 2800.0 283.0969 15000.0 284.1009 11000.0 299.0635 3100.0 299.1474 77000.0 312.1185 5900.0 322.1544 2700.0 327.1426 51000.0 END IONS BEGIN IONS SCANS=160 PEPMASS=328.1549 CHARGE=1 COLLISION_ENERGY=0.0 51.0831 9900.0 56.0496 4500.0 57.6337 4400.0 58.0651 4600000.0 58.0681 33000.0 58.0719 14000.0 58.46 7700.0 59.0684 39000.0 62.7661 120000.0 62.7694 28000.0 63.8544 9600.0 64.1672 3700.0 68.1292 9800.0 70.6242 11000.0 70.7717 19000.0 70.7752 83000.0 72.0805 62000.0 80.1993 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283.0232 160000.0 283.0389 130000.0 283.0968 23000000.0 283.1555 120000.0 283.1705 170000.0 283.1903 36000.0 285.1125 160000.0 326.5881 10000.0 328.1546 760000.0 328.2 6800.0 END IONS BEGIN IONS SCANS=161 PEPMASS=314.1757 CHARGE=1 COLLISION_ENERGY=0.0 49.5032 90000.0 51.049 62000.0 51.8247 37000.0 52.7599 21000.0 56.0495 1400000.0 56.6914 9800.0 58.043 27000.0 58.0565 33000.0 58.0653 510000000.0 58.0704 1600000.0 58.0718 1100000.0 58.0737 400000.0 58.0745 3500000.0 58.0757 230000.0 59.9036 59000.0 61.1504 100000.0 62.157 36000.0 66.7051 40000.0 67.8759 64000.0 68.1447 61000.0 68.5942 24000.0 68.8578 8800.0 69.2896 38000.0 71.0727 170000.0 72.0808 750000.0 73.9382 40000.0 74.3865 90000.0 74.7939 100000.0 75.519 59000.0 75.9009 10000.0 78.5415 25000.0 86.4878 100000.0 91.0542 920000.0 93.0699 600000.0 94.4521 36000.0 95.032 48000.0 95.0491 1200000.0 95.8317 76000.0 98.9748 29000.0 99.6189 11000.0 100.1562 37000.0 101.6562 87000.0 103.0544 270000.0 104.8052 25000.0 105.0452 30000.0 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178.0867 760000.0 181.0652 480000.0 181.1011 860000.0 182.0732 40000.0 183.0808 810000.0 189.0909 510000.0 191.0859 1300000.0 192.1021 5200000.0 193.1095 3300000.0 194.0731 1000000.0 194.1175 3200000.0 195.0804 590000.0 196.0886 74000.0 197.062 51000.0 197.0961 330000.0 199.7913 11000.0 206.1182 11000.0 207.1257 2200000.0 209.0618 240000.0 209.0963 12000000.0 210.0675 76000.0 211.0757 1000000.0 211.112 6400000.0 219.0806 2100000.0 220.1325 120000.0 221.0965 720000.0 223.1119 240000.0 225.1278 660000.0 235.1113 74000.0 236.0832 79000.0 237.0911 36000000.0 237.1311 110000.0 238.099 1100000.0 239.0661 25000.0 239.1067 6600000.0 240.0779 970000.0 241.0852 670000.0 242.0935 460000.0 251.1066 1400000.0 253.1218 990000.0 254.0936 2400000.0 256.1089 75000.0 267.1018 32000.0 269.1171 52000000.0 271.1329 10000000.0 282.1488 1200000.0 282.2046 27000.0 283.1328 890000.0 285.1496 9900.0 298.1108 42000.0 299.1518 660000.0 314.1751 91000000.0 314.207 440000.0 314.2186 160000.0 END IONS BEGIN IONS 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2800.0 242.1172 5500.0 265.5967 2900.0 271.1236 26000.0 272.126 110000.0 273.1399 3000.0 274.1414 20000.0 281.8608 9400.0 293.3658 2400.0 317.1844 220000.0 317.2252 4300.0 END IONS BEGIN IONS SCANS=163 PEPMASS=330.1704 CHARGE=1 COLLISION_ENERGY=0.0 49.4243 2200.0 49.6569 2300.0 49.7778 2600.0 50.2309 2200.0 51.2373 2400.0 51.5075 2300.0 51.6207 2400.0 52.7177 2400.0 52.8776 2200.0 53.1196 2100.0 53.4007 2200.0 53.5527 2300.0 54.5182 2400.0 55.0177 3800.0 57.1018 2400.0 58.0611 5100.0 58.0651 4000000.0 58.069 24000.0 58.0699 16000.0 59.0683 19000.0 66.2423 2800.0 68.8229 2100.0 70.5213 2200.0 74.8382 2200.0 75.5004 2500.0 77.4392 2200.0 78.7965 2300.0 79.7486 2300.0 79.8518 2500.0 80.0675 2500.0 80.6628 2400.0 82.9793 2100.0 85.536 2500.0 94.2144 2500.0 97.5598 2300.0 98.9752 2500.0 100.5305 2800.0 101.9517 2400.0 102.402 2500.0 105.0923 2600.0 107.0487 1000000.0 107.0575 15000.0 109.0728 2300.0 112.2979 2600.0 113.8382 2300.0 115.4843 2200.0 115.5765 2400.0 115.8223 2500.0 116.1738 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227.1066 13000.0 233.0616 4500.0 234.0636 10000.0 235.0694 24000.0 235.0761 3100.0 237.0911 5700.0 242.9948 2400.0 250.9891 2600.0 251.0707 54000.0 251.1945 2500.0 252.044 5800.0 252.0739 140000.0 253.0853 670000.0 254.0944 6000.0 255.1011 17000.0 263.8626 2500.0 266.0649 2700.0 267.1014 34000.0 269.0779 4800.0 270.0878 39000.0 284.1009 51000.0 285.1121 620000.0 287.1279 130000.0 290.9858 2400.0 293.3386 2600.0 298.1428 9000.0 299.1281 25000.0 300.8491 3200.0 315.1467 27000.0 320.3501 2700.0 330.17 1000000.0 END IONS BEGIN IONS SCANS=164 PEPMASS=399.1656 CHARGE=1 COLLISION_ENERGY=0.0 53.0385 3000.0 55.3501 2400.0 57.0333 29000.0 61.0281 12000.0 69.0331 47000.0 71.0855 3000.0 73.028 2300.0 75.8154 2600.0 78.1792 2300.0 78.5051 2700.0 78.7987 2600.0 81.0332 24000.0 82.7931 2100.0 84.4969 2700.0 85.028 140000.0 86.931 2800.0 87.0437 7000.0 91.0384 4600.0 97.0281 36000.0 99.0439 13000.0 102.9278 2400.0 103.0386 5700.0 103.0539 80000.0 109.0281 24000.0 109.7573 2500.0 114.9335 2400.0 117.0541 2700.0 117.1664 2600.0 120.0244 2600.0 127.0387 29000.0 129.0555 2500.0 131.0377 4000.0 131.0488 680000.0 131.0586 3300.0 131.0593 7900.0 133.0633 2600.0 148.0516 86000.0 161.0595 24000.0 162.0666 3300.0 163.0752 140000.0 173.5314 50000.0 173.5462 5500.0 188.9108 2400.0 201.0899 2400.0 202.8297 2700.0 206.1194 4800.0 220.3445 2300.0 253.2318 2500.0 269.9477 2500.0 289.9211 5500.0 301.9229 15000.0 303.9381 5900.0 317.9177 7000.0 319.9321 20000.0 329.9171 22000.0 333.9092 2600.0 347.9288 28000.0 376.0162 12000.0 END IONS BEGIN IONS SCANS=165 PEPMASS=439.1581 CHARGE=1 COLLISION_ENERGY=0.0 76.5821 2500.0 80.7098 2300.0 84.0174 3600.0 95.0099 9400.0 96.017 3200.0 103.0662 2300.0 104.8521 2400.0 109.5514 2300.0 110.2338 2400.0 112.0127 3000.0 113.0203 16000.0 113.192 2500.0 117.7126 2600.0 126.028 2800.0 139.3145 2600.0 157.0464 3000.0 166.0497 3800.0 173.5237 22000.0 173.5428 17000.0 181.3581 2800.0 185.0415 28000.0 201.0361 11000.0 202.0422 2500.0 202.0596 33000.0 203.0517 5700.0 220.8099 2500.0 259.0782 18000.0 273.9823 24000.0 277.104 9900.0 291.9957 3300.0 315.2928 2600.0 343.8292 2900.0 356.9949 2700.0 375.0088 25000.0 393.0202 27000.0 411.0859 3900.0 439.0869 11000.0 439.1569 270000.0 END IONS BEGIN IONS SCANS=166 PEPMASS=210.0401 CHARGE=1 COLLISION_ENERGY=0.0 41.6801 2200.0 44.22 2400.0 45.2849 2300.0 52.579 2000.0 52.6199 2200.0 52.9265 2300.0 53.0384 64000.0 54.7187 2400.0 55.054 13000.0 57.2327 2100.0 57.3792 2300.0 58.7652 2500.0 60.3057 2400.0 60.4402 2000.0 60.6704 2400.0 62.5672 2400.0 65.0384 3000.0 65.4314 2400.0 66.1391 2400.0 67.0176 82000.0 68.0128 220000.0 70.0648 28000.0 70.3164 3300.0 70.9864 2300.0 73.5344 2400.0 73.6703 2300.0 76.1171 2100.0 77.3605 2300.0 78.0115 2700.0 80.0491 260000.0 81.0331 260000.0 83.3133 2400.0 84.0441 4800.0 86.0838 2100.0 87.6836 2300.0 90.2385 2500.0 93.0337 2200.0 95.0124 83000.0 96.044 12000.0 97.052 22000.0 97.8431 2600.0 98.0533 3100.0 98.0597 160000.0 106.8606 2300.0 108.0316 3300.0 108.0441 900000.0 108.0527 5300.0 109.0281 140000.0 116.966 14000.0 117.3317 2500.0 120.0433 2400.0 120.3148 2300.0 121.028 3000.0 122.0234 10000.0 122.247 2500.0 124.0391 73000.0 125.0468 59000.0 126.0442 16000.0 126.0546 1200000.0 126.0648 25000.0 127.0383 3800.0 136.0216 3500.0 136.0391 2100000.0 136.0491 33000.0 137.0238 2900.0 137.4308 2400.0 145.9247 2500.0 147.2382 3100.0 148.0388 2900.0 153.0417 68000.0 154.0496 410000.0 154.0644 4100.0 155.6231 2800.0 158.99 10000.0 164.0342 1300000.0 164.05 21000.0 168.9776 2900.0 170.4162 2600.0 173.524 7200.0 173.5348 72000.0 176.2814 2300.0 182.0446 22000.0 183.0281 2700.0 192.0289 30000.0 193.321 2300.0 206.4986 2400.0 209.8192 2600.0 210.0395 2600.0 211.0711 2500.0 END IONS BEGIN IONS SCANS=167 PEPMASS=243.9932 CHARGE=1 COLLISION_ENERGY=0.0 44.7527 2100.0 45.7706 2200.0 46.505 2000.0 48.4698 2300.0 48.6141 2300.0 49.4854 2200.0 50.7485 2200.0 52.7155 2300.0 55.4373 2700.0 55.9342 470000.0 56.4252 2300.0 62.5816 2100.0 63.1999 2300.0 63.4341 2300.0 63.6837 2500.0 64.9522 2300.0 65.5679 2400.0 66.7686 2400.0 67.0415 38000.0 69.9475 2100.0 70.9446 2200.0 71.9291 13000.0 72.9369 3000.0 72.956 2500.0 73.6824 2700.0 73.945 2800.0 76.0167 2400.0 83.6613 2800.0 85.6754 2500.0 89.94 2600.0 90.9479 3200.0 91.9905 3100.0 92.2023 2300.0 94.0286 21000.0 94.1191 2400.0 99.8747 2500.0 99.9482 2900.0 107.2196 2400.0 111.9814 2200.0 113.6099 2700.0 113.9634 4000.0 119.0367 9500.0 126.2976 2900.0 126.3085 2400.0 128.9503 2600.0 132.9617 2800.0 138.9719 2900.0 139.5139 2300.0 140.9873 20000.0 146.9765 91000.0 147.139 2400.0 148.9758 3000.0 149.9636 10000.0 156.9805 2500.0 164.987 290000.0 167.9742 96000.0 173.5296 63000.0 175.9727 7400.0 180.8536 2400.0 182.4002 2600.0 182.9976 77000.0 183.3483 2500.0 185.985 7700.0 191.57 2500.0 192.982 47000.0 202.9673 32000.0 220.9584 7400.0 220.9771 1500000.0 224.908 2300.0 230.9722 3800.0 234.9285 7100.0 234.9563 450000.0 234.9833 8500.0 238.9875 450000.0 239.0305 2600.0 241.1121 2600.0 243.9701 4000.0 243.9935 23000.0 END IONS BEGIN IONS SCANS=168 PEPMASS=267.0767 CHARGE=1 COLLISION_ENERGY=0.0 47.057 2000.0 47.2496 2500.0 49.6003 2100.0 50.7872 2100.0 53.8435 2100.0 54.604 2300.0 58.0049 2300.0 59.8647 2200.0 62.2592 2300.0 62.4616 2300.0 65.7653 2400.0 79.911 2700.0 86.0964 9400.0 104.1736 2400.0 110.6914 2600.0 113.8588 2500.0 129.3498 2500.0 142.1858 2400.0 151.7939 2700.0 152.4113 2500.0 156.0798 3400.0 173.5225 13000.0 173.5409 18000.0 183.0914 16000.0 184.0756 13000.0 193.0762 57000.0 194.0597 5700.0 210.0788 3100.0 211.0868 60000.0 215.8958 11000.0 220.9764 2800.0 221.0713 31000.0 222.0554 4500.0 222.0792 11000.0 224.0582 3700.0 225.0656 8700.0 226.0297 12000.0 228.9857 22000.0 237.0666 6900.0 238.0742 35000.0 239.0816 150000.0 244.0152 2500.0 244.0403 30000.0 249.0657 18000.0 252.0531 7200.0 254.4692 2400.0 267.0766 57000.0 END IONS BEGIN IONS SCANS=169 PEPMASS=329.0774 CHARGE=1 COLLISION_ENERGY=0.0 53.2835 2300.0 54.6014 2600.0 55.7614 2400.0 57.5344 2400.0 61.134 2100.0 63.5822 2300.0 72.8346 2500.0 91.2609 2600.0 95.0492 2300.0 95.2324 2600.0 96.062 2200.0 105.6637 2200.0 120.0448 2300.0 124.0396 3100.0 125.0469 13000.0 138.0548 11000.0 139.0407 2700.0 148.0391 36000.0 149.0475 9600.0 149.0698 3400.0 149.6813 4700.0 149.6919 4700.0 150.0545 3100.0 154.0861 2700.0 161.0715 8300.0 162.0782 7500.0 163.0877 3300.0 164.0343 310000.0 165.0419 34000.0 166.0499 96000.0 170.1191 2500.0 172.8621 13000.0 173.5301 39000.0 173.5441 4900.0 174.0553 5900.0 176.0344 4800.0 176.0947 3400.0 176.7175 2700.0 180.8882 17000.0 181.0488 2300.0 190.8726 75000.0 197.8909 4300.0 200.0521 2600.0 201.8649 4100.0 202.871 2600.0 208.8601 4300.0 208.8831 500000.0 209.0697 5400.0 210.0558 2900.0 212.0711 2900.0 218.8675 36000.0 226.8939 170000.0 227.0824 11000.0 228.0653 8000.0 231.8989 2800.0 234.6297 2100.0 236.7122 2700.0 236.8782 160000.0 237.0662 69000.0 238.0496 13000.0 238.0742 9300.0 240.0656 14000.0 245.7179 2300.0 246.8625 22000.0 254.0688 3100.0 254.8887 43000.0 255.0764 61000.0 255.1083 3500.0 256.0604 130000.0 256.0888 3800.0 264.8728 54000.0 265.0608 85000.0 265.0926 3000.0 266.0449 12000.0 267.0784 3000.0 267.11 2500.0 268.061 14000.0 282.0648 5700.0 282.8842 8900.0 283.0718 77000.0 283.1084 8200.0 284.0552 34000.0 293.0558 63000.0 301.0807 6700.0 311.0663 35000.0 312.147 15000.0 317.7556 2600.0 329.0784 4600.0 329.1498 160000.0 END IONS BEGIN IONS SCANS=170 PEPMASS=589.1359 CHARGE=1 COLLISION_ENERGY=0.0 63.457 22000.0 63.4601 11000.0 63.5656 6700.0 63.6779 6500.0 63.6809 4400.0 65.4579 24000.0 65.4615 13000.0 65.8502 2300.0 75.3094 2300.0 82.1021 2400.0 85.3258 2700.0 140.7519 2500.0 147.8905 2600.0 162.0542 4300.0 173.2854 3600.0 173.5229 21000.0 173.5384 40000.0 232.6655 4200.0 282.5862 2700.0 283.069 4000.0 293.0549 13000.0 295.0705 5400.0 307.0706 13000.0 354.4048 2400.0 394.0832 6000.0 396.0962 5100.0 412.0922 29000.0 413.0787 11000.0 422.0825 7200.0 423.0878 4300.0 424.0974 5600.0 428.084 6900.0 436.0928 29000.0 439.0787 7100.0 440.015 7200.0 440.0872 450000.0 440.1579 3700.0 441.0952 68000.0 446.0729 4500.0 452.0887 18000.0 454.1048 4700.0 454.9034 4600.0 464.0871 1000000.0 465.0945 18000.0 467.11 7400.0 470.1117 9900.0 478.1022 4700.0 488.1243 6500.0 491.1094 12000.0 492.1138 7900.0 497.122 15000.0 498.1085 40000.0 502.0967 4900.0 503.1085 4200.0 506.0969 11000.0 515.1212 22000.0 516.117 31000.0 517.1175 8300.0 518.1042 9000.0 519.126 6000.0 525.1158 54000.0 526.1044 96000.0 527.1109 16000.0 530.0984 11000.0 533.143 27000.0 535.1055 6600.0 542.1183 5500.0 543.1289 610000.0 544.1142 120000.0 545.1331 5200.0 546.1141 5500.0 553.1137 78000.0 554.106 140000.0 555.107 21000.0 559.124 95000.0 560.115 13000.0 561.1383 73000.0 570.1149 8900.0 571.1244 790000.0 572.1184 350000.0 573.1165 300000.0 588.1275 16000.0 589.1345 1100000.0 END IONS BEGIN IONS SCANS=171 PEPMASS=442.104 CHARGE=1 COLLISION_ENERGY=0.0 57.4803 2300.0 59.0163 2100.0 70.7642 2500.0 70.7685 2400.0 73.2618 2600.0 73.2656 4100.0 74.3466 2100.0 75.1951 2400.0 76.7562 2300.0 82.0822 2200.0 105.8015 2100.0 112.0199 2400.0 123.1492 2400.0 132.0442 12000.0 135.9131 2500.0 148.0387 8300.0 149.047 5500.0 149.671 3100.0 149.6917 4500.0 150.0547 29000.0 173.5245 15000.0 173.5414 13000.0 229.3094 2100.0 233.8645 2300.0 237.0656 34000.0 238.0752 3700.0 247.0497 2400.0 265.0605 180000.0 266.0683 11000.0 267.0791 3100.0 268.0616 5000.0 275.0442 8600.0 288.9393 2300.0 292.9784 10000.0 293.0555 2400000.0 293.1172 5500.0 293.133 9900.0 294.0625 11000.0 295.072 27000.0 299.825 2300.0 307.0705 4300.0 323.0624 2400.0 335.0649 8500.0 340.1075 6400.0 350.0899 3100.0 358.1182 7900.0 368.1021 37000.0 369.0876 11000.0 378.0852 7300.0 385.1011 4700.0 386.1133 75000.0 395.0901 4000.0 396.0368 4200.0 396.0976 160000.0 397.085 35000.0 398.0914 13000.0 399.0787 2800.0 406.0821 14000.0 407.0902 16000.0 408.0966 2700.0 413.0984 8800.0 414.1081 310000.0 415.0871 2700.0 424.0926 140000.0 425.0067 3500.0 425.0261 3300.0 425.0991 220000.0 426.0842 65000.0 427.0818 3400.0 441.0949 9600.0 442.1029 790000.0 442.177 3200.0 END IONS BEGIN IONS SCANS=172 PEPMASS=297.0875 CHARGE=1 COLLISION_ENERGY=0.0 53.2907 2400.0 54.876 2500.0 65.0385 4400.0 74.269 2400.0 79.0539 2300.0 92.0492 9800.0 105.0331 13000.0 120.0441 370000.0 132.044 25000.0 134.0601 4700.0 136.0393 5600.0 147.9958 3200.0 148.0113 13000.0 148.0389 3500000.0 148.0504 17000.0 148.0606 11000.0 148.0646 37000.0 148.0749 8000.0 149.0468 600000.0 149.0581 3500.0 150.0546 86000.0 162.0544 11000.0 164.034 21000.0 173.5346 39000.0 187.0501 14000.0 194.944 2900.0 195.0915 8900.0 196.0755 3200.0 199.0628 8000.0 202.051 2500.0 205.0763 8400.0 206.0596 4500.0 217.8917 6900.0 220.9773 2900.0 222.0762 3200.0 223.0862 34000.0 224.0704 21000.0 227.9504 13000.0 232.9895 3300.0 233.0708 32000.0 234.0557 5200.0 237.9347 3600.0 240.0856 6500.0 241.0954 20000.0 250.0727 3200.0 251.0811 900000.0 252.0652 47000.0 255.9469 7900.0 261.0656 45000.0 262.074 18000.0 267.075 5200.0 268.0797 9900.0 269.0854 57000.0 270.076 290000.0 273.9563 21000.0 279.0763 830000.0 280.0528 4000.0 280.0844 93000.0 281.0685 37000.0 296.0789 76000.0 297.0078 3700.0 297.0864 1100000.0 END IONS BEGIN IONS SCANS=173 PEPMASS=313.0825 CHARGE=1 COLLISION_ENERGY=0.0 51.0369 2300.0 53.8954 2700.0 54.585 2200.0 57.0463 2200.0 80.0494 11000.0 80.07 2200.0 80.0899 2100.0 82.8822 2300.0 86.3019 2700.0 89.9692 2500.0 90.7609 2800.0 96.0446 2300.0 104.0494 19000.0 108.0441 8900.0 111.0914 2200.0 112.4247 2800.0 120.0443 34000.0 122.0236 30000.0 124.0391 10000.0 128.8527 2200.0 132.0443 170000.0 136.0392 120000.0 138.0548 7600.0 148.0392 210000.0 149.0471 100000.0 150.0386 8200.0 150.0548 500000.0 156.5001 2900.0 162.0552 33000.0 164.0017 11000.0 164.0085 7300.0 164.0224 9600.0 164.0342 3800000.0 164.0601 7800.0 164.0666 19000.0 164.0752 4400.0 165.0419 70000.0 166.0497 10000.0 172.962 2500.0 173.5249 16000.0 173.5314 47000.0 173.5439 10000.0 174.0554 3100.0 176.0342 5300.0 179.2009 2400.0 184.076 9300.0 186.0543 2600.0 193.0762 6400.0 194.0602 13000.0 196.0754 18000.0 200.0691 3100.0 202.0501 18000.0 211.0867 54000.0 212.0708 50000.0 221.0709 58000.0 222.0553 63000.0 222.0782 13000.0 223.0631 32000.0 223.0859 12000.0 224.0707 69000.0 225.0662 3000.0 229.097 27000.0 231.8763 2500.0 237.0673 3700.0 238.0734 47000.0 239.06 3600.0 239.0815 320000.0 239.1094 4400.0 239.1895 2200.0 240.0653 130000.0 240.0897 29000.0 241.0974 32000.0 243.8757 2300.0 249.0659 200000.0 250.0498 69000.0 250.0734 2500.0 251.0569 12000.0 251.0828 7700.0 252.0654 55000.0 253.0604 3100.0 257.0918 56000.0 262.0038 8600.0 266.0682 32000.0 267.0763 740000.0 268.0603 260000.0 268.0854 3200.0 269.0679 51000.0 270.0635 2400.0 271.9867 19000.0 274.206 2500.0 275.8904 2700.0 277.061 320000.0 278.04 8700.0 278.0691 63000.0 280.8533 2500.0 283.0713 8400.0 284.0785 16000.0 285.0871 550000.0 293.0569 2700.0 294.063 12000.0 295.0715 330000.0 296.0538 11000.0 313.0811 110000.0 END IONS BEGIN IONS SCANS=174 PEPMASS=259.988 CHARGE=1 COLLISION_ENERGY=0.0 45.2152 2300.0 47.6315 2200.0 48.6712 2000.0 50.8257 3200.0 53.5839 2000.0 53.8192 2000.0 55.5576 2000.0 55.9341 27000.0 56.4222 2500.0 56.7825 2300.0 57.0578 2100.0 58.1221 2400.0 58.3336 2100.0 60.2289 2800.0 62.0749 2300.0 62.2261 3000.0 66.4587 2500.0 69.0698 2700.0 79.3958 2200.0 81.5981 2200.0 81.6495 2100.0 85.4647 2300.0 92.3983 2800.0 95.668 2100.0 103.3598 2100.0 109.8869 2400.0 110.105 2600.0 110.8915 2500.0 112.0752 2600.0 119.8712 2400.0 124.64 2400.0 125.553 2400.0 129.7665 2700.0 131.0493 3000.0 135.614 2200.0 138.1881 2800.0 144.1554 2700.0 145.0284 19000.0 148.0391 3000.0 153.825 2300.0 161.907 2300.0 162.9715 3400.0 163.0387 8600.0 173.531 50000.0 173.5394 7600.0 175.0392 57000.0 180.9818 11000.0 187.6966 2300.0 190.8732 2800.0 190.9652 3100.0 196.968 3000.0 207.9695 31000.0 208.8842 8000.0 208.9771 140000.0 218.9602 2600.0 218.9814 3700.0 222.9565 84000.0 222.9771 3200.0 226.9874 16000.0 229.478 2500.0 231.9894 2600.0 235.9638 13000.0 236.9716 400000.0 236.9996 3500.0 244.9804 4100.0 250.9512 170000.0 254.982 93000.0 255.0087 3500.0 260.1284 3700.0 END IONS BEGIN IONS SCANS=175 PEPMASS=311.0669 CHARGE=1 COLLISION_ENERGY=0.0 49.4745 2400.0 50.6025 2100.0 54.4188 2300.0 56.6849 2300.0 58.1245 2300.0 60.1313 2500.0 60.959 2100.0 64.3304 2500.0 65.5853 3000.0 71.6217 2300.0 73.3059 2700.0 74.154 2200.0 74.8484 2600.0 75.6579 2300.0 75.8553 2700.0 76.2613 2300.0 79.5012 2600.0 82.0535 2900.0 86.1777 2600.0 91.0538 20000.0 91.116 2400.0 91.2359 2700.0 93.7194 2400.0 96.0441 8100.0 98.847 2600.0 100.2042 2100.0 102.8224 2400.0 110.8191 2600.0 114.0214 2300.0 114.7684 2300.0 117.0831 2800.0 121.2278 2900.0 121.4258 2600.0 125.2859 2400.0 131.837 2500.0 136.8033 2300.0 146.0267 11000.0 147.0291 4000.0 148.039 41000.0 149.0471 6200.0 149.6646 5800.0 149.6862 13000.0 149.6935 3900.0 155.7438 2500.0 156.3903 2600.0 156.822 2600.0 164.5408 2300.0 170.7159 2300.0 171.3499 2200.0 173.5218 17000.0 173.5349 84000.0 175.6819 2500.0 176.9773 2600.0 179.9891 2400.0 182.3404 2600.0 199.0872 3800.0 209.071 52000.0 210.0551 30000.0 212.0695 6100.0 213.0669 3000.0 227.0814 76000.0 231.177 2200.0 237.0659 290000.0 238.0496 92000.0 238.0735 8400.0 239.0564 3300.0 240.0647 13000.0 241.0604 20000.0 243.3523 2400.0 247.0497 17000.0 254.0683 16000.0 255.0761 180000.0 265.0605 500000.0 265.086 2500.0 266.0449 38000.0 266.0728 2600.0 267.0525 52000.0 267.9745 2600.0 268.0605 19000.0 269.0561 18000.0 273.6149 2800.0 275.0445 14000.0 276.0536 3000.0 282.0643 27000.0 283.0379 4600.0 283.0714 270000.0 284.0567 3100.0 288.7283 2600.0 293.0557 170000.0 294.0657 6400.0 311.0662 470000.0 312.2047 2600.0 END IONS BEGIN IONS SCANS=176 PEPMASS=260.9958 CHARGE=1 COLLISION_ENERGY=0.0 56.1382 2400.0 72.9372 5300.0 90.9475 3300.0 103.1401 2500.0 132.0442 14000.0 136.0391 19000.0 148.0392 5600.0 148.0626 7100.0 149.6686 2700.0 149.6896 5200.0 151.9793 2900.0 152.9638 3300.0 155.9748 4100.0 163.9791 23000.0 164.0334 2600.0 166.9783 3300.0 168.9582 3700.0 170.0596 2700.0 171.0548 5800.0 173.5313 7100.0 173.9638 4300.0 176.0285 5400.0 179.9743 9500.0 181.9897 9300.0 182.9739 45000.0 183.9693 11000.0 187.0866 22000.0 191.9742 68000.0 192.0238 9800.0 194.0391 31000.0 195.9689 5100.0 200.9843 6800.0 207.9692 20000.0 208.953 15000.0 208.9741 3800.0 209.9848 210000.0 210.0341 30000.0 215.0814 75000.0 219.9692 46000.0 220.0185 7500.0 220.862 2800.0 220.9783 3200.0 223.9633 7900.0 225.9793 5700.0 227.9943 4500.0 236.9706 3300.0 237.9794 220000.0 238.0279 9700.0 247.9735 2600.0 251.9582 28000.0 255.9881 11000.0 END IONS BEGIN IONS SCANS=177 PEPMASS=295.0719 CHARGE=1 COLLISION_ENERGY=0.0 49.4126 2500.0 52.2099 2600.0 60.7256 2500.0 65.4934 2700.0 66.7671 2900.0 66.7695 9900.0 73.7699 2400.0 75.2093 2300.0 77.5564 2600.0 80.9108 2400.0 98.3531 2400.0 101.7468 3000.0 105.2208 2200.0 105.5145 2400.0 106.0495 2400.0 121.2927 2400.0 148.0392 15000.0 149.0466 8000.0 159.0097 2500.0 166.0647 2800.0 167.3279 2400.0 173.5347 63000.0 175.0382 3700.0 183.0914 22000.0 184.0754 11000.0 185.4618 2500.0 187.9002 2300.0 193.076 100000.0 194.0598 9100.0 197.0697 2700.0 198.056 6100.0 199.0625 13000.0 207.066 3800.0 211.0864 120000.0 212.0708 20000.0 215.8953 18000.0 216.7008 2100.0 221.0708 150000.0 222.055 25000.0 222.0781 17000.0 223.0855 4300.0 225.066 24000.0 226.0495 11000.0 227.0565 5700.0 229.9927 17000.0 230.9948 35000.0 238.0736 75000.0 239.0541 7600.0 239.0814 500000.0 240.0652 26000.0 244.9735 16000.0 249.0657 220000.0 250.0489 11000.0 250.0751 16000.0 253.061 7600.0 253.9305 11000.0 254.0242 4300.0 266.0687 13000.0 267.0083 8900.0 267.0243 6600.0 267.0763 3300000.0 267.1428 15000.0 268.0598 11000.0 271.5656 2400.0 272.0359 2300.0 272.065 2300.0 277.061 100000.0 278.0686 110000.0 294.0643 12000.0 295.0307 3600.0 295.0409 6200.0 295.0716 1800000.0 END IONS BEGIN IONS SCANS=178 PEPMASS=258.9802 CHARGE=1 COLLISION_ENERGY=0.0 50.6535 2100.0 52.2459 2600.0 52.4044 2600.0 55.6725 2500.0 55.9343 2900.0 59.2729 2100.0 60.4539 2300.0 63.869 2300.0 72.9367 3600.0 73.0602 2300.0 74.0331 2600.0 89.0181 2200.0 90.9473 3000.0 94.9003 2400.0 98.4902 2100.0 132.856 2700.0 136.9678 7700.0 151.9788 49000.0 154.9792 2800.0 164.0058 2200.0 170.5992 2800.0 173.527 10000.0 173.5329 26000.0 179.9736 10000.0 183.5189 2300.0 193.5318 2800.0 207.8754 4600.0 207.9691 21000.0 207.9894 23000.0 225.9793 5400.0 228.726 2600.0 235.9636 340000.0 235.986 8400.0 245.709 2800.0 253.9744 81000.0 END IONS BEGIN IONS SCANS=179 PEPMASS=307.0018 CHARGE=1 COLLISION_ENERGY=0.0 48.9343 2400.0 50.2707 2200.0 55.9343 13000.0 56.9422 5000.0 60.1329 2600.0 67.0175 2700.0 72.9372 13000.0 76.5002 2800.0 80.2201 2300.0 90.0107 2300.0 90.9476 16000.0 94.8822 2400.0 99.8131 3000.0 100.0838 2300.0 105.8619 2600.0 107.4852 2500.0 112.0546 2700.0 113.9634 6100.0 114.1784 2100.0 120.0076 4000.0 125.2953 2200.0 128.9629 3300.0 132.0426 2300.0 137.686 2500.0 138.0547 37000.0 140.0336 14000.0 148.039 100000.0 149.6886 4300.0 150.0546 3100.0 151.9791 21000.0 163.9791 6600.0 164.034 51000.0 165.0419 33000.0 166.0493 20000.0 167.9734 8000.0 173.5265 19000.0 173.5404 14000.0 175.9791 40000.0 177.9586 4700.0 179.9742 65000.0 181.9897 5900.0 182.015 2400.0 182.9742 4700.0 184.2664 3000.0 191.9743 54000.0 193.9895 12000.0 195.9691 68000.0 197.3075 2400.0 197.9847 35000.0 203.9741 30000.0 207.9691 120000.0 208.8845 6600.0 209.9501 4400.0 209.9849 360000.0 212.0009 5200.0 213.9799 22000.0 219.9692 380000.0 220.9773 19000.0 221.9848 1400000.0 223.9641 57000.0 225.9794 48000.0 227.8952 3200.0 227.9954 17000.0 234.0405 3000.0 235.9637 87000.0 236.9697 2700.0 237.9395 3400.0 237.9797 970000.0 238.9866 3600.0 239.9952 1200000.0 241.9744 29000.0 251.9587 150000.0 253.9742 43000.0 255.9901 590000.0 258.0013 2900.0 260.9472 2800.0 260.996 3300.0 263.0111 18000.0 265.9748 34000.0 269.9697 30000.0 273.9994 8100.0 279.0064 7700.0 283.9855 41000.0 301.5184 2800.0 305.7437 2700.0 END IONS BEGIN IONS SCANS=180 PEPMASS=265.9749 CHARGE=1 COLLISION_ENERGY=0.0 46.8109 2500.0 47.3872 2300.0 55.9342 3300.0 58.1402 2200.0 60.431 2400.0 65.1848 2100.0 68.7114 2500.0 73.5588 2400.0 79.0454 2100.0 84.4574 2900.0 85.8264 2600.0 110.3119 2600.0 113.5017 2400.0 113.7665 2500.0 122.9355 2600.0 141.9475 2500.0 148.6243 2500.0 149.6873 5800.0 161.7122 2100.0 163.1416 2700.0 173.5222 3400.0 173.5357 26000.0 175.9798 6600.0 177.0547 22000.0 178.058 45000.0 184.6347 3000.0 186.9011 14000.0 197.3179 2700.0 209.9845 4000.0 214.8956 44000.0 219.9687 8000.0 221.9812 14000.0 237.9787 12000.0 244.2488 2700.0 247.292 2300.0 264.071 2400.0 269.5096 2600.0 END IONS BEGIN IONS SCANS=181 PEPMASS=314.1393 CHARGE=1 COLLISION_ENERGY=0.0 48.0593 2600.0 48.7916 2400.0 48.9361 2200.0 52.7648 2200.0 53.2806 2400.0 53.5809 2300.0 55.5376 2400.0 58.0652 6600.0 63.6761 2400.0 64.3517 2400.0 74.5244 2800.0 74.7766 4300.0 74.7808 7000.0 76.1561 2600.0 77.7027 2200.0 78.5323 4900.0 78.5354 13000.0 90.5078 2100.0 91.0541 2900.0 93.9821 2400.0 95.0491 6500.0 102.1065 2500.0 105.0699 14000.0 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138.0569 2200.0 145.0492 2400.0 147.0437 69000.0 173.5208 5400.0 173.537 39000.0 195.0875 2700.0 195.1104 2400.0 195.597 2400.0 196.0968 16000.0 226.6119 2400.0 227.2518 2800.0 231.1171 2800.0 256.5139 2900.0 271.8047 2400.0 END IONS BEGIN IONS SCANS=183 PEPMASS=476.2283 CHARGE=1 COLLISION_ENERGY=0.0 58.0649 140000.0 69.0335 3800.0 71.5452 2400.0 72.4267 2300.0 73.1909 2200.0 81.6172 2300.0 81.7027 2200.0 85.028 8700.0 89.4805 2400.0 89.5442 2200.0 107.0487 140000.0 114.4211 2300.0 121.0645 27000.0 127.0386 3800.0 137.0594 39000.0 140.9826 2200.0 143.0488 43000.0 145.0283 2900.0 145.0644 24000.0 147.0802 10000.0 151.0751 3300.0 157.509 2500.0 163.0745 2900.0 167.018 2200.0 173.5242 9000.0 173.5335 31000.0 173.5427 3900.0 175.0752 25000.0 179.929 2500.0 194.1189 2500.0 211.1114 6300.0 219.2159 2400.0 237.0909 26000.0 239.1056 11000.0 269.117 180000.0 271.1325 53000.0 314.1749 420000.0 314.2069 2500.0 414.6381 2800.0 454.7393 2300.0 476.227 560000.0 476.3406 3500.0 END IONS BEGIN IONS 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180.8807 3500.0 181.0495 490000.0 181.0663 2500.0 181.0856 9900.0 185.928 3400.0 203.9397 4000.0 209.0793 2500.0 230.7062 2700.0 END IONS BEGIN IONS SCANS=185 PEPMASS=286.1442 CHARGE=1 COLLISION_ENERGY=0.0 49.3771 2100.0 54.3126 2300.0 56.62 2600.0 57.7286 2500.0 58.065 2700.0 60.3168 2400.0 67.1082 2400.0 67.3846 2200.0 76.8553 2600.0 82.4014 2600.0 85.5691 2300.0 86.7131 2400.0 91.054 8500.0 95.049 6300.0 104.2238 2200.0 105.0695 2300.0 107.032 3700.0 107.0406 3900.0 107.0487 1200000.0 107.0573 13000.0 108.0302 2500.0 108.1302 2200.0 115.0538 60000.0 117.0695 8400.0 119.0488 17000.0 121.0644 90000.0 123.0436 140000.0 131.0486 5300.0 133.0646 22000.0 135.0439 20000.0 137.0595 19000.0 140.8038 2800.0 143.0363 3700.0 143.0488 240000.0 145.0644 140000.0 147.0438 5200.0 147.0802 2400.0 149.0593 19000.0 151.075 8200.0 154.6457 2300.0 157.0642 2600.0 161.0593 230000.0 163.0751 15000.0 166.0863 11000.0 173.5227 23000.0 173.5322 15000.0 173.5397 45000.0 175.0761 5800.0 177.6405 2700.0 178.086 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249.4624 9100.0 251.1067 68000.0 253.1221 120000.0 254.0935 630000.0 256.109 110000.0 262.8536 8600.0 267.1007 18000.0 269.1169 9100000.0 269.1441 13000.0 271.1326 2700000.0 282.1488 420000.0 295.7681 20000.0 299.1158 45000.0 299.1516 170000.0 314.09 18000.0 314.1748 12000000.0 314.2074 120000.0 END IONS BEGIN IONS SCANS=187 PEPMASS=463.0843 CHARGE=1 COLLISION_ENERGY=0.0 58.2436 2600.0 58.3518 2500.0 61.9142 2300.0 63.1569 2400.0 71.737 2200.0 76.5545 2000.0 77.4715 2400.0 79.7907 2100.0 82.897 3000.0 84.557 2400.0 86.022 2700.0 97.495 2300.0 101.0198 2400.0 102.1988 2100.0 105.5533 2700.0 107.0489 160000.0 115.3991 2500.0 135.6958 2900.0 137.0595 36000.0 139.1784 2500.0 143.049 11000.0 145.0645 24000.0 151.0618 4100.0 151.0752 130000.0 163.0752 11000.0 173.5215 8400.0 173.5359 47000.0 175.0752 66000.0 177.0544 14000.0 178.086 2900.0 187.0061 26000.0 199.423 2200.0 209.0963 13000.0 237.0909 71000.0 249.7388 2600.0 269.1171 990000.0 286.1439 600000.0 292.0454 2800.0 317.049 19000.0 337.0768 3400.0 349.0739 370000.0 354.6861 2400.0 365.6221 2400.0 366.1004 760000.0 END IONS BEGIN IONS SCANS=188 PEPMASS=579.1504 CHARGE=1 COLLISION_ENERGY=0.0 64.069 2200.0 67.9748 3400.0 68.9972 36000.0 74.5896 4400.0 77.76 4700.0 80.4093 3200.0 81.0334 38000.0 91.8649 3100.0 93.0326 2900.0 94.7594 3400.0 95.049 20000.0 95.0661 3600.0 97.5877 3300.0 99.0433 5000.0 104.5003 3400.0 107.049 14000.0 109.0282 39000.0 110.9796 3000.0 111.0075 65000.0 111.044 44000.0 112.9825 3900.0 119.0491 12000.0 119.197 4300.0 119.7994 4700.0 123.0439 2000000.0 123.0525 18000.0 127.0388 6200000.0 127.047 63000.0 131.0486 3600.0 135.0439 750000.0 135.0559 31000.0 137.0231 58000.0 138.4362 2300.0 139.0388 3600000.0 141.8822 2300.0 147.0439 240000.0 147.3388 3700.0 149.0232 85000.0 149.0597 4900.0 151.0388 490000.0 155.0342 4200.0 159.0439 66000.0 161.0596 140000.0 163.0388 2500000.0 163.052 22000.0 163.0718 3700.0 165.0545 430000.0 167.0338 410000.0 167.05 5600.0 169.0493 47000.0 173.0598 34000.0 173.2678 2500.0 173.5293 140000.0 173.5346 33000.0 173.545 21000.0 175.039 31000.0 176.3088 3300.0 177.0546 86000.0 179.0337 190000.0 179.0702 2800.0 179.8385 5200.0 181.0495 55000.0 185.0598 7700.0 187.0389 280000.0 189.0548 34000.0 191.0338 290000.0 193.0496 41000.0 197.0591 42000.0 201.0546 170000.0 203.0339 180000.0 203.0701 130000.0 205.0495 240000.0 205.0852 2800.0 207.0652 120000.0 213.0549 9700.0 215.0337 17000.0 215.0702 90000.0 217.0492 32000.0 219.0649 8500.0 221.0445 6800.0 225.0546 59000.0 227.0683 4900.0 229.0244 4400.0 229.0495 320000.0 231.0651 68000.0 233.0443 750000.0 241.0493 56000.0 243.0648 460000.0 245.0442 390000.0 247.0302 5100.0 247.0597 1200000.0 247.0819 4100.0 247.0902 15000.0 249.0754 30000.0 251.0546 230000.0 253.0492 70000.0 255.065 88000.0 257.044 760000.0 257.0761 6900.0 258.0515 13000.0 259.0283 11000.0 259.0596 770000.0 259.0846 7400.0 261.0747 70000.0 265.0488 7100.0 269.0444 270000.0 271.025 16000.0 271.0345 4500.0 271.06 1600000.0 273.0756 160000.0 274.886 2500.0 275.0201 39000.0 275.0299 4600.0 275.0549 1400000.0 275.0898 34000.0 283.024 17000.0 283.06 800000.0 283.0964 9400.0 285.0421 6800.0 285.0759 49000.0 287.0265 8300.0 287.055 3000000.0 289.0707 150000.0 291.0863 180000.0 295.0587 13000.0 297.075 24000.0 299.055 520000.0 299.0936 6500.0 299.2197 2500.0 301.0705 350000.0 303.0864 75000.0 311.0549 80000.0 325.07 53000.0 341.1029 9700.0 343.0807 3100.0 367.081 43000.0 379.08 38000.0 391.0801 81000.0 409.0912 950000.0 411.1068 130000.0 421.094 25000.0 427.1003 7800.0 433.1005 2600.0 435.1052 31000.0 490.9424 5200.0 520.234 3300.0 END IONS BEGIN IONS SCANS=189 PEPMASS=298.1442 CHARGE=1 COLLISION_ENERGY=0.0 47.4435 2600.0 47.773 78000.0 47.7747 8600.0 47.9493 3400.0 48.0251 21000.0 48.0264 4600.0 48.0803 2300.0 51.4611 2500.0 51.5625 3700.0 52.2511 2100.0 53.7113 4100.0 56.0495 15000.0 58.0651 2100000.0 61.1351 2200.0 62.8938 2700.0 63.5368 2300.0 63.6242 2400.0 70.8794 2700.0 71.0728 23000.0 74.4666 3600.0 77.1997 4500.0 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163.0754 56000.0 163.099 35000.0 164.1071 58000.0 170.5391 2500.0 170.8956 2400.0 173.0594 29000.0 173.0837 150000.0 173.5232 58000.0 173.5356 110000.0 173.5432 30000.0 174.0775 2900.0 174.0914 870000.0 174.1051 3400.0 175.0992 24000.0 176.0708 1200000.0 176.0845 5300.0 176.1069 9500.0 177.0608 3800.0 177.0785 1500000.0 177.0919 5700.0 178.0862 380000.0 179.0859 28000.0 181.0653 4900.0 182.4985 3100.0 182.7744 2300.0 183.3216 2700.0 185.0709 6500.0 186.0436 2800.0 186.0912 76000.0 188.0704 17000.0 189.0782 120000.0 189.9556 4100.0 190.0863 500000.0 190.8955 3300.0 191.0188 6500.0 191.0416 16000.0 191.0532 150000.0 191.0616 70000.0 191.0941 23000000.0 191.1265 130000.0 191.1345 170000.0 191.1461 49000.0 191.1576 30000.0 192.0606 24000.0 192.1019 7700000.0 192.1224 8500.0 192.1424 14000.0 194.9701 3600.0 195.9587 3500.0 197.0963 20000.0 199.076 22000.0 202.0862 39000.0 204.102 210000.0 207.0576 9600.0 207.0807 610000.0 208.2188 2600.0 209.0607 4000.0 209.0965 9700.0 210.0676 4000.0 213.0663 11000.0 218.8884 23000.0 221.096 10000.0 225.0269 4300.0 225.0909 76000.0 227.0703 4600.0 234.4553 2600.0 235.0484 21000.0 235.0754 680000.0 235.1004 4500.0 236.0832 4100.0 236.9021 3000.0 237.091 15000.0 243.3736 3700.0 246.8859 10000.0 251.0813 3300.0 251.8541 3900.0 252.1386 27000.0 253.0859 410000.0 255.1017 84000.0 265.1097 14000.0 280.1333 87000.0 282.112 17000.0 283.1201 54000.0 296.1284 110000.0 296.9865 2300.0 298.1441 470000.0 END IONS BEGIN IONS SCANS=190 PEPMASS=272.1283 CHARGE=1 COLLISION_ENERGY=0.0 51.6276 2200.0 52.1304 2100.0 53.137 2100.0 55.0178 5400.0 59.1029 2200.0 63.6707 2500.0 77.0385 3000.0 79.0542 14000.0 86.7522 2900.0 91.0542 21000.0 95.049 20000.0 97.317 2300.0 103.0545 6800.0 104.7614 2100.0 105.0444 3100.0 105.0698 18000.0 107.0319 6000.0 107.049 2800000.0 107.0658 12000.0 115.0451 3700.0 115.0541 170000.0 115.9801 2300.0 117.0697 16000.0 119.049 35000.0 121.0283 20000.0 121.0646 87000.0 123.0335 4500.0 123.0439 260000.0 127.0538 3100.0 130.4469 2400.0 131.0491 28000.0 133.0647 49000.0 133.8714 2400.0 134.2493 2400.0 135.044 52000.0 136.0752 4700.0 137.0594 24000.0 143.0361 4200.0 143.049 490000.0 143.0606 4400.0 144.2052 2300.0 145.0518 2900.0 145.0646 270000.0 147.0441 8700.0 148.6515 2300.0 149.0595 29000.0 155.0602 2400.0 161.044 8500.0 161.0596 460000.0 161.0754 13000.0 162.0672 7100.0 164.0706 160000.0 166.079 2600.0 171.082 2900.0 173.5186 8400.0 173.534 78000.0 178.086 9300.0 181.0643 14000.0 181.1012 25000.0 191.0853 39000.0 194.0724 33000.0 195.0808 7300.0 199.0747 6000.0 203.883 26000.0 205.8987 3300.0 209.0607 7900.0 209.0961 160000.0 216.8911 3500.0 219.0804 33000.0 220.0887 2600.0 222.0671 2600.0 226.0623 34000.0 227.07 2700.0 227.107 16000.0 237.0909 170000.0 240.0779 35000.0 255.07 5600.0 255.1013 490000.0 255.1324 10000.0 272.1278 55000.0 END IONS BEGIN IONS SCANS=191 PEPMASS=344.1861 CHARGE=1 COLLISION_ENERGY=0.0 50.4313 2400.0 50.9239 2300.0 54.2824 2400.0 58.0651 960000.0 58.068 6400.0 58.1151 2300.0 59.7034 2500.0 85.8804 2400.0 86.4003 2400.0 88.6502 2200.0 89.0593 170000.0 91.0535 2800.0 123.0336 4500.0 123.0437 250000.0 125.0795 2700.0 133.0857 41000.0 136.0518 2600.0 136.9394 2600.0 137.0594 58000.0 140.4634 2300.0 143.049 15000.0 149.0585 3000.0 151.0752 54000.0 158.0728 11000.0 161.0596 40000.0 163.0751 33000.0 164.0832 2700.0 165.0907 29000.0 173.5298 48000.0 173.5422 6300.0 174.0673 27000.0 174.6175 2400.0 175.0759 6800.0 177.091 15000.0 189.0909 200000.0 190.0988 4200.0 190.123 4800.0 191.1062 2700.0 206.1174 27000.0 207.1253 21000.0 208.1336 5800.0 241.1185 2500.0 251.1058 2500.0 268.1091 29000.0 281.1165 2700.0 284.1047 28000.0 286.1205 3800.0 289.1201 2600.0 299.128 120000.0 301.1435 24000.0 329.1635 3300.0 344.1855 180000.0 END IONS BEGIN IONS SCANS=192 PEPMASS=279.1708 CHARGE=1 COLLISION_ENERGY=0.0 49.7305 2600.0 64.9107 2200.0 72.6184 2500.0 74.7688 2300.0 86.0963 34000.0 89.0384 11000.0 94.2644 2300.0 103.1233 8300.0 117.0334 62000.0 118.3118 2300.0 120.9509 2300.0 134.0369 2500.0 145.0282 600000.0 149.0231 9000.0 149.0594 34000.0 163.0389 4400.0 172.6423 2600.0 173.0508 5200.0 173.5335 24000.0 177.0546 1000000.0 186.0551 2800.0 201.0465 31000.0 219.057 220000.0 219.0817 3500.0 279.0932 160000.0 END IONS BEGIN IONS SCANS=193 PEPMASS=285.1239 CHARGE=1 COLLISION_ENERGY=0.0 49.8395 2400.0 50.7039 2300.0 52.1777 2100.0 67.6796 2400.0 91.0542 51000.0 95.0493 4300.0 99.9891 2600.0 107.0492 4300.0 111.3175 2400.0 118.0651 17000.0 119.0491 68000.0 120.0445 2500.0 123.044 1100000.0 123.0527 3200.0 123.0547 6200.0 123.0652 6800.0 129.5985 2700.0 130.0653 5500.0 133.0519 3700.0 136.9816 2800.0 137.0596 14000.0 146.06 970000.0 146.0738 3300.0 148.0392 54000.0 149.0471 75000.0 158.0601 8800.0 159.0675 2300.0 170.381 2300.0 173.5329 23000.0 180.0805 2500.0 185.6814 2700.0 194.0965 32000.0 195.082 3300.0 198.0914 25000.0 201.3662 2500.0 203.8832 17000.0 204.0809 6600.0 205.8986 4100.0 206.8524 2600.0 207.0683 15000.0 212.1071 12000.0 220.9784 2900.0 221.0825 4500.0 221.895 2900.0 222.0655 3500.0 222.0917 200000.0 222.117 4800.0 224.2107 2700.0 225.079 16000.0 226.214 2400.0 232.0745 3900.0 233.0834 22000.0 235.0618 4400.0 236.0694 3300.0 238.0878 3400.0 240.1021 130000.0 249.0782 5700.0 250.0863 460000.0 250.1158 4400.0 251.0942 4700.0 252.0663 3300.0 253.0732 10000.0 256.0958 5600.0 267.0883 6700.0 268.0969 550000.0 285.0884 4800.0 END IONS BEGIN IONS SCANS=194 PEPMASS=328.1548 CHARGE=1 COLLISION_ENERGY=0.0 49.7222 2200.0 50.7822 2400.0 53.4818 2400.0 55.2758 14000.0 55.2772 3700.0 56.4647 2700.0 57.7077 2400.0 58.0649 62000.0 61.4037 2500.0 62.1018 2300.0 63.5819 2300.0 68.2005 2600.0 68.6325 2500.0 72.0443 2500.0 77.6448 2400.0 81.3436 2300.0 85.9045 3000.0 86.1764 2400.0 93.0695 5600.0 98.282 2300.0 102.9273 2400.0 107.0489 320000.0 107.0575 4100.0 111.444 2200.0 114.5152 2400.0 115.6307 2400.0 119.7623 2800.0 121.0645 100000.0 131.0488 14000.0 136.0755 9100.0 140.5822 2600.0 141.3195 2400.0 147.0439 29000.0 148.0517 52000.0 150.0908 5200.0 153.0544 6800.0 156.5313 2300.0 159.0441 16000.0 161.0596 6300.0 162.0912 44000.0 163.039 4700.0 166.1225 46000.0 173.5286 30000.0 173.5413 15000.0 175.0987 2600.0 176.0468 88000.0 176.7163 2300.0 177.0545 41000.0 178.0622 33000.0 178.0865 6100.0 179.0699 25000.0 183.2207 2800.0 189.055 5600.0 189.0776 3100.0 190.0862 120000.0 191.0703 45000.0 191.094 37000.0 192.0651 6900.0 192.1039 3400.0 194.1172 4200.0 195.0805 32000.0 196.824 2400.0 203.094 51000.0 206.0811 800000.0 206.0988 3300.0 207.0889 210000.0 208.0965 17000.0 220.0967 32000.0 221.1046 4000000.0 221.1555 26000.0 222.1124 910000.0 222.1378 5800.0 223.0755 80000.0 229.5221 2800.0 233.0589 3300.0 251.0699 85000.0 253.0868 10000.0 255.1016 44000.0 273.4193 2600.0 283.0972 27000.0 302.0762 2500.0 304.4926 2400.0 309.7039 2200.0 311.8787 2500.0 313.129 2500.0 328.154 36000.0 END IONS BEGIN IONS SCANS=195 PEPMASS=716.2221 CHARGE=1 COLLISION_ENERGY=0.0 68.9969 3600.0 74.2791 2200.0 75.0441 12000.0 85.0283 8200.0 89.0593 7800.0 91.054 30000.0 93.0332 78000.0 93.0697 13000.0 95.049 12000.0 95.0668 2500.0 95.0743 2300.0 97.0645 2600.0 98.8162 2300.0 103.0542 6600.0 106.0411 48000.0 107.049 11000.0 111.0434 2800.0 120.108 2700.0 121.0284 5200.0 121.0556 2200.0 121.0645 100000.0 125.0595 56000.0 126.9521 2600.0 127.2786 2400.0 131.0485 12000.0 134.0359 9700.0 135.0438 7600.0 137.0596 2800.0 139.0754 8300.0 145.0278 12000.0 145.0642 4400.0 147.0436 2500.0 149.0459 3300.0 149.0595 290000.0 151.0754 18000.0 153.0541 12000.0 153.0908 100000.0 155.0679 2600.0 156.6028 2400.0 160.0518 2500.0 163.0388 48000.0 163.0754 9000.0 167.0701 53000.0 173.0597 14000.0 173.5283 15000.0 173.5377 30000.0 177.0546 270000.0 177.4534 2900.0 179.0703 32000.0 180.0421 16000.0 181.0488 9900.0 181.0677 3700.0 181.0859 210000.0 182.094 19000.0 191.0703 52000.0 192.0781 30000.0 195.0651 41000.0 205.0858 7000.0 207.0652 27000.0 207.0872 6200.0 209.081 310000.0 210.0886 24000.0 217.0495 5800.0 217.0855 26000.0 223.0603 860000.0 223.0865 4700.0 242.4029 2600.0 261.0754 2500.0 300.4503 2300.0 301.6497 2300.0 334.9418 2300.0 355.9355 2500.0 383.1138 17000.0 595.9135 2600.0 630.4851 2400.0 646.2646 2900.0 720.3608 2900.0 END IONS BEGIN IONS SCANS=196 PEPMASS=300.1599 CHARGE=1 COLLISION_ENERGY=0.0 48.455 6500.0 53.0387 8500.0 55.0178 33000.0 58.0651 130000.0 60.3291 6600.0 60.7633 7000.0 64.436 7100.0 64.8503 8100.0 67.7597 5300.0 77.0388 27000.0 79.0542 45000.0 81.0335 9400.0 88.4188 5300.0 91.0541 140000.0 93.07 76000.0 94.4816 6400.0 95.049 150000.0 103.0542 63000.0 105.0697 76000.0 107.032 130000.0 107.049 18000000.0 107.0557 130000.0 107.062 59000.0 107.0665 220000.0 107.0708 27000.0 107.0812 14000.0 107.1617 8500.0 109.0647 84000.0 111.0435 42000.0 115.0542 460000.0 117.0698 170000.0 119.049 450000.0 119.0846 9000.0 120.5591 6400.0 121.0278 23000.0 121.0647 1600000.0 121.0792 10000.0 123.0439 42000.0 125.0595 38000.0 127.3353 7300.0 129.07 12000.0 130.2343 8700.0 131.049 470000.0 133.0289 17000.0 133.054 17000.0 133.0647 530000.0 135.0432 7900.0 135.0805 63000.0 137.0596 2300000.0 137.0694 12000.0 137.0771 24000.0 139.0751 47000.0 143.049 2000000.0 143.0587 11000.0 143.0627 9000.0 144.0569 110000.0 145.0647 2300000.0 145.0748 15000.0 145.0783 33000.0 147.0437 39000.0 147.0804 300000.0 149.0596 170000.0 149.9697 7700.0 151.0753 440000.0 155.0602 54000.0 155.0845 10000.0 157.0648 90000.0 160.0519 370000.0 161.0594 75000.0 162.0675 130000.0 162.0913 87000.0 163.0638 5600.0 163.0754 830000.0 163.0911 8900.0 164.0707 8400.0 165.0692 12000.0 165.0912 20000.0 166.0779 41000.0 167.0853 40000.0 169.0651 9000.0 169.1017 23000.0 173.526 110000.0 173.5425 59000.0 174.0916 41000.0 175.0755 4200000.0 176.0834 86000.0 177.0911 230000.0 178.0861 130000.0 179.0861 170000.0 180.1019 340000.0 181.0648 130000.0 181.1013 150000.0 182.0726 130000.0 183.0804 75000.0 189.0909 43000.0 191.086 210000.0 192.1019 320000.0 193.1091 52000.0 194.0727 180000.0 194.118 15000.0 195.0803 110000.0 196.089 7000.0 197.0621 51000.0 197.075 8100.0 197.0962 2200000.0 197.1172 21000.0 206.1178 48000.0 207.0807 140000.0 208.089 9100.0 209.0601 27000.0 209.0962 1700000.0 209.1148 7200.0 210.0678 97000.0 211.0755 66000.0 211.1119 240000.0 219.0806 310000.0 220.0875 8700.0 221.0965 74000.0 222.0673 45000.0 223.1112 53000.0 225.0652 8100.0 225.0911 1400000.0 225.1096 9600.0 225.1173 29000.0 226.0991 34000.0 227.1079 6300.0 235.075 10000.0 236.0838 37000.0 237.091 4800000.0 238.0988 160000.0 239.0707 13000.0 239.0721 49000.0 239.1067 240000.0 240.078 150000.0 241.0863 65000.0 241.1229 12000.0 242.094 55000.0 243.1015 49000.0 251.1065 170000.0 254.0936 360000.0 257.1171 1100000.0 257.1433 7400.0 261.2114 7300.0 267.1022 9400.0 268.1331 49000.0 269.1172 4600000.0 271.1328 180000.0 283.1325 60000.0 292.8751 8400.0 293.1692 6900.0 300.1596 2400000.0 300.1898 10000.0 END IONS BEGIN IONS SCANS=197 PEPMASS=434.1815 CHARGE=1 COLLISION_ENERGY=0.0 55.0178 18000.0 56.0744 4100.0 57.0334 45000.0 60.7733 2300.0 61.0283 92000.0 63.7746 29000.0 63.7766 4600.0 63.919 3000.0 67.0544 2600.0 68.0314 31000.0 68.034 7400.0 69.0334 280000.0 71.049 38000.0 73.0283 63000.0 74.7757 3300.0 78.3886 3400.0 79.0542 4000.0 81.0334 87000.0 82.6762 3600.0 85.0283 780000.0 85.033 3800.0 85.7832 3300.0 87.0439 150000.0 87.3215 3200.0 91.0389 65000.0 93.9614 3000.0 95.0491 23000.0 97.0283 280000.0 98.7216 3600.0 99.044 79000.0 101.023 15000.0 103.0385 9700.0 107.032 8800.0 107.049 4400000.0 107.0661 37000.0 109.0283 110000.0 115.0389 23000.0 115.0543 94000.0 117.0703 8500.0 119.0492 28000.0 121.0286 9800.0 121.0647 180000.0 122.1854 3900.0 123.044 840000.0 127.0389 260000.0 127.0499 2300.0 131.0491 12000.0 133.0648 50000.0 135.0439 21000.0 135.0679 31000.0 136.0757 25000.0 137.0596 83000.0 143.0491 1100000.0 145.0498 92000.0 145.0647 620000.0 146.0724 11000.0 147.0442 28000.0 147.595 3100.0 148.0755 9100.0 149.0596 85000.0 152.0709 14000.0 161.0597 1200000.0 164.0707 720000.0 164.0938 9000.0 165.078 18000.0 173.0602 13000.0 173.5245 26000.0 173.5406 31000.0 174.7803 3300.0 175.0748 4400.0 176.0711 17000.0 177.9647 3900.0 178.0865 68000.0 185.0611 3800.0 191.0857 5000.0 194.0731 5900.0 209.0608 4000.0 209.0963 110000.0 219.0805 29000.0 226.0631 33000.0 227.0701 29000.0 227.1069 55000.0 237.0912 290000.0 237.1178 5300.0 239.1067 7000.0 240.078 19000.0 243.1017 10000.0 253.0861 28000.0 254.0918 10000.0 255.0202 6900.0 255.0385 53000.0 255.0516 35000.0 255.1016 7300000.0 255.1519 26000.0 255.164 47000.0 255.182 6600.0 257.1173 11000.0 267.1018 83000.0 270.1127 96000.0 271.1208 42000.0 272.0582 64000.0 272.1282 10000000.0 272.2782 4500.0 279.1016 16000.0 296.1287 8300.0 297.1135 12000.0 314.1385 35000.0 326.1249 8500.0 334.3707 2800.0 398.1612 7400.0 416.1717 20000.0 434.1809 1500000.0 END IONS BEGIN IONS SCANS=198 PEPMASS=274.1078 CHARGE=1 COLLISION_ENERGY=0.0 48.7781 2200.0 49.3094 2300.0 53.1359 2200.0 54.2743 2200.0 55.4401 2500.0 57.3588 2300.0 58.5965 2700.0 61.4115 2800.0 66.5356 2400.0 67.7422 2400.0 77.0383 2800.0 80.4639 2400.0 81.0333 19000.0 81.6762 2600.0 91.0539 42000.0 93.0638 2700.0 93.0696 100000.0 95.0489 20000.0 99.4969 2500.0 103.0539 56000.0 105.0449 3100.0 109.0282 7400.0 109.6413 2400.0 115.8174 2500.0 117.7123 2400.0 121.0645 1600000.0 121.0734 25000.0 127.0387 14000.0 130.2968 2400.0 131.049 6200.0 137.0231 960000.0 137.0334 18000.0 138.091 35000.0 154.0496 34000.0 173.5314 70000.0 174.2057 2700.0 180.0647 4000.0 214.9274 2300.0 222.905 6900.0 246.672 2700.0 254.2483 2400.0 279.7553 2700.0 281.631 2500.0 END IONS BEGIN IONS SCANS=199 PEPMASS=595.1662 CHARGE=1 COLLISION_ENERGY=0.0 68.1561 2400.0 68.2891 2600.0 78.5007 2500.0 83.3368 2900.0 85.0281 16000.0 90.3078 2500.0 102.431 2500.0 103.0386 11000.0 103.3645 2100.0 105.4384 2500.0 108.3999 2300.0 111.3319 2900.0 120.7525 2500.0 121.0281 11000.0 152.584 2300.0 157.1058 2700.0 163.5297 2500.0 172.412 2500.0 173.5197 5100.0 173.5298 57000.0 173.5386 21000.0 223.4535 2500.0 225.7215 2300.0 256.1513 2400.0 281.0765 2800.0 283.0592 15000.0 283.2873 2700.0 287.0192 2500.0 294.0522 20000.0 295.0601 280000.0 301.1614 3400.0 307.0598 240000.0 308.0675 14000.0 309.0761 15000.0 313.07 37000.0 315.5274 2700.0 319.0602 6900.0 321.0749 26000.0 322.0848 6700.0 323.0547 27000.0 325.0704 780000.0 327.0509 2400.0 333.0762 17000.0 335.0915 38000.0 336.063 5300.0 337.0702 480000.0 347.0911 45000.0 349.0702 300000.0 349.1202 7100.0 351.0502 7100.0 351.0862 73000.0 353.0646 4900.0 355.0807 240000.0 355.1288 4800.0 357.0746 3800.0 361.0212 4600.0 361.0701 140000.0 361.1152 4500.0 363.0858 46000.0 365.0605 3300.0 365.1018 92000.0 367.0805 40000.0 373.0701 36000.0 375.0865 78000.0 375.5627 2800.0 377.0626 8300.0 379.0808 650000.0 379.1399 3100.0 385.0708 31000.0 389.1038 26000.0 391.081 340000.0 393.0972 36000.0 397.0915 9000.0 401.1027 9300.0 403.0814 340000.0 405.0975 2700.0 409.0294 4300.0 409.0916 380000.0 409.1573 3000.0 413.0988 7400.0 415.0842 36000.0 417.0975 31000.0 421.0916 290000.0 421.1525 4400.0 427.1004 210000.0 429.0981 16000.0 431.1136 21000.0 433.0924 46000.0 435.1082 11000.0 439.1022 210000.0 441.0982 15000.0 445.0917 80000.0 449.1236 16000.0 451.1003 8800.0 457.1084 160000.0 459.1043 8100.0 463.1018 110000.0 469.0951 29000.0 475.1031 54000.0 477.1138 4000.0 481.1127 110000.0 487.1023 56000.0 493.1129 28000.0 499.1226 14000.0 505.1129 56000.0 511.1224 12000.0 523.122 68000.0 541.1334 41000.0 559.1455 4300.0 589.3495 2300.0 597.1478 2400.0 END IONS BEGIN IONS SCANS=200 PEPMASS=366.1007 CHARGE=1 COLLISION_ENERGY=0.0 52.1582 2700.0 56.1261 2200.0 60.0442 3800.0 60.6836 2400.0 64.2324 2300.0 73.4578 2300.0 84.543 2800.0 88.6851 2700.0 96.2281 2700.0 107.0406 4800.0 107.0487 790000.0 107.0568 11000.0 110.9392 2400.0 112.4905 2400.0 115.0543 11000.0 115.7301 2600.0 119.0488 3400.0 121.0643 14000.0 131.0487 8300.0 137.048 3500.0 137.0593 110000.0 143.0488 74000.0 145.0643 110000.0 151.0749 43000.0 156.5767 2500.0 160.0516 5400.0 161.0601 3000.0 162.0676 8100.0 163.0751 32000.0 165.2919 2400.0 165.3075 2700.0 172.63 2400.0 173.5337 78000.0 173.5447 4400.0 175.0577 3700.0 175.075 250000.0 175.0931 2700.0 178.0861 11000.0 178.7078 2300.0 181.1008 2600.0 187.0058 34000.0 189.0412 2700.0 194.074 3800.0 209.0959 79000.0 219.0803 13000.0 237.0908 310000.0 238.7372 3000.0 254.0931 17000.0 258.1452 2900.0 269.117 890000.0 269.1437 4700.0 286.144 89000.0 317.0457 2900.0 349.0737 28000.0 356.542 2400.0 366.0999 10000.0 END IONS BEGIN IONS SCANS=201 PEPMASS=269.1174 CHARGE=1 COLLISION_ENERGY=0.0 46.0173 2100.0 48.7115 2500.0 53.7501 2300.0 54.0128 2500.0 55.7762 2200.0 55.8205 2300.0 57.3779 2100.0 62.5745 2400.0 62.8376 2300.0 62.8808 2400.0 62.9607 2400.0 63.6892 2200.0 77.0376 2600.0 79.054 6500.0 86.3018 2600.0 86.9051 2300.0 89.091 2200.0 91.0538 5300.0 95.0488 5100.0 107.0487 850000.0 107.0571 6800.0 115.0538 53000.0 117.0694 13000.0 125.5347 2300.0 131.0484 21000.0 137.0593 65000.0 143.0488 96000.0 144.0567 11000.0 145.0644 78000.0 147.08 2900.0 149.8514 2500.0 155.0604 5000.0 157.5365 2300.0 160.0514 32000.0 162.0677 3000.0 163.075 13000.0 166.0778 4000.0 169.1316 2900.0 173.521 6900.0 173.5296 13000.0 173.5396 12000.0 175.0751 98000.0 175.1015 2400.0 176.0827 3500.0 181.0642 5100.0 181.1012 7400.0 183.5016 2900.0 191.085 32000.0 194.0724 24000.0 195.0806 3400.0 197.056 2800.0 209.096 86000.0 217.2418 2300.0 219.0805 23000.0 222.0678 3500.0 237.0907 120000.0 238.0989 3800.0 239.0702 7000.0 254.0931 20000.0 266.9699 2400.0 269.1173 23000.0 END IONS BEGIN IONS SCANS=202 PEPMASS=286.1443 CHARGE=1 COLLISION_ENERGY=0.0 53.5936 19000.0 55.0178 100000.0 58.5336 17000.0 72.1167 16000.0 76.4468 16000.0 77.0385 75000.0 79.0541 160000.0 82.2612 22000.0 91.0541 290000.0 93.0699 68000.0 95.049 370000.0 103.0542 98000.0 105.0447 71000.0 107.0126 28000.0 107.0318 270000.0 107.049 52000000.0 107.0568 770000.0 107.0624 220000.0 107.0667 500000.0 107.072 140000.0 107.0775 74000.0 109.0646 110000.0 115.0541 1900000.0 116.2974 16000.0 117.0697 490000.0 119.049 330000.0 121.0281 46000.0 121.0647 990000.0 125.059 39000.0 129.0694 70000.0 131.049 1200000.0 133.0642 91000.0 137.0595 4500000.0 137.0693 24000.0 143.049 6100000.0 143.0597 150000.0 144.0568 350000.0 145.0646 4700000.0 145.0765 64000.0 147.0434 24000.0 147.08 190000.0 148.0755 81000.0 149.06 37000.0 151.0752 1000000.0 155.0601 210000.0 160.0517 1300000.0 160.075 77000.0 161.0598 160000.0 162.0675 290000.0 163.0594 18000.0 163.0753 1300000.0 165.0694 74000.0 166.0779 140000.0 167.0846 60000.0 173.5244 120000.0 173.5425 86000.0 175.0753 8800000.0 176.0832 250000.0 178.0862 440000.0 179.0841 31000.0 181.0645 430000.0 181.1011 530000.0 190.0783 63000.0 191.0854 1100000.0 194.0725 800000.0 195.0803 220000.0 197.0595 89000.0 197.096 160000.0 204.3862 17000.0 207.0797 89000.0 208.0888 32000.0 209.0596 46000.0 209.0961 4900000.0 209.1139 26000.0 211.0753 29000.0 211.6944 25000.0 212.0832 76000.0 218.0723 28000.0 219.0804 1100000.0 220.0878 79000.0 222.0678 180000.0 223.0757 20000.0 225.0913 41000.0 226.1009 20000.0 226.5099 17000.0 229.0749 54000.0 235.0745 80000.0 236.0827 84000.0 237.0908 11000000.0 237.1131 59000.0 238.0986 450000.0 239.0703 250000.0 240.0778 390000.0 241.0859 150000.0 254.0933 1200000.0 254.1155 10000.0 267.1009 59000.0 269.1169 5900000.0 286.1437 370000.0 END IONS BEGIN IONS SCANS=203 PEPMASS=239.0918 CHARGE=1 COLLISION_ENERGY=0.0 45.0333 20000.0 46.7545 2100.0 49.3816 2300.0 55.2685 2100.0 55.9343 6500.0 65.8606 2300.0 66.4161 2700.0 73.7033 2100.0 76.1465 2600.0 76.1813 2700.0 78.1351 2200.0 79.6533 2700.0 83.6646 2500.0 89.059 12000.0 91.0544 3800.0 95.7985 2200.0 109.065 3300.0 121.0646 8000.0 123.0437 3900.0 125.0587 2600.0 125.7148 3000.0 138.0673 160000.0 139.0389 2600.0 139.0753 25000.0 149.0594 20000.0 154.0622 130000.0 162.0661 3000.0 163.0392 9700.0 164.0831 20000.0 165.0553 4500.0 169.0693 7400.0 169.0859 300000.0 173.5345 36000.0 178.0622 5000.0 179.0704 14000.0 180.0773 4100.0 182.9088 2600.0 189.1554 2400.0 190.0622 9900.0 191.0342 11000.0 193.0861 13000.0 197.0808 17000.0 204.5563 2100.0 240.7866 2500.0 END IONS BEGIN IONS SCANS=204 PEPMASS=300.16 CHARGE=1 COLLISION_ENERGY=0.0 51.3136 2500.0 51.7415 2400.0 55.0009 2400.0 57.2105 2500.0 58.0649 140000.0 59.8523 2400.0 64.6631 2500.0 70.2385 2300.0 72.0439 2200.0 75.4605 2200.0 75.6734 2400.0 78.1739 2400.0 79.4854 2300.0 81.9497 2500.0 85.1561 2200.0 91.054 14000.0 93.5369 2600.0 94.622 2300.0 95.0491 8500.0 96.4099 2600.0 107.0406 4700.0 107.0489 1800000.0 107.0575 5000.0 107.0656 3300.0 109.0643 2800.0 115.0539 36000.0 117.0698 12000.0 118.0123 2300.0 118.2423 2700.0 119.0488 33000.0 121.0645 120000.0 125.8203 2800.0 131.049 41000.0 133.0644 32000.0 136.3253 2300.0 137.048 4400.0 137.0593 200000.0 138.1542 2600.0 143.0488 190000.0 145.0644 210000.0 145.9738 2500.0 147.0803 30000.0 149.0599 12000.0 151.0751 51000.0 159.8517 3100.0 160.0516 33000.0 160.725 2600.0 161.0592 15000.0 162.0677 8000.0 163.0752 69000.0 167.1274 2300.0 173.5285 67000.0 173.5423 24000.0 174.091 2600.0 175.0575 3300.0 175.0752 440000.0 175.0933 9900.0 176.0837 3500.0 177.0764 2700.0 177.091 3400.0 177.3412 2200.0 177.8664 2600.0 178.0863 20000.0 179.0928 2300.0 180.1016 27000.0 180.8885 2900.0 181.0643 12000.0 181.1009 16000.0 182.0058 2800.0 183.08 5000.0 185.9177 2500.0 191.0853 30000.0 192.1019 46000.0 193.109 2900.0 193.3759 2400.0 194.0722 24000.0 195.0804 7200.0 195.875 3100.0 197.0617 2400.0 197.096 120000.0 197.1148 4100.0 197.8907 20000.0 198.0833 2300.0 209.0962 210000.0 210.0671 3000.0 211.0754 9700.0 211.1115 23000.0 217.4424 2800.0 219.0809 30000.0 225.0907 78000.0 227.359 2800.0 237.0909 320000.0 238.0987 8100.0 239.0718 3300.0 239.1065 22000.0 240.0788 4400.0 241.0853 4000.0 243.101 7200.0 246.9629 2200.0 253.8802 8700.0 254.0935 51000.0 255.1012 7000.0 257.1169 50000.0 268.1338 13000.0 269.1171 390000.0 271.1327 18000.0 282.7471 2400.0 300.1211 8300.0 300.1596 220000.0 300.1966 4600.0 308.4383 2400.0 END IONS BEGIN IONS SCANS=205 PEPMASS=426.0515 CHARGE=1 COLLISION_ENERGY=0.0 56.8888 2300.0 57.4982 2400.0 63.0556 2300.0 63.23 2400.0 71.5476 2300.0 71.918 2200.0 73.1507 2200.0 79.9587 2200.0 80.4619 2300.0 84.8456 2200.0 87.0706 2100.0 87.6863 2600.0 91.2345 2500.0 93.6229 2600.0 94.1228 2800.0 98.5128 2700.0 101.2826 2500.0 101.4207 2200.0 104.3014 2100.0 132.4156 2500.0 135.3777 2500.0 137.5507 2400.0 149.6855 9400.0 151.0389 17000.0 151.9654 2700.0 173.5258 37000.0 173.5391 38000.0 173.8673 2200.0 176.9653 3500.0 185.3577 2700.0 194.9739 100000.0 195.9814 6200.0 197.5782 2500.0 205.9675 43000.0 207.9815 4200.0 209.9612 2900.0 210.9684 10000.0 211.9768 12000.0 212.9846 10000.0 217.9678 3200.0 217.9898 79000.0 221.9614 48000.0 222.054 2200.0 222.9692 27000.0 223.9767 920000.0 224.0133 6500.0 230.7996 2800.0 235.9764 3200.0 236.9839 2900.0 237.9291 4300.0 237.9559 330000.0 237.9824 5200.0 239.9717 17000.0 241.9871 170000.0 242.0122 2500.0 245.9847 25000.0 246.9925 1500000.0 260.0119 6600.0 265.0031 75000.0 269.997 6500.0 273.9914 8000.0 285.9901 2400.0 287.9734 10000.0 288.0089 23000.0 297.992 45000.0 301.9877 37000.0 314.9951 280000.0 315.0352 4700.0 316.0032 180000.0 318.9317 2500.0 325.9874 28000.0 334.0134 64000.0 342.9929 2400.0 343.9976 1300000.0 353.0127 3000.0 362.0068 14000.0 381.3143 2600.0 427.5162 2400.0 END IONS BEGIN IONS SCANS=206 PEPMASS=291.0868 CHARGE=1 COLLISION_ENERGY=0.0 47.5347 2500.0 50.2892 3100.0 50.361 2600.0 50.6609 2200.0 51.0233 15000.0 51.2154 2000.0 53.0386 24000.0 54.0335 3000.0 55.0178 220000.0 55.0542 17000.0 58.6885 2200.0 59.0484 2400.0 59.118 2500.0 59.6644 2300.0 61.2477 2300.0 61.7242 2200.0 61.7602 2100.0 63.0949 2300.0 65.0386 93000.0 66.7214 2400.0 67.0179 6200.0 67.0541 210000.0 68.2214 2500.0 68.997 230000.0 69.0336 17000.0 70.5023 2100.0 71.0127 2600.0 71.0485 2500.0 71.6693 2500.0 77.0387 34000.0 78.1814 2500.0 79.0546 6100.0 81.0333 39000.0 83.0491 190000.0 85.0283 62000.0 91.0542 120000.0 92.7875 2400.0 93.0334 120000.0 95.049 640000.0 97.0282 55000.0 99.0439 43000.0 101.9428 2600.0 104.2666 2900.0 104.5693 2600.0 105.0335 34000.0 105.0444 2500.0 105.0697 17000.0 107.0491 68000.0 109.0282 27000.0 109.6215 2400.0 111.0076 73000.0 111.0439 300000.0 115.0542 70000.0 117.0701 2800.0 118.9399 2500.0 119.0392 16000.0 119.0491 930000.0 119.0592 11000.0 120.425 2600.0 121.0283 42000.0 121.0387 2500.0 122.0732 2200.0 123.0231 30000.0 123.0439 9700000.0 123.0617 150000.0 123.0665 18000.0 123.077 3400.0 124.0478 8500.0 125.0492 3500.0 126.6608 2800.0 127.0389 230000.0 131.0492 18000.0 133.0273 5400.0 133.0647 110000.0 135.0337 3000.0 135.044 160000.0 137.0232 140000.0 137.0597 180000.0 138.9989 3700.0 139.0144 99000.0 139.0188 7700.0 139.0389 17000000.0 139.0494 43000.0 139.0644 210000.0 139.0784 25000.0 140.0423 42000.0 143.0491 450000.0 145.0647 29000.0 145.7135 2500.0 147.0296 3600.0 147.044 4300000.0 147.055 16000.0 147.0711 4300.0 147.0802 3000.0 147.2643 2600.0 149.0596 49000.0 151.026 4100.0 151.0389 350000.0 151.0753 120000.0 152.1774 2500.0 153.0545 170000.0 159.044 80000.0 161.0596 2100000.0 161.0736 8100.0 163.0389 260000.0 163.0754 52000.0 165.0546 1000000.0 167.1873 2600.0 169.0496 100000.0 169.0634 2800.0 171.0437 22000.0 171.4445 2700.0 173.5255 68000.0 173.5425 36000.0 175.0756 17000.0 177.0547 280000.0 179.0338 32000.0 179.0703 1000000.0 179.3562 2400.0 181.0494 110000.0 181.0653 3200.0 182.7948 2700.0 185.0598 39000.0 187.0749 11000.0 189.0348 2700.0 189.0546 510000.0 189.0747 3100.0 196.631 2800.0 199.0749 12000.0 203.0705 75000.0 205.0861 62000.0 207.0443 9700.0 207.0653 1500000.0 213.0549 22000.0 217.0087 2300.0 226.8349 2800.0 227.0698 19000.0 231.0656 29000.0 245.0794 3000.0 249.0749 18000.0 255.0653 4600.0 262.9138 2700.0 270.5971 2500.0 273.0759 16000.0 END IONS BEGIN IONS SCANS=207 PEPMASS=385.025 CHARGE=1 COLLISION_ENERGY=0.0 53.6614 2600.0 56.7729 2200.0 58.3914 2700.0 62.5662 2500.0 63.6533 2300.0 63.7132 2500.0 71.6229 2400.0 71.7026 2500.0 73.4078 2500.0 81.5348 2300.0 82.7345 2600.0 84.3869 2400.0 90.5079 2400.0 92.6161 2200.0 103.6471 2200.0 107.1021 2900.0 113.9875 2500.0 117.2198 2300.0 118.8524 2400.0 120.4868 2900.0 123.0437 92000.0 127.2261 2600.0 138.8567 2300.0 139.0393 2600.0 149.0704 2400.0 153.3175 2900.0 157.6213 2400.0 160.3694 2700.0 163.3241 2500.0 173.5268 58000.0 173.5397 47000.0 176.3317 2300.0 189.938 2400.0 194.9737 7600.0 201.632 2600.0 202.5726 2400.0 202.9814 3600.0 218.2424 2300.0 223.9766 69000.0 228.8432 2400.0 233.5033 2200.0 235.4508 2400.0 237.9555 26000.0 238.4175 2300.0 241.9873 6400.0 246.9927 31000.0 252.3996 2500.0 263.0041 5500.0 292.4665 2400.0 306.1412 2200.0 308.4171 2800.0 312.9257 2600.0 314.9946 25000.0 316.002 5200.0 335.0028 48000.0 343.997 27000.0 353.0134 45000.0 358.8004 2400.0 362.0284 22000.0 385.7621 2600.0 387.5173 2500.0 END IONS BEGIN IONS SCANS=208 PEPMASS=388.2548 CHARGE=1 COLLISION_ENERGY=0.0 58.896 2500.0 59.6866 2300.0 62.7935 2500.0 65.7602 2600.0 68.7174 2400.0 70.227 2400.0 70.944 2100.0 71.4924 2300.0 73.0648 4900.0 76.6731 2500.0 87.0437 23000.0 89.0593 540000.0 89.0652 3500.0 92.5778 2300.0 93.3622 2200.0 107.0702 2800.0 107.7068 2400.0 109.9695 2200.0 120.4007 2600.0 130.9768 2200.0 131.0699 2300.0 133.074 3100.0 133.0856 170000.0 140.8167 2500.0 163.1346 2600.0 173.5222 12000.0 173.5395 34000.0 177.1121 19000.0 191.4129 2800.0 247.0368 2400.0 255.369 2400.0 266.1881 2400.0 296.8708 2600.0 329.0723 2500.0 END IONS BEGIN IONS SCANS=209 PEPMASS=289.0712 CHARGE=1 COLLISION_ENERGY=0.0 48.4517 2200.0 51.0228 19000.0 51.4438 2200.0 51.6792 2200.0 53.0384 3100.0 54.9987 2500.0 55.0177 31000.0 59.0053 2200.0 62.431 2200.0 63.242 2100.0 64.6097 2200.0 64.9921 2100.0 65.0383 3400.0 66.0721 2500.0 67.0539 62000.0 67.1827 2300.0 68.2388 2300.0 68.9968 44000.0 69.5692 2300.0 70.7449 3100.0 71.0487 2600.0 75.2385 2300.0 76.0694 2600.0 77.0383 37000.0 79.054 5300.0 79.5418 2100.0 81.9822 2200.0 83.0123 37000.0 83.0489 7900.0 86.1646 2200.0 89.0384 15000.0 95.0489 150000.0 96.4482 2200.0 97.0278 2500.0 101.5114 2100.0 105.0333 47000.0 105.0447 5500.0 107.0488 43000.0 109.3923 2700.0 111.0075 22000.0 111.044 31000.0 114.3825 2500.0 114.9271 2400.0 117.0332 42000.0 119.0494 4700.0 121.0282 3200.0 123.023 3200.0 123.0438 2800000.0 123.0523 49000.0 123.1823 3000.0 127.0379 2400.0 129.0178 6000.0 131.0491 35000.0 135.0439 170000.0 137.0595 5300.0 139.0388 690000.0 139.0512 10000.0 141.0699 3500.0 143.0488 2800.0 145.0282 140000.0 147.901 2400.0 149.0234 14000.0 149.0595 22000.0 151.0388 95000.0 153.018 3100.0 153.0699 3500.0 159.044 72000.0 161.0596 3100.0 163.0214 12000.0 163.0389 690000.0 163.0519 2800.0 169.0646 25000.0 173.06 13000.0 173.5209 14000.0 173.537 68000.0 177.0547 22000.0 178.9791 64000.0 185.0604 21000.0 187.0391 140000.0 197.0597 72000.0 199.0396 3500.0 201.0551 2900.0 205.0498 110000.0 206.9739 16000.0 215.0706 31000.0 217.0494 11000.0 224.8986 7500.0 224.985 37000.0 225.055 47000.0 225.6077 3500.0 229.05 11000.0 243.0651 31000.0 245.0446 23000.0 253.0503 9500.0 271.0612 20000.0 278.4674 3000.0 278.5203 2700.0 287.4371 2300.0 END IONS BEGIN IONS SCANS=210 PEPMASS=311.0532 CHARGE=1 COLLISION_ENERGY=0.0 50.1099 2300.0 52.5368 2100.0 54.556 2300.0 55.9042 2500.0 57.2256 2500.0 61.1374 2500.0 63.8011 2900.0 65.9653 2800.0 70.2551 2300.0 80.0501 2500.0 102.6415 2300.0 103.6712 2400.0 132.4076 2400.0 147.1877 2200.0 149.6831 4900.0 149.6933 4500.0 173.5206 4800.0 173.5339 32000.0 182.3035 2400.0 193.1017 2400.0 212.2459 2400.0 237.0657 7000.0 265.0607 12000.0 265.5989 2500.0 272.8821 2300.0 309.9309 2700.0 311.1001 4500.0 314.0717 2600.0 END IONS BEGIN IONS SCANS=211 PEPMASS=326.1393 CHARGE=1 COLLISION_ENERGY=0.0 49.245 2400.0 51.1202 2200.0 55.4603 2300.0 57.0697 3100.0 57.5429 2300.0 58.0648 63000.0 58.9014 2500.0 58.9541 2300.0 65.0216 2500.0 66.9198 2200.0 70.1403 2400.0 71.2751 2400.0 72.0259 2700.0 73.0831 2500.0 76.8513 2600.0 77.5046 2200.0 77.7792 11000.0 78.3624 2500.0 79.4045 2400.0 94.5952 2200.0 96.1022 2400.0 96.4095 2200.0 97.7013 2400.0 111.1677 2300.0 111.957 2500.0 112.3459 2400.0 115.2151 2500.0 121.5505 2800.0 126.2612 2400.0 143.1908 2600.0 147.581 2500.0 155.5812 2300.0 173.5225 44000.0 173.5397 59000.0 173.5417 13000.0 203.0932 2600.0 213.4578 2500.0 219.1523 2800.0 221.0208 2400.0 268.0965 2800.0 278.0952 2600.0 280.2112 2200.0 281.0685 9400.0 289.0244 2500.0 289.509 2500.0 292.8447 2600.0 295.8972 2600.0 296.0917 260000.0 307.5641 2900.0 310.1059 3200.0 311.0303 17000.0 311.0477 6400.0 311.1153 4200000.0 311.1992 19000.0 326.1387 490000.0 END IONS BEGIN IONS SCANS=212 PEPMASS=867.2131 CHARGE=1 COLLISION_ENERGY=0.0 78.5866 2200.0 92.2319 2400.0 92.4491 2600.0 94.7561 2500.0 95.4359 2700.0 96.7271 2400.0 110.4608 2500.0 111.0076 7200.0 111.0437 17000.0 123.0335 5200.0 123.0437 260000.0 127.028 9300.0 127.0386 610000.0 127.0499 5900.0 135.0438 160000.0 137.0237 2600.0 139.0387 360000.0 139.2665 2100.0 147.0439 15000.0 149.0232 9800.0 151.0387 79000.0 161.0599 9000.0 163.0389 340000.0 165.0547 43000.0 167.0339 37000.0 169.0492 20000.0 173.5286 68000.0 173.5375 9400.0 177.0546 9100.0 177.2917 2800.0 179.0338 35000.0 186.5614 2500.0 187.0387 21000.0 191.0337 16000.0 201.0546 14000.0 203.0338 20000.0 203.0697 4400.0 203.4857 2400.0 205.0498 20000.0 207.0639 3100.0 215.0711 4300.0 219.0635 6000.0 225.0548 3200.0 229.0494 30000.0 231.0286 2900.0 231.0655 6800.0 233.0447 31000.0 241.0497 2600.0 243.0651 41000.0 245.0444 360000.0 247.0316 8400.0 247.0599 330000.0 251.0549 8200.0 253.0493 5600.0 255.0645 6800.0 257.0441 65000.0 258.0448 2700.0 259.0597 98000.0 261.0442 5900.0 261.0758 24000.0 263.0545 13000.0 269.0445 14000.0 271.0348 2600.0 271.0602 220000.0 273.0754 18000.0 274.047 26000.0 275.0552 270000.0 283.0604 98000.0 285.0404 7900.0 285.0746 4500.0 287.0553 260000.0 288.0612 2800.0 289.0705 60000.0 291.0866 47000.0 295.0614 4000.0 299.0554 64000.0 301.0711 62000.0 303.0488 5500.0 303.0856 5500.0 307.8041 2500.0 311.0553 5800.0 313.0702 8500.0 315.0489 3000.0 323.0561 16000.0 325.0704 2900.0 327.0492 2800.0 338.4818 2600.0 342.5019 2400.0 349.0697 3400.0 361.0707 2800.0 363.0864 4500.0 365.0656 20000.0 377.069 5900.0 379.0814 26000.0 381.0959 4200.0 383.0775 5000.0 389.066 26000.0 391.081 24000.0 393.0606 67000.0 395.0754 25000.0 397.091 3000.0 405.0599 33000.0 407.0769 110000.0 407.1324 4300.0 409.0924 150000.0 409.1447 2200.0 411.1067 22000.0 417.0613 4000.0 419.0764 55000.0 421.0899 16000.0 427.0964 4200.0 431.0754 7100.0 433.0911 5400.0 437.0886 3200.0 449.0848 2900.0 450.6503 2700.0 451.1012 5200.0 517.1148 7400.0 527.0967 53000.0 537.1182 2900.0 545.1055 17000.0 557.1078 8300.0 END IONS BEGIN IONS SCANS=213 PEPMASS=373.1839 CHARGE=1 COLLISION_ENERGY=0.0 57.9779 2400.0 62.8743 2300.0 62.9692 2600.0 74.7334 2400.0 113.0154 2100.0 132.7736 2500.0 137.0591 9300.0 173.5254 12000.0 173.5341 35000.0 183.297 2700.0 183.417 2800.0 201.0543 21000.0 211.1301 29000.0 256.2083 2300.0 340.8226 2500.0 357.8689 3300.0 373.0733 6400.0 373.1832 2000000.0 END IONS BEGIN IONS SCANS=214 PEPMASS=328.1549 CHARGE=1 COLLISION_ENERGY=0.0 49.6561 2600.0 49.6677 2500.0 53.3833 2400.0 53.8384 2200.0 56.7885 2200.0 57.3758 2900.0 58.0649 110000.0 62.3342 2700.0 63.9887 2200.0 66.273 2700.0 66.6989 2100.0 73.0282 7400.0 74.2758 2400.0 77.0423 2200.0 79.5038 2800.0 81.5713 2100.0 89.0595 8900.0 112.2057 2600.0 117.3248 2300.0 126.6386 2400.0 152.7191 2700.0 154.3344 3000.0 165.071 5800.0 166.0778 3800.0 167.5988 2300.0 172.7303 2500.0 173.5288 51000.0 173.5382 20000.0 173.5472 4300.0 179.0853 20000.0 181.1015 27000.0 189.0712 3400.0 191.0856 180000.0 193.0652 8100.0 194.0727 24000.0 195.0804 12000.0 202.87 2300.0 203.0865 4600.0 205.0651 61000.0 207.0805 130000.0 208.0883 14000.0 209.0618 3400.0 209.0962 170000.0 209.4716 2800.0 217.0652 9800.0 217.3307 2300.0 218.0736 7500.0 219.0805 280000.0 220.087 5600.0 221.0599 76000.0 221.0965 5200.0 222.0677 200000.0 223.0755 62000.0 223.1116 5700.0 225.0912 57000.0 233.0599 140000.0 235.0755 69000.0 236.0833 45000.0 236.3084 2700.0 237.0911 770000.0 239.0698 13000.0 247.0754 130000.0 248.0832 12000.0 250.0624 75000.0 251.0702 370000.0 251.1061 28000.0 252.0779 5100.0 253.0858 96000.0 254.0938 6300.0 255.1016 97000.0 263.0708 4100.0 263.9054 2600.0 264.078 24000.0 265.0192 8300.0 265.0527 16000.0 265.0859 2500000.0 265.1193 5000.0 265.1516 4100.0 266.0937 56000.0 267.0653 51000.0 267.1012 26000.0 268.0735 12000.0 268.1338 3500.0 269.1175 10000.0 279.1018 87000.0 282.0889 950000.0 282.1234 3700.0 283.0969 260000.0 283.1327 3300.0 284.1045 5100.0 285.1126 22000.0 296.1286 3700.0 297.1125 1500000.0 298.1044 4200.0 299.1286 9300.0 311.1293 7500.0 312.1203 4600.0 313.1228 59000.0 320.5806 3000.0 322.9946 2700.0 326.7262 2600.0 328.1539 87000.0 END IONS BEGIN IONS SCANS=215 PEPMASS=460.2183 CHARGE=1 COLLISION_ENERGY=0.0 57.4055 2300.0 58.3144 2300.0 61.0281 36000.0 62.3457 2300.0 66.7362 2300.0 67.0542 7700.0 67.8761 2200.0 69.0333 55000.0 70.576 2000.0 71.0489 12000.0 73.0283 3800.0 73.9026 2100.0 74.0193 2100.0 76.4151 2300.0 77.5579 2400.0 79.0551 3600.0 81.0333 17000.0 81.0696 2900.0 83.0489 9400.0 85.0281 340000.0 87.6939 2800.0 91.0388 22000.0 91.7948 2200.0 94.1534 2500.0 94.8036 3200.0 95.0489 25000.0 95.0854 52000.0 96.07 2400.0 96.1758 2500.0 97.0282 100000.0 97.0582 3800.0 97.0645 200000.0 99.0439 55000.0 102.1811 2400.0 103.5498 2300.0 105.0703 5600.0 107.0853 5100.0 108.0811 2800.0 109.0283 26000.0 109.0648 9700.0 111.0439 36000.0 119.085 18000.0 120.0122 2300.0 120.9903 2200.0 121.065 12000.0 121.1016 2800.0 123.0443 5400.0 123.0802 2500000.0 123.0889 4100.0 123.09 21000.0 125.0597 6800.0 127.0388 79000.0 131.0854 7300.0 133.1009 6900.0 135.0803 24000.0 137.0597 35000.0 137.096 11000.0 139.0753 64000.0 145.0496 70000.0 145.0623 4800.0 147.0802 63000.0 147.1176 3100.0 149.0596 8700.0 150.0205 2500.0 151.0774 2600.0 153.8847 2300.0 156.0953 2600.0 157.1014 21000.0 159.0805 35000.0 159.1172 20000.0 161.096 47000.0 161.1308 2700.0 163.0755 53000.0 165.0581 23000.0 165.0909 11000000.0 165.1241 47000.0 165.1328 9000.0 165.8526 2700.0 166.0785 2600.0 167.0702 88000.0 168.0934 2300.0 171.1171 31000.0 173.0964 35000.0 173.1329 23000.0 173.5295 100000.0 173.542 5400.0 174.7885 2500.0 175.074 3100.0 175.1118 77000.0 177.0912 38000.0 179.0692 2900.0 183.1162 3000.0 185.0961 53000.0 185.3349 2500.0 187.0754 20000.0 187.1118 71000.0 189.1272 42000.0 199.1118 230000.0 201.1269 17000.0 203.1068 160000.0 205.0862 150000.0 205.1219 8000.0 212.0834 25000.0 215.1068 150000.0 215.8089 2400.0 217.1226 75000.0 221.1175 20000.0 227.1069 160000.0 233.1175 430000.0 233.3111 2500.0 234.9672 2800.0 235.1334 25000.0 245.1175 210000.0 263.1281 440000.0 263.1515 2800.0 263.1785 2600.0 266.2491 2400.0 295.5838 2400.0 347.5094 2700.0 367.8394 2400.0 392.3002 2500.0 403.3942 2100.0 416.4888 2400.0 END IONS BEGIN IONS SCANS=216 PEPMASS=263.128 CHARGE=1 COLLISION_ENERGY=0.0 46.0558 2200.0 46.2576 2400.0 46.9884 2100.0 50.4986 2100.0 51.3033 2200.0 55.0541 5900.0 56.3084 2200.0 56.6018 2600.0 67.0541 8400.0 68.911 2200.0 69.0333 6500.0 72.7042 2200.0 72.9726 2700.0 77.553 2600.0 81.0697 6800.0 91.054 7200.0 91.4202 2700.0 93.0695 4100.0 95.0488 24000.0 95.0852 48000.0 97.0646 30000.0 98.0595 12000.0 99.8236 2400.0 105.0697 7100.0 114.89 2400.0 118.2688 2200.0 119.0853 18000.0 121.0276 3200.0 121.0647 19000.0 123.0439 13000.0 123.0702 4600.0 123.08 420000.0 128.0634 2800.0 131.085 8900.0 133.1006 6700.0 135.0804 16000.0 137.0595 8100.0 139.0751 6900.0 143.0851 6600.0 147.08 6300.0 154.6294 2300.0 156.093 2900.0 157.101 13000.0 159.08 14000.0 159.1166 17000.0 160.0886 3300.0 161.0954 11000.0 162.3208 2200.0 163.0756 2800.0 165.0908 37000.0 167.9414 2300.0 171.1168 8800.0 173.096 8900.0 173.5288 54000.0 173.5424 11000.0 175.1111 9800.0 184.0895 2900.0 186.1021 2400.0 187.1116 16000.0 199.0724 2500.0 199.1117 17000.0 205.0876 3400.0 212.0837 5300.0 215.1071 3400.0 242.4541 2400.0 265.6884 2800.0 END IONS BEGIN IONS SCANS=217 PEPMASS=465.1736 CHARGE=1 COLLISION_ENERGY=0.0 57.04 2600.0 58.7099 4700.0 61.6592 2600.0 62.5263 2300.0 62.6176 2300.0 65.2957 2400.0 67.5061 2300.0 73.9429 2400.0 74.0314 2600.0 75.7776 3400.0 75.7816 3400.0 78.1472 2400.0 80.8142 2300.0 92.4472 2400.0 94.4208 2400.0 99.9155 2200.0 103.6511 2400.0 106.081 2300.0 115.4181 2400.0 117.7114 2500.0 128.0217 2500.0 133.1926 2500.0 135.5626 2700.0 145.4061 2400.0 162.524 2600.0 173.5197 15000.0 173.5278 28000.0 173.5353 71000.0 173.5469 5300.0 177.4581 2500.0 185.0418 150000.0 249.7749 2300.0 250.2183 2600.0 285.1093 28000.0 303.0387 9700.0 303.0577 4800.0 303.0797 6500.0 303.1204 4200000.0 303.2013 17000.0 339.8971 2300.0 340.0121 2600.0 442.0187 3400.0 450.5223 2500.0 465.0973 11000.0 465.1728 510000.0 465.2428 4500.0 END IONS BEGIN IONS SCANS=218 PEPMASS=234.1491 CHARGE=1 COLLISION_ENERGY=0.0 45.0334 3100.0 51.8579 2300.0 53.0385 2600.0 55.0177 11000.0 55.0541 120000.0 57.0698 29000.0 58.065 42000.0 62.5756 2200.0 67.054 9300.0 69.0697 250000.0 69.6192 2200.0 72.0806 33000.0 73.0282 62000.0 73.5091 2500.0 79.0542 17000.0 79.5662 2100.0 81.0697 39000.0 91.0541 42000.0 93.0698 4900.0 98.0961 7900.0 103.0541 31000.0 105.0697 32000.0 107.0489 8000.0 107.0854 7900.0 108.1546 2600.0 109.2052 2300.0 115.054 59000.0 116.0619 8400.0 117.0696 27000.0 118.0649 14000.0 119.049 10000.0 119.0854 9600.0 121.0635 2300.0 122.4484 2600.0 123.0438 150000.0 128.062 24000.0 129.059 4600.0 129.0697 200000.0 130.0408 15000.0 131.0377 4800.0 131.049 160000.0 131.0857 2500.0 133.0646 31000.0 134.4973 2500.0 135.1587 2600.0 137.0595 71000.0 141.0696 2600.0 142.0775 12000.0 143.049 98000.0 143.0854 87000.0 144.0567 21000.0 145.0647 55000.0 146.0598 33000.0 147.031 3900.0 147.0438 170000.0 147.0803 37000.0 147.6503 2400.0 148.0517 120000.0 149.0459 5400.0 149.0595 360000.0 149.0738 2900.0 151.0753 24000.0 156.0932 15000.0 157.0521 2000.0 157.0646 220000.0 157.1006 2200.0 158.0725 10000.0 159.0802 3200.0 160.0518 57000.0 161.0595 640000.0 161.0756 5700.0 162.0538 6600.0 162.0674 150000.0 163.0753 31000.0 164.0705 720000.0 165.0698 2800.0 166.0769 2700.0 170.0728 38000.0 171.0804 85000.0 171.1168 110000.0 173.0598 25000.0 173.5208 3800.0 173.5347 60000.0 174.0676 28000.0 175.0575 3400.0 175.0754 860000.0 176.0833 16000.0 177.0576 2400.0 181.1012 13000.0 184.0882 32000.0 188.0832 76000.0 189.0911 45000.0 197.9157 2800.0 199.1118 67000.0 202.0993 3900.0 217.1225 120000.0 221.5599 2600.0 234.1492 14000.0 244.4298 2600.0 END IONS BEGIN IONS SCANS=219 PEPMASS=344.1859 CHARGE=1 COLLISION_ENERGY=0.0 50.4445 4000.0 55.8147 4200.0 56.0494 45000.0 58.0652 14000000.0 58.0692 160000.0 58.0703 120000.0 58.0718 74000.0 58.0739 25000.0 58.0757 22000.0 58.0898 8000.0 59.0684 49000.0 62.0078 3700.0 62.1155 3900.0 62.9675 3300.0 65.4269 3800.0 69.2089 4300.0 70.2809 3800.0 70.527 6900.0 71.0727 25000.0 72.0807 32000.0 83.2993 6900.0 83.3045 8500.0 86.0598 12000.0 89.0447 3900.0 91.0541 52000.0 94.1668 4000.0 95.049 40000.0 101.7929 7000.0 107.0489 15000.0 109.0648 37000.0 115.0542 120000.0 117.0697 46000.0 119.0491 87000.0 121.0649 25000.0 122.036 18000.0 123.0438 40000.0 125.0596 70000.0 131.0492 7000.0 137.0596 4400000.0 137.0693 47000.0 143.0491 2000000.0 143.0589 9000.0 143.0625 9300.0 144.0568 14000.0 145.0648 170000.0 147.0801 24000.0 149.0596 170000.0 151.0753 1600000.0 154.803 2500.0 157.0645 3800.0 157.8574 4200.0 160.0519 120000.0 160.0761 9000.0 160.8177 3700.0 161.0596 43000.0 162.0675 38000.0 163.0753 62000.0 165.0908 23000.0 173.5335 120000.0 174.0674 5000.0 174.0917 67000.0 175.0755 4100000.0 175.0951 19000.0 175.1031 50000.0 175.1114 13000.0 176.0836 34000.0 176.1075 27000.0 177.0912 330000.0 179.0859 30000.0 179.1078 19000.0 181.0648 7400.0 181.1015 27000.0 187.0752 5400.0 188.0461 2600.0 188.1067 21000.0 189.0915 8300.0 192.0816 4200.0 192.1021 380000.0 193.0666 8200.0 193.0906 7500.0 193.1099 320000.0 194.1176 100000.0 195.081 8300.0 206.1177 85000.0 207.0808 220000.0 207.1021 4300.0 207.1258 110000.0 208.0873 3500.0 209.0604 23000.0 209.0962 110000.0 211.0755 5200.0 213.0919 12000.0 219.0807 26000.0 220.1341 17000.0 221.0876 2900.0 223.1116 8500.0 224.0824 10000.0 235.0755 250000.0 236.0834 14000.0 237.0911 140000.0 238.0949 8800.0 239.0713 25000.0 239.1065 360000.0 240.0779 4500.0 241.0864 82000.0 241.1224 300000.0 241.1497 14000.0 249.0908 21000.0 251.1061 37000.0 252.0778 26000.0 253.1247 7800.0 254.093 5400.0 255.1374 8100.0 265.0861 10000.0 266.0893 46000.0 267.1006 670000.0 268.1094 33000.0 269.1175 390000.0 270.0893 24000.0 271.0983 18000.0 271.1318 4300.0 272.1047 36000.0 281.1141 4100.0 283.0969 8600.0 283.1327 26000.0 284.1027 110000.0 286.1179 25000.0 298.1155 24000.0 299.0742 3000.0 299.1276 1500000.0 301.1437 430000.0 312.1596 210000.0 313.1697 18000.0 314.646 4900.0 329.1619 74000.0 344.1858 3100000.0 END IONS BEGIN IONS SCANS=220 PEPMASS=202.0503 CHARGE=1 COLLISION_ENERGY=0.0 46.7408 2100.0 49.634 2100.0 50.0107 2400.0 50.2845 2300.0 50.8429 2200.0 51.4333 2400.0 52.5522 2700.0 54.0199 2400.0 55.9342 15000.0 65.6533 2400.0 66.48 2300.0 70.1186 2700.0 72.6935 2200.0 77.4783 2500.0 78.9493 3400.0 99.7978 2100.0 105.317 2800.0 110.2066 2500.0 114.4768 2600.0 114.9709 10000.0 116.975 5800.0 118.0649 26000.0 119.1459 2600.0 128.0495 9700.0 130.8556 2400.0 130.9491 2700.0 131.0489 8200.0 131.9742 2900.0 132.9693 20000.0 140.0993 2300.0 146.0598 54000.0 147.044 2800.0 148.0112 2500.0 156.0442 92000.0 173.5253 19000.0 173.5418 9900.0 174.0551 58000.0 184.0394 230000.0 184.0584 4000.0 202.0501 100000.0 204.9049 2300.0 END IONS BEGIN IONS SCANS=221 PEPMASS=342.0824 CHARGE=1 COLLISION_ENERGY=0.0 51.223 2300.0 56.9972 2300.0 57.0334 4800.0 57.3532 2400.0 58.0649 58000.0 59.3584 2500.0 61.3742 2400.0 62.6344 2000.0 64.5056 2100.0 67.1136 2200.0 69.0331 43000.0 69.2228 2400.0 75.1058 2300.0 75.2716 2700.0 85.028 34000.0 95.0124 58000.0 95.0426 2700.0 95.0488 150000.0 97.0215 4100.0 97.028 260000.0 101.1556 2400.0 110.7792 2300.0 111.9872 2500.0 113.023 160000.0 121.0281 110000.0 122.9984 3800.0 123.0073 150000.0 125.023 52000.0 139.0387 620000.0 141.0069 4000.0 141.0179 220000.0 143.0336 99000.0 148.8771 2500.0 157.0643 2300.0 169.013 180000.0 169.409 2300.0 173.5246 9100.0 173.5364 35000.0 177.4884 2200.0 187.0236 38000.0 189.1143 2600.0 207.2635 2600.0 225.9769 3000.0 237.0901 3200.0 250.2778 2400.0 265.0861 27000.0 266.0859 2400.0 277.1837 3000.0 284.0533 2500.0 289.6482 2600.0 297.1121 21000.0 306.492 2500.0 340.7537 2300.0 END IONS BEGIN IONS SCANS=222 PEPMASS=207.1383 CHARGE=1 COLLISION_ENERGY=0.0 41.0385 17000.0 43.0177 380000.0 43.0542 5900.0 45.0333 17000.0 51.9949 2500.0 53.0384 12000.0 54.6433 2400.0 55.0176 17000.0 55.054 140000.0 55.5163 2100.0 57.0333 9600.0 57.0696 100000.0 58.4369 2500.0 59.0489 21000.0 63.6897 2200.0 64.1489 2200.0 65.0383 22000.0 67.0539 560000.0 67.0582 5800.0 69.0332 44000.0 69.0695 40000.0 71.0458 2100.0 71.0488 29000.0 75.8965 2400.0 77.0386 2500.0 79.0539 71000.0 80.0618 3700.0 80.9117 2800.0 81.0333 6500.0 81.0696 81000.0 83.0446 2200.0 83.0488 37000.0 83.0852 5100.0 85.0645 56000.0 87.9068 2200.0 89.9767 2300.0 91.0539 110000.0 93.0631 4000.0 93.0696 220000.0 95.0488 61000.0 95.0852 1600000.0 95.0919 16000.0 95.096 13000.0 95.0993 11000.0 97.0643 11000.0 103.0539 6200.0 105.0447 2800.0 105.0615 3500.0 105.0695 200000.0 105.0782 3700.0 106.0781 3100.0 107.0488 11000.0 107.0773 5100.0 107.0852 210000.0 108.0569 4600.0 109.0645 57000.0 109.0935 2900.0 109.1009 31000.0 111.0803 14000.0 112.7459 2200.0 113.0598 11000.0 114.9711 5600.0 115.0538 2700.0 115.9639 22000.0 116.0619 11000.0 116.9725 3100.0 117.0695 16000.0 119.0489 4200.0 119.0852 260000.0 119.0938 2900.0 119.0955 5200.0 120.0931 16000.0 121.0644 46000.0 121.0911 4200.0 121.1009 180000.0 123.0801 250000.0 123.1165 57000.0 125.0958 9100.0 129.0698 9700.0 130.0778 8000.0 131.0853 53000.0 132.6166 2500.0 133.0645 16000.0 133.0749 2500.0 133.0903 3500.0 133.1009 65000.0 135.0801 16000.0 135.1165 19000.0 137.0957 26000.0 137.1322 9600.0 139.075 11000.0 141.0681 2600.0 143.0854 13000.0 145.0643 3200.0 145.1011 22000.0 146.1088 6500.0 147.0801 38000.0 147.1165 75000.0 149.0958 400000.0 149.1072 3600.0 151.0748 11000.0 155.9972 11000.0 156.0931 31000.0 157.0861 3600.0 159.0803 25000.0 159.1172 7900.0 160.0882 13000.0 161.0961 10000.0 161.1322 56000.0 162.692 2600.0 163.1123 9900.0 165.0915 3300.0 165.1272 47000.0 171.1167 19000.0 173.5228 6100.0 173.5325 16000.0 173.5407 11000.0 174.1039 50000.0 189.1274 36000.0 207.138 13000.0 END IONS BEGIN IONS SCANS=223 PEPMASS=409.1839 CHARGE=1 COLLISION_ENERGY=0.0 55.7479 2200.0 58.7915 2100.0 63.3881 2400.0 66.431 2500.0 68.6395 2400.0 71.1403 2500.0 75.4346 2100.0 88.7205 2300.0 100.4245 2400.0 107.5457 2200.0 165.6822 2400.0 173.5262 26000.0 173.544 9000.0 200.2019 2300.0 203.0522 4000.0 208.9636 2700.0 221.4194 2500.0 228.5702 2500.0 259.7844 2700.0 297.3979 2600.0 369.1518 2500.0 372.785 2600.0 384.8168 2400.0 409.1831 430000.0 409.2462 3300.0 END IONS BEGIN IONS SCANS=224 PEPMASS=285.1239 CHARGE=1 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5600.0 238.0861 9800.0 239.0932 7600.0 240.1018 940000.0 241.0843 12000.0 241.1102 2600.0 249.0786 5500.0 250.0861 350000.0 251.0935 22000.0 252.0656 7900.0 253.0732 20000.0 256.093 8200.0 267.0561 2500.0 267.0887 79000.0 268.0965 1100000.0 268.1631 5800.0 END IONS BEGIN IONS SCANS=225 PEPMASS=342.1706 CHARGE=1 COLLISION_ENERGY=0.0 54.095 13000.0 56.0495 100000.0 56.7445 12000.0 58.0652 34000000.0 58.069 300000.0 58.0705 130000.0 58.072 100000.0 58.074 57000.0 58.0799 23000.0 59.2742 11000.0 60.9135 17000.0 61.7315 7100.0 65.3543 10000.0 66.2708 96000.0 66.2733 33000.0 66.905 16000.0 72.0807 99000.0 72.7036 18000.0 74.2758 67000.0 74.2799 29000.0 77.9631 14000.0 94.9409 17000.0 118.7675 6100.0 152.065 11000.0 156.6744 16000.0 161.2009 11000.0 165.0719 63000.0 166.0788 31000.0 169.4895 6100.0 173.5208 13000.0 173.5352 190000.0 178.0793 7300.0 179.0859 110000.0 181.065 15000.0 181.1009 120000.0 181.7488 11000.0 182.2738 17000.0 189.0704 36000.0 190.0782 34000.0 191.0858 830000.0 194.0727 110000.0 195.0808 100000.0 201.0719 23000.0 202.8713 20000.0 203.0853 13000.0 205.0652 260000.0 205.1015 38000.0 205.1407 7000.0 206.0725 34000.0 207.0807 640000.0 208.0874 80000.0 209.0964 880000.0 217.0643 17000.0 218.0721 32000.0 218.2931 20000.0 219.0808 1600000.0 219.1058 31000.0 219.4655 19000.0 220.0879 61000.0 221.0605 74000.0 221.0968 95000.0 222.0679 890000.0 223.0757 160000.0 223.1112 30000.0 224.0834 25000.0 225.0923 32000.0 233.0341 10000.0 233.06 740000.0 233.088 27000.0 233.0976 39000.0 234.0679 50000.0 235.0488 15000.0 235.0756 880000.0 236.0834 300000.0 237.0913 5400000.0 239.0703 93000.0 239.1067 170000.0 240.0768 7600.0 241.0835 14000.0 247.0756 920000.0 248.0828 79000.0 249.0912 87000.0 250.0627 410000.0 251.0745 71000.0 251.1068 410000.0 252.078 74000.0 253.0859 210000.0 253.1187 24000.0 254.0936 98000.0 255.1017 490000.0 261.0907 9300.0 263.0711 45000.0 264.0781 180000.0 265.0193 190000.0 265.034 130000.0 265.0861 26000000.0 265.1389 24000.0 265.1521 170000.0 266.0938 480000.0 267.0655 230000.0 267.1017 690000.0 269.1175 670000.0 270.0897 26000.0 271.0968 96000.0 271.2453 21000.0 279.102 1300000.0 279.1361 25000.0 281.0857 9300.0 281.1178 230000.0 282.0891 7000000.0 283.0973 110000.0 284.1046 1000000.0 285.1123 81000.0 296.1046 40000.0 297.0344 92000.0 297.1126 22000000.0 298.1224 21000.0 299.0979 16000.0 299.1282 3000000.0 310.1441 120000.0 311.1283 450000.0 313.1434 150000.0 324.1161 12000.0 327.1475 100000.0 342.1702 4400000.0 344.1417 13000.0 END IONS BEGIN IONS SCANS=226 PEPMASS=347.1451 CHARGE=1 COLLISION_ENERGY=0.0 52.2093 2100.0 55.0176 3400.0 57.0332 12000.0 61.0281 34000.0 69.0331 45000.0 69.9263 2200.0 71.0488 8000.0 73.0281 12000.0 80.2609 2300.0 81.0331 15000.0 85.0198 3200.0 85.028 300000.0 85.0372 3800.0 87.0437 8400.0 91.0385 19000.0 97.0214 3500.0 97.0281 81000.0 99.0438 17000.0 109.028 19000.0 127.0386 57000.0 128.8468 2400.0 133.2368 2200.0 145.0492 32000.0 163.3025 2500.0 173.5217 11000.0 173.5397 23000.0 220.5695 2300.0 221.3443 2400.0 239.3727 2600.0 249.8888 2400.0 251.4438 2400.0 257.1306 2900.0 291.9836 2700.0 296.3102 3100.0 296.6739 2900.0 END IONS BEGIN IONS SCANS=227 PEPMASS=328.1913 CHARGE=1 COLLISION_ENERGY=0.0 49.2916 20000.0 56.0495 320000.0 56.207 19000.0 58.0582 210000.0 58.0653 100000000.0 58.0704 340000.0 58.0719 330000.0 58.0739 860000.0 58.074 120000.0 58.0758 63000.0 66.8265 31000.0 69.4244 29000.0 69.6123 36000.0 71.0727 34000.0 72.0808 140000.0 75.9669 31000.0 79.0541 36000.0 85.527 36000.0 87.0901 24000.0 91.0544 170000.0 93.0699 120000.0 95.0492 190000.0 103.0542 81000.0 105.0698 24000.0 107.0319 160000.0 107.0491 39000000.0 107.0661 370000.0 113.7746 30000.0 117.0699 350000.0 118.1883 39000.0 119.0491 300000.0 119.0856 130000.0 121.0647 5300000.0 121.0732 40000.0 124.0521 120000.0 125.06 97000.0 128.4906 28000.0 129.0701 94000.0 131.049 160000.0 133.0649 490000.0 135.0803 300000.0 136.0518 340000.0 137.0596 220000.0 139.0753 440000.0 145.0493 120000.0 145.0647 6800000.0 145.0784 57000.0 146.072 89000.0 147.0804 1800000.0 149.0962 100000.0 150.0675 130000.0 151.0753 6200000.0 155.0601 91000.0 158.0727 940000.0 159.0452 41000.0 159.0806 440000.0 160.0881 92000.0 161.0596 130000.0 161.0962 290000.0 162.067 32000.0 163.0616 24000.0 163.0755 2600000.0 164.0831 46000.0 164.225 22000.0 165.0911 2400000.0 173.0972 72000.0 173.5303 620000.0 173.5448 48000.0 174.0519 60000.0 174.0677 2300000.0 174.084 54000.0 175.0754 180000.0 176.0834 1100000.0 177.0911 2500000.0 179.1067 270000.0 183.08 43000.0 189.0911 13000000.0 190.0992 340000.0 190.1226 500000.0 191.1068 850000.0 192.102 250000.0 193.8979 40000.0 195.0806 38000.0 196.089 44000.0 197.0961 200000.0 203.1068 140000.0 206.1177 2000000.0 207.1255 1100000.0 208.1335 670000.0 209.0971 62000.0 211.077 34000.0 221.097 74000.0 221.1409 350000.0 222.1498 44000.0 223.1115 110000.0 224.0828 140000.0 225.0912 210000.0 225.1276 610000.0 226.1002 49000.0 236.0836 47000.0 237.0908 330000.0 238.0993 240000.0 251.1064 550000.0 252.0831 41000.0 252.1146 6000000.0 252.1449 200000.0 253.0892 90000.0 253.1222 660000.0 254.0938 330000.0 254.1296 360000.0 255.1021 270000.0 256.1091 700000.0 257.1186 43000.0 266.1304 160000.0 267.1368 40000.0 268.1095 3800000.0 268.1416 160000.0 270.1251 1000000.0 277.7158 21000.0 281.1169 70000.0 283.0955 72000.0 283.1331 18000000.0 285.1109 29000.0 285.1488 3700000.0 285.1848 62000.0 296.1641 24000.0 297.1738 280000.0 313.1675 480000.0 328.1908 17000000.0 END IONS BEGIN IONS SCANS=228 PEPMASS=432.2809 CHARGE=1 COLLISION_ENERGY=0.0 58.8652 2500.0 60.0002 2600.0 60.9089 2200.0 61.3197 2400.0 62.0799 2300.0 62.7728 2200.0 66.0665 2200.0 67.933 2400.0 73.0646 6200.0 75.1113 2400.0 84.4744 2300.0 87.0435 44000.0 87.4063 2300.0 89.0593 860000.0 89.0653 4800.0 97.5125 2400.0 99.2004 2600.0 102.9092 2300.0 110.4718 2400.0 123.6005 2400.0 126.9491 2500.0 131.0699 2300.0 133.0754 4200.0 133.0855 320000.0 148.0595 2900.0 148.1998 2700.0 151.6281 2800.0 153.5 2500.0 155.9037 2300.0 166.158 2700.0 173.5182 4900.0 173.5289 92000.0 173.5443 25000.0 173.7885 2500.0 173.8409 2800.0 177.1119 31000.0 188.6293 3100.0 189.2424 2400.0 190.124 2300.0 197.8543 2300.0 200.827 2200.0 200.931 2400.0 205.1424 2600.0 211.0938 2500.0 211.3869 2100.0 230.5586 3400.0 241.6428 2300.0 284.0428 2600.0 317.6653 2600.0 330.5451 2500.0 382.7034 3300.0 400.649 2600.0 421.4684 2400.0 END IONS BEGIN IONS SCANS=229 PEPMASS=342.1703 CHARGE=1 COLLISION_ENERGY=0.0 55.9851 2200.0 56.0494 7100.0 58.065 2000000.0 58.0678 17000.0 58.0704 11000.0 58.0718 10000.0 58.08 2700.0 59.0626 2200.0 62.9726 2200.0 79.7196 2200.0 80.2353 3000.0 80.5062 2400.0 82.5646 2300.0 83.3129 2500.0 86.0599 15000.0 95.7343 2200.0 97.0283 7500.0 101.9623 2600.0 104.2201 2200.0 104.879 2300.0 113.0231 5300.0 121.0276 2600.0 123.0066 2400.0 123.0436 2500.0 135.0439 4100.0 137.2683 2400.0 137.4394 2300.0 139.0388 25000.0 141.0184 4900.0 143.0335 2500.0 164.0831 28000.0 169.0125 3700.0 173.528 27000.0 173.5386 12000.0 174.0911 16000.0 175.1003 2500.0 188.1071 150000.0 189.0978 3200.0 189.1148 400000.0 190.1017 2900.0 190.1224 7300.0 203.0939 4200.0 204.102 58000.0 205.1097 63000.0 206.1176 56000.0 206.1385 4100.0 208.1341 3900.0 218.1179 23000.0 220.1334 350000.0 243.1027 3600.0 265.0854 3100.0 266.0927 9300.0 269.119 2800.0 271.0972 9000.0 285.1138 3000.0 297.112 12000.0 306.2882 3100.0 310.4841 2400.0 342.1717 2700.0 END IONS BEGIN IONS SCANS=230 PEPMASS=330.0976 CHARGE=1 COLLISION_ENERGY=0.0 58.0651 1600000.0 58.0683 10000.0 58.0699 9500.0 59.0618 10000.0 59.0683 500000.0 59.0715 5300.0 59.2711 2400.0 60.0653 3500.0 60.0717 32000.0 60.7485 2200.0 61.9738 2100.0 65.0386 16000.0 68.9941 2100.0 69.1113 2200.0 72.0803 3000.0 86.096 2500.0 87.6017 2300.0 88.0354 2700.0 91.054 45000.0 93.0695 2700.0 107.049 370000.0 107.0577 3900.0 108.0524 290000.0 109.0547 92000.0 109.5948 2900.0 111.9159 2700.0 114.4717 2700.0 119.0392 3400.0 119.0489 180000.0 121.0282 100000.0 121.0646 97000.0 121.0736 4800.0 122.0594 9600.0 122.068 45000.0 123.0703 12000.0 123.2599 2800.0 126.6379 2500.0 134.0685 3000.0 138.0546 7500.0 145.0646 47000.0 146.068 57000.0 147.0439 1300000.0 147.0708 28000.0 147.0809 7900.0 148.0838 12000.0 149.0856 5900.0 149.6859 5000.0 149.6964 3800.0 151.0753 41000.0 152.0786 55000.0 152.4736 2500.0 153.0809 33000.0 159.0766 6500.0 160.0807 3100.0 163.0753 14000.0 164.0706 250000.0 165.0795 3000.0 165.0919 3600.0 166.0941 18000.0 166.5828 2400.0 167.0168 3500.0 167.0339 900000.0 167.0963 17000.0 173.5291 22000.0 173.5398 9100.0 174.0679 8800.0 175.0715 20000.0 176.0716 20000.0 177.0894 12000.0 178.0932 17000.0 179.0972 5700.0 182.237 2400.0 189.091 48000.0 190.0945 100000.0 191.0971 97000.0 192.1091 8400.0 193.1113 5600.0 206.118 7300.0 207.1216 16000.0 208.1259 21000.0 209.1326 12000.0 225.3615 2300.0 227.1335 3400.0 252.1132 10000.0 253.117 31000.0 254.1209 84000.0 255.1277 11000.0 256.102 6900.0 256.1372 2900.0 257.1099 5400.0 258.115 9800.0 269.1121 17000.0 270.1157 57000.0 272.1311 19000.0 284.1359 62000.0 285.1393 300000.0 286.1521 14000.0 287.1549 54000.0 330.1971 300000.0 330.2398 4400.0 END IONS BEGIN IONS SCANS=231 PEPMASS=743.2035 CHARGE=1 COLLISION_ENERGY=0.0 69.0331 29000.0 71.0488 61000.0 73.4958 2200.0 75.0438 2400.0 75.7649 2500.0 81.0329 2800.0 83.0486 11000.0 85.028 120000.0 87.0436 21000.0 87.7363 2600.0 90.0216 2400.0 97.0279 45000.0 99.0437 8500.0 99.2796 2300.0 111.0438 10000.0 115.0384 24000.0 115.3123 2700.0 127.0385 11000.0 129.0541 23000.0 133.0495 4400.0 139.0394 2600.0 145.0493 11000.0 147.8224 2300.0 151.0262 2500.0 169.2172 2300.0 171.0645 3200.0 173.5212 7100.0 173.5398 28000.0 183.4869 2300.0 242.7465 2400.0 243.9078 2400.0 258.1874 2300.0 261.0963 4000.0 302.9688 3700.0 303.0498 1400000.0 308.7199 2900.0 345.0597 9500.0 474.8039 2500.0 553.6123 3200.0 585.7518 3000.0 641.3464 2500.0 END IONS BEGIN IONS SCANS=232 PEPMASS=316.1913 CHARGE=1 COLLISION_ENERGY=0.0 48.4184 2600.0 52.5586 2300.0 53.6888 2300.0 54.1576 2500.0 57.0699 2100.0 58.0648 7200.0 58.5018 2300.0 58.5863 2300.0 59.2105 2400.0 60.0805 640000.0 60.0839 3400.0 61.599 2200.0 62.5327 2500.0 62.7882 2300.0 63.485 2200.0 66.4934 2200.0 69.4311 2200.0 74.0761 2200.0 77.8506 2200.0 81.338 2500.0 81.3558 2300.0 83.1553 2600.0 87.1542 2300.0 87.1833 2300.0 89.3242 2500.0 89.9045 2400.0 91.0539 56000.0 93.0695 27000.0 93.1154 2200.0 95.0489 26000.0 101.8471 2400.0 103.0537 2800.0 107.0488 130000.0 109.0645 8300.0 112.4294 2500.0 117.0695 63000.0 117.0777 2700.0 118.6135 2500.0 119.0402 4000.0 119.0488 200000.0 119.0854 26000.0 120.0431 2600.0 121.0645 870000.0 121.0733 15000.0 123.0437 65000.0 123.7171 2500.0 133.0645 16000.0 135.0438 110000.0 135.0804 25000.0 137.048 4700.0 137.0594 470000.0 137.0715 5300.0 139.5712 2700.0 145.0556 2300.0 145.0644 140000.0 147.0698 2100.0 147.0801 360000.0 149.04 2700.0 149.0595 32000.0 151.075 3000.0 163.0751 370000.0 163.091 2700.0 173.5295 44000.0 173.5402 21000.0 176.0805 2300.0 178.0809 2200.0 180.236 2300.0 182.0727 6300.0 182.0893 2600.0 183.0803 32000.0 193.1009 8300.0 210.067 19000.0 211.0755 27000.0 211.1118 160000.0 218.3007 2300.0 221.0961 29000.0 223.9055 3400.0 228.0776 47000.0 229.1227 7100.0 239.1066 120000.0 250.1542 2500.0 257.088 4000.0 257.1171 300000.0 257.1471 6300.0 271.5126 3100.0 272.783 2800.0 308.7747 2200.0 311.2586 2300.0 316.1901 33000.0 318.8927 2800.0 END IONS BEGIN IONS SCANS=233 PEPMASS=330.1707 CHARGE=1 COLLISION_ENERGY=0.0 58.0652 3600.0 76.4742 2600.0 85.623 2200.0 87.5945 2600.0 91.0541 17000.0 95.217 2300.0 95.8377 2500.0 95.9193 2200.0 96.7901 2700.0 97.6303 2300.0 102.628 3000.0 104.9453 2500.0 105.0339 2400.0 109.0647 3400.0 115.0543 35000.0 118.8269 2600.0 119.0492 17000.0 122.0363 5500.0 125.0597 3600.0 133.1439 2400.0 135.0436 3600.0 137.0597 1000000.0 140.8288 2400.0 143.036 3100.0 143.0491 500000.0 143.0626 3400.0 145.0646 13000.0 147.0441 2500.0 147.0806 5400.0 149.0597 20000.0 151.062 5100.0 151.0754 160000.0 157.0647 3100.0 160.0519 24000.0 160.0768 6800.0 161.0597 5500.0 163.0756 33000.0 165.0903 5700.0 173.533 37000.0 174.0918 2900.0 175.0575 4400.0 175.0756 730000.0 175.0934 5500.0 176.0837 3500.0 177.0787 69000.0 177.0926 10000.0 178.0864 30000.0 179.0878 9700.0 180.1025 11000.0 192.0607 17000.0 192.0872 17000.0 192.102 3000000.0 192.1426 14000.0 192.1544 3200.0 192.7312 2900.0 193.108 6000.0 195.0808 12000.0 207.0807 61000.0 209.0959 2800.0 223.0759 12000.0 227.1069 54000.0 235.0753 60000.0 237.0907 8600.0 239.0674 3300.0 239.1068 80000.0 241.0872 6800.0 241.1224 13000.0 252.0781 3000.0 255.1016 48000.0 267.1016 150000.0 268.11 9500.0 269.1166 14000.0 284.1044 27000.0 287.1278 25000.0 289.8487 2300.0 298.1438 12000.0 299.1282 150000.0 301.1447 12000.0 327.7255 2900.0 330.1702 110000.0 END IONS BEGIN IONS SCANS=234 PEPMASS=360.2172 CHARGE=1 COLLISION_ENERGY=0.0 51.1381 2200.0 51.2454 2300.0 55.0177 3800.0 57.3563 2700.0 58.0651 3700.0 69.2409 2200.0 69.245 2800.0 71.3543 2700.0 81.0696 14000.0 91.0541 25000.0 91.557 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790000.0 193.1223 29000.0 195.1015 22000.0 208.5788 2700.0 212.0853 2500.0 213.0919 2800.0 215.107 18000.0 223.1114 7100.0 224.119 7800.0 227.1066 4200.0 234.102 4800.0 236.165 8400.0 237.091 16000.0 240.5099 2500.0 241.0873 2500.0 241.1224 33000.0 242.0918 2500.0 250.1804 16000.0 251.1062 13000.0 252.1144 78000.0 253.0852 3400.0 254.0927 3100.0 255.1369 12000.0 259.988 2500.0 265.1213 11000.0 268.1096 37000.0 269.1177 21000.0 272.1049 11000.0 283.1332 42000.0 286.1202 41000.0 301.1439 69000.0 328.3864 2500.0 350.9016 2600.0 357.2488 2600.0 360.217 53000.0 END IONS BEGIN IONS SCANS=235 PEPMASS=344.186 CHARGE=1 COLLISION_ENERGY=0.0 52.9421 2300.0 56.0494 2900.0 56.7491 2200.0 58.0651 1100000.0 70.1704 2100.0 72.0807 8700.0 74.6322 2000.0 77.8242 2500.0 79.9677 2000.0 81.3662 2300.0 89.0599 3300.0 91.054 10000.0 93.7484 2200.0 95.0493 2400.0 97.5624 2700.0 100.4459 2600.0 107.0492 5400.0 115.0542 16000.0 121.0646 9500.0 123.023 7300.0 123.0439 1900000.0 123.0651 7000.0 124.3757 2500.0 129.0703 7100.0 131.0493 3700.0 131.0853 2900.0 133.0649 3900.0 136.0517 16000.0 137.0597 60000.0 139.0756 9800.0 143.0377 3800.0 143.0491 110000.0 144.0562 3400.0 145.065 8700.0 146.0728 8200.0 147.0439 3600.0 149.0598 2800.0 151.0645 2100.0 151.0753 320000.0 151.0892 5400.0 155.3005 2400.0 158.0726 130000.0 159.0805 29000.0 161.0441 6400.0 161.0597 260000.0 162.0674 13000.0 163.0753 54000.0 165.0912 33000.0 173.5298 39000.0 174.0676 230000.0 174.0849 5100.0 175.0754 16000.0 176.0834 18000.0 177.0911 90000.0 189.091 1400000.0 190.0987 95000.0 190.1218 17000.0 191.1069 6300.0 192.1018 6700.0 206.1175 45000.0 207.1255 35000.0 208.1332 15000.0 223.0756 2500.0 249.0914 13000.0 250.0985 6800.0 253.0858 15000.0 253.121 13000.0 267.1012 22000.0 268.1094 280000.0 269.0807 6700.0 270.0882 19000.0 271.0975 3700.0 279.4023 2700.0 281.1167 23000.0 284.0685 4800.0 284.1044 230000.0 299.1279 650000.0 299.1848 3300.0 301.1426 22000.0 313.168 10000.0 329.1634 2800.0 344.1372 4100.0 344.1852 250000.0 END IONS BEGIN IONS SCANS=236 PEPMASS=252.0869 CHARGE=1 COLLISION_ENERGY=0.0 44.0131 17000.0 44.4867 2300.0 44.5504 2000.0 46.0525 2200.0 49.0109 2500.0 49.3123 2500.0 49.8301 2300.0 50.4483 2400.0 50.4583 2400.0 53.3737 2500.0 55.0194 2300.0 55.7488 2200.0 60.4968 2600.0 60.8188 2600.0 62.9504 2200.0 63.5755 2300.0 68.6368 2200.0 69.4786 2400.0 71.7405 2600.0 74.3369 2200.0 74.8027 2200.0 74.8876 2200.0 75.9144 2400.0 77.0385 4800.0 77.2589 2200.0 79.0539 1100000.0 79.0592 5500.0 81.2372 2400.0 82.4025 2300.0 86.0233 82000.0 87.0073 100000.0 87.8894 2200.0 90.6419 2600.0 95.0488 20000.0 95.1051 2200.0 97.9137 2400.0 103.0539 210000.0 104.0339 1200000.0 104.0417 11000.0 104.1068 6400.0 105.0695 52000.0 106.0532 3000.0 106.0648 1900000.0 106.0729 16000.0 107.0395 5000.0 107.0489 5000000.0 107.0617 15000.0 107.0632 61000.0 107.0656 12000.0 111.0154 2500.0 113.0675 2300.0 121.0161 2400.0 131.0379 11000.0 131.0488 1200000.0 131.0588 4000.0 131.0603 19000.0 132.0441 150000.0 135.889 2400.0 139.2933 2600.0 145.6924 2500.0 148.8895 2300.0 149.0598 10000.0 161.7452 2200.0 164.0703 19000.0 164.9499 2200.0 173.5238 15000.0 173.5363 57000.0 174.0545 2500.0 182.2902 2400.0 191.3963 2300.0 192.0654 280000.0 192.0851 3400.0 215.6228 2500.0 243.8957 2400.0 END IONS BEGIN IONS SCANS=237 PEPMASS=476.3069 CHARGE=1 COLLISION_ENERGY=0.0 58.2395 2400.0 68.2345 2200.0 73.0647 3800.0 74.8131 2400.0 87.0436 29000.0 89.0593 420000.0 89.0654 2500.0 97.9959 2300.0 104.6811 3000.0 108.9618 2300.0 110.5698 2400.0 119.0388 2300.0 119.0487 2500.0 125.3477 2300.0 133.0855 160000.0 136.8069 2200.0 167.0894 2600.0 173.5338 66000.0 177.1122 14000.0 198.6416 2700.0 274.9514 2700.0 317.7368 2300.0 320.6321 2500.0 348.1523 2200.0 467.292 2900.0 END IONS BEGIN IONS SCANS=238 PEPMASS=482.185 CHARGE=1 COLLISION_ENERGY=0.0 61.2158 2500.0 86.5857 2400.0 88.0391 8300.0 88.3002 2300.0 95.4444 2300.0 96.2184 2600.0 98.393 2600.0 111.358 2000.0 113.8062 2700.0 131.0488 9300.0 132.754 2300.0 136.0254 2200.0 137.0594 340000.0 137.0693 2400.0 145.0651 2500.0 145.6681 2600.0 151.0202 2600.0 151.0751 33000.0 157.0649 3500.0 161.0595 61000.0 162.0676 5900.0 163.0213 17000.0 163.0753 42000.0 165.0367 20000.0 167.7229 2500.0 169.015 4200.0 169.0316 190000.0 171.0812 2600.0 173.5172 4500.0 173.5358 53000.0 175.0753 34000.0 177.0347 2600.0 177.0913 5400.0 177.7684 2500.0 181.0319 4200.0 183.0473 11000.0 183.6334 2500.0 185.0267 18000.0 187.0754 57000.0 188.083 26000.0 189.037 29000.0 189.0907 25000.0 190.0985 2600.0 190.3204 2400.0 193.0318 55000.0 195.0472 57000.0 201.0363 3600.0 201.0909 14000.0 203.1066 17000.0 207.0476 14000.0 207.1019 7300.0 209.0267 2900.0 209.0623 3900.0 213.0914 14000.0 215.052 3300.0 215.1065 2600.0 219.0477 6100.0 221.0631 41000.0 224.038 21000.0 229.0325 5600.0 233.0631 13000.0 239.074 5400.0 251.0732 25000.0 257.0631 4300.0 259.0431 3700.0 264.1108 3300.0 265.0677 4300.0 267.0488 3500.0 270.0882 3100.0 271.0449 3500.0 277.0874 3300.0 281.0655 3000.0 283.0774 5100.0 292.108 3200.0 293.0621 8900.0 297.0587 3100.0 297.0948 12000.0 299.3226 2400.0 309.1134 5000.0 310.0652 5100.0 311.0742 52000.0 315.1061 12000.0 319.0794 3300.0 324.1355 28000.0 325.0905 26000.0 329.0823 3000.0 342.1469 42000.0 343.1004 34000.0 350.1517 34000.0 351.1056 13000.0 357.1136 14000.0 360.1546 11000.0 361.1105 3600.0 375.1268 18000.0 383.1322 37000.0 393.1329 3400.0 401.141 9400.0 452.7366 2500.0 478.4809 2900.0 END IONS BEGIN IONS SCANS=239 PEPMASS=360.1081 CHARGE=1 COLLISION_ENERGY=0.0 51.4773 2500.0 51.9747 2400.0 52.4845 2100.0 55.054 2500.0 55.5334 2700.0 56.1436 2400.0 59.412 2500.0 59.6768 2200.0 60.6241 4400.0 61.7212 2300.0 63.0234 7400.0 64.5071 2500.0 65.0384 130000.0 67.054 23000.0 68.4157 2500.0 70.6715 2200.0 71.5403 2500.0 72.0805 15000.0 72.501 2200.0 73.7022 3200.0 75.2232 2100.0 82.0981 2400.0 82.4671 2600.0 82.9461 2300.0 84.1796 2400.0 84.761 2300.0 86.0598 9600.0 87.7609 2200.0 89.0385 180000.0 89.2541 2700.0 89.8175 2200.0 90.5512 2300.0 91.054 63000.0 91.4773 2300.0 92.115 2600.0 92.8882 2200.0 93.0332 41000.0 94.4247 2200.0 94.5082 2200.0 95.0491 2200.0 95.3042 2400.0 95.3904 2600.0 98.5013 2500.0 101.2002 2400.0 101.7833 2300.0 106.041 2900.0 110.0716 2900.0 110.1702 2300.0 110.7587 2400.0 111.9303 2400.0 113.1558 2800.0 114.0174 2200.0 115.7528 2200.0 117.0241 7900.0 117.0333 770000.0 119.0489 130000.0 120.0447 8300.0 121.0182 15000.0 121.0281 960000.0 121.0367 2400.0 121.0386 13000.0 121.0633 2200.0 123.0437 4400.0 124.4312 2300.0 127.9919 2400.0 130.9684 2500.0 134.0361 35000.0 135.0439 55000.0 136.0407 2700.0 136.0518 74000.0 137.0599 8600.0 137.1297 2600.0 138.0546 81000.0 138.0655 5400.0 140.3155 2700.0 142.0276 2200.0 144.9481 2600.0 145.0282 8400000.0 145.0392 75000.0 145.0548 50000.0 147.0437 3400.0 149.0595 390000.0 151.0752 310000.0 152.0705 120000.0 156.0301 2400.0 162.0305 25000.0 162.6054 2300.0 163.0387 140000.0 164.0341 62000.0 164.9258 3000.0 167.0338 12000000.0 167.0472 57000.0 167.0668 71000.0 167.0762 11000.0 170.1844 3000.0 173.5231 18000.0 173.5318 120000.0 173.5412 25000.0 177.0073 5500.0 177.0179 32000.0 177.0265 6300.0 177.0546 16000000.0 177.0691 36000.0 177.0907 150000.0 177.1021 8200.0 178.0565 2800.0 182.0454 12000.0 186.055 56000.0 188.8434 2900.0 194.0812 1300000.0 194.1004 6300.0 200.5937 3300.0 210.0399 140000.0 229.5228 2700.0 245.4935 2600.0 255.8139 2800.0 267.1973 2700.0 274.5637 2700.0 295.0061 2300.0 301.7283 2900.0 313.6378 3000.0 318.4731 2300.0 338.7488 2400.0 341.4839 2600.0 353.3285 2500.0 363.5977 2300.0 368.7456 2800.0 END IONS BEGIN IONS SCANS=240 PEPMASS=328.155 CHARGE=1 COLLISION_ENERGY=0.0 49.3004 2300.0 49.6912 2200.0 52.6112 2300.0 55.875 2200.0 58.0648 360000.0 60.1157 2300.0 62.0236 2400.0 62.4164 2400.0 63.9256 2400.0 64.886 2300.0 65.8452 2500.0 72.4967 2500.0 74.3368 2200.0 76.8394 2300.0 79.2131 2300.0 80.888 2600.0 86.0599 3100.0 86.0961 2600.0 90.1133 2300.0 95.1599 2500.0 121.0648 3200.0 123.0432 5700.0 123.7098 2500.0 125.7634 2400.0 127.897 2200.0 128.2487 2100.0 130.2247 2300.0 136.2888 2300.0 137.0229 60000.0 138.725 2500.0 141.6196 2300.0 143.4147 2300.0 143.7984 2500.0 146.0962 7600.0 147.7881 2500.0 154.0487 4800.0 158.1472 2500.0 160.2884 2700.0 160.9246 2600.0 173.2574 2700.0 173.5283 53000.0 173.5388 25000.0 174.0912 38000.0 175.0985 9000.0 183.199 2300.0 184.925 2500.0 189.1988 2500.0 190.0855 8200.0 191.0942 13000.0 192.1014 4900.0 195.079 2900.0 200.8878 2700.0 205.0647 50000.0 206.1173 66000.0 208.6325 2500.0 218.9716 2500.0 219.0807 4700.0 222.0671 5400.0 223.0761 7000.0 232.9291 2400.0 233.0597 150000.0 234.0677 2800.0 237.0908 180000.0 247.0759 2900.0 250.0625 31000.0 251.0701 170000.0 252.0779 11000.0 253.0491 2600.0 254.0941 3300.0 255.1015 51000.0 265.0857 1100000.0 266.0927 5000.0 267.5219 2800.0 268.0727 23000.0 269.1173 2300.0 282.0892 45000.0 283.0966 460000.0 283.1323 4700.0 285.1122 6500.0 297.1122 300000.0 302.602 2300.0 310.2665 2700.0 313.0823 2200.0 END IONS BEGIN IONS SCANS=241 PEPMASS=554.1695 CHARGE=1 COLLISION_ENERGY=0.0 62.1669 2400.0 63.7969 2100.0 65.0384 23000.0 66.8968 2200.0 67.0541 3800.0 68.9969 28000.0 69.5997 2200.0 70.9555 2400.0 71.0489 2400.0 72.3952 2300.0 75.0438 49000.0 75.6447 2500.0 77.0388 6200.0 78.0463 18000.0 79.0541 18000.0 83.8825 2300.0 85.0281 36000.0 87.6551 2300.0 89.0385 2700.0 89.0595 32000.0 91.054 120000.0 93.0333 370000.0 93.0402 6300.0 93.0696 55000.0 95.049 52000.0 97.0645 17000.0 97.3264 2100.0 100.6409 2200.0 103.054 46000.0 105.0447 2900.0 105.0698 18000.0 106.0411 190000.0 107.049 31000.0 109.0644 5100.0 111.0438 4600.0 117.0333 16000.0 117.6729 2400.0 118.0416 5300.0 119.0491 27000.0 121.0285 15000.0 121.0646 390000.0 121.0763 8500.0 121.4287 2600.0 122.037 2400.0 122.0725 5700.0 123.0438 15000.0 123.0802 9800.0 123.7527 2300.0 125.0595 230000.0 131.049 58000.0 132.0568 17000.0 133.0646 18000.0 134.0361 30000.0 135.044 36000.0 135.0802 6400.0 137.0596 33000.0 139.0753 48000.0 144.1401 2300.0 145.0285 35000.0 147.0435 14000.0 148.0518 28000.0 149.0596 1200000.0 151.0753 70000.0 152.7847 2600.0 153.0544 36000.0 153.091 460000.0 154.0624 14000.0 156.0316 2600.0 156.4267 2500.0 159.0439 12000.0 160.0517 22000.0 161.06 3200.0 162.1851 2500.0 163.025 3900.0 163.039 170000.0 163.0755 56000.0 165.0543 4200.0 166.0624 15000.0 167.0705 150000.0 167.0854 4700.0 173.0603 3000.0 173.5264 11000.0 173.5397 12000.0 176.0452 2800.0 177.0408 22000.0 177.0549 1300000.0 179.0161 6900.0 179.0706 55000.0 180.042 47000.0 180.0783 54000.0 181.0497 20000.0 181.056 4700.0 181.071 14000.0 181.0861 980000.0 181.7618 2600.0 182.094 93000.0 191.0705 280000.0 191.089 4200.0 192.0581 5600.0 192.0783 270000.0 194.0569 4000.0 195.0655 110000.0 205.0498 3200.0 207.0659 10000.0 207.0897 12000.0 207.1775 2500.0 208.0377 6200.0 209.0646 18000.0 209.0813 1500000.0 210.0891 120000.0 222.0524 2700.0 223.0427 23000.0 223.0608 1300000.0 267.0857 2600.0 270.6929 2500.0 299.3516 2400.0 307.056 2800.0 344.957 2600.0 383.1141 49000.0 417.808 2700.0 END IONS BEGIN IONS SCANS=242 PEPMASS=344.186 CHARGE=1 COLLISION_ENERGY=0.0 51.5295 2400.0 55.661 2200.0 57.149 2400.0 58.0648 620000.0 58.0698 8800.0 59.2803 2900.0 60.9789 2200.0 61.033 2500.0 64.8418 2400.0 70.0716 2600.0 70.8595 2200.0 81.052 2500.0 82.0171 2500.0 86.397 2100.0 91.8743 2100.0 101.9308 2600.0 102.4038 2600.0 104.5404 2500.0 107.0487 250000.0 114.5087 2600.0 121.0644 52000.0 135.0796 2300.0 141.7962 2400.0 145.0644 50000.0 147.0796 5800.0 161.0604 5500.0 167.0701 41000.0 173.0597 51000.0 173.5222 4000.0 173.5365 38000.0 175.0753 3500.0 179.0708 2900.0 181.086 11000.0 181.6573 2400.0 192.0776 2400.0 193.0859 17000.0 205.0861 34000.0 207.08 9600.0 207.1021 13000.0 222.1121 21000.0 224.1276 12000.0 235.0754 4100.0 237.0896 3200.0 238.3025 2500.0 239.1062 19000.0 241.1218 6800.0 246.4326 2600.0 251.066 3000.0 252.0772 3400.0 267.1012 58000.0 268.1088 16000.0 269.1174 6600.0 276.5505 2400.0 284.1039 21000.0 297.9016 2800.0 299.128 97000.0 301.1435 40000.0 312.1607 4900.0 344.1856 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294.1253 84000.0 295.0965 50000.0 297.1131 35000.0 304.11 3300.0 305.1175 180000.0 306.1254 170000.0 307.0968 100000.0 308.1062 2600.0 308.9008 33000.0 309.1136 12000.0 310.0793 3700.0 310.1203 200000.0 310.1583 3800.0 311.1275 12000.0 321.1127 9500.0 322.1207 70000.0 323.1271 3700.0 324.1367 5400.0 325.1433 40000.0 334.4759 2600.0 337.1438 86000.0 355.1582 5100.0 END IONS BEGIN IONS SCANS=245 PEPMASS=570.2547 CHARGE=1 COLLISION_ENERGY=0.0 63.7152 2500.0 74.6185 2200.0 75.8908 2200.0 76.9755 2100.0 80.7013 2400.0 82.3573 2300.0 82.3929 2100.0 82.9319 2600.0 83.049 9200.0 95.0491 3700.0 103.0541 3700.0 109.0651 2900.0 111.5792 2200.0 117.5548 2800.0 121.0646 2800.0 124.0522 3500.0 125.0595 4300.0 128.0624 2600.0 129.0695 21000.0 131.049 27000.0 136.0514 21000.0 137.0595 370000.0 137.0693 4500.0 139.0751 19000.0 143.0493 3200.0 145.0644 3200.0 146.0725 3700.0 147.0801 2700.0 149.0591 4000.0 151.0383 6800.0 151.0751 300000.0 151.0891 4000.0 153.0542 16000.0 157.0646 76000.0 160.0517 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130000.0 325.1882 4200.0 327.1588 2600.0 337.1431 120000.0 343.1552 3500.0 355.153 35000.0 362.8528 2500.0 578.8154 2600.0 END IONS BEGIN IONS SCANS=246 PEPMASS=373.1647 CHARGE=1 COLLISION_ENERGY=0.0 55.6569 2300.0 63.9695 2000.0 66.0062 2400.0 67.3674 2200.0 73.7411 2300.0 79.0175 2200.0 82.2403 2200.0 91.0544 2600.0 105.0335 3600.0 109.0644 6400.0 111.0436 2600.0 115.6396 2600.0 121.6692 2100.0 122.0362 3000.0 125.0592 3900.0 129.0696 4000.0 131.0485 14000.0 136.0518 8200.0 137.048 4600.0 137.0594 260000.0 147.0441 5300.0 149.059 6300.0 151.0384 11000.0 151.0751 100000.0 153.0537 5800.0 154.7753 3200.0 155.3067 2500.0 157.065 15000.0 158.0724 3100.0 163.0758 2800.0 165.0915 2800.0 167.2104 2700.0 172.0882 14000.0 173.5234 21000.0 173.5351 36000.0 173.5444 14000.0 174.0674 34000.0 175.0752 30000.0 177.0909 17000.0 179.0705 3600.0 187.0752 29000.0 188.083 45000.0 189.0909 150000.0 191.1071 2500.0 201.091 250000.0 201.1134 4600.0 203.1066 73000.0 205.3626 2600.0 213.0914 10000.0 217.0863 3200.0 224.4708 2300.0 231.1018 46000.0 233.0966 6700.0 241.084 2500.0 245.095 2800.0 246.1035 4600.0 247.075 2500.0 251.107 3600.0 253.087 3200.0 254.0945 4500.0 261.0907 28000.0 262.0989 24000.0 265.1209 4500.0 268.1442 2500.0 269.0809 14000.0 270.0882 5200.0 273.0903 2500.0 274.0992 23000.0 275.1045 3800.0 277.0912 3600.0 277.1226 26000.0 278.0938 13000.0 279.102 14000.0 284.1047 45000.0 285.1142 3900.0 287.9091 2500.0 290.0951 15000.0 291.1021 27000.0 293.1172 33000.0 294.1252 31000.0 295.0969 5400.0 297.114 18000.0 305.1175 58000.0 306.1258 39000.0 307.0974 18000.0 309.1124 5100.0 310.1204 57000.0 322.1205 22000.0 325.1443 28000.0 337.1442 34000.0 END IONS BEGIN IONS SCANS=247 PEPMASS=575.21 CHARGE=1 COLLISION_ENERGY=0.0 74.5231 2400.0 79.9507 2300.0 97.7391 2500.0 137.0594 20000.0 151.0751 17000.0 173.5399 11000.0 175.0749 4700.0 177.0902 3500.0 187.0742 2900.0 189.0906 9800.0 190.6507 2500.0 203.0526 66000.0 203.1065 10000.0 234.9821 2400.0 325.1442 4200.0 337.143 2400.0 377.1359 3800.0 395.1468 15000.0 575.2087 27000.0 END IONS BEGIN IONS SCANS=248 PEPMASS=540.1898 CHARGE=1 COLLISION_ENERGY=0.0 65.0384 20000.0 65.7198 2100.0 74.156 2600.0 74.2014 2500.0 75.0439 56000.0 77.0386 5200.0 78.0464 20000.0 78.1648 2200.0 79.0539 10000.0 85.0282 39000.0 87.2583 2300.0 89.0389 2900.0 89.0595 34000.0 91.054 60000.0 93.0333 380000.0 93.0397 3000.0 93.0697 55000.0 95.0489 35000.0 97.0648 19000.0 103.0541 36000.0 105.0443 5800.0 105.0697 21000.0 106.0335 4000.0 106.0411 190000.0 106.0493 3400.0 107.0488 20000.0 109.0651 5800.0 115.7435 2200.0 116.424 2300.0 117.0337 5800.0 118.0414 5800.0 119.0491 9200.0 121.0646 390000.0 121.0794 3000.0 122.0722 2500.0 123.044 13000.0 123.0798 6400.0 125.0492 3000.0 125.0595 230000.0 131.0489 17000.0 132.9416 2500.0 133.0648 15000.0 134.0362 30000.0 135.0436 9100.0 135.0799 6100.0 137.0594 24000.0 138.0675 3300.0 139.0751 38000.0 145.0282 36000.0 148.0518 22000.0 149.0595 1300000.0 149.0699 14000.0 149.0736 6700.0 149.0878 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22000.0 113.059 4500.0 115.0384 65000.0 117.0541 7300.0 123.044 2800.0 123.8962 2300.0 127.0384 32000.0 129.0541 61000.0 133.0491 22000.0 137.0594 3100.0 139.0379 2400.0 145.0491 27000.0 145.0615 3200.0 149.0441 4500.0 149.0578 2900.0 151.0402 2700.0 151.0756 3400.0 153.0182 6000.0 153.0539 8800.0 171.0645 15000.0 173.5216 24000.0 173.5408 41000.0 179.0691 2900.0 225.0753 8000.0 245.2788 2500.0 248.2799 2400.0 258.0529 2500.0 261.0962 9600.0 286.9793 22000.0 286.997 13000.0 287.0549 3300000.0 287.1296 24000.0 287.1505 5200.0 299.055 8700.0 329.0663 16000.0 353.062 4200.0 529.0477 2800.0 612.7719 2500.0 END IONS BEGIN IONS SCANS=250 PEPMASS=595.1658 CHARGE=1 COLLISION_ENERGY=0.0 69.3858 2100.0 71.0487 31000.0 77.3926 2600.0 78.1976 2100.0 80.4254 2500.0 82.0217 2200.0 85.028 46000.0 92.3404 2700.0 95.2094 2400.0 97.0281 4000.0 129.0541 2500.0 145.1802 2400.0 153.5209 2200.0 157.6064 2500.0 165.3761 2200.0 173.5236 8200.0 173.5323 39000.0 173.5435 3200.0 174.159 2800.0 194.0182 2400.0 223.0726 2300.0 241.9687 2400.0 287.0164 3600.0 287.0551 400000.0 287.0914 5800.0 291.8618 2400.0 312.9709 2600.0 371.6186 2500.0 409.0896 2300.0 428.5607 2300.0 481.5931 2500.0 END IONS BEGIN IONS SCANS=251 PEPMASS=311.0669 CHARGE=1 COLLISION_ENERGY=0.0 51.3582 2200.0 51.9028 2300.0 55.0079 2400.0 57.5655 2300.0 57.6156 2200.0 60.9288 2600.0 64.0592 2200.0 67.7854 2300.0 70.8391 2500.0 73.9189 2300.0 78.4112 2300.0 89.2111 2000.0 94.9361 2400.0 96.044 17000.0 105.0329 9900.0 113.5761 3000.0 120.0446 2300.0 121.587 2100.0 122.0234 4900.0 122.7671 2400.0 137.8557 2100.0 148.0389 51000.0 170.0591 2700.0 172.7013 2300.0 173.5225 23000.0 173.5408 37000.0 174.8948 2500.0 184.0758 3700.0 185.0709 6900.0 186.0557 4100.0 194.0605 4400.0 199.0865 17000.0 209.071 41000.0 210.0552 56000.0 211.0862 9600.0 212.0702 6400.0 213.0661 11000.0 221.0717 7500.0 222.0545 3800.0 226.0486 2500.0 227.0816 51000.0 237.0659 92000.0 238.0498 82000.0 238.074 8400.0 239.0819 11000.0 240.0668 3500.0 241.0606 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208.8831 58000.0 223.1222 3200.0 226.2115 3400.0 226.7482 2600.0 226.8936 28000.0 227.1302 2400.0 229.1223 4400.0 230.1245 2400.0 244.1342 14000.0 246.1487 2000000.0 251.9019 2500.0 252.2504 2600.0 265.946 2700.0 304.133 3000.0 304.1514 5300.0 304.1909 540000.0 304.2293 5400.0 END IONS BEGIN IONS SCANS=253 PEPMASS=382.7086 CHARGE=1 COLLISION_ENERGY=0.0 70.0284 13000.0 70.0648 290000.0 72.4092 2200.0 74.878 2300.0 75.5402 2100.0 77.5289 2400.0 84.0805 3000.0 86.0962 1900000.0 86.101 8200.0 87.055 27000.0 87.0788 18000.0 87.0994 31000.0 88.0391 24000.0 91.0539 19000.0 93.1626 2600.0 97.0764 3200.0 98.0598 30000.0 99.055 3300.0 100.0872 2500.0 100.8187 2400.0 105.5171 2200.0 106.2725 2600.0 112.0865 150000.0 113.0951 2900.0 113.5868 24000.0 114.6698 2400.0 115.0498 93000.0 115.0863 22000.0 118.0647 61000.0 119.0487 38000.0 119.0721 4300.0 120.0804 110000.0 121.3742 2100.0 123.0436 51000.0 124.0869 5100.0 125.0707 16000.0 126.0551 8100.0 129.1132 17000.0 131.0493 5700.0 132.0803 5200.0 135.0675 71000.0 136.0753 280000.0 136.0875 3400.0 138.1026 3000.0 140.0817 34000.0 144.0805 6500.0 146.0465 5300.0 146.0596 550000.0 146.0959 30000.0 147.0437 43000.0 147.0629 13000.0 151.1232 2500.0 157.0944 3400.0 157.1082 160000.0 157.1331 37000.0 161.107 4300.0 165.0544 280000.0 165.1003 2400.0 166.1335 3500.0 167.1172 21000.0 169.101 21000.0 171.4464 2400.0 173.5236 34000.0 173.5369 54000.0 177.1054 28000.0 178.1149 42000.0 178.4772 2400.0 182.0634 3000.0 182.081 180000.0 183.0852 2500.0 183.1122 41000.0 183.126 3900.0 186.1137 3200.0 189.1021 55000.0 191.1054 29000.0 192.1134 12000.0 193.1443 3100.0 194.1285 96000.0 195.1126 340000.0 195.1331 5200.0 195.7613 2300.0 196.115 13000.0 197.0962 3600.0 200.1103 81000.0 204.1384 59000.0 209.1395 41000.0 210.1489 4600.0 217.0972 83000.0 217.1337 44000.0 220.1052 2500.0 224.1072 17000.0 226.1662 20000.0 227.1742 24000.0 228.1013 19000.0 234.1241 40000.0 236.0754 2000.0 236.1072 6900.0 236.1504 19000.0 237.1345 160000.0 238.1398 3200.0 243.1129 24000.0 250.1435 140000.0 251.1473 2600.0 253.1763 24000.0 254.1608 870000.0 254.1849 3000.0 255.1632 28000.0 263.152 3200.0 267.6459 9500.0 270.1126 200000.0 271.1154 11000.0 271.1875 20000.0 272.644 2300.0 276.145 15000.0 279.1779 2700.0 280.1401 27000.0 282.1131 25000.0 286.1613 2800.0 290.4149 2300.0 293.1723 27000.0 294.1581 3500.0 296.176 38000.0 299.1391 5200.0 306.1582 2900.0 308.9036 2900.0 311.183 35000.0 312.1825 2700.0 314.1861 18000.0 321.1703 3300.0 322.1545 52000.0 322.1917 3300.0 324.6788 5100.0 336.2146 36000.0 337.1972 13000.0 338.1965 16000.0 339.1841 3200.0 340.1648 16000.0 340.659 2500.0 346.4861 2600.0 352.2083 2700.0 354.2244 130000.0 355.224 84000.0 356.2085 120000.0 360.0291 26000.0 364.2098 37000.0 365.2072 10000.0 368.7119 2600.0 372.2247 4700.0 373.2348 400000.0 373.2875 2800.0 374.2374 35000.0 381.2036 91000.0 382.1797 6700.0 382.2213 41000.0 383.2145 4000.0 390.2503 6600.0 396.1913 8300.0 398.23 14000.0 399.2143 300000.0 399.2664 4200.0 400.2173 24000.0 407.2251 3000.0 411.204 2600.0 420.6791 2800.0 424.2464 50000.0 425.2312 45000.0 426.2625 2800.0 442.2561 170000.0 443.2616 20000.0 448.6555 2900.0 449.2996 38000.0 452.2416 2500.0 467.2336 2600.0 469.2697 3200.0 470.2519 72000.0 471.2539 4600.0 487.2775 7600.0 513.1528 2700.0 521.2392 13000.0 529.4775 2600.0 534.2804 11000.0 535.266 16000.0 555.3393 9600.0 561.2832 4000.0 562.2755 3500.0 562.2938 2800.0 563.2618 6900.0 577.3236 12000.0 578.3096 52000.0 579.3113 26000.0 579.3307 3300.0 580.2881 84000.0 605.3172 20000.0 606.3039 70000.0 607.3149 3200.0 623.2127 8800.0 623.3295 460000.0 623.4186 2000.0 624.3324 60000.0 651.3256 45000.0 END IONS BEGIN IONS SCANS=254 PEPMASS=300.1599 CHARGE=1 COLLISION_ENERGY=0.0 50.016 3800.0 51.0233 6300.0 53.7117 4000.0 54.693 4100.0 58.065 15000.0 77.0388 26000.0 79.0541 42000.0 91.054 23000.0 92.2929 5200.0 93.07 17000.0 95.049 67000.0 103.0543 17000.0 105.0446 21000.0 105.0696 27000.0 105.1679 5300.0 107.0318 71000.0 107.0354 25000.0 107.049 13000000.0 107.0641 190000.0 107.0661 58000.0 107.0712 22000.0 107.0756 13000.0 115.0542 23000.0 117.0697 160000.0 119.0489 18000.0 121.0647 270000.0 124.0516 37000.0 125.1052 5000.0 128.0617 15000.0 129.0697 64000.0 130.0764 4700.0 131.049 43000.0 131.0856 13000.0 133.0646 41000.0 135.0805 7600.0 136.0518 130000.0 137.0594 27000.0 139.0751 38000.0 143.0493 21000.0 144.0568 45000.0 145.0646 1700000.0 145.0751 12000.0 145.0913 8500.0 146.0726 58000.0 147.0804 28000.0 150.0674 76000.0 151.0752 1300000.0 151.0867 9400.0 155.0601 70000.0 157.0643 17000.0 158.0725 510000.0 158.0874 9600.0 159.044 53000.0 159.0805 98000.0 160.0517 6200.0 161.0597 55000.0 161.0956 8100.0 161.2738 5300.0 162.0677 28000.0 163.0753 21000.0 164.0824 6500.0 165.091 390000.0 173.0604 5900.0 173.531 31000.0 173.5391 16000.0 174.0675 1000000.0 174.0932 15000.0 175.0755 55000.0 175.0988 11000.0 176.066 8200.0 176.0832 260000.0 177.0733 9500.0 177.091 500000.0 177.1049 3200.0 178.0868 18000.0 180.102 15000.0 189.0508 12000.0 189.0909 3000000.0 190.0817 5500.0 190.0987 96000.0 192.1018 120000.0 195.0789 4600.0 207.0801 17000.0 208.0876 5100.0 209.0956 22000.0 219.0806 28000.0 220.0879 22000.0 221.0959 52000.0 223.1122 24000.0 224.0836 31000.0 224.1201 5300.0 225.0914 24000.0 226.0978 9500.0 235.0735 7500.0 235.1125 6000.0 236.083 40000.0 237.0908 210000.0 239.0702 24000.0 239.1059 28000.0 240.1148 15000.0 246.7426 5000.0 251.1065 110000.0 252.1143 2000000.0 252.1758 14000.0 253.0854 110000.0 254.0933 110000.0 255.1015 44000.0 255.1337 5200.0 268.1092 1300000.0 271.1332 4900.0 281.1175 23000.0 283.1329 1500000.0 300.1589 52000.0 END IONS BEGIN IONS SCANS=255 PEPMASS=376.2123 CHARGE=1 COLLISION_ENERGY=0.0 55.5355 2200.0 58.0651 150000.0 59.073 10000.0 59.6842 2100.0 62.9386 2100.0 65.3128 2200.0 69.0828 2300.0 71.3375 2200.0 71.5228 2300.0 81.2259 2900.0 96.7174 2600.0 98.8909 2700.0 103.8979 2200.0 107.0493 2800.0 109.3048 2600.0 118.0849 2500.0 131.1086 2100.0 135.081 4100.0 142.603 2100.0 147.0805 14000.0 148.8088 2300.0 163.0755 83000.0 164.0833 630000.0 164.0994 4700.0 173.523 6100.0 173.5389 35000.0 176.084 4400.0 177.0912 140000.0 178.084 11000.0 178.099 1200000.0 191.1068 36000.0 191.8434 2200.0 192.1146 270000.0 197.0675 2400.0 209.1413 59000.0 222.13 7000.0 222.1491 1100000.0 229.9272 3000.0 236.1643 25000.0 237.1434 9300.0 237.1515 8400.0 237.1725 850000.0 272.449 2700.0 284.1412 13000.0 298.6677 2400.0 306.5042 2300.0 318.2376 2900.0 321.5779 2400.0 329.4851 3200.0 343.2145 24000.0 348.1642 2700.0 END IONS BEGIN IONS SCANS=256 PEPMASS=492.2597 CHARGE=1 COLLISION_ENERGY=0.0 58.062 4200.0 58.0648 160000.0 60.2525 2200.0 60.6283 2300.0 61.0283 7300.0 61.4871 2100.0 69.0332 37000.0 71.0489 5400.0 72.6657 2300.0 74.9794 2400.0 79.0463 2700.0 81.0334 4000.0 85.0281 120000.0 87.0439 16000.0 89.4731 2100.0 91.0389 3300.0 91.0539 3200.0 91.5527 2200.0 93.0699 3200.0 95.0482 3700.0 97.0282 30000.0 99.0436 12000.0 101.023 3200.0 103.0383 2600.0 107.0488 47000.0 108.8763 2300.0 109.028 16000.0 117.635 2400.0 119.0488 16000.0 119.0851 3200.0 121.0645 360000.0 121.0743 7700.0 123.0804 4100.0 124.0516 3500.0 125.0595 12000.0 127.0385 33000.0 128.5908 2300.0 129.0699 2600.0 133.0646 27000.0 135.0802 28000.0 137.0593 16000.0 139.075 28000.0 141.0906 7100.0 145.0504 13000.0 145.0644 46000.0 147.0801 220000.0 149.059 9100.0 149.0954 11000.0 150.0674 3000.0 150.8086 2300.0 151.0751 120000.0 152.0833 6300.0 159.0802 21000.0 161.0958 35000.0 163.0752 160000.0 165.0908 270000.0 167.1067 11000.0 171.0802 2400.0 173.0954 12000.0 173.5189 5600.0 173.5284 20000.0 173.5369 51000.0 176.0831 2600.0 177.0908 44000.0 179.0137 2500.0 179.1065 16000.0 183.0809 6800.0 189.0905 2800.0 191.1064 83000.0 197.0961 22000.0 225.0916 19000.0 225.1272 96000.0 235.1112 3000.0 238.0997 7800.0 253.1219 130000.0 254.1295 18000.0 256.1091 36000.0 257.1178 6900.0 257.1523 16000.0 267.1376 16000.0 270.1248 130000.0 271.1334 2500.0 283.1326 11000.0 285.1109 4500.0 285.1485 1200000.0 309.1484 20000.0 327.159 35000.0 330.2062 67000.0 330.2427 3100.0 378.9906 2400.0 492.2596 190000.0 END IONS BEGIN IONS SCANS=257 PEPMASS=506.2754 CHARGE=1 COLLISION_ENERGY=0.0 61.0284 2900.0 67.1473 2200.0 69.0334 41000.0 73.0285 3000.0 75.0439 3300.0 77.923 2300.0 81.0333 13000.0 85.0282 120000.0 87.0438 14000.0 89.7382 2400.0 91.0539 3900.0 95.0488 3900.0 95.8373 2600.0 97.0282 33000.0 99.044 10000.0 101.0602 3200.0 104.7293 2200.0 107.0491 52000.0 108.2462 2100.0 109.0283 20000.0 109.377 2700.0 111.0437 2400.0 117.0343 2500.0 119.0488 26000.0 119.0856 7700.0 121.0554 3300.0 121.0646 460000.0 121.0729 2000.0 123.0806 5600.0 125.0596 15000.0 127.0388 36000.0 131.048 3000.0 133.0646 46000.0 135.0439 2700.0 135.0803 33000.0 137.0598 12000.0 139.0753 38000.0 141.091 6300.0 145.0514 9800.0 145.0646 51000.0 147.0802 270000.0 149.0598 14000.0 149.0961 7800.0 151.0752 150000.0 152.0831 7700.0 159.0803 24000.0 160.088 3000.0 161.0959 46000.0 163.0609 3800.0 163.0753 170000.0 164.0853 2900.0 165.077 2000.0 165.0909 310000.0 167.1066 12000.0 171.08 3200.0 173.096 11000.0 173.5245 25000.0 173.5408 44000.0 177.0745 3900.0 177.091 50000.0 179.1066 13000.0 182.4962 2400.0 183.0798 8300.0 189.0906 10000.0 190.8822 2500.0 191.1065 100000.0 196.0877 2700.0 197.0957 18000.0 206.4604 2500.0 207.6468 2200.0 210.7933 2500.0 211.1134 3000.0 219.5987 2200.0 224.0823 3800.0 225.0905 14000.0 225.1273 120000.0 235.1121 8100.0 238.0985 12000.0 240.858 2600.0 243.1366 2500.0 244.7525 2500.0 253.1218 160000.0 254.1301 18000.0 256.1092 40000.0 257.1176 5600.0 257.1528 12000.0 267.1375 20000.0 270.1251 170000.0 271.1338 2600.0 277.1213 2400.0 283.1334 16000.0 285.1209 6900.0 285.1486 1700000.0 292.9128 2500.0 309.1488 24000.0 310.787 2700.0 327.1587 43000.0 342.4223 2400.0 344.218 2800.0 398.8828 2700.0 433.1512 2600.0 437.9278 2900.0 449.5094 2600.0 506.274 170000.0 511.6328 2200.0 END IONS BEGIN IONS SCANS=258 PEPMASS=757.2191 CHARGE=1 COLLISION_ENERGY=0.0 71.0487 52000.0 74.6841 2500.0 80.4236 2400.0 81.0333 6200.0 83.0487 17000.0 84.4645 2200.0 85.0279 120000.0 85.034 2500.0 85.2947 2300.0 87.0435 17000.0 90.2781 2300.0 96.0698 2200.0 97.0279 45000.0 99.0439 3200.0 102.8118 2500.0 103.1862 2400.0 107.8844 2300.0 111.0437 13000.0 115.0385 26000.0 115.0473 2300.0 126.7485 2400.0 127.0387 11000.0 129.0542 20000.0 133.0491 3700.0 134.6731 2400.0 145.0491 2800.0 151.0377 2300.0 152.1196 2300.0 173.5238 24000.0 173.533 24000.0 173.5428 13000.0 218.557 2500.0 221.7879 2800.0 227.548 2700.0 230.0829 2500.0 245.309 2300.0 280.778 2700.0 285.0399 2800.0 287.0553 32000.0 302.0432 17000.0 317.0654 1600000.0 359.0744 13000.0 538.5103 2500.0 650.4453 2800.0 END IONS BEGIN IONS SCANS=259 PEPMASS=579.1508 CHARGE=1 COLLISION_ENERGY=0.0 64.5334 2300.0 64.723 2200.0 68.927 2500.0 69.4317 2100.0 71.4262 2500.0 72.5012 2600.0 73.986 2300.0 76.7417 2500.0 78.4298 2300.0 81.7393 2900.0 84.9374 2500.0 88.2515 2500.0 88.9675 2500.0 89.1601 2700.0 90.443 2400.0 90.5051 2500.0 92.1054 2500.0 109.313 2300.0 117.3584 2400.0 119.0481 3000.0 119.2661 2200.0 123.0337 15000.0 123.0435 610000.0 123.0547 3400.0 127.0282 7600.0 127.0385 510000.0 127.0498 6500.0 128.1241 2100.0 128.6396 2400.0 135.0436 91000.0 139.0273 4200.0 139.0385 270000.0 139.051 3100.0 142.8467 2100.0 146.8519 2600.0 147.0436 70000.0 151.0385 39000.0 154.9769 2300.0 160.7628 2200.0 161.0594 16000.0 161.4562 2800.0 162.225 3900.0 163.0386 270000.0 163.3798 2600.0 165.0542 93000.0 167.0337 36000.0 169.0494 2500.0 169.5035 2500.0 169.8833 2500.0 173.5208 7200.0 173.5291 61000.0 173.5406 33000.0 177.054 14000.0 179.0335 22000.0 180.5844 2200.0 181.0196 2500.0 181.0495 17000.0 187.0386 27000.0 191.0336 31000.0 193.0491 11000.0 195.2999 3100.0 197.1178 2400.0 201.054 11000.0 203.0333 31000.0 203.0702 7500.0 205.0493 19000.0 207.065 22000.0 215.0691 2500.0 217.0492 2700.0 229.0492 32000.0 229.1847 3000.0 231.0663 2600.0 232.0892 2800.0 233.0443 27000.0 243.0651 43000.0 245.0442 110000.0 247.0597 150000.0 255.0648 20000.0 257.0441 100000.0 259.0598 41000.0 261.0759 3100.0 267.9466 2400.0 269.0444 21000.0 271.06 160000.0 273.0767 12000.0 275.0551 150000.0 283.0602 96000.0 285.0758 25000.0 287.0551 530000.0 291.0857 18000.0 295.0614 2700.0 299.0552 130000.0 301.0717 40000.0 303.0867 6400.0 311.0542 2700.0 363.2834 2900.0 391.0811 7200.0 391.3152 2800.0 400.7737 2900.0 409.0921 260000.0 411.1061 7800.0 421.0937 7200.0 433.0919 2800.0 435.1074 13000.0 451.3876 2400.0 END IONS BEGIN IONS SCANS=260 PEPMASS=346.2017 CHARGE=1 COLLISION_ENERGY=0.0 50.691 2400.0 52.0444 2700.0 52.0546 2300.0 54.3073 2000.0 56.0349 2300.0 57.8345 2500.0 60.0808 21000.0 64.4422 2200.0 69.7594 2300.0 80.9905 2400.0 81.0699 2500.0 81.2363 2300.0 91.0483 3200.0 91.0542 120000.0 95.0491 39000.0 101.0146 2500.0 101.2231 2500.0 107.0491 50000.0 107.2053 2300.0 109.0648 22000.0 111.044 25000.0 116.0313 2300.0 117.0698 150000.0 119.0491 120000.0 119.0863 2900.0 121.0648 38000.0 123.035 4300.0 123.0439 180000.0 124.129 2400.0 125.0597 32000.0 126.1409 2100.0 131.0491 39000.0 133.0648 51000.0 135.044 200000.0 135.0559 3400.0 135.0807 19000.0 136.0513 3700.0 137.0596 2500000.0 137.084 5600.0 138.0684 5800.0 139.0749 2500.0 143.0492 16000.0 145.0514 9100.0 145.0647 430000.0 145.0747 2600.0 146.0728 6100.0 147.0442 12000.0 147.0802 16000.0 149.0231 11000.0 149.0596 280000.0 149.0738 3100.0 149.0965 8200.0 150.0675 48000.0 151.0629 10000.0 151.0753 1100000.0 151.0957 2900.0 152.0831 16000.0 153.0552 12000.0 153.091 7100.0 157.0638 3800.0 159.0798 3700.0 160.4205 2600.0 161.0596 51000.0 162.0675 13000.0 163.059 3400.0 163.0754 620000.0 163.091 6400.0 164.0813 6600.0 165.0911 95000.0 173.0607 2800.0 173.5289 51000.0 173.5408 21000.0 175.0753 14000.0 177.0734 4900.0 177.0911 770000.0 178.0993 19000.0 181.0649 21000.0 181.1012 58000.0 187.0742 5500.0 190.1088 2500.0 191.0859 22000.0 194.0727 7100.0 195.0806 26000.0 198.0675 9700.0 199.0749 22000.0 199.1129 3100.0 209.0607 15000.0 209.0962 270000.0 209.118 5100.0 211.0708 2400.0 212.0847 4100.0 213.091 16000.0 219.0804 38000.0 222.0687 2900.0 223.112 24000.0 226.0623 40000.0 226.0983 3000.0 226.7343 2600.0 227.0692 35000.0 227.1068 500000.0 230.3 2500.0 237.091 310000.0 240.0781 35000.0 241.0905 3600.0 241.1223 180000.0 251.1065 28000.0 254.094 3200.0 255.0701 2800.0 255.1015 520000.0 255.1325 11000.0 258.0884 100000.0 259.0999 3100.0 259.1328 22000.0 269.1172 170000.0 287.0896 3400.0 287.1279 750000.0 302.7144 3100.0 346.2008 67000.0 END IONS BEGIN IONS SCANS=261 PEPMASS=404.1558 CHARGE=1 COLLISION_ENERGY=0.0 57.0332 59000.0 59.5287 2400.0 60.7301 2200.0 61.8211 2600.0 63.5819 2100.0 64.1598 2500.0 64.9778 2300.0 66.1941 2300.0 67.0247 2700.0 67.4449 2500.0 71.9586 2400.0 73.028 9100.0 73.4315 2400.0 75.0437 72000.0 75.4233 2500.0 76.7274 2400.0 85.028 66000.0 87.9058 2300.0 88.3413 2500.0 91.0539 2300000.0 91.0619 16000.0 91.0639 8200.0 94.7177 2300.0 95.0125 17000.0 96.5839 2700.0 101.0688 2600.0 103.0391 2800.0 113.0231 31000.0 118.0864 3700.0 119.0488 25000.0 121.9829 2500.0 122.5374 2500.0 122.9603 2400.0 129.1658 2300.0 131.0334 29000.0 137.0481 3500.0 137.0594 270000.0 137.0714 4100.0 141.0179 190000.0 144.9818 2700.0 145.0211 2200.0 159.0288 12000.0 162.5924 2500.0 165.0707 2300.0 169.6627 2300.0 173.5235 15000.0 173.5331 100000.0 173.5429 22000.0 174.8128 2600.0 181.0115 2700.0 188.6071 2700.0 193.0654 14000.0 193.0859 1300000.0 193.1066 16000.0 193.434 2300.0 202.544 2800.0 211.097 9800.0 252.1297 2400.0 255.4798 2500.0 261.524 2300.0 331.1441 2800.0 347.6565 2400.0 359.949 2300.0 380.4065 2400.0 386.5981 2500.0 409.9354 2300.0 END IONS BEGIN IONS SCANS=262 PEPMASS=684.2505 CHARGE=1 COLLISION_ENERGY=0.0 67.3394 2500.0 69.0331 37000.0 71.0254 2600.0 78.8587 2400.0 79.2661 2200.0 83.0484 2200.0 85.0281 30000.0 87.0386 2900.0 87.0436 46000.0 97.0225 3400.0 97.028 52000.0 114.4094 2500.0 115.0385 58000.0 119.7259 2500.0 127.0389 2600.0 131.2959 3100.0 133.049 26000.0 137.0479 4900.0 137.0593 220000.0 146.8815 2400.0 150.0758 7700.0 161.0602 3800.0 173.5273 50000.0 173.5447 9300.0 175.0755 8300.0 189.0541 2600.0 194.7145 2900.0 201.0546 16000.0 203.0712 3400.0 207.0651 26000.0 219.0647 13000.0 228.3723 2400.0 231.0639 9400.0 237.0896 3700.0 265.0856 25000.0 277.0855 4800.0 279.1017 3000.0 283.0961 5700.0 293.0809 40000.0 293.8405 2400.0 297.1123 23000.0 305.0795 13000.0 307.0968 60000.0 309.1122 8700.0 311.0887 4700.0 323.0908 5600.0 325.1073 150000.0 337.1066 26000.0 343.1176 36000.0 355.1169 5300.0 363.5962 2600.0 END IONS BEGIN IONS SCANS=263 PEPMASS=621.1796 CHARGE=1 COLLISION_ENERGY=0.0 65.2057 2500.0 67.0423 2400.0 68.6571 2200.0 71.1145 2400.0 71.3085 2300.0 76.2461 2300.0 84.5222 2300.0 84.7049 2200.0 92.7811 2200.0 93.109 2300.0 97.6644 2100.0 100.442 2400.0 115.3398 3100.0 115.6548 2300.0 122.6011 2500.0 126.4182 2400.0 131.5866 2400.0 141.1395 2300.0 143.0307 6000.0 149.6896 5200.0 173.5267 60000.0 173.5422 22000.0 181.6407 2700.0 217.2791 2500.0 221.0806 7500.0 253.7471 2500.0 275.5473 2500.0 293.2797 2300.0 361.0246 54000.0 375.078 2800.0 381.0954 16000.0 404.0193 3000.0 411.1065 17000.0 435.1054 9900.0 441.117 27000.0 446.6597 2600.0 453.1154 16000.0 459.1241 6100.0 465.1172 21000.0 471.1251 5500.0 477.1138 4100.0 483.1266 91000.0 495.1273 30000.0 501.1363 95000.0 507.1269 8000.0 513.1369 120000.0 519.126 3400.0 525.1372 12000.0 531.1469 57000.0 549.1383 29000.0 567.1479 71000.0 585.1584 130000.0 603.1687 160000.0 621.1791 60000.0 END IONS BEGIN IONS SCANS=264 PEPMASS=599.1978 CHARGE=1 COLLISION_ENERGY=0.0 68.1481 2300.0 69.0334 5800.0 70.4862 5900.0 75.813 5700.0 77.0385 6000.0 78.0627 6200.0 81.0333 32000.0 81.4632 6500.0 85.0282 270000.0 86.4127 7900.0 92.3029 2300.0 95.049 24000.0 97.0283 57000.0 98.4621 2400.0 99.4506 2700.0 99.8086 2200.0 101.2828 3400.0 103.0386 58000.0 103.3931 6200.0 107.049 6100000.0 107.0552 32000.0 107.066 18000.0 109.0281 38000.0 111.1629 2700.0 111.3515 3200.0 113.3262 3200.0 114.0319 3300.0 121.0281 33000.0 121.0647 48000.0 122.2125 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720000.0 249.0404 18000.0 249.0745 24000.0 253.0467 7600.0 255.0651 68000.0 257.0444 59000.0 259.0284 18000.0 259.0598 1100000.0 261.0404 15000.0 261.0759 42000.0 263.0549 4600.0 264.1731 3000.0 265.0708 52000.0 267.0651 7000.0 269.0443 39000.0 269.0806 13000.0 271.0601 430000.0 273.043 16000.0 273.0756 230000.0 275.0561 51000.0 275.0887 27000.0 277.0708 670000.0 279.0649 4200.0 281.0814 12000.0 283.0601 260000.0 285.0762 120000.0 287.0551 100000.0 287.0916 330000.0 289.0707 570000.0 293.0806 32000.0 295.058 26000.0 295.657 6300.0 297.0753 110000.0 299.0551 64000.0 299.0917 380000.0 301.04 2000.0 301.0708 1100000.0 301.1034 2400.0 305.0721 32000.0 307.0127 2400.0 307.0819 98000.0 309.0762 25000.0 311.0551 51000.0 311.0916 410000.0 313.0707 560000.0 313.1101 3000.0 315.0866 82000.0 317.1025 110000.0 319.0816 220000.0 323.0911 170000.0 325.0707 420000.0 325.1079 27000.0 327.0864 320000.0 329.0602 18000.0 329.0684 5400.0 329.102 810000.0 329.1466 9800.0 329.2567 2500.0 331.0813 71000.0 335.089 75000.0 337.0695 54000.0 337.1058 21000.0 339.0864 62000.0 341.0597 26000.0 341.1017 570000.0 341.1494 3900.0 343.0813 350000.0 347.0897 85000.0 349.108 7500.0 353.0514 18000.0 353.1016 1700000.0 353.1378 3800.0 353.1525 30000.0 355.0809 250000.0 357.1011 8200.0 359.0905 40000.0 361.0939 120000.0 363.0874 9300.0 365.0481 16000.0 365.1015 1200000.0 365.1554 16000.0 367.0805 110000.0 367.1247 9100.0 371.0917 17000.0 371.1018 6900.0 373.0933 73000.0 376.1688 3700.0 377.051 4700.0 377.102 510000.0 379.1181 76000.0 381.0966 54000.0 383.1125 760000.0 383.1563 2500.0 385.0932 89000.0 389.1018 350000.0 391.1167 61000.0 393.0968 110000.0 393.1494 3000.0 395.1125 1700000.0 401.1037 86000.0 403.1133 88000.0 407.0497 7800.0 407.1126 980000.0 407.1752 13000.0 407.205 4000.0 411.1074 49000.0 413.1217 370000.0 415.117 14000.0 417.1353 3500.0 419.1125 1400000.0 419.1627 2400.0 421.127 26000.0 425.1224 150000.0 429.1179 77000.0 431.1166 980000.0 433.1287 50000.0 437.1212 29000.0 443.1149 170000.0 443.1994 2500.0 445.1279 40000.0 449.1225 330000.0 451.1466 7800.0 455.1147 23000.0 461.0519 4200.0 461.1225 660000.0 467.1336 64000.0 473.1221 230000.0 479.1329 500000.0 491.1323 170000.0 497.1433 170000.0 509.1437 57000.0 604.9941 6800.0 END IONS BEGIN IONS SCANS=265 PEPMASS=581.1872 CHARGE=1 COLLISION_ENERGY=0.0 71.7801 2600.0 72.0451 2400.0 73.2672 2300.0 73.8738 2300.0 74.0476 2400.0 81.7473 2600.0 83.7268 2400.0 85.0281 20000.0 87.3452 2200.0 92.7359 2300.0 96.7407 2200.0 102.261 2200.0 103.0605 2100.0 103.5769 2300.0 104.1714 2400.0 107.0406 5700.0 107.0488 430000.0 107.0575 3100.0 123.0447 2200.0 124.6011 2400.0 124.6993 2500.0 124.8311 2200.0 133.3443 2100.0 143.2304 2300.0 143.6573 2600.0 147.5483 2500.0 149.0584 2600.0 163.0385 7400.0 173.5216 31000.0 173.5379 110000.0 180.5816 2500.0 181.051 2700.0 182.7401 2900.0 193.0496 8900.0 205.0495 32000.0 217.0496 35000.0 217.0943 2200.0 221.0457 4200.0 229.4624 2300.0 231.0297 2300.0 231.0652 5400.0 235.0602 37000.0 238.3455 2500.0 240.3257 2200.0 243.0665 5200.0 247.0601 59000.0 259.0598 83000.0 267.302 2600.0 271.0603 30000.0 273.0765 7400.0 277.072 33000.0 283.0593 21000.0 285.0772 3100.0 287.0551 37000.0 287.0909 29000.0 289.0707 41000.0 299.0568 2700.0 299.0913 35000.0 301.071 90000.0 311.0919 19000.0 313.0713 45000.0 313.6718 2600.0 319.0798 6700.0 323.0916 3800.0 325.0708 38000.0 327.086 21000.0 329.1024 55000.0 331.0854 2500.0 341.1022 15000.0 343.0815 26000.0 351.9348 2500.0 353.102 190000.0 353.1517 2900.0 355.0807 19000.0 355.8544 2700.0 361.092 6500.0 365.1024 110000.0 367.0804 4500.0 377.1014 42000.0 378.0494 2400.0 383.1131 54000.0 389.1024 16000.0 393.0987 4000.0 395.113 150000.0 403.1172 3500.0 407.1134 85000.0 413.1228 37000.0 419.1131 140000.0 425.1252 9700.0 426.4299 2900.0 429.1169 3000.0 431.118 96000.0 434.1702 2900.0 443.1172 6600.0 449.1229 30000.0 451.1375 2600.0 455.1845 2700.0 461.1231 71000.0 467.1344 6500.0 473.1227 12000.0 479.1344 47000.0 491.1343 25000.0 492.4137 2900.0 497.1477 4400.0 END IONS BEGIN IONS SCANS=266 PEPMASS=300.1599 CHARGE=1 COLLISION_ENERGY=0.0 48.2553 2900.0 48.8147 6900.0 49.0589 2800.0 50.0221 2300.0 50.2226 2400.0 50.7781 2700.0 55.0179 11000.0 55.783 2700.0 58.0651 38000.0 58.9642 2200.0 65.7005 2300.0 67.2773 3200.0 69.1087 2500.0 70.9332 2200.0 77.0389 8300.0 79.0541 22000.0 82.6469 2300.0 91.0541 58000.0 93.0698 43000.0 95.049 61000.0 103.0541 25000.0 104.7223 2200.0 107.0319 43000.0 107.049 9000000.0 107.0575 88000.0 107.0659 24000.0 107.0661 86000.0 107.0723 15000.0 109.0648 17000.0 109.7845 2400.0 113.9178 4100.0 115.0452 3000.0 115.0541 390000.0 117.0698 73000.0 119.0489 79000.0 121.0282 86000.0 121.0646 820000.0 121.0735 11000.0 125.0593 13000.0 129.0699 17000.0 130.9489 2700.0 131.049 110000.0 133.0647 40000.0 135.0792 2600.0 137.0595 1000000.0 137.0696 2800.0 137.1509 2400.0 143.049 1800000.0 143.0604 19000.0 144.0567 24000.0 145.0646 1000000.0 145.0745 6000.0 145.0783 19000.0 146.0964 26000.0 147.0803 82000.0 148.075 3800.0 149.0597 62000.0 149.0836 3000.0 151.0752 160000.0 153.0703 3700.0 155.0602 19000.0 157.0646 45000.0 160.0518 53000.0 161.0596 51000.0 161.0832 2800.0 162.0676 34000.0 162.0912 84000.0 163.0752 160000.0 166.0775 12000.0 167.0851 7800.0 168.9931 4200.0 173.5252 35000.0 173.5426 38000.0 174.0915 34000.0 175.0575 16000.0 175.0753 1000000.0 175.099 14000.0 176.0834 24000.0 177.0768 12000.0 177.0911 95000.0 178.0862 120000.0 179.0937 32000.0 180.0839 3800.0 180.1019 260000.0 180.9287 2400.0 181.0645 49000.0 181.1011 64000.0 182.0738 2600.0 183.0801 12000.0 189.0907 22000.0 191.0862 93000.0 192.0812 17000.0 192.1018 980000.0 192.1221 3800.0 193.1091 24000.0 194.0726 85000.0 194.1178 14000.0 195.0805 44000.0 197.0611 9500.0 197.096 100000.0 197.8907 11000.0 206.1175 100000.0 207.0806 12000.0 208.0898 3900.0 209.0596 35000.0 209.0961 770000.0 210.0669 11000.0 211.0759 25000.0 211.1118 100000.0 213.0922 3500.0 213.8856 3700.0 219.0805 140000.0 220.088 19000.0 221.0961 9700.0 222.0677 19000.0 223.1111 27000.0 223.7331 3100.0 225.0544 6400.0 225.0911 66000.0 226.098 5100.0 227.1061 9500.0 235.0742 11000.0 236.0827 33000.0 237.0908 1200000.0 237.113 12000.0 238.0985 44000.0 239.0702 30000.0 239.1066 78000.0 239.6737 2600.0 240.078 68000.0 240.1382 18000.0 241.0861 24000.0 241.1216 22000.0 242.0927 7900.0 251.1062 110000.0 252.114 4800.0 254.0659 3500.0 254.0936 140000.0 257.1171 36000.0 267.1018 16000.0 268.1329 55000.0 269.1169 2500000.0 271.1327 110000.0 283.1315 22000.0 285.1366 5400.0 290.6642 2500.0 300.1594 1600000.0 300.1899 11000.0 300.2015 5900.0 END IONS BEGIN IONS SCANS=267 PEPMASS=354.8521 CHARGE=1 COLLISION_ENERGY=0.0 83.0606 5300.0 84.0816 150000.0 86.0972 48000.0 89.3659 2200.0 91.0549 25000.0 92.0239 2300.0 92.4592 2600.0 92.7013 2300.0 93.0455 3400.0 98.0609 7000.0 107.0501 17000.0 108.7351 2400.0 109.6145 2500.0 110.0725 430000.0 110.9281 2500.0 112.1869 2600.0 118.0664 100000.0 119.0741 50000.0 120.0821 84000.0 121.5738 2700.0 122.3823 2400.0 125.0721 11000.0 129.1037 190000.0 132.8498 2200.0 134.0605 3300.0 136.0521 11000.0 136.0666 2700.0 136.077 56000.0 137.0611 6700.0 145.008 2500.0 146.0479 6400.0 146.0618 330000.0 147.0653 7800.0 148.5741 2500.0 155.0937 4500.0 161.0617 4300.0 161.3838 2400.0 162.0569 8900.0 164.0472 12000.0 165.0565 11000.0 167.8907 2600.0 169.135 5800.0 172.1142 160000.0 173.5217 6600.0 173.5313 86000.0 173.5396 24000.0 180.397 2400.0 181.074 39000.0 187.1244 5800.0 190.329 2300.0 192.9479 2500.0 197.0165 2500.0 203.0549 46000.0 205.1365 8400.0 205.5963 5600.0 215.1546 2500.0 216.1278 23000.0 217.1348 18000.0 221.3595 2600.0 230.1204 12000.0 231.1265 31000.0 231.1518 43000.0 237.9483 2300.0 243.1154 7200.0 244.1114 25000.0 245.1318 2500.0 247.1465 2500.0 248.1531 29000.0 249.1598 2600.0 258.1159 3000.0 258.8658 3100.0 259.1476 22000.0 262.7838 2900.0 263.111 2500.0 266.1649 110000.0 271.1228 42000.0 272.106 9500.0 275.1429 33000.0 276.1415 8300.0 276.8823 2300.0 277.0891 4700.0 286.1138 2500.0 289.8583 2500.0 290.5486 2600.0 290.8925 17000.0 291.1382 2800.0 292.1451 300000.0 293.1265 2800.0 293.151 21000.0 299.1185 38000.0 305.085 8000.0 308.1774 2800.0 308.9046 130000.0 310.1812 39000.0 314.1241 2500.0 319.3119 2600.0 323.0939 4400.0 337.1099 2500.0 340.6679 2800.0 343.6016 2500.0 355.1777 330000.0 359.753 2600.0 361.1688 5100.0 370.1985 2700.0 381.7554 2600.0 389.1683 3300.0 391.9299 2300.0 394.1915 3400.0 410.1904 3600.0 412.2038 6400.0 414.2069 43000.0 420.1971 8200.0 427.2115 10000.0 428.1981 3100.0 434.9053 2300.0 447.2405 42000.0 455.2098 15000.0 473.2179 29000.0 482.5792 2900.0 488.4392 2600.0 498.0946 2300.0 529.2574 4200.0 551.2654 3100.0 642.0324 2800.0 749.0381 2700.0 825.7965 2700.0 856.5671 2900.0 882.0062 2600.0 994.0111 2500.0 1004.3564 2800.0 END IONS BEGIN IONS SCANS=268 PEPMASS=526.1921 CHARGE=1 COLLISION_ENERGY=0.0 64.881 2300.0 66.2488 2600.0 66.4775 2500.0 70.2348 2300.0 70.5786 2200.0 70.6696 2200.0 75.8256 2200.0 80.3341 2500.0 85.028 27000.0 101.3765 2200.0 121.0642 6800.0 123.4637 2500.0 127.0382 2400.0 131.3552 2100.0 135.0427 2300.0 137.0593 560000.0 137.0696 5600.0 147.2427 2500.0 148.34 2700.0 150.068 2400.0 161.023 8900.0 161.059 17000.0 162.067 11000.0 170.2244 2900.0 173.5165 2200.0 173.5302 75000.0 173.542 13000.0 175.0367 3000.0 179.0339 2800.0 181.0492 25000.0 191.0341 13000.0 193.0494 74000.0 195.6002 2800.0 202.7431 2400.0 205.0493 29000.0 225.0892 2500.0 237.055 7000.0 238.0628 5800.0 241.1671 2500.0 253.0488 8000.0 257.0802 5700.0 265.0492 78000.0 266.8317 2900.0 267.0653 8400.0 269.0809 23000.0 285.0374 6300.0 285.0758 710000.0 285.1122 5700.0 297.0368 4000.0 297.0757 440000.0 302.0803 12000.0 303.088 3200.0 315.0862 190000.0 317.1018 200000.0 317.1447 3000.0 329.1022 68000.0 347.1123 56000.0 355.8003 2800.0 456.9537 2800.0 474.9786 2900.0 END IONS BEGIN IONS SCANS=269 PEPMASS=347.1127 CHARGE=1 COLLISION_ENERGY=0.0 57.0195 2300.0 62.1486 2100.0 62.6821 2900.0 64.2671 2200.0 65.2381 2500.0 66.4982 2700.0 73.3279 2400.0 78.1848 2300.0 80.6331 2700.0 97.8602 2900.0 107.0491 6000.0 117.2782 2100.0 121.0648 12000.0 137.0594 140000.0 149.0233 4700.0 149.6695 3600.0 149.6901 4900.0 161.0235 7600.0 161.0596 6800.0 162.0665 3500.0 163.0385 10000.0 167.0859 3200.0 173.5344 24000.0 177.6734 2600.0 179.1477 3100.0 181.0489 9000.0 181.0649 10000.0 193.05 5100.0 195.473 2500.0 197.0603 6600.0 201.2701 2100.0 205.0492 2800.0 209.0591 4900.0 211.0749 11000.0 214.6672 2400.0 225.0542 7800.0 229.0854 3100.0 237.0544 27000.0 238.0625 10000.0 239.0698 5800.0 241.0844 2600.0 242.0567 2800.0 242.4033 2600.0 253.0503 11000.0 257.0811 6800.0 265.0495 54000.0 267.0645 12000.0 269.0809 17000.0 285.0761 110000.0 297.076 40000.0 312.8184 2900.0 322.334 2500.0 END IONS BEGIN IONS SCANS=270 PEPMASS=286.1442 CHARGE=1 COLLISION_ENERGY=0.0 48.1749 5300.0 48.2257 9200.0 51.0235 5300.0 53.0385 28000.0 54.5428 12000.0 55.0179 58000.0 69.517 8500.0 71.1717 7700.0 72.2604 5300.0 74.7889 8000.0 77.0387 54000.0 79.0542 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570000.0 254.121 21000.0 267.1024 29000.0 269.0912 13000.0 269.1174 6900000.0 286.1441 600000.0 END IONS BEGIN IONS SCANS=271 PEPMASS=511.2552 CHARGE=1 COLLISION_ENERGY=0.0 61.2503 2200.0 69.0697 7600.0 75.3532 2300.0 79.1338 2200.0 86.0911 3700.0 86.0961 190000.0 89.6123 2200.0 90.1389 2400.0 91.0542 15000.0 91.9574 2200.0 93.8338 2400.0 102.5327 2300.0 103.0535 2600.0 107.5661 2200.0 108.1579 2400.0 115.0498 9100.0 115.6568 2500.0 118.0648 79000.0 120.0718 2400.0 120.0803 47000.0 129.5984 2400.0 131.0488 3800.0 136.0755 64000.0 146.0466 4500.0 146.0597 790000.0 146.0703 9100.0 146.0958 21000.0 155.9448 2600.0 157.1334 65000.0 165.0543 60000.0 173.5253 47000.0 173.5424 24000.0 182.0809 86000.0 183.1127 39000.0 185.1285 11000.0 187.7365 2700.0 189.102 84000.0 217.0972 190000.0 236.1065 7300.0 239.6937 2800.0 246.4436 2400.0 265.0888 2800.0 270.1119 8300.0 282.113 33000.0 282.4192 2600.0 299.1395 21000.0 321.9867 2800.0 333.4979 2500.0 345.5506 2300.0 383.1931 2800.0 383.2002 7200.0 387.3828 2900.0 END IONS BEGIN IONS SCANS=272 PEPMASS=764.4088 CHARGE=1 COLLISION_ENERGY=0.0 70.065 1100000.0 70.0691 6000.0 70.0716 3500.0 78.4773 2900.0 80.5676 2300.0 81.4423 2300.0 82.9309 6500.0 83.0415 56000.0 83.0457 6800.0 84.1986 2500.0 84.933 62000.0 84.9378 7200.0 86.0961 230000.0 86.2841 2400.0 90.1768 2400.0 94.7248 2300.0 96.4247 2500.0 97.0758 37000.0 98.0598 160000.0 105.0177 3000.0 110.9696 2400.0 111.0626 2500.0 112.0867 740000.0 112.0943 3200.0 113.0945 19000.0 115.0863 98000.0 117.6509 2300.0 118.0648 9800.0 120.0807 26000.0 122.7934 2200.0 124.0867 7000.0 125.0354 2400.0 125.0707 76000.0 126.0547 70000.0 129.1132 18000.0 136.0754 53000.0 140.0816 170000.0 141.1132 9100.0 143.0535 2600.0 146.0598 220000.0 150.0915 6200.0 151.1229 21000.0 155.6482 2400.0 157.1082 550000.0 157.1331 140000.0 158.092 32000.0 163.0676 2600.0 165.0545 32000.0 165.1022 10000.0 166.1336 50000.0 167.1178 98000.0 172.1121 3300.0 173.5239 31000.0 173.5352 110000.0 173.5451 4300.0 175.1191 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2900.0 555.3405 19000.0 563.2619 24000.0 565.3262 20000.0 566.3087 30000.0 580.3092 20000.0 583.3347 97000.0 584.3187 93000.0 590.3015 7200.0 592.275 7200.0 599.3182 2700.0 601.3465 44000.0 606.3035 76000.0 608.3081 69000.0 618.291 23000.0 623.3324 30000.0 634.2992 46000.0 648.3422 6100.0 651.3275 23000.0 658.3659 48000.0 674.3671 3300.0 676.3401 3400.0 677.3616 13000.0 687.3495 54000.0 698.2489 2800.0 701.3847 5900.0 703.3932 3500.0 704.3832 12000.0 705.36 120000.0 716.2426 2800.0 718.4066 15000.0 719.3868 230000.0 722.3882 3700.0 728.3966 3200.0 729.3707 60000.0 730.3607 3300.0 736.4134 140000.0 746.3978 390000.0 746.5123 2300.0 746.5367 4200.0 746.5543 3400.0 747.2255 5200.0 747.3813 1400000.0 747.5011 7500.0 764.2844 4500.0 764.4085 1400000.0 764.5691 3700.0 END IONS BEGIN IONS SCANS=273 PEPMASS=382.7086 CHARGE=1 COLLISION_ENERGY=0.0 70.0286 160000.0 70.065 2400000.0 71.06 100000.0 76.388 9000.0 79.2824 11000.0 81.1805 10000.0 86.0963 13000000.0 86.1031 97000.0 87.0551 280000.0 87.0789 150000.0 87.0997 200000.0 88.0391 290000.0 88.0866 12000.0 89.0706 47000.0 91.0541 280000.0 94.0641 17000.0 95.0492 27000.0 97.0759 73000.0 98.0599 270000.0 99.0552 150000.0 102.711 8900.0 103.0542 72000.0 107.0493 19000.0 109.8558 6400.0 111.4099 6000.0 112.0868 1200000.0 112.3787 8300.0 113.0945 30000.0 113.5867 180000.0 114.0917 18000.0 115.0501 1200000.0 115.0866 190000.0 117.4346 10000.0 118.065 910000.0 118.5793 11000.0 119.049 430000.0 120.0707 24000.0 120.0806 1400000.0 121.0647 55000.0 123.0439 690000.0 123.0533 9600.0 124.087 51000.0 125.0707 140000.0 126.0548 120000.0 129.1133 130000.0 130.1201 20000.0 132.0811 25000.0 135.0566 11000.0 135.0678 760000.0 136.0633 49000.0 136.0756 3500000.0 136.0879 47000.0 137.0795 66000.0 140.0818 290000.0 141.1022 32000.0 141.1132 44000.0 142.0861 60000.0 143.0936 12000.0 144.0808 120000.0 146.0599 7800000.0 146.0708 72000.0 146.0961 370000.0 147.0438 480000.0 147.0633 180000.0 148.0756 70000.0 149.1078 6500.0 151.1226 56000.0 157.0948 37000.0 157.1083 1300000.0 157.1334 450000.0 158.6806 6400.0 161.1075 120000.0 163.087 7200.0 165.0547 3500000.0 165.101 22000.0 166.0582 110000.0 166.1337 93000.0 167.118 290000.0 169.1011 140000.0 172.076 92000.0 173.527 360000.0 173.5361 33000.0 173.545 130000.0 175.1196 22000.0 177.1063 240000.0 178.1154 410000.0 179.0849 15000.0 182.0657 8400.0 182.0813 2200000.0 183.0851 100000.0 183.1129 700000.0 183.3617 6700.0 186.1136 120000.0 187.1227 18000.0 189.1024 820000.0 190.1069 21000.0 191.1055 290000.0 191.6071 7100.0 192.1134 150000.0 193.1444 74000.0 194.1288 1100000.0 195.0971 18000.0 195.1128 4600000.0 196.1154 210000.0 197.096 78000.0 198.6304 8000.0 200.1107 690000.0 200.6124 17000.0 204.1385 510000.0 206.1294 51000.0 209.1399 320000.0 210.1479 39000.0 212.1397 160000.0 212.6266 12000.0 217.0974 1000000.0 217.1339 500000.0 220.1083 64000.0 223.0764 14000.0 224.1074 98000.0 225.1347 12000.0 226.1663 190000.0 227.174 200000.0 228.1022 100000.0 233.1396 97000.0 234.1239 480000.0 236.1076 110000.0 236.1504 150000.0 237.1347 1600000.0 237.1609 53000.0 238.1383 56000.0 238.1657 19000.0 243.113 230000.0 245.1637 13000.0 250.1139 9700.0 250.1438 1200000.0 250.1712 43000.0 251.1488 110000.0 253.177 250000.0 253.6479 73000.0 254.0995 22000.0 254.1366 38000.0 254.1612 12000000.0 254.2225 16000.0 255.1639 500000.0 260.1428 12000.0 265.0856 15000.0 267.6445 110000.0 270.1127 1000000.0 271.1157 78000.0 271.1876 180000.0 275.1601 8900.0 276.1459 230000.0 277.17 74000.0 280.1411 160000.0 282.1129 160000.0 286.1554 69000.0 289.1296 9500.0 293.1727 390000.0 294.1577 20000.0 296.1763 240000.0 299.1398 60000.0 302.1649 15000.0 306.1583 73000.0 310.1995 13000.0 310.6808 20000.0 311.1835 190000.0 312.1756 6900.0 314.1507 21000.0 314.1871 190000.0 319.1886 20000.0 321.1715 100000.0 322.155 410000.0 322.1885 100000.0 324.6795 7900.0 329.72 10000.0 336.2146 450000.0 337.2002 62000.0 338.1974 170000.0 339.1828 78000.0 340.1655 180000.0 346.2008 28000.0 347.1835 75000.0 348.1832 25000.0 352.2101 40000.0 354.1866 11000.0 354.2246 730000.0 355.2245 620000.0 356.2084 960000.0 357.2073 87000.0 360.0273 8000.0 363.2298 15000.0 364.2093 520000.0 365.1598 37000.0 365.2076 180000.0 368.7073 15000.0 368.7167 6800.0 371.217 23000.0 372.2273 55000.0 373.1929 16000.0 373.2349 3400000.0 374.2379 270000.0 380.2169 16000.0 381.2038 560000.0 382.1857 260000.0 382.2251 220000.0 383.2126 120000.0 390.2497 140000.0 391.2213 23000.0 396.1923 9400.0 398.2307 170000.0 399.2145 2000000.0 399.2648 20000.0 400.2182 180000.0 407.2172 56000.0 408.2524 15000.0 411.2051 8600.0 424.1898 46000.0 424.2461 410000.0 425.2316 310000.0 426.2556 11000.0 428.2531 7500.0 432.2744 73000.0 442.2563 1200000.0 443.2606 180000.0 449.2989 670000.0 450.2976 53000.0 452.2409 78000.0 453.2244 23000.0 469.2653 82000.0 470.2514 570000.0 471.2537 61000.0 478.2294 13000.0 487.2787 110000.0 504.8635 13000.0 521.2387 53000.0 534.2836 88000.0 535.2677 130000.0 537.3292 85000.0 538.3196 40000.0 552.2927 80000.0 555.3397 260000.0 561.285 28000.0 562.2827 11000.0 562.3079 53000.0 563.2631 70000.0 564.2808 31000.0 577.3247 78000.0 578.3087 410000.0 579.3188 220000.0 580.2886 510000.0 581.288 15000.0 605.3214 94000.0 606.3039 450000.0 607.3044 15000.0 622.3372 12000.0 623.3294 3100000.0 623.4207 27000.0 624.3321 400000.0 650.3318 12000.0 651.3265 250000.0 END IONS BEGIN IONS SCANS=274 PEPMASS=316.1911 CHARGE=1 COLLISION_ENERGY=0.0 55.0179 11000.0 58.062 4300.0 58.065 170000.0 58.176 2300.0 65.6284 2400.0 68.2582 2200.0 69.512 2200.0 72.0807 6300.0 78.1908 2700.0 78.4981 2500.0 79.0539 3000.0 83.1276 2400.0 91.0541 57000.0 93.0697 33000.0 94.3293 2400.0 95.049 65000.0 97.0644 3800.0 103.0541 13000.0 107.049 230000.0 107.1995 2700.0 109.0648 5500.0 117.0697 70000.0 119.049 150000.0 119.0853 36000.0 121.0646 780000.0 121.0729 4500.0 123.0443 2600.0 123.0798 7500.0 125.0593 17000.0 129.0696 6200.0 131.049 27000.0 133.0647 43000.0 135.0803 19000.0 137.048 3700.0 137.0596 170000.0 142.6035 2500.0 145.0515 3300.0 145.0646 220000.0 145.3498 2200.0 146.073 2900.0 147.0802 390000.0 149.0595 170000.0 149.096 51000.0 150.0677 8900.0 151.0646 4000.0 151.0752 500000.0 153.091 8300.0 157.0647 17000.0 160.3739 2400.0 161.0964 2700.0 163.0752 44000.0 165.0691 6200.0 165.0908 30000.0 167.0857 3500.0 169.0647 8800.0 173.5247 38000.0 173.5423 31000.0 173.5666 2600.0 173.6651 2300.0 177.091 150000.0 181.0652 7600.0 181.1017 2500.0 182.0728 35000.0 183.0804 85000.0 183.1161 3100.0 193.1012 39000.0 195.08 15000.0 196.0884 24000.0 197.0609 2700.0 197.0957 24000.0 203.0853 6800.0 209.0959 6500.0 210.0675 46000.0 211.0753 72000.0 211.1118 500000.0 211.1464 3100.0 212.0835 23000.0 213.0912 31000.0 221.0961 58000.0 221.5981 3300.0 224.0838 16000.0 225.0895 3800.0 225.1278 20000.0 229.1227 2500.0 235.1109 12000.0 237.0908 18000.0 238.9827 2300.0 239.1065 350000.0 241.1228 5900.0 242.0935 82000.0 246.7801 2300.0 253.1218 20000.0 254.5493 2400.0 256.1093 18000.0 271.1326 230000.0 271.166 4500.0 316.1893 8500.0 END IONS BEGIN IONS SCANS=275 PEPMASS=330.2069 CHARGE=1 COLLISION_ENERGY=0.0 50.2686 2700.0 51.1675 2400.0 51.6459 2400.0 53.2951 3200.0 59.1167 2300.0 60.0807 220000.0 60.2381 2400.0 61.9454 2400.0 62.1846 2400.0 62.6098 2000.0 64.0955 2200.0 67.4466 2300.0 68.576 2100.0 75.6209 4600.0 75.6294 2300.0 77.404 2200.0 82.634 2100.0 82.7332 2500.0 83.6498 2300.0 89.3516 2400.0 91.0541 64000.0 93.0699 27000.0 94.2661 2300.0 95.049 87000.0 98.6907 2300.0 103.0543 12000.0 107.049 270000.0 109.0647 2700.0 116.3353 2400.0 117.0698 74000.0 119.049 210000.0 119.0854 43000.0 121.0647 1100000.0 121.0793 3600.0 123.0435 2700.0 123.0804 8100.0 123.6452 2700.0 125.0597 23000.0 131.0491 26000.0 133.0648 65000.0 135.0446 2700.0 135.0801 25000.0 136.0521 2700.0 137.0481 3100.0 137.0597 200000.0 138.4524 2600.0 145.0646 310000.0 147.0672 5100.0 147.0803 660000.0 149.0596 230000.0 149.096 73000.0 151.0753 750000.0 151.089 7200.0 151.6311 2700.0 153.0909 17000.0 157.0648 23000.0 159.0798 3000.0 161.096 7300.0 163.0754 63000.0 163.1344 2500.0 165.0912 36000.0 173.5335 99000.0 175.1108 8200.0 177.0911 230000.0 181.0651 5900.0 181.1017 6100.0 182.0727 24000.0 183.0805 100000.0 187.8096 2400.0 188.1196 2300.0 193.1012 51000.0 193.6933 2400.0 195.0817 5700.0 196.0879 32000.0 197.0621 2700.0 197.0963 31000.0 203.0853 5700.0 203.9004 2500.0 207.4441 2600.0 209.0956 2600.0 210.0676 61000.0 211.0755 96000.0 211.1119 700000.0 211.1351 14000.0 212.0834 27000.0 213.0911 45000.0 216.595 2400.0 221.0962 79000.0 223.6743 2900.0 224.0829 15000.0 225.0906 4700.0 225.1276 30000.0 235.1115 9200.0 237.0916 22000.0 238.0973 2300.0 239.0792 5400.0 239.1067 600000.0 240.1128 2700.0 241.1219 13000.0 241.3721 2400.0 242.0938 95000.0 243.1379 3400.0 253.1221 41000.0 256.11 22000.0 271.1328 520000.0 271.1659 8800.0 299.485 2500.0 330.2059 2900.0 339.2608 2600.0 END IONS BEGIN IONS SCANS=276 PEPMASS=577.135 CHARGE=1 COLLISION_ENERGY=0.0 62.3694 2200.0 63.4845 2700.0 66.621 2000.0 67.6146 2200.0 69.5293 2900.0 71.7611 2600.0 71.7651 2400.0 72.6324 2100.0 73.7462 2300.0 74.7284 2400.0 75.9663 2400.0 76.2186 2500.0 77.7546 2500.0 78.2006 2300.0 83.0734 2400.0 86.8097 2300.0 88.9989 2300.0 91.4317 2300.0 101.1666 2300.0 104.0444 2300.0 105.8609 2300.0 113.0126 2400.0 117.7307 2700.0 120.348 2700.0 123.0351 2900.0 123.0435 160000.0 127.0384 25000.0 135.2378 2800.0 137.0237 7000.0 139.0383 39000.0 147.6132 2600.0 147.7454 2700.0 149.0233 13000.0 151.0387 21000.0 154.1019 2700.0 155.0354 2900.0 159.1384 2500.0 165.0544 3000.0 173.5313 100000.0 173.5454 4200.0 203.0333 6800.0 211.5318 2400.0 227.2312 2800.0 231.0646 23000.0 232.1991 2700.0 245.0439 42000.0 247.0599 26000.0 257.0457 3500.0 259.0601 56000.0 269.0441 24000.0 271.0602 61000.0 280.069 2700.0 283.0601 26000.0 287.017 6400.0 287.055 3900000.0 287.1292 16000.0 295.6332 2300.0 299.0552 140000.0 311.0572 15000.0 337.2232 2500.0 358.4574 2400.0 377.3345 2700.0 391.09 2400.0 396.4076 2300.0 397.0095 2400.0 407.0761 23000.0 419.0214 2700.0 419.0763 120000.0 425.0885 19000.0 429.2146 2900.0 437.0868 19000.0 525.192 2600.0 536.3975 3300.0 562.4755 2600.0 575.8272 2800.0 END IONS BEGIN IONS SCANS=277 PEPMASS=368.8595 CHARGE=1 COLLISION_ENERGY=0.0 82.8966 2600.0 86.0909 11000.0 86.0971 910000.0 87.1005 18000.0 87.5295 2300.0 89.9571 2600.0 91.0551 25000.0 95.7774 2300.0 97.0768 11000.0 97.2543 2400.0 98.0605 8200.0 101.7711 2400.0 106.0658 3800.0 110.0726 190000.0 112.0794 2100.0 112.0877 28000.0 115.0876 11000.0 118.0665 100000.0 119.0741 43000.0 120.0821 70000.0 122.0608 8200.0 125.0719 23000.0 134.0627 2300.0 136.0772 36000.0 140.083 7700.0 144.1794 2500.0 146.0456 8900.0 146.0618 350000.0 147.065 5300.0 152.8333 2700.0 155.093 2300.0 157.1093 2600.0 158.4409 2600.0 162.0568 9500.0 172.1144 170000.0 173.1162 3700.0 173.531 97000.0 173.544 17000.0 173.5995 2500.0 174.0569 6700.0 175.121 18000.0 180.0898 9100.0 181.0744 32000.0 187.1253 20000.0 188.1456 17000.0 198.0929 3300.0 199.233 2500.0 202.8212 2300.0 207.0651 2500.0 207.7465 2400.0 208.6071 2500.0 215.1209 6400.0 216.1283 40000.0 217.1363 13000.0 218.569 2400.0 228.1136 16000.0 230.1213 33000.0 231.1525 47000.0 235.1208 5500.0 238.1264 6200.0 241.8976 2700.0 243.1152 22000.0 245.1317 2500.0 251.1168 39000.0 252.1477 7800.0 257.4619 2900.0 258.1173 6300.0 259.1485 14000.0 271.1216 27000.0 275.1423 22000.0 277.1453 67000.0 278.1291 100000.0 278.4387 2800.0 279.1125 43000.0 290.139 6500.0 293.4615 2500.0 294.1712 33000.0 295.1546 6100.0 299.1176 30000.0 300.2434 2800.0 301.1208 7500.0 303.1236 41000.0 304.1321 5000.0 312.1813 27000.0 315.6384 2600.0 320.1508 6100.0 321.1613 31000.0 321.3162 2800.0 323.1633 25000.0 338.1568 8600.0 338.1903 24000.0 362.6685 3100.0 369.1681 4700.0 396.1694 3000.0 412.2038 3100.0 420.1971 3300.0 438.1915 17000.0 439.1799 3800.0 441.1931 25000.0 442.1826 12000.0 458.2224 68000.0 473.234 2900.0 475.2491 80000.0 476.2481 3900.0 484.2007 28000.0 501.2258 27000.0 540.3132 9100.0 562.2494 3000.0 583.7516 2800.0 586.3156 21000.0 593.2702 2700.0 598.8314 3500.0 614.7429 2700.0 619.2706 2500.0 636.2991 72000.0 637.2927 6300.0 662.2782 11000.0 731.3603 2600.0 732.3625 3600.0 736.3358 2600.0 749.3824 94000.0 750.3879 22000.0 753.3555 10000.0 775.3667 7100.0 866.441 26000.0 867.4352 2900.0 877.4128 8800.0 894.4386 81000.0 895.4388 31000.0 922.4383 32000.0 END IONS BEGIN IONS SCANS=278 PEPMASS=251.107 CHARGE=1 COLLISION_ENERGY=0.0 59.049 6000.0 59.256 2600.0 62.4649 2500.0 63.4825 2300.0 64.8819 2500.0 65.0528 2400.0 95.1656 2500.0 99.6923 2600.0 105.9946 2300.0 114.3723 2300.0 121.1591 2800.0 137.3916 2600.0 139.5992 2600.0 165.0707 10000.0 173.5205 2300.0 173.5383 26000.0 179.0859 14000.0 180.0932 27000.0 189.041 2600.0 189.07 20000.0 190.0778 79000.0 191.065 4400.0 191.0855 650000.0 191.1056 5100.0 195.3061 3000.0 203.0855 5600.0 205.0672 2900.0 205.1012 22000.0 207.0802 6200.0 208.0885 67000.0 218.0729 21000.0 219.0807 97000.0 220.0883 55000.0 230.5781 2700.0 235.9663 2300.0 236.0835 92000.0 251.1069 23000.0 252.6321 2300.0 END IONS BEGIN IONS SCANS=279 PEPMASS=268.1335 CHARGE=1 COLLISION_ENERGY=0.0 45.7533 2500.0 46.8314 2200.0 47.6496 2400.0 47.7701 4800.0 47.7714 17000.0 49.5121 2900.0 50.0929 2100.0 51.6283 2100.0 52.2992 2300.0 52.3308 2400.0 52.5009 2500.0 53.3841 2200.0 54.7694 9500.0 55.5164 2300.0 55.6021 2100.0 55.6662 2600.0 59.0229 2300.0 60.0236 2600.0 62.7783 2700.0 63.5261 2700.0 64.9776 2300.0 70.5595 2700.0 74.3066 2200.0 80.7409 2600.0 82.6956 2400.0 83.7809 2400.0 87.9443 2700.0 91.4118 2400.0 92.3325 2300.0 94.0015 2300.0 105.2071 2800.0 108.8299 2300.0 115.6245 2400.0 118.7246 2400.0 128.3779 2600.0 132.0806 2500.0 136.4158 2300.0 139.5635 2400.0 150.0089 2500.0 153.1085 2400.0 155.7847 2500.0 158.6247 2200.0 162.8953 2700.0 163.0543 2400.0 165.0704 40000.0 167.0853 2400.0 170.3027 2200.0 173.5298 48000.0 173.5422 5400.0 177.0689 3800.0 178.0785 2900.0 179.0859 25000.0 180.0934 64000.0 180.1106 2900.0 181.0648 5700.0 188.8967 16000.0 189.0706 68000.0 190.0779 200000.0 191.0331 10000.0 191.0449 16000.0 191.0534 13000.0 191.0857 6200000.0 191.1262 40000.0 191.1379 4800.0 191.1492 3400.0 192.0937 12000.0 193.1006 4300.0 194.0724 12000.0 195.081 14000.0 195.1171 2800.0 201.0703 23000.0 201.2925 2600.0 203.0867 12000.0 205.0673 6000.0 205.1014 190000.0 207.0806 28000.0 208.0887 240000.0 209.0966 5500.0 215.0858 5300.0 216.8914 57000.0 218.0728 92000.0 219.0308 9300.0 219.0806 3800000.0 219.0984 5400.0 219.1307 7400.0 220.0886 670000.0 220.108 2400.0 221.0978 6700.0 222.0685 18000.0 223.0764 5100.0 223.1119 34000.0 229.0773 3300.0 231.233 2500.0 233.0964 56000.0 234.9011 12000.0 235.0752 17000.0 235.1008 2300.0 236.0834 1100000.0 251.0468 4300.0 251.0766 4000.0 251.1066 2000000.0 251.1336 7000.0 END IONS BEGIN IONS SCANS=280 PEPMASS=670.2714 CHARGE=1 COLLISION_ENERGY=0.0 67.9206 2600.0 69.0295 2600.0 69.0331 140000.0 74.2216 2400.0 76.1128 2300.0 81.0332 10000.0 82.3239 2400.0 82.7284 2600.0 83.0494 2500.0 85.0233 2400.0 85.028 100000.0 87.0386 3800.0 87.0437 160000.0 89.728 2700.0 90.8658 2300.0 97.0214 3200.0 97.028 210000.0 101.5654 2400.0 102.9754 2600.0 105.6998 2300.0 112.5907 2300.0 115.0305 3300.0 115.0386 210000.0 115.0535 7100.0 122.9967 2300.0 127.0388 16000.0 129.0701 7100.0 131.049 6600.0 133.0492 97000.0 137.0594 510000.0 137.0696 2100.0 143.0489 70000.0 145.0493 18000.0 145.0639 2400.0 150.0759 36000.0 151.0388 3200.0 153.0543 24000.0 157.0644 22000.0 160.0516 33000.0 161.0594 12000.0 162.0757 3600.0 163.0754 25000.0 173.5256 40000.0 173.5426 19000.0 175.0574 13000.0 175.0754 910000.0 175.0934 3700.0 179.0711 5700.0 180.087 3600.0 185.0596 3200.0 187.0754 240000.0 187.8977 2200.0 189.091 81000.0 204.6225 2300.0 205.0861 49000.0 206.2587 2900.0 217.0863 37000.0 235.0965 26000.0 239.0703 14000.0 241.0713 2400.0 241.6585 2500.0 253.12 2300.0 259.0754 8200.0 263.1072 23000.0 264.7001 2500.0 270.09 9800.0 271.0969 32000.0 279.1028 18000.0 291.1026 76000.0 311.1286 27000.0 323.129 41000.0 323.3754 2600.0 341.1399 5000.0 401.5325 2800.0 440.393 2500.0 478.9891 2800.0 556.1188 2400.0 559.712 2800.0 618.0468 2400.0 END IONS BEGIN IONS SCANS=281 PEPMASS=415.2108 CHARGE=1 COLLISION_ENERGY=0.0 78.9988 2400.0 86.0961 1500000.0 86.1023 4100.0 87.0996 24000.0 88.8284 2500.0 91.0541 31000.0 91.2027 2500.0 91.2102 2200.0 95.0489 21000.0 95.2735 2100.0 96.147 2400.0 97.0758 24000.0 98.0596 65000.0 100.7073 2100.0 103.0546 2500.0 105.608 2200.0 106.0649 28000.0 107.0489 6300.0 107.2842 2400.0 109.4435 2700.0 114.5445 2700.0 115.0863 53000.0 115.7632 2500.0 118.0649 70000.0 119.0488 150000.0 119.0728 3000.0 120.0804 78000.0 121.0648 6000.0 123.0338 5800.0 123.0437 330000.0 123.8771 2900.0 123.9837 2400.0 124.0475 5700.0 125.0706 120000.0 126.0549 15000.0 127.5361 2200.0 130.064 2200.0 131.0486 4800.0 132.311 2400.0 134.0597 110000.0 135.0675 43000.0 136.0754 270000.0 137.517 2300.0 141.1023 4000.0 146.0466 8800.0 146.0597 800000.0 146.0704 2900.0 147.0437 200000.0 147.0632 24000.0 148.0466 2900.0 148.0754 21000.0 154.9991 2300.0 155.6521 2200.0 162.0549 27000.0 164.7121 2500.0 165.0545 530000.0 166.0578 9300.0 172.1119 110000.0 173.5224 17000.0 173.5307 41000.0 173.5393 44000.0 174.0554 8500.0 174.1275 12000.0 180.0648 2500.0 182.0647 2500.0 182.081 51000.0 182.5668 2600.0 183.1491 83000.0 187.123 53000.0 188.144 10000.0 203.0233 2800.0 203.1546 3200.0 204.138 30000.0 204.2529 2700.0 211.1445 55000.0 213.088 2700.0 214.1212 2100.0 215.1177 57000.0 216.1257 110000.0 217.1336 310000.0 218.1367 6500.0 224.1074 7800.0 230.1176 77000.0 231.1493 170000.0 236.1072 38000.0 240.1017 41000.0 243.1129 84000.0 245.1285 14000.0 247.1441 68000.0 249.1603 62000.0 253.0676 2600.0 253.1334 22000.0 258.1118 26000.0 259.144 270000.0 260.1463 6700.0 268.0939 3200.0 273.1227 11000.0 275.1395 190000.0 281.1295 13000.0 286.108 70000.0 287.1402 18000.0 292.7982 2900.0 293.15 71000.0 297.1232 15000.0 301.1191 91000.0 313.0395 2700.0 319.1291 20000.0 321.6693 20000.0 330.2166 15000.0 331.6454 3000.0 335.6661 120000.0 336.165 4100.0 336.52 2300.0 337.1919 50000.0 349.1917 26000.0 356.1964 23000.0 366.2181 47000.0 386.5891 2400.0 393.1846 6500.0 399.4518 2700.0 410.2083 34000.0 420.3491 2300.0 422.2077 28000.0 436.6751 2500.0 438.2066 9300.0 463.2692 2900.0 466.1956 20000.0 526.3287 3200.0 551.8563 2900.0 584.8535 2700.0 622.6456 2800.0 622.8093 3000.0 END IONS BEGIN IONS SCANS=282 PEPMASS=219.102 CHARGE=1 COLLISION_ENERGY=0.0 42.1203 2500.0 42.1403 2200.0 43.0178 11000.0 43.4445 2300.0 43.9227 2300.0 45.0333 2400.0 49.7784 2600.0 51.3306 2800.0 52.0476 2900.0 53.9318 2400.0 54.9422 2300.0 55.9343 9000.0 56.2739 2200.0 57.0334 12000.0 67.0541 6300.0 69.7909 2300.0 72.2122 2100.0 73.0287 2500.0 73.7407 2500.0 83.9399 2600.0 87.345 2500.0 91.054 71000.0 91.0602 3400.0 98.6116 2200.0 103.0541 20000.0 107.467 2400.0 115.0542 57000.0 116.0618 23000.0 117.0697 21000.0 128.062 61000.0 129.0589 4300.0 129.0697 350000.0 130.0775 21000.0 131.0489 57000.0 131.0854 310000.0 131.0967 5000.0 131.2455 2300.0 133.0643 3400.0 133.1011 3500.0 137.0597 29000.0 140.5814 2200.0 141.0571 11000.0 141.0697 330000.0 141.083 3500.0 142.0779 4100.0 142.354 2700.0 143.0492 17000.0 143.0855 22000.0 144.0568 47000.0 145.0646 50000.0 146.0725 46000.0 148.0519 9000.0 151.076 3100.0 155.0601 4500.0 156.0366 2500.0 156.0566 6000.0 157.0647 160000.0 158.0584 4000.0 158.0726 190000.0 159.0439 16000.0 159.0804 120000.0 160.0518 45000.0 161.0596 11000.0 161.096 33000.0 162.0675 2900.0 163.0756 15000.0 168.0571 12000.0 169.0647 99000.0 170.0727 63000.0 171.0803 10000.0 173.0598 37000.0 173.0965 11000.0 173.5192 4100.0 173.5351 55000.0 174.0676 710000.0 174.0851 6300.0 174.731 2500.0 175.0754 59000.0 183.0793 2400.0 185.059 10000.0 186.0676 170000.0 187.076 8400.0 188.0834 45000.0 189.0711 5300.0 189.091 320000.0 189.1109 8300.0 191.1065 7400.0 195.3443 2800.0 195.9433 9600.0 201.0715 3700.0 201.0912 150000.0 203.1433 7900.0 219.1014 23000.0 219.1748 11000.0 END IONS BEGIN IONS SCANS=283 PEPMASS=316.1912 CHARGE=1 COLLISION_ENERGY=0.0 49.4812 2300.0 53.0388 5300.0 55.0178 56000.0 55.121 4100.0 56.0499 4700.0 57.0334 4300.0 58.0651 3600000.0 58.068 18000.0 58.0703 16000.0 59.8851 2400.0 61.7118 4700.0 63.5107 2500.0 64.3147 2300.0 67.0542 23000.0 72.0807 64000.0 73.5831 2300.0 77.0389 5600.0 78.0657 2500.0 79.0541 23000.0 79.4075 2400.0 81.0333 6800.0 81.0698 17000.0 83.0492 7100.0 89.348 4500.0 91.0541 470000.0 91.0593 3000.0 91.0607 4700.0 93.0637 7700.0 93.0696 330000.0 95.0425 8700.0 95.049 370000.0 97.0647 32000.0 99.1756 5400.0 103.0541 120000.0 103.9797 4400.0 105.045 11000.0 105.0698 42000.0 107.0404 11000.0 107.049 1000000.0 107.0551 5000.0 107.0576 24000.0 108.779 2500.0 109.0646 39000.0 115.0542 41000.0 117.0607 4300.0 117.0697 730000.0 117.0778 2400.0 119.0392 15000.0 119.0489 940000.0 119.058 14000.0 119.0854 250000.0 121.0646 9800000.0 121.0729 79000.0 121.085 71000.0 121.097 7400.0 123.044 38000.0 123.0802 49000.0 125.0594 94000.0 129.0698 41000.0 131.049 160000.0 132.0569 18000.0 133.0282 27000.0 133.0541 4100.0 133.0646 330000.0 134.0361 3000.0 135.0439 11000.0 135.0802 110000.0 136.0515 26000.0 137.0595 990000.0 137.0694 4500.0 137.8884 4200.0 138.0672 32000.0 145.0646 1700000.0 145.0748 8400.0 145.0767 22000.0 146.0724 60000.0 147.0446 22000.0 147.0802 2500000.0 147.091 16000.0 149.046 11000.0 149.0595 530000.0 149.0959 96000.0 150.0677 26000.0 151.0752 3000000.0 153.0693 8200.0 153.0911 63000.0 155.0601 22000.0 155.0852 12000.0 157.0646 100000.0 157.2565 5100.0 158.0726 2900.0 159.0802 32000.0 161.06 42000.0 161.0961 39000.0 162.0673 62000.0 163.0752 350000.0 164.0833 24000.0 165.0698 45000.0 165.0909 160000.0 167.0853 13000.0 167.3284 4700.0 167.9103 6000.0 169.0645 47000.0 169.1027 3200.0 171.0803 11000.0 173.0964 24000.0 173.5233 7000.0 173.5327 91000.0 173.5443 14000.0 175.0754 8600.0 175.1117 36000.0 177.0909 3300000.0 177.1048 23000.0 178.0779 28000.0 179.0848 6600.0 181.0648 48000.0 181.101 36000.0 182.0726 150000.0 183.0622 2900.0 183.0803 490000.0 183.1166 34000.0 185.0964 7900.0 193.0665 14000.0 193.1012 240000.0 194.0724 4500.0 195.0805 59000.0 196.0881 130000.0 197.0599 39000.0 197.0961 130000.0 199.076 2900.0 201.0912 7500.0 202.0762 4600.0 203.0855 60000.0 206.0724 35000.0 208.4 2300.0 209.0646 4800.0 209.0962 51000.0 210.0676 240000.0 211.0753 340000.0 211.1117 2600000.0 213.0911 12000.0 215.1066 8200.0 217.1014 4700.0 219.0814 15000.0 221.0712 6900.0 221.0961 360000.0 224.0835 91000.0 225.0912 34000.0 225.1273 85000.0 227.0705 16000.0 227.1065 12000.0 229.1226 6500.0 231.0938 2200.0 235.1117 29000.0 237.0909 110000.0 238.0993 20000.0 239.1065 2100000.0 239.1284 11000.0 240.1142 18000.0 241.0835 9300.0 242.0936 460000.0 243.1015 39000.0 243.1382 47000.0 247.6753 2400.0 251.4592 2700.0 253.1217 130000.0 256.1092 53000.0 271.1326 1600000.0 286.5316 5000.0 316.1905 140000.0 END IONS BEGIN IONS SCANS=284 PEPMASS=346.2015 CHARGE=1 COLLISION_ENERGY=0.0 51.9436 2600.0 53.2266 2400.0 54.5931 2800.0 55.7587 2100.0 56.9 2200.0 58.0649 230000.0 63.1965 2600.0 72.12 2100.0 82.2531 2300.0 87.7533 2500.0 91.0539 35000.0 103.054 2700.0 105.0695 6400.0 107.0488 19000.0 109.0647 12000.0 117.0696 28000.0 117.2645 2200.0 119.0489 28000.0 119.0849 5400.0 119.6267 2400.0 121.0645 27000.0 123.0349 3900.0 123.0437 110000.0 123.0537 5300.0 123.0801 3000.0 125.0594 5600.0 131.049 22000.0 131.0853 3500.0 133.0646 9300.0 134.606 2600.0 135.0437 55000.0 135.0802 27000.0 136.052 3800.0 137.0594 690000.0 137.0697 6800.0 139.0749 18000.0 139.2561 2300.0 140.7567 2600.0 145.0645 84000.0 147.0433 2500.0 147.0802 8900.0 149.0594 62000.0 150.0671 40000.0 151.0751 260000.0 151.0892 4800.0 152.0833 11000.0 153.0906 2900.0 157.3542 2300.0 159.0803 27000.0 160.088 33000.0 161.0597 13000.0 163.0425 2900.0 163.0591 3300.0 163.0752 710000.0 163.0915 5100.0 163.098 3900.0 164.0829 66000.0 165.0908 470000.0 166.0982 16000.0 167.1076 3000.0 173.5232 6800.0 173.5324 27000.0 173.5409 9300.0 175.076 7800.0 176.0831 18000.0 177.0911 54000.0 178.0983 7000.0 179.1065 42000.0 189.0902 13000.0 190.1015 2600.0 191.1065 130000.0 192.1141 6900.0 195.081 9700.0 195.1165 18000.0 199.0747 2500.0 208.0897 2500.0 209.0966 6600.0 212.0833 3200.0 213.0917 2700.0 214.3467 2500.0 223.0752 4200.0 223.112 53000.0 224.388 2200.0 226.0983 3800.0 227.1059 3900.0 237.0914 7000.0 240.0779 12000.0 240.1154 3200.0 241.0856 3100.0 241.1224 58000.0 243.6799 2400.0 251.1068 41000.0 252.1143 17000.0 254.0936 32000.0 255.1062 12000.0 255.1379 54000.0 257.0817 7500.0 258.0896 6200.0 269.1174 56000.0 270.1253 58000.0 272.1045 140000.0 273.1124 2800.0 283.1333 59000.0 286.1202 79000.0 294.6582 2500.0 301.144 170000.0 341.8767 2500.0 346.1998 6100.0 END IONS BEGIN IONS SCANS=285 PEPMASS=330.2068 CHARGE=1 COLLISION_ENERGY=0.0 49.0782 3400.0 49.4218 4600.0 50.7393 5000.0 53.0386 11000.0 53.3624 4800.0 53.5301 8400.0 54.8592 2700.0 55.0179 140000.0 55.2412 5600.0 56.5673 2900.0 57.0335 17000.0 57.6435 8600.0 57.924 4800.0 58.0448 4800.0 59.6762 4900.0 60.0807 200000.0 61.0828 4900.0 62.5594 6100.0 63.6312 5600.0 64.0734 7700.0 64.2443 8200.0 64.3973 9700.0 67.0542 79000.0 67.7813 7000.0 69.0334 23000.0 71.0801 5300.0 75.5647 7600.0 77.0391 53000.0 79.0542 76000.0 81.0335 34000.0 81.0699 68000.0 83.0492 32000.0 83.7944 5700.0 83.8186 7800.0 87.4388 8800.0 88.0396 7700.0 91.0543 1100000.0 93.0637 14000.0 93.0698 750000.0 95.0491 1100000.0 95.4283 2900.0 96.7132 3100.0 97.0285 21000.0 97.0648 110000.0 103.0542 330000.0 105.0699 120000.0 107.0405 17000.0 107.0492 2700000.0 107.0576 69000.0 109.0648 120000.0 110.9841 7300.0 111.0438 51000.0 115.0546 110000.0 117.0699 1900000.0 119.0392 65000.0 119.0493 3000000.0 119.0591 36000.0 119.0856 700000.0 119.0953 8400.0 121.0442 140000.0 121.0569 87000.0 121.0648 31000000.0 121.0854 170000.0 121.0973 13000.0 123.0441 130000.0 123.0804 140000.0 124.1721 7600.0 125.0597 390000.0 127.0747 7100.0 129.07 95000.0 131.0492 390000.0 131.0853 5100.0 132.0572 50000.0 133.0285 94000.0 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239.0834 46000.0 239.1071 8300000.0 239.1283 6800.0 240.1146 86000.0 241.0862 5900.0 241.1175 6800.0 241.8309 9500.0 242.0673 4300.0 242.0942 1200000.0 243.1019 170000.0 243.1384 180000.0 253.1228 610000.0 253.1502 15000.0 256.1096 170000.0 257.1786 5600.0 263.8003 5300.0 271.1045 39000.0 271.1335 9100000.0 279.2717 7300.0 279.3065 8700.0 284.0741 6300.0 289.4716 5100.0 291.4087 5300.0 330.2071 560000.0 339.9043 8300.0 END IONS BEGIN IONS SCANS=286 PEPMASS=360.2173 CHARGE=1 COLLISION_ENERGY=0.0 52.5957 3400.0 54.1666 4100.0 55.018 28000.0 57.0335 26000.0 59.6003 4700.0 59.6243 4100.0 60.5372 15000.0 63.024 14000.0 65.0391 11000.0 65.9969 4300.0 67.0543 16000.0 68.6118 3700.0 69.0335 25000.0 70.2998 4700.0 71.0492 72000.0 73.0648 100000.0 73.1072 14000.0 74.5298 13000.0 75.044 200000.0 75.2883 14000.0 77.0155 16000.0 77.0394 23000.0 77.1744 16000.0 79.0543 120000.0 79.3055 16000.0 81.033 4200.0 81.0698 190000.0 82.0854 18000.0 83.049 25000.0 84.2888 14000.0 85.0645 5200.0 85.1954 5200.0 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5400000.0 286.1587 5900.0 301.0636 23000.0 301.1435 15000000.0 301.2227 28000.0 360.2163 530000.0 END IONS BEGIN IONS SCANS=287 PEPMASS=358.2018 CHARGE=1 COLLISION_ENERGY=0.0 53.2053 2300.0 53.2745 2200.0 54.3296 2200.0 55.0178 22000.0 63.0243 2300.0 64.7733 2300.0 65.069 2700.0 65.2348 2600.0 66.0332 2200.0 66.5202 2700.0 67.8678 2400.0 69.0333 31000.0 72.9375 2700.0 77.6556 2200.0 78.1121 2500.0 79.8587 2800.0 80.1455 2300.0 81.0333 3600.0 83.0488 19000.0 85.7991 2500.0 86.0963 7400.0 91.0542 36000.0 91.9367 2400.0 95.0488 3600.0 95.4944 2300.0 95.5795 2100.0 98.4981 2900.0 100.3276 2500.0 103.0097 2400.0 103.055 3000.0 105.0697 13000.0 107.0488 11000.0 115.0542 16000.0 115.6635 2600.0 117.0697 86000.0 119.0853 7300.0 120.529 2300.0 121.0645 140000.0 122.9545 2900.0 126.5052 2600.0 131.0493 9800.0 133.0647 10000.0 134.0723 17000.0 134.3362 2500.0 135.0441 17000.0 135.0803 14000.0 136.8904 2600.0 137.6474 2600.0 139.2632 2300.0 139.9684 2700.0 142.6139 2300.0 145.0644 50000.0 146.0724 370000.0 147.045 3600.0 147.0803 66000.0 149.0595 45000.0 149.096 49000.0 150.0669 2700.0 151.0386 7200.0 151.0751 120000.0 161.0597 34000.0 161.3965 2600.0 162.0675 210000.0 163.0608 7500.0 163.0753 570000.0 163.0913 3700.0 164.0827 32000.0 165.0909 260000.0 165.1772 2300.0 167.5145 2500.0 173.5218 14000.0 173.534 110000.0 173.5415 9300.0 174.0672 5300.0 175.0753 42000.0 177.0345 3900.0 177.0548 71000.0 177.091 15000000.0 177.1048 40000.0 177.1191 50000.0 177.1276 68000.0 177.1378 7900.0 177.235 2500.0 177.5266 2400.0 178.0797 2400.0 178.0986 42000.0 179.0697 2700.0 179.0869 9700.0 179.1068 23000.0 181.6611 3000.0 187.076 2600.0 188.0831 36000.0 189.0912 94000.0 190.0988 150000.0 193.0857 17000.0 195.0813 3500.0 196.0878 6800.0 197.0962 27000.0 198.1038 16000.0 199.1117 2900.0 200.0829 12000.0 201.0912 110000.0 202.099 23000.0 203.1067 24000.0 205.0856 3000.0 207.0799 8000.0 208.3153 2500.0 209.0964 14000.0 211.0756 22000.0 211.1128 34000.0 212.0841 9600.0 212.1199 150000.0 213.0912 29000.0 214.0991 40000.0 214.6382 3100.0 215.1071 53000.0 221.0968 23000.0 222.1043 62000.0 222.1488 27000.0 223.0757 14000.0 224.0829 25000.0 225.0911 62000.0 226.0989 3200.0 227.0701 2600.0 227.1066 44000.0 228.1147 90000.0 228.8248 2500.0 229.1224 91000.0 234.5801 2600.0 235.0745 15000.0 238.0993 79000.0 239.1067 110000.0 240.1145 110000.0 241.0862 120000.0 241.1168 8200.0 242.0934 55000.0 243.1039 17000.0 243.1382 480000.0 249.0908 23000.0 250.0991 70000.0 251.0697 14000.0 252.0793 7900.0 253.0861 100000.0 253.1224 130000.0 255.1018 31000.0 256.0782 10000.0 256.1095 590000.0 256.1389 6600.0 266.0937 34000.0 267.1015 69000.0 268.1093 110000.0 269.0809 73000.0 270.0895 9800.0 271.1333 520000.0 281.1179 60000.0 284.1049 270000.0 299.1288 280000.0 330.2069 180000.0 335.9919 2400.0 338.9789 2700.0 349.7947 2500.0 355.5294 3000.0 358.2016 99000.0 END IONS BEGIN IONS SCANS=288 PEPMASS=359.2057 CHARGE=1 COLLISION_ENERGY=0.0 51.7463 2200.0 53.68 2300.0 54.5964 2200.0 58.7645 2300.0 59.8168 2700.0 60.0563 2300.0 66.1762 2100.0 69.9528 2300.0 78.4305 2200.0 83.8429 2500.0 90.2414 2800.0 103.5202 2200.0 107.049 2700.0 108.7204 2300.0 117.0696 6400.0 117.353 2600.0 117.5241 2400.0 118.4787 2800.0 121.0645 14000.0 121.5842 2300.0 123.0433 2700.0 126.7945 2400.0 133.5957 2800.0 135.0804 2500.0 136.867 2100.0 137.0595 38000.0 146.0721 33000.0 147.0767 24000.0 149.686 5100.0 151.0748 23000.0 152.0785 3400.0 154.2136 2300.0 154.9753 2700.0 155.6477 2300.0 162.0669 17000.0 163.0749 120000.0 164.0811 74000.0 165.0909 53000.0 166.0947 20000.0 173.5311 55000.0 173.5413 11000.0 177.0735 5000.0 177.091 1300000.0 178.0947 1400000.0 179.1043 4900.0 189.0895 6100.0 190.0985 12000.0 191.1047 13000.0 200.8581 2700.0 201.0905 9200.0 202.0954 11000.0 212.1197 3400.0 213.1238 17000.0 214.281 3000.0 215.1031 3000.0 216.1098 5100.0 221.73 2600.0 222.1492 100000.0 223.1112 2900.0 225.0904 5800.0 226.0974 2300.0 229.1203 13000.0 230.1256 5800.0 239.1039 11000.0 240.1109 17000.0 241.1186 13000.0 242.0904 18000.0 243.1382 18000.0 244.1416 55000.0 251.1039 13000.0 253.931 2300.0 254.0906 9600.0 254.1251 11000.0 256.1095 18000.0 257.1128 69000.0 267.0988 2800.0 268.1062 7800.0 269.0787 2900.0 269.1134 19000.0 269.3647 2500.0 270.0869 3200.0 271.0937 3600.0 271.1327 17000.0 272.105 7300.0 272.1369 70000.0 282.122 3400.0 284.1042 7300.0 285.1095 39000.0 300.1316 47000.0 301.1442 13000.0 327.6346 2300.0 331.2104 22000.0 359.2055 16000.0 END IONS BEGIN IONS SCANS=289 PEPMASS=303.0746 CHARGE=1 COLLISION_ENERGY=0.0 53.9307 2100.0 54.784 2600.0 55.0763 2200.0 55.318 2100.0 56.2132 2900.0 57.4545 2200.0 60.6842 2600.0 60.8891 2600.0 63.1142 2100.0 66.6551 2500.0 67.2028 2200.0 68.7786 2200.0 72.6801 2200.0 80.9999 2700.0 83.341 2300.0 83.8232 2500.0 86.6664 2400.0 88.6826 2500.0 89.1582 2600.0 96.0994 2300.0 102.1078 2300.0 125.0607 2200.0 150.1905 2400.0 151.8699 2200.0 165.7023 2700.0 173.5227 19000.0 173.5328 13000.0 173.5407 31000.0 180.924 2600.0 210.1628 3000.0 266.5216 2400.0 278.5314 2500.0 294.2906 2700.0 303.0742 200000.0 303.1116 4200.0 307.463 2200.0 312.0676 2300.0 END IONS BEGIN IONS SCANS=290 PEPMASS=281.0925 CHARGE=1 COLLISION_ENERGY=0.0 49.3715 2300.0 51.2417 2000.0 54.4645 2300.0 55.015 3300.0 55.0178 220000.0 55.7283 2100.0 56.8594 2400.0 57.7968 2200.0 58.0134 2400.0 59.528 2500.0 63.2727 2600.0 63.2742 13000.0 66.4625 2400.0 66.6341 2700.0 67.0542 17000.0 67.3609 2200.0 69.134 2200.0 70.2726 30000.0 70.2749 4700.0 70.876 2200.0 71.3171 2600.0 72.1629 2200.0 74.3562 2400.0 78.7379 2600.0 79.0542 2800.0 80.0494 40000.0 81.0334 15000.0 83.222 2500.0 85.2666 2600.0 87.2006 2300.0 94.0289 10000.0 94.0651 2800.0 94.4701 2500.0 95.0425 3300.0 95.049 250000.0 96.0444 13000.0 96.8866 2000.0 100.9975 2600.0 103.1777 2900.0 104.0494 50000.0 104.056 2700.0 106.532 2400.0 107.049 62000.0 108.9638 2300.0 117.6101 2600.0 118.0625 2300.0 119.0603 26000.0 120.0444 47000.0 121.0519 2300.0 122.06 37000.0 123.044 34000.0 124.012 2600.0 130.0652 5200.0 132.0444 410000.0 132.0557 4300.0 133.0522 47000.0 134.0602 11000.0 136.002 3000.0 142.8289 2500.0 143.0607 15000.0 146.0026 2300.0 146.06 51000.0 147.0552 110000.0 147.2693 3000.0 148.0392 51000.0 148.0624 3500.0 149.0475 6500.0 150.055 50000.0 156.0682 36000.0 156.0811 15000.0 157.0762 13000.0 158.06 38000.0 159.0553 410000.0 159.0691 3800.0 168.081 6400.0 169.8691 2600.0 170.0594 14000.0 171.0379 3600.0 171.0554 530000.0 171.0723 8600.0 172.0631 170000.0 173.5261 27000.0 173.5359 45000.0 174.0556 2500.0 175.0519 2900.0 180.0809 64000.0 182.0838 49000.0 183.0734 4200.0 183.0918 170000.0 184.0762 43000.0 185.0709 30000.0 186.0554 46000.0 186.141 2500.0 193.0755 3700.0 194.059 5800.0 195.0921 6200.0 196.0621 2700.0 197.0712 32000.0 197.1073 150000.0 198.0764 12000.0 198.0932 8700.0 199.0502 3500.0 199.0865 75000.0 206.0835 9900.0 207.0721 2600.0 207.0918 120000.0 208.076 280000.0 208.0984 11000.0 209.0712 130000.0 210.0607 6800.0 210.079 640000.0 210.1016 10000.0 211.0868 2300000.0 213.0664 14000.0 221.0674 2900.0 222.0778 6900.0 223.0867 50000.0 224.0723 22000.0 224.0944 75000.0 225.0645 42000.0 225.0735 3800.0 225.1025 1500000.0 225.1285 9100.0 226.0866 23000.0 235.0595 9300.0 235.0867 540000.0 235.1122 4700.0 236.0707 240000.0 236.094 35000.0 238.0737 310000.0 239.0815 38000.0 246.0787 4300.0 251.0816 33000.0 252.0645 20000.0 252.0907 32000.0 253.0343 17000.0 253.0746 29000.0 253.0972 5900000.0 253.1473 4400.0 253.1588 41000.0 254.0772 2800.0 263.0815 180000.0 264.0625 7200.0 264.0903 15000.0 266.0684 6200.0 280.9985 4200.0 281.0199 40000.0 281.0339 10000.0 281.0923 7900000.0 281.1504 6400.0 281.1643 31000.0 281.1858 7200.0 END IONS BEGIN IONS SCANS=291 PEPMASS=313.0824 CHARGE=1 COLLISION_ENERGY=0.0 48.6851 2300.0 51.0819 2200.0 53.9695 2100.0 54.4947 2100.0 54.7005 2300.0 56.6812 2200.0 57.3295 2600.0 63.2579 2900.0 64.4254 2200.0 66.0521 2500.0 69.4306 2500.0 77.5741 2300.0 80.0493 8400.0 84.4237 2200.0 89.3877 2300.0 92.9952 2500.0 104.0322 2600.0 114.658 2500.0 116.5589 2100.0 120.0439 27000.0 122.4889 2400.0 132.0442 6800.0 136.0393 16000.0 138.0547 130000.0 138.9747 2400.0 140.8524 2400.0 141.6575 2200.0 144.6192 2600.0 144.8528 2400.0 148.0389 280000.0 148.053 2400.0 148.8247 2200.0 149.0467 11000.0 150.0548 44000.0 151.0388 5200.0 160.863 2600.0 163.9288 2300.0 164.0341 220000.0 165.042 51000.0 165.0559 2900.0 166.05 8300.0 173.528 32000.0 173.5388 19000.0 186.4388 2400.0 190.0507 3400.0 198.0186 2500.0 203.8834 13000.0 205.7709 2700.0 205.8996 6200.0 211.0865 18000.0 212.0707 11000.0 219.8402 2300.0 221.0706 5400.0 222.0547 16000.0 223.8292 2500.0 224.071 12000.0 239.0815 180000.0 240.065 33000.0 249.066 42000.0 250.0491 12000.0 252.0658 24000.0 257.0914 4600.0 263.253 2400.0 267.0763 260000.0 268.0604 80000.0 268.1491 2700.0 268.2787 3100.0 277.0612 76000.0 278.0444 22000.0 285.0871 250000.0 285.1228 3700.0 295.0716 170000.0 313.0818 54000.0 END IONS BEGIN IONS SCANS=292 PEPMASS=640.262 CHARGE=1 COLLISION_ENERGY=0.0 68.1493 3000.0 69.4616 2100.0 70.0649 700000.0 70.0689 4100.0 70.7526 2400.0 72.5076 2400.0 74.009 2400.0 74.4105 2200.0 78.4245 2300.0 80.0798 2200.0 82.3174 2100.0 84.0442 54000.0 88.465 2400.0 91.054 17000.0 92.3472 2800.0 97.0759 2800.0 97.4677 2300.0 99.0718 2300.0 102.0548 13000.0 111.9903 2500.0 115.0862 32000.0 118.0649 80000.0 119.0729 7800.0 120.0807 72000.0 125.0707 22000.0 130.0655 2500.0 133.0289 2300.0 134.045 2600.0 136.0757 22000.0 137.0707 68000.0 139.0863 20000.0 146.0469 2900.0 146.0598 660000.0 153.0894 100000.0 155.0819 5700.0 157.0969 630000.0 157.1081 3900.0 157.1123 9900.0 163.2595 2400.0 164.0702 15000.0 164.0836 4100.0 165.0542 4300.0 165.0889 3000.0 165.1924 2900.0 166.0972 2400.0 167.082 4800.0 168.0892 20000.0 172.1122 33000.0 173.5257 43000.0 173.537 48000.0 180.8919 2400.0 181.7355 2600.0 182.0812 45000.0 183.1 8000.0 184.1082 10000.0 185.0922 120000.0 187.1229 3000.0 199.1245 4400.0 204.1026 9100.0 210.4073 2500.0 215.1178 11000.0 216.1258 54000.0 217.1337 60000.0 224.1039 19000.0 225.1015 4400.0 229.0971 9200.0 236.1071 38000.0 243.1127 47000.0 245.094 2700.0 245.8321 2700.0 247.1078 100000.0 254.128 11000.0 256.144 9500.0 258.1236 8900.0 264.1018 12000.0 265.0857 24000.0 266.1281 12000.0 268.1448 16000.0 270.1128 22000.0 273.0873 110000.0 275.1028 130000.0 282.1148 83000.0 284.1399 41000.0 286.1556 220000.0 291.0975 14000.0 293.1135 100000.0 294.124 48000.0 300.1348 120000.0 301.0825 13000.0 302.1155 6700.0 303.099 2900.0 312.1348 140000.0 319.0919 12000.0 330.1454 480000.0 331.1526 21000.0 347.1391 47000.0 356.5707 2500.0 357.1223 16000.0 381.1449 46000.0 393.0888 2600.0 393.1443 44000.0 399.1554 21000.0 410.1704 7600.0 424.3916 2800.0 435.2497 2900.0 438.1656 15000.0 456.1763 30000.0 484.1705 27000.0 507.2225 18000.0 511.218 13000.0 525.2303 6200.0 535.2188 4500.0 553.228 20000.0 577.5272 3000.0 579.2559 2500.0 622.2517 76000.0 END IONS BEGIN IONS SCANS=293 PEPMASS=489.2237 CHARGE=1 COLLISION_ENERGY=0.0 58.9348 2400.0 62.2615 2400.0 64.0988 2100.0 64.4226 2400.0 71.6751 2400.0 73.9159 2400.0 76.9449 2200.0 79.5489 2300.0 89.2628 2300.0 90.1172 2100.0 91.0543 4300.0 97.1915 2400.0 104.88 2200.0 111.5135 2300.0 116.0702 2800.0 119.0486 2700.0 129.7286 2100.0 137.048 4500.0 137.0595 160000.0 137.0715 5400.0 143.6977 2500.0 147.0443 3300.0 147.2504 2800.0 158.1307 2200.0 159.0761 8700.0 162.0675 25000.0 163.0388 4800.0 163.0743 3100.0 173.5216 15000.0 173.5381 41000.0 175.0382 3100.0 177.0553 2700.0 178.0626 20000.0 180.1024 5500.0 189.0549 17000.0 189.9072 2400.0 190.0624 190000.0 191.0337 34000.0 191.0698 13000.0 192.0811 3300.0 192.1018 510000.0 192.1222 4200.0 193.0859 170000.0 206.0573 67000.0 221.0303 14000.0 221.0808 3700000.0 221.1204 12000.0 221.132 12000.0 222.0847 8200.0 223.0867 4000.0 251.139 19000.0 252.1228 30000.0 269.1494 25000.0 290.1395 2600.0 295.1293 16000.0 297.316 2200.0 336.144 450000.0 336.1798 2300.0 353.171 3500.0 370.0054 2600.0 387.2316 2500.0 403.307 2200.0 404.2116 2300.0 413.1259 2600.0 472.1961 12000.0 489.2233 37000.0 END IONS BEGIN IONS SCANS=294 PEPMASS=490.2803 CHARGE=1 COLLISION_ENERGY=0.0 59.049 2300.0 59.6247 2300.0 59.6644 2400.0 60.9198 2400.0 61.8592 2300.0 70.4001 2300.0 71.0126 2600.0 71.0491 19000.0 73.0283 67000.0 74.7387 2500.0 75.0438 260000.0 83.0491 19000.0 85.0282 76000.0 87.0441 14000.0 87.2511 2400.0 95.0494 5900.0 99.0438 4000.0 101.0595 13000.0 103.238 2600.0 105.0696 2200.0 105.9946 2600.0 107.049 49000.0 111.044 22000.0 113.0599 3100.0 116.4025 2200.0 119.0492 17000.0 119.0853 8700.0 121.0646 370000.0 123.0801 6900.0 125.0596 15000.0 126.2751 2200.0 129.0543 21000.0 131.0499 2600.0 133.0646 30000.0 135.0803 32000.0 135.5839 2400.0 136.8827 2300.0 137.0597 31000.0 138.0634 4500.0 139.0752 43000.0 139.826 2900.0 140.9075 2500.0 141.0908 8200.0 145.0646 33000.0 147.0803 230000.0 149.0597 9000.0 149.0962 8500.0 150.0681 7700.0 151.0752 120000.0 152.0832 2800.0 159.0804 17000.0 161.096 44000.0 163.0753 140000.0 163.0892 4600.0 165.091 260000.0 167.1064 8500.0 173.0958 9700.0 173.5209 17000.0 173.5384 62000.0 177.0912 50000.0 179.1062 12000.0 180.3907 3000.0 183.081 8400.0 184.338 2300.0 190.0624 18000.0 191.0665 9300.0 191.1067 72000.0 192.1019 63000.0 193.0859 17000.0 193.1053 41000.0 194.0898 9000.0 196.0884 2900.0 197.0965 13000.0 206.0576 6400.0 207.0608 3600.0 208.7045 2900.0 221.0808 390000.0 222.0844 370000.0 222.1065 3500.0 224.083 9800.0 225.0907 9100.0 225.1028 3100.0 225.1274 100000.0 238.0996 11000.0 239.1064 3000.0 251.1389 2300.0 253.1221 150000.0 254.1303 13000.0 256.1093 32000.0 257.1176 7900.0 257.1532 8900.0 267.1383 17000.0 269.1472 2700.0 270.1251 150000.0 270.1572 4600.0 283.1327 14000.0 285.1487 1500000.0 309.1481 13000.0 313.1426 9500.0 327.1598 11000.0 336.1439 26000.0 337.1474 64000.0 342.0614 3000.0 344.2219 120000.0 365.6527 2400.0 369.1689 6600.0 377.1728 3400.0 402.2407 2400.0 431.2062 3800.0 490.2788 76000.0 END IONS BEGIN IONS SCANS=295 PEPMASS=449.1713 CHARGE=1 COLLISION_ENERGY=0.0 56.8865 2200.0 61.5913 2200.0 63.0213 2300.0 63.1722 2400.0 63.2375 2400.0 63.7944 2700.0 64.0086 2700.0 64.3667 2700.0 64.8398 2400.0 65.9281 2900.0 67.7377 2600.0 68.3698 2400.0 68.8276 2300.0 69.0293 2100.0 71.5907 2300.0 72.8398 3100.0 75.6297 2100.0 76.4784 2100.0 76.9358 2700.0 77.5969 2200.0 79.0628 2500.0 82.1275 2400.0 84.6071 2200.0 85.7695 2300.0 87.5895 2300.0 89.6842 2500.0 91.4467 2200.0 94.2329 2100.0 96.3736 2600.0 97.6466 2400.0 97.9765 2400.0 102.1087 2800.0 107.0488 660000.0 108.0442 17000.0 108.5198 2300.0 115.0543 2300.0 118.7922 2400.0 121.0649 17000.0 123.1134 2300.0 124.0252 2600.0 125.5591 2500.0 126.0547 48000.0 129.4279 2300.0 130.7923 2400.0 135.002 2300.0 135.1574 2500.0 136.5994 2300.0 137.0594 110000.0 141.0617 2600.0 142.0237 2300.0 142.4675 2200.0 142.5887 2300.0 143.049 65000.0 145.0646 110000.0 146.4007 2500.0 151.0752 60000.0 152.034 24000.0 154.0352 18000.0 154.0495 1000000.0 154.0621 7400.0 161.5772 2500.0 163.0752 38000.0 164.034 340000.0 165.042 24000.0 167.0126 2700.0 173.4472 2400.0 173.5256 70000.0 173.5374 100000.0 175.0596 3600.0 175.0752 250000.0 177.0902 2800.0 178.0861 880000.0 178.1029 6700.0 179.8894 2700.0 180.9076 2600.0 181.061 53000.0 184.3201 2600.0 187.6048 2300.0 188.7827 2500.0 189.6194 2700.0 190.0861 53000.0 191.0951 2200.0 195.051 2600.0 196.8514 2400.0 197.102 2700.0 209.0961 53000.0 215.4249 2200.0 219.0814 2500.0 222.9476 2400.0 226.3041 2500.0 237.0909 220000.0 241.0857 2900.0 250.5495 2600.0 256.8345 2400.0 269.0849 5000.0 269.1171 700000.0 277.6017 3400.0 286.1438 240000.0 294.7574 3000.0 297.2988 2200.0 298.1441 98000.0 299.1522 2600.0 303.3109 2600.0 307.0809 2400.0 321.8969 2600.0 324.4569 2400.0 337.0715 2400.0 338.818 2600.0 346.9269 2400.0 374.214 2500.0 376.6181 2400.0 379.4111 2200.0 386.7341 2600.0 426.4266 2500.0 431.1503 2700.0 449.1707 590000.0 449.2794 8400.0 END IONS BEGIN IONS SCANS=296 PEPMASS=303.108 CHARGE=1 COLLISION_ENERGY=0.0 52.4894 2200.0 55.0178 2900.0 55.0539 6600.0 57.0334 3700.0 58.6019 2400.0 60.9212 2400.0 64.9449 2200.0 66.3989 2600.0 67.054 8200.0 67.5835 2400.0 78.3871 2100.0 79.0539 41000.0 81.0696 13000.0 82.1676 2200.0 83.995 2300.0 89.9544 2700.0 91.0541 17000.0 91.9983 2300.0 93.0696 30000.0 94.3439 2500.0 97.1009 6100.0 100.8975 2200.0 107.049 15000.0 107.0851 55000.0 111.0801 15000.0 117.0695 31000.0 119.236 2500.0 119.5576 2500.0 121.0642 4100.0 123.502 2100.0 125.0958 30000.0 127.4313 2200.0 135.0802 130000.0 141.8241 2500.0 145.0647 6400.0 153.0907 110000.0 155.2177 2500.0 163.0751 26000.0 173.5221 4200.0 173.5361 35000.0 181.0859 110000.0 182.7056 2600.0 190.0052 2500.0 252.5941 2500.0 265.1013 2400.0 END IONS BEGIN IONS SCANS=297 PEPMASS=427.1802 CHARGE=1 COLLISION_ENERGY=0.0 81.0445 9800.0 82.0525 3700.0 83.06 52000.0 85.0394 3900.0 86.0961 1300000.0 86.1022 6500.0 86.1053 8600.0 87.0994 22000.0 88.039 82000.0 91.0538 27000.0 93.0444 17000.0 93.1521 2300.0 95.0601 30000.0 96.8882 2700.0 97.7586 2500.0 98.7541 2200.0 101.0596 5200.0 105.8668 2200.0 106.0647 3500.0 107.0487 24000.0 110.0709 830000.0 110.0793 5100.0 110.0838 4700.0 111.0439 19000.0 111.0746 14000.0 115.3928 2500.0 118.0649 20000.0 119.0163 2400.0 119.0489 30000.0 119.0728 6600.0 119.1306 2500.0 120.0546 3300.0 120.0805 37000.0 121.2741 2500.0 122.06 2700.0 122.0703 4700.0 123.044 13000.0 125.1066 3100.0 129.054 5300.0 130.0647 14000.0 131.0487 54000.0 134.0499 2900.0 134.0597 100000.0 135.0437 5900.0 135.0674 29000.0 135.0781 2900.0 136.0501 76000.0 136.0754 260000.0 136.975 2600.0 137.0785 2400.0 138.0658 13000.0 138.9815 2300.0 141.1008 6700.0 146.0595 67000.0 150.0651 6200.0 155.0926 41000.0 160.0385 4200.0 162.04 3800.0 162.0547 230000.0 162.4612 2400.0 163.0582 5200.0 164.0452 150000.0 164.0688 3100.0 165.0547 40000.0 165.077 29000.0 166.061 16000.0 166.5758 2500.0 167.0926 25000.0 172.0757 3700.0 173.0714 4000.0 173.5214 9200.0 173.5289 82000.0 173.5404 29000.0 174.0544 11000.0 174.071 2500.0 174.1277 10000.0 174.3013 2500.0 178.0607 61000.0 178.1352 2600.0 178.363 2500.0 179.0824 2600.0 181.0717 22000.0 182.0569 2800.0 182.0808 19000.0 183.0795 2600.0 184.6073 31000.0 184.6231 2300.0 186.1273 9100.0 186.5827 2400.0 188.0697 3800.0 188.143 33000.0 190.1226 17000.0 193.0718 46000.0 193.1685 2300.0 195.0875 130000.0 198.055 16000.0 198.1025 36000.0 201.6745 2500.0 202.2653 2400.0 205.0723 5300.0 205.0963 3100.0 206.0786 2300.0 210.1032 20000.0 211.0756 6500.0 212.118 87000.0 213.7658 3200.0 214.099 20000.0 214.1226 39000.0 216.0661 24000.0 216.9616 2700.0 217.0613 22000.0 219.0749 2600.0 221.067 40000.0 222.0962 3300.0 223.0773 2900.0 224.1072 9300.0 226.0967 5500.0 228.113 70000.0 231.1485 9500.0 232.1567 9700.0 235.0822 4300.0 236.6199 8500.0 237.1128 2700.0 238.097 66000.0 240.0583 2400.0 240.102 200000.0 241.1075 7300.0 242.1178 3000.0 243.1212 3300.0 244.0996 2600.0 248.868 2500.0 249.0871 26000.0 250.0867 8800.0 250.6183 5400.0 252.1025 2600.0 254.0912 10000.0 255.1237 230000.0 256.107 23000.0 259.071 94000.0 259.1439 78000.0 264.1086 27000.0 265.1063 7300.0 266.093 14000.0 267.0991 6300.0 268.098 12000.0 269.0922 8400.0 271.1182 29000.0 273.1352 46000.0 275.0678 4400.0 277.0823 110000.0 278.7834 2900.0 279.0763 5000.0 279.1133 35000.0 280.084 5800.0 282.0875 16000.0 283.1191 220000.0 284.1234 14000.0 286.1075 83000.0 288.0998 13000.0 289.1055 3000.0 291.1566 2400.0 293.104 3000.0 296.0912 2800.0 297.1004 31000.0 298.1079 5700.0 299.1141 280000.0 300.1162 9700.0 302.0954 8600.0 310.1148 22000.0 311.1112 30000.0 312.1458 2600.0 313.1301 2700.0 325.0935 47000.0 329.0381 2600.0 335.7658 2400.0 336.0936 34000.0 337.1914 11000.0 340.1402 21000.0 341.1123 27000.0 352.1398 5700.0 352.2126 5200.0 363.1696 3500.0 366.0951 4000.0 368.1323 6800.0 368.2075 4300.0 373.1644 6400.0 378.1934 27000.0 394.1429 7600.0 396.1319 13000.0 396.2027 20000.0 398.1496 4700.0 399.145 15000.0 400.1778 7100.0 401.1358 81000.0 402.1349 3100.0 414.1401 30000.0 415.1494 6200.0 416.1718 60000.0 418.1824 2700.0 427.1397 46000.0 440.123 7300.0 444.1674 45000.0 456.1418 3400.0 472.1595 8600.0 518.1951 3100.0 559.1927 6200.0 579.3061 3100.0 587.1882 3700.0 595.2131 17000.0 608.2667 2500.0 669.3976 2700.0 711.7042 2600.0 740.266 39000.0 741.2672 2800.0 800.6078 2600.0 808.6974 2300.0 END IONS BEGIN IONS SCANS=298 PEPMASS=282.1494 CHARGE=1 COLLISION_ENERGY=0.0 46.325 2100.0 51.3577 2400.0 51.8416 2200.0 52.5308 2400.0 57.0698 2700.0 57.6017 2400.0 58.1726 2300.0 59.8766 2300.0 62.7747 2500.0 63.0022 2600.0 64.5842 2500.0 67.0518 2600.0 67.8538 2000.0 70.319 2300.0 77.723 2900.0 77.9594 2300.0 83.0858 5600.0 84.7702 2900.0 88.2069 2400.0 89.4502 2400.0 93.5135 2300.0 95.9347 2200.0 96.6856 3000.0 96.7416 2200.0 100.0656 2700.0 107.7147 2200.0 118.6508 2400.0 118.82 2400.0 127.719 2400.0 129.937 2400.0 131.6122 2600.0 134.0963 88000.0 142.8487 2300.0 150.674 2500.0 152.5268 2300.0 165.0709 4200.0 167.085 5100.0 173.5235 39000.0 173.5373 75000.0 173.5435 3400.0 173.8466 2500.0 177.0689 2800.0 177.2141 2400.0 178.0775 6000.0 179.0842 3300.0 189.071 3100.0 190.078 35000.0 190.2023 2300.0 191.0651 9700.0 191.0856 800000.0 191.1058 11000.0 191.1154 3100.0 193.0644 3100.0 193.1009 6800.0 194.0726 48000.0 195.0803 91000.0 197.4783 2300.0 201.0693 11000.0 203.085 6800.0 204.5715 2400.0 205.1008 33000.0 207.0809 25000.0 208.0886 71000.0 211.1353 21000.0 218.0721 6500.0 219.0302 3100.0 219.056 9200.0 219.0806 2300000.0 219.1055 14000.0 221.0967 43000.0 223.1117 34000.0 229.0761 62000.0 236.0833 350000.0 249.1257 2300.0 249.6671 2300.0 251.0763 4700.0 251.1066 3000000.0 269.5633 2400.0 275.5179 2500.0 282.149 3100.0 282.2219 230000.0 289.5362 2300.0 END IONS BEGIN IONS SCANS=299 PEPMASS=610.2878 CHARGE=1 COLLISION_ENERGY=0.0 65.0523 4800.0 70.0651 4100000.0 70.0706 39000.0 70.074 14000.0 72.0806 570000.0 72.0876 7900.0 91.0543 34000.0 97.0758 50000.0 98.0599 240000.0 107.0489 14000.0 109.0769 9000.0 115.0865 590000.0 115.096 10000.0 118.065 160000.0 119.0733 23000.0 120.0806 160000.0 125.0708 270000.0 126.0548 120000.0 134.2791 5500.0 136.0757 79000.0 137.0708 160000.0 141.1384 15000.0 146.0599 1500000.0 151.1231 38000.0 152.0818 39000.0 153.0769 3700.0 153.0895 280000.0 153.1386 18000.0 155.0449 6200.0 158.9574 4800.0 160.076 24000.0 160.1121 9000.0 162.092 4800.0 164.0705 48000.0 165.055 40000.0 166.1336 6500.0 167.118 86000.0 169.1092 6400.0 169.1335 1100000.0 169.1504 11000.0 172.1121 350000.0 173.5221 14000.0 173.5349 120000.0 174.0553 29000.0 174.1277 66000.0 176.0708 3800.0 179.1179 54000.0 180.1124 48000.0 180.1261 88000.0 182.0813 220000.0 187.087 12000.0 187.123 44000.0 188.0707 72000.0 192.6137 3600.0 194.1288 14000.0 195.1145 27000.0 195.1367 81000.0 196.1445 47000.0 197.1075 3800.0 197.1284 370000.0 199.1229 83000.0 205.0971 97000.0 205.2103 3700.0 215.0818 19000.0 215.1178 89000.0 216.1258 790000.0 217.0975 38000.0 217.1102 3500.0 217.1336 260000.0 219.7606 4800.0 223.076 11000.0 223.1079 77000.0 225.1023 41000.0 231.0772 16000.0 233.0921 500000.0 233.1192 4900.0 236.107 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466.196 15000.0 477.2483 19000.0 483.2233 430000.0 493.2071 100000.0 511.2182 460000.0 523.253 30000.0 581.7455 4100.0 592.2734 24000.0 610.2857 220000.0 END IONS BEGIN IONS SCANS=300 PEPMASS=388.1609 CHARGE=1 COLLISION_ENERGY=0.0 53.0386 5600.0 55.0176 20000.0 57.0334 9700.0 61.0282 16000.0 69.0332 96000.0 69.5418 2100.0 70.1988 2100.0 71.0488 17000.0 73.0281 28000.0 73.0388 2200.0 80.6482 3000.0 81.0332 63000.0 85.028 410000.0 87.0021 3900.0 87.0073 130000.0 87.0441 2700.0 96.1107 2200.0 97.0281 120000.0 99.0437 72000.0 105.0179 170000.0 105.0695 24000.0 108.0443 8800.0 109.0281 120000.0 116.6524 2100.0 117.6007 2500.0 126.0545 9400.0 127.0386 260000.0 129.0182 16000.0 145.0492 46000.0 147.0285 11000.0 148.8159 2900.0 155.3797 2400.0 159.0285 77000.0 173.5253 12000.0 173.5372 32000.0 179.3307 2600.0 189.0391 3800.0 231.0499 20000.0 247.6759 2500.0 327.6671 3000.0 334.1415 2500.0 END IONS BEGIN IONS SCANS=301 PEPMASS=316.1912 CHARGE=1 COLLISION_ENERGY=0.0 49.1107 2300.0 49.7811 2200.0 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55000.0 176.0834 20000.0 177.0912 45000.0 179.1068 27000.0 183.0804 16000.0 191.1066 120000.0 193.1008 3200.0 195.0807 2900.0 196.0886 16000.0 197.0961 41000.0 202.5575 2600.0 207.1166 6800.0 209.0967 2800.0 210.1047 4100.0 211.1118 9900.0 215.1053 2700.0 221.0976 6900.0 224.0837 14000.0 225.0916 16000.0 225.1277 61000.0 226.098 3700.0 238.0992 35000.0 239.1062 14000.0 241.0859 22000.0 242.0935 9300.0 251.4297 2400.0 253.1224 58000.0 254.1304 76000.0 255.101 15000.0 256.1094 170000.0 257.1171 15000.0 267.1371 3200.0 270.1253 87000.0 285.1489 120000.0 END IONS BEGIN IONS SCANS=302 PEPMASS=311.1107 CHARGE=1 COLLISION_ENERGY=0.0 53.4129 2200.0 54.5664 2500.0 57.0947 2500.0 64.4022 2200.0 75.7804 2300.0 86.0514 2300.0 86.4816 2700.0 112.4124 2400.0 115.532 2700.0 116.9314 2300.0 129.0992 2300.0 164.6703 3000.0 173.5206 8700.0 173.5301 13000.0 173.5389 20000.0 197.1024 3000.0 199.8403 2200.0 227.0818 3000.0 230.5485 2700.0 237.0667 7700.0 239.5149 2600.0 253.1735 3300.0 255.0768 8100.0 265.0605 11000.0 283.0716 13000.0 311.0661 11000.0 321.5013 2700.0 END IONS BEGIN IONS SCANS=303 PEPMASS=289.1287 CHARGE=1 COLLISION_ENERGY=0.0 47.3938 2400.0 52.9558 3000.0 53.0385 19000.0 53.8702 2200.0 54.3471 2400.0 55.0176 120000.0 55.054 230000.0 56.0827 2300.0 56.5942 2300.0 57.0332 55000.0 57.0697 30000.0 57.3442 2300.0 57.6024 2500.0 58.1967 2600.0 58.5807 2200.0 59.0488 5600.0 59.6836 2600.0 60.6997 2100.0 60.7616 2100.0 62.9813 2600.0 64.7648 2400.0 65.0385 14000.0 65.0518 2400.0 67.0539 480000.0 68.6918 2200.0 68.8209 2300.0 69.0332 100000.0 69.0658 4200.0 69.0696 270000.0 69.9724 3100.0 71.016 2300.0 71.0489 820000.0 71.2763 2400.0 73.0282 28000.0 76.969 2500.0 77.0383 13000.0 77.248 2200.0 79.0539 1200000.0 79.0593 4200.0 81.0331 34000.0 81.0647 4200.0 81.0696 470000.0 82.7308 2200.0 83.0488 220000.0 83.0851 10000.0 85.0281 11000.0 85.0645 210000.0 85.9822 2300.0 86.583 2800.0 87.0073 80000.0 87.0437 160000.0 87.3041 2400.0 91.0484 2700.0 91.0539 200000.0 92.3596 2800.0 93.0333 19000.0 93.0696 1500000.0 93.076 3700.0 95.0488 60000.0 95.0852 420000.0 97.0282 2900.0 97.0585 2400.0 97.0644 250000.0 97.1008 8500.0 99.0438 9000.0 99.0801 15000.0 100.3758 2300.0 101.0593 55000.0 103.0538 3000.0 105.0182 4000.0 105.0446 9200.0 105.0696 170000.0 107.0488 140000.0 107.0773 4600.0 107.0852 490000.0 108.7696 2200.0 109.0645 5500.0 109.101 29000.0 110.5618 2500.0 111.0437 57000.0 111.0512 2300.0 111.0802 68000.0 111.1166 5300.0 113.0595 35000.0 115.0387 29000.0 115.1018 2300.0 116.062 3000.0 119.0852 74000.0 121.0645 54000.0 121.0734 2500.0 121.1008 1200000.0 121.1098 3400.0 121.111 29000.0 121.4563 2200.0 123.0801 85000.0 124.9748 2300.0 125.0593 91000.0 125.0958 16000.0 126.016 2700.0 129.0695 23000.0 131.0747 9300.0 131.0852 360000.0 131.0966 3600.0 137.096 19000.0 139.0996 5200.0 139.1115 410000.0 149.0958 370000.0 157.122 150000.0 167.1067 65000.0 173.5246 24000.0 173.5395 47000.0 185.1186 3200.0 202.4617 2200.0 203.6203 2500.0 208.0164 2400.0 213.674 2500.0 216.0558 2600.0 222.9554 2900.0 240.9804 2700.0 243.5207 2600.0 274.5161 2500.0 291.4058 2400.0 END IONS BEGIN IONS SCANS=304 PEPMASS=518.1877 CHARGE=1 COLLISION_ENERGY=0.0 60.5572 2600.0 69.0332 30000.0 69.5248 2400.0 71.0488 6500.0 73.0282 12000.0 79.3494 2200.0 79.689 2200.0 81.0332 53000.0 83.0493 2500.0 85.0281 140000.0 87.0074 32000.0 91.0539 250000.0 97.0281 97000.0 99.0437 48000.0 103.0388 32000.0 105.0179 81000.0 109.0281 250000.0 115.7576 3000.0 127.028 6600.0 127.0387 330000.0 129.018 17000.0 132.4423 2600.0 145.0494 50000.0 145.0619 7700.0 146.0117 2300.0 147.0286 17000.0 158.5238 2200.0 159.0286 67000.0 163.6971 2100.0 166.0767 2600.0 169.0495 6900.0 171.0796 3000.0 173.5293 54000.0 173.5435 9400.0 181.0472 2700.0 181.1164 2600.0 181.7755 2200.0 187.0594 3700.0 199.0754 11000.0 213.0397 25000.0 229.4629 2500.0 230.7838 2600.0 231.0499 42000.0 241.4174 2400.0 291.0725 3200.0 403.5247 2500.0 413.0342 2300.0 492.7175 2700.0 523.6804 2600.0 END IONS BEGIN IONS SCANS=305 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238.0531 100000.0 238.9799 6600.0 239.0372 3300000.0 239.0934 8800.0 241.328 2500.0 253.0961 3100.0 284.0589 64000.0 292.1545 2700.0 312.1567 2600.0 370.2343 2400.0 404.0544 2500.0 END IONS BEGIN IONS SCANS=312 PEPMASS=345.2251 CHARGE=1 COLLISION_ENERGY=0.0 51.2873 2700.0 57.5463 2100.0 63.5851 2200.0 72.8148 2600.0 76.5717 2400.0 80.1206 2300.0 96.9384 2600.0 107.0488 11000.0 117.0329 2900.0 121.0645 45000.0 122.0678 28000.0 125.2742 2400.0 131.721 2700.0 133.7786 2400.0 139.6522 2300.0 143.9525 2400.0 145.028 28000.0 146.0315 29000.0 147.08 11000.0 148.0833 10000.0 149.6883 9900.0 151.075 17000.0 152.0784 6600.0 162.9711 2100.0 163.0752 26000.0 164.0785 30000.0 165.091 17000.0 166.0943 19000.0 173.5213 6100.0 173.5309 12000.0 173.5413 11000.0 177.0546 44000.0 178.058 46000.0 190.9182 2800.0 191.107 2800.0 192.1103 5500.0 214.677 2500.0 226.1317 3200.0 254.1272 3400.0 257.1122 3400.0 271.1271 12000.0 278.6917 2200.0 286.1521 23000.0 303.0533 2500.0 355.4495 3100.0 END IONS BEGIN IONS 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211.0755 29000.0 211.1118 50000.0 213.0912 94000.0 219.0802 2700.0 220.0882 12000.0 221.0965 49000.0 222.1038 20000.0 223.0756 150000.0 223.1124 17000.0 224.0835 150000.0 225.091 150000.0 225.1278 98000.0 226.0991 81000.0 227.107 37000.0 231.9408 2400.0 233.9008 3000.0 235.1126 6300.0 236.1197 27000.0 237.091 33000.0 238.0988 200000.0 238.8762 2400.0 239.1067 240000.0 241.0859 710000.0 241.1142 5100.0 242.0937 150000.0 246.6246 2400.0 252.1137 17000.0 253.1221 100000.0 254.1013 2000.0 254.1299 470000.0 255.1017 160000.0 256.0778 16000.0 256.1092 1200000.0 256.1412 2600.0 257.1175 16000.0 259.2775 2500.0 270.1252 240000.0 285.1481 38000.0 285.2988 2700.0 290.4687 3000.0 END IONS BEGIN IONS SCANS=317 PEPMASS=461.3008 CHARGE=1 COLLISION_ENERGY=0.0 57.6899 2200.0 69.0217 2500.0 69.068 2200.0 70.0316 2600.0 91.7929 2300.0 92.7002 2400.0 104.8318 2200.0 107.049 29000.0 111.4262 2400.0 114.3615 2500.0 117.1744 2700.0 119.0488 13000.0 121.0645 270000.0 121.074 2300.0 123.0806 2700.0 125.0586 3000.0 133.0646 25000.0 135.0804 16000.0 137.0595 5000.0 139.0749 27000.0 145.0648 20000.0 147.0686 2600.0 147.0801 160000.0 151.0751 83000.0 151.6718 2300.0 156.2728 2500.0 159.0797 10000.0 161.0962 20000.0 163.0752 120000.0 164.0825 4000.0 165.0907 170000.0 165.1063 4100.0 167.1067 7400.0 169.2177 2400.0 171.0803 2500.0 172.746 2500.0 173.2223 2600.0 173.5219 32000.0 173.5403 42000.0 177.0909 23000.0 178.0995 2600.0 178.7256 2400.0 179.107 6800.0 185.5659 2700.0 191.1063 68000.0 192.5184 2300.0 192.9059 2300.0 197.0968 13000.0 201.3723 2800.0 222.1498 5400.0 224.0832 3600.0 225.0917 5300.0 225.1274 73000.0 233.7442 2400.0 235.1123 2400.0 237.1728 6300.0 238.0987 6600.0 238.6022 2500.0 248.8866 2600.0 251.9955 2300.0 253.1221 97000.0 254.1294 14000.0 256.1098 33000.0 257.1188 4300.0 257.1523 2900.0 262.0878 2400.0 267.1376 10000.0 270.1247 120000.0 285.1106 5000.0 285.1485 1500000.0 326.1181 2700.0 344.1717 3200.0 344.1828 2000.0 344.2219 470000.0 344.2699 15000.0 346.1386 2800.0 349.3935 3000.0 401.3002 2600.0 END IONS BEGIN IONS SCANS=318 PEPMASS=515.2327 CHARGE=1 COLLISION_ENERGY=0.0 80.8486 2400.0 86.0961 13000.0 99.064 2600.0 103.5919 2700.0 110.071 110000.0 112.0867 9100.0 121.209 2500.0 122.0598 3100.0 129.0569 2500.0 130.0648 130000.0 134.0603 5800.0 135.7315 2400.0 136.0753 56000.0 140.0815 2900.0 145.1749 2400.0 146.0602 6700.0 156.0442 52000.0 158.0596 25000.0 160.0383 3500.0 160.5765 3400.0 163.0516 2200.0 164.8708 2400.0 168.9792 2500.0 169.5822 8500.0 173.5278 45000.0 173.5363 13000.0 174.0549 36000.0 175.1192 18000.0 180.5486 2400.0 181.0719 25000.0 188.0343 11000.0 199.0996 5600.0 209.7369 2700.0 221.5905 4300.0 227.118 180000.0 228.1122 53000.0 228.6116 3700.0 230.1176 57000.0 235.1189 3400.0 238.124 21000.0 245.1296 8900.0 251.1137 92000.0 251.6148 14000.0 252.1467 2600.0 253.0971 91000.0 255.1126 100000.0 256.1146 3700.0 258.1122 2500.0 273.1243 6800.0 275.1393 12000.0 277.1414 32000.0 278.1252 85000.0 279.1092 29000.0 280.8891 2900.0 281.0925 200000.0 282.0948 14000.0 294.1668 25000.0 301.1195 29000.0 302.3738 2700.0 303.12 37000.0 312.1784 28000.0 320.1465 6100.0 321.1586 8500.0 323.6729 2500.0 336.2358 2400.0 338.1573 42000.0 353.6488 2600.0 395.1141 2700.0 396.1655 13000.0 410.1834 3300.0 410.2394 2600.0 423.2235 2700.0 438.1859 16000.0 441.1892 17000.0 442.1738 6700.0 449.2003 2600.0 458.2151 25000.0 473.2291 3100.0 475.2409 81000.0 476.2421 11000.0 484.1952 21000.0 501.2214 27000.0 508.3581 2600.0 520.7061 2600.0 533.2009 2600.0 586.3063 2700.0 612.2887 7800.0 636.2887 28000.0 646.2734 3300.0 672.4435 2500.0 749.3753 32000.0 750.3655 2600.0 750.3772 11000.0 758.0978 2700.0 775.352 43000.0 776.3574 3400.0 END IONS BEGIN IONS SCANS=319 PEPMASS=515.7342 CHARGE=2 COLLISION_ENERGY=0.0 84.1218 2700.0 109.7604 2500.0 110.071 8400.0 130.0649 12000.0 136.0755 3700.0 156.0443 5300.0 173.5264 13000.0 173.5451 3800.0 203.0068 2300.0 227.1178 9000.0 228.1133 4700.0 230.1176 2700.0 251.114 2800.0 253.0981 4200.0 255.1134 6200.0 278.1258 6400.0 281.093 11000.0 365.0658 2900.0 475.2414 4500.0 574.3746 2400.0 END IONS BEGIN IONS SCANS=320 PEPMASS=402.1398 CHARGE=1 COLLISION_ENERGY=0.0 57.5654 2000.0 62.1544 2100.0 62.2218 2400.0 69.0331 36000.0 69.4145 2500.0 71.7878 2300.0 75.6992 2400.0 79.0541 16000.0 81.0695 5500.0 82.9631 2600.0 84.7385 2400.0 85.0282 12000.0 86.2745 2400.0 87.2035 2700.0 90.0472 2100.0 90.6548 2300.0 91.054 16000.0 93.0694 3300.0 95.0124 37000.0 95.7503 2400.0 97.0281 190000.0 97.0646 6100.0 97.3724 2500.0 99.0437 3500.0 99.7957 2200.0 103.857 2400.0 103.9046 2500.0 105.0698 2800.0 105.7352 2400.0 107.0493 5500.0 107.0852 280000.0 109.0641 3000.0 109.1013 22000.0 113.023 140000.0 116.7134 2900.0 117.0697 25000.0 119.4967 2300.0 121.5194 2500.0 123.0073 99000.0 123.0438 2900.0 125.0231 42000.0 125.0958 48000.0 135.0802 1300000.0 135.0896 18000.0 135.0927 4700.0 141.0065 4200.0 141.018 160000.0 143.0337 110000.0 149.6862 5200.0 153.0909 60000.0 160.971 2300.0 161.43 2300.0 163.059 11000.0 163.0753 1000000.0 163.0911 21000.0 165.9697 2500.0 169.0131 170000.0 169.0284 4300.0 173.5264 37000.0 173.5364 34000.0 181.0859 110000.0 187.0239 36000.0 190.6372 2400.0 199.0974 3000.0 204.0346 2400.0 228.7551 2300.0 293.0537 2500.0 298.1811 2700.0 387.8698 2800.0 391.3299 2500.0 404.326 2400.0 408.9921 2400.0 END IONS BEGIN IONS SCANS=321 PEPMASS=211.0969 CHARGE=1 COLLISION_ENERGY=0.0 41.0385 14000.0 43.0177 500000.0 45.0333 140000.0 47.69 2800.0 48.1603 2200.0 51.3004 2200.0 53.0385 3100.0 53.3118 2200.0 53.6859 2400.0 55.0174 3200.0 55.054 91000.0 55.7275 2800.0 57.0332 110000.0 57.0696 110000.0 60.0088 2100.0 62.8839 2300.0 65.0383 55000.0 67.018 2300.0 67.054 710000.0 67.058 3700.0 67.0604 5100.0 68.9968 74000.0 69.0332 21000.0 69.9606 2400.0 72.9516 2100.0 73.0849 2200.0 79.0538 27000.0 81.0646 3200.0 81.0696 210000.0 83.049 11000.0 83.0851 8000.0 85.0281 11000.0 85.0644 570000.0 85.0707 4600.0 86.7319 2700.0 91.0539 15000.0 93.0697 6600.0 95.0489 17000.0 95.0852 27000.0 99.08 68000.0 100.5199 2500.0 100.8753 2400.0 102.7358 2400.0 105.0695 23000.0 107.0489 5000.0 107.0853 25000.0 109.0286 4000.0 109.0561 8600.0 109.0644 400000.0 109.0736 3000.0 109.1006 2600.0 109.9475 2300.0 111.0073 19000.0 111.0437 12000.0 111.5399 2200.0 113.06 2600.0 118.9631 3100.0 119.049 3100.0 119.0852 24000.0 119.9572 3600.0 121.0645 23000.0 123.0336 4900.0 123.0437 640000.0 123.0549 3600.0 123.0715 3700.0 123.08 140000.0 125.0956 81000.0 127.0386 120000.0 127.075 430000.0 127.0842 2100.0 129.0696 20000.0 133.0647 3000.0 135.0439 2600.0 137.0229 5800.0 137.0594 96000.0 137.096 11000.0 139.0274 4900.0 139.0387 170000.0 139.0511 3900.0 139.9048 2400.0 147.0801 39000.0 149.0593 18000.0 151.0386 74000.0 151.0749 62000.0 151.0867 3200.0 153.0173 2500.0 153.0543 58000.0 153.328 2700.0 155.0335 200000.0 155.0482 2400.0 159.9886 5700.0 160.0516 28000.0 161.4671 2200.0 163.0385 11000.0 164.0466 100000.0 165.0545 30000.0 165.0908 120000.0 166.3739 2300.0 167.0699 9600.0 173.5268 27000.0 173.5396 24000.0 175.0753 95000.0 178.0621 7500.0 193.0857 110000.0 206.4661 2100.0 END IONS BEGIN IONS SCANS=322 PEPMASS=264.2323 CHARGE=1 COLLISION_ENERGY=0.0 48.3573 2700.0 49.0997 2700.0 49.2782 2300.0 54.8553 2600.0 55.7528 2500.0 57.2625 2300.0 58.0648 35000.0 58.4527 2200.0 60.0481 2100.0 64.4462 2500.0 69.0695 18000.0 69.962 2100.0 70.0647 26000.0 71.0488 10000.0 72.4496 2800.0 74.2858 2800.0 75.1304 2500.0 78.8939 2400.0 79.8744 2400.0 81.0694 32000.0 86.6528 2500.0 93.0694 49000.0 95.0852 29000.0 95.4557 2400.0 96.3756 2700.0 99.0331 2800.0 100.0753 9000.0 100.6371 2700.0 104.2718 2400.0 105.0694 39000.0 107.0851 49000.0 108.0805 3100.0 108.8218 2800.0 109.1009 15000.0 112.1115 2500.0 119.0849 44000.0 119.967 2300.0 121.1008 42000.0 122.0957 2500.0 123.0802 9100.0 123.116 12000.0 123.4371 2500.0 130.5157 2200.0 133.1005 52000.0 137.132 10000.0 138.1271 14000.0 139.7482 2500.0 145.1004 3300.0 146.2184 2600.0 147.1163 73000.0 149.132 140000.0 151.1109 21000.0 159.1161 7400.0 159.9546 2400.0 161.1322 3400.0 163.1114 6400.0 163.1474 4100.0 173.1326 12000.0 173.5211 4400.0 173.5278 27000.0 173.5398 23000.0 187.1482 10000.0 189.1635 100000.0 191.1431 9300.0 203.1782 7000.0 204.175 6300.0 207.1745 15000.0 212.9392 3000.0 229.1949 25000.0 246.2214 21000.0 247.2044 3100.0 264.1039 3200.0 264.2319 730000.0 265.1938 2500.0 END IONS BEGIN IONS SCANS=323 PEPMASS=471.2132 CHARGE=1 COLLISION_ENERGY=0.0 61.3473 2900.0 69.1678 2400.0 69.8838 2500.0 73.5411 2600.0 74.4928 2400.0 81.319 2400.0 82.0649 2700.0 91.0542 34000.0 92.8976 2700.0 93.053 2400.0 93.439 2800.0 104.2593 2300.0 111.0647 2200.0 111.7653 2300.0 112.6352 2400.0 115.3149 2900.0 119.049 15000.0 119.4039 2600.0 120.6921 2400.0 127.903 2700.0 133.118 2400.0 135.044 2900.0 137.0596 690000.0 137.0692 3100.0 138.8562 2300.0 147.0441 19000.0 147.3581 2400.0 157.065 3200.0 158.9494 2400.0 161.0594 2600.0 162.0677 63000.0 163.0391 8100.0 163.0757 7600.0 171.3859 2400.0 172.5675 2200.0 173.5283 99000.0 173.5442 6400.0 174.0303 2700.0 175.0396 14000.0 175.0757 3900.0 176.0475 5000.0 177.0555 12000.0 178.0628 51000.0 178.488 2600.0 189.0546 44000.0 190.0429 9200.0 190.0624 440000.0 190.0795 3700.0 190.0827 6600.0 191.0339 81000.0 191.0701 32000.0 192.0812 3000.0 192.1019 940000.0 192.1219 15000.0 193.0859 380000.0 204.2693 2700.0 205.8158 2500.0 206.0575 160000.0 206.0771 2300.0 206.1794 2500.0 206.7206 2400.0 221.0307 12000.0 221.0809 3600000.0 221.1067 2800.0 221.1324 9100.0 226.8391 2400.0 251.1387 2600.0 325.1648 2400.0 327.6342 2500.0 329.226 2700.0 338.1438 2200.0 339.8834 2500.0 349.5995 2500.0 361.94 2500.0 366.7722 2400.0 413.7135 2600.0 429.4442 2600.0 443.4627 2500.0 454.5101 2800.0 471.2571 5700.0 END IONS BEGIN IONS SCANS=324 PEPMASS=346.2015 CHARGE=1 COLLISION_ENERGY=0.0 58.0652 9500.0 66.0734 2200.0 66.7098 2200.0 70.4197 2200.0 71.5952 2300.0 75.044 4100.0 81.0701 4600.0 91.0543 18000.0 93.0698 10000.0 95.0493 6400.0 103.0544 4500.0 105.07 10000.0 107.0492 100000.0 107.0575 2800.0 109.0648 4000.0 110.1821 2400.0 111.0803 2600.0 117.0703 6200.0 119.0491 31000.0 119.0854 22000.0 121.0284 3400.0 121.057 6600.0 121.0648 480000.0 122.0682 16000.0 122.4887 2500.0 123.071 4700.0 123.0806 7000.0 124.0518 6300.0 125.0597 7400.0 129.0694 3100.0 131.0492 7600.0 131.0852 3900.0 133.0649 50000.0 135.0804 29000.0 137.0601 15000.0 139.0754 21000.0 141.091 2900.0 145.0649 26000.0 147.0609 3600.0 147.0805 190000.0 148.0839 8000.0 149.0602 7900.0 149.0846 4200.0 149.0964 11000.0 150.0676 24000.0 151.0754 150000.0 152.0811 9700.0 157.0644 3900.0 159.0806 20000.0 160.0883 18000.0 161.06 4900.0 161.0963 21000.0 163.0634 7400.0 163.0755 390000.0 164.0808 16000.0 165.0912 220000.0 166.0948 9900.0 167.0952 3700.0 171.0823 3000.0 173.0964 7900.0 173.538 13000.0 176.0832 12000.0 177.0913 31000.0 178.0968 5600.0 179.0895 4500.0 179.1067 20000.0 183.0812 9000.0 185.0959 3500.0 191.1068 89000.0 192.1105 5000.0 195.0798 3900.0 196.0888 11000.0 197.0963 28000.0 207.118 2900.0 210.1045 4300.0 211.1127 5500.0 215.3264 2500.0 221.0965 8300.0 223.1118 2600.0 224.0834 16000.0 225.0911 14000.0 225.1276 57000.0 226.1004 3600.0 227.107 4200.0 229.0328 2600.0 229.1241 5100.0 235.1122 6600.0 238.0989 22000.0 239.1069 6400.0 241.0859 9000.0 242.0923 7000.0 253.1223 45000.0 254.13 47000.0 255.1016 6300.0 255.1307 5700.0 256.1094 110000.0 257.1153 11000.0 257.1525 5100.0 258.1156 6700.0 267.1373 5900.0 268.8536 3000.0 270.1253 86000.0 272.1314 5500.0 285.1489 140000.0 286.1528 3500.0 287.155 17000.0 END IONS BEGIN IONS SCANS=325 PEPMASS=427.1734 CHARGE=1 COLLISION_ENERGY=0.0 57.0697 6600.0 61.8594 2500.0 64.058 2300.0 70.386 2300.0 71.0852 11000.0 71.4235 2400.0 78.8243 2300.0 79.1027 2300.0 85.1011 13000.0 95.3305 2700.0 95.7113 2200.0 101.0598 7500.0 109.1109 2400.0 111.0436 11000.0 127.7613 2900.0 151.7661 2500.0 154.4808 2500.0 173.1705 2600.0 173.5233 7600.0 173.5316 69000.0 173.5425 14000.0 174.5852 2300.0 175.0363 4100.0 176.0442 3700.0 341.3344 2200.0 412.1486 3400.0 415.5769 2900.0 427.1732 410000.0 433.5286 2500.0 437.6942 2900.0 END IONS BEGIN IONS SCANS=326 PEPMASS=201.0913 CHARGE=1 COLLISION_ENERGY=0.0 41.9223 2100.0 42.78 2500.0 43.7122 2200.0 46.451 2700.0 49.014 2000.0 50.0859 2100.0 55.9314 2700.0 55.9342 200000.0 56.9346 73000.0 58.1666 2600.0 60.0441 2300.0 62.2826 2700.0 62.9016 2100.0 65.9291 2300.0 67.9114 2000.0 68.698 2500.0 71.9289 3200.0 72.9368 40000.0 73.9373 8700.0 74.8919 2300.0 85.0179 2100.0 87.1681 2800.0 87.4454 2200.0 89.9397 3100.0 90.9474 50000.0 91.9478 16000.0 92.3038 2300.0 93.8202 2600.0 94.4117 2700.0 96.9369 3500.0 96.9605 2800.0 102.9484 2400.0 107.9501 22000.0 108.0829 2500.0 108.9503 2600.0 108.9586 2600.0 110.4654 2400.0 110.6602 2500.0 113.9633 12000.0 114.9478 25000.0 114.9711 17000.0 115.0542 11000.0 115.7045 2500.0 115.9791 28000.0 118.9426 8200.0 125.9607 2700.0 128.0619 11000.0 128.9504 39000.0 129.0695 20000.0 129.9523 48000.0 130.0776 27000.0 131.9739 100000.0 132.9586 14000.0 135.9451 36000.0 136.9464 11000.0 137.9639 11000.0 140.0619 37000.0 141.0695 19000.0 142.0783 2700.0 149.6838 4000.0 149.6938 3200.0 149.9845 11000.0 152.275 2500.0 155.9743 7900.0 156.0568 15000.0 157.0502 3200.0 157.0646 420000.0 158.0724 240000.0 158.0873 4200.0 171.0426 2700.0 172.0509 3800.0 173.5306 38000.0 185.06 33000.0 186.0678 29000.0 198.0145 2800.0 201.091 230000.0 201.1126 2300.0 201.5223 2700.0 END IONS BEGIN IONS SCANS=327 PEPMASS=369.17 CHARGE=1 COLLISION_ENERGY=0.0 52.4887 2900.0 55.0177 4000.0 55.9581 2700.0 57.657 3000.0 61.381 2400.0 64.2234 2400.0 64.6476 2100.0 65.0392 5100.0 65.1384 2400.0 67.6801 2200.0 69.0698 8500.0 70.065 110000.0 71.0493 6000.0 71.0685 3000.0 71.4613 2100.0 71.7219 2700.0 74.868 2300.0 75.0439 31000.0 79.0539 4000.0 79.4964 2300.0 80.0618 3600.0 85.0164 2600.0 86.0963 48000.0 87.0997 4200.0 87.1325 2500.0 90.0464 8600.0 91.0541 43000.0 91.2405 2100.0 93.0698 3700.0 95.049 67000.0 97.3883 2500.0 103.9659 2100.0 106.0413 2500.0 106.4561 2700.0 107.0491 79000.0 108.0568 44000.0 109.0648 3000.0 110.0712 15000.0 118.0653 6800.0 119.0486 2400.0 120.5707 2600.0 121.0647 75000.0 123.0803 15000.0 124.052 11000.0 128.0618 17000.0 129.0696 7900.0 135.044 43000.0 136.0517 570000.0 136.0638 15000.0 137.0596 36000.0 138.0674 3800.0 139.0647 3200.0 139.0751 78000.0 140.653 2400.0 143.0852 27000.0 144.0566 2400.0 145.0646 25000.0 146.0601 12000.0 146.0727 10000.0 148.0519 2900.0 149.0598 33000.0 150.0675 20000.0 151.0752 4400000.0 151.1034 19000.0 151.1119 4300.0 153.0906 6200.0 156.0573 5100.0 157.0648 45000.0 158.0726 61000.0 159.0807 24000.0 160.088 4600.0 161.0597 25000.0 162.0677 13000.0 163.0754 41000.0 165.0549 51000.0 165.091 140000.0 166.9808 2200.0 167.0704 25000.0 167.2668 2700.0 169.0642 2700.0 170.0716 4100.0 171.0802 59000.0 172.0882 300000.0 172.1097 9500.0 173.0597 67000.0 173.096 11000.0 173.522 28000.0 173.5398 53000.0 174.0677 78000.0 174.3368 2600.0 175.0752 71000.0 177.091 94000.0 179.0702 77000.0 181.0714 3700.0 181.0853 3100.0 182.0726 7200.0 183.0805 16000.0 185.059 4300.0 186.0675 27000.0 187.0753 33000.0 188.0831 800000.0 189.0909 290000.0 189.1106 3400.0 190.0983 3200.0 191.0701 52000.0 191.1063 27000.0 193.0857 37000.0 193.1085 2900.0 198.0668 8500.0 199.0752 13000.0 200.0835 27000.0 201.0692 13000.0 201.0909 1400000.0 201.113 9800.0 202.0986 10000.0 203.0892 3200.0 203.1066 920000.0 203.138 3600.0 205.0857 28000.0 207.3678 2600.0 213.0737 2300.0 213.0911 220000.0 215.1066 94000.0 216.078 38000.0 217.0869 3900.0 221.0974 5700.0 223.485 2300.0 224.0834 17000.0 225.0907 11000.0 227.1059 3700.0 231.1015 810000.0 231.1401 3700.0 233.0959 29000.0 234.1048 3600.0 238.0985 3100.0 240.0778 8900.0 241.0857 3400.0 245.0958 45000.0 246.1028 20000.0 247.076 3400.0 247.1109 12000.0 248.6856 2800.0 249.0904 31000.0 249.1293 2500.0 251.1044 3100.0 253.0859 34000.0 254.0946 6100.0 255.1014 200000.0 257.0953 3100.0 258.1043 11000.0 259.1114 25000.0 260.0855 2900.0 260.1179 6700.0 261.0907 120000.0 262.0986 77000.0 263.1066 28000.0 264.1134 6600.0 264.7245 2700.0 265.1222 30000.0 267.1004 12000.0 268.0745 3200.0 268.1092 240000.0 269.0808 53000.0 269.1116 3500.0 272.0831 3100.0 273.0909 55000.0 274.0991 24000.0 275.1066 130000.0 276.08 4100.0 276.1143 200000.0 277.0861 67000.0 277.1222 210000.0 278.0935 34000.0 278.1262 8600.0 279.1021 36000.0 281.1169 47000.0 282.1234 3500.0 283.0598 2600.0 283.0966 420000.0 284.0694 3000.0 284.1042 150000.0 286.0409 2400.0 286.1018 2600.0 287.107 34000.0 288.1146 110000.0 289.0859 63000.0 289.1224 420000.0 289.1596 5800.0 290.0939 33000.0 290.1279 8000.0 291.1019 48000.0 291.1337 5800.0 292.1093 95000.0 293.1172 440000.0 294.0895 5000.0 294.1253 67000.0 295.0971 8900.0 295.132 16000.0 296.1045 28000.0 297.1137 7000.0 298.1199 1100000.0 298.1528 3300.0 299.1279 95000.0 303.101 26000.0 304.1095 120000.0 305.0767 9600.0 305.117 950000.0 305.147 2800.0 305.1586 15000.0 306.0885 13000.0 306.1255 36000.0 307.096 13000.0 307.1327 220000.0 308.1032 21000.0 308.1405 460000.0 308.1802 4500.0 309.112 280000.0 309.1515 10000.0 310.12 28000.0 310.1558 3600.0 311.1277 170000.0 311.5631 2900.0 312.1354 12000.0 318.1252 20000.0 319.1327 330000.0 320.0982 5600.0 320.1405 1000000.0 320.1736 2100.0 321.1119 540000.0 321.1547 11000.0 322.12 13000.0 323.1278 92000.0 324.1354 810000.0 325.1433 56000.0 326.1528 4200.0 335.1278 80000.0 336.1352 240000.0 338.1513 72000.0 339.1224 3300.0 339.1585 180000.0 351.1082 3900.0 351.1587 450000.0 366.4273 2800.0 369.1691 31000.0 370.8504 2800.0 END IONS BEGIN IONS SCANS=328 PEPMASS=422.218 CHARGE=1 COLLISION_ENERGY=0.0 55.0178 7300.0 55.0542 5900.0 55.4056 2600.0 60.8776 2700.0 62.4748 2200.0 67.2502 2400.0 67.4929 2200.0 67.4969 2700.0 69.0317 2200.0 69.0401 2300.0 71.5736 2300.0 75.0437 4300.0 75.3804 2400.0 76.7021 2200.0 79.0544 3100.0 80.7699 2600.0 83.0489 39000.0 85.9625 2200.0 87.2294 2200.0 87.4144 2000.0 87.7045 2200.0 91.0542 6000.0 94.6434 2600.0 95.0489 39000.0 104.2933 2300.0 104.394 2300.0 107.0492 10000.0 114.7487 2400.0 115.2988 2600.0 116.3541 2400.0 117.0688 5500.0 121.0646 40000.0 124.0518 11000.0 126.857 2500.0 128.0621 2400.0 129.0699 3500.0 130.6715 2500.0 135.0443 5100.0 136.0411 3400.0 136.0517 160000.0 136.0636 2600.0 137.0595 33000.0 138.0673 15000.0 139.075 100000.0 139.4783 2400.0 143.0853 26000.0 145.0417 2400.0 145.0645 5900.0 146.0724 30000.0 147.0797 9800.0 147.8478 2600.0 149.0595 7100.0 149.6661 2900.0 149.6862 11000.0 151.0751 2000000.0 151.087 2900.0 151.1036 11000.0 155.9653 2300.0 156.0563 2700.0 157.0649 11000.0 158.0721 17000.0 159.0802 8100.0 160.088 7100.0 161.0596 56000.0 162.0675 9700.0 163.0757 17000.0 165.0545 16000.0 165.0908 26000.0 167.0702 88000.0 171.0807 19000.0 172.0881 240000.0 172.114 3200.0 173.0596 28000.0 173.0958 12000.0 173.5279 5500.0 173.5304 32000.0 174.0675 120000.0 175.0752 130000.0 175.1121 2900.0 177.0909 620000.0 179.0705 15000.0 181.0864 5600.0 188.083 420000.0 189.0709 8300.0 189.0908 830000.0 189.1106 2800.0 189.4069 2600.0 191.0705 8500.0 191.1064 77000.0 193.0862 8100.0 193.1216 12000.0 198.3534 2400.0 199.0738 2900.0 200.0831 5000.0 201.0693 5900.0 201.0909 850000.0 202.0989 6700.0 203.1065 1100000.0 203.1236 9100.0 205.0848 3200.0 205.1133 2300.0 213.0909 43000.0 215.106 15000.0 216.0782 17000.0 219.1017 20000.0 221.1171 17000.0 231.1015 280000.0 234.7764 2400.0 243.8389 2500.0 249.1119 3200.0 252.6229 2700.0 268.1098 29000.0 275.1045 4100.0 276.1138 23000.0 277.123 16000.0 283.0958 24000.0 284.1034 18000.0 288.1142 13000.0 288.866 2600.0 289.122 32000.0 292.1084 13000.0 293.117 28000.0 294.1265 3800.0 298.1198 160000.0 299.1274 38000.0 304.1085 14000.0 305.0805 4200.0 305.1171 76000.0 307.1331 47000.0 308.1409 110000.0 309.1121 16000.0 311.1279 65000.0 319.1328 73000.0 320.1406 210000.0 321.1124 35000.0 323.1298 3200.0 324.136 160000.0 325.1435 12000.0 335.1269 3200.0 336.1351 60000.0 338.1505 7900.0 339.1589 220000.0 351.1589 210000.0 369.1719 15000.0 398.4547 2500.0 END IONS BEGIN IONS SCANS=329 PEPMASS=387.1808 CHARGE=1 COLLISION_ENERGY=0.0 54.2725 2200.0 55.0178 29000.0 55.0542 6200.0 55.2505 2300.0 58.282 2200.0 59.302 2200.0 60.879 3300.0 62.2828 2600.0 65.657 2400.0 66.1039 2800.0 66.8358 2200.0 67.0539 2400.0 70.8556 2300.0 71.1097 2500.0 73.2466 2600.0 75.044 17000.0 79.0542 3600.0 83.0492 13000.0 86.0779 2400.0 90.7856 2100.0 91.0542 25000.0 95.0491 8700.0 98.9939 2300.0 107.0491 41000.0 108.0569 26000.0 109.0646 4400.0 111.3214 2800.0 115.0547 9000.0 117.0701 8200.0 117.6163 3000.0 118.6395 2500.0 119.6913 2300.0 121.0647 78000.0 123.0803 6200.0 124.0515 31000.0 128.0625 14000.0 129.0697 21000.0 131.049 8300.0 132.0565 3200.0 135.0439 17000.0 136.0518 400000.0 136.064 3700.0 137.0595 38000.0 138.0673 14000.0 139.0752 130000.0 140.0625 4100.0 141.0693 4300.0 143.0853 26000.0 145.0648 19000.0 146.0725 54000.0 147.081 8100.0 149.0595 21000.0 149.6872 4800.0 149.7076 2700.0 150.0675 6400.0 151.0645 4900.0 151.0752 3100000.0 151.1034 9300.0 153.674 2400.0 156.0569 5000.0 157.0647 90000.0 158.0726 130000.0 159.0437 15000.0 159.0802 21000.0 160.0513 7400.0 160.088 14000.0 161.0597 33000.0 162.0673 14000.0 162.9537 2700.0 163.0753 52000.0 165.0547 67000.0 165.0909 92000.0 167.07 54000.0 171.0807 35000.0 172.0883 280000.0 172.1054 4500.0 173.0598 61000.0 173.0953 7900.0 173.5275 51000.0 173.5385 20000.0 173.5474 3700.0 174.0502 4400.0 174.0676 370000.0 175.0755 89000.0 176.0831 7400.0 177.091 310000.0 179.0702 49000.0 186.0676 31000.0 187.076 9100.0 188.0831 610000.0 189.0711 8300.0 189.091 1700000.0 189.111 5000.0 189.4647 2400.0 191.0704 34000.0 191.1066 79000.0 193.0859 41000.0 199.076 6100.0 200.0832 10000.0 201.047 5600.0 201.091 2600000.0 201.1347 7500.0 202.097 6100.0 203.1067 970000.0 205.0857 18000.0 213.0911 130000.0 215.0858 3400.0 215.1067 62000.0 216.0779 17000.0 218.8784 2600.0 219.1016 12000.0 222.7876 2600.0 224.0832 9600.0 229.2517 3200.0 231.1016 580000.0 231.1269 3800.0 233.0963 8900.0 233.8132 2800.0 245.0962 15000.0 246.1037 2800.0 249.0909 9900.0 250.0978 3200.0 253.0832 3300.0 254.0923 2700.0 255.1014 110000.0 259.1113 9400.0 260.1194 3100.0 261.0906 55000.0 262.0988 35000.0 263.107 7700.0 263.5247 2400.0 265.0885 3200.0 265.1228 12000.0 268.1094 140000.0 269.0806 17000.0 273.092 23000.0 274.099 9400.0 275.1068 68000.0 276.1146 120000.0 277.0871 34000.0 277.1223 110000.0 277.1543 3800.0 278.0938 14000.0 278.1287 9900.0 279.101 9700.0 281.1175 20000.0 283.0966 210000.0 283.132 3100.0 284.1043 100000.0 287.1066 12000.0 288.1144 66000.0 289.087 35000.0 289.1226 210000.0 290.1268 3300.0 291.1006 18000.0 291.1358 4400.0 292.1095 60000.0 293.1171 250000.0 294.1252 40000.0 295.0966 4700.0 295.1317 5000.0 296.1045 9000.0 298.12 710000.0 298.1756 3700.0 299.1279 77000.0 303.1014 10000.0 304.1095 67000.0 305.0767 4300.0 305.117 470000.0 306.0898 2400.0 306.1255 17000.0 307.0936 5500.0 307.1329 140000.0 308.1407 380000.0 308.3329 2700.0 309.1121 140000.0 309.1503 2500.0 310.1215 15000.0 311.1278 200000.0 312.1353 8600.0 318.1252 9600.0 319.1328 200000.0 320.1406 570000.0 321.112 270000.0 321.1544 3500.0 322.1195 8800.0 323.1277 56000.0 324.1355 540000.0 325.1433 36000.0 335.1271 40000.0 336.1355 150000.0 337.1411 3600.0 338.1513 38000.0 339.1587 220000.0 351.1075 3300.0 351.1587 350000.0 351.2089 3800.0 368.4077 2600.0 END IONS BEGIN IONS SCANS=330 PEPMASS=450.2492 CHARGE=1 COLLISION_ENERGY=0.0 56.9954 2400.0 58.569 2400.0 59.8616 3000.0 59.9399 2100.0 60.0862 2400.0 63.9167 2300.0 71.2909 2300.0 73.2656 2600.0 82.5887 2700.0 83.0491 6900.0 89.8796 2400.0 91.7031 2600.0 95.0491 9700.0 100.866 2300.0 106.879 2900.0 121.0645 12000.0 125.1759 2400.0 136.0518 48000.0 137.06 3700.0 139.0751 27000.0 146.0721 3000.0 151.0646 5300.0 151.0753 760000.0 153.5924 2300.0 160.6594 2700.0 161.06 6700.0 165.0543 5300.0 165.0914 9500.0 167.0701 32000.0 172.0885 58000.0 173.5242 11000.0 173.5323 70000.0 173.5434 9000.0 174.0678 38000.0 175.0751 26000.0 177.0911 140000.0 178.0868 7100.0 179.0711 2900.0 188.0834 110000.0 188.7335 2800.0 189.0912 300000.0 189.1107 4700.0 191.1066 15000.0 201.0694 3000.0 201.0914 290000.0 203.0889 2400.0 203.107 360000.0 203.1273 4900.0 211.9285 2600.0 213.0919 12000.0 215.1062 3600.0 216.0775 2600.0 219.103 6000.0 221.1179 5100.0 231.1019 120000.0 239.8538 2500.0 260.1827 2800.0 268.1099 7800.0 276.1146 4300.0 283.0965 6600.0 284.1046 4800.0 289.1215 4700.0 293.1183 3700.0 298.1205 74000.0 299.1287 15000.0 305.1186 17000.0 306.7919 2500.0 307.1333 15000.0 308.1419 34000.0 309.1155 3300.0 311.1281 22000.0 319.1335 20000.0 320.1418 77000.0 321.1135 7300.0 324.1367 49000.0 336.1358 20000.0 338.1495 2500.0 339.1602 77000.0 351.1601 84000.0 369.1665 2500.0 382.1143 2500.0 412.4333 2500.0 436.338 3400.0 END IONS BEGIN IONS SCANS=331 PEPMASS=236.1679 CHARGE=1 COLLISION_ENERGY=0.0 43.1644 2500.0 43.4094 2500.0 43.6706 4300.0 43.9774 2100.0 44.73 2100.0 45.2636 2600.0 45.4377 2600.0 45.7026 2600.0 45.7859 2200.0 46.1938 2100.0 46.3857 2100.0 46.7263 2500.0 46.7958 2400.0 47.6304 2200.0 47.8471 2400.0 47.9953 2300.0 48.1232 2300.0 48.4383 2100.0 48.7522 2300.0 48.9593 2500.0 49.9886 2300.0 50.6017 2200.0 51.3817 2700.0 52.6704 2300.0 52.9529 2000.0 53.0742 2300.0 53.5283 2400.0 53.9055 2300.0 54.1218 2300.0 54.2131 2000.0 54.9509 2200.0 54.9892 2300.0 56.0492 1400000.0 56.1432 2300.0 56.2128 2300.0 56.3378 2400.0 56.5761 2700.0 57.0333 150000.0 57.1004 2000.0 57.4984 2300.0 58.6534 2600.0 58.8569 2200.0 58.9555 2700.0 59.2313 2400.0 59.3372 2200.0 59.6921 2200.0 59.8836 2200.0 61.029 2100.0 61.8858 2600.0 61.9034 2400.0 62.1698 2700.0 62.4223 2500.0 63.0102 2900.0 63.509 2300.0 63.5573 2200.0 63.6311 2100.0 64.4649 2300.0 65.7253 2400.0 66.5248 2600.0 66.8533 2600.0 67.3755 2400.0 67.8137 2800.0 68.7983 2400.0 68.9873 2300.0 69.0491 2600.0 69.571 2200.0 71.2672 2300.0 71.9501 2300.0 71.9998 2400.0 72.2347 2400.0 72.667 2300.0 73.0755 2100.0 73.3492 2200.0 73.927 2700.0 74.0597 61000.0 74.1545 2500.0 74.7435 2400.0 75.0255 3100.0 75.6546 2100.0 77.0414 41000.0 77.6437 2700.0 78.2028 2200.0 78.6642 2100.0 79.1844 2500.0 79.668 2700.0 79.7546 2500.0 81.033 2200.0 81.197 2100.0 81.3737 2400.0 82.0035 2700.0 82.8345 2100.0 83.9338 2100.0 84.3057 2300.0 84.4702 2800.0 86.0597 2800.0 86.2231 2200.0 87.0622 94000.0 87.8494 2200.0 88.1257 2200.0 88.5606 2400.0 89.0045 2100.0 89.1233 2200.0 89.613 2300.0 92.0501 2400.0 92.3005 2400.0 92.3737 2700.0 93.0364 50000.0 95.0155 2400.0 96.1742 2500.0 98.75 2500.0 100.0833 2300.0 100.3017 2400.0 103.0572 2200.0 103.9396 2500.0 104.0702 410000.0 105.0726 720000.0 107.0519 280000.0 108.9142 3200.0 109.0313 34000.0 109.341 2500.0 109.6103 2800.0 110.5277 2300.0 111.6376 5100.0 112.5138 2400.0 115.0934 130000.0 115.6824 2500.0 116.2611 2300.0 117.0722 3400.0 118.5095 2300.0 119.1773 2400.0 121.0678 18000.0 121.9461 2400.0 122.407 2400.0 123.0473 2700.0 124.0951 2500.0 124.4011 2200.0 124.5177 2500.0 125.6031 2300.0 125.754 2300.0 127.0753 2300.0 128.9499 3200.0 129.8266 2700.0 129.8891 2700.0 130.7371 2400.0 131.0699 2400.0 133.1039 450000.0 133.2449 2200.0 133.6056 2400.0 135.0832 250000.0 135.9264 2500.0 136.2713 2500.0 136.9323 2400.0 137.347 2900.0 138.3242 2500.0 142.7601 2100.0 143.0886 11000.0 143.3631 2100.0 144.2471 2500.0 146.1685 2700.0 146.3558 2500.0 147.2009 2500.0 148.9767 41000.0 149.2888 2900.0 149.3839 2400.0 149.6855 4300.0 149.8212 2500.0 151.7059 2600.0 152.3472 2300.0 152.9464 2200.0 157.9789 2400.0 158.8627 2300.0 160.2235 2400.0 166.4773 2300.0 166.8292 2600.0 166.9874 11000.0 167.4987 2300.0 171.7861 2600.0 172.5343 2700.0 173.5259 110000.0 173.5381 190000.0 173.6306 2400.0 174.739 2200.0 176.389 2600.0 177.1539 2300.0 180.5618 2600.0 184.2247 2900.0 186.095 2400.0 187.7124 2200.0 188.3746 2300.0 190.0037 2500.0 190.7835 2400.0 191.5855 2900.0 194.9433 21000.0 201.8977 2500.0 202.6203 2300.0 204.0042 2300.0 208.0158 2400.0 210.6066 2400.0 213.4124 2600.0 214.1142 2100.0 214.1919 2500.0 217.9596 11000.0 224.0444 3500.0 226.155 3000.0 231.9755 2300.0 233.2214 2500.0 233.3086 2400.0 END IONS BEGIN IONS SCANS=332 PEPMASS=455.2183 CHARGE=1 COLLISION_ENERGY=0.0 56.0494 77000.0 59.939 2300.0 62.682 2500.0 63.3425 2300.0 63.8137 2600.0 69.5993 2600.0 73.7249 2400.0 74.4988 2200.0 74.9473 2200.0 75.3149 2600.0 75.5746 2300.0 79.0541 3800.0 81.674 2600.0 82.065 6700.0 83.2632 2300.0 91.0542 31000.0 93.0698 44000.0 95.0489 16000.0 98.0601 13000.0 102.0464 5000.0 102.6551 2200.0 103.0542 32000.0 103.7707 2500.0 105.045 4500.0 107.0492 24000.0 116.7945 2300.0 119.049 12000.0 121.0647 2900000.0 121.0729 20000.0 121.0849 8500.0 121.7253 2700.0 129.7672 2600.0 130.0414 18000.0 131.0489 3500.0 131.0851 7000.0 132.057 5300.0 133.0649 18000.0 135.044 26000.0 142.2152 2600.0 143.1023 2400.0 145.0585 2400.0 147.0441 68000.0 147.0801 15000.0 147.5736 2500.0 148.0516 2700.0 149.0594 11000.0 150.0682 7100.0 159.0803 23000.0 160.0523 11000.0 161.0447 2300.0 161.0595 37000.0 162.0676 210000.0 162.0818 2300.0 162.6276 2400.0 163.039 71000.0 163.0754 35000.0 165.0914 5900.0 165.1663 2800.0 167.07 10000.0 173.5186 4900.0 173.536 100000.0 174.0315 20000.0 174.0912 11000.0 175.0391 51000.0 176.0472 43000.0 176.0891 11000.0 176.1071 2600000.0 176.1249 5400.0 176.1429 7700.0 177.0549 48000.0 178.0626 180000.0 188.047 9300.0 189.0547 150000.0 190.0426 10000.0 190.0624 1500000.0 191.0139 3700.0 191.0339 270000.0 191.0703 120000.0 192.0415 8300.0 193.0653 12000.0 193.086 1200000.0 193.1064 3800.0 200.341 2200.0 205.0508 6900.0 206.0348 5700.0 206.0576 570000.0 206.0777 4400.0 221.0304 60000.0 221.0405 22000.0 221.0809 10000000.0 221.1204 31000.0 221.1319 42000.0 221.1465 11000.0 235.1451 3600.0 236.1275 3000.0 239.6074 2200.0 248.9868 2300.0 260.948 2700.0 261.1121 2600.0 262.7369 2400.0 276.1261 2600.0 290.9231 2600.0 353.2533 2600.0 END IONS BEGIN IONS SCANS=333 PEPMASS=265.1226 CHARGE=1 COLLISION_ENERGY=0.0 45.9905 2200.0 48.1054 2300.0 49.7407 2100.0 49.7497 2300.0 50.2539 2300.0 58.6101 2600.0 59.6169 2300.0 62.4212 2300.0 64.901 2700.0 67.3231 2300.0 68.6055 2300.0 68.7902 2700.0 69.2881 2600.0 69.4766 2200.0 70.8793 2200.0 73.4113 2300.0 77.1229 2300.0 88.9035 2200.0 90.834 2300.0 93.2585 2200.0 96.6292 2200.0 97.2296 2100.0 99.9703 2400.0 104.9388 2200.0 105.2511 2400.0 108.4139 2700.0 114.0498 2100.0 117.8444 2500.0 121.8812 2400.0 129.8827 2200.0 130.92 2700.0 138.0014 2200.0 151.0707 2700.0 152.877 2500.0 164.3467 2400.0 173.5258 50000.0 173.5382 57000.0 178.0774 5200.0 179.0851 43000.0 189.0701 4100.0 190.0777 35000.0 191.0853 64000.0 193.0647 2400.0 194.1098 3100.0 202.0776 13000.0 203.0854 72000.0 204.0934 15000.0 205.0649 8600.0 205.1011 52000.0 206.0726 5800.0 207.0804 91000.0 212.9158 2500.0 215.0858 6500.0 217.0647 27000.0 218.0725 100000.0 219.0804 190000.0 220.0881 8600.0 221.0598 69000.0 221.0962 98000.0 222.0668 7400.0 222.1039 39000.0 226.2679 2300.0 227.2912 2500.0 229.4215 2400.0 232.0889 3600.0 233.0961 70000.0 234.1039 480000.0 234.129 5700.0 235.0481 10000.0 235.0754 660000.0 235.1025 10000.0 236.0827 58000.0 236.1798 2500.0 237.3697 2300.0 239.535 2300.0 249.0913 54000.0 250.0988 390000.0 250.1285 8400.0 261.3658 2600.0 265.0146 2700.0 265.1222 140000.0 265.2324 2600.0 END IONS BEGIN IONS SCANS=334 PEPMASS=282.1494 CHARGE=1 COLLISION_ENERGY=0.0 46.3843 2300.0 47.6509 2100.0 48.2831 2500.0 49.1566 2600.0 49.2149 2400.0 49.2525 2300.0 49.7564 2600.0 50.4411 2500.0 51.0905 2200.0 51.211 2500.0 51.3321 2300.0 51.4877 2300.0 54.5965 2400.0 54.9411 2300.0 55.6961 2100.0 56.5533 2400.0 57.0699 6600.0 57.4012 2200.0 58.4241 2300.0 62.5228 3800.0 62.526 3100.0 66.2796 5300.0 66.838 2600.0 68.5619 2000.0 69.0696 6300.0 74.441 2600.0 75.044 7700.0 75.8798 2500.0 76.4002 2400.0 76.8567 2500.0 80.8667 2400.0 81.3843 2600.0 83.0854 6100.0 83.2365 2000.0 86.4726 2300.0 86.5046 2300.0 89.4716 2600.0 91.8584 2300.0 92.3032 2300.0 96.8017 2400.0 97.1009 3000.0 97.3805 2700.0 103.752 2400.0 106.8051 2300.0 107.1266 2400.0 107.9347 2200.0 118.4563 2800.0 118.5407 3000.0 123.0097 2200.0 123.6411 2500.0 124.4149 2400.0 128.0619 3100.0 128.4394 2500.0 130.7869 2700.0 133.0967 2500.0 134.0962 130000.0 136.0322 2200.0 137.2152 2500.0 146.339 2600.0 148.8792 3100.0 165.0705 5900.0 171.216 2600.0 173.5226 35000.0 173.5371 130000.0 173.5448 4800.0 178.0788 39000.0 179.0854 89000.0 179.3588 2400.0 184.0918 2400.0 187.1943 2400.0 188.2539 2500.0 189.0707 45000.0 190.0776 140000.0 191.0855 160000.0 191.104 2300.0 192.0934 13000.0 192.3711 2700.0 193.0648 12000.0 193.1014 8800.0 194.072 2500.0 194.1088 3900.0 197.0141 2700.0 202.0779 79000.0 203.0855 250000.0 204.0932 68000.0 204.4242 2500.0 205.0651 51000.0 205.1012 360000.0 206.0727 140000.0 206.109 7600.0 207.06 4300.0 207.0805 250000.0 208.088 22000.0 210.1276 6100.0 211.135 38000.0 213.2336 2700.0 215.0858 27000.0 217.065 70000.0 218.0727 530000.0 219.0805 550000.0 220.0884 83000.0 221.0598 280000.0 221.0962 450000.0 222.0674 93000.0 222.104 200000.0 231.0806 14000.0 231.3803 2500.0 232.0884 69000.0 233.0686 6300.0 233.0962 670000.0 233.1233 7400.0 234.0487 5500.0 234.1038 4900000.0 234.1316 3500.0 234.159 7200.0 235.0353 2800.0 235.0479 16000.0 235.0752 3300000.0 235.11 130000.0 235.1328 3000.0 236.0831 950000.0 237.0908 140000.0 237.4168 2500.0 238.8124 2600.0 243.0908 3600.0 245.1411 2900.0 247.9914 2500.0 249.0909 220000.0 250.0369 6200.0 250.068 17000.0 250.0988 6800000.0 250.1591 22000.0 254.7762 2400.0 260.0371 2400.0 263.9795 2500.0 265.0559 18000.0 265.1221 6000000.0 265.1902 2900.0 268.3228 2500.0 268.8039 2500.0 272.5194 2400.0 279.1075 2500.0 281.8549 2400.0 282.2218 330000.0 292.3907 2600.0 END IONS BEGIN IONS SCANS=335 PEPMASS=532.2033 CHARGE=1 COLLISION_ENERGY=0.0 61.0281 2600.0 62.7556 2200.0 69.0332 88000.0 71.0489 14000.0 73.0281 35000.0 76.9292 2300.0 80.4632 2800.0 81.0331 180000.0 83.049 11000.0 85.0281 450000.0 87.0022 2800.0 87.0073 120000.0 91.5745 2200.0 93.8297 2600.0 97.0279 310000.0 99.0437 150000.0 103.0386 89000.0 104.2056 2300.0 105.0098 3200.0 105.0179 250000.0 105.0696 46000.0 109.0281 800000.0 109.0354 5600.0 121.8897 2300.0 122.9816 2500.0 125.1565 2400.0 127.0386 1000000.0 127.0475 17000.0 127.3729 2500.0 128.8108 2700.0 129.018 51000.0 145.0492 170000.0 147.0286 61000.0 159.0286 190000.0 163.0602 12000.0 168.0531 2500.0 169.0493 26000.0 173.5216 8400.0 173.5357 18000.0 173.5425 8200.0 176.3115 2200.0 177.0392 4300.0 180.1788 2200.0 183.029 2300.0 183.7771 2600.0 187.0603 34000.0 195.2111 2400.0 213.0396 74000.0 227.1435 2500.0 231.0502 160000.0 231.1005 2600.0 233.4278 2600.0 248.8988 2400.0 249.0611 3200.0 255.0506 4200.0 271.0822 3000.0 273.0602 26000.0 288.3718 2600.0 291.0713 23000.0 305.0522 2200.0 339.073 5600.0 351.6642 2300.0 357.0824 22000.0 375.0911 6900.0 508.2067 2400.0 530.8592 2800.0 END IONS BEGIN IONS SCANS=336 PEPMASS=344.1497 CHARGE=1 COLLISION_ENERGY=0.0 51.7647 6600.0 52.4071 2200.0 54.9874 2300.0 55.6592 2200.0 57.089 2600.0 70.2925 2900.0 72.556 2300.0 77.0386 5200.0 82.1906 2200.0 83.9707 2400.0 91.0541 210000.0 93.0165 2300.0 93.0698 150000.0 95.0491 30000.0 100.7096 2600.0 101.9001 2300.0 103.0541 75000.0 103.4007 2300.0 105.0447 5900.0 109.9799 2200.0 119.0492 720000.0 119.0591 4500.0 120.0568 5000.0 121.0647 1700000.0 121.0728 8100.0 125.2814 2200.0 131.0491 9000.0 132.8004 2300.0 135.0449 3300.0 145.0285 6100.0 146.9754 2600.0 147.0333 7100.0 147.044 1100000.0 157.0397 79000.0 160.2927 2700.0 164.0471 9500.0 166.0627 19000.0 173.5341 44000.0 175.0042 5600.0 175.0252 16000.0 175.0391 3400000.0 175.0739 8700.0 176.0461 3100.0 177.0549 7900.0 179.0704 41000.0 179.0865 3300.0 181.0858 9600.0 192.0418 67000.0 197.0047 2200.0 202.963 2400.0 205.5237 2400.0 207.0478 9700.0 207.0653 2300000.0 207.1089 3800.0 226.595 3100.0 250.1066 4000.0 END IONS BEGIN IONS SCANS=337 PEPMASS=314.1392 CHARGE=1 COLLISION_ENERGY=0.0 49.4027 2200.0 49.9349 2300.0 51.023 2600.0 51.4363 2500.0 53.0385 15000.0 53.1692 2300.0 53.5433 2400.0 53.7884 2400.0 54.414 2200.0 55.0177 12000.0 56.0715 2300.0 58.0648 37000.0 58.8106 2500.0 59.225 2300.0 60.2706 2100.0 61.8502 2900.0 62.1213 2500.0 62.6362 2500.0 63.0234 19000.0 65.7431 2400.0 66.2989 2400.0 69.3803 2300.0 77.0385 52000.0 79.0536 4300.0 82.23 2200.0 84.0495 2400.0 89.0384 150000.0 91.0539 400000.0 93.0696 950000.0 93.0763 3500.0 95.0488 180000.0 95.6511 2400.0 103.0539 430000.0 105.0444 57000.0 106.0413 3200.0 107.0489 21000.0 117.0332 900000.0 117.0418 2200.0 117.043 8500.0 119.0489 59000.0 121.0645 9800000.0 121.0739 220000.0 121.085 99000.0 121.0863 32000.0 121.0907 4400.0 123.4548 2500.0 125.3912 2400.0 131.0477 2600.0 133.9725 2800.0 134.0359 28000.0 135.0439 73000.0 136.0518 49000.0 137.0599 5400.0 140.659 3100.0 144.0442 7100.0 144.9088 2800.0 145.0282 9300000.0 145.0389 140000.0 145.056 75000.0 147.044 110000.0 149.046 3400.0 149.0595 400000.0 149.0703 5100.0 151.0754 65000.0 153.7067 2200.0 162.0308 32000.0 163.039 120000.0 163.1255 2400.0 164.0708 9800.0 173.5252 27000.0 173.5371 56000.0 173.5471 2400.0 176.0705 17000.0 177.018 37000.0 177.0264 28000.0 177.0547 12000000.0 177.0836 18000.0 177.0911 84000.0 177.1009 5900.0 177.111 4300.0 183.0815 3000.0 186.0552 100000.0 191.6388 2900.0 194.0814 170000.0 203.7983 2500.0 204.0657 3000.0 220.0972 57000.0 238.5526 2500.0 258.2895 2900.0 314.1394 37000.0 314.1756 6300.0 END IONS BEGIN IONS SCANS=338 PEPMASS=801.346 CHARGE=1 COLLISION_ENERGY=0.0 74.0599 220000.0 74.3103 2500.0 74.5976 2400.0 74.7771 2200.0 75.7207 2500.0 76.3874 2300.0 76.7317 2400.0 78.461 2200.0 79.3411 2600.0 79.4907 2700.0 82.597 2300.0 84.0443 250000.0 85.1183 2200.0 89.4489 2500.0 89.8022 2400.0 91.0542 220000.0 93.269 2500.0 95.0165 2300.0 95.049 5900.0 97.0758 110000.0 98.0599 270000.0 98.4421 2400.0 100.9202 2400.0 101.3614 2400.0 102.0548 170000.0 102.3379 2200.0 103.0541 61000.0 107.6725 2800.0 108.6544 2400.0 109.0758 13000.0 112.3003 2500.0 114.6352 2200.0 115.0864 120000.0 117.0574 8900.0 118.0554 7100.0 118.065 690000.0 118.5594 2400.0 119.0493 22000.0 119.0729 4800.0 120.0708 4200.0 120.0806 3300000.0 120.0896 28000.0 120.7834 2400.0 120.9261 2400.0 122.6108 2500.0 123.0438 24000.0 124.087 9800.0 125.0708 490000.0 126.0547 130000.0 130.0498 40000.0 130.0651 2800.0 131.0491 22000.0 132.0808 3100.0 136.0642 14000.0 136.0755 980000.0 136.0876 5600.0 137.0708 190000.0 137.7579 2500.0 137.7706 2400.0 138.0499 2500.0 139.0864 24000.0 140.0704 150000.0 146.0329 3500.0 146.0598 6400000.0 146.0709 52000.0 146.0869 3100.0 146.9659 2700.0 147.0437 13000.0 148.0755 23000.0 150.9807 2500.0 152.0816 160000.0 155.0814 3100.0 158.081 57000.0 158.6437 2600.0 162.0911 6300.0 163.0867 3300.0 163.5177 2600.0 164.0705 150000.0 165.0546 530000.0 165.0699 3400.0 167.0815 42000.0 168.0652 2800.0 168.7979 2500.0 169.0974 2400.0 172.1122 120000.0 173.5215 6000.0 173.5256 110000.0 173.5389 140000.0 174.0551 120000.0 175.1891 2400.0 176.107 32000.0 176.6319 2700.0 182.0812 2100000.0 182.5566 2200.0 182.9357 2200.0 184.0749 18000.0 185.0921 240000.0 185.9821 2900.0 186.0729 2700.0 186.0916 46000.0 187.1231 49000.0 189.1395 2700.0 190.0859 3400.0 192.0656 2400.0 193.0615 15000.0 195.0763 120000.0 197.0122 2700.0 197.0561 3600.0 197.1056 3200.0 198.091 6900.0 199.123 97000.0 200.1061 3300.0 201.1385 35000.0 202.0868 14000.0 202.1247 2400.0 203.1028 160000.0 204.102 100000.0 208.1129 23000.0 211.0508 4200.0 211.0714 380000.0 212.0705 12000.0 213.0871 270000.0 214.134 2800.0 215.0817 43000.0 215.118 200000.0 216.1259 110000.0 217.1094 8900.0 217.1336 3200000.0 217.1585 27000.0 217.3048 2400.0 217.9077 2300.0 219.1129 23000.0 220.096 3300.0 220.1146 3400.0 221.0553 2300.0 222.1283 2400.0 223.0762 6500.0 223.6275 2700.0 225.1025 77000.0 227.1181 130000.0 228.101 3900.0 228.1259 23000.0 229.0979 55000.0 230.0812 50000.0 231.0977 200000.0 236.107 150000.0 236.1311 5000.0 236.4693 2500.0 237.1236 79000.0 238.082 31000.0 239.0663 96000.0 242.1282 13000.0 243.1127 1100000.0 243.1381 44000.0 244.1436 8900.0 245.1283 470000.0 247.1076 420000.0 248.0904 38000.0 248.5899 2500.0 249.0859 13000.0 249.1186 2500.0 253.0972 6200.0 254.1285 10000.0 256.0932 4500.0 257.0763 84000.0 257.0951 25000.0 257.6672 2500.0 259.1093 3000.0 265.0855 110000.0 265.1184 160000.0 267.1123 9800.0 270.1121 100000.0 272.0811 2800.0 273.1235 33000.0 275.0527 3700.0 275.0685 4700.0 275.1027 1800000.0 275.1382 6300.0 275.7393 2500.0 277.1215 2600.0 282.1128 320000.0 283.1291 730000.0 284.1395 36000.0 285.0883 32000.0 285.1231 3200.0 291.1345 80000.0 293.114 48000.0 297.7827 2400.0 299.1402 13000.0 300.1346 53000.0 301.1558 31000.0 302.1502 3800.0 303.098 280000.0 303.1302 3600.0 305.1651 18000.0 313.12 4400.0 319.1297 48000.0 321.1232 41000.0 330.1453 100000.0 331.1282 13000.0 332.1207 3100.0 332.1637 2500.0 333.1089 17000.0 337.1502 2900.0 339.9026 2900.0 340.1287 16000.0 341.9665 2600.0 344.1182 3800.0 344.1728 120000.0 345.157 2800.0 345.5655 2700.0 346.1914 510000.0 346.2391 4400.0 348.1554 65000.0 349.1421 5200.0 351.7133 2700.0 352.5437 2600.0 355.1271 2900.0 358.0956 2800.0 358.1394 130000.0 364.2015 46000.0 365.1507 11000.0 371.1603 140000.0 371.2063 3200.0 372.1663 500000.0 373.1564 2700.0 374.1339 35000.0 375.834 2600.0 376.1503 350000.0 377.9148 2600.0 383.1608 79000.0 386.1351 69000.0 390.123 3200.0 390.1814 1000000.0 392.1472 8200.0 393.7055 2900.0 394.1617 110000.0 396.1945 10000.0 402.1297 12000.0 402.1387 2800.0 404.1461 100000.0 412.1711 18000.0 420.142 18000.0 422.1621 16000.0 424.1882 3000.0 438.1482 6600.0 438.1598 5000.0 455.1943 3700.0 456.1772 9800.0 473.208 45000.0 490.921 2800.0 491.2288 9900.0 500.2017 29000.0 502.5123 2600.0 519.2228 74000.0 521.202 21000.0 524.2579 2700.0 525.2387 6100.0 539.2133 56000.0 541.4777 2700.0 549.2004 13000.0 557.227 38000.0 559.3414 2700.0 564.6324 2400.0 567.2077 58000.0 568.3361 2300.0 571.2538 36000.0 572.8826 2700.0 585.2181 54000.0 585.2338 3300.0 586.0209 2700.0 586.2251 2600.0 587.9152 2800.0 592.8614 3200.0 608.2719 6000.0 626.2758 2600.0 636.2652 35000.0 647.2521 3100.0 647.8156 2900.0 654.2756 80000.0 672.2886 2600.0 700.7612 3000.0 783.3318 45000.0 END IONS BEGIN IONS SCANS=339 PEPMASS=344.1497 CHARGE=1 COLLISION_ENERGY=0.0 51.8632 2000.0 56.2421 2400.0 56.7859 2500.0 59.7495 2500.0 60.2508 2200.0 63.0235 8000.0 66.2427 2200.0 66.6907 2100.0 73.1231 2200.0 75.3669 2200.0 89.0386 85000.0 91.0484 4600.0 91.054 180000.0 93.1358 2200.0 94.0917 2400.0 95.049 55000.0 96.4517 2700.0 117.024 15000.0 117.0334 420000.0 117.0418 2100.0 117.0436 3100.0 119.049 210000.0 121.0646 6400.0 123.0795 2700.0 132.75 2600.0 134.0363 20000.0 135.044 32000.0 136.0518 23000.0 137.0597 20000.0 145.0009 8100.0 145.0074 8800.0 145.0142 6400.0 145.0283 5000000.0 145.0395 24000.0 145.0552 27000.0 145.0634 7400.0 147.0439 4800.0 149.0462 2500.0 149.0596 200000.0 151.0602 2700.0 151.0645 2800.0 151.0752 870000.0 151.087 4700.0 151.3109 2600.0 154.977 2400.0 162.0307 3800.0 163.0389 36000.0 173.5286 52000.0 173.545 14000.0 177.0072 5500.0 177.0182 14000.0 177.0267 12000.0 177.0412 31000.0 177.0546 7400000.0 177.069 47000.0 177.0911 52000.0 177.1014 14000.0 186.055 61000.0 188.5959 2600.0 194.0822 5300.0 195.0635 2300.0 213.7522 3000.0 220.0977 3000.0 END IONS BEGIN IONS SCANS=340 PEPMASS=362.179 CHARGE=1 COLLISION_ENERGY=0.0 70.065 1200000.0 70.0693 9300.0 70.0715 6000.0 70.6026 2500.0 71.0683 19000.0 74.6259 2400.0 75.7002 2300.0 76.2106 2100.0 81.3489 2700.0 82.7349 2600.0 86.0904 3100.0 86.0961 180000.0 91.0542 12000.0 93.0842 2600.0 95.0493 2800.0 95.9034 2900.0 97.0757 18000.0 115.0537 2600.0 115.0863 30000.0 118.0649 35000.0 119.0491 12000.0 119.0728 7300.0 120.0804 58000.0 123.0439 17000.0 125.0707 43000.0 129.1025 6700.0 130.065 650000.0 131.049 15000.0 131.0687 20000.0 131.1172 6800.0 132.0806 81000.0 133.757 2400.0 135.0566 4200.0 135.0677 140000.0 136.0754 94000.0 137.3301 2500.0 138.8796 2300.0 141.1015 2200.0 142.065 19000.0 144.0805 39000.0 145.8874 2100.0 146.0599 220000.0 146.0703 2200.0 146.1504 2200.0 147.0437 12000.0 148.0754 26000.0 157.0975 3600.0 158.061 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BEGIN IONS SCANS=341 PEPMASS=723.3506 CHARGE=1 COLLISION_ENERGY=0.0 70.0651 1600000.0 70.0687 10000.0 70.0741 4000.0 82.0653 3000.0 83.5653 2600.0 85.0395 2900.0 86.0904 5500.0 86.0963 420000.0 86.1011 2000.0 86.1037 7300.0 87.3997 2200.0 88.4491 2700.0 90.5328 2400.0 91.0542 20000.0 97.0759 100000.0 106.065 2800.0 109.0758 24000.0 113.1069 15000.0 115.0865 78000.0 117.0575 2800.0 118.065 41000.0 119.0488 8900.0 120.0807 79000.0 123.044 4800.0 125.0608 5100.0 125.0708 290000.0 130.0483 3100.0 130.0651 310000.0 130.0763 13000.0 131.0489 16000.0 132.0807 120000.0 136.0647 5300.0 136.0756 210000.0 137.0705 9500.0 141.0869 7800.0 141.1021 330000.0 144.0806 130000.0 146.0599 550000.0 146.0742 6500.0 147.044 3800.0 148.0755 48000.0 155.0811 5400.0 158.0603 6400.0 158.0837 16000.0 159.0916 1500000.0 159.1031 7200.0 160.076 3700.0 161.6826 2800.0 162.0548 9200.0 163.0867 7100.0 164.0703 7200.0 165.0546 130000.0 169.0761 31000.0 170.0601 82000.0 170.0964 6100.0 171.0909 3300.0 172.1121 170000.0 173.523 5800.0 173.5378 32000.0 174.055 65000.0 174.1278 76000.0 181.0972 12000.0 182.0812 240000.0 185.071 37000.0 186.1283 3900.0 187.0866 120000.0 187.1226 19000.0 188.0712 11000.0 188.1432 21000.0 188.5212 2800.0 191.0808 7500.0 197.0711 16000.0 197.1077 4400.0 198.0914 33000.0 199.1227 16000.0 200.1433 18000.0 203.154 20000.0 204.1381 25000.0 208.0604 14000.0 211.1213 3400.0 214.1223 4200.0 215.1178 77000.0 216.1258 120000.0 216.1463 4500.0 217.1335 290000.0 220.1123 50000.0 227.1543 42000.0 231.1493 170000.0 232.1117 13000.0 232.1338 3400.0 236.1072 20000.0 237.0876 4300.0 237.1388 26000.0 238.1213 3200.0 239.1543 12000.0 241.133 19000.0 243.1126 1000000.0 243.153 17000.0 247.1227 130000.0 250.1518 2800.0 253.1344 3200.0 254.1655 19000.0 255.1489 18000.0 259.1132 6100.0 259.1438 370000.0 260.1401 4400.0 265.0865 4300.0 269.1283 17000.0 270.1123 65000.0 272.1756 180000.0 280.1443 13000.0 281.1287 21000.0 282.1128 50000.0 282.1599 40000.0 287.1389 57000.0 298.0988 3300.0 298.155 620000.0 299.1397 20000.0 300.1708 89000.0 300.2063 11000.0 305.1298 3300.0 308.1381 2700.0 309.1222 8900.0 310.1549 20000.0 310.1906 3100.0 322.1531 3300.0 323.1398 37000.0 326.1496 110000.0 327.1363 3400.0 328.2015 40000.0 332.1403 5900.0 337.1148 3000.0 339.4539 2500.0 351.1334 550000.0 356.1965 100000.0 360.2064 71000.0 368.1598 61000.0 378.1452 16000.0 378.5025 2600.0 388.201 14000.0 396.1916 44000.0 400.2017 17000.0 401.2372 3300.0 408.37 2700.0 417.2244 4200.0 419.1946 8000.0 424.186 24000.0 428.1955 12000.0 429.5744 2700.0 439.166 11000.0 445.2219 16000.0 451.1667 12000.0 463.2322 21000.0 468.1955 31000.0 473.2195 14000.0 480.1894 2600.0 491.2267 11000.0 507.2244 2900.0 541.2057 34000.0 582.2696 16000.0 654.2899 10000.0 END IONS BEGIN IONS SCANS=342 PEPMASS=419.201 CHARGE=1 COLLISION_ENERGY=0.0 81.07 2700.0 85.1008 10000.0 85.7487 2800.0 86.0911 3900.0 86.0961 140000.0 87.055 130000.0 91.054 7900.0 99.0074 12000.0 103.0537 3100.0 107.049 5400.0 107.3786 2600.0 108.8945 2400.0 115.054 2200.0 115.0862 11000.0 118.0647 38000.0 118.9132 2600.0 119.049 13000.0 119.0728 6500.0 120.0805 42000.0 123.0437 17000.0 123.7689 2500.0 125.0707 59000.0 125.5091 2300.0 128.612 2700.0 130.0649 530000.0 130.0758 13000.0 131.0685 20000.0 131.1177 3100.0 132.0805 78000.0 135.0677 120000.0 135.1164 11000.0 136.0755 120000.0 136.6065 2900.0 138.9358 2900.0 141.1018 30000.0 142.0648 8000.0 143.0727 3200.0 144.0807 39000.0 146.0598 230000.0 147.0443 11000.0 147.0631 8700.0 148.0759 9300.0 149.0232 51000.0 152.5501 2600.0 156.0447 7100.0 157.0971 11000.0 158.0837 62000.0 159.0916 580000.0 160.0762 7000.0 160.0947 20000.0 162.0554 2700.0 165.0546 84000.0 167.0812 5600.0 169.0759 43000.0 170.06 170000.0 171.0648 5000.0 172.1117 3000.0 173.5225 10000.0 173.5333 39000.0 173.5414 20000.0 174.055 15000.0 174.2761 2300.0 181.0994 2600.0 182.0813 68000.0 184.1083 24000.0 185.0713 22000.0 187.0867 84000.0 188.0699 5900.0 188.144 6000.0 195.0765 140000.0 195.7641 2400.0 196.0789 2700.0 200.0703 4100.0 210.1129 3100.0 212.1028 17000.0 216.1251 3500.0 217.1339 59000.0 225.1017 3400.0 227.1183 38000.0 231.1499 54000.0 234.0875 27000.0 236.1082 12000.0 241.0988 3300.0 243.1131 95000.0 244.1165 4300.0 248.1067 16000.0 251.1142 23000.0 252.1136 9300.0 253.0976 24000.0 253.133 6300.0 254.1296 6500.0 255.1128 32000.0 259.1445 63000.0 260.1063 4500.0 260.1488 2400.0 262.636 10000.0 270.112 19000.0 272.1392 8400.0 272.1766 21000.0 272.635 3000.0 276.1426 5300.0 277.1319 3000.0 277.4025 2700.0 279.1125 2700.0 280.1089 23000.0 280.1421 3100.0 281.0931 130000.0 282.1138 17000.0 287.1389 2500.0 292.0983 13000.0 296.1402 8700.0 297.1242 34000.0 297.6402 4700.0 298.1196 32000.0 298.156 91000.0 299.1386 7800.0 300.1717 15000.0 309.1219 3300.0 311.4349 2800.0 313.1669 2800.0 322.12 35000.0 323.103 33000.0 323.14 110000.0 324.1419 5900.0 326.15 10000.0 339.1462 75000.0 340.1301 77000.0 348.1839 3700.0 351.1352 32000.0 356.1985 7300.0 357.1567 76000.0 366.1833 3200.0 388.1671 2500.0 396.1937 3000.0 405.9441 2600.0 408.1949 3000.0 424.9548 2600.0 440.2258 3500.0 514.342 2600.0 521.1957 2300.0 524.2685 3200.0 593.9263 2700.0 701.7225 2800.0 750.0775 2600.0 789.0916 2600.0 END IONS BEGIN IONS SCANS=343 PEPMASS=837.3937 CHARGE=1 COLLISION_ENERGY=0.0 81.7676 2500.0 85.4557 2400.0 86.0963 250000.0 87.0553 20000.0 88.0033 2500.0 91.0543 41000.0 97.0763 5800.0 98.5048 2400.0 107.2653 2300.0 113.1072 8000.0 115.0864 16000.0 116.9983 2400.0 118.065 190000.0 120.0806 120000.0 123.0439 5700.0 123.4197 2300.0 125.0708 95000.0 126.9326 2300.0 127.2324 2500.0 130.065 220000.0 130.0762 3500.0 131.0495 4100.0 131.7617 2300.0 132.0807 77000.0 136.0755 180000.0 137.0708 29000.0 141.0896 6600.0 141.1021 280000.0 141.868 2600.0 142.9967 2500.0 144.0806 64000.0 146.0329 3100.0 146.0598 2000000.0 146.0705 2300.0 146.3199 2400.0 147.0442 2300.0 148.1894 2300.0 149.0713 2900.0 152.0831 2600.0 153.0656 10000.0 154.0969 6600.0 158.0603 3100.0 158.0843 7100.0 159.0915 520000.0 159.1033 3200.0 160.0756 2200.0 163.0868 9600.0 165.0546 110000.0 165.0906 6800.0 167.0671 2400.0 167.0814 33000.0 169.0762 25000.0 170.06 48000.0 173.5115 2500.0 173.5171 3200.0 173.5258 25000.0 173.5394 39000.0 174.1277 19000.0 177.0658 15000.0 182.0812 210000.0 184.108 200000.0 185.0713 28000.0 186.1281 3500.0 187.0866 98000.0 188.1433 42000.0 192.0769 16000.0 193.084 13000.0 194.0921 16000.0 195.0763 290000.0 197.0703 4000.0 200.0707 2600.0 200.1443 3800.0 203.1538 4700.0 206.0927 13000.0 212.103 87000.0 214.1235 3500.0 215.0767 2300.0 215.1186 2700.0 216.0752 2300.0 216.1247 3300.0 217.1335 110000.0 220.1122 18000.0 225.1028 13000.0 227.1179 28000.0 227.1545 23000.0 231.1492 350000.0 231.1759 3300.0 232.1125 6400.0 234.0873 440000.0 234.1085 2600.0 236.1077 8800.0 237.1384 24000.0 238.1486 2400.0 239.0839 2500.0 239.1536 7300.0 243.1127 170000.0 247.1226 52000.0 251.1136 420000.0 252.1126 70000.0 253.097 2700.0 254.1284 120000.0 254.1615 11000.0 255.1124 11000.0 255.1475 7100.0 259.1437 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411.2001 4100.0 411.2063 8800.0 419.1978 3700.0 424.2342 42000.0 425.218 31000.0 428.1941 3600.0 435.2023 15000.0 445.2212 4200.0 451.1662 12000.0 452.2276 42000.0 453.2129 33000.0 463.2346 17000.0 468.1923 16000.0 470.2392 8000.0 475.2009 2700.0 477.2123 3600.0 503.1898 9700.0 521.2031 47000.0 538.2284 17000.0 617.1343 3000.0 636.2852 4100.0 639.2844 2900.0 639.2972 4400.0 654.2805 2900.0 695.3405 2700.0 707.2795 19000.0 802.3569 3300.0 803.3373 2700.0 END IONS BEGIN IONS SCANS=344 PEPMASS=501.26 CHARGE=1 COLLISION_ENERGY=0.0 64.0834 2100.0 69.9028 2300.0 75.8037 2200.0 91.0544 5900.0 92.3771 2800.0 93.0701 4800.0 93.1228 2400.0 93.6564 2600.0 98.0602 2400.0 99.0441 5800.0 107.0986 2500.0 117.0545 14000.0 121.0647 460000.0 123.5608 2300.0 126.0911 4700.0 144.1025 4500.0 145.086 43000.0 147.0446 7000.0 150.0689 2800.0 150.0918 11000.0 160.0526 2800.0 162.0676 33000.0 163.0396 7600.0 163.0757 5600.0 164.1072 9700.0 173.5345 52000.0 175.0393 6200.0 176.0934 7500.0 176.1072 1100000.0 176.143 6300.0 177.0558 2700.0 178.0628 30000.0 178.0927 2900.0 187.1077 15000.0 189.0549 20000.0 190.0625 250000.0 190.0811 4200.0 191.034 35000.0 191.0705 23000.0 193.0651 3900.0 193.0862 220000.0 206.0576 97000.0 217.1329 4500.0 219.1132 20000.0 221.0307 37000.0 221.081 5700000.0 221.1206 14000.0 221.1322 27000.0 236.1284 11000.0 238.1076 22000.0 263.1753 40000.0 264.1595 38000.0 266.3561 3000.0 281.1867 39000.0 290.1401 3700.0 290.3269 2300.0 305.4653 2500.0 307.1654 25000.0 329.6103 2500.0 336.1449 14000.0 350.9579 2300.0 364.1216 4300.0 364.1374 13000.0 364.1757 920000.0 381.2024 21000.0 386.4982 2600.0 444.0071 2700.0 484.2335 30000.0 501.2597 110000.0 END IONS BEGIN IONS SCANS=345 PEPMASS=287.1259 CHARGE=1 COLLISION_ENERGY=0.0 48.2464 2300.0 49.1959 2200.0 49.9667 2400.0 52.0937 2100.0 52.692 2600.0 55.0539 2600.0 62.2561 2200.0 62.5577 2300.0 64.5791 2100.0 68.2457 2300.0 69.0697 6500.0 70.3609 2700.0 79.7791 2100.0 81.0696 14000.0 85.1547 2300.0 86.5262 2700.0 86.9564 2300.0 93.0601 2600.0 95.05 2700.0 95.0853 11000.0 97.3842 2300.0 105.0696 18000.0 107.085 3200.0 119.0854 33000.0 121.1006 5300.0 133.1004 4000.0 133.6786 2400.0 136.8241 2200.0 142.0605 2400.0 145.1008 11000.0 147.1169 2500.0 157.101 4300.0 159.1164 13000.0 173.1319 3500.0 173.5253 25000.0 173.5383 28000.0 193.6845 2300.0 193.7917 2400.0 201.1637 12000.0 286.6232 2400.0 287.126 15000.0 END IONS BEGIN IONS SCANS=346 PEPMASS=247.1331 CHARGE=1 COLLISION_ENERGY=0.0 44.6272 2300.0 46.1934 2700.0 46.8654 2600.0 47.378 2500.0 48.9178 2000.0 49.0937 2400.0 51.1957 2400.0 53.0385 130000.0 53.4515 2300.0 54.1326 2500.0 55.0178 34000.0 55.0542 110000.0 56.2518 2400.0 57.0334 3100.0 57.0698 30000.0 58.6393 2200.0 59.0491 12000.0 63.7787 2100.0 65.0384 110000.0 67.0541 110000.0 68.9969 4800.0 69.0333 480000.0 69.0377 5500.0 69.0698 33000.0 70.3297 2200.0 71.2955 2300.0 74.3108 2400.0 75.0806 2200.0 75.6532 2300.0 77.0385 19000.0 79.0541 170000.0 81.0333 3500.0 81.0697 240000.0 83.0489 470000.0 83.0854 5000.0 85.028 2400.0 85.0647 3500.0 91.0541 280000.0 93.0334 120000.0 93.0428 2500.0 93.0697 340000.0 95.049 150000.0 95.0854 40000.0 97.0283 120000.0 97.0647 25000.0 98.351 2400.0 100.8158 2400.0 103.0541 5800.0 105.0447 16000.0 105.0697 280000.0 105.0781 2700.0 106.0777 2200.0 107.049 35000.0 107.0854 440000.0 108.0569 6600.0 108.0927 2100.0 109.0283 440000.0 109.0647 290000.0 109.1011 52000.0 110.0727 6400.0 111.0439 110000.0 111.0803 35000.0 112.6637 2400.0 113.5002 2300.0 115.0544 37000.0 116.0621 6800.0 117.0697 190000.0 119.049 15000.0 119.0768 4800.0 119.0854 470000.0 119.0941 2100.0 120.0928 2400.0 121.0282 93000.0 121.0552 8300.0 121.0647 480000.0 121.101 190000.0 122.0724 17000.0 122.1644 3000.0 123.0437 7300.0 123.0802 51000.0 125.0236 3000.0 125.0592 11000.0 125.0956 2800.0 128.062 46000.0 129.0698 94000.0 130.0778 30000.0 131.0854 530000.0 131.1436 2400.0 132.0568 43000.0 133.0649 18000.0 133.0903 4500.0 133.1011 310000.0 135.0437 9000.0 135.0685 4700.0 135.0803 730000.0 135.1176 2700.0 136.0891 5500.0 137.0596 58000.0 137.096 79000.0 139.0394 9200.0 141.07 43000.0 142.0776 66000.0 143.0854 200000.0 144.056 3300.0 144.0933 260000.0 145.0646 250000.0 145.0888 4200.0 145.1011 380000.0 146.0725 21000.0 147.0803 92000.0 149.0595 25000.0 149.0829 4900.0 149.096 480000.0 149.1165 3800.0 150.1037 59000.0 151.075 13000.0 151.1117 78000.0 153.0697 36000.0 153.0908 24000.0 154.0777 17000.0 155.0854 130000.0 156.0936 26000.0 157.064 12000.0 157.101 100000.0 157.8274 2600.0 158.0726 52000.0 158.1089 450000.0 158.1238 5000.0 159.0804 300000.0 159.1167 900000.0 160.0882 110000.0 160.7195 2700.0 161.096 96000.0 161.1319 5600.0 163.0753 350000.0 163.1115 50000.0 165.0914 32000.0 166.0784 2600.0 167.0851 7900.0 168.0934 140000.0 169.1013 71000.0 170.109 130000.0 170.6821 2400.0 171.0805 120000.0 171.1169 42000.0 172.0739 9200.0 172.0883 420000.0 173.0601 34000.0 173.0962 720000.0 173.1326 1000000.0 173.1501 5000.0 173.5264 13000.0 173.5342 43000.0 174.0678 3500.0 175.0752 27000.0 175.1118 5600.0 177.0912 16000.0 177.1282 4100.0 178.0779 5700.0 179.7822 2600.0 181.0649 45000.0 181.1026 2900.0 183.1169 220000.0 184.124 2600.0 185.0962 36000.0 185.133 8000.0 186.0845 19000.0 186.1039 810000.0 186.1234 19000.0 187.0747 50000.0 187.1117 2000000.0 188.1199 5200.0 189.0909 38000.0 189.1289 2200.0 191.0509 3000.0 191.0702 570000.0 193.1011 41000.0 195.08 6400.0 196.0882 170000.0 199.0754 45000.0 199.813 2400.0 201.0941 11000.0 201.1064 3600.0 201.1274 570000.0 201.1496 3600.0 203.1417 3600.0 205.1227 32000.0 211.1119 130000.0 214.099 98000.0 219.1386 9200.0 229.1224 150000.0 231.4461 2400.0 247.1328 75000.0 252.5036 2400.0 END IONS BEGIN IONS SCANS=347 PEPMASS=229.1227 CHARGE=1 COLLISION_ENERGY=0.0 43.0177 31000.0 44.0663 2300.0 44.3565 2200.0 44.8417 2100.0 46.7723 3000.0 50.2294 2400.0 51.4071 2600.0 51.779 2500.0 53.0384 43000.0 54.8022 2100.0 55.0542 5600.0 55.9343 22000.0 57.162 2200.0 58.8598 2400.0 59.2016 2200.0 59.406 2200.0 59.5264 2300.0 67.0537 3400.0 67.3477 2600.0 68.3763 2300.0 69.0332 110000.0 71.7085 2400.0 73.5437 2400.0 79.861 2600.0 81.0694 3000.0 83.0489 10000.0 83.1692 2600.0 84.2997 2200.0 90.9478 6100.0 91.054 30000.0 91.7231 2600.0 92.1012 2400.0 93.0696 37000.0 95.5067 2600.0 97.8593 2600.0 103.3496 2800.0 103.6052 2500.0 105.0695 33000.0 105.8606 2700.0 109.028 86000.0 109.0644 3000.0 109.368 2200.0 115.9639 2400.0 116.7131 2300.0 117.0697 7600.0 119.0852 48000.0 121.0645 34000.0 123.4089 2400.0 123.4883 2500.0 128.062 2500.0 129.0696 15000.0 129.3423 2400.0 130.9187 2600.0 131.0853 99000.0 133.1009 65000.0 133.1109 3000.0 141.0697 5300.0 143.0854 55000.0 144.0293 2500.0 144.0931 33000.0 145.0648 7000.0 145.101 72000.0 147.1358 2700.0 154.0781 2600.0 154.1783 2400.0 155.0851 28000.0 157.1008 3200.0 158.1088 130000.0 159.0803 43000.0 159.1165 71000.0 164.9518 3200.0 168.0936 29000.0 169.1001 5500.0 170.1089 35000.0 171.0802 20000.0 172.0883 51000.0 173.096 180000.0 173.1122 3400.0 173.1158 4000.0 173.1325 240000.0 173.5239 7100.0 173.5326 50000.0 173.5416 6100.0 181.0654 3000.0 183.1169 41000.0 185.131 2500.0 186.1038 160000.0 187.1116 280000.0 196.0884 38000.0 199.0767 5200.0 201.092 2900.0 201.1273 90000.0 211.112 23000.0 214.0982 18000.0 214.7946 2800.0 229.1219 31000.0 234.8754 2600.0 END IONS BEGIN IONS SCANS=348 PEPMASS=353.1388 CHARGE=1 COLLISION_ENERGY=0.0 52.2154 2200.0 52.3228 2100.0 52.7565 2500.0 56.145 2100.0 56.8318 2100.0 56.9681 2500.0 57.7743 2300.0 58.5089 2600.0 61.0286 2300.0 61.2034 2300.0 61.9453 2900.0 64.3054 2400.0 66.1501 2300.0 67.2121 2300.0 67.7341 3000.0 71.6192 2300.0 79.0543 2700.0 79.7822 2300.0 80.322 2100.0 84.0686 2200.0 84.6098 2000.0 86.4109 2300.0 86.5414 2400.0 87.0985 2400.0 87.9134 2900.0 95.0488 3900.0 107.0491 9100.0 117.2921 2600.0 117.4121 2500.0 121.0651 2300.0 127.9657 2600.0 129.0696 79000.0 135.033 4200.0 135.0439 570000.0 136.0517 73000.0 139.0754 7300.0 142.9782 2600.0 144.3843 2500.0 145.0654 3300.0 147.0434 3000.0 149.0596 17000.0 151.0752 500000.0 155.8832 2900.0 157.0646 100000.0 160.7364 2200.0 161.06 10000.0 165.0546 5100.0 165.0912 14000.0 170.9245 2300.0 171.0811 5800.0 172.051 2900.0 172.0884 19000.0 173.0596 45000.0 173.5216 32000.0 173.5309 16000.0 173.5404 58000.0 174.0671 3300.0 175.0754 6700.0 177.092 2800.0 179.0714 8400.0 181.0643 2400.0 185.0597 230000.0 185.0789 4900.0 186.0681 3100.0 187.0753 110000.0 188.0834 59000.0 189.0909 21000.0 197.0596 33000.0 199.0751 36000.0 201.091 120000.0 203.1067 71000.0 208.8849 2600.0 213.0909 15000.0 215.0703 95000.0 217.1016 4300.0 218.0767 2700.0 231.0794 6200.0 231.1019 60000.0 233.0964 16000.0 239.0702 38000.0 245.096 27000.0 246.0758 2700.0 246.1036 48000.0 247.0759 20000.0 247.1101 3000.0 249.0906 8100.0 251.1067 7100.0 252.0777 46000.0 253.0857 3500.0 258.0674 2500.0 259.0736 7200.0 260.0821 18000.0 261.0907 52000.0 262.0985 61000.0 263.0701 6100.0 265.0894 5200.0 265.1219 30000.0 267.0649 64000.0 268.0729 42000.0 272.0827 6500.0 273.091 59000.0 274.099 69000.0 275.0701 12000.0 275.1073 3300.0 276.0788 13000.0 277.0862 46000.0 277.1225 85000.0 278.0936 34000.0 279.1019 7200.0 282.0888 380000.0 283.0963 46000.0 288.0783 22000.0 289.0863 130000.0 290.0942 53000.0 291.1018 43000.0 292.0762 3600.0 292.1095 100000.0 293.081 30000.0 293.1179 37000.0 295.0968 48000.0 303.1017 96000.0 304.1097 260000.0 305.0804 70000.0 305.1177 120000.0 306.0881 13000.0 307.0965 7100.0 308.1047 190000.0 309.1122 14000.0 319.0969 18000.0 320.1045 71000.0 322.1205 13000.0 323.1275 37000.0 335.1279 100000.0 353.1385 9600.0 END IONS BEGIN IONS SCANS=349 PEPMASS=718.3243 CHARGE=1 COLLISION_ENERGY=0.0 68.0496 12000.0 70.065 4000000.0 70.0703 34000.0 70.0719 18000.0 70.0739 19000.0 70.9643 4200.0 72.186 3600.0 86.1571 2700.0 87.568 3100.0 91.0541 180000.0 93.0696 5300.0 95.0491 10000.0 97.0759 51000.0 98.06 120000.0 103.0541 54000.0 107.0499 3400.0 109.0769 3100.0 110.7038 4200.0 115.0864 240000.0 117.0574 5800.0 118.065 230000.0 119.0728 41000.0 120.0806 3600000.0 120.0888 23000.0 120.1005 4200.0 124.0867 52000.0 125.0708 280000.0 126.0547 62000.0 130.0651 33000.0 131.049 24000.0 132.0805 25000.0 133.8563 4900.0 135.6938 4200.0 136.0757 160000.0 136.9508 5800.0 137.0708 420000.0 137.0831 3200.0 144.6035 4000.0 146.0599 2200000.0 146.0702 12000.0 146.0738 12000.0 148.0751 8800.0 151.0739 21000.0 152.0817 420000.0 162.055 16000.0 164.0706 76000.0 165.0546 48000.0 172.0966 9100.0 172.1122 300000.0 173.0713 6100.0 173.527 45000.0 174.0549 28000.0 182.0813 180000.0 185.1097 5500.0 187.1231 46000.0 189.1398 2900.0 191.0819 8200.0 192.0661 5000.0 199.123 170000.0 200.1069 6500.0 201.1391 33000.0 208.1123 95000.0 214.1337 14000.0 215.0815 30000.0 215.1179 190000.0 216.1258 460000.0 217.1336 1200000.0 217.1517 7700.0 217.1588 9800.0 220.1124 30000.0 221.55 2600.0 222.128 100000.0 223.0752 14000.0 225.1021 98000.0 227.1179 200000.0 228.1024 22000.0 228.1259 69000.0 236.1071 130000.0 237.1385 17000.0 238.1228 46000.0 242.1283 18000.0 243.1126 430000.0 243.1371 65000.0 244.1444 54000.0 245.1284 190000.0 248.1069 52000.0 253.134 3900.0 254.1285 68000.0 256.1437 20000.0 262.1545 4000.0 264.1017 20000.0 265.0856 79000.0 265.1335 280000.0 266.1179 12000.0 270.1125 85000.0 272.1395 55000.0 277.1337 97000.0 281.1278 33000.0 282.1128 310000.0 283.1447 20000.0 284.1393 32000.0 293.1287 330000.0 293.166 3800.0 299.1381 47000.0 299.3519 2900.0 300.1347 160000.0 301.1698 25000.0 302.1518 3500.0 305.1649 28000.0 309.1235 550000.0 311.1378 4600.0 312.1233 6100.0 318.1949 16000.0 321.1232 63000.0 327.1361 20000.0 329.1501 220000.0 339.1338 49000.0 344.1756 210000.0 346.1406 4200.0 346.1536 4500.0 346.1914 1000000.0 355.1287 200000.0 362.1865 29000.0 372.1707 280000.0 383.1754 23000.0 390.1811 2200000.0 391.1859 11000.0 391.1954 5700.0 396.1471 3600.0 396.1975 21000.0 400.1543 22000.0 406.1771 11000.0 415.1398 5700.0 417.1811 250000.0 424.1896 11000.0 429.1807 130000.0 446.2059 21000.0 456.1913 28000.0 458.2069 76000.0 474.202 99000.0 484.182 4400.0 498.2371 16000.0 502.1967 650000.0 502.2817 16000.0 525.2488 29000.0 526.2322 20000.0 543.1831 3900.0 543.2592 140000.0 553.2433 69000.0 571.2541 160000.0 578.4147 2900.0 718.322 33000.0 END IONS BEGIN IONS SCANS=350 PEPMASS=685.2768 CHARGE=1 COLLISION_ENERGY=0.0 79.4136 2800.0 81.016 2400.0 81.1545 2200.0 93.7566 2300.0 96.3507 2500.0 103.054 2400.0 114.1704 2600.0 115.1549 2200.0 121.0551 9600.0 121.0646 240000.0 124.774 2400.0 138.17 2700.0 138.7051 2500.0 155.0701 2400.0 155.5782 2600.0 162.6816 2800.0 164.07 3700.0 168.8496 2200.0 173.5254 28000.0 173.5412 36000.0 182.2631 2400.0 219.0816 5000.0 231.0388 10000.0 231.0651 380000.0 233.0601 7000.0 235.0746 2800.0 235.3224 2400.0 237.0905 21000.0 247.074 2800.0 250.0629 2900.0 250.5087 2500.0 262.1345 2800.0 263.0701 81000.0 265.0855 80000.0 274.0708 20000.0 291.0655 13000.0 293.0809 110000.0 297.1119 53000.0 298.8282 2700.0 305.0809 2900.0 307.4566 2300.0 308.0672 20000.0 318.0488 2700.0 321.0765 2900.0 323.0913 75000.0 325.1072 95000.0 342.1095 89000.0 351.0857 1200000.0 351.1233 6900.0 352.0948 6700.0 355.1129 3000.0 355.4034 2500.0 357.1328 92000.0 368.0908 3000.0 383.0565 5300.0 383.1124 370000.0 390.3831 2700.0 394.1287 47000.0 401.2897 2600.0 406.4375 2400.0 411.1084 27000.0 429.1188 18000.0 509.937 2700.0 520.1957 77000.0 548.1907 6300.0 611.9456 2700.0 END IONS BEGIN IONS SCANS=351 PEPMASS=221.0812 CHARGE=1 COLLISION_ENERGY=0.0 42.6381 4600.0 43.4796 2400.0 44.3123 2100.0 45.3966 2500.0 48.89 2400.0 48.945 2200.0 50.7338 2300.0 51.6834 2700.0 52.482 2400.0 52.6724 2100.0 53.085 2400.0 53.5937 2400.0 55.1248 2400.0 55.1543 2500.0 56.2748 2200.0 56.6497 2200.0 56.6815 4300.0 58.8682 2200.0 59.3874 3000.0 60.8214 2400.0 63.6555 2300.0 65.2295 2300.0 67.2312 2200.0 69.6635 2400.0 70.0399 2100.0 72.8697 2300.0 74.2084 2300.0 75.4155 2100.0 78.0462 27000.0 79.054 56000.0 79.1635 2600.0 85.3479 2300.0 85.5059 2600.0 85.8306 2200.0 88.1002 2300.0 90.0465 3500.0 91.054 91000.0 93.4984 2800.0 95.0489 13000.0 95.1051 2600.0 102.0095 2400.0 102.0463 110000.0 103.054 52000.0 104.0618 45000.0 104.7275 2600.0 105.0335 6200.0 105.0699 38000.0 107.0489 100000.0 109.8305 2800.0 114.634 2700.0 115.0547 3500.0 116.062 2600.0 117.0338 2900.0 117.8939 2400.0 118.0411 65000.0 119.0489 190000.0 120.0566 15000.0 121.0646 41000.0 121.4312 2400.0 122.0725 14000.0 122.5399 2700.0 130.0412 180000.0 131.049 79000.0 132.0205 3500.0 132.0466 2700.0 132.0568 140000.0 132.3839 2300.0 133.0284 35000.0 133.0646 51000.0 134.037 3500.0 134.0726 8600.0 135.033 4500.0 135.0439 240000.0 135.3654 2200.0 136.0256 2700.0 136.6818 2400.0 137.7898 2300.0 140.8732 2400.0 141.069 2500.0 144.0568 2600.0 145.0282 22000.0 145.113 2400.0 146.036 30000.0 147.0439 600000.0 147.0571 4400.0 148.0517 93000.0 149.0596 130000.0 150.0674 47000.0 150.1903 2500.0 152.6988 2300.0 156.9736 8100.0 157.0396 14000.0 158.0361 2700.0 159.0438 26000.0 160.0518 160000.0 161.023 28000.0 161.0597 120000.0 162.0531 4800.0 162.0675 410000.0 162.0829 3800.0 163.0388 740000.0 163.0751 68000.0 173.5255 33000.0 173.5362 55000.0 174.0314 38000.0 174.985 37000.0 175.039 400000.0 176.0468 110000.0 176.0739 6800.0 177.0547 110000.0 177.7835 2600.0 178.0625 380000.0 178.0805 3300.0 187.0396 3600.0 188.0468 55000.0 188.1798 2400.0 189.0546 23000.0 190.0427 9300.0 190.0625 520000.0 190.0808 4500.0 191.0338 230000.0 191.0705 14000.0 191.6745 2500.0 193.0861 240000.0 205.0499 6900.0 206.0576 120000.0 217.724 2600.0 221.081 35000.0 221.1899 5200.0 223.5993 2300.0 227.6747 2300.0 END IONS BEGIN IONS SCANS=352 PEPMASS=334.1291 CHARGE=1 COLLISION_ENERGY=0.0 50.2103 2800.0 51.4262 2100.0 53.105 2400.0 54.6978 2300.0 55.2697 41000.0 55.2714 4800.0 55.2914 2400.0 55.6588 2700.0 57.5358 2500.0 62.0729 2200.0 63.6303 2100.0 63.6873 2200.0 63.8988 2300.0 64.9927 2300.0 68.9858 2600.0 70.7663 2600.0 71.076 2300.0 71.2149 2200.0 72.6389 2100.0 73.0831 2600.0 74.2426 2300.0 79.0541 6200.0 80.6623 2200.0 88.7573 2500.0 91.0541 18000.0 95.3024 2200.0 98.3747 2300.0 100.3336 2500.0 102.0465 14000.0 103.054 8600.0 103.338 2700.0 104.0622 6900.0 105.0699 9900.0 107.0492 5400.0 107.1606 2500.0 108.2694 2400.0 114.0543 2600.0 115.4316 2700.0 118.0411 25000.0 119.0492 44000.0 120.0577 2800.0 122.072 2900.0 130.0413 64000.0 131.0491 22000.0 132.0571 35000.0 133.0286 2800.0 133.0647 57000.0 135.0442 60000.0 144.0099 2400.0 146.0359 9900.0 147.044 270000.0 148.0521 32000.0 149.0597 46000.0 150.0675 41000.0 158.036 3500.0 159.0438 16000.0 160.0519 75000.0 161.0598 140000.0 162.0676 790000.0 162.0831 19000.0 163.039 260000.0 163.0753 140000.0 165.0912 31000.0 167.0703 28000.0 167.6844 2300.0 170.651 2200.0 173.5266 27000.0 173.5368 48000.0 173.5463 4200.0 174.0167 2400.0 174.0314 80000.0 175.0392 190000.0 176.047 190000.0 177.0549 140000.0 178.0484 2500.0 178.0626 720000.0 178.0806 14000.0 178.4034 2500.0 181.6827 2400.0 188.0468 66000.0 189.0547 370000.0 189.0724 4700.0 190.0221 7900.0 190.0426 11000.0 190.0624 4000000.0 190.6677 2300.0 191.0138 21000.0 191.0338 820000.0 191.0701 310000.0 192.0416 40000.0 193.086 3000000.0 193.1066 6400.0 202.0693 2600.0 202.7986 2400.0 205.0494 24000.0 206.0346 15000.0 206.0413 3800.0 206.0575 1500000.0 206.0801 18000.0 207.531 2400.0 220.8655 2400.0 221.0305 63000.0 221.0809 10000000.0 221.1199 9100.0 221.1323 46000.0 222.0847 20000.0 267.0266 2400.0 270.2938 2800.0 291.1017 2700.0 298.3531 2600.0 318.0905 2400.0 343.1904 2600.0 END IONS BEGIN IONS SCANS=353 PEPMASS=356.1108 CHARGE=1 COLLISION_ENERGY=0.0 52.049 2300.0 52.1674 2600.0 53.1675 2100.0 53.9535 2500.0 54.392 2400.0 75.4029 2600.0 79.5402 2100.0 86.0625 2200.0 87.0532 2200.0 96.067 2500.0 106.1401 2300.0 108.1613 2700.0 173.521 11000.0 173.5323 49000.0 173.5401 23000.0 184.0157 2700.0 200.5066 2200.0 201.9275 2200.0 210.0161 3100.0 237.1799 2800.0 255.558 2400.0 286.7584 2600.0 307.5224 2400.0 309.9 9000.0 313.6196 2600.0 END IONS BEGIN IONS SCANS=354 PEPMASS=245.0136 CHARGE=1 COLLISION_ENERGY=0.0 47.0586 2200.0 50.0403 2300.0 53.0572 2300.0 55.9342 23000.0 65.3099 2300.0 66.9751 2200.0 75.46 2300.0 82.7495 2100.0 88.2843 2400.0 88.5484 2400.0 92.1079 2300.0 96.7269 2700.0 102.7498 2400.0 113.1016 2300.0 114.7087 2400.0 115.7152 2400.0 117.1599 2500.0 137.3131 2200.0 137.7341 2700.0 167.0 3100.0 173.5224 4700.0 173.5363 40000.0 175.9916 9000.0 184.9966 3100.0 203.9866 7600.0 219.5722 2600.0 220.9896 18000.0 221.9303 2800.0 221.9967 16000.0 222.7486 2600.0 240.0078 7700.0 END IONS BEGIN IONS SCANS=355 PEPMASS=219.102 CHARGE=1 COLLISION_ENERGY=0.0 42.5982 2000.0 43.0177 16000.0 44.8793 2300.0 45.0334 6400.0 47.6885 2500.0 50.6115 2700.0 53.3773 2300.0 55.0173 2500.0 55.9343 6500.0 56.2341 2200.0 57.0333 20000.0 58.544 2300.0 61.9156 2400.0 63.9235 2200.0 66.1915 2500.0 67.0127 2100.0 67.0542 12000.0 81.2674 2700.0 82.3532 2500.0 85.0283 2900.0 90.9475 3000.0 91.0539 120000.0 103.0539 29000.0 104.113 2400.0 105.0697 11000.0 107.0852 2300.0 107.4827 2300.0 109.0642 2400.0 112.8421 2700.0 115.054 92000.0 116.0617 33000.0 117.0696 37000.0 119.0861 2500.0 123.0787 2600.0 128.0618 95000.0 129.0589 4900.0 129.0695 580000.0 129.0795 3800.0 129.9507 2700.0 130.0775 34000.0 131.0488 90000.0 131.0852 500000.0 131.0946 2600.0 131.0987 6100.0 133.1013 11000.0 137.0594 60000.0 141.0696 510000.0 141.0807 2600.0 141.0829 4100.0 141.8279 2500.0 142.0773 3500.0 143.0488 26000.0 143.085 31000.0 144.0568 73000.0 145.0644 77000.0 146.0725 72000.0 147.0438 8000.0 148.0518 19000.0 151.0766 3600.0 152.1979 2300.0 153.0703 2500.0 154.7886 2300.0 155.0607 5200.0 156.0564 6700.0 157.0507 8300.0 157.0645 250000.0 158.0724 310000.0 158.0874 9600.0 159.0438 31000.0 159.0802 200000.0 160.0516 79000.0 161.0595 16000.0 161.096 51000.0 162.0673 13000.0 163.0753 24000.0 168.057 17000.0 169.0646 160000.0 170.0726 100000.0 171.0442 4100.0 171.0802 16000.0 172.0885 2800.0 173.0597 60000.0 173.0961 7600.0 173.5249 13000.0 173.5384 30000.0 174.0502 4300.0 174.0674 1100000.0 175.0752 110000.0 183.0815 6100.0 184.0347 2900.0 185.0596 8800.0 186.0674 260000.0 187.0756 13000.0 188.0833 74000.0 189.0909 480000.0 189.1111 9200.0 191.0699 3500.0 191.1073 3300.0 196.2653 2300.0 201.091 250000.0 203.1432 9800.0 217.9115 2600.0 219.1017 38000.0 219.1745 15000.0 221.2251 2400.0 END IONS BEGIN IONS SCANS=356 PEPMASS=467.1819 CHARGE=1 COLLISION_ENERGY=0.0 57.5665 2500.0 66.1873 2300.0 68.6225 2300.0 71.6511 2300.0 72.7022 2200.0 73.2864 2300.0 74.8404 2200.0 75.1911 2200.0 78.5216 2200.0 98.0598 26000.0 101.9975 2500.0 120.1961 2300.0 121.5909 2900.0 122.0589 3500.0 125.745 2400.0 132.0445 3100.0 135.0452 3100.0 147.044 21000.0 150.0546 150000.0 161.0594 7100.0 162.0537 2500.0 162.0673 76000.0 163.0384 17000.0 163.0751 8600.0 163.4233 2400.0 173.5374 29000.0 174.0312 4100.0 175.039 14000.0 176.0467 15000.0 177.0553 16000.0 178.0624 47000.0 189.0544 52000.0 190.0622 520000.0 190.0773 7800.0 191.0337 94000.0 191.0702 46000.0 193.0655 3600.0 193.0857 440000.0 193.1004 4400.0 193.1063 9800.0 206.041 2300.0 206.0572 190000.0 211.3005 2500.0 219.1131 2900.0 221.0297 19000.0 221.0807 4900000.0 221.1001 23000.0 221.12 10000.0 221.1316 25000.0 230.0817 24000.0 247.1075 390000.0 247.1368 4600.0 355.6633 2500.0 412.6211 2500.0 470.4674 2500.0 END IONS BEGIN IONS SCANS=357 PEPMASS=326.1005 CHARGE=1 COLLISION_ENERGY=0.0 49.932 2100.0 55.2694 2300.0 57.0418 2400.0 58.0648 3100.0 59.0103 2200.0 60.6661 2500.0 62.3907 2200.0 63.6597 2300.0 63.7292 2400.0 68.243 2300.0 69.8033 2800.0 70.9844 2200.0 76.1463 2300.0 76.3557 2200.0 77.1628 2100.0 81.743 2400.0 83.5551 2400.0 90.1629 2400.0 91.008 2200.0 100.4659 2200.0 116.9707 2700.0 117.4213 2600.0 120.0416 28000.0 122.9545 2200.0 147.0438 2700.0 153.8955 2600.0 157.9082 2600.0 163.706 2300.0 173.5252 15000.0 173.535 58000.0 173.5452 5000.0 175.0392 11000.0 205.6184 2500.0 207.0644 11000.0 207.829 2300.0 212.8014 2500.0 221.457 2600.0 229.0447 2600.0 233.8999 3100.0 249.016 2400.0 250.265 2400.0 262.0706 2400.0 288.3494 2300.0 297.9064 2400.0 311.1159 5400.0 326.1005 70000.0 END IONS BEGIN IONS SCANS=358 PEPMASS=303.1108 CHARGE=1 COLLISION_ENERGY=0.0 48.1599 2100.0 49.6031 2200.0 50.5534 2200.0 53.8455 2400.0 57.8911 2600.0 59.1999 2600.0 64.8517 2200.0 71.8515 2600.0 73.9428 2500.0 81.0333 6300.0 82.065 17000.0 83.353 2300.0 84.6237 2400.0 86.1373 2200.0 91.0541 100000.0 93.3271 2600.0 96.0446 6400.0 98.0599 30000.0 102.0462 4000.0 104.5537 2300.0 114.7555 2500.0 119.0392 6400.0 119.049 420000.0 119.0592 3700.0 119.0636 3000.0 122.0594 3000.0 124.16 2300.0 126.415 2200.0 129.0332 10000.0 130.0412 82000.0 130.5675 2600.0 132.0567 23000.0 133.0282 4800.0 146.0609 2600.0 147.0244 3300.0 147.044 580000.0 147.0546 3400.0 148.0512 5800.0 149.0233 2800.0 149.0589 2300.0 150.6854 2300.0 157.0397 45000.0 158.4852 2300.0 160.052 7200.0 160.4484 2300.0 161.0232 4800.0 163.0388 27000.0 164.069 2300.0 165.0545 26000.0 173.5261 57000.0 173.5413 40000.0 175.0203 3100.0 175.0391 1600000.0 176.047 74000.0 176.071 15000.0 177.0553 20000.0 178.0625 210000.0 179.0704 30000.0 180.0783 150000.0 181.0496 38000.0 188.0472 8800.0 191.0343 3200.0 194.1441 2700.0 195.0889 5900.0 203.5169 2300.0 204.1403 3300.0 205.0494 14000.0 206.0541 31000.0 207.0448 6900.0 207.0654 1100000.0 207.0849 21000.0 222.0511 2900.0 225.0776 2900.0 232.0974 11000.0 241.8602 2400.0 243.0899 7400.0 244.3784 2700.0 258.1122 29000.0 260.0911 29000.0 274.1078 27000.0 275.1154 130000.0 301.1961 2600.0 303.1068 14000.0 END IONS BEGIN IONS SCANS=359 PEPMASS=207.0655 CHARGE=1 COLLISION_ENERGY=0.0 43.0178 15000.0 43.626 2200.0 45.0334 8100.0 45.7621 2300.0 47.1602 3600.0 48.2659 2200.0 48.5217 2100.0 51.0228 30000.0 51.52 2200.0 52.7145 2600.0 53.002 26000.0 53.0384 2600.0 53.1113 2200.0 54.8576 2300.0 55.0177 25000.0 55.8927 2600.0 57.9346 5600.0 60.0992 3500.0 60.474 2100.0 61.3368 2200.0 62.3013 3800.0 63.023 7500.0 64.0306 6500.0 65.0383 420000.0 65.099 3900.0 66.0461 11000.0 66.6843 2400.0 67.0539 5000.0 68.2229 2600.0 75.4374 2300.0 76.0305 63000.0 77.0383 80000.0 77.9646 2800.0 78.0462 21000.0 79.0539 65000.0 80.0617 74000.0 80.7219 2700.0 83.8379 2300.0 84.9154 2300.0 84.9454 2700.0 85.1585 2400.0 86.8438 4000.0 88.6888 2200.0 89.0327 5300.0 89.0383 290000.0 90.0461 88000.0 91.0466 9000.0 91.054 7300000.0 91.0642 31000.0 91.0651 160000.0 91.0671 22000.0 91.0712 10000.0 93.0333 38000.0 93.0698 4900.0 94.0412 17000.0 95.0488 79000.0 95.0852 6800.0 97.9531 14000.0 98.9611 39000.0 101.0384 140000.0 102.9563 14000.0 103.0539 120000.0 104.0188 3500.0 104.0254 120000.0 105.0333 47000.0 105.0444 18000.0 105.0695 6500.0 106.041 27000.0 106.6398 2600.0 107.0488 130000.0 108.0567 110000.0 108.1304 3400.0 109.0653 2900.0 109.4606 2400.0 110.2562 2400.0 110.9721 2300.0 112.7176 2100.0 115.0173 2500.0 115.955 7900.0 115.9638 370000.0 116.6454 2200.0 116.9716 120000.0 117.0333 140000.0 118.0411 240000.0 119.0381 2700.0 119.0488 4800000.0 119.0572 72000.0 119.7441 2400.0 121.0281 94000.0 121.0372 3400.0 121.0643 9200.0 122.0361 53000.0 122.0473 3800.0 123.0803 9100.0 126.9674 2600.0 129.0227 3900.0 129.0333 240000.0 129.0445 59000.0 129.6956 4100.0 129.9777 2300.0 130.0413 19000.0 131.0489 26000.0 132.0092 15000.0 132.0203 650000.0 133.0282 71000.0 133.0642 2600.0 133.9745 9000.0 134.036 57000.0 135.0438 320000.0 136.0517 210000.0 137.06 7200.0 137.9868 4100.0 145.0282 200000.0 146.0361 220000.0 147.0438 2800000.0 147.0548 10000.0 148.0516 28000.0 149.0106 8300.0 149.0232 590000.0 149.06 9500.0 150.031 58000.0 151.0748 5000.0 155.9965 7000.0 157.0264 11000.0 157.0395 380000.0 157.0529 2100.0 159.8195 2700.0 160.0153 50000.0 162.0311 99000.0 163.0388 78000.0 164.0467 280000.0 173.5274 43000.0 173.5405 11000.0 174.0312 150000.0 175.039 530000.0 175.0551 9400.0 176.0467 19000.0 177.0181 16000.0 178.0264 17000.0 179.0703 390000.0 192.0419 96000.0 192.4723 2900.0 207.0662 34000.0 208.891 2600.0 END IONS BEGIN IONS SCANS=360 PEPMASS=304.1184 CHARGE=1 COLLISION_ENERGY=0.0 48.4502 2200.0 50.0159 2500.0 51.0233 3000.0 51.7657 53000.0 52.7576 5000.0 52.9206 3100.0 53.3639 2600.0 55.018 12000.0 55.9199 2100.0 60.2277 2400.0 60.4778 2400.0 60.5609 2300.0 60.9109 2700.0 64.228 2600.0 65.0385 110000.0 71.1446 2500.0 71.5701 3700.0 71.9835 2200.0 75.0232 2500.0 75.1849 3200.0 76.0314 38000.0 76.5775 4700.0 77.0385 49000.0 77.6285 2300.0 80.062 8200.0 82.2669 2600.0 87.8484 2800.0 87.943 2300.0 88.3873 3300.0 88.4913 2600.0 89.0387 72000.0 90.3075 2100.0 91.0321 2600.0 91.0542 3400000.0 91.0651 10000.0 92.4382 2400.0 95.0489 22000.0 98.0599 400000.0 99.7293 2400.0 101.0387 30000.0 101.8845 2400.0 103.054 150000.0 103.9829 5000.0 104.0257 17000.0 105.0336 45000.0 105.0445 3100.0 107.0124 2700.0 107.0493 25000.0 108.0568 23000.0 108.7783 6100.0 109.065 5700.0 111.6175 2500.0 117.0333 37000.0 118.0414 49000.0 119.0292 43000.0 119.0351 21000.0 119.0492 11000000.0 119.0575 66000.0 119.0675 130000.0 119.0804 3600.0 120.0524 30000.0 121.0286 27000.0 129.0334 100000.0 129.0438 17000.0 129.7225 2200.0 131.049 130000.0 132.0205 170000.0 133.0283 99000.0 135.044 66000.0 136.0521 74000.0 137.0596 3500.0 142.3279 2300.0 145.0283 130000.0 146.0362 47000.0 147.0169 30000.0 147.0438 14000000.0 147.055 79000.0 147.0716 97000.0 148.0477 57000.0 148.229 2700.0 149.0232 120000.0 149.0598 23000.0 149.1314 2400.0 151.0749 4600.0 155.334 2400.0 156.6008 3300.0 157.0293 11000.0 157.0395 1300000.0 157.052 2400.0 157.0552 3100.0 160.0156 53000.0 161.0589 7800.0 162.0308 47000.0 163.0391 31000.0 164.0467 230000.0 171.6096 2600.0 172.5596 3900.0 173.0227 5900.0 173.5257 14000.0 173.5362 66000.0 174.0314 55000.0 175.0027 140000.0 175.0389 31000000.0 175.0531 140000.0 175.0673 30000.0 175.0746 210000.0 175.0851 32000.0 175.0944 18000.0 176.0434 170000.0 177.0546 69000.0 178.0264 8900.0 178.0625 9700.0 179.0527 10000.0 179.0703 910000.0 180.8885 16000.0 189.0549 7000.0 190.8732 3300.0 191.0339 9500.0 192.0417 200000.0 193.0493 17000.0 203.6704 2500.0 207.0191 55000.0 207.0652 15000000.0 207.1108 75000.0 207.1237 8900.0 208.0687 110000.0 208.8831 140000.0 226.8938 110000.0 236.191 2500.0 239.3767 3600.0 244.149 2300.0 276.1185 15000.0 281.15 2500.0 305.3842 2700.0 311.155 2500.0 END IONS BEGIN IONS SCANS=361 PEPMASS=325.1441 CHARGE=1 COLLISION_ENERGY=0.0 49.6554 2600.0 49.9412 2400.0 50.075 2000.0 51.2698 2200.0 51.7231 2400.0 54.3679 2200.0 56.1825 3200.0 58.6506 2200.0 59.0006 2200.0 59.9179 2200.0 67.0361 2500.0 67.9456 2300.0 67.9844 2400.0 72.3683 2900.0 72.8744 2700.0 74.8398 2400.0 77.4731 2300.0 81.0441 2900.0 81.1113 2200.0 86.2786 2500.0 86.4911 2400.0 89.0701 2200.0 90.8117 2100.0 91.0539 2700.0 94.2389 2100.0 95.2583 2100.0 98.3006 2400.0 98.9417 2200.0 100.3262 2400.0 104.9412 2300.0 105.0695 25000.0 108.0577 2500.0 109.3844 2700.0 114.6588 2400.0 125.4742 2300.0 127.9121 2500.0 127.9819 2800.0 129.0694 52000.0 129.6219 2400.0 133.0646 32000.0 135.0438 8400.0 136.0516 58000.0 137.0594 15000.0 145.4498 2700.0 147.6365 2700.0 148.4645 2500.0 149.6872 4400.0 149.6971 3300.0 149.7074 3000.0 151.0751 380000.0 151.0888 2700.0 155.0489 33000.0 156.057 2800.0 158.2028 2400.0 159.0803 64000.0 161.0596 32000.0 163.0754 10000.0 167.4079 2300.0 173.5291 100000.0 173.5413 18000.0 175.0746 2500.0 187.0753 120000.0 188.4244 2600.0 203.0858 7100.0 204.6281 2300.0 218.0737 18000.0 219.0805 22000.0 221.0957 8100.0 231.0803 3500.0 232.0915 3000.0 233.0961 50000.0 234.104 130000.0 235.0758 14000.0 238.2869 2200.0 242.9659 2500.0 246.0652 2400.0 247.0757 13000.0 249.091 11000.0 250.0986 42000.0 251.1066 6500.0 256.0941 2700.0 260.0826 2700.0 261.0916 42000.0 262.0989 99000.0 263.0695 6100.0 263.106 5700.0 263.681 2600.0 265.0894 3900.0 265.1224 320000.0 265.1516 4400.0 267.1023 9400.0 272.1324 2400.0 278.0948 41000.0 279.1019 91000.0 293.118 63000.0 294.1258 78000.0 295.0973 44000.0 296.904 2600.0 303.9229 2300.0 308.9879 2700.0 309.111 7300.0 310.1201 36000.0 311.5187 2200.0 312.3401 2400.0 312.3866 2700.0 318.6327 2400.0 325.1438 22000.0 333.1533 2300.0 END IONS BEGIN IONS SCANS=362 PEPMASS=355.1545 CHARGE=1 COLLISION_ENERGY=0.0 54.0528 2300.0 55.0177 4500.0 55.3256 2900.0 57.1246 2400.0 59.2563 2200.0 59.5005 2300.0 60.7846 2300.0 70.0648 3500.0 72.0805 2800.0 75.0439 3600.0 76.258 2800.0 79.0541 13000.0 80.9572 2300.0 82.1307 2200.0 82.9382 2300.0 83.564 2500.0 90.046 2600.0 90.7316 2400.0 91.054 64000.0 92.999 2500.0 93.0697 4600.0 95.0491 2300.0 103.0542 9200.0 104.062 5100.0 105.0336 2400.0 105.0697 130000.0 106.0414 2800.0 107.0489 78000.0 108.0567 28000.0 109.0643 4400.0 110.7226 2200.0 114.0775 2300.0 115.0541 50000.0 117.0697 22000.0 118.0412 4600.0 119.0853 65000.0 121.0645 27000.0 123.0803 8300.0 124.0519 6300.0 125.0602 2900.0 125.1643 2400.0 126.2872 2400.0 127.5179 2100.0 128.0621 14000.0 129.0696 96000.0 131.0489 32000.0 131.0856 8000.0 132.0567 35000.0 132.9091 2400.0 133.0646 170000.0 135.0438 45000.0 136.0396 2600.0 136.0517 280000.0 136.0641 4300.0 137.0246 2500.0 137.0596 44000.0 139.0756 9500.0 141.0692 8300.0 143.0491 15000.0 143.0604 12000.0 144.0569 2900.0 145.0647 33000.0 146.0718 2800.0 147.0801 110000.0 149.0593 2300.0 149.6331 2300.0 151.0473 4100.0 151.0751 2600000.0 151.0868 13000.0 151.1032 10000.0 153.2157 2700.0 155.0488 42000.0 156.0576 2600.0 157.0644 27000.0 159.0803 120000.0 160.0516 120000.0 161.0595 230000.0 161.0952 8400.0 162.0677 19000.0 163.0752 34000.0 165.0908 18000.0 167.0494 2700.0 168.0574 6800.0 169.0646 12000.0 171.08 37000.0 172.0518 46000.0 173.5206 4700.0 173.5359 56000.0 174.0678 7400.0 175.0753 820000.0 175.0916 7300.0 176.0834 19000.0 176.2462 2400.0 177.0907 15000.0 180.5222 2500.0 181.0638 3700.0 181.0858 15000.0 184.0521 21000.0 184.4079 2400.0 185.059 18000.0 187.0558 3800.0 187.0752 280000.0 187.0945 2300.0 189.0906 40000.0 190.0783 2700.0 193.0853 6900.0 199.0752 180000.0 201.0905 14000.0 201.4819 2400.0 202.079 5900.0 203.0854 19000.0 205.101 18000.0 207.081 6500.0 214.874 8400.0 215.0857 18000.0 218.0728 27000.0 218.8684 5600.0 219.0799 31000.0 220.0883 2600.0 221.0958 8200.0 230.0723 5700.0 231.08 41000.0 232.0877 13000.0 233.0959 99000.0 234.1038 140000.0 235.0757 21000.0 235.1108 9500.0 243.0791 3600.0 244.0884 6600.0 245.0957 35000.0 246.0685 17000.0 246.1035 69000.0 247.0472 2800.0 247.0752 38000.0 247.1127 6500.0 248.0821 2900.0 249.091 23000.0 250.0986 62000.0 251.1066 12000.0 256.0886 2700.0 257.0915 2500.0 259.0746 24000.0 260.0837 12000.0 261.0908 100000.0 262.0984 180000.0 263.0717 16000.0 263.1064 59000.0 264.1133 3600.0 265.0891 3500.0 265.1219 550000.0 265.1558 12000.0 267.1018 14000.0 273.0912 33000.0 274.0987 69000.0 275.0715 14000.0 275.1066 75000.0 276.0767 3100.0 276.1154 3300.0 277.0891 18000.0 277.1222 78000.0 278.0937 70000.0 278.1293 17000.0 279.1015 93000.0 281.1174 16000.0 282.0909 6300.0 289.0866 13000.0 290.0941 40000.0 290.8928 2800.0 291.1016 180000.0 292.1077 7200.0 293.1172 130000.0 294.1249 140000.0 295.0964 59000.0 296.1028 2700.0 305.117 71000.0 306.1248 130000.0 307.0963 36000.0 308.9004 42000.0 309.1114 16000.0 309.1485 11000.0 310.1197 66000.0 314.1125 2600.0 317.3673 3000.0 321.1113 2600.0 322.1191 23000.0 323.1318 3100.0 324.1355 4900.0 325.1434 51000.0 328.0218 2800.0 364.2522 2600.0 END IONS BEGIN IONS SCANS=363 PEPMASS=271.0604 CHARGE=1 COLLISION_ENERGY=0.0 49.4632 2500.0 51.3722 2500.0 67.0174 7000.0 68.9971 6200.0 71.1266 2100.0 82.6472 2600.0 84.8868 2400.0 85.6994 2200.0 87.2548 2400.0 94.0591 2400.0 100.6661 2200.0 119.0487 38000.0 121.028 10000.0 126.9676 2400.0 134.4333 2300.0 145.0283 7400.0 153.0058 3400.0 153.0177 92000.0 160.082 2400.0 163.0388 4600.0 171.0285 19000.0 173.5236 12000.0 173.5405 22000.0 187.0388 2600.0 200.119 3100.0 224.9051 2600.0 225.0544 5800.0 243.0645 3100.0 269.7808 2500.0 271.0252 4600.0 271.06 1600000.0 271.1286 7100.0 END IONS BEGIN IONS SCANS=364 PEPMASS=292.155 CHARGE=1 COLLISION_ENERGY=0.0 49.4264 2200.0 50.5584 2500.0 51.6664 2300.0 51.7672 2700.0 54.2156 2300.0 56.3775 2100.0 56.7684 2300.0 58.805 2500.0 59.6924 2300.0 60.1001 2100.0 60.7323 2500.0 61.1228 2700.0 66.1976 2700.0 67.0541 2400.0 67.8543 2400.0 69.0697 210000.0 70.065 5400.0 74.5719 2500.0 79.8014 2200.0 84.0806 52000.0 85.0619 2100.0 85.3982 2400.0 86.0903 3500.0 86.0962 540000.0 86.1026 3800.0 88.1818 2300.0 91.0541 170000.0 103.0537 6900.0 105.2605 2200.0 105.3254 2100.0 112.0755 180000.0 112.6572 2300.0 114.1111 2600.0 119.039 4900.0 119.0491 720000.0 119.0563 3100.0 119.0592 7500.0 125.24 2900.0 131.0486 4200.0 132.0208 2700.0 133.0292 2600.0 136.0066 2500.0 140.196 2500.0 141.7226 2300.0 147.0439 960000.0 149.0591 2600.0 151.5681 2700.0 153.1555 2400.0 154.5279 2500.0 157.0397 83000.0 164.0467 7100.0 167.0699 6900.0 173.5254 13000.0 173.536 54000.0 175.039 3000000.0 175.0742 9400.0 176.0478 2800.0 179.0701 40000.0 180.1549 2300.0 192.042 62000.0 204.028 2700.0 207.0197 3100.0 207.0653 2500000.0 207.1106 3700.0 222.1037 2500.0 251.2592 2400.0 280.4131 2400.0 282.5216 2500.0 292.0713 8000.0 292.1542 10000.0 END IONS BEGIN IONS SCANS=365 PEPMASS=262.1441 CHARGE=1 COLLISION_ENERGY=0.0 45.1596 2200.0 47.8606 2200.0 49.6561 2400.0 55.0433 2200.0 56.6231 2200.0 56.9639 2300.0 58.3066 2400.0 59.6155 2300.0 61.304 2800.0 61.3382 2600.0 61.9591 2300.0 67.888 2100.0 69.0696 110000.0 69.7788 2400.0 70.0649 4400.0 72.9954 2500.0 84.0805 30000.0 86.0961 150000.0 89.0384 14000.0 100.8866 2600.0 106.2384 2300.0 112.0754 110000.0 114.3535 2400.0 117.0333 74000.0 119.5998 2200.0 135.0441 5700.0 138.4687 2300.0 145.0282 700000.0 145.0393 7600.0 149.0596 36000.0 149.223 2400.0 150.285 2500.0 153.4618 2400.0 163.0388 9500.0 173.5266 29000.0 173.5426 9000.0 174.7217 2800.0 177.0548 1100000.0 178.4462 2300.0 186.0553 5300.0 186.6136 2400.0 189.8034 2700.0 191.1036 2300.0 262.1442 63000.0 END IONS BEGIN IONS SCANS=366 PEPMASS=341.1389 CHARGE=1 COLLISION_ENERGY=0.0 55.0537 2500.0 56.2096 2100.0 62.406 2200.0 65.7784 2600.0 71.0489 32000.0 72.5176 2400.0 77.593 2300.0 79.0545 2300.0 81.0701 3100.0 82.5559 2200.0 91.0539 3800.0 94.0413 2900.0 94.3678 2300.0 99.6931 2400.0 107.0496 2900.0 109.0647 14000.0 119.7133 2600.0 122.0362 14000.0 122.6928 2400.0 123.0432 2900.0 125.059 8800.0 129.0697 30000.0 131.0491 13000.0 131.0856 2600.0 131.8613 2600.0 133.0282 46000.0 137.0595 650000.0 137.0695 2800.0 143.0491 12000.0 143.086 4100.0 144.0571 7200.0 145.0651 5600.0 149.0595 26000.0 151.0385 13000.0 151.0752 52000.0 157.0645 43000.0 160.0519 18000.0 161.0598 17000.0 161.0958 2900.0 163.0757 18000.0 165.0546 30000.0 169.3563 2700.0 172.0523 7100.0 173.5314 73000.0 174.0676 53000.0 175.0754 110000.0 176.0831 6400.0 177.0547 39000.0 177.0912 16000.0 178.1992 2400.0 179.0703 24000.0 183.2585 2700.0 187.0753 320000.0 187.095 4300.0 188.0831 11000.0 189.0909 97000.0 191.0687 3100.0 196.0529 3500.0 199.0753 32000.0 203.0856 57000.0 205.0859 8500.0 211.0753 120000.0 211.0961 3600.0 212.0828 3700.0 213.0896 2600.0 217.086 74000.0 219.0805 41000.0 220.0888 8800.0 221.0964 3900.0 225.0915 7600.0 227.0702 24000.0 228.0781 8100.0 231.0804 130000.0 232.0885 20000.0 233.0956 8600.0 237.0905 5900.0 239.0701 130000.0 239.2848 2300.0 240.078 94000.0 241.0862 30000.0 243.1026 13000.0 245.098 3800.0 247.0756 47000.0 248.083 120000.0 249.0906 17000.0 251.1062 44000.0 253.0876 3000.0 253.1236 6900.0 254.0936 3800.0 255.0648 120000.0 256.0727 95000.0 259.0752 54000.0 260.083 33000.0 261.0899 26000.0 262.0976 6500.0 263.0749 2400.0 263.1064 190000.0 263.9187 2500.0 264.0778 27000.0 265.0858 31000.0 268.0734 16000.0 269.0814 4300.0 270.0549 4400.0 270.0885 400000.0 270.123 3100.0 271.0636 3300.0 271.0964 190000.0 276.0783 140000.0 277.0861 55000.0 279.1019 110000.0 280.11 23000.0 281.0818 15000.0 281.1168 8900.0 282.0888 3500.0 283.0966 110000.0 283.1285 4100.0 290.0931 9100.0 291.1017 360000.0 292.1092 53000.0 293.0811 65000.0 294.0886 12000.0 295.0976 8700.0 296.1047 80000.0 297.112 22000.0 305.1161 22000.0 307.097 7100.0 308.1041 76000.0 311.1282 16000.0 323.1275 46000.0 342.3858 2400.0 END IONS BEGIN IONS SCANS=367 PEPMASS=326.1006 CHARGE=1 COLLISION_ENERGY=0.0 49.6342 2900.0 52.5462 2300.0 52.5946 2500.0 53.3046 2100.0 53.7681 2500.0 54.8921 2400.0 56.3631 3000.0 57.2522 2100.0 58.8825 2200.0 59.3613 2200.0 60.024 2400.0 60.6071 2500.0 63.7603 2400.0 66.1048 2600.0 67.3697 2300.0 67.8808 2100.0 70.4414 2400.0 76.3572 2300.0 86.0962 4100.0 90.374 2500.0 91.0542 3600.0 96.3688 2900.0 118.2078 2400.0 120.1182 2300.0 120.8873 2600.0 122.8808 2200.0 125.221 2400.0 126.8323 2600.0 131.0492 3800.0 132.0515 6200.0 133.0636 2700.0 134.0686 6800.0 135.0442 16000.0 136.0478 4700.0 137.0596 6300.0 138.0624 3000.0 138.0821 2700.0 148.5722 2400.0 149.688 8900.0 164.9702 2200.0 173.5237 25000.0 173.538 58000.0 174.8524 2400.0 178.7276 2500.0 198.7485 3000.0 233.8984 6500.0 236.6215 2200.0 238.876 2600.0 262.0975 2500.0 263.6006 3200.0 310.7369 2900.0 313.5652 2500.0 326.1016 2900.0 END IONS BEGIN IONS SCANS=368 PEPMASS=207.0656 CHARGE=1 COLLISION_ENERGY=0.0 41.0834 2600.0 41.607 2200.0 42.7031 2200.0 42.8012 2300.0 43.0178 5300.0 43.402 2700.0 44.4629 2400.0 44.9298 2400.0 45.0334 12000.0 45.4263 2500.0 45.5921 2100.0 46.8451 2600.0 47.1693 2500.0 48.9755 2300.0 52.2439 2400.0 52.7167 2400.0 54.9151 2300.0 55.0177 2500.0 55.0543 2100.0 57.9347 15000.0 58.0443 2200.0 58.354 2600.0 60.8936 2800.0 62.3356 2400.0 63.548 2300.0 65.0383 89000.0 69.8656 2700.0 72.1792 2100.0 73.0277 3400.0 74.9377 5600.0 76.0306 35000.0 77.0385 2400.0 78.0459 5100.0 79.0541 16000.0 80.0618 18000.0 83.0348 2300.0 83.0648 2200.0 83.3936 2700.0 84.9454 21000.0 87.1358 2600.0 89.0384 58000.0 89.0474 2300.0 90.0462 40000.0 91.054 990000.0 91.0608 5700.0 91.0638 3300.0 93.0332 5500.0 94.0415 7300.0 94.3595 2500.0 95.0487 18000.0 95.0851 5800.0 95.5979 2500.0 97.1903 2200.0 97.2974 2200.0 97.9539 3700.0 98.8623 2300.0 98.9613 36000.0 101.0376 2700.0 102.201 2700.0 102.956 39000.0 103.0539 13000.0 104.0253 110000.0 105.033 10000.0 106.0416 2400.0 107.0125 5500.0 107.0489 24000.0 108.0567 35000.0 108.8164 2200.0 114.9702 9100.0 115.1858 2400.0 115.9551 17000.0 115.9638 670000.0 116.8122 2400.0 116.9646 2800.0 116.9715 270000.0 117.0333 31000.0 118.041 120000.0 119.0393 12000.0 119.0489 710000.0 119.0591 6600.0 121.0281 86000.0 121.0645 18000.0 122.036 58000.0 126.9673 6100.0 129.0335 20000.0 129.9253 2500.0 130.0414 3500.0 131.7376 2400.0 132.0203 220000.0 133.0282 34000.0 133.9746 58000.0 134.0359 31000.0 135.0439 95000.0 136.0516 89000.0 137.9872 2500.0 145.0281 48000.0 146.036 140000.0 146.3251 2400.0 147.0438 590000.0 147.057 4700.0 148.0516 35000.0 149.0231 190000.0 150.0309 57000.0 150.6754 2300.0 151.0751 28000.0 155.9968 17000.0 157.0396 26000.0 158.4371 2800.0 160.0153 240000.0 162.031 110000.0 163.0388 66000.0 164.0466 190000.0 173.5287 67000.0 173.5415 22000.0 174.0312 51000.0 174.0483 2700.0 175.039 130000.0 176.0473 6400.0 177.0182 7800.0 178.0259 72000.0 179.0702 110000.0 182.0338 2400.0 185.39 2600.0 192.0416 45000.0 207.0652 6300.0 207.1392 2600.0 213.8795 2400.0 216.4771 2500.0 END IONS BEGIN IONS SCANS=369 PEPMASS=304.1186 CHARGE=1 COLLISION_ENERGY=0.0 48.633 2300.0 48.9736 2200.0 51.0326 2300.0 52.9779 2500.0 53.2022 2500.0 53.8098 2300.0 54.2511 2000.0 54.7943 2300.0 55.0705 2300.0 55.5773 2300.0 57.1463 2100.0 57.4336 2400.0 60.2156 2600.0 65.0388 2600.0 65.373 2900.0 65.5393 2200.0 65.792 2200.0 67.8124 2500.0 69.4741 2200.0 70.0338 2400.0 70.6001 2700.0 70.8153 2100.0 70.8819 2700.0 73.2773 2100.0 74.4616 2300.0 76.7121 2800.0 77.0388 2600.0 77.372 2300.0 79.5244 2300.0 80.4773 2700.0 80.8556 2800.0 85.6346 2300.0 85.7099 2500.0 88.2795 2500.0 88.4876 2500.0 90.0462 2200.0 90.7078 2500.0 91.0072 2400.0 91.054 360000.0 92.7396 2500.0 94.0407 2900.0 95.0493 2500.0 97.9611 2300.0 98.0598 180000.0 101.6927 2300.0 101.7305 2300.0 103.0542 18000.0 103.8009 2300.0 104.0253 9900.0 105.5568 2200.0 106.4819 2400.0 107.0126 2700.0 108.7093 2400.0 117.0334 5700.0 118.0411 5900.0 118.081 2600.0 119.0393 9600.0 119.0489 980000.0 119.0563 3700.0 119.0592 23000.0 121.0283 17000.0 122.0363 2500.0 124.8759 2300.0 129.0335 16000.0 132.0205 50000.0 132.7117 2100.0 133.0284 42000.0 133.065 3200.0 134.0365 5700.0 135.0442 4300.0 136.0521 6000.0 140.1956 2400.0 144.5055 2600.0 145.0283 68000.0 145.5869 2500.0 146.0361 27000.0 147.0438 1500000.0 147.0547 2400.0 148.0517 22000.0 149.0236 24000.0 149.0593 7000.0 150.0311 3600.0 151.0752 44000.0 157.0395 72000.0 157.7851 2400.0 160.0153 320000.0 161.0233 18000.0 162.0309 69000.0 163.0394 10000.0 164.0465 110000.0 164.8164 2800.0 173.5205 13000.0 173.5352 100000.0 174.0311 13000.0 175.0389 4200000.0 175.053 16000.0 175.0741 13000.0 176.0464 42000.0 177.0547 7600.0 178.0259 100000.0 179.0526 3500.0 179.0702 460000.0 180.8882 42000.0 181.1928 2300.0 184.0505 2900.0 190.8729 6700.0 192.0415 210000.0 193.0494 150000.0 201.2515 2400.0 202.1462 2600.0 204.2671 2500.0 207.0651 2700000.0 208.8828 190000.0 223.9633 2400.0 226.8935 140000.0 236.1299 2400.0 239.4833 2300.0 244.9993 2300.0 250.6964 2600.0 295.0185 2700.0 END IONS BEGIN IONS SCANS=370 PEPMASS=817.3925 CHARGE=1 COLLISION_ENERGY=0.0 72.0805 85000.0 72.3169 2600.0 78.2532 2400.0 78.8165 2000.0 78.8444 2800.0 83.7567 2500.0 87.5835 2600.0 91.9558 2400.0 94.7487 2300.0 94.906 2300.0 96.6049 2100.0 96.6998 2100.0 97.0757 23000.0 100.8767 2200.0 103.2123 2500.0 107.6285 2400.0 115.0862 130000.0 118.0644 9400.0 118.4597 2300.0 120.0062 2400.0 120.0804 650000.0 120.0908 5700.0 125.0706 99000.0 127.1812 2600.0 132.6114 2400.0 136.0755 22000.0 141.1074 2200.0 146.0597 160000.0 157.9588 2500.0 164.0705 38000.0 165.0539 2500.0 166.2442 2400.0 172.1119 140000.0 173.5188 5500.0 173.5262 120000.0 173.5397 100000.0 173.5595 2900.0 174.0547 3400.0 176.575 2500.0 178.9335 2200.0 181.7436 2300.0 182.0812 45000.0 183.7961 2400.0 187.1227 4600.0 210.4335 2600.0 213.7599 3000.0 215.1182 27000.0 215.5921 2300.0 216.1257 220000.0 217.1335 130000.0 218.3157 2500.0 219.1492 210000.0 222.4129 2300.0 230.9083 2500.0 234.6483 2500.0 236.1071 34000.0 238.1231 3200.0 240.8219 2300.0 243.1127 160000.0 245.1279 2600.0 247.1441 66000.0 248.2709 2500.0 249.3286 2100.0 249.7784 2400.0 258.9864 2600.0 261.4822 2500.0 265.086 9700.0 265.1333 44000.0 270.1129 5800.0 277.1336 39000.0 281.4485 2400.0 282.113 95000.0 288.7039 2500.0 293.1283 100000.0 300.7679 2400.0 309.1236 120000.0 321.1249 7200.0 329.15 64000.0 339.1355 5300.0 355.1292 66000.0 372.1725 4100.0 377.6888 2800.0 389.5153 2800.0 390.1815 68000.0 391.8868 2600.0 396.1969 5700.0 417.182 91000.0 429.181 52000.0 433.4802 2400.0 446.2092 4200.0 450.0389 2400.0 458.2078 29000.0 465.4306 2500.0 469.0143 2500.0 474.2012 28000.0 489.6938 2400.0 496.4499 2800.0 497.6633 2600.0 502.1977 290000.0 502.3789 2600.0 543.2617 62000.0 553.2457 21000.0 571.2565 27000.0 591.4986 3700.0 670.5769 2700.0 740.2322 2600.0 754.6219 2800.0 766.4645 2600.0 END IONS BEGIN IONS SCANS=371 PEPMASS=288.1236 CHARGE=1 COLLISION_ENERGY=0.0 47.7667 96000.0 47.7688 17000.0 48.5363 2200.0 53.0023 2700.0 55.0179 14000.0 55.7566 2600.0 56.6864 2100.0 57.7544 2900.0 59.2382 2100.0 59.9195 2100.0 65.0387 3100.0 68.8068 2500.0 69.2916 2100.0 72.8175 2200.0 77.0392 9000.0 78.6623 2900.0 79.0541 100000.0 79.3186 2300.0 79.5113 2400.0 89.039 14000.0 90.0465 12000.0 91.0542 110000.0 92.062 20000.0 93.2894 2500.0 94.1978 3700.0 95.0491 25000.0 95.6789 2500.0 98.06 77000.0 98.8762 3000.0 100.3736 2500.0 101.3351 2800.0 102.047 24000.0 102.6104 2700.0 103.0541 220000.0 103.0615 2300.0 105.0335 61000.0 105.0698 320000.0 107.0492 9100.0 107.3987 2900.0 110.0218 2100.0 115.0542 37000.0 117.0334 16000.0 117.0701 4400.0 118.0413 55000.0 119.049 190000.0 120.0569 150000.0 121.0649 6600.0 127.4061 3400.0 130.041 23000.0 131.0492 39000.0 132.0455 3300.0 132.0569 360000.0 132.0685 8500.0 133.0283 140000.0 133.0647 350000.0 135.0803 120000.0 137.0599 7200.0 143.0606 10000.0 146.0363 87000.0 147.0441 150000.0 148.0518 1300000.0 148.0652 4900.0 158.0365 6900.0 159.0441 18000.0 160.0398 2200.0 160.0519 690000.0 160.0667 4500.0 161.0597 200000.0 163.0433 47000.0 163.0504 11000.0 163.0753 6000000.0 163.1073 26000.0 173.0594 10000.0 173.525 14000.0 173.5309 47000.0 173.5423 15000.0 173.9314 2500.0 176.0289 4400.0 176.047 800000.0 176.0647 3800.0 178.0876 3600.0 190.915 3800.0 191.0178 15000.0 191.0293 160000.0 191.0379 73000.0 191.0702 27000000.0 191.1019 100000.0 191.1114 180000.0 191.123 63000.0 191.1345 33000.0 191.1455 8900.0 192.0733 27000.0 226.5506 2400.0 246.1135 13000.0 256.3578 3400.0 287.9934 2900.0 294.3731 2700.0 END IONS BEGIN IONS SCANS=372 PEPMASS=333.1814 CHARGE=1 COLLISION_ENERGY=0.0 54.1663 2100.0 56.345 2500.0 65.4677 2300.0 69.4984 2300.0 78.9769 2300.0 87.9058 2600.0 90.494 2700.0 97.1174 2600.0 98.06 9200.0 100.9936 2500.0 101.8991 2200.0 103.054 3300.0 105.0696 14000.0 108.4807 2300.0 111.0092 2400.0 119.0487 2600.0 120.0567 3400.0 129.6854 2700.0 132.0567 6500.0 133.0646 17000.0 135.0806 5800.0 135.4077 2700.0 147.0431 4000.0 147.5118 2500.0 148.0514 62000.0 153.5185 2400.0 155.3859 2800.0 156.6935 2300.0 159.985 2600.0 160.0516 47000.0 161.0597 11000.0 163.0752 380000.0 163.0898 5200.0 173.5239 58000.0 173.5342 41000.0 173.5437 36000.0 176.0467 65000.0 191.0289 10000.0 191.0701 6900000.0 191.0857 23000.0 191.1017 11000.0 191.1111 36000.0 194.3326 2400.0 199.2266 2400.0 228.8761 12000.0 230.1275 2500.0 234.0649 2400.0 264.8114 2500.0 268.6578 2400.0 273.23 3300.0 286.8587 2700.0 298.4527 2200.0 330.6624 2900.0 END IONS BEGIN IONS SCANS=373 PEPMASS=310.1056 CHARGE=1 COLLISION_ENERGY=0.0 49.4338 2000.0 54.9309 2200.0 58.4139 2300.0 73.0282 2900.0 74.5549 2100.0 75.753 3000.0 77.8686 2900.0 79.8749 2500.0 88.2425 2300.0 88.7537 2600.0 92.556 2400.0 93.0702 2900.0 95.6981 2400.0 101.3768 2900.0 109.4398 2500.0 112.5432 2400.0 120.0337 2900.0 120.0417 130000.0 125.1018 3000.0 144.3583 2700.0 148.0505 2800.0 168.8233 2500.0 173.526 20000.0 173.5358 27000.0 173.544 7000.0 190.5068 2500.0 191.0701 61000.0 199.3271 3000.0 217.6597 2400.0 219.8335 2200.0 222.6232 2200.0 228.9855 2300.0 231.9217 2300.0 241.1103 4500.0 250.7983 2300.0 250.8741 2700.0 252.1733 2600.0 254.2963 2400.0 280.7161 2600.0 302.3255 2400.0 310.1055 93000.0 END IONS BEGIN IONS SCANS=374 PEPMASS=597.2217 CHARGE=1 COLLISION_ENERGY=0.0 75.3085 2600.0 80.3049 2600.0 99.1469 2400.0 101.0954 2700.0 101.1445 2700.0 105.6455 2700.0 114.9495 2200.0 120.0415 20000.0 134.4387 2400.0 137.1543 2500.0 145.6323 2600.0 149.6844 5700.0 173.5236 2700.0 173.534 58000.0 187.9825 2800.0 191.0987 2300.0 252.6109 2300.0 310.0628 5400.0 310.105 870000.0 314.4269 3000.0 462.7966 2600.0 510.0106 2400.0 END IONS BEGIN IONS SCANS=375 PEPMASS=403.1759 CHARGE=1 COLLISION_ENERGY=0.0 55.0178 3000.0 55.0538 2800.0 55.3637 2800.0 55.591 2200.0 57.1593 2200.0 57.6603 2400.0 63.4999 2400.0 65.0389 2100.0 66.8657 2200.0 68.2745 2200.0 70.0778 2500.0 72.2075 2300.0 72.9382 2300.0 74.7943 2600.0 79.0542 19000.0 79.8733 2100.0 80.0614 2400.0 81.0334 2000000.0 81.038 9300.0 81.0701 2600.0 81.8281 2300.0 82.2027 2200.0 84.0786 3300.0 87.9496 2700.0 88.6377 2600.0 90.21 2200.0 91.0544 14000.0 95.0491 10000.0 96.1769 2300.0 97.727 2500.0 103.002 2500.0 104.5387 2200.0 105.0443 2900.0 106.7701 3100.0 107.0489 13000.0 109.0644 6800.0 117.0701 2500.0 119.0141 2600.0 121.0648 36000.0 121.6321 2700.0 122.0359 12000.0 123.5267 2200.0 123.8202 2800.0 125.8659 2200.0 126.1567 2700.0 127.0393 3100.0 129.07 4000.0 135.0434 2600.0 136.0518 170000.0 137.0596 35000.0 138.0673 6500.0 139.0751 83000.0 140.2473 2200.0 140.4349 2300.0 143.0851 13000.0 145.0649 17000.0 146.0726 13000.0 147.0803 17000.0 147.9903 2400.0 148.8617 2800.0 149.06 19000.0 151.0604 3900.0 151.0646 3500.0 151.0752 1700000.0 151.0892 11000.0 155.07 68000.0 157.0644 2900.0 158.0725 22000.0 159.0802 28000.0 160.0889 8400.0 161.0595 37000.0 161.096 250000.0 163.0754 3000.0 164.0465 2700.0 165.0223 4100.0 165.0546 3700000.0 165.067 3900.0 165.0882 18000.0 167.0704 59000.0 167.1341 2300.0 168.1918 2400.0 171.0805 6100.0 172.0883 200000.0 173.0597 19000.0 173.5259 15000.0 173.5344 110000.0 173.5444 6000.0 174.0678 49000.0 175.0755 68000.0 175.1121 2800.0 175.3183 2500.0 176.0817 3300.0 177.091 37000.0 177.3208 2300.0 179.0702 130000.0 181.0859 3100.0 186.0676 39000.0 188.083 200000.0 189.0909 240000.0 189.1108 4500.0 190.0621 35000.0 191.0702 16000.0 191.1065 96000.0 195.0646 3400.0 198.0661 3900.0 201.091 87000.0 202.062 34000.0 202.0988 18000.0 203.0724 17000.0 203.1066 390000.0 204.0779 13000.0 205.086 240000.0 214.0628 8700.0 217.0613 6700.0 217.0858 940000.0 217.1105 14000.0 219.1016 92000.0 224.9516 2300.0 229.0859 120000.0 231.9662 2800.0 235.0975 7000.0 243.6152 2400.0 247.0963 94000.0 271.0965 19000.0 274.7761 2600.0 275.1068 4000.0 277.0859 2600.0 283.0965 13000.0 284.1025 2500.0 291.1014 15000.0 292.1095 28000.0 293.1175 33000.0 294.1267 2600.0 299.0915 91000.0 303.1012 17000.0 304.1104 8400.0 305.1177 42000.0 306.1247 33000.0 307.0952 3000.0 307.1336 2600.0 308.1053 5500.0 308.1413 55000.0 309.1125 18000.0 310.1199 16000.0 312.1357 14000.0 312.2518 2500.0 313.1069 85000.0 313.1432 3900.0 314.1149 540000.0 315.1194 2900.0 318.1244 48000.0 319.0957 15000.0 320.1041 3400.0 321.1127 42000.0 322.1191 6900.0 323.1267 21000.0 324.1356 180000.0 325.1051 3200.0 325.144 16000.0 327.1601 7700.0 334.1202 20000.0 335.1275 36000.0 336.1354 72000.0 337.1041 10000.0 337.1436 59000.0 337.6057 3100.0 339.1597 17000.0 340.1301 84000.0 349.1431 64000.0 352.1295 23000.0 354.147 22000.0 355.1533 47000.0 367.153 18000.0 END IONS BEGIN IONS SCANS=376 PEPMASS=448.2337 CHARGE=1 COLLISION_ENERGY=0.0 62.2914 2100.0 68.1861 2300.0 81.0331 250000.0 81.0389 4300.0 97.4606 2600.0 107.5782 2600.0 107.9335 2300.0 125.2783 2400.0 136.0518 8300.0 137.5106 2100.0 138.9126 2300.0 139.0759 3200.0 151.0751 250000.0 157.781 2600.0 161.0959 33000.0 165.0545 370000.0 165.0701 5500.0 167.0702 5100.0 172.0882 14000.0 173.5215 9400.0 173.5347 66000.0 175.0758 3800.0 179.0709 21000.0 188.0833 16000.0 189.0909 21000.0 191.1068 8300.0 201.0899 7800.0 203.1068 79000.0 205.086 28000.0 217.086 120000.0 217.1077 3700.0 219.1015 37000.0 229.0856 18000.0 231.1733 2400.0 235.0963 3500.0 247.0964 31000.0 251.3038 3300.0 312.1368 2900.0 313.1076 2900.0 314.1146 57000.0 324.1354 16000.0 335.1293 3700.0 336.1356 2500.0 337.144 4800.0 339.1591 5300.0 340.134 2500.0 349.1424 13000.0 355.1538 22000.0 367.1517 4600.0 END IONS BEGIN IONS SCANS=377 PEPMASS=219.102 CHARGE=1 COLLISION_ENERGY=0.0 43.0178 12000.0 43.2266 2300.0 44.306 2500.0 45.0335 5400.0 45.768 2200.0 45.823 2100.0 47.91 2200.0 47.9522 2900.0 48.0309 2200.0 48.2129 2400.0 48.7421 2500.0 49.3627 2100.0 51.0479 2400.0 51.559 2700.0 52.3898 2500.0 55.1382 2300.0 55.9341 30000.0 56.6835 2500.0 56.9348 2400.0 57.0334 20000.0 59.7176 2900.0 61.5548 2300.0 61.8399 2300.0 65.1483 2200.0 65.4644 2400.0 67.0541 15000.0 71.5316 2400.0 72.7044 2800.0 74.0248 2400.0 74.4648 2400.0 80.1208 2300.0 81.0332 12000.0 83.2669 2700.0 84.6706 2200.0 85.1419 2300.0 86.454 2600.0 86.6676 2600.0 91.0539 160000.0 92.1245 2400.0 92.3536 2400.0 93.0697 3300.0 93.0942 2300.0 94.3477 2500.0 95.669 2300.0 101.2464 2300.0 103.0544 26000.0 105.0695 16000.0 115.0541 120000.0 116.0619 42000.0 117.0696 44000.0 119.0855 6800.0 120.2918 2500.0 121.1008 2700.0 123.4537 2500.0 124.0336 2900.0 127.8521 2500.0 128.0619 130000.0 128.9506 11000.0 129.0697 750000.0 129.0816 3200.0 130.0777 43000.0 131.049 110000.0 131.0585 2200.0 131.0747 7400.0 131.0853 650000.0 131.0966 4300.0 133.1008 7100.0 135.6893 3000.0 135.9447 2900.0 136.0849 2300.0 137.0596 73000.0 140.0625 3000.0 141.0571 3900.0 141.0697 660000.0 142.0774 6800.0 143.0492 23000.0 143.0854 39000.0 144.0569 100000.0 145.0646 96000.0 146.0725 83000.0 148.0518 11000.0 149.5484 2700.0 149.6879 11000.0 151.0757 6400.0 153.0689 3400.0 155.0612 3500.0 155.085 2500.0 156.0564 7400.0 157.0646 310000.0 157.0789 5200.0 158.0726 390000.0 158.0873 4500.0 159.0439 37000.0 159.0804 250000.0 159.0958 4400.0 159.3424 2900.0 160.0519 88000.0 161.0596 22000.0 161.096 58000.0 163.0754 24000.0 163.9802 2400.0 164.7654 2800.0 168.0571 13000.0 169.0647 200000.0 170.0728 130000.0 170.5052 2600.0 171.0449 2900.0 171.0806 11000.0 173.0599 79000.0 173.0963 10000.0 173.5233 5600.0 173.5311 110000.0 173.5413 15000.0 174.0498 14000.0 174.0676 1400000.0 174.0852 13000.0 175.0194 2300.0 175.0756 130000.0 181.6154 2300.0 183.0809 5200.0 185.0588 8500.0 186.0676 350000.0 187.0748 7000.0 188.0833 82000.0 189.0911 620000.0 189.1108 11000.0 191.0706 9500.0 191.1064 5400.0 192.5181 2200.0 195.9437 2700.0 201.091 310000.0 202.219 3100.0 203.1434 29000.0 206.1606 2300.0 206.8612 3000.0 211.9441 2800.0 219.102 35000.0 219.1742 37000.0 END IONS BEGIN IONS SCANS=378 PEPMASS=363.1917 CHARGE=1 COLLISION_ENERGY=0.0 51.8203 2200.0 52.3305 2400.0 52.8298 2100.0 53.9746 2100.0 55.2682 9300.0 55.2703 160000.0 55.3962 2300.0 55.5456 2300.0 56.3397 2100.0 56.9465 2000.0 57.3988 2400.0 58.7806 2800.0 59.3167 2400.0 59.4822 2100.0 60.6534 2300.0 61.9387 2200.0 63.5308 2200.0 63.5479 2700.0 65.0849 2400.0 66.8534 2100.0 68.1353 3000.0 71.5048 2600.0 71.9737 2000.0 75.3476 2700.0 76.8605 2500.0 77.5116 2600.0 81.2918 2500.0 82.4992 2400.0 84.6129 2700.0 85.8376 2500.0 86.2876 2400.0 86.4746 2700.0 88.1579 2200.0 88.4618 2400.0 91.0549 2400.0 92.1261 2300.0 94.82 2500.0 95.7111 2100.0 95.8549 2200.0 96.8323 2200.0 98.0543 3200.0 98.0599 250000.0 98.2282 2300.0 100.6527 2300.0 103.054 2600.0 105.07 4500.0 109.0824 2300.0 109.4553 2200.0 111.0495 3500.0 115.0528 2600.0 115.5218 2900.0 118.0413 3100.0 118.8621 2300.0 119.0487 13000.0 119.6706 2800.0 120.446 3000.0 122.0493 2500.0 127.4205 2300.0 127.5669 2300.0 127.7535 3000.0 130.0412 19000.0 130.2559 2500.0 131.0493 8300.0 132.0571 6300.0 133.0305 2200.0 133.0649 53000.0 133.6557 2800.0 134.8226 2400.0 135.0444 24000.0 138.0623 2400.0 138.9653 2700.0 143.8658 2500.0 144.2828 2800.0 145.776 2300.0 147.0441 160000.0 148.0516 2700.0 149.0598 11000.0 150.0675 23000.0 155.4127 2200.0 160.0519 38000.0 161.0596 100000.0 162.0675 770000.0 162.0832 8600.0 163.039 140000.0 163.0752 110000.0 165.0917 34000.0 165.192 2300.0 167.0701 22000.0 168.3163 2200.0 169.7234 3200.0 172.2128 2300.0 173.5235 8500.0 173.5328 120000.0 173.5415 18000.0 174.0312 67000.0 175.0391 110000.0 176.047 140000.0 177.0548 140000.0 177.071 2400.0 178.0626 570000.0 178.3077 2700.0 178.5753 2900.0 178.5848 2600.0 179.1389 2700.0 181.5943 2600.0 188.0468 57000.0 189.0369 8000.0 189.0547 580000.0 189.0721 2900.0 190.022 3900.0 190.0426 4500.0 190.0624 5400000.0 190.0795 42000.0 191.014 17000.0 191.0339 940000.0 191.0702 480000.0 192.0413 44000.0 193.0649 7300.0 193.086 4600000.0 204.9375 2600.0 205.0497 19000.0 206.0344 27000.0 206.0575 2200000.0 206.0802 21000.0 214.1625 2700.0 215.1209 3000.0 216.546 2400.0 220.9741 3700.0 220.9877 4200.0 221.0021 3800.0 221.0155 32000.0 221.0301 270000.0 221.0406 160000.0 221.0809 44000000.0 221.0999 290000.0 221.1201 210000.0 221.1319 300000.0 221.1464 110000.0 221.1605 15000.0 221.1742 5400.0 221.2185 3000.0 226.6671 2300.0 232.5295 2500.0 247.1748 2200.0 255.4262 2700.0 270.127 3300.0 276.1206 4200.0 289.6578 2500.0 291.0976 2300.0 296.6392 2700.0 317.5465 2800.0 330.8629 2500.0 332.3331 2600.0 332.9954 2600.0 349.9943 2800.0 END IONS BEGIN IONS SCANS=379 PEPMASS=356.0898 CHARGE=1 COLLISION_ENERGY=0.0 58.8133 2300.0 60.7576 2200.0 62.3498 2400.0 64.3278 2300.0 70.205 2700.0 73.7983 2200.0 81.1371 2300.0 81.6448 2200.0 81.6874 2400.0 90.8777 2100.0 121.7889 2300.0 123.1827 2400.0 136.8218 2700.0 142.4376 2300.0 149.6846 4800.0 149.6948 3400.0 153.0936 2500.0 158.4981 2400.0 164.0692 2400.0 173.5256 37000.0 173.54 25000.0 195.4477 2500.0 220.8724 2300.0 280.2412 2500.0 309.901 3900.0 312.8931 2700.0 322.5323 2600.0 325.575 2900.0 328.6613 2400.0 END IONS BEGIN IONS SCANS=380 PEPMASS=206.0577 CHARGE=1 COLLISION_ENERGY=0.0 43.5453 2500.0 43.7969 2200.0 45.0334 8300.0 49.5665 2200.0 51.9975 2600.0 52.8893 2400.0 55.9342 3000.0 60.3137 2000.0 62.1796 2100.0 63.164 2700.0 63.6538 2100.0 73.0282 59000.0 75.3369 2100.0 77.037 2100.0 78.046 4100.0 79.054 9300.0 88.0752 2500.0 91.0538 9400.0 98.5197 2400.0 102.0462 7700.0 103.054 4200.0 104.062 6200.0 107.0489 42000.0 108.2958 2200.0 110.1237 2300.0 117.0329 3200.0 118.0411 5200.0 118.9624 2700.0 119.0491 5200.0 120.0206 3700.0 120.0569 4900.0 121.0646 13000.0 124.9601 2400.0 130.0412 16000.0 131.049 15000.0 132.0566 5000.0 133.028 15000.0 135.0224 2600.0 135.0438 49000.0 141.5249 2800.0 141.9778 2400.0 145.029 5300.0 147.0441 7700.0 149.0594 16000.0 149.6801 3100.0 149.6907 5300.0 152.8878 2300.0 161.2869 2700.0 163.0388 120000.0 173.5337 42000.0 175.0385 2600.0 176.0469 2700.0 177.0544 5100.0 178.0626 26000.0 179.9739 2300.0 191.0338 32000.0 206.0564 3900.0 206.1904 13000.0 END IONS BEGIN IONS SCANS=381 PEPMASS=321.142 CHARGE=1 COLLISION_ENERGY=0.0 52.5793 2200.0 56.2694 2100.0 58.5989 2100.0 58.8263 2200.0 60.3393 2700.0 60.4973 2700.0 62.6963 2500.0 75.6257 2400.0 76.8995 2300.0 77.8962 2500.0 88.35 2500.0 90.7642 2500.0 98.965 2600.0 101.1733 2400.0 103.691 2300.0 112.2681 2300.0 162.0667 4800.0 163.0705 15000.0 163.4186 2300.0 164.0417 2300.0 165.0754 7800.0 173.5246 17000.0 173.5353 13000.0 173.5435 7800.0 178.0629 3100.0 179.0654 8400.0 180.067 13000.0 181.0706 10000.0 181.1276 2300.0 190.0613 22000.0 191.065 57000.0 192.0373 5100.0 192.0677 67000.0 193.0391 12000.0 193.0704 62000.0 193.0865 6900.0 194.0416 13000.0 194.0891 40000.0 195.0914 42000.0 195.2741 2300.0 196.0939 51000.0 207.0606 13000.0 208.0625 30000.0 209.0656 36000.0 221.081 27000.0 222.0842 83000.0 223.0864 160000.0 224.089 240000.0 244.169 2600.0 END IONS BEGIN IONS SCANS=382 PEPMASS=426.0667 CHARGE=1 COLLISION_ENERGY=0.0 55.0238 2600.0 58.4174 2300.0 62.3204 2100.0 66.7496 2300.0 67.7599 2400.0 69.5474 2200.0 88.3796 2400.0 145.3866 2900.0 161.0599 2700.0 161.3634 2300.0 162.067 14000.0 173.5254 24000.0 173.5415 13000.0 177.0546 2600.0 178.0624 15000.0 189.0547 11000.0 190.0622 140000.0 191.0337 27000.0 191.0697 12000.0 193.0858 100000.0 205.0859 11000.0 206.0574 47000.0 221.0808 650000.0 222.0836 12000.0 249.8274 2400.0 283.7291 2300.0 325.1529 2500.0 367.7258 2600.0 END IONS BEGIN IONS SCANS=383 PEPMASS=435.0615 CHARGE=1 COLLISION_ENERGY=0.0 57.1918 2400.0 73.2208 2500.0 76.8119 2100.0 81.0336 3900.0 84.0649 2500.0 94.3244 2400.0 98.8773 2400.0 129.2353 2300.0 145.5167 2300.0 151.2013 2400.0 162.0673 13000.0 173.5239 14000.0 173.5365 25000.0 173.5424 5400.0 175.0389 2700.0 177.0549 12000.0 178.0627 6100.0 179.0706 7400.0 189.0546 6400.0 190.0625 84000.0 191.0339 16000.0 191.069 20000.0 192.0782 18000.0 193.086 61000.0 194.0935 30000.0 201.8911 2400.0 205.0497 93000.0 206.0578 29000.0 207.0641 2800.0 220.0739 25000.0 221.081 1400000.0 222.0856 87000.0 234.0756 13000.0 234.9964 2200.0 236.0681 32000.0 246.1118 6500.0 246.5889 2500.0 250.9998 7400.0 253.432 2300.0 258.1121 2700.0 260.1287 9300.0 261.136 3700.0 272.1283 76000.0 274.0726 2300.0 274.1075 370000.0 274.1424 3200.0 278.9955 17000.0 286.1079 11000.0 288.1227 2800.0 289.0937 10000.0 289.131 350000.0 302.1025 180000.0 315.0192 2800.0 317.0823 14000.0 317.1259 420000.0 317.1577 3100.0 330.0425 18000.0 333.0322 3100.0 369.5236 2800.0 396.4172 2700.0 END IONS BEGIN IONS SCANS=384 PEPMASS=657.2424 CHARGE=1 COLLISION_ENERGY=0.0 66.523 4900.0 66.5434 2900.0 68.3956 2900.0 68.7513 2700.0 82.1912 2600.0 83.68 2400.0 85.0254 9900.0 85.0294 45000.0 86.6715 2400.0 87.8326 2500.0 92.4336 2300.0 93.0154 2400.0 93.654 2400.0 95.3612 2300.0 96.2362 5800.0 108.8827 2800.0 117.9991 2500.0 120.0325 5400.0 120.0414 310000.0 120.6659 2400.0 121.3445 2900.0 147.3396 5000.0 151.0733 3100.0 158.8676 2800.0 173.517 5100.0 173.5346 150000.0 173.548 12000.0 192.3146 2300.0 216.2906 3300.0 219.4858 2600.0 221.0813 50000.0 232.403 2700.0 236.4835 2700.0 240.4857 4900.0 242.0778 4500.0 243.063 42000.0 244.8969 3500.0 306.69 2300.0 318.4491 2300.0 325.0921 110000.0 327.8982 3300.0 335.0405 2300.0 339.9919 10000.0 340.0187 100000.0 340.0382 29000.0 340.1151 16000000.0 340.1897 60000.0 340.2125 96000.0 340.2397 16000.0 483.8683 2700.0 504.1042 2400.0 604.2342 2400.0 612.3163 2800.0 636.7711 2400.0 END IONS BEGIN IONS SCANS=385 PEPMASS=317.1267 CHARGE=1 COLLISION_ENERGY=0.0 49.0768 2200.0 52.8525 2500.0 53.0386 12000.0 56.5067 2100.0 58.7247 2300.0 64.292 2100.0 72.9926 2300.0 75.2511 2400.0 81.0335 56000.0 81.0381 3000.0 82.4304 2300.0 83.9783 2200.0 91.054 8200.0 93.2076 2500.0 96.0439 2700.0 98.06 52000.0 98.337 2400.0 105.93 2300.0 111.4918 2600.0 113.9165 2200.0 117.0333 15000.0 118.0418 3100.0 118.0655 3100.0 119.049 12000.0 125.2784 2200.0 129.6453 2700.0 131.0491 3000.0 132.0569 2900.0 133.0649 12000.0 135.0435 5700.0 145.0283 11000.0 146.0599 36000.0 147.044 46000.0 148.0526 3200.0 149.0595 39000.0 150.0667 2900.0 151.0752 9400.0 153.6581 2300.0 157.5151 2600.0 159.837 2500.0 161.0595 27000.0 162.0676 140000.0 162.1171 2300.0 163.039 34000.0 163.0753 27000.0 166.0442 2700.0 167.0716 3200.0 173.5208 5300.0 173.5294 41000.0 173.5401 22000.0 174.0311 11000.0 174.0551 31000.0 175.0391 38000.0 176.0469 24000.0 176.0714 3600.0 177.0548 250000.0 178.0626 110000.0 178.0866 25000.0 178.7818 2600.0 179.0705 68000.0 189.0547 82000.0 190.0624 750000.0 191.0339 140000.0 191.0703 81000.0 192.0423 3900.0 192.0782 50000.0 193.0653 11000.0 193.086 590000.0 193.1067 11000.0 194.094 38000.0 195.0656 50000.0 202.3645 2700.0 203.2681 2200.0 205.0495 280000.0 206.0575 280000.0 206.0798 16000.0 207.0651 2800.0 214.0866 18000.0 217.0863 3300.0 220.0725 3400.0 221.0322 4100.0 221.0809 2800000.0 221.1326 3200.0 222.0756 8800.0 229.8398 2800.0 230.241 3400.0 231.0893 14000.0 234.076 69000.0 236.0673 24000.0 239.0942 4700.0 242.0813 26000.0 244.0967 3200.0 246.1123 55000.0 253.2927 2400.0 256.0964 8200.0 258.1113 7900.0 259.0846 2900.0 270.0766 6400.0 271.0864 2800.0 272.1283 60000.0 274.0725 10000.0 274.1075 1100000.0 274.1418 4900.0 286.1077 18000.0 288.1251 3200.0 289.1312 51000.0 302.1025 64000.0 317.1243 7500.0 END IONS BEGIN IONS SCANS=386 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36000000.0 175.0746 280000.0 175.0849 52000.0 175.0943 24000.0 176.0461 78000.0 177.0174 6000.0 177.055 61000.0 178.0263 6400.0 179.0703 670000.0 186.2518 3100.0 189.0568 7800.0 191.0334 9700.0 192.0213 31000.0 192.0418 2000000.0 192.0623 43000.0 193.0497 480000.0 195.0605 2500.0 197.5588 5900.0 199.0185 3600.0 206.602 5900.0 207.0192 67000.0 207.0297 43000.0 207.0653 23000000.0 207.1112 160000.0 207.1238 20000.0 228.1024 6900.0 230.1188 6900.0 248.1278 76000.0 258.1115 2600.0 290.1391 76000.0 299.0626 3400.0 END IONS BEGIN IONS SCANS=397 PEPMASS=207.0656 CHARGE=1 COLLISION_ENERGY=0.0 43.0178 17000.0 43.6421 2500.0 45.0333 11000.0 47.6106 2300.0 48.0491 2300.0 49.3235 2400.0 49.3809 2300.0 52.6281 2200.0 54.5292 2100.0 55.546 2100.0 56.4569 2500.0 57.1696 2100.0 57.9346 16000.0 58.0927 2200.0 62.6561 2700.0 65.0383 26000.0 65.2119 2600.0 70.3697 2500.0 72.3899 2400.0 72.6283 2300.0 74.3669 2500.0 74.9375 12000.0 79.0541 2900.0 81.0697 2500.0 84.8907 3100.0 84.9455 25000.0 87.4574 2400.0 89.0384 11000.0 91.0538 490000.0 91.0607 5100.0 92.9478 4300.0 95.0853 8000.0 95.648 2200.0 96.0467 2300.0 97.9531 30000.0 98.9611 52000.0 101.0383 5100.0 101.9474 2400.0 102.8603 2800.0 102.9559 27000.0 103.0538 2300.0 104.025 2300.0 104.2121 2300.0 107.0493 10000.0 108.0567 6100.0 109.8374 2300.0 114.9709 2400.0 115.9551 9100.0 115.9637 520000.0 115.9733 5200.0 116.9716 200000.0 117.0335 2500.0 118.0411 5800.0 119.0488 320000.0 119.0852 3300.0 121.064 3100.0 124.5875 2200.0 126.9676 5500.0 129.0333 10000.0 129.0442 3100.0 130.7546 2600.0 132.0203 41000.0 133.9744 40000.0 135.0438 21000.0 136.0517 12000.0 139.9842 2700.0 140.7319 2100.0 142.6509 2200.0 145.0279 9700.0 146.0356 6300.0 147.0437 190000.0 149.0231 41000.0 155.9966 6100.0 157.0397 29000.0 162.0304 3000.0 163.1344 2800.0 164.0469 18000.0 173.5269 32000.0 173.5389 26000.0 175.0389 30000.0 179.07 26000.0 201.4166 2500.0 207.3335 2500.0 END IONS BEGIN IONS SCANS=398 PEPMASS=365.2073 CHARGE=1 COLLISION_ENERGY=0.0 63.3032 2700.0 65.0202 2200.0 73.3875 2700.0 89.2609 2200.0 100.0752 15000.0 100.1044 2300.0 105.7094 2500.0 106.3752 2100.0 119.141 2500.0 131.266 2500.0 135.0435 2400.0 148.4705 2300.0 149.6824 3800.0 149.6896 11000.0 162.0671 32000.0 163.0394 3700.0 173.534 20000.0 176.0474 2700.0 177.0556 2300.0 178.0622 19000.0 189.0542 22000.0 190.0622 230000.0 191.0337 37000.0 191.0699 20000.0 193.0673 2300.0 193.0857 180000.0 206.0574 86000.0 217.027 2900.0 221.0808 1900000.0 END IONS BEGIN IONS SCANS=399 PEPMASS=221.0811 CHARGE=1 COLLISION_ENERGY=0.0 43.0178 2400.0 44.3567 2100.0 44.6717 2100.0 47.3494 2600.0 47.7978 2100.0 51.9672 2700.0 54.1719 2300.0 54.6339 2300.0 61.0637 2400.0 64.2489 3000.0 64.5483 2300.0 65.6664 2500.0 65.6799 2500.0 67.8384 2400.0 72.8676 2400.0 75.4007 2300.0 76.7404 2100.0 77.8684 2100.0 78.0462 16000.0 78.7252 2300.0 79.0538 33000.0 83.2383 2200.0 88.2592 2300.0 91.0539 46000.0 93.995 2400.0 94.2427 2300.0 94.7723 2700.0 95.0488 2700.0 98.8352 2300.0 101.7137 2400.0 101.8481 2400.0 102.046 52000.0 103.0539 25000.0 104.0618 30000.0 105.0695 19000.0 107.0487 46000.0 118.0411 40000.0 118.0498 2800.0 119.0489 96000.0 120.0567 7100.0 121.0644 20000.0 122.0721 9400.0 130.0411 96000.0 131.0489 41000.0 132.0202 6200.0 132.0566 74000.0 133.0282 16000.0 133.0647 32000.0 135.0437 140000.0 138.8042 2700.0 140.0429 2700.0 145.0279 14000.0 145.8424 2500.0 146.0357 10000.0 147.0438 320000.0 147.057 4300.0 148.0517 53000.0 148.0634 2800.0 149.0595 66000.0 149.1349 2300.0 150.0674 25000.0 157.0405 2500.0 157.6472 2400.0 158.0368 6100.0 159.0085 2900.0 159.0442 13000.0 160.0517 83000.0 161.0232 7800.0 161.0595 64000.0 162.053 4300.0 162.0674 220000.0 163.0232 8900.0 163.0388 390000.0 163.0754 42000.0 168.7683 2900.0 170.0955 2500.0 173.5337 44000.0 173.5421 4600.0 174.0312 21000.0 174.9849 22000.0 175.039 200000.0 176.0469 52000.0 177.0547 63000.0 178.0624 200000.0 188.0467 32000.0 189.0546 7600.0 190.0624 270000.0 190.0809 4300.0 191.0338 130000.0 191.0692 12000.0 193.0859 130000.0 205.0502 11000.0 206.0575 61000.0 209.3329 2300.0 221.0809 19000.0 END IONS BEGIN IONS SCANS=400 PEPMASS=320.1499 CHARGE=1 COLLISION_ENERGY=0.0 49.1466 2300.0 52.6124 2400.0 53.3565 2100.0 54.3722 2300.0 55.0592 2300.0 55.2699 13000.0 64.6503 2400.0 71.1124 2300.0 72.1466 2900.0 77.3549 2700.0 77.7207 2600.0 79.8426 2400.0 83.2423 2200.0 91.0539 3800.0 100.0755 59000.0 102.0461 7700.0 103.0541 4900.0 105.0696 6500.0 106.6527 2500.0 107.3761 2600.0 111.3102 2800.0 115.9145 2300.0 116.6334 2400.0 118.0415 8000.0 119.049 18000.0 130.0411 27000.0 131.0488 7200.0 132.0565 19000.0 133.0646 31000.0 135.044 34000.0 139.8325 2700.0 140.6259 2500.0 141.7897 2700.0 146.0355 2800.0 147.0439 120000.0 148.0517 19000.0 149.0594 21000.0 150.0673 22000.0 154.6445 2500.0 159.0439 9100.0 160.0517 36000.0 161.0595 63000.0 162.0674 400000.0 162.083 12000.0 163.0388 130000.0 163.0752 73000.0 165.0905 13000.0 165.3507 2400.0 167.0705 11000.0 167.1555 2500.0 173.5247 12000.0 173.5348 39000.0 174.0313 41000.0 175.0389 100000.0 176.0469 89000.0 177.0546 67000.0 178.0624 350000.0 179.078 2300.0 181.4243 2800.0 188.047 33000.0 189.0368 4400.0 189.0545 170000.0 190.0221 3200.0 190.0623 2000000.0 190.0777 18000.0 190.0831 6000.0 191.0139 9300.0 191.0337 410000.0 191.07 160000.0 192.0415 20000.0 193.0446 3200.0 193.0651 4900.0 193.0858 1500000.0 193.1036 17000.0 205.0501 12000.0 206.0346 15000.0 206.0573 780000.0 206.08 20000.0 210.5402 2600.0 221.0308 8700.0 221.0807 5000000.0 221.0999 38000.0 221.1199 10000.0 221.1315 16000.0 222.0841 3200.0 223.0864 5400.0 255.8816 4100.0 260.4284 2600.0 272.764 2800.0 277.1261 2700.0 END IONS BEGIN IONS SCANS=401 PEPMASS=342.1315 CHARGE=1 COLLISION_ENERGY=0.0 50.1191 2300.0 60.4393 2500.0 63.5241 2100.0 64.6554 2300.0 65.4683 2100.0 70.6054 2200.0 84.5063 2500.0 85.8966 2600.0 87.6182 2400.0 110.8222 2600.0 122.0573 20000.0 125.4548 2300.0 133.0672 2400.0 136.5029 2400.0 153.1274 2600.0 173.5203 5400.0 173.5351 48000.0 193.0877 2900.0 221.0796 6700.0 233.297 2300.0 252.4319 2700.0 252.4651 2600.0 271.7657 2600.0 328.8345 2500.0 342.1311 40000.0 END IONS BEGIN IONS SCANS=402 PEPMASS=625.2557 CHARGE=1 COLLISION_ENERGY=0.0 64.1522 2500.0 64.5482 3000.0 68.0125 2500.0 71.384 2400.0 76.8163 2400.0 77.9349 2300.0 83.4219 2200.0 84.8984 2200.0 84.9734 2400.0 88.5087 2500.0 90.2587 2300.0 90.5704 2300.0 92.8587 3200.0 93.0695 8600.0 95.9276 2600.0 96.5446 2100.0 102.8067 2500.0 102.9883 2700.0 105.6078 2200.0 121.0645 240000.0 121.4203 2300.0 122.7203 2500.0 122.7827 2700.0 133.0282 13000.0 136.0753 28000.0 136.1032 2700.0 137.0592 38000.0 138.0906 9000.0 143.0487 7500.0 149.0594 53000.0 150.0672 25000.0 161.0589 4200.0 164.0702 52000.0 173.5217 35000.0 173.5394 100000.0 173.5496 2800.0 175.0388 78000.0 175.0754 14000.0 177.0548 36000.0 181.6594 2300.0 187.0385 19000.0 198.8765 2300.0 201.0545 140000.0 203.0696 9800.0 221.0972 6100.0 227.07 8700.0 233.0593 27000.0 237.0912 18000.0 247.0051 2500.0 247.075 16000.0 249.0917 2600.0 251.0724 3100.0 254.0567 2300.0 261.0546 3100.0 263.0698 13000.0 264.0787 14000.0 265.0857 110000.0 266.0931 12000.0 272.1282 11000.0 275.0704 5900.0 276.5277 2400.0 278.0572 8300.0 279.1012 26000.0 292.0735 29000.0 293.0443 7200.0 293.0811 240000.0 295.096 16000.0 297.0781 2700.0 297.1123 49000.0 307.0967 450000.0 308.0681 210000.0 310.0837 14000.0 314.461 2200.0 319.0602 20000.0 322.5711 3000.0 323.0912 75000.0 325.0612 5100.0 325.0731 3000.0 325.1069 570000.0 325.1514 11000.0 336.0628 14000.0 340.1916 2600.0 351.0362 5600.0 351.086 760000.0 351.1233 3300.0 371.9644 2900.0 452.4577 2300.0 459.1305 2400.0 462.1897 22000.0 488.1738 3000.0 509.6094 2800.0 511.9201 2500.0 551.5922 2800.0 564.8727 3000.0 596.1522 2500.0 607.8865 2900.0 618.6901 2400.0 END IONS BEGIN IONS SCANS=403 PEPMASS=266.0814 CHARGE=1 COLLISION_ENERGY=0.0 45.6968 12000.0 46.0675 2600.0 48.5298 8700.0 50.4337 6800.0 54.0099 2700.0 57.5014 6500.0 57.6992 8800.0 59.0171 3100.0 62.7625 84000.0 62.7662 22000.0 63.4869 7800.0 63.5111 6000.0 64.603 3800.0 65.5627 2800.0 66.5183 40000.0 66.5221 16000.0 71.1826 7900.0 76.3828 8700.0 77.9306 8100.0 87.6254 7700.0 87.9531 6900.0 99.5404 8300.0 101.4497 3100.0 102.4253 3000.0 107.5177 3700.0 117.8242 3000.0 122.6549 8900.0 130.4519 3500.0 139.056 35000.0 140.0624 13000.0 143.1882 8400.0 161.9709 3200.0 165.0698 31000.0 166.0662 33000.0 167.0731 460000.0 168.0574 76000.0 169.302 3300.0 171.0672 19000.0 173.5245 35000.0 173.533 43000.0 179.0497 12000.0 179.0968 8200.0 180.0812 41000.0 182.0606 12000.0 182.0965 61000.0 192.0803 40000.0 194.0603 38000.0 195.0468 24000.0 195.0679 1100000.0 195.0886 10000.0 196.0518 63000.0 196.0757 150000.0 198.0548 14000.0 199.0638 12000.0 203.097 8900.0 206.0601 440000.0 208.076 64000.0 210.0552 9500.0 210.0917 120000.0 211.0759 82000.0 219.9454 8100.0 220.075 47000.0 222.0555 45000.0 223.0628 400000.0 230.7548 3100.0 234.0551 240000.0 238.0864 400000.0 243.4285 11000.0 250.0503 22000.0 250.9615 13000.0 250.9959 64000.0 251.0576 29000000.0 251.1194 190000.0 251.1372 40000.0 265.0747 11000.0 266.0136 110000.0 266.029 61000.0 266.0811 19000000.0 266.1482 120000.0 266.1665 24000.0 END IONS BEGIN IONS SCANS=404 PEPMASS=621.2449 CHARGE=1 COLLISION_ENERGY=0.0 64.5206 2200.0 69.7881 2100.0 72.4103 2200.0 78.6021 2400.0 79.054 4200.0 81.0332 340000.0 81.0386 4900.0 82.0284 3500.0 94.0649 2500.0 95.9429 2200.0 98.0596 9100.0 106.0655 3000.0 107.8755 2500.0 109.6856 2100.0 110.0234 19000.0 119.0497 2700.0 122.06 9800.0 123.3927 2500.0 132.0443 6600.0 134.06 4500.0 134.2878 2300.0 136.0388 7700.0 147.0444 3000.0 150.0547 140000.0 150.066 2100.0 165.5482 2700.0 173.5322 46000.0 175.0388 8700.0 178.0498 410000.0 181.0495 16000.0 195.0654 4600.0 196.0589 2300.0 205.0864 9000.0 207.0652 32000.0 221.0809 50000.0 244.4942 2300.0 245.0813 3000.0 273.0754 3400.0 290.104 3700.0 300.1219 4400.0 336.1006 4600.0 337.1089 3500.0 339.1237 5800.0 341.4686 2600.0 353.1015 10000.0 357.1335 5200.0 361.0238 16000.0 366.1123 5300.0 367.1186 23000.0 368.1253 18000.0 381.134 19000.0 384.1213 3900.0 385.1286 71000.0 389.0979 2600.0 395.116 5300.0 396.1203 9700.0 399.1443 24000.0 409.127 2900.0 412.1201 3400.0 427.1407 23000.0 459.2717 26000.0 510.2023 3200.0 615.9564 2900.0 621.3231 14000.0 END IONS BEGIN IONS SCANS=405 PEPMASS=597.2216 CHARGE=1 COLLISION_ENERGY=0.0 67.3207 2400.0 73.5578 2400.0 76.0916 2300.0 76.2434 2300.0 76.5205 2200.0 76.9058 2100.0 77.0276 2200.0 79.7985 2300.0 83.9468 2400.0 89.0392 2500.0 94.3516 2400.0 97.8585 2300.0 101.1221 2700.0 104.9264 2400.0 109.1179 2500.0 118.9887 2200.0 119.7462 2300.0 120.0414 23000.0 127.2334 2100.0 133.2068 2500.0 143.0789 2900.0 148.0134 2300.0 148.7233 2300.0 159.3648 2600.0 173.5221 7300.0 173.5323 110000.0 173.5411 11000.0 206.0437 2400.0 211.5775 2700.0 214.7722 2800.0 228.5142 2400.0 237.5999 2800.0 258.4243 2400.0 263.7636 2500.0 277.0904 2300.0 294.9262 2300.0 310.105 2400000.0 310.1894 3300.0 315.3971 2400.0 334.175 2800.0 354.6057 2300.0 364.1619 2800.0 368.3382 2800.0 422.9711 2400.0 443.3141 2700.0 466.3701 2400.0 542.1138 2700.0 END IONS BEGIN IONS SCANS=406 PEPMASS=288.1235 CHARGE=1 COLLISION_ENERGY=0.0 47.7672 560000.0 47.7688 52000.0 48.1445 5200.0 48.9981 9000.0 49.9679 5000.0 53.0021 13000.0 53.7223 2400.0 54.2864 5500.0 55.0178 98000.0 55.3527 5300.0 56.6153 2100.0 57.4875 4800.0 57.5946 4900.0 57.6265 5100.0 58.6221 8500.0 59.5369 4400.0 60.7405 5300.0 62.9194 7800.0 65.0385 14000.0 65.8524 4400.0 66.1151 6300.0 68.109 4300.0 69.8579 4800.0 70.5149 5400.0 70.9716 4100.0 72.4678 4800.0 75.5449 6900.0 76.7875 5800.0 77.0391 64000.0 79.054 570000.0 79.6578 6200.0 84.2803 4800.0 89.0389 100000.0 90.0463 71000.0 90.5189 3900.0 91.0542 600000.0 92.062 150000.0 92.9204 6400.0 95.049 150000.0 97.0766 5900.0 98.0599 400000.0 101.2243 4700.0 102.0469 140000.0 103.054 1200000.0 104.0619 22000.0 105.0334 360000.0 105.0426 14000.0 105.0442 6900.0 105.0618 22000.0 105.0698 1700000.0 105.0782 7600.0 107.0492 69000.0 109.0642 7400.0 112.1176 5600.0 115.0543 160000.0 116.2313 5600.0 117.0338 97000.0 117.0698 6600.0 118.0413 330000.0 119.0491 1100000.0 119.0579 14000.0 120.0569 910000.0 121.0646 65000.0 123.2477 5600.0 127.0811 8300.0 130.0413 160000.0 131.0491 220000.0 132.0453 10000.0 132.0569 1900000.0 132.0686 28000.0 133.0179 8800.0 133.0283 790000.0 133.0648 2000000.0 133.0765 26000.0 135.0445 9900.0 135.0803 660000.0 137.0602 91000.0 137.6867 4600.0 143.0608 54000.0 145.0289 6500.0 146.0362 470000.0 147.0441 810000.0 148.0402 23000.0 148.0518 7200000.0 148.0629 26000.0 149.0587 6500.0 151.076 8900.0 152.5068 4700.0 158.0366 45000.0 159.0435 110000.0 160.0398 9200.0 160.0519 3800000.0 160.0641 20000.0 160.1931 7500.0 161.0597 1100000.0 163.0431 260000.0 163.0496 29000.0 163.0754 33000000.0 163.101 38000.0 163.1063 350000.0 163.1162 86000.0 165.0551 18000.0 173.059 71000.0 173.5275 280000.0 173.5435 59000.0 176.0288 55000.0 176.047 4500000.0 178.0859 31000.0 190.8802 6400.0 190.9393 5000.0 190.9854 9300.0 190.9928 6600.0 191.0177 24000.0 191.0293 840000.0 191.0378 710000.0 191.0703 140000000.0 191.0855 330000.0 191.1019 810000.0 191.1112 980000.0 191.123 410000.0 191.1343 190000.0 191.1456 120000.0 191.1574 43000.0 192.0735 150000.0 212.1146 7900.0 246.1134 66000.0 257.7062 6300.0 270.2065 4900.0 END IONS BEGIN IONS SCANS=407 PEPMASS=310.1055 CHARGE=1 COLLISION_ENERGY=0.0 49.0702 3700.0 49.0852 2500.0 49.5533 2300.0 50.4455 2400.0 50.6455 6500.0 51.0067 2800.0 51.25 2300.0 53.7444 3900.0 53.7871 3400.0 54.0377 3800.0 56.9691 5800.0 58.6394 3400.0 60.269 2200.0 62.4704 7900.0 62.5168 3400.0 62.7679 3600.0 64.4328 3000.0 65.0066 3200.0 65.8363 4300.0 66.7575 5600.0 66.9673 2100.0 67.4563 2700.0 67.9335 4300.0 68.0017 2200.0 68.0631 5300.0 69.5623 5800.0 69.9058 6700.0 70.7297 5400.0 71.8528 2400.0 73.1315 2700.0 73.4011 3400.0 74.0071 2200.0 76.4129 5900.0 77.4598 2100.0 79.6235 3700.0 80.1221 4200.0 80.6725 4700.0 81.0736 5900.0 82.3934 4100.0 82.6129 2900.0 84.483 4200.0 87.9397 2800.0 88.305 6400.0 91.2175 3700.0 92.2973 2800.0 101.4904 4900.0 103.6394 4100.0 105.5498 2500.0 109.5576 3400.0 111.6654 3500.0 112.4063 3000.0 120.0416 200000.0 120.3847 6500.0 122.5571 2300.0 123.1075 2500.0 123.7517 7000.0 124.9385 3100.0 128.5806 2700.0 130.7751 4700.0 136.0439 2100.0 142.5704 4900.0 145.4341 4200.0 150.0939 2400.0 152.616 4100.0 163.0746 6700.0 165.6185 3700.0 170.3094 3000.0 173.5061 4400.0 173.5258 18000.0 173.5348 260000.0 173.5429 4200.0 174.3187 4100.0 175.3362 2800.0 179.0784 6000.0 179.2037 3700.0 184.6666 2300.0 191.07 230000.0 194.9328 4900.0 195.0442 12000.0 214.4281 2500.0 225.0561 2300.0 275.2114 4600.0 277.3925 2500.0 287.8205 2100.0 288.4825 4200.0 310.1053 430000.0 313.7245 6300.0 317.2225 4900.0 END IONS BEGIN IONS SCANS=408 PEPMASS=304.1185 CHARGE=1 COLLISION_ENERGY=0.0 50.2857 2700.0 52.4102 2600.0 53.0052 2500.0 53.0436 2600.0 55.1048 2200.0 56.3585 2500.0 59.2426 2200.0 59.8047 2100.0 61.8677 2500.0 62.9091 2500.0 65.0385 3100.0 69.945 2400.0 87.3698 2400.0 91.0541 200000.0 98.06 24000.0 103.0542 4300.0 119.0394 3900.0 119.049 650000.0 119.0565 4200.0 119.0592 12000.0 127.7641 2600.0 127.8092 2400.0 129.0341 3800.0 131.0484 3100.0 132.0204 10000.0 133.0273 2400.0 136.052 2600.0 136.2263 2800.0 145.0285 3000.0 147.0439 840000.0 149.0231 6400.0 157.0395 78000.0 164.0467 12000.0 173.5303 11000.0 173.5351 25000.0 175.0039 3600.0 175.039 1800000.0 176.0462 4100.0 179.0703 49000.0 179.0863 2800.0 180.8884 22000.0 188.0635 3700.0 190.873 7100.0 191.0704 2600.0 192.042 8700.0 207.0653 900000.0 207.0978 3500.0 208.8832 78000.0 226.8937 56000.0 256.4912 2900.0 END IONS BEGIN IONS SCANS=409 PEPMASS=207.0655 CHARGE=1 COLLISION_ENERGY=0.0 42.3157 2200.0 44.2245 2200.0 45.0334 6100.0 46.1742 2400.0 46.9021 2200.0 47.6328 2400.0 47.8546 2700.0 48.2165 2200.0 48.9931 2200.0 49.0663 2400.0 54.7254 2500.0 54.7291 2100.0 56.8838 2400.0 57.9347 13000.0 58.5027 2600.0 62.2982 2300.0 65.0383 20000.0 73.0281 4700.0 74.9377 5000.0 77.0384 5200.0 79.0538 2700.0 80.0618 3100.0 84.9455 15000.0 89.0383 18000.0 91.0539 420000.0 91.0608 6000.0 92.4687 2300.0 95.0486 3700.0 97.9533 20000.0 98.9611 46000.0 101.038 2500.0 102.956 24000.0 104.0254 2700.0 107.0491 6000.0 108.0563 3100.0 109.9381 2600.0 115.9638 350000.0 116.9716 140000.0 117.0329 3500.0 118.0412 11000.0 119.0392 6800.0 119.0488 300000.0 121.0274 2700.0 123.0802 2400.0 126.9339 2500.0 126.9663 3500.0 129.0331 15000.0 132.0203 37000.0 133.9743 21000.0 135.0437 18000.0 135.7229 2600.0 136.0517 12000.0 136.712 2500.0 145.0278 13000.0 146.0361 8600.0 147.0438 170000.0 147.4393 2300.0 149.0232 31000.0 155.9971 3200.0 157.0396 25000.0 162.0322 2900.0 164.0471 18000.0 171.8617 2300.0 173.5241 23000.0 173.5349 23000.0 173.5433 9700.0 174.0312 7800.0 175.0387 34000.0 179.0705 22000.0 187.426 2600.0 191.3735 2200.0 207.1745 2500.0 END IONS BEGIN IONS SCANS=410 PEPMASS=339.1595 CHARGE=1 COLLISION_ENERGY=0.0 51.0694 2200.0 53.7235 2200.0 55.4288 2300.0 60.061 2300.0 60.5072 2200.0 65.3547 2100.0 70.627 2100.0 73.2583 2400.0 77.0392 2800.0 79.0542 20000.0 80.3636 2400.0 83.2896 2100.0 84.2608 2300.0 87.9422 2400.0 91.0541 23000.0 93.0697 7400.0 95.0491 6600.0 99.3829 3100.0 100.3395 2800.0 101.5568 2500.0 103.0541 29000.0 103.4425 2700.0 105.0697 60000.0 107.0491 33000.0 109.2186 2700.0 115.0547 4800.0 117.0696 35000.0 118.3298 2300.0 118.7145 2900.0 119.0494 11000.0 121.0646 120000.0 123.0802 17000.0 126.4411 2300.0 129.0701 5900.0 131.049 82000.0 133.0529 3100.0 133.0647 510000.0 133.0763 4100.0 133.4564 2500.0 134.4168 2400.0 135.0319 3100.0 135.0439 1400000.0 135.068 3400.0 135.0804 16000.0 136.0518 120000.0 137.0595 33000.0 139.0747 2500.0 143.0491 12000.0 143.0858 3600.0 143.1088 2300.0 145.0646 92000.0 146.0725 86000.0 147.0803 80000.0 147.8409 3100.0 149.0595 65000.0 149.0959 8500.0 150.0674 73000.0 151.0752 1000000.0 157.0648 37000.0 157.5045 2400.0 158.0733 2700.0 159.0803 11000.0 160.0526 3300.0 160.0881 14000.0 161.0595 75000.0 162.0676 33000.0 162.7819 2400.0 162.9872 2800.0 163.0754 120000.0 164.0838 2900.0 165.091 200000.0 166.8484 2400.0 167.4245 2500.0 171.0804 32000.0 173.0597 16000.0 173.5292 58000.0 173.5435 9000.0 174.0671 15000.0 175.0757 22000.0 176.0833 30000.0 177.0732 5100.0 177.0911 780000.0 177.1079 6100.0 177.6229 2400.0 179.1062 6900.0 179.7144 2300.0 185.0603 2500.0 187.0755 36000.0 188.0835 15000.0 189.0911 82000.0 190.1001 3900.0 191.1068 50000.0 201.091 46000.0 202.0988 26000.0 203.1066 82000.0 209.1377 2700.0 215.1064 3800.0 217.1229 20000.0 246.8864 6900.0 247.1104 3000.0 251.1053 2400.0 276.1137 2700.0 277.1228 4200.0 278.1305 37000.0 279.1382 2600.0 281.1157 3700.0 294.1259 9400.0 296.4121 2700.0 307.133 7000.0 308.1404 10000.0 309.1501 11000.0 318.6784 2800.0 321.1494 6000.0 324.1357 84000.0 339.1575 2900.0 END IONS BEGIN IONS SCANS=411 PEPMASS=276.1599 CHARGE=1 COLLISION_ENERGY=0.0 46.1321 2100.0 46.5711 2300.0 48.2629 2200.0 50.5669 2100.0 53.4301 2500.0 56.0053 2100.0 58.6666 2700.0 63.667 2100.0 64.3031 2400.0 67.0921 2600.0 67.5775 2300.0 67.7314 2400.0 69.0695 120000.0 71.3803 2300.0 73.0281 54000.0 74.0959 2200.0 78.0574 2300.0 78.857 2500.0 79.9755 2300.0 84.0804 31000.0 86.0961 68000.0 88.9415 2700.0 98.6266 2300.0 105.0722 9600.0 106.9366 2200.0 109.4213 2400.0 112.0754 130000.0 115.0936 3800.0 119.0486 2700.0 130.7593 2600.0 132.0567 6000.0 133.0649 6500.0 133.104 24000.0 137.3242 2600.0 148.0516 38000.0 160.0517 23000.0 161.0592 3000.0 162.4604 2500.0 163.0753 220000.0 173.5264 25000.0 173.5399 36000.0 174.454 2200.0 176.0469 39000.0 180.8885 9500.0 181.3941 2500.0 181.9882 2700.0 191.0703 2100000.0 205.1224 8800.0 208.8829 24000.0 211.8845 2500.0 220.5303 2500.0 226.8937 17000.0 227.8512 2600.0 233.814 2300.0 276.1598 34000.0 END IONS BEGIN IONS SCANS=412 PEPMASS=233.1176 CHARGE=1 COLLISION_ENERGY=0.0 43.0178 13000.0 45.0335 24000.0 47.0197 3800.0 47.0217 2600.0 48.2765 2300.0 52.3013 2200.0 53.4501 2600.0 57.0335 51000.0 57.0698 5400.0 59.0585 2400.0 67.0542 55000.0 69.0699 3700.0 69.6283 2400.0 75.0437 10000.0 78.0846 4500.0 79.0541 22000.0 81.0696 3100.0 85.8514 4100.0 91.0542 34000.0 95.049 20000.0 96.6518 2300.0 103.054 14000.0 105.0698 27000.0 107.049 11000.0 107.1977 4700.0 108.0572 2900.0 109.0651 4100.0 115.0544 57000.0 116.0622 3100.0 117.0698 43000.0 119.0855 8300.0 121.0647 94000.0 127.0557 4600.0 128.062 190000.0 129.0318 2700.0 129.0698 170000.0 130.0777 26000.0 131.0491 26000.0 131.0854 89000.0 132.0572 8200.0 133.0649 29000.0 134.0359 3100.0 135.0806 25000.0 136.052 22000.0 137.0597 53000.0 138.0674 26000.0 139.0753 12000.0 140.0621 14000.0 141.0698 120000.0 142.0421 3200.0 142.0776 46000.0 143.0491 51000.0 143.0855 160000.0 144.0569 53000.0 144.093 11000.0 145.0516 7300.0 145.0647 270000.0 145.1011 23000.0 145.114 2900.0 146.0726 92000.0 147.0439 10000.0 147.0801 43000.0 149.0596 32000.0 151.0753 220000.0 152.062 13000.0 153.0699 130000.0 154.0776 75000.0 155.0604 12000.0 155.0854 84000.0 156.0568 59000.0 157.0647 410000.0 158.0612 3600.0 158.0726 330000.0 158.0874 4900.0 159.0442 49000.0 159.0586 3300.0 159.0804 670000.0 159.4884 2400.0 160.0518 15000.0 160.0882 140000.0 161.0596 120000.0 161.096 21000.0 162.0675 93000.0 163.0754 37000.0 164.0825 9100.0 165.0909 31000.0 168.0571 100000.0 169.0647 340000.0 170.0727 120000.0 171.0452 3100.0 171.0805 470000.0 171.0943 2000.0 172.0532 15000.0 172.0706 3500.0 172.0883 1700000.0 173.0598 870000.0 173.0962 170000.0 173.5241 11000.0 173.5373 42000.0 174.0676 260000.0 174.0857 5200.0 174.104 730000.0 174.122 3200.0 175.0755 180000.0 175.112 29000.0 176.0833 190000.0 177.055 7500.0 177.0911 190000.0 179.4014 2900.0 181.0631 4400.0 182.0729 23000.0 183.0805 110000.0 183.4664 2700.0 184.0883 820000.0 185.0598 340000.0 185.0961 45000.0 186.068 23000.0 187.0466 4900.0 187.0754 230000.0 188.0832 3600000.0 188.1222 7000.0 189.091 340000.0 190.0622 15000.0 190.0988 210000.0 191.0691 4900.0 191.1069 21000.0 192.0777 3400.0 199.0754 64000.0 200.0832 610000.0 201.0911 32000.0 202.0809 3600.0 202.099 290000.0 203.072 5000.0 203.1068 1400000.0 204.0787 3100.0 204.1143 13000.0 205.086 48000.0 205.1224 240000.0 214.0983 2700.0 215.1067 780000.0 216.8414 4400.0 218.0945 6000.0 233.1172 200000.0 239.6468 4400.0 END IONS BEGIN IONS SCANS=413 PEPMASS=434.2546 CHARGE=1 COLLISION_ENERGY=0.0 62.4464 2200.0 68.2326 2300.0 72.9651 2400.0 78.6583 2100.0 84.6943 2500.0 90.9716 2700.0 97.0623 2300.0 99.8145 2300.0 101.8305 2400.0 103.7365 2100.0 109.7545 2600.0 119.8107 2400.0 126.0551 5700.0 141.1139 2300.0 144.5003 2400.0 151.0755 12000.0 157.0871 2600.0 159.5227 2300.0 159.5447 2300.0 173.5246 34000.0 173.5409 28000.0 179.4624 2300.0 197.4753 2200.0 199.054 2400.0 201.0984 2100.0 203.1065 15000.0 227.9214 2400.0 232.0054 2300.0 233.1172 74000.0 235.263 2600.0 252.4421 2600.0 264.1577 2600.0 275.9996 2900.0 308.1404 2400.0 313.8029 2600.0 328.3606 2700.0 END IONS BEGIN IONS SCANS=414 PEPMASS=355.1544 CHARGE=1 COLLISION_ENERGY=0.0 51.9466 2200.0 51.9658 2300.0 52.6781 2300.0 60.8545 2500.0 61.7455 2300.0 63.401 2100.0 63.9355 2400.0 68.994 2300.0 70.0369 2600.0 70.8373 2500.0 71.049 66000.0 71.173 2200.0 72.8608 2100.0 75.0442 6800.0 79.4247 2600.0 91.0542 25000.0 91.421 2600.0 94.0412 6000.0 95.0493 2400.0 97.282 2300.0 98.2524 2100.0 101.3953 2400.0 105.4021 2300.0 105.4696 2300.0 107.0489 26000.0 108.0566 2300.0 108.8546 2500.0 109.0646 45000.0 111.0439 5700.0 117.0698 5500.0 117.4394 2300.0 119.0487 11000.0 119.0849 2700.0 120.3332 2100.0 121.0646 24000.0 122.0361 28000.0 125.0595 7600.0 127.694 2100.0 128.0617 3200.0 129.0698 43000.0 131.0491 23000.0 131.0858 3400.0 131.981 2300.0 132.8494 2400.0 133.0284 59000.0 133.2846 2400.0 135.0441 22000.0 136.0518 110000.0 136.827 2400.0 137.0502 2400.0 137.0596 1400000.0 139.0751 29000.0 143.049 21000.0 143.0858 6300.0 144.0575 3700.0 145.0647 23000.0 146.0724 2600.0 147.0445 5700.0 147.0803 2700.0 148.0516 3400.0 149.0595 62000.0 151.0386 25000.0 151.0753 1000000.0 151.0866 2900.0 153.0541 9200.0 157.0648 80000.0 158.0725 39000.0 158.9876 2500.0 159.081 7000.0 160.052 38000.0 161.0596 28000.0 162.0667 3000.0 163.0753 64000.0 165.0547 63000.0 165.0909 67000.0 167.0699 6100.0 171.0807 17000.0 172.0884 95000.0 173.0597 23000.0 173.0975 2900.0 173.524 26000.0 173.5376 67000.0 174.0676 120000.0 175.0755 280000.0 176.0853 3200.0 177.0547 110000.0 177.0911 65000.0 178.0586 14000.0 179.0703 130000.0 181.0645 6300.0 185.059 6900.0 186.0674 27000.0 187.0754 240000.0 188.0832 240000.0 189.091 290000.0 190.0985 26000.0 190.6228 2300.0 191.0702 89000.0 191.1066 29000.0 193.086 35000.0 194.7189 2500.0 194.7634 2600.0 199.0753 32000.0 201.0911 840000.0 201.1129 16000.0 202.0791 3100.0 202.0983 38000.0 203.0857 5300.0 203.1067 260000.0 204.8885 4300.0 205.0858 13000.0 205.9473 2600.0 210.068 4700.0 211.0748 8800.0 213.0911 87000.0 214.1012 2600.0 214.8737 18000.0 215.0857 5300.0 215.1074 2600.0 216.0776 7300.0 217.086 63000.0 218.8686 13000.0 219.0807 12000.0 219.1038 3100.0 220.088 2600.0 221.094 2600.0 224.0828 15000.0 225.0911 180000.0 226.0626 3000.0 227.0693 12000.0 231.0795 27000.0 231.1017 240000.0 233.0526 2300.0 233.0962 81000.0 234.1041 28000.0 239.0704 53000.0 239.1064 6600.0 240.0782 13000.0 241.086 230000.0 242.0942 16000.0 244.088 11000.0 245.0958 55000.0 245.14 2700.0 246.1037 110000.0 247.0751 66000.0 247.1127 5000.0 248.0828 16000.0 249.0912 20000.0 250.0988 15000.0 251.0725 2600.0 251.1064 30000.0 253.0857 130000.0 254.0627 15000.0 254.0936 680000.0 254.1247 14000.0 255.0649 110000.0 255.1011 68000.0 257.1154 3100.0 258.0664 3300.0 259.0743 17000.0 260.082 6200.0 260.4779 2400.0 261.0907 230000.0 262.0986 240000.0 263.0739 24000.0 263.1064 91000.0 264.0774 7200.0 264.1132 22000.0 265.0885 21000.0 265.1223 66000.0 266.0946 2800.0 267.102 31000.0 267.1377 11000.0 268.109 26000.0 269.0478 4800.0 269.0807 740000.0 269.1075 4200.0 269.1159 3600.0 270.0546 4700.0 270.0885 530000.0 270.1208 6000.0 272.8803 2800.0 273.0911 70000.0 274.0988 220000.0 275.0704 56000.0 275.1066 170000.0 276.0787 7100.0 276.1146 7800.0 277.0877 40000.0 277.1223 280000.0 278.0938 82000.0 278.1259 5800.0 279.1016 190000.0 280.1095 25000.0 281.0816 14000.0 281.1151 7700.0 281.539 3200.0 282.0885 83000.0 283.0964 23000.0 284.1044 1800000.0 284.1321 5000.0 284.1428 3900.0 285.1123 440000.0 285.1483 4100.0 289.0858 34000.0 289.1214 25000.0 290.0938 260000.0 290.8899 2600.0 291.1017 610000.0 291.1388 5600.0 292.075 2700.0 292.1095 21000.0 293.082 16000.0 293.1174 230000.0 294.0905 4200.0 294.1253 160000.0 295.0962 100000.0 295.1309 26000.0 296.1042 24000.0 296.1392 3200.0 297.1123 500000.0 297.1501 5300.0 298.1195 11000.0 304.1093 13000.0 305.077 5600.0 305.1173 690000.0 305.1476 2500.0 305.1584 3200.0 306.1252 700000.0 307.0589 4200.0 307.0966 340000.0 307.1343 7900.0 308.1047 28000.0 308.9005 68000.0 309.1125 61000.0 310.0793 4900.0 310.1199 400000.0 311.128 77000.0 319.1327 31000.0 321.1123 52000.0 322.1199 310000.0 324.1354 15000.0 325.1057 3100.0 325.1432 95000.0 337.1432 180000.0 355.1532 2800.0 END IONS BEGIN IONS SCANS=415 PEPMASS=312.1212 CHARGE=1 COLLISION_ENERGY=0.0 48.5759 2200.0 52.4638 2200.0 53.4598 2500.0 53.5886 2000.0 54.0216 3000.0 55.2701 2700.0 55.942 2500.0 61.2105 2000.0 67.0504 2200.0 69.0697 3000.0 70.7462 2400.0 72.8426 2100.0 74.4243 2200.0 77.7304 2200.0 78.7095 2100.0 79.2457 2200.0 82.9041 2300.0 93.6971 2400.0 94.1089 2700.0 94.9957 2400.0 97.7265 2100.0 98.5913 2700.0 101.2819 2800.0 104.0605 2100.0 112.0537 2300.0 112.0755 7400.0 112.1851 2400.0 112.3974 2600.0 117.7734 2300.0 120.365 2500.0 122.0575 15000.0 123.7249 2400.0 125.0171 2700.0 128.4594 2500.0 130.69 2500.0 133.0123 2500.0 134.7034 2500.0 140.6333 2200.0 141.069 2300.0 145.4997 2600.0 155.6104 2300.0 169.0646 6000.0 173.526 63000.0 173.542 35000.0 191.0696 3500.0 218.0699 3200.0 224.2785 2600.0 228.9928 2300.0 231.4903 2200.0 251.1286 2800.0 251.2878 2600.0 262.6259 2600.0 278.8423 2300.0 284.3403 2300.0 286.6907 2500.0 312.1209 64000.0 END IONS BEGIN IONS SCANS=416 PEPMASS=290.1392 CHARGE=1 COLLISION_ENERGY=0.0 47.7662 4900.0 47.7676 41000.0 50.757 2200.0 52.0279 2200.0 52.1454 2200.0 52.3102 2100.0 53.6914 2100.0 54.7082 2300.0 59.1438 2300.0 63.5296 2300.0 79.0541 33000.0 79.1853 2300.0 83.44 2400.0 86.6327 2300.0 87.2104 2500.0 90.0916 2800.0 90.5867 2400.0 91.0542 33000.0 100.0757 37000.0 101.9244 2100.0 103.0541 64000.0 105.0334 18000.0 105.0698 95000.0 108.0543 2100.0 111.4639 2300.0 111.9762 2200.0 112.4293 2500.0 115.0543 2400.0 118.0416 15000.0 118.5248 2300.0 119.0491 55000.0 120.057 43000.0 122.9821 2400.0 128.0462 2300.0 132.0569 120000.0 133.0285 47000.0 133.0647 110000.0 135.0803 41000.0 135.9671 3000.0 146.0364 22000.0 147.0441 51000.0 148.0518 400000.0 152.4822 3200.0 160.0517 210000.0 161.0595 53000.0 163.0592 17000.0 163.0753 1900000.0 168.9011 2400.0 173.5296 81000.0 173.5433 24000.0 175.0395 3000.0 176.0469 260000.0 191.0183 6900.0 191.0297 56000.0 191.0703 9200000.0 191.1019 15000.0 191.1113 43000.0 192.0732 2900.0 205.0499 6000.0 218.0565 2800.0 219.5424 2600.0 235.8703 2900.0 235.9046 2400.0 276.774 2800.0 288.7917 2400.0 298.221 3300.0 END IONS BEGIN IONS SCANS=417 PEPMASS=208.0439 CHARGE=1 COLLISION_ENERGY=0.0 41.9989 2500.0 43.5056 2200.0 49.2153 2300.0 50.6305 2300.0 56.7315 2500.0 57.1722 2300.0 58.7291 2300.0 59.5123 2600.0 59.6785 2400.0 59.7155 2300.0 59.9775 2400.0 62.3521 2200.0 65.6049 2600.0 69.0922 2700.0 69.8968 2200.0 70.6314 2400.0 74.6316 2300.0 78.8735 2500.0 84.9593 74000.0 87.357 2900.0 91.0541 2500.0 91.4286 2200.0 95.1118 2200.0 96.1833 2700.0 102.9202 2400.0 102.9696 4900.0 109.7755 2400.0 110.7536 2700.0 111.3582 2200.0 115.206 2500.0 115.9638 12000.0 116.1051 2400.0 116.961 5600.0 118.7829 2400.0 123.9658 2500.0 127.2121 2300.0 130.5461 2300.0 139.3409 2400.0 141.8765 2200.0 144.8033 2500.0 149.0584 2700.0 149.808 2300.0 157.1596 2500.0 165.0435 4400.0 165.6033 2600.0 170.6631 2400.0 173.5275 100000.0 173.5416 41000.0 184.9689 3500.0 257.8578 2500.0 282.0181 3000.0 293.761 2700.0 297.1691 2700.0 356.1404 3000.0 END IONS BEGIN IONS SCANS=418 PEPMASS=436.0645 CHARGE=1 COLLISION_ENERGY=0.0 55.8912 2400.0 68.8669 2500.0 72.522 2400.0 98.8213 2400.0 139.637 2600.0 173.5257 7400.0 183.1141 2600.0 190.0618 5600.0 191.0661 7800.0 193.0856 4900.0 194.0906 5300.0 205.0489 4900.0 206.0536 8300.0 221.0564 4000.0 221.0809 84000.0 222.0844 120000.0 222.1093 5300.0 223.0882 7000.0 237.07 3900.0 273.1313 10000.0 274.1081 12000.0 275.111 40000.0 289.1316 7600.0 290.1345 40000.0 302.1026 5000.0 303.1059 19000.0 317.1266 7600.0 318.1295 50000.0 335.1277 2400.0 434.3537 2900.0 END IONS BEGIN IONS SCANS=419 PEPMASS=207.0437 CHARGE=1 COLLISION_ENERGY=0.0 42.8969 2200.0 43.0543 2300.0 57.9346 3500.0 74.9372 3200.0 91.5989 2100.0 97.9532 5700.0 98.961 11000.0 102.9559 5000.0 115.9638 100000.0 116.9716 31000.0 133.9742 6500.0 134.5491 2400.0 137.8294 2200.0 147.5058 2600.0 164.0424 4900.0 173.5359 4600.0 190.9653 2400.0 192.0374 3600.0 207.1753 2700.0 END IONS BEGIN IONS SCANS=420 PEPMASS=422.0549 CHARGE=1 COLLISION_ENERGY=0.0 61.4475 2800.0 62.1763 2400.0 64.8326 2300.0 68.084 3100.0 72.5348 2300.0 87.8647 2400.0 89.5733 2300.0 100.1854 2600.0 114.9167 2600.0 118.2989 2600.0 149.6662 3300.0 149.681 4100.0 149.6889 13000.0 149.6976 4300.0 168.3426 2400.0 172.9783 3700.0 173.5315 15000.0 181.0858 16000.0 186.9575 12000.0 221.0814 16000.0 238.4325 2400.0 241.9905 2800.0 246.5742 2800.0 304.999 3500.0 308.3838 3000.0 320.0242 8800.0 335.0464 14000.0 338.8463 2400.0 388.6261 3100.0 END IONS BEGIN IONS SCANS=421 PEPMASS=760.3339 CHARGE=1 COLLISION_ENERGY=0.0 70.0648 290000.0 86.0962 27000.0 87.409 2200.0 89.1825 2600.0 89.8657 2500.0 95.1867 2500.0 97.0759 3200.0 98.797 2600.0 115.0862 33000.0 118.0647 7200.0 120.0707 3300.0 120.0804 160000.0 124.9996 15000.0 125.0706 27000.0 136.0756 7000.0 146.0598 39000.0 146.6981 2200.0 147.6681 2300.0 162.091 12000.0 164.0709 9900.0 172.112 46000.0 173.5202 3100.0 173.53 32000.0 173.5387 14000.0 174.0548 8200.0 182.081 10000.0 184.0458 2900.0 184.0733 330000.0 185.0767 46000.0 186.0779 15000.0 187.1235 2900.0 188.4652 2500.0 190.0623 2700.0 215.118 8300.0 216.1259 48000.0 217.1336 36000.0 221.0809 23000.0 236.1075 12000.0 243.1132 34000.0 265.0847 4700.0 265.1326 10000.0 277.1342 11000.0 282.1131 23000.0 289.1321 6300.0 293.1306 16000.0 296.3721 2500.0 309.1242 33000.0 317.1264 25000.0 329.1508 7100.0 339.1335 3200.0 355.1307 9600.0 385.6527 2400.0 417.1298 2500.0 417.1836 21000.0 429.1825 9300.0 458.21 4000.0 477.964 2500.0 502.1989 42000.0 543.2609 4300.0 END IONS BEGIN IONS SCANS=422 PEPMASS=464.0596 CHARGE=1 COLLISION_ENERGY=0.0 89.3581 2700.0 120.353 2200.0 121.8007 2300.0 173.5331 32000.0 177.055 2700.0 181.0878 2400.0 190.0622 11000.0 191.066 3300.0 193.0852 9700.0 194.0912 5900.0 195.0975 3500.0 205.0491 7700.0 206.0545 7900.0 221.0808 140000.0 222.0843 100000.0 223.0888 2900.0 236.0672 4500.0 237.0706 4500.0 272.1265 4700.0 273.1324 8400.0 274.1074 21000.0 275.111 38000.0 289.1315 15000.0 290.1344 39000.0 302.1019 7000.0 303.106 19000.0 317.1258 17000.0 318.1292 53000.0 321.0264 2500.0 336.0488 7800.0 END IONS BEGIN IONS SCANS=423 PEPMASS=426.0669 CHARGE=1 COLLISION_ENERGY=0.0 68.7647 2200.0 69.6672 2400.0 78.7807 2400.0 89.0012 2800.0 96.8536 2500.0 110.7516 2800.0 128.3629 2300.0 150.2023 2200.0 162.0674 23000.0 163.0391 3400.0 168.9965 2600.0 173.5351 37000.0 178.0625 16000.0 189.0547 12000.0 190.0624 130000.0 191.0335 22000.0 191.0708 12000.0 193.086 99000.0 205.0856 13000.0 206.0575 46000.0 220.8858 2400.0 221.0453 3600.0 221.081 540000.0 221.7955 2500.0 222.0851 11000.0 287.3685 2500.0 354.3951 2800.0 382.0804 3500.0 END IONS BEGIN IONS SCANS=424 PEPMASS=345.0935 CHARGE=1 COLLISION_ENERGY=0.0 67.2523 2400.0 67.8676 2200.0 72.4631 2000.0 72.6777 2500.0 74.6668 2300.0 76.1174 2700.0 82.6275 2400.0 84.8658 2300.0 85.6642 2600.0 89.2644 2100.0 130.0416 2400.0 140.1195 2400.0 147.0441 19000.0 149.6877 5600.0 150.0674 2600.0 151.1216 2200.0 153.2336 2500.0 160.053 2900.0 161.06 5300.0 162.0674 49000.0 163.0389 24000.0 163.0753 3900.0 173.5255 17000.0 173.5372 24000.0 174.0309 3900.0 175.039 14000.0 176.0468 10000.0 177.0545 6100.0 178.0625 52000.0 189.0545 26000.0 190.0429 3500.0 190.0624 280000.0 191.0339 59000.0 191.068 27000.0 193.0656 2700.0 193.086 210000.0 194.0896 4600.0 206.0576 98000.0 221.081 1200000.0 222.0845 68000.0 249.0324 39000.0 267.0428 57000.0 356.0226 3800.0 372.0555 6300.0 375.0407 11000.0 397.1961 2500.0 414.5987 2400.0 469.1103 3200.0 520.0839 2400.0 629.2126 2400.0 680.0906 2600.0 END IONS BEGIN IONS SCANS=425 PEPMASS=463.0564 CHARGE=1 COLLISION_ENERGY=0.0 58.7344 2200.0 60.5699 2300.0 62.2337 2400.0 66.0394 2400.0 66.7162 2100.0 69.9997 2300.0 71.0725 2100.0 71.1396 2500.0 71.9894 2600.0 72.332 2900.0 74.1712 2800.0 75.6361 2600.0 76.9002 2300.0 79.2706 2200.0 81.0336 13000.0 81.2545 2600.0 88.0582 2500.0 88.1935 2400.0 93.4462 2100.0 95.9074 2100.0 96.0443 24000.0 97.5205 2000.0 98.0601 7000.0 100.2269 2500.0 103.209 2500.0 104.1997 2400.0 104.3321 2400.0 112.1032 2400.0 112.305 2400.0 114.0807 2600.0 116.4865 2500.0 117.0685 2200.0 120.148 2900.0 121.5198 2500.0 124.9301 2300.0 128.0871 2300.0 131.269 2900.0 135.9315 2300.0 141.2564 2200.0 143.6214 2300.0 144.7543 2600.0 147.0436 2200.0 147.0809 2600.0 149.0587 2900.0 149.6926 5800.0 158.035 2600.0 162.0675 34000.0 163.0769 5100.0 168.077 5300.0 168.7355 2700.0 169.4518 2700.0 171.9708 6500.0 172.9777 42000.0 173.5304 110000.0 173.541 21000.0 173.9859 3700.0 175.0386 2900.0 177.0548 68000.0 178.0626 19000.0 178.108 2600.0 179.0703 32000.0 181.0858 95000.0 186.4349 2200.0 186.9571 77000.0 189.0545 22000.0 189.645 2900.0 190.0624 200000.0 191.0343 37000.0 191.0703 47000.0 192.0778 71000.0 193.0859 180000.0 194.0937 110000.0 195.0641 11000.0 195.1027 3100.0 205.0495 400000.0 206.0572 76000.0 206.0774 3200.0 220.073 100000.0 220.0947 9200.0 221.0808 5200000.0 221.0999 10000.0 222.0875 150000.0 222.1093 3000.0 222.1859 2500.0 234.0763 59000.0 236.0679 150000.0 237.1615 2300.0 246.1129 32000.0 255.9656 2400.0 256.0049 2800.0 257.0065 2500.0 257.5792 2200.0 258.1126 36000.0 260.1282 48000.0 261.1356 25000.0 262.0161 3000.0 269.9853 3200.0 270.076 9800.0 271.029 2500.0 272.128 330000.0 273.0447 2600.0 274.0725 22000.0 274.1074 1600000.0 274.1422 21000.0 274.1574 3500.0 275.2202 3000.0 286.1078 57000.0 288.1238 3200.0 289.0769 3200.0 289.0937 9800.0 289.1308 1400000.0 289.1592 6100.0 289.1698 11000.0 293.2161 2400.0 297.9784 2700.0 299.9971 2800.0 302.0621 2900.0 302.1023 750000.0 302.1358 2400.0 302.142 7100.0 305.0002 15000.0 307.0185 3000.0 317.0825 9500.0 317.1256 1800000.0 317.1695 20000.0 319.0137 4000.0 320.0227 76000.0 321.0258 2400.0 335.0464 230000.0 350.0698 36000.0 351.7005 2900.0 361.0302 2800.0 363.0408 77000.0 376.0495 3500.0 378.0656 42000.0 440.9575 2600.0 END IONS BEGIN IONS SCANS=426 PEPMASS=435.0615 CHARGE=1 COLLISION_ENERGY=0.0 57.0403 2400.0 57.9131 2200.0 58.0549 2600.0 58.8685 4600.0 61.1539 2800.0 62.6123 2400.0 65.7743 2400.0 66.402 2400.0 66.4162 2200.0 68.3325 2400.0 69.9514 2100.0 69.9847 2600.0 71.5864 2200.0 73.3384 2300.0 74.7777 2200.0 77.0559 2300.0 80.88 2800.0 81.0333 24000.0 81.1116 2300.0 81.8605 2500.0 81.9953 2400.0 82.0771 2300.0 82.6364 2400.0 83.4642 2500.0 85.4497 2300.0 88.8499 2500.0 92.7646 2400.0 93.7986 2600.0 96.0442 15000.0 96.1919 2400.0 96.2327 2400.0 98.0602 7400.0 98.4511 2400.0 100.2693 2700.0 100.4267 2300.0 107.3644 2500.0 112.9663 2500.0 113.4211 2300.0 113.7368 2500.0 117.3638 2700.0 119.103 2300.0 120.3158 2500.0 147.0436 3000.0 151.4472 2500.0 151.9128 2700.0 152.8594 2600.0 153.2533 2200.0 161.0607 3000.0 162.0675 49000.0 163.0395 11000.0 168.0769 2800.0 173.5283 120000.0 173.5443 24000.0 175.039 18000.0 176.0463 6000.0 177.0548 71000.0 178.0622 36000.0 179.0701 28000.0 187.7707 2400.0 189.0547 44000.0 190.0624 360000.0 190.0809 4600.0 191.0338 62000.0 191.0688 98000.0 192.0781 72000.0 193.0861 290000.0 194.093 140000.0 195.0649 9100.0 195.1007 3100.0 200.2941 2500.0 203.4987 2300.0 205.0496 410000.0 206.0573 130000.0 207.063 8800.0 214.0285 8700.0 220.0733 120000.0 220.0946 13000.0 221.0307 10000.0 221.0809 5900000.0 221.1302 4400.0 222.0855 360000.0 222.3596 2200.0 233.8663 2500.0 234.0767 53000.0 235.6414 2600.0 236.0679 140000.0 246.113 25000.0 250.9996 29000.0 258.1124 32000.0 260.1279 52000.0 261.1356 30000.0 266.023 22000.0 270.0764 13000.0 272.1281 320000.0 273.1366 3000.0 274.072 15000.0 274.1075 1600000.0 274.142 11000.0 274.1581 3100.0 278.995 76000.0 286.1072 65000.0 288.1215 3200.0 289.0939 8400.0 289.1309 1400000.0 289.1692 6900.0 302.0619 8500.0 302.1024 740000.0 305.1607 2700.0 308.2385 2500.0 315.0189 43000.0 316.1154 3800.0 317.066 12000.0 317.0831 8800.0 317.1258 1700000.0 317.1694 19000.0 318.0435 3400.0 330.0426 62000.0 330.084 2600.0 333.0294 13000.0 338.0081 7200.0 348.0531 7700.0 358.0364 11000.0 377.6124 2900.0 395.9898 2800.0 432.4557 2900.0 441.4247 2400.0 END IONS BEGIN IONS SCANS=427 PEPMASS=346.0938 CHARGE=1 COLLISION_ENERGY=0.0 67.024 2300.0 72.2162 2100.0 73.1891 2100.0 73.4074 2600.0 76.1119 2800.0 84.8442 2400.0 85.1042 2400.0 86.3864 2600.0 89.024 2300.0 90.786 2500.0 92.3821 2200.0 93.1195 2100.0 93.5534 2700.0 95.1948 2200.0 97.4706 2500.0 99.3122 2300.0 104.2274 2100.0 107.6452 2300.0 108.3148 2400.0 110.1568 2100.0 110.899 2500.0 111.1717 2100.0 120.3813 2400.0 121.0643 2600.0 123.2803 2500.0 131.0756 2600.0 133.0642 2900.0 134.6268 2600.0 138.5217 2200.0 147.0438 30000.0 149.684 9800.0 149.6946 9500.0 152.0491 2700.0 154.3428 2300.0 161.0597 5400.0 162.0672 80000.0 163.0386 36000.0 163.0745 8100.0 171.3688 2500.0 173.5271 23000.0 173.5356 38000.0 175.039 27000.0 176.0469 15000.0 177.0545 7200.0 178.0622 85000.0 189.054 30000.0 190.0429 3400.0 190.0622 390000.0 191.0335 91000.0 191.067 65000.0 192.04 3100.0 193.0674 4600.0 193.0857 290000.0 194.0894 32000.0 206.0573 140000.0 207.0612 3700.0 211.9458 2700.0 221.0808 1700000.0 222.0843 200000.0 223.0865 47000.0 232.2604 2900.0 239.4087 2400.0 274.1085 8800.0 280.9966 2900.0 317.0566 3400.0 319.0713 21000.0 321.2934 2500.0 333.0476 6100.0 359.032 2800.0 360.037 14000.0 374.0534 20000.0 376.0779 2300.0 389.3996 2400.0 392.0612 2700.0 411.1988 2900.0 422.7998 2400.0 441.4715 2400.0 528.9417 2700.0 589.2762 2600.0 END IONS BEGIN IONS SCANS=428 PEPMASS=459.0617 CHARGE=1 COLLISION_ENERGY=0.0 61.0717 2700.0 81.9173 2300.0 162.067 8000.0 163.0749 2900.0 167.0031 3400.0 173.5289 14000.0 175.0758 3500.0 176.083 11000.0 179.07 15000.0 180.9827 9900.0 181.0856 7500.0 181.9898 3000.0 182.998 13000.0 189.0554 3700.0 190.0623 48000.0 191.0333 6500.0 191.0701 21000.0 191.9736 3200.0 192.9808 3400.0 193.0857 36000.0 194.0938 10000.0 197.0134 12000.0 197.9848 3500.0 198.993 8600.0 205.0856 8200.0 206.0575 19000.0 207.0664 3300.0 207.1016 39000.0 210.9936 22000.0 221.0809 390000.0 222.0883 23000.0 229.0036 23000.0 238.0669 2700.0 247.0151 3700.0 310.5525 2500.0 324.4321 2800.0 326.0097 3800.0 327.0178 3900.0 327.0563 14000.0 331.0512 11000.0 334.0382 4800.0 338.0509 2700.0 341.0355 3700.0 342.0791 7000.0 344.0204 9100.0 345.029 3000.0 349.0608 2800.0 356.0593 21000.0 358.0366 4400.0 359.046 51000.0 362.0331 8300.0 374.0701 7300.0 377.0561 30000.0 388.0492 8400.0 418.0596 2900.0 END IONS BEGIN IONS SCANS=429 PEPMASS=420.0594 CHARGE=1 COLLISION_ENERGY=0.0 57.3475 2200.0 58.245 2300.0 59.0936 2400.0 60.9861 2400.0 62.2697 2200.0 62.8543 2500.0 63.4986 2500.0 65.9973 2300.0 67.6253 2400.0 70.515 2300.0 74.2815 2700.0 78.6605 2500.0 87.96 2200.0 88.2857 2400.0 92.3413 2300.0 93.7038 2400.0 94.4986 2100.0 97.9121 2600.0 102.652 2200.0 105.323 2300.0 105.7703 2700.0 105.9817 2300.0 106.2355 2800.0 112.9429 2300.0 115.1892 2500.0 125.3305 2800.0 135.3821 2400.0 138.6445 2600.0 142.1643 2400.0 147.0804 6000.0 149.0232 2500.0 152.7717 2300.0 152.9724 8200.0 153.4349 2300.0 157.7789 2400.0 162.0673 5100.0 169.9745 23000.0 170.9824 92000.0 171.9903 25000.0 172.9978 11000.0 173.5247 21000.0 173.5349 94000.0 173.5419 8700.0 178.062 2900.0 180.978 7900.0 181.0858 170000.0 184.9616 140000.0 190.0623 51000.0 191.0677 11000.0 192.0681 2700.0 193.0858 35000.0 194.0893 6000.0 204.8208 2500.0 206.0579 9200.0 212.2841 2600.0 213.8401 2600.0 221.0809 230000.0 222.0844 66000.0 223.0864 77000.0 225.9763 2600.0 229.0771 2400.0 229.4311 2500.0 232.4762 2400.0 237.0068 5700.0 239.9934 14000.0 243.3525 2100.0 253.2825 2600.0 253.9723 13000.0 254.01 2700.0 256.0256 12000.0 256.8351 2500.0 259.1283 2500.0 267.988 6200.0 270.0037 15000.0 271.7592 2900.0 295.9842 7100.0 303.0042 47000.0 317.0182 19000.0 318.0275 120000.0 319.0356 2900.0 329.4114 2500.0 331.0355 5000.0 333.0509 170000.0 346.0222 8900.0 354.161 2600.0 361.0462 68000.0 379.0603 3300.0 399.7035 2600.0 END IONS BEGIN IONS SCANS=430 PEPMASS=503.1587 CHARGE=1 COLLISION_ENERGY=0.0 85.8794 2200.0 91.3611 2400.0 93.9157 2600.0 102.534 2600.0 147.0441 2900.0 149.6875 7100.0 149.6988 4800.0 162.067 6600.0 163.0393 4000.0 173.5334 7000.0 175.0399 4000.0 178.0631 4000.0 187.0438 2900.0 189.0546 6500.0 190.0622 64000.0 191.0339 11000.0 191.069 6500.0 193.0857 53000.0 206.0574 20000.0 221.0807 1100000.0 221.1319 8100.0 222.0842 25000.0 248.0357 6900.0 249.0322 24000.0 266.0447 3000.0 266.1377 2300.0 267.0424 30000.0 340.1135 3700.0 344.5939 7500.0 345.0927 21000.0 357.0293 3600.0 371.0558 6800.0 372.0531 16000.0 375.041 6200.0 389.0684 3000.0 390.0639 13000.0 467.108 4000.0 468.1077 38000.0 469.0291 5300.0 469.1051 130000.0 469.1638 2400.0 485.1193 2500.0 486.1189 5800.0 487.1153 40000.0 END IONS BEGIN IONS SCANS=431 PEPMASS=343.1245 CHARGE=1 COLLISION_ENERGY=0.0 51.9112 2700.0 52.5339 2200.0 52.7735 2300.0 53.2835 2600.0 54.5167 2800.0 56.2068 2300.0 60.9711 2500.0 61.0166 2600.0 64.9789 2500.0 73.174 2500.0 75.8407 2300.0 78.4318 2300.0 84.1678 2100.0 84.6097 2200.0 85.4794 2300.0 91.7002 2600.0 96.7445 2600.0 127.8625 2800.0 131.3258 2400.0 133.054 2800.0 147.4984 2500.0 149.6839 10000.0 149.6948 11000.0 149.7056 3300.0 155.4704 2500.0 163.6428 2500.0 173.5217 22000.0 173.5367 76000.0 174.6553 2500.0 188.2211 2500.0 207.5538 2400.0 207.6844 2300.0 267.4292 2500.0 277.3464 2800.0 287.2596 2700.0 298.7066 2200.0 343.1237 2800.0 END IONS BEGIN IONS SCANS=432 PEPMASS=654.7352 CHARGE=1 COLLISION_ENERGY=0.0 97.8783 2700.0 116.9995 2600.0 120.4581 2900.0 149.6836 6800.0 149.6956 5400.0 154.0179 6200.0 162.0678 3800.0 172.0277 4200.0 173.5296 5400.0 180.3922 2500.0 190.0624 25000.0 191.0341 3400.0 191.0654 4000.0 193.0859 23000.0 194.0897 4000.0 206.0573 5800.0 221.081 260000.0 222.0846 48000.0 233.0602 13000.0 239.4126 3400.0 251.0703 20000.0 252.0722 3300.0 274.1073 7000.0 289.1312 12000.0 302.1015 4100.0 317.1262 18000.0 323.4176 3300.0 337.1082 27000.0 337.6089 24000.0 337.6454 3000.0 339.7097 2700.0 346.1144 4000.0 356.0811 35000.0 357.0846 14000.0 374.0912 24000.0 375.0957 6100.0 453.1345 54000.0 453.201 4100.0 454.1375 29000.0 471.1455 9800.0 472.1458 3900.0 END IONS BEGIN IONS 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293.0749 2600.0 298.0161 5500.0 299.0219 6300.0 304.0274 3600.0 311.9972 6500.0 314.0109 13000.0 316.0273 5000.0 318.0415 3300.0 326.0119 29000.0 328.0272 27000.0 328.9976 15000.0 330.0051 12000.0 330.0439 3500.0 331.0502 29000.0 332.0219 13000.0 334.0377 57000.0 344.0216 67000.0 345.0307 11000.0 347.0481 3400.0 349.0621 18000.0 358.037 28000.0 359.0455 95000.0 359.0917 4200.0 362.0325 76000.0 367.8093 2800.0 376.0478 3000.0 377.0563 150000.0 381.6749 2500.0 END IONS BEGIN IONS SCANS=434 PEPMASS=317.1269 CHARGE=1 COLLISION_ENERGY=0.0 50.8862 6600.0 52.4277 11000.0 53.0386 96000.0 53.3256 10000.0 55.2692 42000.0 55.7228 8600.0 56.0968 7100.0 59.2348 2300.0 59.5498 7600.0 60.6662 4800.0 61.7545 8200.0 62.2012 8600.0 64.5412 8300.0 68.6535 2200.0 68.957 6600.0 69.3165 2900.0 69.6913 8100.0 70.5155 8700.0 71.8881 8100.0 72.8681 9900.0 72.9529 3500.0 81.0334 500000.0 83.1672 4900.0 86.7273 8000.0 89.0384 8500.0 89.6662 2200.0 91.0543 71000.0 94.4518 6300.0 96.0442 98000.0 98.06 450000.0 102.704 9200.0 103.0543 33000.0 103.8067 2200.0 107.0498 2700.0 108.9371 5600.0 113.0886 2300.0 116.685 8300.0 117.0334 170000.0 118.0652 41000.0 119.049 110000.0 121.0647 6400.0 126.7604 2600.0 129.6036 2300.0 130.0415 67000.0 131.049 32000.0 131.712 9600.0 131.9669 3500.0 132.057 24000.0 133.0648 110000.0 134.0362 59000.0 135.0441 97000.0 137.0603 6600.0 138.4746 3500.0 145.0287 130000.0 146.0366 9800.0 146.06 320000.0 147.0441 450000.0 147.0684 8300.0 147.441 2400.0 148.0519 17000.0 149.0596 360000.0 150.0676 27000.0 151.075 59000.0 153.0535 6700.0 159.0442 9600.0 159.6004 3200.0 160.0519 98000.0 161.0596 260000.0 162.0315 40000.0 162.0531 34000.0 162.0676 1200000.0 163.039 340000.0 163.0756 210000.0 164.0466 3100.0 165.0908 17000.0 165.6425 5200.0 167.0702 36000.0 168.0779 10000.0 170.5191 4000.0 173.5083 9600.0 173.5234 59000.0 173.5366 450000.0 173.5469 6400.0 174.0312 140000.0 174.055 260000.0 175.0392 350000.0 176.047 230000.0 176.0704 53000.0 177.038 23000.0 177.0547 2200000.0 177.0721 25000.0 178.0625 1000000.0 178.086 190000.0 179.0704 520000.0 180.1873 11000.0 188.0466 61000.0 189.0547 700000.0 190.0304 13000.0 190.0624 6700000.0 190.0798 48000.0 191.0339 1300000.0 191.0565 7600.0 191.0703 680000.0 192.0434 27000.0 192.0781 450000.0 193.054 47000.0 193.0654 57000.0 193.086 5100000.0 193.1066 72000.0 193.4039 10000.0 194.0938 260000.0 195.0653 360000.0 196.8422 8700.0 201.869 2700.0 205.0497 2300000.0 205.07 13000.0 206.0351 13000.0 206.0575 2500000.0 206.08 160000.0 207.1514 10000.0 214.0866 140000.0 215.7351 11000.0 216.0642 21000.0 217.0862 12000.0 220.0735 52000.0 221.0163 3600.0 221.031 79000.0 221.0809 24000000.0 221.1 40000.0 221.1321 43000.0 222.076 40000.0 231.0891 130000.0 234.0761 640000.0 236.0679 160000.0 238.0863 2700.0 239.0937 42000.0 242.081 220000.0 242.1069 4000.0 243.0891 32000.0 244.0973 16000.0 246.1123 430000.0 256.0964 67000.0 257.1039 21000.0 258.1127 30000.0 259.0843 3500.0 260.1286 8200.0 265.8239 2600.0 270.075 20000.0 271.0827 39000.0 272.0938 4800.0 272.1283 540000.0 274.0725 12000.0 274.1076 9000000.0 286.1075 110000.0 288.1232 31000.0 289.1309 400000.0 302.1026 530000.0 317.126 48000.0 END IONS BEGIN IONS SCANS=435 PEPMASS=737.1861 CHARGE=1 COLLISION_ENERGY=0.0 116.5673 2100.0 131.0005 2200.0 137.8444 2500.0 147.0806 5900.0 152.9737 2600.0 162.0675 4700.0 169.9744 4600.0 170.9825 15000.0 171.9911 5800.0 173.537 29000.0 177.0909 4000.0 181.0861 34000.0 183.9899 2500.0 184.962 19000.0 186.0065 3200.0 190.062 11000.0 191.068 8800.0 192.0707 2700.0 193.0859 12000.0 194.0875 2800.0 205.0861 4700.0 206.0571 6900.0 209.0104 3000.0 221.0809 270000.0 222.0843 89000.0 223.0863 32000.0 237.0055 6100.0 239.0215 2800.0 241.0374 3100.0 246.4074 2700.0 254.007 3400.0 256.0262 8000.0 258.0422 5700.0 263.9924 3200.0 267.0161 2400.0 267.9888 4900.0 269.0315 6300.0 270.0031 5600.0 271.0464 7900.0 281.0348 2500.0 283.0116 2900.0 285.9998 2700.0 286.0374 13000.0 290.0338 3500.0 295.9809 4000.0 301.0256 5100.0 301.9254 2400.0 303.0044 6000.0 303.0395 4300.0 305.0196 6200.0 305.0566 4100.0 311.4079 2700.0 316.0476 7600.0 317.0186 11000.0 317.0572 11000.0 318.0271 36000.0 318.0639 4300.0 319.0346 9700.0 319.5997 2400.0 320.0408 3300.0 320.0791 6900.0 331.0374 10000.0 332.0503 3300.0 333.0039 5900.0 333.0504 200000.0 333.0975 3800.0 346.0199 5800.0 346.0604 6400.0 348.0738 85000.0 359.0399 11000.0 360.0475 13000.0 361.0454 73000.0 374.0547 19000.0 375.0721 3900.0 376.0688 110000.0 377.0545 7200.0 378.0586 8200.0 379.0591 7800.0 394.0784 4000.0 411.2636 2500.0 418.0585 3500.0 419.0599 4700.0 420.0624 9400.0 END IONS BEGIN IONS SCANS=436 PEPMASS=300.1234 CHARGE=1 COLLISION_ENERGY=0.0 47.5433 2100.0 50.3126 2500.0 50.9302 2300.0 52.9406 2200.0 53.0383 15000.0 54.7525 2400.0 55.0719 2300.0 55.7748 2500.0 55.8552 2300.0 59.3386 2400.0 59.8704 2500.0 60.2579 2200.0 61.8436 2200.0 62.7354 2300.0 64.7543 2900.0 66.9626 2200.0 69.9105 2100.0 70.1577 2500.0 71.2944 2300.0 72.0807 2400.0 72.211 2300.0 80.0492 13000.0 81.0331 370000.0 81.553 2000.0 83.4753 2500.0 89.8208 2500.0 98.3133 2600.0 100.1205 2200.0 103.0538 2100.0 104.7384 2100.0 107.5602 2500.0 108.8192 2800.0 114.5232 2400.0 118.379 2500.0 125.7567 3000.0 129.0038 2800.0 133.7683 2400.0 135.0442 6500.0 138.5549 2300.0 142.5053 2600.0 144.0565 6000.0 149.6846 11000.0 149.6946 8700.0 149.7071 3400.0 160.0515 31000.0 160.0757 8200.0 161.0832 27000.0 170.0604 5400.0 171.0675 24000.0 173.5311 92000.0 173.5414 21000.0 174.0547 25000.0 183.0803 7000.0 187.062 2600.0 188.0707 21000.0 189.0782 42000.0 197.8904 2500.0 198.0549 3400.0 199.0419 2000.0 199.0627 20000.0 202.0499 86000.0 204.0649 6500.0 217.0735 180000.0 220.0966 31000.0 232.0969 1300000.0 232.7917 2600.0 234.1446 2300.0 236.7184 2700.0 238.086 6200.0 239.0556 2800.0 239.0936 17000.0 242.0812 32000.0 249.7987 2400.0 256.0974 37000.0 257.1058 6800.0 260.4371 2700.0 270.0763 67000.0 271.0962 28000.0 284.0923 36000.0 285.1003 25000.0 291.6838 3000.0 300.1236 89000.0 END IONS BEGIN IONS 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56000.0 120.0204 49000.0 120.0572 14000.0 121.0282 8700.0 121.0646 140000.0 126.2959 2400.0 130.0412 110000.0 130.0513 2300.0 131.0133 2700.0 131.049 140000.0 132.0568 82000.0 133.0283 93000.0 133.0647 13000.0 133.4686 2400.0 135.044 410000.0 135.0559 8900.0 138.0315 3100.0 138.1689 2500.0 138.2178 2500.0 138.8314 2500.0 141.8749 2300.0 145.0283 62000.0 145.0399 5800.0 146.0366 26000.0 147.0441 96000.0 148.0153 21000.0 148.0519 37000.0 149.0233 21000.0 149.0596 120000.0 149.6661 3000.0 149.6882 12000.0 149.6988 6300.0 151.9321 2300.0 159.044 27000.0 160.0518 41000.0 161.0231 25000.0 161.0599 23000.0 162.0314 7000.0 163.0231 18000.0 163.039 950000.0 163.0551 13000.0 169.1415 2500.0 171.529 2700.0 173.0236 4700.0 173.5082 4300.0 173.5228 33000.0 173.5386 64000.0 173.5516 4500.0 175.0389 35000.0 176.0107 63000.0 176.0473 39000.0 177.0549 81000.0 178.0627 210000.0 178.0805 3500.0 187.0391 8300.0 187.161 2600.0 188.0474 2400.0 191.0341 270000.0 191.0522 4200.0 205.0493 2900.0 206.0575 61000.0 206.1908 5500.0 END IONS BEGIN IONS SCANS=438 PEPMASS=690.1872 CHARGE=1 COLLISION_ENERGY=0.0 67.0675 2100.0 74.0167 2200.0 76.4583 2200.0 77.9599 2300.0 80.2257 2400.0 81.3503 2400.0 82.2761 3000.0 82.2899 2600.0 105.1982 2400.0 118.9636 2600.0 126.013 2500.0 135.0442 2300.0 146.4452 2500.0 149.6899 5400.0 151.0748 11000.0 164.3293 2700.0 173.5194 5700.0 173.5345 72000.0 176.7318 2100.0 177.0552 5400.0 187.8898 2800.0 190.0445 2700.0 190.0624 34000.0 193.0858 32000.0 200.1559 2200.0 200.7955 2600.0 206.0578 6200.0 206.1819 2500.0 221.0303 3100.0 221.0809 1300000.0 221.9705 2900.0 222.0847 24000.0 249.0322 75000.0 267.043 100000.0 299.5104 3000.0 357.0312 4600.0 358.0375 11000.0 372.054 34000.0 375.0411 20000.0 380.7485 2700.0 390.0636 19000.0 396.1369 2400.0 457.4067 2600.0 469.107 140000.0 469.1773 6900.0 470.1094 3400.0 487.1174 47000.0 505.0119 2700.0 END IONS BEGIN IONS SCANS=439 PEPMASS=735.1849 CHARGE=1 COLLISION_ENERGY=0.0 69.9947 2000.0 74.7919 2700.0 76.3088 2500.0 77.6432 2300.0 79.4985 2100.0 79.918 2900.0 81.3895 2500.0 86.9459 2500.0 90.8869 2000.0 96.7081 2200.0 102.2935 2300.0 114.1141 2200.0 118.9584 2300.0 119.0488 2800.0 121.2426 2300.0 125.7419 2100.0 127.8287 2300.0 133.0641 2600.0 135.0443 2600.0 138.8076 2000.0 147.044 28000.0 149.6758 3700.0 149.686 12000.0 149.6964 6900.0 153.9949 13000.0 161.0598 16000.0 162.0676 67000.0 163.039 23000.0 163.0753 27000.0 167.974 3200.0 169.9904 28000.0 171.3902 2400.0 173.5209 4300.0 173.5335 110000.0 175.0395 21000.0 176.047 6400.0 177.0546 10000.0 178.0627 55000.0 181.0859 100000.0 185.2944 3200.0 189.0546 49000.0 190.0431 2500.0 190.0625 520000.0 190.6023 2400.0 191.0341 86000.0 191.0702 240000.0 193.0653 2800.0 193.086 430000.0 197.985 72000.0 205.0861 67000.0 206.0576 180000.0 215.9961 7000.0 221.0166 12000.0 221.0306 61000.0 221.0407 13000.0 221.0809 11000000.0 221.1201 32000.0 221.132 51000.0 221.1468 12000.0 222.0845 100000.0 263.0004 3300.0 264.0035 2700.0 270.9668 2500.0 271.1531 2400.0 277.0151 9000.0 299.0227 4000.0 304.0269 3400.0 306.0441 2900.0 307.1691 2400.0 310.7662 2600.0 311.996 7700.0 314.0077 3300.0 316.0263 6300.0 318.0419 2600.0 326.012 48000.0 327.0186 14000.0 328.0275 49000.0 329.0348 12000.0 330.0046 11000.0 330.0478 4100.0 331.0505 330000.0 334.0378 52000.0 342.042 32000.0 343.0555 2600.0 344.0216 150000.0 344.0585 23000.0 345.0291 46000.0 346.0746 24000.0 347.0453 24000.0 349.0609 110000.0 358.0384 73000.0 358.9928 11000.0 359.007 7600.0 359.0452 1100000.0 359.0967 25000.0 360.0523 29000.0 361.0595 3000.0 362.0321 100000.0 362.0588 3900.0 362.0737 25000.0 364.0838 28000.0 371.7932 2600.0 372.0541 16000.0 374.0143 7500.0 374.069 450000.0 375.0418 18000.0 376.0495 3100.0 376.999 3300.0 377.0142 3200.0 377.0561 1100000.0 390.0637 11000.0 392.0799 200000.0 417.9926 3800.0 418.0111 2100.0 418.0589 550000.0 418.1245 3600.0 502.3071 2700.0 511.9328 2300.0 534.7039 2900.0 576.5334 2700.0 654.9898 2600.0 698.2972 2700.0 END IONS BEGIN IONS SCANS=440 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1300000.0 317.1695 6000.0 318.1267 2500.0 330.044 7000.0 338.0085 34000.0 358.0345 3800.0 392.7502 2800.0 432.2201 3000.0 436.7552 2800.0 438.7754 2500.0 446.4049 3000.0 470.1312 3300.0 478.557 2700.0 490.7456 2600.0 538.3663 2600.0 546.6264 2400.0 553.9721 2900.0 628.1152 2800.0 644.0045 2400.0 END IONS BEGIN IONS SCANS=441 PEPMASS=357.0932 CHARGE=1 COLLISION_ENERGY=0.0 118.31 2200.0 147.0441 2600.0 154.0169 7700.0 172.0282 4500.0 173.5275 8900.0 190.0625 14000.0 193.0858 11000.0 206.0569 2900.0 221.081 40000.0 233.059 3000.0 251.0705 4900.0 333.3409 2300.0 356.0827 3200.0 END IONS BEGIN IONS SCANS=442 PEPMASS=743.1928 CHARGE=1 COLLISION_ENERGY=0.0 70.9744 2700.0 80.0131 2100.0 84.447 2300.0 86.5945 2600.0 87.4012 2300.0 98.3111 2300.0 134.2498 2500.0 138.7108 2400.0 162.0678 5100.0 163.0386 2600.0 163.3254 2600.0 173.5264 52000.0 173.5396 37000.0 174.6421 2200.0 175.0396 2400.0 178.0622 6500.0 178.5326 2600.0 189.0554 6900.0 190.0623 62000.0 190.3351 2300.0 191.0341 5500.0 191.0686 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187.0556 9000.0 187.0607 5100.0 187.0755 890000.0 187.0947 15000.0 188.0436 38000.0 188.0833 11000000.0 188.1002 20000.0 188.1237 34000.0 189.0528 2900.0 189.0911 950000.0 189.11 12000.0 190.0624 95000.0 190.0989 640000.0 191.0705 12000.0 191.1068 78000.0 196.0195 4400.0 199.0755 230000.0 200.0529 3500.0 200.0833 2000000.0 200.1002 4900.0 201.0912 98000.0 202.0991 820000.0 202.121 3600.0 203.0713 55000.0 203.1068 3900000.0 203.1237 6500.0 204.0798 13000.0 204.1148 43000.0 205.0863 170000.0 205.1225 670000.0 205.869 2400.0 211.2647 2400.0 215.0873 12000.0 215.1069 2300000.0 215.1254 3100.0 218.0943 42000.0 230.3832 2500.0 230.8228 2300.0 233.1174 560000.0 234.021 2700.0 END IONS BEGIN IONS SCANS=458 PEPMASS=306.1705 CHARGE=1 COLLISION_ENERGY=0.0 48.0242 2400.0 48.8488 2100.0 51.3956 2300.0 55.2684 5500.0 55.2707 29000.0 55.3168 2600.0 55.845 2700.0 57.3192 2100.0 57.7157 2300.0 57.763 2500.0 59.3284 2400.0 59.3873 2300.0 60.652 2400.0 61.0516 2200.0 64.4273 2400.0 65.5709 2400.0 65.821 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2500.0 47.7549 2200.0 51.6509 2400.0 53.0383 3200.0 53.3133 2100.0 54.007 3700.0 55.0177 19000.0 57.0333 93000.0 62.0158 2400.0 63.0235 4300.0 65.0386 12000.0 67.0541 32000.0 67.3353 2200.0 67.7136 3000.0 68.4436 2600.0 68.7397 2500.0 74.068 2100.0 74.4423 2200.0 77.0392 2400.0 79.0543 2700.0 80.3931 4000.0 83.5636 2700.0 89.4293 2600.0 90.3462 2200.0 91.0474 4100.0 91.054 510000.0 91.0595 2900.0 91.0609 6100.0 94.133 2300.0 95.049 6200.0 96.0135 3800.0 102.0468 8100.0 103.054 100000.0 105.0696 16000.0 111.0438 2500.0 112.5529 2400.0 113.3045 2500.0 114.0462 3200.0 115.054 750000.0 115.0628 6300.0 116.0619 150000.0 116.0707 3100.0 117.0697 200000.0 119.0849 2500.0 120.0604 2700.0 120.1012 2500.0 127.0547 19000.0 128.0618 670000.0 129.0696 8700000.0 129.0787 110000.0 129.0921 100000.0 129.0982 9200.0 129.9904 2300.0 130.041 21000.0 130.0774 14000.0 131.049 310000.0 131.0853 2300000.0 131.0948 14000.0 133.0647 42000.0 135.0439 170000.0 135.0803 22000.0 138.562 2200.0 139.0549 3100.0 141.0369 3100.0 141.0571 4900.0 141.0696 4300000.0 141.0796 73000.0 141.0895 9600.0 141.0952 35000.0 142.5558 2200.0 143.0489 240000.0 143.0601 6600.0 143.0853 130000.0 144.0441 3800.0 144.0568 280000.0 145.0519 4200.0 145.0646 220000.0 147.0438 7400.0 149.0595 33000.0 153.0695 23000.0 155.0603 73000.0 156.0568 54000.0 156.6914 2300.0 157.0646 3700000.0 157.0764 17000.0 158.9918 2400.0 159.0439 80000.0 159.0803 1100000.0 159.1018 3700.0 159.1423 2600.0 160.0519 62000.0 161.0596 160000.0 168.0567 14000.0 169.0407 3300.0 169.0647 1400000.0 169.0795 2800.0 171.0439 25000.0 171.0804 16000.0 172.0345 3100.0 172.0519 530000.0 172.0691 12000.0 173.0597 500000.0 173.5218 12000.0 173.5355 71000.0 174.068 33000.0 175.0398 16000.0 175.0756 32000.0 176.0463 16000.0 179.0603 2800.0 184.2193 2600.0 185.0597 160000.0 186.0488 3400.0 186.0675 550000.0 187.0754 2500000.0 188.0834 23000.0 189.0544 47000.0 189.0911 80000.0 194.2068 2700.0 198.0913 24000.0 199.0754 1600000.0 199.092 4700.0 199.106 3700.0 202.0622 6000.0 217.086 300000.0 END IONS BEGIN IONS SCANS=460 PEPMASS=342.2431 CHARGE=1 COLLISION_ENERGY=0.0 50.7967 2800.0 52.9881 2200.0 53.5343 2100.0 53.6843 2300.0 55.0541 120000.0 57.0698 11000.0 58.5566 2100.0 63.2813 2500.0 65.0384 6200.0 67.05 4200.0 67.0541 490000.0 67.9391 2200.0 68.0781 2300.0 69.0697 120000.0 71.4072 2500.0 74.3335 2100.0 74.9286 2100.0 75.1045 2700.0 78.1236 2300.0 78.8121 2100.0 79.054 250000.0 80.8174 2100.0 81.0697 420000.0 83.0853 30000.0 83.2544 2200.0 91.054 110000.0 93.0697 280000.0 94.8645 2500.0 95.0488 10000.0 95.0853 300000.0 95.0959 2700.0 95.4865 2300.0 97.101 4700.0 103.0541 15000.0 105.0697 64000.0 107.0853 160000.0 109.0648 3000.0 109.101 89000.0 109.8595 2400.0 115.0542 6800.0 117.0697 41000.0 118.065 2900.0 119.0853 79000.0 120.6799 2300.0 121.101 98000.0 123.0439 320000.0 123.117 15000.0 127.6258 2800.0 129.0698 42000.0 131.049 100000.0 131.0855 50000.0 133.0647 4400.0 133.101 47000.0 135.0434 3500.0 135.1166 21000.0 137.0481 4400.0 137.0596 370000.0 137.0715 10000.0 141.0697 15000.0 143.0489 40000.0 143.0856 21000.0 143.7858 2300.0 145.0646 130000.0 145.1007 18000.0 145.8622 2300.0 146.0597 15000.0 147.0439 42000.0 147.0807 2800.0 147.1165 19000.0 148.0504 2900.0 149.0596 420000.0 151.0752 66000.0 152.0706 11000.0 152.3993 2800.0 153.069 4600.0 155.0854 60000.0 157.0648 73000.0 157.1007 17000.0 159.0804 74000.0 160.0521 19000.0 161.044 14000.0 161.0597 770000.0 161.0755 9300.0 162.0679 12000.0 163.0612 4400.0 163.0754 160000.0 164.0706 41000.0 165.0704 5500.0 166.0862 27000.0 167.0859 15000.0 169.0648 33000.0 169.1011 31000.0 171.0805 54000.0 173.0599 320000.0 173.0965 12000.0 173.522 24000.0 173.5315 10000.0 173.5405 51000.0 174.068 25000.0 175.0756 470000.0 175.0928 3200.0 176.0829 2300.0 177.0911 53000.0 181.0649 14000.0 181.1005 6200.0 183.0805 94000.0 183.1171 11000.0 185.0961 61000.0 186.0681 5800.0 187.0756 140000.0 187.1113 3400.0 188.0831 19000.0 189.0912 130000.0 189.109 3500.0 191.1068 17000.0 195.0805 22000.0 195.1169 6300.0 197.0963 55000.0 197.132 5300.0 199.0756 59000.0 199.1116 18000.0 200.0834 24000.0 201.0697 4000.0 201.0913 400000.0 202.0991 26000.0 203.1069 86000.0 203.5521 2400.0 209.097 12000.0 209.1323 7400.0 211.1119 19000.0 213.0915 82000.0 213.1272 3800.0 214.0989 18000.0 215.0699 3000.0 215.107 240000.0 216.1146 15000.0 217.1229 23000.0 223.112 25000.0 225.127 8600.0 227.1068 34000.0 228.1145 5100.0 229.1228 62000.0 237.1283 10000.0 241.1226 46000.0 243.1375 27000.0 252.7187 2400.0 255.1379 40000.0 256.0748 2600.0 256.1463 6700.0 266.5213 2500.0 271.5031 2500.0 277.8061 3000.0 312.7333 2700.0 328.3362 2300.0 342.2432 100000.0 352.4108 2700.0 END IONS BEGIN IONS SCANS=461 PEPMASS=296.0923 CHARGE=1 COLLISION_ENERGY=0.0 50.8728 2400.0 58.2399 2100.0 61.1827 2400.0 70.4413 2400.0 70.8358 2200.0 92.8881 2600.0 99.89 2500.0 121.9053 2500.0 152.0623 7200.0 173.5302 24000.0 179.0737 3200.0 181.0648 39000.0 190.0668 3000.0 206.0601 3900.0 207.0682 19000.0 208.076 27000.0 209.0594 15000.0 210.0553 3000.0 219.0676 3200.0 225.079 10000.0 226.9528 2600.0 234.055 41000.0 235.0628 1400000.0 235.084 6200.0 236.0705 110000.0 238.0497 51000.0 247.0631 16000.0 249.041 9600.0 251.0577 7000.0 252.0383 2500.0 252.0651 15000.0 253.0725 7500.0 262.0501 7100.0 263.0574 780000.0 263.0813 4900.0 264.0654 170000.0 264.0981 4700.0 265.073 45000.0 266.0448 110000.0 266.0764 4400.0 267.0529 40000.0 280.0606 80000.0 281.0684 390000.0 282.076 21000.0 296.0919 360000.0 296.1479 3900.0 END IONS BEGIN IONS SCANS=462 PEPMASS=221.0812 CHARGE=1 COLLISION_ENERGY=0.0 42.3367 8000.0 45.0335 48000.0 45.3118 6600.0 45.5287 6500.0 47.076 9400.0 47.2708 7500.0 48.0781 7700.0 48.4353 7400.0 53.0022 48000.0 53.0384 6700.0 55.0178 76000.0 58.1275 8300.0 58.9015 8200.0 61.6656 9200.0 63.5221 8900.0 65.0386 8400.0 68.997 40000.0 74.2648 6800.0 77.0386 100000.0 78.0463 340000.0 79.054 660000.0 81.5063 6600.0 89.0387 84000.0 90.0463 130000.0 91.0541 860000.0 92.0258 8400.0 92.0619 86000.0 93.0699 48000.0 95.049 150000.0 96.7099 7400.0 97.4128 8500.0 102.0386 11000.0 102.0463 1200000.0 103.0099 9600.0 103.0541 560000.0 104.0619 530000.0 105.0335 140000.0 105.0443 10000.0 105.0697 350000.0 106.0412 8400.0 107.0488 1000000.0 109.0646 9000.0 114.0463 12000.0 115.0542 66000.0 116.0621 140000.0 117.0335 150000.0 117.0698 9400.0 118.0412 780000.0 119.0394 20000.0 119.049 1700000.0 119.0591 24000.0 120.0206 36000.0 120.0569 230000.0 121.0286 42000.0 121.0647 420000.0 121.8178 11000.0 122.0725 200000.0 129.0337 29000.0 130.0413 1900000.0 130.0523 18000.0 131.013 7700.0 131.049 900000.0 132.0206 140000.0 132.0453 9300.0 132.0569 1600000.0 132.0657 7100.0 132.0685 23000.0 133.0283 360000.0 133.0648 580000.0 134.0364 90000.0 134.0725 130000.0 134.5787 11000.0 135.044 2600000.0 135.056 49000.0 135.0804 23000.0 136.052 7900.0 137.0603 9100.0 141.5996 7700.0 142.0415 38000.0 144.0568 130000.0 145.0284 240000.0 145.0401 13000.0 145.0647 56000.0 146.0362 360000.0 147.044 5800000.0 148.0518 930000.0 149.0229 9200.0 149.0459 10000.0 149.0596 1300000.0 149.0698 6400.0 150.0675 540000.0 151.0759 18000.0 157.0395 140000.0 158.0362 190000.0 159.0076 120000.0 159.0441 280000.0 160.037 13000.0 160.0519 1600000.0 160.0668 19000.0 161.0233 290000.0 161.0479 5300.0 161.0598 1300000.0 162.0335 40000.0 162.0516 13000.0 162.0529 44000.0 162.0676 4400000.0 163.039 7500000.0 163.0552 21000.0 163.0752 730000.0 165.0913 19000.0 170.0359 18000.0 172.0527 10000.0 173.0231 110000.0 173.5261 81000.0 173.534 110000.0 173.5426 17000.0 174.0313 450000.0 175.0255 17000.0 175.0391 4100000.0 176.0104 17000.0 176.0307 7900.0 176.047 1100000.0 176.0643 8400.0 177.0548 1100000.0 178.0465 52000.0 178.0626 3900000.0 187.0389 60000.0 188.047 560000.0 189.0548 250000.0 190.0625 5200000.0 190.0831 15000.0 191.0137 45000.0 191.034 2200000.0 191.0705 210000.0 192.0418 77000.0 193.0677 26000.0 193.0694 9200.0 193.0861 2400000.0 193.1065 43000.0 205.0497 180000.0 206.0576 1200000.0 218.1167 7400.0 221.0811 410000.0 224.3188 7600.0 226.535 7700.0 END IONS BEGIN IONS SCANS=463 PEPMASS=320.1497 CHARGE=1 COLLISION_ENERGY=0.0 55.018 33000.0 55.2697 290000.0 55.2718 29000.0 55.8978 8200.0 59.5028 8800.0 62.2987 7600.0 63.0335 9100.0 66.2296 8500.0 66.5701 11000.0 68.2727 9200.0 69.1544 9700.0 70.2281 10000.0 75.126 8600.0 76.3852 8300.0 78.0464 55000.0 79.0542 130000.0 81.7542 7800.0 82.0651 10000.0 86.7176 11000.0 86.7463 7900.0 89.8204 11000.0 91.0543 240000.0 92.8048 11000.0 93.0702 11000.0 95.049 23000.0 100.0757 1100000.0 102.0466 200000.0 103.0542 150000.0 104.0619 83000.0 104.1587 8100.0 105.0333 13000.0 105.0699 230000.0 107.0492 160000.0 113.5255 10000.0 113.8215 11000.0 116.062 39000.0 117.0332 14000.0 118.0414 190000.0 119.0492 380000.0 120.057 42000.0 121.0648 120000.0 122.0727 93000.0 130.0414 600000.0 130.2535 8500.0 131.0493 230000.0 132.0211 23000.0 132.0571 410000.0 133.0281 79000.0 133.0649 600000.0 134.0727 85000.0 135.0442 620000.0 135.0804 110000.0 141.4679 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193.0862 26000000.0 193.1193 25000.0 193.1273 180000.0 193.139 27000.0 194.0902 19000.0 205.0502 240000.0 206.013 9700.0 206.0415 100000.0 206.0578 14000000.0 206.1031 14000.0 221.0021 20000.0 221.0158 120000.0 221.0305 600000.0 221.041 470000.0 221.0811 87000000.0 221.121 290000.0 221.1322 580000.0 221.1467 170000.0 221.1608 22000.0 222.0846 150000.0 223.0865 140000.0 273.0711 9400.0 277.127 93000.0 293.641 12000.0 299.0117 11000.0 308.0672 10000.0 END IONS BEGIN IONS SCANS=464 PEPMASS=661.2738 CHARGE=1 COLLISION_ENERGY=0.0 71.8631 2200.0 72.5924 2500.0 72.6618 2300.0 78.5499 2300.0 80.1661 2200.0 80.4231 2700.0 80.8726 2500.0 85.5333 17000.0 85.5348 3000.0 86.4695 2500.0 88.0691 2700.0 98.4324 2300.0 104.3528 2800.0 108.3343 2300.0 109.3349 2500.0 114.2908 2300.0 117.0564 2200.0 118.0293 2600.0 118.5687 2300.0 118.8716 2100.0 122.0572 53000.0 122.3333 2200.0 123.0412 26000.0 125.8711 2600.0 130.4611 2200.0 133.9412 2100.0 136.0168 2400.0 140.3046 2300.0 158.1349 2200.0 173.5253 44000.0 173.5392 27000.0 188.7172 2900.0 199.5022 2800.0 202.8856 2800.0 217.3739 2500.0 221.0802 11000.0 243.0622 3100.0 244.6397 2800.0 254.735 2700.0 304.4031 2600.0 327.1077 36000.0 330.1187 2600.0 342.0344 35000.0 342.1307 6100000.0 342.2059 19000.0 342.2291 31000.0 343.133 3500.0 345.1059 2900.0 350.567 2600.0 383.1559 9000.0 455.6665 2500.0 479.3565 2300.0 525.0709 2600.0 593.6865 2700.0 END IONS BEGIN IONS SCANS=465 PEPMASS=342.1316 CHARGE=1 COLLISION_ENERGY=0.0 50.038 3700.0 51.1809 3500.0 52.2676 3600.0 54.7629 3900.0 55.4169 3500.0 57.439 3200.0 57.9043 2800.0 58.3144 2900.0 58.8868 2500.0 59.1161 2800.0 60.3916 2800.0 60.6754 2700.0 63.6259 3700.0 66.2391 3300.0 67.6569 3400.0 69.472 3100.0 71.6597 2400.0 81.0696 3900.0 82.9908 2400.0 94.36 2700.0 97.5236 2700.0 106.5579 3300.0 114.5182 3500.0 121.3991 2800.0 122.0572 130000.0 123.0413 48000.0 127.0245 2800.0 129.1971 4400.0 135.0802 25000.0 138.721 2500.0 142.58 4200.0 146.3728 3300.0 160.7299 3500.0 161.0601 2900.0 163.0751 5500.0 164.0699 12000.0 167.2154 3200.0 173.4065 3000.0 173.522 29000.0 173.5379 130000.0 179.3049 3600.0 181.6029 4400.0 187.6984 2200.0 190.0639 2900.0 191.0702 77000.0 193.0866 2800.0 197.2691 2900.0 221.0807 110000.0 228.2761 3100.0 228.5988 3600.0 230.4212 3000.0 264.1868 3800.0 265.0842 2900.0 267.0241 3500.0 280.0956 2500.0 281.104 3000.0 296.727 4300.0 299.1133 3600.0 322.3414 3900.0 327.1082 37000.0 342.0834 13000.0 342.0967 2500.0 342.1311 580000.0 END IONS BEGIN IONS SCANS=466 PEPMASS=358.1053 CHARGE=1 COLLISION_ENERGY=0.0 58.0657 2200.0 66.4586 2200.0 66.8823 2400.0 76.2765 2200.0 79.8854 2600.0 80.7193 2400.0 84.7846 2200.0 87.4338 2100.0 90.1713 2500.0 97.5473 2600.0 103.6037 2400.0 103.6117 2300.0 112.3789 2500.0 124.8552 2100.0 149.6879 5500.0 149.7392 2400.0 170.2379 2300.0 173.5308 55000.0 173.5448 14000.0 180.0106 2600.0 183.6175 2600.0 217.9704 2600.0 222.2153 2800.0 239.452 2200.0 276.3654 2900.0 318.1549 2900.0 END IONS BEGIN IONS SCANS=467 PEPMASS=467.1817 CHARGE=1 COLLISION_ENERGY=0.0 61.424 4000.0 65.2249 5000.0 73.6868 2200.0 73.8828 3900.0 79.0541 16000.0 81.2988 5300.0 81.8453 5400.0 88.5311 4700.0 91.0542 16000.0 95.0494 2800.0 98.0601 13000.0 99.2362 4300.0 102.0464 21000.0 103.0541 10000.0 105.0697 11000.0 107.049 16000.0 118.0411 15000.0 119.049 30000.0 120.0573 8700.0 130.0414 27000.0 131.049 14000.0 132.0569 18000.0 133.028 3100.0 133.0649 29000.0 135.044 39000.0 146.0373 4700.0 147.044 130000.0 148.052 18000.0 149.0595 30000.0 150.0548 15000.0 150.0676 19000.0 159.0444 3700.0 160.0521 32000.0 161.0598 55000.0 162.0675 360000.0 162.0832 13000.0 163.039 130000.0 163.0752 55000.0 165.0914 14000.0 167.0703 17000.0 173.5236 20000.0 173.5325 23000.0 173.5428 19000.0 174.0313 39000.0 174.0466 2300.0 175.0391 96000.0 176.0471 71000.0 177.0548 68000.0 178.0626 290000.0 181.0876 2500.0 188.0463 26000.0 189.0547 220000.0 190.0624 2200000.0 191.014 16000.0 191.0339 420000.0 191.0701 200000.0 192.0413 20000.0 193.086 1800000.0 193.1276 9600.0 205.0498 11000.0 206.0575 850000.0 219.049 5700.0 221.0302 90000.0 221.0405 56000.0 221.0809 14000000.0 221.1203 68000.0 221.1321 92000.0 221.1465 27000.0 221.1606 6600.0 221.1748 8900.0 222.0844 84000.0 223.0865 15000.0 231.4379 5300.0 247.1068 15000.0 422.52 5100.0 END IONS BEGIN IONS SCANS=468 PEPMASS=342.2431 CHARGE=1 COLLISION_ENERGY=0.0 53.9134 2100.0 55.054 28000.0 57.0699 3700.0 60.0022 2100.0 67.0539 140000.0 67.058 2100.0 69.0695 23000.0 69.8596 2300.0 77.0384 2600.0 77.7704 2200.0 79.0539 81000.0 81.0695 90000.0 83.0852 8700.0 91.0539 27000.0 93.0695 87000.0 94.7934 2600.0 95.0488 5300.0 95.0852 76000.0 97.1003 3100.0 103.0544 3500.0 105.0698 8900.0 105.9464 2400.0 107.0852 48000.0 109.1009 33000.0 117.07 3600.0 119.0491 3200.0 119.0853 12000.0 121.0645 5700.0 121.1009 29000.0 123.0438 26000.0 123.1164 5100.0 129.07 5600.0 131.0489 17000.0 131.0857 5400.0 133.0648 3400.0 133.1019 6000.0 135.0436 15000.0 135.1164 12000.0 136.0474 11000.0 137.0595 63000.0 143.0496 5000.0 143.0855 3400.0 145.0645 14000.0 146.0596 5700.0 147.044 10000.0 147.1163 4000.0 149.0595 87000.0 150.0545 2800.0 151.0752 8100.0 155.0852 4800.0 157.0646 10000.0 159.0803 9700.0 161.0596 96000.0 162.0665 6500.0 163.0754 22000.0 164.0706 33000.0 164.8962 2500.0 166.0862 37000.0 169.0649 5200.0 169.1015 2400.0 171.081 4700.0 173.0598 43000.0 173.5306 18000.0 175.0756 42000.0 177.0913 11000.0 178.0859 4500.0 180.1006 2400.0 181.066 3700.0 183.0803 8600.0 185.0955 6000.0 187.0754 20000.0 189.0912 16000.0 191.1062 3100.0 197.0962 3200.0 199.0757 6600.0 201.0913 31000.0 203.107 8100.0 204.1025 6800.0 206.1907 12000.0 213.0915 10000.0 215.1071 19000.0 217.121 3600.0 227.1073 4400.0 229.1207 3000.0 240.8427 2900.0 241.1218 3100.0 255.139 3900.0 342.1409 3100.0 342.2439 49000.0 END IONS BEGIN IONS SCANS=469 PEPMASS=407.2587 CHARGE=1 COLLISION_ENERGY=0.0 54.5185 2300.0 54.6474 2300.0 55.0268 2200.0 55.0541 6000.0 57.0696 26000.0 59.0491 7100.0 59.8205 2100.0 61.0361 2300.0 62.2288 2900.0 64.0299 2400.0 65.4182 2300.0 67.0539 3500.0 67.8966 2400.0 69.0333 16000.0 69.0694 3100.0 70.7878 2900.0 70.8039 2300.0 70.9203 2400.0 71.786 2300.0 74.2407 2400.0 78.6276 2100.0 79.054 20000.0 81.0695 65000.0 83.0489 13000.0 84.183 2500.0 85.0645 22000.0 85.2406 2100.0 91.0539 23000.0 91.3247 2400.0 93.0695 88000.0 95.0488 130000.0 95.0852 30000.0 97.0645 15000.0 100.1085 2500.0 105.0173 2400.0 105.0695 100000.0 107.0851 76000.0 108.4658 2500.0 109.0645 43000.0 109.0721 2600.0 109.1015 3100.0 111.0798 2800.0 113.3712 3000.0 117.0695 10000.0 119.047 2300.0 119.0851 95000.0 119.4161 2500.0 121.0645 52000.0 121.1009 40000.0 123.08 47000.0 123.1169 3600.0 128.0997 2300.0 129.0697 9300.0 131.0853 58000.0 133.0646 26000.0 133.1008 48000.0 135.0802 46000.0 137.0585 2800.0 137.096 22000.0 137.8877 2800.0 139.0746 9600.0 142.0773 6800.0 143.0851 80000.0 144.0931 7200.0 144.3839 2300.0 145.1008 120000.0 146.1425 2400.0 147.08 57000.0 147.1164 16000.0 147.1488 2400.0 149.0957 49000.0 151.0751 93000.0 155.0854 13000.0 156.093 22000.0 157.1009 98000.0 157.3207 2600.0 159.0805 23000.0 159.1166 93000.0 161.0958 49000.0 161.1324 6700.0 163.1118 9100.0 165.0907 79000.0 167.0853 6000.0 167.4821 2600.0 168.093 2800.0 169.1009 52000.0 170.1086 3300.0 171.0807 3900.0 171.1167 85000.0 173.0962 28000.0 173.1325 26000.0 173.5315 100000.0 173.5442 7700.0 175.1115 13000.0 177.0908 56000.0 177.1273 6900.0 181.1008 40000.0 182.1092 6200.0 183.1168 44000.0 183.8065 2800.0 185.096 13000.0 185.1328 18000.0 186.1018 2900.0 187.1115 41000.0 189.1271 41000.0 193.1011 3200.0 194.1092 9300.0 195.1169 34000.0 197.095 2600.0 197.1323 35000.0 199.1117 63000.0 199.1478 15000.0 201.1276 16000.0 203.1426 27000.0 207.1166 23000.0 207.1381 37000.0 209.1328 41000.0 211.1116 14000.0 211.1485 4800.0 213.1272 24000.0 215.1436 6800.0 216.792 2800.0 217.1219 2900.0 221.1322 11000.0 221.1541 13000.0 223.1122 8500.0 223.1479 15000.0 224.1223 2700.0 225.1284 8900.0 225.1637 12000.0 227.1429 21000.0 229.1229 35000.0 231.1384 12000.0 235.1481 6900.0 237.1276 8700.0 241.1227 2300.0 247.145 4300.0 249.1279 3500.0 249.1625 2700.0 253.1559 2700.0 267.1424 2300.0 267.1746 10000.0 271.171 5700.0 278.4828 2300.0 279.173 2800.0 285.1843 12000.0 286.1926 9200.0 287.2004 9800.0 289.1647 2700.0 298.9062 2400.0 302.2735 2300.0 365.1493 2400.0 389.2461 2600.0 407.259 53000.0 END IONS BEGIN IONS SCANS=470 PEPMASS=340.1161 CHARGE=1 COLLISION_ENERGY=0.0 55.4184 2500.0 59.5615 2400.0 61.3331 2200.0 72.6618 2300.0 73.8085 2300.0 78.0461 5800.0 95.2487 2500.0 106.0412 3600.0 115.0541 3200.0 116.0616 6300.0 129.0694 8300.0 131.0488 9700.0 133.0648 2900.0 135.0437 65000.0 136.0515 45000.0 143.0484 3600.0 144.0567 8000.0 146.0598 3400.0 148.0513 7400.0 149.0593 7400.0 157.0643 23000.0 160.05 2500.0 161.0595 9600.0 173.0597 120000.0 173.5351 29000.0 174.0672 14000.0 176.0698 7800.0 186.0675 11000.0 187.0753 36000.0 189.0551 4800.0 192.0781 7200.0 204.0783 23000.0 209.8509 2300.0 296.267 2400.0 340.1132 3600.0 END IONS BEGIN IONS SCANS=471 PEPMASS=358.1413 CHARGE=1 COLLISION_ENERGY=0.0 51.9764 2200.0 54.9947 3000.0 57.1512 2300.0 65.7971 2200.0 68.4135 2400.0 71.7677 2700.0 71.8349 2200.0 73.7339 2300.0 78.0421 2400.0 78.0463 80000.0 79.0544 3400.0 100.2885 2400.0 103.0543 21000.0 104.2242 2800.0 106.0412 59000.0 112.0034 2900.0 114.9802 2800.0 115.0543 23000.0 116.0619 78000.0 117.0695 3600.0 119.0491 8700.0 122.0361 33000.0 124.0517 16000.0 128.0625 4000.0 128.2476 2400.0 129.0697 150000.0 131.049 180000.0 132.0568 6100.0 133.0646 3500.0 135.0439 960000.0 135.0535 5500.0 136.0517 500000.0 136.0633 8000.0 137.0607 3300.0 143.049 41000.0 144.0568 180000.0 145.0646 15000.0 146.0704 2600.0 147.0437 8000.0 147.0804 5600.0 148.0518 180000.0 149.0596 42000.0 150.0671 13000.0 157.0501 3700.0 157.0647 280000.0 159.043 3100.0 160.0516 6400.0 161.0596 120000.0 162.0674 26000.0 171.9829 2500.0 172.0519 22000.0 173.0598 800000.0 173.5265 36000.0 173.5426 10000.0 174.0676 220000.0 174.085 3300.0 175.0753 22000.0 176.0829 4000.0 185.0599 13000.0 186.0675 96000.0 187.0754 390000.0 187.095 13000.0 189.0546 42000.0 191.0702 26000.0 192.078 91000.0 200.0835 20000.0 201.6768 2900.0 204.0783 100000.0 224.1502 2600.0 259.8222 2300.0 310.7884 2500.0 342.1336 3000.0 END IONS BEGIN IONS SCANS=472 PEPMASS=205.0862 CHARGE=1 COLLISION_ENERGY=0.0 43.0177 16000.0 43.0447 2200.0 44.0806 2200.0 45.0334 59000.0 46.154 2400.0 48.7722 2300.0 50.3096 2100.0 50.8683 2400.0 54.1265 2300.0 55.0179 8000.0 55.054 3200.0 55.9342 21000.0 62.0916 2700.0 64.9454 2300.0 70.842 2500.0 72.937 22000.0 73.2091 2100.0 73.3746 2500.0 74.2605 2200.0 75.6827 2000.0 79.3038 2300.0 81.0696 6300.0 90.9475 23000.0 91.054 56000.0 99.0954 2800.0 100.5651 2500.0 103.0539 31000.0 105.0697 25000.0 107.0487 5100.0 107.085 6100.0 112.513 2600.0 113.9636 43000.0 114.9713 2700.0 115.0541 42000.0 116.0619 29000.0 117.0698 440000.0 117.0786 3400.0 119.0853 77000.0 123.1169 8400.0 126.2507 2500.0 127.0542 9400.0 128.0618 110000.0 128.9507 11000.0 129.0538 3100.0 129.0696 1300000.0 129.0792 6800.0 131.0489 110000.0 131.0854 40000.0 133.0647 52000.0 135.0333 4300.0 135.0439 120000.0 135.1165 2800.0 135.9446 2900.0 144.0568 97000.0 145.0515 6300.0 145.0646 1200000.0 145.0761 10000.0 147.0673 4200.0 147.0802 140000.0 149.0602 13000.0 155.06 22000.0 157.05 4100.0 157.0646 740000.0 157.0767 3600.0 159.0437 2400.0 159.0805 5800.0 160.0515 3800.0 161.0596 37000.0 163.0392 11000.0 163.0745 8200.0 172.0518 61000.0 173.0596 6400.0 173.5198 4000.0 173.5346 80000.0 174.05 7400.0 174.0675 330000.0 174.0857 4600.0 175.0576 3400.0 175.0753 300000.0 175.0934 9100.0 176.046 8300.0 177.0915 13000.0 187.0753 720000.0 187.095 4200.0 196.3267 2500.0 204.8578 2300.0 205.0859 45000.0 210.8929 2600.0 END IONS BEGIN IONS SCANS=473 PEPMASS=219.1019 CHARGE=1 COLLISION_ENERGY=0.0 43.0176 5600.0 43.5267 2300.0 46.6674 2000.0 51.4949 2900.0 55.0177 8400.0 55.8503 2400.0 55.9343 2500.0 57.5654 2300.0 79.0539 10000.0 91.054 11000.0 92.7588 2300.0 103.0541 4200.0 105.0694 8700.0 107.2093 2500.0 115.0451 7700.0 115.0539 130000.0 117.0695 36000.0 127.0538 5600.0 128.0617 310000.0 128.0706 2000.0 128.0777 3300.0 129.0695 17000.0 131.0489 15000.0 131.0853 51000.0 133.065 3300.0 135.0437 16000.0 137.0945 2600.0 141.0695 21000.0 142.0764 3000.0 143.049 82000.0 143.0589 3600.0 143.0853 750000.0 143.0957 8200.0 144.0574 3100.0 145.0644 55000.0 145.1011 14000.0 149.0595 18000.0 149.6829 4600.0 149.6937 5600.0 153.0698 17000.0 153.8537 2600.0 155.0602 19000.0 156.0569 9700.0 156.2221 2500.0 158.0722 3100.0 159.0439 13000.0 159.0802 46000.0 160.0514 11000.0 161.0596 14000.0 161.0965 4600.0 171.0446 11000.0 171.0803 390000.0 172.0518 95000.0 173.0597 210000.0 173.0758 7400.0 173.5244 22000.0 173.5428 19000.0 175.0748 9800.0 185.0594 6900.0 186.0675 120000.0 189.091 10000.0 191.3161 2500.0 196.5987 2500.0 201.091 140000.0 203.1436 2700.0 219.1759 4300.0 END IONS BEGIN IONS SCANS=474 PEPMASS=458.0663 CHARGE=1 COLLISION_ENERGY=0.0 56.3121 2400.0 74.6019 2400.0 78.046 3400.0 81.0333 3700.0 92.9048 2300.0 101.0376 2500.0 106.0404 3100.0 109.7862 2600.0 117.0696 20000.0 120.0858 2300.0 129.0694 4000.0 131.0486 15000.0 135.0437 160000.0 136.0515 50000.0 143.9119 2300.0 145.0647 16000.0 145.8534 2400.0 148.0519 8400.0 149.0587 2400.0 149.5386 2300.0 157.0647 12000.0 161.0594 17000.0 162.0677 9300.0 167.9863 2600.0 172.0524 3900.0 173.0596 64000.0 173.5214 7100.0 173.5366 28000.0 174.0674 20000.0 175.0752 36000.0 178.9795 7500.0 179.9866 25000.0 186.0674 11000.0 187.0751 53000.0 191.0693 2600.0 191.9866 31000.0 192.078 19000.0 193.9659 11000.0 194.9737 14000.0 195.9814 11000.0 197.998 2600.0 204.078 43000.0 207.959 8000.0 207.9817 220000.0 208.6454 2300.0 208.9907 2800.0 209.9612 2900.0 209.9987 3100.0 211.9765 7000.0 221.961 97000.0 221.9986 3200.0 223.977 3100.0 225.9922 80000.0 232.9907 3400.0 235.9768 18000.0 244.0179 2500.0 245.998 7300.0 247.0051 42000.0 249.0087 3600.0 262.0111 3000.0 263.0158 6800.0 264.0192 11000.0 265.0149 10000.0 276.0085 19000.0 277.0164 32000.0 288.1343 2400.0 295.027 20000.0 322.0285 10000.0 334.0329 2800.0 343.0949 2300.0 352.0397 75000.0 364.0397 59000.0 369.0575 3700.0 382.0512 89000.0 457.8282 2600.0 END IONS BEGIN IONS SCANS=475 PEPMASS=770.2024 CHARGE=1 COLLISION_ENERGY=0.0 74.514 2500.0 81.0335 12000.0 89.3626 2700.0 90.9474 3000.0 90.98 2200.0 94.6348 2200.0 133.0644 3100.0 135.0439 160000.0 149.0595 27000.0 149.6788 3400.0 149.6874 10000.0 149.6974 6600.0 157.966 12000.0 161.0595 3800.0 164.2085 2400.0 173.0598 3100.0 173.5308 21000.0 173.5422 2500.0 179.9867 2900.0 186.0749 2300.0 187.0756 6900.0 191.9868 64000.0 193.9657 3400.0 194.9739 23000.0 195.9817 13000.0 206.9743 2800.0 207.9817 80000.0 208.9881 6000.0 209.9975 6900.0 210.9686 2400.0 211.9761 7300.0 212.9849 2800.0 219.0109 4900.0 219.9816 4100.0 220.9887 11000.0 221.9608 19000.0 221.9979 5900.0 225.9923 27000.0 231.0103 31000.0 232.9896 16000.0 233.9975 7700.0 237.9922 21000.0 245.9978 16000.0 247.0053 48000.0 248.0129 14000.0 249.0199 8000.0 249.9918 13000.0 251.0005 9500.0 251.9749 2900.0 252.0067 7400.0 260.0123 14000.0 261.0199 12000.0 264.0072 2500.0 265.0151 16000.0 266.0236 2900.0 268.0033 3300.0 276.0081 280000.0 276.0429 5100.0 277.0159 180000.0 278.9968 4900.0 279.0315 71000.0 288.8136 2700.0 294.0188 3000.0 295.0265 150000.0 295.062 2500.0 312.0084 28000.0 318.0398 3700.0 322.029 27000.0 324.0435 14000.0 326.0607 15000.0 331.8773 2500.0 334.03 8300.0 336.0421 5100.0 340.039 19000.0 352.039 460000.0 353.0469 8200.0 353.2236 2800.0 354.0541 3300.0 364.0393 39000.0 365.0303 2600.0 366.0546 44000.0 372.0645 4800.0 382.0498 96000.0 383.0574 26000.0 384.0656 22000.0 385.8365 2900.0 396.0659 14000.0 400.0599 17000.0 412.0605 100000.0 414.076 230000.0 430.0713 10000.0 517.0949 8800.0 545.1454 2300.0 679.111 2800.0 END IONS BEGIN IONS SCANS=476 PEPMASS=293.1177 CHARGE=1 COLLISION_ENERGY=0.0 49.0697 2800.0 52.0645 3000.0 53.3063 2600.0 54.7219 2800.0 55.0178 58000.0 62.1784 2700.0 63.3009 2600.0 69.0337 3800.0 77.0388 13000.0 79.0541 51000.0 89.1291 3000.0 91.0073 2700.0 91.0541 88000.0 93.0697 34000.0 95.0491 32000.0 103.0541 580000.0 103.0602 3900.0 103.0623 4100.0 105.0444 4000.0 105.0617 6500.0 105.0697 550000.0 105.077 6700.0 105.0782 2500.0 107.049 220000.0 115.0542 61000.0 117.0698 22000.0 119.049 29000.0 121.0551 5400.0 121.0647 480000.0 121.0733 3600.0 125.2261 2600.0 128.0623 17000.0 129.0695 16000.0 130.0411 12000.0 131.0263 6700.0 131.049 2800000.0 131.0578 26000.0 131.0725 3500.0 132.0569 26000.0 132.1028 2600.0 133.0647 3100000.0 133.0882 19000.0 135.0319 2800.0 135.044 480000.0 135.0559 13000.0 138.2175 3000.0 141.0693 11000.0 143.0491 62000.0 143.0857 13000.0 144.0569 23000.0 145.0527 4700.0 145.0647 210000.0 147.0443 3700.0 149.0459 3700.0 149.0596 760000.0 149.0738 15000.0 153.0698 10000.0 154.0777 2900.0 156.0571 18000.0 157.0648 110000.0 159.0443 4100.0 160.0518 98000.0 160.2818 3000.0 161.0597 2200000.0 161.091 14000.0 165.0705 3500.0 169.0647 17000.0 171.0806 58000.0 172.0522 8300.0 173.0599 280000.0 173.0767 5500.0 173.5341 53000.0 174.0675 25000.0 179.0857 21000.0 181.0642 4100.0 185.0421 5700.0 185.0598 180000.0 186.0676 200000.0 187.0752 17000.0 192.0938 16000.0 193.0655 9500.0 193.1008 14000.0 194.073 17000.0 195.0806 7500.0 199.0758 21000.0 202.078 45000.0 203.0868 3400.0 204.1354 3400.0 205.0655 2800.0 205.1027 3000.0 206.0733 5000.0 207.0806 52000.0 207.1171 48000.0 214.1008 2600.0 217.1015 110000.0 218.0745 3500.0 219.0806 20000.0 220.0885 120000.0 221.0964 14000.0 222.115 2500.0 223.0752 15000.0 227.0848 8000.0 231.0809 14000.0 233.096 21000.0 235.0759 24000.0 235.112 340000.0 237.0911 2700.0 238.0628 4900.0 241.6271 2800.0 244.0885 3700.0 245.0669 3200.0 245.0961 140000.0 247.0756 13000.0 248.0833 93000.0 250.0981 3600.0 251.07 11000.0 251.8999 3100.0 260.0829 2900.0 261.0913 3600.0 263.0812 2500.0 263.1066 220000.0 264.079 10000.0 265.0872 7900.0 265.1221 11000.0 275.1067 3500.0 278.0942 43000.0 293.1174 150000.0 END IONS BEGIN IONS SCANS=477 PEPMASS=341.1387 CHARGE=1 COLLISION_ENERGY=0.0 50.408 8600.0 51.0234 57000.0 52.8484 5500.0 52.9605 5200.0 53.0386 27000.0 53.2851 5400.0 55.0179 100000.0 60.5185 5000.0 62.6741 9700.0 65.0388 6100.0 66.8095 5600.0 67.0542 57000.0 69.0335 49000.0 74.7486 8600.0 77.0389 120000.0 78.0463 48000.0 79.0542 310000.0 81.0334 87000.0 81.0699 45000.0 81.5633 8800.0 83.0491 47000.0 91.0542 270000.0 93.07 69000.0 94.0774 6900.0 95.0491 380000.0 100.4656 9100.0 103.0542 500000.0 103.0615 17000.0 105.0335 120000.0 105.0446 71000.0 105.0698 900000.0 106.0414 94000.0 107.0046 12000.0 107.0491 510000.0 108.2462 9900.0 109.065 54000.0 115.0543 110000.0 115.0947 5800.0 117.0698 230000.0 119.0492 190000.0 121.0285 81000.0 121.0647 510000.0 123.0338 6100.0 123.044 550000.0 123.0536 6700.0 128.0621 78000.0 129.0699 190000.0 130.0776 62000.0 131.0491 3500000.0 131.0856 77000.0 132.0571 52000.0 133.0648 4400000.0 133.4532 12000.0 134.0363 1400000.0 134.0452 6600.0 135.021 160000.0 135.0247 52000.0 135.0441 23000000.0 135.0634 47000.0 135.0682 160000.0 135.0816 26000.0 136.0514 6900.0 137.0597 310000.0 141.0699 66000.0 143.0491 170000.0 143.0856 250000.0 144.0568 44000.0 145.0516 15000.0 145.0648 820000.0 146.0724 32000.0 147.0442 39000.0 147.0809 39000.0 148.0517 88000.0 149.0597 3900000.0 151.0386 13000.0 151.0766 11000.0 153.0695 49000.0 155.061 12000.0 155.0857 42000.0 157.0648 410000.0 158.0725 56000.0 159.0441 140000.0 159.0806 120000.0 160.052 200000.0 161.0437 22000.0 161.0598 3300000.0 162.0684 7600.0 163.0756 320000.0 165.0546 65000.0 165.0698 41000.0 167.0857 39000.0 169.0649 130000.0 171.0806 460000.0 172.0513 30000.0 173.0464 3800.0 173.0599 1000000.0 173.0963 35000.0 173.5322 260000.0 174.0675 210000.0 175.0757 270000.0 175.088 10000.0 179.0857 43000.0 181.0647 61000.0 183.0805 100000.0 185.06 270000.0 185.0963 5600.0 186.0677 360000.0 187.0756 1200000.0 187.095 40000.0 188.083 29000.0 189.0552 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110000.0 249.0913 28000.0 251.0709 24000.0 251.1069 55000.0 253.1217 7100.0 255.1027 6300.0 257.0811 72000.0 261.0911 15000.0 263.1068 320000.0 265.0871 47000.0 265.1224 69000.0 267.1384 23000.0 269.1179 6600.0 275.1076 46000.0 277.122 7100.0 278.0954 33000.0 293.1176 190000.0 295.1334 22000.0 308.1048 400000.0 323.1281 420000.0 323.1668 16000.0 326.0706 13000.0 326.1153 760000.0 326.1598 6800.0 326.3135 5400.0 332.45 12000.0 341.1385 3000000.0 END IONS BEGIN IONS SCANS=478 PEPMASS=201.0912 CHARGE=1 COLLISION_ENERGY=0.0 40.7065 2400.0 43.0177 9500.0 44.0317 2900.0 49.3053 2200.0 50.5924 2300.0 55.0176 33000.0 55.9341 80000.0 56.9346 30000.0 57.4864 2800.0 63.0241 2700.0 63.0386 2500.0 65.0384 9100.0 66.0719 2300.0 66.1063 2100.0 68.6626 2800.0 72.9369 15000.0 73.937 3300.0 78.7123 2300.0 79.0539 41000.0 81.1232 2400.0 86.0232 2300.0 87.7482 2600.0 89.9396 2900.0 90.3203 2400.0 90.9474 20000.0 91.0539 21000.0 91.948 4900.0 92.0676 2400.0 95.0488 13000.0 103.054 24000.0 103.6395 2300.0 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173.0598 360000.0 173.0844 3000.0 173.5286 19000.0 173.5362 8100.0 181.0765 11000.0 185.06 32000.0 186.0676 250000.0 199.0753 8800.0 201.0912 150000.0 203.5991 3100.0 END IONS BEGIN IONS SCANS=479 PEPMASS=717.2909 CHARGE=1 COLLISION_ENERGY=0.0 69.3799 5600.0 77.0389 23000.0 79.0542 33000.0 81.0696 5200.0 82.8545 6300.0 84.3353 5200.0 91.0542 18000.0 95.049 22000.0 95.0854 11000.0 102.8276 2900.0 103.0542 38000.0 105.034 12000.0 105.0698 50000.0 107.0492 37000.0 115.0548 4300.0 117.0702 12000.0 121.0647 130000.0 123.0438 7900.0 128.0624 7600.0 131.0491 250000.0 133.0648 1400000.0 135.044 3600000.0 135.0679 10000.0 137.0597 3200.0 143.0491 11000.0 143.0853 23000.0 145.0647 90000.0 149.0458 6900.0 149.0597 360000.0 149.0697 3100.0 151.0756 4500.0 157.0647 52000.0 159.0431 3200.0 160.0516 12000.0 161.0598 1400000.0 163.0754 78000.0 171.0807 93000.0 172.0528 3100.0 173.0599 120000.0 173.5116 3400.0 173.5252 49000.0 173.5445 24000.0 173.5531 3600.0 175.0756 61000.0 185.0598 44000.0 186.0677 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169.0648 59000.0 170.0725 22000.0 171.0804 90000.0 172.0706 2700.0 172.0883 310000.0 172.1053 5700.0 173.0598 200000.0 173.096 30000.0 173.5246 33000.0 173.5379 46000.0 174.0676 48000.0 174.0861 4000.0 174.1039 130000.0 175.0755 32000.0 175.1115 4400.0 176.0835 33000.0 177.0912 29000.0 183.0808 19000.0 184.0883 160000.0 185.0597 85000.0 185.0961 7600.0 186.0674 4800.0 187.0754 53000.0 188.0832 610000.0 189.0911 54000.0 190.0988 40000.0 191.1067 3600.0 199.0759 13000.0 200.0833 110000.0 200.4867 3000.0 201.0909 3700.0 202.0991 51000.0 203.1068 230000.0 205.0867 6500.0 205.1223 42000.0 212.5296 2500.0 215.0839 3000.0 215.1069 130000.0 223.6319 2400.0 233.1174 30000.0 END IONS BEGIN IONS SCANS=485 PEPMASS=274.1442 CHARGE=1 COLLISION_ENERGY=0.0 46.4163 2300.0 47.767 11000.0 53.0383 2300.0 54.0337 6500.0 55.0542 4700.0 56.0494 11000.0 59.6715 2500.0 62.4028 2600.0 63.1364 2600.0 65.0382 8000.0 65.9783 2900.0 66.7375 2100.0 67.0415 16000.0 67.0541 110000.0 67.1082 2400.0 67.9335 2200.0 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7900.0 182.4776 2200.0 186.1278 150000.0 187.1116 21000.0 191.03 23000.0 191.0703 4900000.0 191.1018 7600.0 191.1113 9400.0 207.0657 21000.0 232.1334 12000.0 233.6312 2700.0 240.8978 2300.0 241.36 2500.0 242.7877 2200.0 247.8932 2300.0 257.2697 2800.0 258.5764 2600.0 274.1439 42000.0 END IONS BEGIN IONS SCANS=486 PEPMASS=337.144 CHARGE=1 COLLISION_ENERGY=0.0 50.8732 2100.0 52.3792 2200.0 53.2375 2200.0 53.7096 2100.0 53.8619 2600.0 54.5357 2400.0 54.7109 2400.0 54.7695 2300.0 56.1881 2300.0 57.131 2400.0 61.1011 2500.0 61.4789 4700.0 61.8284 2300.0 62.0284 2200.0 62.0588 2300.0 63.8709 2300.0 63.8928 2300.0 64.3365 2600.0 66.6438 2200.0 67.0489 2500.0 67.4178 2400.0 67.9218 2300.0 70.1702 2200.0 71.3034 2300.0 74.3535 2100.0 76.8262 2400.0 78.0523 2300.0 79.0968 2100.0 83.1273 2200.0 83.7184 2600.0 85.3545 2300.0 88.2437 2700.0 91.054 18000.0 98.4965 2400.0 102.0526 2400.0 102.099 2500.0 103.0216 2600.0 103.0541 18000.0 105.0704 3500.0 108.4787 2800.0 110.2788 2200.0 112.035 2600.0 113.6519 2400.0 116.5172 2600.0 117.0695 13000.0 120.0291 2100.0 121.0646 42000.0 125.6716 2900.0 131.0489 220000.0 135.0438 230000.0 136.052 20000.0 136.1056 2200.0 141.0694 2300.0 145.0647 3000.0 145.7187 3000.0 146.0726 100000.0 147.0798 11000.0 147.844 2600.0 149.0458 7700.0 149.0594 760000.0 149.0705 2300.0 149.4098 2700.0 150.0672 110000.0 151.0622 4500.0 151.0751 390000.0 151.2981 2900.0 152.7339 2300.0 158.0728 6400.0 161.0441 7500.0 161.0595 620000.0 161.0752 3300.0 162.0681 15000.0 163.4538 2500.0 165.0909 1000000.0 165.1037 2400.0 169.0661 2500.0 173.0597 120000.0 173.5262 59000.0 173.539 74000.0 174.068 32000.0 176.8054 2400.0 177.0649 3200.0 177.0735 7600.0 177.091 1000000.0 177.1046 5300.0 179.7452 2600.0 185.0598 92000.0 187.8721 2800.0 189.091 280000.0 189.106 2600.0 199.0758 22000.0 201.0914 55000.0 207.9743 2500.0 208.194 2900.0 215.107 13000.0 221.3699 2300.0 231.5782 2700.0 233.3309 2400.0 236.4697 2500.0 241.974 2600.0 242.2448 2600.0 243.3297 2500.0 243.3405 2500.0 244.0714 2300.0 247.9185 2600.0 248.1197 38000.0 256.2276 2700.0 256.7129 2500.0 261.0909 4000.0 264.1147 3300.0 274.1929 2300.0 275.1066 11000.0 276.1146 27000.0 277.0854 5600.0 278.9993 2500.0 279.1383 75000.0 291.1025 12000.0 292.1109 7400.0 305.1173 3700.0 306.1254 200000.0 307.0953 2800.0 307.1336 65000.0 319.0524 2600.0 322.1202 32000.0 337.143 28000.0 END IONS BEGIN IONS SCANS=487 PEPMASS=538.2076 CHARGE=1 COLLISION_ENERGY=0.0 64.8575 5400.0 66.1577 7400.0 67.0298 2200.0 69.4969 4700.0 73.7944 2200.0 75.044 33000.0 77.1964 5000.0 77.324 6300.0 77.533 4600.0 79.0542 6500.0 80.0497 5600.0 81.0333 1400000.0 81.0382 8000.0 82.0286 48000.0 83.5453 4500.0 94.0652 18000.0 98.0598 42000.0 99.8395 4400.0 104.0492 13000.0 105.0546 6400.0 107.9046 4900.0 110.0235 150000.0 115.7956 2600.0 116.5057 2600.0 122.0597 40000.0 122.6199 6300.0 123.1155 4800.0 132.0442 33000.0 134.0599 17000.0 136.0385 17000.0 150.041 7000.0 150.0548 480000.0 153.6891 2800.0 173.522 84000.0 173.5409 86000.0 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10000.0 377.1028 7200.0 379.0712 19000.0 379.1173 110000.0 380.1254 100000.0 381.1329 160000.0 382.1412 500000.0 383.1132 47000.0 385.1648 66000.0 393.0968 58000.0 394.1053 22000.0 395.1074 160000.0 395.1497 310000.0 397.164 76000.0 398.1365 51000.0 408.1208 180000.0 409.1283 200000.0 410.0895 4100.0 410.1363 470000.0 411.1075 130000.0 413.1594 200000.0 421.1545 7800.0 423.1442 170000.0 424.1751 40000.0 426.1314 110000.0 426.1975 7100.0 428.8657 2700.0 441.1541 190000.0 452.1709 3200.0 470.1747 7100.0 492.1998 67000.0 514.1749 5200.0 527.1172 6800.0 END IONS BEGIN IONS SCANS=488 PEPMASS=680.3183 CHARGE=1 COLLISION_ENERGY=0.0 71.9725 5700.0 75.0441 7100.0 78.8986 5700.0 79.0542 34000.0 80.0494 42000.0 81.0221 29000.0 81.0334 6500000.0 81.0446 46000.0 82.0288 30000.0 85.1654 5700.0 91.9504 3300.0 94.065 54000.0 95.0491 26000.0 98.0235 13000.0 98.0599 63000.0 104.0493 20000.0 106.065 44000.0 108.3368 2900.0 110.0238 230000.0 121.2577 3200.0 121.5298 2900.0 122.0599 130000.0 132.0444 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409.1284 79000.0 410.1359 210000.0 411.1069 36000.0 413.1592 450000.0 423.1436 85000.0 426.1313 67000.0 441.1539 390000.0 492.2007 54000.0 495.741 3200.0 520.1976 10000.0 538.206 30000.0 END IONS BEGIN IONS SCANS=489 PEPMASS=652.2871 CHARGE=1 COLLISION_ENERGY=0.0 67.0182 15000.0 68.317 4500.0 79.0541 83000.0 80.0494 98000.0 81.027 29000.0 81.0332 17000000.0 81.0417 100000.0 81.0426 300000.0 81.0443 64000.0 81.0823 14000.0 82.0053 18000.0 82.0285 57000.0 83.6679 4500.0 86.7967 4800.0 89.0612 12000.0 94.0648 160000.0 94.533 14000.0 95.0491 61000.0 95.6453 4800.0 98.0598 150000.0 104.0493 43000.0 106.0648 110000.0 108.0439 31000.0 110.0235 590000.0 115.7782 14000.0 122.0597 340000.0 128.6942 12000.0 132.0441 320000.0 134.0599 340000.0 136.039 390000.0 150.0547 7000000.0 150.0662 89000.0 160.0392 91000.0 160.4429 19000.0 166.6921 13000.0 173.524 340000.0 173.5425 180000.0 175.8281 5400.0 176.9941 13000.0 178.013 170000.0 178.0218 38000.0 178.0498 32000000.0 178.0624 130000.0 178.0861 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250.3851 12000.0 254.2039 5800.0 260.8401 11000.0 271.0971 21000.0 273.0762 170000.0 285.1011 38000.0 300.1235 1300000.0 314.1395 15000.0 322.1207 35000.0 323.1275 14000.0 335.1298 49000.0 336.1001 25000.0 337.1035 61000.0 339.1228 67000.0 345.1342 81000.0 349.1066 72000.0 350.1148 100000.0 351.0847 57000.0 351.123 530000.0 352.131 64000.0 354.1466 150000.0 360.1566 75000.0 362.1155 18000.0 365.0981 140000.0 365.14 150000.0 366.1078 190000.0 366.1472 350000.0 367.1181 720000.0 370.1383 20000.0 377.1058 5300.0 379.1195 86000.0 380.1272 190000.0 381.1333 500000.0 382.1414 1600000.0 383.1133 160000.0 385.1636 110000.0 393.0971 22000.0 394.1071 15000.0 395.0998 9600.0 395.1495 1300000.0 397.1664 22000.0 398.1372 220000.0 399.1423 26000.0 408.1206 160000.0 409.1285 210000.0 410.1368 880000.0 411.1078 190000.0 413.16 1300000.0 413.2218 21000.0 423.1447 190000.0 426.1315 250000.0 441.1549 720000.0 492.202 140000.0 520.2013 40000.0 END IONS BEGIN IONS SCANS=491 PEPMASS=441.1548 CHARGE=1 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172.0365 12000.0 173.5221 23000.0 173.5313 61000.0 173.5412 34000.0 178.0494 41000.0 200.0316 68000.0 221.0829 5200.0 253.0941 84000.0 269.0396 7400.0 269.0568 5000.0 269.0894 520000.0 273.0749 30000.0 297.0071 8600.0 297.0845 2400000.0 300.1232 27000.0 310.0683 5400.0 324.0837 7000.0 325.0917 84000.0 332.7985 4900.0 340.0194 27000.0 340.1151 4600000.0 352.1153 110000.0 383.146 25000.0 385.1656 5900.0 389.0963 4800.0 405.0919 12000.0 413.1604 19000.0 420.1178 16000.0 433.0886 3000.0 435.1415 98000.0 448.1112 6000.0 457.8185 2800.0 463.1357 91000.0 470.1523 7800.0 486.075 8700.0 486.0857 3100.0 486.1517 370000.0 486.2305 6900.0 490.8794 4700.0 501.1754 130000.0 502.1476 16000.0 516.1987 140000.0 517.1645 5400.0 530.1402 9400.0 530.2321 3100.0 532.1935 390000.0 532.2831 3100.0 545.1615 6800.0 559.2029 6700.0 560.1887 260000.0 655.6205 4800.0 657.2408 650000.0 END IONS BEGIN IONS SCANS=493 PEPMASS=673.2161 CHARGE=1 COLLISION_ENERGY=0.0 69.0444 7800.0 70.8921 2200.0 75.0798 2300.0 81.2289 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335.0886 8700.0 335.1279 38000.0 336.1356 47000.0 336.1749 3100.0 337.1069 29000.0 347.9841 2300.0 349.1102 3000.0 350.1146 13000.0 351.1227 28000.0 352.0863 3900.0 352.1303 64000.0 353.1011 6200.0 355.1524 7200.0 365.0951 8900.0 365.1388 37000.0 366.1461 2800.0 367.1545 12000.0 368.1249 6500.0 378.1093 14000.0 379.1176 24000.0 380.1259 59000.0 381.0966 15000.0 383.15 32000.0 393.133 22000.0 396.1204 19000.0 411.1443 38000.0 462.1908 5200.0 489.8201 2600.0 504.105 2600.0 END IONS BEGIN IONS SCANS=497 PEPMASS=627.2318 CHARGE=1 COLLISION_ENERGY=0.0 64.4985 2500.0 66.0129 2800.0 71.8074 2300.0 73.729 2100.0 92.3542 2500.0 96.2721 2700.0 96.6293 2200.0 99.6871 2300.0 103.6257 2600.0 120.0415 20000.0 124.9443 2800.0 140.6468 2700.0 141.3251 2300.0 143.4313 2100.0 149.6839 9300.0 149.6944 7700.0 152.3682 2500.0 162.541 2500.0 173.529 38000.0 173.5444 8400.0 178.0495 7000.0 200.0319 7400.0 215.4245 2600.0 220.9111 2400.0 252.2368 2400.0 253.094 16000.0 269.0894 110000.0 297.0846 440000.0 310.105 430000.0 310.1466 5300.0 316.4331 2400.0 322.1043 8500.0 325.0886 2800.0 330.0111 2700.0 340.1152 380000.0 340.1649 3000.0 352.1143 3900.0 377.0509 2700.0 382.893 2400.0 405.1318 9500.0 433.1226 8100.0 456.1411 39000.0 471.1655 17000.0 486.1883 20000.0 502.1832 74000.0 530.1789 37000.0 589.536 2800.0 627.231 79000.0 END IONS BEGIN IONS SCANS=498 PEPMASS=650.3076 CHARGE=1 COLLISION_ENERGY=0.0 65.323 4700.0 67.6509 2800.0 71.3265 2200.0 81.0333 670000.0 81.0389 5800.0 87.5815 2500.0 91.1967 2800.0 94.065 2600.0 98.0598 6300.0 99.6665 2600.0 101.3937 2500.0 102.1403 2400.0 106.0645 2700.0 107.9032 2900.0 110.0235 21000.0 110.3071 3000.0 122.0599 13000.0 132.0441 15000.0 134.0598 15000.0 136.0395 13000.0 137.7339 2400.0 146.4731 2500.0 150.0411 3700.0 150.0547 280000.0 162.1989 2300.0 166.2465 2500.0 172.5361 2600.0 173.5202 5600.0 173.5356 81000.0 178.0498 1400000.0 185.0715 2500.0 219.6758 2600.0 252.8792 2500.0 258.7371 2800.0 279.8394 2600.0 285.2986 2500.0 292.5379 2600.0 300.1238 24000.0 330.147 3600.0 351.122 6000.0 352.1298 24000.0 354.8698 2500.0 365.1376 21000.0 380.1253 17000.0 383.1493 49000.0 396.1208 4600.0 411.1438 45000.0 450.4547 3000.0 507.4238 2400.0 594.6995 2900.0 END IONS BEGIN IONS SCANS=499 PEPMASS=280.0948 CHARGE=1 COLLISION_ENERGY=0.0 49.1195 2200.0 54.8663 2300.0 58.4264 2200.0 59.2393 2300.0 60.8363 2600.0 63.1085 2500.0 65.2857 2200.0 70.2721 2200.0 81.8484 2700.0 83.2903 2100.0 93.0574 2400.0 93.7606 2500.0 95.5203 2300.0 96.4257 2200.0 98.9281 2900.0 98.9819 2300.0 109.4923 2300.0 111.605 2700.0 115.3264 2600.0 118.245 2200.0 120.0415 5200.0 121.1257 2700.0 137.9423 2300.0 161.0584 2700.0 164.9294 2300.0 173.5285 54000.0 175.6325 2400.0 180.9866 2300.0 202.05 2900.0 219.0571 19000.0 220.0599 41000.0 221.4831 2200.0 280.0962 83000.0 END IONS BEGIN IONS SCANS=500 PEPMASS=675.267 CHARGE=1 COLLISION_ENERGY=0.0 66.8021 18000.0 66.8049 4000.0 66.9711 2500.0 68.406 2400.0 69.2673 2500.0 70.3603 88000.0 70.3641 15000.0 75.0269 2200.0 79.4357 2500.0 81.0088 2300.0 82.1458 2700.0 83.385 2500.0 84.6698 2500.0 85.1773 2400.0 86.3357 2300.0 88.8576 2300.0 101.0737 2300.0 115.3543 2400.0 129.5169 2600.0 158.3077 2200.0 173.5265 16000.0 173.5372 62000.0 180.7317 2700.0 197.1542 2300.0 209.7531 2400.0 222.0257 2300.0 223.946 2700.0 286.0149 2400.0 287.061 2500.0 287.4895 2500.0 324.0716 2400.0 349.3474 2500.0 368.0897 2400.0 369.7715 2500.0 372.8662 2200.0 394.1755 2900.0 408.1696 2600.0 424.5204 3200.0 426.3569 2800.0 443.0478 2700.0 444.1785 6300.0 445.1895 3500.0 457.1499 6700.0 469.1817 2900.0 472.1745 88000.0 473.1837 10000.0 478.1956 3000.0 486.1535 11000.0 497.1789 15000.0 497.1874 3000.0 500.1703 35000.0 501.178 15000.0 527.1922 3500.0 544.2276 7800.0 545.2323 50000.0 556.1954 57000.0 560.3754 2500.0 573.1254 4600.0 573.2351 1200000.0 573.3389 5000.0 574.2354 6600.0 597.265 2900.0 601.2303 450000.0 605.2508 18000.0 615.2452 4600.0 632.2523 3400.0 633.0097 9000.0 633.2557 2500000.0 643.2397 25000.0 657.2556 26000.0 675.2673 120000.0 682.7578 2400.0 END IONS BEGIN IONS SCANS=501 PEPMASS=288.1235 CHARGE=1 COLLISION_ENERGY=0.0 47.0495 2400.0 47.4871 2200.0 47.7664 4400.0 47.7687 7600.0 48.7824 2500.0 52.2479 2400.0 55.7401 2700.0 61.3253 2600.0 61.6237 2500.0 65.5028 2200.0 66.137 2300.0 70.6197 2700.0 73.0755 2400.0 74.096 2400.0 78.0612 2200.0 78.3179 2200.0 79.0542 14000.0 80.3113 2600.0 91.0542 18000.0 91.7476 2500.0 92.0333 2200.0 98.0598 8400.0 102.0463 2500.0 103.0541 31000.0 105.0336 3300.0 105.0697 43000.0 106.2332 2400.0 108.6786 2800.0 111.5691 2100.0 115.0543 2500.0 118.042 9200.0 119.0491 31000.0 119.7404 2500.0 120.0569 19000.0 121.0645 2600.0 129.9304 2300.0 132.0569 51000.0 133.0285 20000.0 133.0648 53000.0 133.5214 2400.0 135.0803 15000.0 135.1898 2300.0 136.3133 2400.0 146.0357 7800.0 147.0439 47000.0 148.0515 190000.0 151.0415 2500.0 151.3949 2200.0 156.6224 2600.0 160.0518 95000.0 161.0595 27000.0 163.059 11000.0 163.0753 840000.0 163.0914 5000.0 167.0341 46000.0 168.0375 38000.0 173.5232 5200.0 173.5317 74000.0 173.5412 6900.0 176.047 110000.0 184.0328 2300.0 187.5032 2500.0 191.0302 18000.0 191.0703 3900000.0 204.1093 3000.0 211.0842 2800.0 239.4389 2800.0 245.2666 2700.0 250.4921 2300.0 261.6057 2200.0 284.438 2400.0 288.0959 7900.0 END IONS BEGIN IONS SCANS=502 PEPMASS=627.232 CHARGE=1 COLLISION_ENERGY=0.0 66.6221 2400.0 66.7017 2200.0 68.7749 2500.0 74.6857 2400.0 78.725 2500.0 82.9803 2100.0 101.9928 2300.0 106.1061 2500.0 107.2946 2200.0 108.9042 2500.0 112.2516 2300.0 120.0414 22000.0 126.9754 2300.0 128.9849 2100.0 132.3295 2500.0 136.3172 2400.0 138.2757 2700.0 140.5775 2400.0 141.3815 2300.0 153.382 2000.0 162.5913 2600.0 172.0696 2500.0 173.5304 98000.0 173.542 15000.0 177.8176 3000.0 188.0312 140000.0 191.0704 3000.0 226.2144 2900.0 297.0851 2700.0 310.0742 2100.0 310.1049 330000.0 310.1461 3700.0 325.0917 3000.0 340.1153 280000.0 365.1355 7700.0 406.5245 2600.0 416.1407 2600.0 433.1257 110000.0 433.1891 3900.0 530.1771 50000.0 537.1439 2500.0 627.2298 60000.0 END IONS BEGIN IONS SCANS=503 PEPMASS=304.1548 CHARGE=1 COLLISION_ENERGY=0.0 48.2715 5200.0 48.8502 2200.0 49.2096 2400.0 52.4772 2200.0 52.6415 2300.0 54.0338 23000.0 55.0179 6600.0 55.0542 11000.0 55.2684 5300.0 55.2709 44000.0 55.4605 2400.0 56.0494 30000.0 56.0967 2600.0 60.1426 2100.0 62.2501 2300.0 65.0386 22000.0 67.0415 40000.0 67.054 250000.0 68.0493 30000.0 69.0334 8900.0 71.0269 2200.0 79.054 7000.0 80.0494 29000.0 82.0232 5400.0 82.0285 450000.0 82.0649 450000.0 83.0728 120000.0 84.0806 150000.0 91.0542 33000.0 92.0494 7000.0 102.0465 10000.0 103.0541 19000.0 104.0621 7000.0 105.022 2500.0 105.0697 39000.0 107.0489 31000.0 108.0805 3900.0 110.06 1200000.0 113.0595 73000.0 113.8139 2600.0 118.0411 30000.0 119.049 48000.0 120.2167 2700.0 121.0647 7100.0 122.0721 3600.0 130.0314 3100.0 130.0413 69000.0 131.049 33000.0 132.0568 39000.0 133.0647 110000.0 134.0724 14000.0 135.0441 77000.0 135.0804 6400.0 136.075 3600.0 138.8455 3100.0 139.2962 2900.0 144.0568 3500.0 145.7888 2400.0 146.0362 23000.0 147.044 360000.0 148.0519 44000.0 149.0596 56000.0 150.0675 64000.0 158.035 6600.0 158.2866 2700.0 159.0441 22000.0 160.0518 91000.0 161.0597 230000.0 162.0513 4500.0 162.0675 1100000.0 163.0389 330000.0 163.0753 190000.0 164.0479 2500.0 164.4524 2200.0 165.0912 48000.0 167.0702 51000.0 172.0516 5100.0 173.5212 10000.0 173.5338 76000.0 173.5488 2800.0 174.0161 2500.0 174.0313 120000.0 175.0391 290000.0 176.047 230000.0 177.0547 240000.0 178.0442 9100.0 178.0493 4400.0 178.0626 1000000.0 178.0807 15000.0 179.0705 8700.0 180.8879 13000.0 181.086 42000.0 188.0469 65000.0 189.0347 7900.0 189.0547 610000.0 189.0744 7300.0 190.0226 21000.0 190.0624 5600000.0 190.0773 30000.0 190.1017 4700.0 190.4612 2300.0 190.8697 2700.0 191.0141 5100.0 191.0339 1600000.0 191.0701 450000.0 191.088 6900.0 192.0415 81000.0 193.0445 8400.0 193.086 4200000.0 193.2549 3100.0 195.0516 2400.0 201.8845 2500.0 205.0499 61000.0 206.0347 5900.0 206.0575 2500000.0 207.0652 140000.0 208.8832 70000.0 221.0019 4000.0 221.0301 89000.0 221.0406 21000.0 221.0809 14000000.0 221.0999 36000.0 221.1202 46000.0 221.1318 63000.0 221.1466 17000.0 226.8941 55000.0 242.1184 24000.0 262.1436 19000.0 270.1116 6900.0 END IONS BEGIN IONS SCANS=504 PEPMASS=217.0862 CHARGE=1 COLLISION_ENERGY=0.0 42.2832 2200.0 42.4815 5100.0 43.0178 76000.0 44.0087 2200.0 45.0335 58000.0 45.1593 2300.0 45.7493 3100.0 45.8503 2500.0 47.0591 2600.0 47.9032 2400.0 47.9599 2300.0 48.275 2400.0 49.5677 4900.0 50.9607 4900.0 53.0386 12000.0 55.0177 43000.0 55.4483 2200.0 57.0333 220000.0 57.3061 2200.0 57.7436 2400.0 58.3207 2900.0 58.6886 2500.0 58.7185 2200.0 59.4079 2400.0 63.6705 2400.0 64.0696 5100.0 67.0541 72000.0 68.068 2300.0 70.2039 2100.0 73.5758 2200.0 73.6768 2800.0 75.4901 2300.0 77.0389 5300.0 77.5863 2500.0 78.1659 2500.0 79.582 2200.0 80.5172 2300.0 81.0331 2500.0 81.847 2400.0 82.3509 2200.0 91.0541 1200000.0 91.0592 5000.0 91.0608 10000.0 94.9671 2800.0 95.0493 19000.0 102.046 2800.0 103.054 210000.0 105.0697 51000.0 110.9998 2400.0 111.4513 2500.0 114.4518 2200.0 115.0406 2900.0 115.0449 3800.0 115.0541 1700000.0 115.0624 9400.0 116.0619 340000.0 117.0697 430000.0 119.1364 3400.0 121.6561 3000.0 125.411 2300.0 127.0544 60000.0 127.6007 2100.0 128.0512 5300.0 128.0619 1500000.0 128.0709 4200.0 129.0469 9900.0 129.0696 19000000.0 129.0789 180000.0 129.0875 20000.0 129.0923 180000.0 129.112 2800.0 130.0411 41000.0 130.0776 39000.0 131.0489 690000.0 131.0616 4600.0 131.0853 5200000.0 131.0948 37000.0 131.1085 4300.0 132.8973 4800.0 133.0646 85000.0 133.3363 3200.0 135.0439 390000.0 135.0802 120000.0 139.0547 8900.0 140.0612 6000.0 141.0441 28000.0 141.0697 9900000.0 141.0798 110000.0 141.0926 33000.0 141.0953 9000.0 141.103 4600.0 141.5743 2300.0 143.0489 520000.0 143.061 32000.0 143.0854 290000.0 144.044 12000.0 144.0568 650000.0 144.0692 11000.0 145.0531 5700.0 145.0646 480000.0 147.0445 14000.0 148.0194 2800.0 148.9005 2500.0 149.0229 4300.0 149.0595 78000.0 151.0535 2500.0 152.0622 31000.0 153.0698 82000.0 155.0484 6300.0 155.0602 170000.0 156.0568 150000.0 157.035 5100.0 157.0646 8100000.0 157.0763 80000.0 157.0943 27000.0 158.0727 12000.0 159.044 160000.0 159.0803 2400000.0 159.0924 7200.0 160.0518 160000.0 161.0596 360000.0 168.0571 51000.0 169.0647 3200000.0 171.0439 55000.0 171.0804 69000.0 172.0519 1100000.0 172.0689 32000.0 173.0597 1000000.0 173.0767 5200.0 173.5215 32000.0 173.5367 120000.0 174.0677 48000.0 175.0393 23000.0 175.0755 72000.0 176.047 43000.0 179.0599 18000.0 185.0598 370000.0 186.0485 9900.0 186.0676 1300000.0 186.0827 5500.0 187.0556 5100.0 187.0754 5300000.0 187.0897 6500.0 188.0467 6600.0 188.0833 44000.0 189.0546 110000.0 189.0734 2400.0 189.0912 170000.0 195.3627 3500.0 198.0713 6000.0 198.0911 50000.0 199.0753 3500000.0 199.0925 2600.0 199.1057 3400.0 202.0627 6700.0 215.0696 2500.0 217.0861 630000.0 END IONS BEGIN IONS SCANS=505 PEPMASS=680.3184 CHARGE=1 COLLISION_ENERGY=0.0 68.0829 2400.0 74.1151 3900.0 74.5746 4200.0 76.4496 2500.0 81.0334 100000.0 85.0082 2400.0 90.4356 2300.0 91.0362 2400.0 98.0598 130000.0 98.4926 5300.0 112.7393 2500.0 117.2045 2300.0 119.049 2900.0 129.0287 2600.0 130.0403 4500.0 134.0397 2700.0 135.0439 5800.0 135.9472 2400.0 136.5608 2900.0 140.3099 2600.0 147.0441 36000.0 150.0549 16000.0 161.0601 3000.0 162.0675 73000.0 163.0388 32000.0 163.0753 3700.0 165.1206 2400.0 169.7104 2500.0 173.5256 73000.0 173.5374 140000.0 173.5452 14000.0 175.0396 29000.0 177.0557 9500.0 178.0497 75000.0 178.0634 42000.0 181.0857 9400.0 181.1599 2600.0 183.0345 2500.0 189.0547 41000.0 190.0624 510000.0 191.034 84000.0 191.0705 53000.0 193.0859 440000.0 195.0652 260000.0 205.0859 81000.0 206.0574 190000.0 219.1021 12000.0 220.9722 3700.0 221.0154 31000.0 221.0299 150000.0 221.0408 44000.0 221.0809 22000000.0 221.12 66000.0 221.132 150000.0 221.1465 28000.0 221.161 11000.0 222.0847 18000.0 240.0055 2500.0 244.745 2600.0 245.0807 14000.0 273.0757 63000.0 288.4161 3100.0 289.8533 2300.0 290.1028 57000.0 299.8408 2700.0 300.1237 130000.0 300.7198 2800.0 310.1067 8700.0 318.1334 52000.0 326.1404 4600.0 339.7556 2700.0 342.1338 39000.0 353.1021 14000.0 354.1449 31000.0 367.118 6500.0 368.1262 33000.0 369.095 3900.0 370.1324 19000.0 371.149 79000.0 382.1401 34000.0 384.1222 6800.0 385.1651 36000.0 399.144 1100000.0 399.2055 13000.0 413.1602 120000.0 441.1544 190000.0 459.3759 2700.0 461.7388 2500.0 512.668 2500.0 520.1962 10000.0 584.2372 2600.0 591.6115 4500.0 613.1817 4800.0 622.0554 49000.0 667.1505 2800.0 END IONS BEGIN IONS SCANS=506 PEPMASS=637.2727 CHARGE=1 COLLISION_ENERGY=0.0 75.9065 2300.0 76.2147 2800.0 81.0333 290000.0 81.039 4000.0 82.0288 3200.0 82.065 30000.0 98.0599 5600.0 108.0443 3600.0 110.0234 110000.0 119.4248 2800.0 124.0393 11000.0 131.0747 2300.0 134.0599 4700.0 136.0391 56000.0 136.0755 55000.0 147.0443 2900.0 150.0547 110000.0 152.0705 66000.0 153.0177 2300.0 162.0669 6800.0 171.9509 2300.0 173.5235 16000.0 173.5317 59000.0 173.5429 12000.0 175.1404 2800.0 178.0498 320000.0 178.0676 3900.0 179.0532 6300.0 180.0654 430000.0 180.0841 6000.0 181.0856 3800.0 190.0621 20000.0 191.067 17000.0 192.0687 4000.0 193.086 16000.0 194.089 5700.0 195.0651 55000.0 196.0684 29000.0 197.0699 13000.0 205.0858 15000.0 206.0564 5000.0 206.0895 9600.0 219.1018 3000.0 221.0808 300000.0 221.0997 3300.0 222.0843 220000.0 222.1097 3200.0 223.0864 100000.0 273.0752 7900.0 274.0787 3500.0 275.0811 2700.0 280.5205 2900.0 290.1023 4300.0 300.123 28000.0 301.1256 17000.0 302.1327 11000.0 326.1312 2400.0 351.1221 8200.0 353.0977 3100.0 354.1013 3000.0 355.1505 4100.0 367.1162 14000.0 368.1229 9100.0 369.1253 10000.0 370.1328 4900.0 371.1469 6600.0 372.1506 15000.0 373.1553 16000.0 381.1333 10000.0 382.1402 30000.0 383.1463 3800.0 384.1499 5500.0 386.1654 3500.0 387.171 7200.0 395.1485 24000.0 398.1322 2600.0 399.1431 67000.0 400.1468 150000.0 401.1495 180000.0 409.1243 3700.0 410.136 17000.0 413.1596 35000.0 414.1614 9200.0 415.1641 16000.0 426.1316 3100.0 441.1529 25000.0 442.1573 14000.0 443.1601 26000.0 510.1209 2500.0 END IONS BEGIN IONS SCANS=507 PEPMASS=657.2425 CHARGE=1 COLLISION_ENERGY=0.0 66.6954 2400.0 73.0246 7800.0 73.0276 12000.0 81.932 2500.0 83.5111 3300.0 85.0263 15000.0 85.0309 4500.0 86.4609 2500.0 90.3373 3800.0 107.0635 2400.0 115.6994 3700.0 117.0223 2700.0 119.0342 2800.0 120.0417 170000.0 130.3307 2900.0 135.6241 2600.0 147.0301 2600.0 157.7898 2400.0 165.0095 3200.0 173.5295 120000.0 173.5419 30000.0 188.0119 5500.0 188.0317 1200000.0 188.0517 7600.0 205.0858 3300.0 215.4759 4400.0 217.047 3600.0 221.0812 38000.0 243.0631 12000.0 279.0892 5600.0 296.0903 5000.0 297.0848 15000.0 300.1218 3100.0 310.0705 7300.0 320.1288 2600.0 324.0851 8900.0 325.0924 100000.0 338.1001 6300.0 340.0198 29000.0 340.1154 5700000.0 340.1899 6400.0 340.2126 10000.0 364.118 3000.0 389.0952 5000.0 395.1468 160000.0 399.1437 11000.0 431.6431 2600.0 433.0877 13000.0 448.1099 18000.0 461.1663 3800.0 463.0582 15000.0 463.1362 1400000.0 463.212 7600.0 486.153 2900.0 516.1989 31000.0 530.1367 3100.0 532.1969 4300.0 559.2039 31000.0 560.1889 440000.0 567.6682 3900.0 657.2406 580000.0 657.3655 5700.0 END IONS BEGIN IONS SCANS=508 PEPMASS=221.0812 CHARGE=1 COLLISION_ENERGY=0.0 43.0177 12000.0 45.0335 14000.0 46.2724 2400.0 46.9784 5700.0 53.0021 26000.0 54.5171 7400.0 55.0178 32000.0 55.7278 5600.0 61.6214 5600.0 65.0385 17000.0 66.5371 8100.0 68.997 28000.0 69.1203 2500.0 69.791 5700.0 71.9108 5800.0 72.0274 7400.0 73.4358 7500.0 73.9448 4200.0 76.0502 6000.0 77.0385 44000.0 78.0462 180000.0 79.0539 320000.0 82.1317 7500.0 85.246 4800.0 85.4241 8700.0 89.0385 39000.0 90.0462 55000.0 91.0483 13000.0 91.0539 470000.0 92.0257 15000.0 92.0619 53000.0 93.07 30000.0 94.0411 6300.0 95.0488 88000.0 102.0387 9800.0 102.0462 620000.0 103.054 290000.0 103.8139 4400.0 104.0618 300000.0 105.0333 89000.0 105.0444 8900.0 105.0697 210000.0 105.5639 6900.0 106.0411 18000.0 107.0489 520000.0 115.0539 41000.0 116.0619 57000.0 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20000.0 162.0675 2300000.0 163.0389 4100000.0 163.0508 25000.0 163.0751 390000.0 163.0902 4100.0 165.0911 12000.0 167.0711 6500.0 170.036 6500.0 173.023 53000.0 173.5247 53000.0 173.5369 120000.0 174.0313 240000.0 175.0255 2600.0 175.0391 2200000.0 176.0105 5800.0 176.0469 560000.0 176.0646 18000.0 177.0547 630000.0 177.0723 23000.0 178.0439 36000.0 178.0626 2100000.0 187.0388 51000.0 188.0469 290000.0 189.0549 150000.0 190.0624 2800000.0 191.0138 30000.0 191.0339 1200000.0 191.07 120000.0 192.041 45000.0 193.0707 3400.0 193.086 1300000.0 193.1067 43000.0 205.0276 2400.0 205.0498 91000.0 206.0348 6800.0 206.0576 700000.0 206.0798 2600.0 221.081 220000.0 END IONS BEGIN IONS SCANS=509 PEPMASS=319.1373 CHARGE=1 COLLISION_ENERGY=0.0 49.1485 2100.0 50.4843 3200.0 69.3746 2500.0 82.2281 2500.0 82.7067 2200.0 86.1739 2900.0 86.9223 2500.0 92.0003 2400.0 98.8868 2200.0 119.721 3000.0 128.1728 2600.0 161.0568 2700.0 162.067 10000.0 163.0707 17000.0 173.5244 22000.0 173.5405 21000.0 175.0363 3100.0 177.0507 2800.0 178.0617 10000.0 179.0655 15000.0 190.0617 46000.0 191.0344 9900.0 191.0658 68000.0 192.0371 15000.0 192.0723 2600.0 193.086 27000.0 194.0892 63000.0 206.0574 18000.0 207.0607 33000.0 221.0809 95000.0 222.0843 190000.0 248.5656 2700.0 322.1586 2500.0 END IONS BEGIN IONS SCANS=510 PEPMASS=635.2604 CHARGE=1 COLLISION_ENERGY=0.0 71.2226 2700.0 71.5626 2600.0 73.0126 2700.0 74.9574 2400.0 75.7471 2100.0 76.4388 2300.0 77.0877 2400.0 79.0542 4100.0 81.0333 800000.0 86.2994 2300.0 86.6182 2700.0 88.3152 2200.0 91.0543 2400.0 95.0491 2800.0 96.933 2800.0 97.8429 2100.0 98.0599 71000.0 99.7799 2400.0 99.868 2800.0 104.0358 2600.0 105.0698 2600.0 106.5278 2800.0 107.0482 2900.0 108.6111 2500.0 109.5444 3000.0 110.0237 20000.0 113.9639 2300.0 117.4006 2500.0 119.049 9800.0 122.06 16000.0 124.5589 2200.0 125.1312 2100.0 129.7932 2300.0 130.041 4200.0 131.0486 2600.0 132.0439 7800.0 132.0571 9000.0 133.0645 3300.0 134.0602 6900.0 135.0439 16000.0 136.0397 11000.0 137.1669 2400.0 138.055 4800.0 139.0501 2100.0 145.9628 2300.0 147.0439 53000.0 148.0518 5600.0 149.0596 7400.0 150.0411 4400.0 150.0548 260000.0 150.0674 2800.0 151.0874 2400.0 152.0469 2500.0 154.8757 2800.0 158.1589 3100.0 158.8133 2300.0 160.052 12000.0 161.0595 9200.0 162.0676 71000.0 163.0389 74000.0 163.0749 23000.0 163.6432 2200.0 166.0489 3200.0 167.0702 3600.0 167.9789 2100.0 173.5105 3100.0 173.5304 130000.0 173.5377 40000.0 174.462 2300.0 175.0388 30000.0 175.8249 2400.0 175.8693 2500.0 176.0468 5100.0 177.0551 5700.0 178.0335 22000.0 178.0499 910000.0 178.0636 56000.0 180.042 3500.0 181.0859 50000.0 182.607 2200.0 189.0548 13000.0 190.0624 290000.0 191.034 64000.0 191.0697 12000.0 193.0859 220000.0 194.7467 2700.0 195.0652 710000.0 197.078 2400.0 198.0572 2300.0 198.2822 2200.0 205.086 250000.0 206.0575 100000.0 211.2224 2800.0 219.1017 41000.0 221.0165 3800.0 221.0304 16000.0 221.0809 4600000.0 221.1322 13000.0 222.0847 20000.0 226.7964 2400.0 244.9753 2400.0 245.0808 66000.0 247.0955 2600.0 248.1203 2500.0 273.0759 120000.0 274.1064 8400.0 274.9985 2300.0 275.1109 7700.0 283.0956 4300.0 285.6404 2400.0 289.1313 13000.0 290.1024 96000.0 290.1354 5900.0 291.6359 2500.0 300.1234 290000.0 300.1622 6400.0 302.102 7700.0 302.2538 2600.0 309.1034 2800.0 310.1084 12000.0 312.3416 2600.0 313.1084 2600.0 314.1384 10000.0 317.127 11000.0 318.1308 13000.0 322.1203 4700.0 324.122 2600.0 325.1069 4100.0 326.1388 21000.0 327.121 5500.0 328.1184 3900.0 330.1458 3700.0 337.1016 3500.0 338.1154 5000.0 339.122 23000.0 340.1309 3200.0 341.1004 4500.0 342.1336 57000.0 350.1153 3600.0 351.1235 24000.0 352.0923 7300.0 352.1241 8400.0 353.1016 70000.0 353.1399 3100.0 354.146 110000.0 355.1166 6300.0 356.1257 16000.0 357.382 3400.0 358.1427 4400.0 365.1008 10000.0 366.1087 24000.0 367.1176 120000.0 368.1253 140000.0 369.097 23000.0 370.1338 39000.0 371.1488 240000.0 380.1259 11000.0 381.1331 65000.0 382.141 240000.0 383.1102 23000.0 384.1203 48000.0 385.1646 120000.0 395.1008 2500.0 395.1493 120000.0 398.1355 30000.0 399.022 7800.0 399.0839 5000.0 399.1438 2900000.0 399.2048 5100.0 399.2676 3300.0 409.1286 12000.0 410.1368 41000.0 411.1061 7600.0 413.1597 350000.0 413.221 3300.0 417.0536 3200.0 423.1456 6000.0 426.1315 12000.0 441.1542 420000.0 520.1952 30000.0 596.1783 2700.0 608.5355 2800.0 634.1426 2700.0 635.0578 22000.0 END IONS BEGIN IONS SCANS=511 PEPMASS=318.1341 CHARGE=1 COLLISION_ENERGY=0.0 49.0042 3700.0 51.1122 9000.0 55.0179 19000.0 55.2697 160000.0 55.2717 34000.0 57.5317 4100.0 71.372 10000.0 76.0322 9300.0 76.0544 11000.0 78.0463 32000.0 78.8432 8000.0 79.0541 92000.0 81.8558 3500.0 88.264 3800.0 89.039 4100.0 89.0935 3600.0 91.0543 150000.0 95.0492 38000.0 95.0853 12000.0 98.06 400000.0 102.0464 110000.0 103.0542 84000.0 104.0619 73000.0 105.0339 20000.0 105.0697 130000.0 105.3645 9200.0 105.4479 7700.0 107.049 130000.0 111.0443 7600.0 112.1824 3600.0 115.0546 6500.0 116.0623 20000.0 116.1013 7900.0 118.0412 110000.0 118.0493 4100.0 119.0491 250000.0 120.0571 24000.0 121.0649 65000.0 122.0723 50000.0 125.6304 7400.0 125.9626 13000.0 130.0413 380000.0 131.0489 150000.0 132.0568 260000.0 133.0284 45000.0 133.0648 380000.0 134.0729 55000.0 134.255 14000.0 135.0441 380000.0 135.0805 45000.0 137.8393 4400.0 144.0571 60000.0 145.0288 21000.0 145.0654 5000.0 146.0363 100000.0 147.0441 1500000.0 147.0552 3200.0 148.0519 200000.0 149.0596 260000.0 150.0675 260000.0 151.0757 5300.0 158.0359 41000.0 159.0442 120000.0 160.0519 470000.0 161.0244 17000.0 161.0598 720000.0 161.4831 4400.0 162.0559 9400.0 162.0676 4200000.0 163.039 1400000.0 163.055 4000.0 163.0754 790000.0 165.0912 210000.0 167.0704 150000.0 172.0515 42000.0 173.0233 23000.0 173.5299 230000.0 173.5576 9400.0 174.0313 460000.0 175.0391 1200000.0 176.047 1100000.0 176.0646 4900.0 177.0548 780000.0 178.0438 16000.0 178.0626 4000000.0 188.047 420000.0 189.0348 18000.0 189.0547 1900000.0 189.0746 26000.0 190.0111 6100.0 190.0225 110000.0 190.0625 21000000.0 190.0936 83000.0 190.1031 120000.0 191.0339 4500000.0 191.0703 1500000.0 191.0855 12000.0 192.0416 220000.0 193.0328 14000.0 193.0861 15000000.0 193.1272 100000.0 193.1392 6500.0 203.986 8100.0 205.05 160000.0 206.0576 8000000.0 221.0155 15000.0 221.0302 310000.0 221.0405 140000.0 221.081 48000000.0 221.1203 200000.0 221.132 290000.0 221.1467 30000.0 221.1747 7400.0 235.4184 13000.0 290.4157 4600.0 294.528 8700.0 310.7798 11000.0 323.4232 12000.0 END IONS BEGIN IONS SCANS=512 PEPMASS=538.2075 CHARGE=1 COLLISION_ENERGY=0.0 60.5983 2300.0 67.1325 2200.0 69.1531 2200.0 69.8118 2400.0 74.5811 2200.0 77.9835 2300.0 81.0334 41000.0 82.6481 2600.0 83.7689 2200.0 85.004 2700.0 95.8071 2600.0 97.3638 2200.0 98.0601 23000.0 99.6887 2500.0 104.7732 2700.0 111.8771 2300.0 114.3934 2500.0 122.0601 2700.0 132.1276 2700.0 140.82 3000.0 145.4023 2200.0 149.6874 5000.0 149.6978 3700.0 152.0467 5700.0 156.4637 2400.0 163.0757 12000.0 163.7101 2500.0 167.0701 2700.0 173.5221 14000.0 173.531 58000.0 173.5412 17000.0 173.6847 2400.0 178.0489 2800.0 178.5824 2100.0 181.0861 11000.0 185.2636 2500.0 190.0622 30000.0 192.3059 2800.0 193.0859 23000.0 195.0444 2600.0 195.0653 340000.0 195.0859 6400.0 205.0862 170000.0 206.0576 25000.0 219.1021 22000.0 221.0809 1000000.0 238.7744 2900.0 244.5509 2500.0 245.0811 33000.0 269.5546 2600.0 273.0756 24000.0 279.9697 2400.0 290.1006 3800.0 300.123 21000.0 307.0966 2600.0 309.1125 2300.0 310.1086 6200.0 317.3214 2400.0 318.1318 2600.0 324.1234 5700.0 327.122 4500.0 337.0686 4200.0 337.1096 4100.0 338.1161 7300.0 339.1236 19000.0 340.1293 3200.0 341.1014 11000.0 342.1331 35000.0 351.0845 3200.0 351.1254 3700.0 352.0921 23000.0 352.1192 7300.0 353.1015 85000.0 354.1464 51000.0 356.1257 21000.0 358.14 3000.0 358.4862 2400.0 366.1084 6600.0 367.118 47000.0 368.1253 130000.0 369.0961 42000.0 370.1412 7200.0 371.0959 3400.0 371.1487 190000.0 381.1329 11000.0 382.1405 44000.0 383.1122 7400.0 384.1203 48000.0 385.1651 30000.0 391.0242 2600.0 395.1528 4300.0 398.1364 6300.0 399.1437 1900000.0 399.2063 3100.0 410.1312 3600.0 413.1594 42000.0 415.6976 2500.0 419.849 3100.0 423.1384 2600.0 423.1476 3400.0 426.132 2400.0 441.1541 85000.0 444.4185 2600.0 530.7488 2500.0 END IONS BEGIN IONS SCANS=513 PEPMASS=617.25 CHARGE=1 COLLISION_ENERGY=0.0 67.6746 2700.0 68.1033 2700.0 74.2001 2200.0 81.4061 2200.0 82.8903 2200.0 86.7954 2300.0 102.51 3100.0 118.2173 2500.0 122.0597 19000.0 131.8907 2700.0 140.489 2600.0 145.1713 2400.0 148.1218 2600.0 149.6888 16000.0 159.3089 2500.0 162.0669 3600.0 173.523 29000.0 173.5408 36000.0 178.0632 2600.0 178.4566 2300.0 181.0859 19000.0 184.0144 2400.0 185.0126 3100.0 189.0551 3100.0 190.0623 58000.0 191.0702 5000.0 193.0859 47000.0 198.1912 2300.0 203.5112 2500.0 206.0572 26000.0 211.4095 2100.0 219.1017 71000.0 221.0808 1600000.0 270.076 2700.0 285.1001 17000.0 300.1232 2400000.0 300.2031 7600.0 324.1234 10000.0 337.1024 2900.0 339.1206 2500.0 346.9607 2500.0 352.1176 140000.0 353.1027 11000.0 356.1249 7700.0 368.1262 19000.0 369.0982 3900.0 371.1485 78000.0 384.1203 15000.0 385.473 2500.0 399.082 5400.0 399.1436 900000.0 399.2054 4700.0 407.3198 2500.0 416.2353 2600.0 441.1548 2400.0 446.1585 2800.0 462.1538 2900.0 474.1503 3200.0 490.1463 4400.0 492.2025 4700.0 505.1721 18000.0 520.1958 360000.0 520.2844 5500.0 END IONS BEGIN IONS SCANS=514 PEPMASS=673.2163 CHARGE=1 COLLISION_ENERGY=0.0 66.7947 2500.0 72.376 2500.0 72.6427 2500.0 74.105 2300.0 79.0448 2400.0 79.5301 2700.0 79.803 2000.0 120.5487 2400.0 121.2148 2400.0 125.2849 2500.0 128.892 2200.0 142.7443 2600.0 156.603 2500.0 161.4902 2700.0 173.5276 55000.0 173.544 16000.0 201.4119 2300.0 201.5685 2700.0 207.2705 2300.0 234.8189 2200.0 420.723 3900.0 500.51 2600.0 526.7961 2900.0 628.6236 2900.0 630.8904 2600.0 END IONS BEGIN IONS SCANS=515 PEPMASS=222.0844 CHARGE=1 COLLISION_ENERGY=0.0 51.2875 2200.0 54.7291 2400.0 55.4732 2300.0 57.9563 2400.0 58.0649 17000.0 61.2676 2700.0 62.0658 2500.0 62.1786 2300.0 65.2754 2300.0 65.5809 2500.0 65.7319 2200.0 70.8441 2900.0 73.0266 2500.0 91.0539 12000.0 98.2808 2300.0 103.0491 2500.0 107.0485 2600.0 109.9041 2400.0 111.9676 9400.0 112.9535 6300.0 117.8855 2400.0 119.0486 18000.0 120.0521 2700.0 120.23 2200.0 121.6127 2400.0 122.3107 2700.0 131.0444 3800.0 133.06 2800.0 134.0695 2500.0 135.0434 18000.0 135.9696 5100.0 136.0472 4000.0 147.0438 8300.0 148.0473 22000.0 149.0549 3700.0 149.6865 12000.0 150.9102 2300.0 153.9803 6100.0 154.8577 2900.0 162.0643 4900.0 163.039 13000.0 163.0708 25000.0 164.0421 37000.0 173.5281 12000.0 173.5388 17000.0 176.0422 19000.0 178.058 2800.0 178.1378 2300.0 179.0661 18000.0 190.0618 2600.0 191.0658 33000.0 192.0373 10000.0 194.0894 12000.0 203.1971 2300.0 207.0603 3100.0 207.6944 2400.0 214.6943 2100.0 226.788 2200.0 228.2394 2500.0 END IONS BEGIN IONS SCANS=516 PEPMASS=346.0937 CHARGE=1 COLLISION_ENERGY=0.0 67.8304 2100.0 92.0291 2600.0 95.7843 2300.0 98.0595 7300.0 112.9802 2100.0 128.4985 2200.0 129.8371 2800.0 132.97 2400.0 147.0434 5500.0 147.0798 12000.0 162.0664 4300.0 166.9439 2200.0 169.9749 2900.0 171.9899 16000.0 173.5368 44000.0 178.062 2700.0 190.0623 32000.0 191.0628 2900.0 193.0858 24000.0 206.0572 11000.0 220.0185 7000.0 221.0808 120000.0 222.0851 13000.0 238.8313 2700.0 245.081 18000.0 251.0316 6600.0 320.043 2700.0 324.7066 2400.0 374.0593 2600.0 END IONS BEGIN IONS SCANS=517 PEPMASS=285.0762 CHARGE=1 COLLISION_ENERGY=0.0 50.4616 11000.0 51.6802 4500.0 53.7261 4500.0 56.5819 13000.0 56.8111 9800.0 57.0335 32000.0 61.359 13000.0 61.668 9400.0 61.7781 13000.0 67.0178 90000.0 68.9969 30000.0 69.6632 11000.0 71.2675 350000.0 71.2713 67000.0 79.4117 12000.0 80.2408 5300.0 81.0334 100000.0 86.6309 12000.0 87.8713 4700.0 88.9825 12000.0 91.054 52000.0 113.4745 4000.0 119.0404 32000.0 119.049 700000.0 120.0569 75000.0 121.0284 270000.0 122.8445 12000.0 124.0156 320000.0 131.6 11000.0 140.2294 13000.0 141.0547 19000.0 145.0283 570000.0 154.5737 11000.0 157.0206 16000.0 157.299 12000.0 160.0526 29000.0 160.2501 4100.0 163.0406 13000.0 167.0339 3000000.0 167.0484 26000.0 168.0573 21000.0 169.0649 14000.0 173.5235 130000.0 173.5374 250000.0 177.1128 4600.0 177.9384 14000.0 185.0445 350000.0 185.0604 48000.0 186.0675 33000.0 187.0389 150000.0 194.0032 4800.0 196.0522 56000.0 197.0597 220000.0 204.7347 11000.0 210.885 6700.0 213.0551 170000.0 214.0631 100000.0 217.0834 15000.0 223.5446 5200.0 224.0459 56000.0 225.0546 510000.0 228.8949 8500.0 233.9002 5500.0 238.8799 7200.0 242.0278 36000.0 242.0574 7200000.0 243.0645 110000.0 253.0481 68000.0 257.081 140000.0 267.0653 19000.0 268.0762 46000.0 270.0272 49000.0 270.0523 9000000.0 283.0616 35000.0 284.0667 17000.0 284.9589 65000.0 284.9799 200000.0 285.001 680000.0 285.0168 400000.0 285.0758 99000000.0 285.135 650000.0 285.1502 730000.0 285.1717 250000.0 285.1922 130000.0 285.2124 22000.0 END IONS BEGIN IONS SCANS=518 PEPMASS=344.2587 CHARGE=1 COLLISION_ENERGY=0.0 50.1026 2100.0 52.1903 2100.0 53.4097 2100.0 55.054 28000.0 56.7834 2700.0 57.0696 4300.0 58.8214 2600.0 62.3495 2400.0 64.7196 2200.0 67.0505 3600.0 67.0539 76000.0 69.0695 44000.0 79.0538 13000.0 81.0695 83000.0 83.0853 16000.0 89.4987 2600.0 91.054 14000.0 93.0696 19000.0 95.0852 71000.0 96.0511 2900.0 96.5419 2400.0 97.101 3500.0 102.0912 3200.0 105.0694 3600.0 107.0851 8800.0 107.6464 2400.0 109.1008 34000.0 113.7577 2200.0 117.0701 5800.0 121.0645 28000.0 121.101 23000.0 122.3651 2600.0 122.8413 2600.0 123.0437 62000.0 123.117 6800.0 124.6432 2400.0 129.07 2400.0 131.0488 16000.0 133.0646 2900.0 135.1166 4400.0 137.0595 72000.0 143.0494 2800.0 145.0647 17000.0 147.0431 3300.0 147.0802 11000.0 149.0595 110000.0 151.0752 23000.0 153.1762 2200.0 155.0851 9000.0 157.0648 14000.0 159.0802 16000.0 161.0595 190000.0 161.0735 2400.0 163.0753 64000.0 164.0699 9700.0 165.0909 13000.0 166.0861 3000.0 169.1017 8800.0 171.0808 10000.0 173.0598 60000.0 173.5282 36000.0 173.5437 7000.0 175.0591 4400.0 175.0754 130000.0 177.0906 9500.0 180.173 2500.0 183.0806 21000.0 185.097 6600.0 187.075 21000.0 189.0912 30000.0 191.1066 3500.0 197.0968 17000.0 199.1113 2900.0 200.0816 3000.0 201.091 110000.0 202.098 8700.0 203.1071 16000.0 211.1131 3500.0 215.1068 70000.0 216.1159 8200.0 225.1285 5900.0 229.1226 21000.0 256.1133 2900.0 266.4879 2400.0 267.8271 2800.0 285.1485 8100.0 338.4112 2400.0 344.2588 20000.0 END IONS BEGIN IONS SCANS=519 PEPMASS=274.2744 CHARGE=1 COLLISION_ENERGY=0.0 46.6638 2400.0 48.8792 2400.0 49.0975 2300.0 51.2184 2700.0 51.3112 2400.0 53.9977 2300.0 56.8766 2700.0 57.0696 480000.0 57.0729 6000.0 58.0649 21000.0 58.2056 2100.0 61.1669 2500.0 62.0597 26000.0 65.4177 2300.0 70.0647 570000.0 71.0852 190000.0 73.267 2400.0 74.198 2200.0 79.8893 2300.0 83.288 2100.0 85.0958 2200.0 85.1008 80000.0 85.5941 2300.0 86.0595 5400.0 88.0753 1200000.0 88.0815 7200.0 89.6535 2100.0 89.942 2500.0 100.9722 2300.0 102.0909 330000.0 102.8923 2300.0 106.0857 730000.0 108.3354 2200.0 109.6266 2400.0 112.2785 2200.0 112.2924 2200.0 118.3263 2600.0 122.1773 2400.0 124.2654 2400.0 124.4293 2300.0 127.595 2800.0 130.1417 2400.0 132.1663 3200.0 135.0437 52000.0 135.944 2500.0 136.2128 2400.0 142.5065 2300.0 143.0489 8900.0 144.9044 2300.0 148.1663 2700.0 153.7845 2400.0 155.5312 2200.0 157.3738 2300.0 157.8199 2200.0 161.5601 2500.0 162.3169 2600.0 167.9583 2600.0 169.1014 2800.0 171.0439 5000.0 171.3253 2700.0 173.0608 2800.0 173.5309 93000.0 173.5412 9100.0 186.1264 4500.0 201.0545 49000.0 211.4755 2400.0 212.2376 20000.0 230.2478 80000.0 237.0153 2400.0 246.3383 2300.0 248.7885 2300.0 256.2167 3300.0 256.2322 7100.0 256.2631 550000.0 274.183 2900.0 274.2486 8900.0 274.2741 2200000.0 274.3085 17000.0 274.3438 3500.0 274.5629 2300.0 274.7158 2400.0 END IONS BEGIN IONS SCANS=520 PEPMASS=369.17 CHARGE=1 COLLISION_ENERGY=0.0 54.6503 2600.0 55.6055 2200.0 57.7276 2300.0 68.4192 2300.0 70.0035 2200.0 70.065 7600.0 71.049 32000.0 71.7564 2300.0 75.044 17000.0 77.1853 2400.0 77.2516 2300.0 79.0539 2300.0 80.0387 2700.0 80.4389 2500.0 81.4792 2500.0 88.8327 2500.0 91.0541 20000.0 93.246 2400.0 95.0236 2400.0 104.6685 2700.0 107.0493 18000.0 108.0571 5000.0 112.5147 2200.0 121.0647 34000.0 123.0811 2700.0 124.0521 2500.0 135.0442 22000.0 136.0519 230000.0 136.879 2400.0 137.0596 10000.0 139.0753 67000.0 143.0852 3000.0 146.0726 16000.0 148.0519 14000.0 149.0599 13000.0 150.0675 14000.0 150.4885 2900.0 151.0753 2000000.0 151.1001 6800.0 153.0907 7000.0 154.1996 2400.0 157.0649 18000.0 158.0726 31000.0 159.0803 9600.0 160.0882 5500.0 161.0594 4800.0 161.0963 3100.0 162.0034 2700.0 162.0677 4700.0 163.0755 59000.0 165.0549 59000.0 165.0911 170000.0 167.0704 22000.0 170.7088 2200.0 171.0804 15000.0 172.0885 89000.0 173.0602 16000.0 173.0962 2700.0 173.5227 30000.0 173.5346 44000.0 173.5429 29000.0 174.0676 140000.0 175.0753 40000.0 177.0911 79000.0 179.0703 180000.0 186.0676 9500.0 187.0752 4300.0 188.0832 290000.0 188.0962 2000.0 189.0721 7800.0 189.0911 430000.0 189.1108 7700.0 190.0992 21000.0 191.0703 170000.0 191.1067 60000.0 193.086 79000.0 195.0798 3400.0 200.0821 3800.0 201.0689 3800.0 201.0911 840000.0 201.1132 6700.0 202.0998 3000.0 203.086 2700.0 203.1068 350000.0 205.0858 21000.0 205.3423 2400.0 213.0913 85000.0 214.4826 2900.0 215.1067 41000.0 216.0769 4300.0 223.9019 2600.0 224.0834 59000.0 225.0919 16000.0 227.1061 4000.0 231.0762 5700.0 231.1017 260000.0 233.096 8500.0 237.0902 3400.0 238.0975 2600.0 239.1073 8100.0 240.078 29000.0 241.0858 26000.0 245.0967 19000.0 246.103 9600.0 247.1111 3400.0 249.0929 8000.0 250.0998 3000.0 252.0787 3700.0 253.0859 79000.0 254.094 19000.0 255.0699 3300.0 255.1016 450000.0 255.1322 9600.0 258.1048 7100.0 259.1125 10000.0 261.0907 62000.0 262.0988 58000.0 263.1049 14000.0 265.0873 7700.0 265.1231 15000.0 267.1015 39000.0 268.0761 14000.0 268.084 7500.0 268.1095 780000.0 268.1429 5400.0 269.0809 160000.0 269.1124 7500.0 273.0909 34000.0 274.0986 13000.0 275.1068 79000.0 275.1379 2800.0 276.1144 100000.0 277.0881 29000.0 277.1224 130000.0 278.0949 23000.0 278.128 6200.0 279.1017 22000.0 281.0831 7600.0 281.1179 23000.0 282.1242 12000.0 283.0599 8900.0 283.0968 1100000.0 284.0688 8600.0 284.1045 510000.0 284.1353 2200.0 287.1072 33000.0 288.1147 73000.0 289.0866 47000.0 289.1227 350000.0 289.1599 4800.0 290.0938 16000.0 290.1282 8400.0 291.1019 21000.0 292.1098 57000.0 293.1174 220000.0 294.0904 3300.0 294.1253 24000.0 295.097 23000.0 295.1323 15000.0 296.1045 65000.0 297.1104 3900.0 298.0898 11000.0 298.1201 2300000.0 298.1768 3500.0 299.128 310000.0 303.1014 11000.0 304.1098 89000.0 305.0767 4800.0 305.1173 780000.0 305.1583 8800.0 306.0901 7600.0 306.1261 21000.0 307.0952 5400.0 307.1331 120000.0 308.1035 13000.0 308.1408 180000.0 309.1122 110000.0 310.1191 10000.0 310.1558 3800.0 311.0967 3100.0 311.128 580000.0 311.1695 5000.0 312.1363 10000.0 318.1264 5200.0 319.133 310000.0 320.0978 5700.0 320.1408 870000.0 321.1122 320000.0 321.1542 6400.0 322.1207 26000.0 323.1278 59000.0 324.1357 330000.0 325.1436 61000.0 335.1283 57000.0 335.7509 2800.0 336.1356 230000.0 338.1507 23000.0 338.2554 3000.0 339.1591 72000.0 351.159 180000.0 369.1692 5300.0 END IONS BEGIN IONS SCANS=521 PEPMASS=320.2589 CHARGE=1 COLLISION_ENERGY=0.0 49.3713 2800.0 54.2575 2200.0 55.0541 7000.0 56.9231 2400.0 57.0697 41000.0 61.7036 2300.0 62.4118 2200.0 65.7565 2400.0 66.7768 2200.0 67.0541 2400.0 67.2091 3000.0 67.2997 2100.0 69.0696 14000.0 70.4219 2400.0 71.0853 17000.0 71.2148 2200.0 78.6963 2700.0 81.0698 3100.0 83.0855 3000.0 83.6439 2400.0 84.5862 2200.0 86.2624 2400.0 91.0539 2600.0 91.1086 2400.0 91.2841 2700.0 92.4935 2700.0 94.8475 2300.0 95.0852 5600.0 98.0599 13000.0 98.6497 2200.0 101.394 2300.0 103.0539 46000.0 104.796 2500.0 104.8675 2100.0 109.1009 3100.0 110.173 2300.0 112.3963 2500.0 117.0696 45000.0 118.7121 2500.0 123.0438 92000.0 131.0379 3400.0 131.0489 300000.0 131.0854 31000.0 133.0646 20000.0 135.2416 2600.0 136.8669 2400.0 137.0594 130000.0 145.0517 3700.0 145.0646 250000.0 147.0808 5700.0 149.046 5000.0 149.0595 1900000.0 149.0715 22000.0 151.0752 400000.0 151.4746 2500.0 157.473 2100.0 159.0804 160000.0 159.1685 2200.0 159.5185 2100.0 161.0956 3100.0 161.6728 2600.0 162.0671 7600.0 162.8421 2400.0 163.0593 14000.0 163.0753 850000.0 163.091 6400.0 166.086 7500.0 173.0958 27000.0 173.5228 17000.0 173.5332 52000.0 173.5406 19000.0 173.9456 2900.0 177.0911 170000.0 181.0852 5900.0 184.2056 5900.0 185.4158 2700.0 185.7187 2300.0 187.1126 2500.0 190.0627 37000.0 191.1066 21000.0 192.0676 13000.0 193.0858 17000.0 194.4414 2600.0 194.7891 2400.0 195.0911 14000.0 199.3297 2600.0 208.0632 3400.0 221.081 60000.0 222.0844 27000.0 223.0867 60000.0 234.518 2500.0 235.9824 2900.0 269.6816 2400.0 289.9384 2300.0 299.6201 2200.0 302.1753 2500.0 303.2325 100000.0 303.2631 2100.0 320.2587 32000.0 END IONS BEGIN IONS SCANS=522 PEPMASS=280.0973 CHARGE=1 COLLISION_ENERGY=0.0 56.9234 2300.0 60.3084 2700.0 63.7083 2100.0 65.3376 2300.0 66.2678 13000.0 66.2694 3600.0 68.0716 2400.0 70.0223 2400.0 70.026 2600.0 77.0277 2300.0 81.1427 2600.0 86.3203 2500.0 93.5881 2200.0 96.307 2300.0 114.8332 2300.0 151.0892 2400.0 152.0624 5500.0 166.3522 2200.0 171.9772 2300.0 173.5356 32000.0 180.0807 15000.0 181.0885 20000.0 196.1126 2800.0 205.2169 2400.0 208.0753 8700.0 209.0834 94000.0 210.0914 8900.0 219.0576 10000.0 219.0675 38000.0 219.666 2400.0 220.0594 26000.0 220.0773 12000.0 224.1069 4200.0 234.0912 6000.0 235.0629 13000.0 236.0486 2000.0 236.0704 99000.0 237.0779 29000.0 247.0622 10000.0 248.0702 21000.0 250.0499 27000.0 251.0573 17000.0 252.1016 27000.0 262.0494 3100.0 264.0652 320000.0 265.006 9900.0 265.0213 6700.0 265.0477 8100.0 265.0731 3800000.0 265.1389 21000.0 280.0253 7900.0 280.0968 2500000.0 283.426 2500.0 END IONS BEGIN IONS SCANS=523 PEPMASS=315.0868 CHARGE=1 COLLISION_ENERGY=0.0 48.5859 2100.0 56.5633 2200.0 58.0651 2900.0 59.8907 2200.0 63.0706 2300.0 65.5606 2200.0 68.2237 2000.0 69.5511 2400.0 69.629 2200.0 86.1674 2200.0 102.1345 2300.0 111.7377 2800.0 115.4245 2200.0 115.7423 2300.0 118.4971 2300.0 128.2579 2600.0 130.2905 2300.0 141.2922 2500.0 167.0345 2800.0 173.5257 12000.0 173.5375 35000.0 240.774 2600.0 267.4456 3000.0 272.0372 4200.0 272.0676 130000.0 300.0629 1100000.0 315.0861 1200000.0 315.13 5300.0 END IONS BEGIN IONS SCANS=524 PEPMASS=354.0975 CHARGE=1 COLLISION_ENERGY=0.0 57.0723 2200.0 57.1085 2200.0 60.4962 2500.0 74.288 2100.0 85.4691 2500.0 95.3651 2300.0 114.1837 2900.0 125.3895 2700.0 126.9706 2700.0 139.6184 2300.0 157.0898 2200.0 165.5317 2800.0 173.5252 29000.0 173.5429 13000.0 197.8988 2300.0 220.2382 2600.0 228.3292 2400.0 232.839 2900.0 237.0789 6000.0 264.0659 17000.0 265.0732 63000.0 272.2767 2400.0 278.045 17000.0 287.9755 2800.0 292.0606 27000.0 293.0683 270000.0 294.0784 3100.0 296.0555 200000.0 302.2051 2700.0 306.04 16000.0 307.8028 2900.0 308.0551 13000.0 310.0711 75000.0 320.0123 4200.0 320.0554 250000.0 321.0635 87000.0 322.0732 3300.0 324.006 5400.0 324.0503 550000.0 336.0874 6600.0 338.0659 80000.0 339.0737 400000.0 354.0972 200000.0 END IONS BEGIN IONS SCANS=525 PEPMASS=376.0797 CHARGE=1 COLLISION_ENERGY=0.0 59.1717 2300.0 61.4017 2400.0 71.6481 2500.0 73.0916 2400.0 74.5493 2300.0 77.2176 2600.0 87.6243 2300.0 90.3647 2200.0 99.6096 2500.0 102.704 2500.0 135.0441 4000.0 159.165 2700.0 165.5156 2400.0 173.5229 13000.0 173.541 19000.0 198.4497 2400.0 325.0091 3400.0 346.0321 42000.0 360.0489 16000.0 361.0559 79000.0 376.0796 45000.0 END IONS BEGIN IONS SCANS=526 PEPMASS=438.0403 CHARGE=1 COLLISION_ENERGY=0.0 55.4689 2100.0 56.3678 2500.0 57.0537 2200.0 57.1849 2200.0 58.0193 2400.0 58.6654 2400.0 59.6465 2000.0 61.2632 2500.0 61.7972 2400.0 62.4362 2200.0 62.5796 2400.0 63.3415 2500.0 63.4731 2100.0 63.5347 2400.0 70.667 2300.0 73.539 2400.0 75.7399 2300.0 76.6343 2200.0 78.307 2400.0 81.1449 2700.0 82.074 2100.0 83.1321 2300.0 84.7207 2100.0 84.8133 2200.0 85.9388 2600.0 89.5368 2200.0 93.0192 2300.0 99.9061 2500.0 101.5553 2200.0 114.5615 2100.0 120.9331 2500.0 122.0557 2200.0 125.3192 2100.0 126.4161 2300.0 137.8711 2700.0 148.0515 85000.0 148.2032 2300.0 152.0125 2400.0 154.3319 2800.0 163.3406 2200.0 172.0509 2900.0 173.5191 11000.0 173.5342 150000.0 194.1139 2300.0 206.2779 2700.0 207.9816 73000.0 221.9609 56000.0 225.9924 14000.0 231.9814 71000.0 237.7536 2600.0 237.7817 2600.0 239.9714 22000.0 244.1127 2200.0 249.9919 3300.0 267.7767 2900.0 274.7808 2700.0 279.0896 6900.0 286.4091 2600.0 288.2338 2500.0 291.7493 2300.0 304.0728 56000.0 306.09 6400.0 308.1303 2700.0 309.4935 2300.0 320.014 20000.0 322.028 2600.0 334.0284 3600.0 336.0081 27000.0 338.0222 10000.0 341.1256 2400.0 350.9944 26000.0 362.0235 340000.0 364.0027 250000.0 364.0454 6900.0 366.0186 190000.0 366.945 2600.0 370.6427 2400.0 371.4949 2300.0 376.0028 37000.0 378.0154 3800.0 379.9916 29000.0 380.0376 64000.0 382.0131 23000.0 387.8307 2500.0 392.0371 28000.0 393.0068 26000.0 394.014 150000.0 407.9926 6700.0 412.0259 14000.0 436.5729 3100.0 END IONS BEGIN IONS SCANS=527 PEPMASS=356.1257 CHARGE=1 COLLISION_ENERGY=0.0 54.0907 2400.0 54.1086 2200.0 55.0429 2200.0 57.6983 2200.0 58.8011 2300.0 59.7163 2100.0 62.8749 2200.0 65.0385 8900.0 66.8829 2400.0 67.054 10000.0 69.5968 2900.0 71.4122 2300.0 71.977 2300.0 72.1077 2400.0 72.6165 2400.0 73.028 5200.0 73.3019 2300.0 74.7907 2500.0 75.6858 2300.0 76.1386 2500.0 77.0389 7200.0 77.1395 3400.0 77.1803 2200.0 77.2129 2200.0 77.8735 2200.0 78.0461 230000.0 78.6432 2400.0 79.0539 43000.0 81.0331 290000.0 81.0695 9700.0 81.1679 2100.0 82.8425 2400.0 85.028 35000.0 88.8614 2300.0 91.0539 3500.0 93.0332 17000.0 93.3476 2100.0 94.9458 2400.0 95.0488 20000.0 99.0438 48000.0 102.1047 2100.0 102.6884 2600.0 103.0539 62000.0 103.9115 2300.0 104.0617 5800.0 106.041 170000.0 107.0415 3200.0 107.0487 200000.0 108.8886 2200.0 111.0437 74000.0 113.4314 2200.0 114.1086 2200.0 115.054 6700.0 117.0696 120000.0 118.3157 2200.0 121.6838 2200.0 122.0358 90000.0 123.0437 260000.0 124.0515 71000.0 125.0593 8100.0 128.6112 2800.0 130.0411 12000.0 131.0378 5800.0 131.0488 500000.0 132.0561 39000.0 133.0639 3400.0 135.0318 4400.0 135.0437 1300000.0 135.0542 15000.0 136.0515 2000000.0 136.063 27000.0 137.048 9500.0 137.0594 1100000.0 137.0704 11000.0 143.0489 32000.0 144.0567 16000.0 145.0645 470000.0 145.4563 2800.0 147.0439 6400.0 148.0516 240000.0 149.0595 44000.0 150.0672 39000.0 151.0386 32000.0 158.0711 2800.0 159.0436 17000.0 159.0795 3700.0 160.0517 240000.0 161.0595 270000.0 162.0672 240000.0 163.075 10000.0 163.6372 2700.0 164.0464 7000.0 169.9879 2300.0 172.0517 28000.0 173.0596 590000.0 173.5267 68000.0 173.5404 77000.0 174.0671 43000.0 175.0391 30000.0 175.0753 130000.0 178.0632 6100.0 185.0598 39000.0 186.067 6700.0 187.0757 9200.0 188.0828 35000.0 189.0544 60000.0 190.0624 35000.0 193.0491 5800.0 202.0625 93000.0 203.0702 180000.0 221.0821 2800.0 228.2996 2500.0 228.5574 2800.0 232.0849 11000.0 243.5901 2400.0 243.9493 2300.0 245.3372 2500.0 249.1549 3000.0 253.8699 2400.0 255.0248 2600.0 256.0188 2500.0 256.3854 2300.0 260.0789 2500.0 260.3901 2800.0 261.2241 2600.0 262.0957 15000.0 283.0023 2400.0 290.0919 11000.0 291.8182 2300.0 294.3462 2500.0 295.0746 13000.0 298.0606 8800.0 303.4907 2700.0 303.7538 2600.0 305.0807 13000.0 309.4739 2200.0 309.5268 2300.0 309.9009 38000.0 322.0614 11000.0 323.0685 2700.0 325.0541 3400.0 326.0568 34000.0 339.7089 2700.0 340.0737 7000.0 341.08 25000.0 345.7777 2300.0 356.1031 12000.0 END IONS BEGIN IONS SCANS=528 PEPMASS=321.1127 CHARGE=1 COLLISION_ENERGY=0.0 49.9257 6100.0 51.0236 16000.0 51.0729 2500.0 53.0386 3100.0 53.8603 7600.0 55.0178 5600.0 55.8138 3500.0 58.4759 4000.0 62.8531 4700.0 63.3137 3100.0 63.3646 8900.0 63.4958 3200.0 65.0388 96000.0 65.8188 2000.0 66.6279 3300.0 67.6938 3300.0 68.0679 2300.0 68.6277 3300.0 68.7627 2200.0 69.0336 4100.0 70.3315 3100.0 70.7252 7000.0 72.5415 2200.0 72.5887 2400.0 73.3436 3200.0 74.8638 2200.0 76.0314 2600.0 76.3894 2300.0 77.0391 92000.0 77.0712 9100.0 79.0541 85000.0 81.0398 5200.0 83.9864 5400.0 87.9717 3400.0 89.0394 3200.0 91.0483 14000.0 91.0542 770000.0 91.8416 4300.0 93.0698 260000.0 94.5913 7500.0 95.0491 200000.0 95.3076 5800.0 100.7332 2900.0 101.4891 3200.0 101.596 3900.0 102.0465 14000.0 103.0462 25000.0 103.0542 1700000.0 103.0659 4100.0 104.3284 6300.0 105.0327 3800.0 105.0447 65000.0 105.1209 3500.0 107.0484 8800.0 111.3415 4600.0 112.419 3200.0 115.0542 570000.0 117.07 66000.0 119.0491 450000.0 120.4695 4100.0 121.0646 37000.0 123.0625 3300.0 127.8131 2500.0 130.042 4600.0 131.0262 38000.0 131.0491 13000000.0 131.0576 130000.0 131.0669 8100.0 131.0723 14000.0 131.2004 7700.0 135.0168 13000.0 135.0253 3500.0 135.044 11000000.0 135.068 39000.0 137.0596 52000.0 138.312 7500.0 140.8444 2300.0 141.0698 240000.0 143.0362 6500.0 143.0491 1000000.0 143.0864 8700.0 145.1183 4600.0 147.0436 15000.0 148.0521 57000.0 149.0238 6000.0 149.0334 330000.0 149.037 33000.0 149.0596 33000000.0 149.0699 90000.0 149.0814 44000.0 149.0862 380000.0 149.0958 93000.0 149.1082 11000.0 152.6825 3300.0 155.0485 9300.0 157.1644 3100.0 157.7364 4900.0 159.0441 100000.0 160.0518 200000.0 161.0013 6000.0 161.0105 7200.0 161.0191 31000.0 161.0295 320000.0 161.0341 32000.0 161.0597 32000000.0 161.0845 47000.0 161.0892 380000.0 161.1001 68000.0 161.109 19000.0 161.2029 3200.0 162.3525 3000.0 164.911 3300.0 167.8214 8100.0 169.0648 390000.0 171.0802 3400.0 172.0516 35000.0 172.0746 5300.0 173.0256 5300.0 173.0457 32000.0 173.0598 9400000.0 173.5248 87000.0 173.5374 170000.0 181.2193 2500.0 185.0433 21000.0 185.0598 2700000.0 185.0781 14000.0 185.0874 6200.0 189.0705 10000.0 190.078 97000.0 199.0755 990000.0 199.096 5100.0 203.0862 76000.0 204.8351 3000.0 205.0672 17000.0 205.1013 1100000.0 207.116 2500.0 209.0596 9100.0 210.0678 13000.0 212.0053 3700.0 215.0858 230000.0 217.1005 5700.0 218.051 3800.0 218.0728 220000.0 219.0806 7400.0 222.0669 23000.0 225.3396 5300.0 231.0808 34000.0 232.3476 3400.0 233.0565 18000.0 233.0962 3700000.0 233.1237 29000.0 235.0754 170000.0 235.1113 28000.0 243.0808 130000.0 243.5561 2500.0 245.0957 49000.0 246.0674 75000.0 248.0833 180000.0 249.0912 31000.0 259.0758 15000.0 261.0586 30000.0 261.0909 1800000.0 261.1234 26000.0 262.0625 59000.0 262.0968 8000.0 263.0714 290000.0 263.1065 4200000.0 263.1321 8300.0 266.0577 15000.0 273.091 390000.0 275.0715 20000.0 276.0784 440000.0 279.0642 24000.0 289.0863 170000.0 290.0961 3300.0 291.0725 12000.0 291.1017 3700000.0 292.0731 70000.0 293.0817 91000.0 306.0889 590000.0 321.1121 820000.0 328.3031 3100.0 END IONS BEGIN IONS SCANS=529 PEPMASS=657.2426 CHARGE=1 COLLISION_ENERGY=0.0 69.5401 2400.0 70.3161 2700.0 71.236 2400.0 73.0265 13000.0 73.0286 3400.0 74.2701 10000.0 74.2726 3300.0 75.7288 2400.0 81.0334 3700.0 82.8564 2100.0 85.4258 2300.0 91.0965 2200.0 91.9379 2400.0 96.4299 2200.0 101.3614 2300.0 103.3523 2600.0 103.9486 2600.0 111.4624 3100.0 118.026 30000.0 120.0416 84000.0 121.4809 2400.0 123.2829 2700.0 123.4102 2400.0 125.1958 2300.0 125.9313 2600.0 127.8638 2500.0 128.0465 9500.0 129.0857 2300.0 130.7989 2500.0 134.0606 3200.0 139.5122 2300.0 143.1979 2300.0 150.0542 5800.0 152.9121 2300.0 156.0414 35000.0 157.0496 8600.0 157.3009 2600.0 158.0575 32000.0 160.2936 2400.0 160.3954 2400.0 162.2449 2500.0 163.1235 2200.0 172.0366 31000.0 173.5218 42000.0 173.5334 160000.0 173.5418 29000.0 175.7199 2300.0 176.5773 2500.0 178.0504 14000.0 180.485 2700.0 188.0308 7300.0 190.0811 2500.0 199.0482 2600.0 200.0314 160000.0 212.8433 2900.0 213.752 2500.0 224.171 2500.0 253.0943 210000.0 254.9108 2500.0 267.6843 2800.0 269.0569 5700.0 269.0895 1400000.0 269.1152 2700.0 273.0766 24000.0 277.0181 2500.0 279.087 2500.0 285.1712 2600.0 297.0074 14000.0 297.0226 8400.0 297.0542 4700.0 297.0846 6200000.0 297.1625 3900.0 310.0689 14000.0 325.0917 84000.0 340.0465 3400.0 340.1152 1600000.0 352.115 110000.0 354.1443 4400.0 357.0715 2600.0 359.3719 2700.0 368.1237 9400.0 378.2383 2800.0 383.1457 12000.0 385.1631 4100.0 402.4492 2900.0 405.0943 18000.0 413.1599 20000.0 420.1199 21000.0 433.0899 2900.0 435.1415 110000.0 449.7007 2600.0 450.7814 2500.0 460.3309 2400.0 463.1361 97000.0 486.152 84000.0 501.1759 19000.0 502.1463 5700.0 516.1995 22000.0 517.1709 12000.0 525.2804 2500.0 530.1401 7600.0 532.1939 440000.0 541.58 3000.0 559.2042 3100.0 560.1893 240000.0 633.2497 3100.0 657.2417 660000.0 END IONS BEGIN IONS SCANS=530 PEPMASS=680.3185 CHARGE=1 COLLISION_ENERGY=0.0 67.3818 2300.0 67.5017 2200.0 67.815 2000.0 68.6541 2000.0 75.0439 19000.0 76.8574 2400.0 77.445 2600.0 78.6082 2200.0 78.7981 2500.0 79.281 3100.0 80.0493 8900.0 80.278 3000.0 81.0334 2200000.0 81.0391 15000.0 82.6039 2500.0 83.7367 2300.0 85.2999 2200.0 87.0985 2600.0 88.07 2400.0 88.6792 2400.0 89.7544 2100.0 91.2676 2400.0 93.1271 2400.0 94.0651 16000.0 94.8628 2300.0 95.0489 6200.0 98.0598 88000.0 99.6021 2300.0 100.0724 2400.0 101.9805 2300.0 103.3939 2400.0 104.0495 2500.0 106.0648 10000.0 107.5551 2500.0 110.0236 71000.0 111.9317 2300.0 122.0599 41000.0 128.7872 2400.0 132.0443 37000.0 134.0599 45000.0 134.3303 2500.0 136.0393 44000.0 138.0543 6600.0 149.6829 4800.0 149.6931 4200.0 150.0547 920000.0 150.0652 2700.0 160.0386 6400.0 161.9327 2700.0 165.4109 2900.0 168.0752 2500.0 173.5253 70000.0 173.538 130000.0 174.3482 2700.0 178.0313 9100.0 178.0498 4400000.0 178.0862 18000.0 178.0971 3500.0 178.8394 2800.0 181.0858 100000.0 188.9303 2200.0 190.0624 11000.0 193.0858 9300.0 193.4137 2400.0 195.0649 79000.0 196.0604 9500.0 199.7958 2300.0 206.0576 13000.0 207.1013 8400.0 221.0565 3600.0 221.0809 980000.0 221.1072 2600.0 223.061 4900.0 223.0944 2400.0 230.3379 2600.0 245.0809 2800.0 247.0963 10000.0 262.6172 2400.0 263.9194 2300.0 265.0698 2400.0 273.0764 35000.0 275.1029 42000.0 281.756 2600.0 300.1223 17000.0 314.1152 2700.0 321.1883 2600.0 322.1203 11000.0 324.6585 2600.0 325.1538 2400.0 330.1455 11000.0 337.1034 8500.0 339.1246 12000.0 349.1066 5000.0 350.1173 6100.0 351.0843 8000.0 351.1227 52000.0 352.123 12000.0 353.1378 2900.0 354.146 36000.0 361.1654 18000.0 364.3216 2500.0 365.101 18000.0 366.1083 55000.0 366.152 13000.0 366.6527 2500.0 367.1174 130000.0 370.1373 2800.0 380.1265 23000.0 381.1332 200000.0 382.0847 10000.0 382.1412 510000.0 382.1933 3700.0 383.1115 25000.0 385.1647 63000.0 394.104 3300.0 395.1011 2800.0 395.1491 350000.0 398.1362 60000.0 399.1436 32000.0 409.129 12000.0 410.1363 150000.0 411.1078 47000.0 413.1596 580000.0 422.0588 3400.0 423.1445 5700.0 426.1307 65000.0 441.1543 350000.0 485.5563 2300.0 486.0357 2900.0 492.1919 3000.0 520.1966 7800.0 538.9649 2600.0 640.2341 2400.0 652.5799 2800.0 END IONS BEGIN IONS SCANS=531 PEPMASS=275.103 CHARGE=1 COLLISION_ENERGY=0.0 51.023 3000.0 51.5989 2300.0 53.0384 710000.0 53.0414 6600.0 53.0428 6600.0 54.8832 2200.0 55.0176 66000.0 55.054 20000.0 55.4395 2400.0 57.0697 13000.0 63.2458 2700.0 67.0539 22000.0 69.0331 3800.0 69.0697 17000.0 69.8992 2300.0 70.4164 2400.0 71.0488 37000.0 71.2616 2600.0 74.9169 2100.0 75.4866 2100.0 76.12 2200.0 79.0539 62000.0 80.0492 51000.0 81.027 5900.0 81.0332 3900000.0 81.0417 22000.0 81.0425 92000.0 81.0453 17000.0 81.0696 25000.0 82.0286 12000.0 83.0489 12000.0 83.0852 3400.0 84.9064 2200.0 85.0646 13000.0 85.3787 2300.0 87.1895 2300.0 87.8256 2200.0 91.0539 22000.0 93.0695 49000.0 94.0597 2200.0 94.0648 76000.0 95.0489 42000.0 95.0851 56000.0 95.4853 2300.0 97.0644 11000.0 98.0598 12000.0 100.3921 2200.0 104.0491 30000.0 104.2853 2600.0 105.0696 47000.0 106.0648 21000.0 107.049 12000.0 107.0852 56000.0 108.0442 21000.0 108.1408 2500.0 109.0644 30000.0 109.1008 20000.0 110.0148 2700.0 110.0233 230000.0 111.0801 51000.0 117.0695 17000.0 119.0852 55000.0 121.1009 58000.0 121.1179 2200.0 122.0506 3800.0 122.0597 160000.0 123.0801 3500.0 125.2422 2400.0 125.6163 2400.0 129.0703 9500.0 131.0853 79000.0 132.0441 140000.0 133.1009 61000.0 134.0597 36000.0 135.0801 43000.0 135.1174 2800.0 136.039 63000.0 137.0958 19000.0 142.0773 8900.0 143.0574 2500.0 143.0853 33000.0 144.0935 8600.0 145.1009 62000.0 147.1165 20000.0 149.0959 2500.0 150.0409 5300.0 150.0546 1200000.0 150.067 20000.0 154.8214 2400.0 155.0854 7000.0 156.0934 12000.0 157.1009 54000.0 158.1089 27000.0 159.1166 100000.0 160.0389 13000.0 161.0963 7900.0 168.0935 5800.0 169.1009 12000.0 171.1016 2500.0 171.1169 32000.0 173.0968 2500.0 173.1324 100000.0 173.5242 4300.0 173.5359 43000.0 174.1404 7600.0 175.1115 15000.0 175.2018 3000.0 177.1271 24000.0 178.0498 810000.0 178.0677 3000.0 183.1169 19000.0 184.1232 2400.0 186.2849 2600.0 187.1111 14000.0 187.1484 8900.0 189.1278 2600.0 191.1433 2900.0 197.1322 8800.0 197.965 2400.0 198.458 2300.0 199.1483 27000.0 201.1273 9000.0 206.7172 2300.0 233.1541 3500.0 257.1532 2700.0 END IONS BEGIN IONS SCANS=532 PEPMASS=635.2606 CHARGE=1 COLLISION_ENERGY=0.0 66.365 2600.0 70.3409 3500.0 73.7488 3400.0 75.0439 48000.0 79.0541 38000.0 80.0494 58000.0 81.0221 22000.0 81.027 7500.0 81.0334 6500000.0 81.0421 22000.0 81.0433 86000.0 81.0444 19000.0 81.0478 9000.0 82.0286 75000.0 93.2355 2800.0 94.0649 92000.0 95.049 38000.0 96.0446 4100.0 98.0235 12000.0 98.0599 370000.0 98.1606 3100.0 100.3413 2400.0 104.0494 44000.0 106.0648 38000.0 107.0492 7000.0 108.0444 26000.0 110.0235 380000.0 110.0321 6700.0 115.435 2300.0 122.0599 170000.0 130.8395 3800.0 132.0443 160000.0 134.0599 120000.0 136.0392 130000.0 138.0546 32000.0 150.0548 2600000.0 150.0655 17000.0 151.0754 4000.0 160.0394 32000.0 161.084 2800.0 167.0708 12000.0 173.4549 3400.0 173.5285 15000.0 173.5365 42000.0 176.0845 4600.0 178.0132 36000.0 178.0215 21000.0 178.0499 8100000.0 178.0863 57000.0 178.0966 12000.0 181.086 320000.0 188.0464 2700.0 193.0858 8100.0 195.0652 270000.0 195.1002 7300.0 196.0606 28000.0 205.084 3900.0 206.0576 65000.0 207.0666 2900.0 207.1016 35000.0 209.0019 3900.0 219.1009 10000.0 221.0562 4700.0 221.0809 770000.0 221.0997 4900.0 223.0598 21000.0 230.0585 5900.0 235.0959 17000.0 243.0769 3900.0 245.0809 41000.0 245.1065 3600.0 247.0966 77000.0 273.0759 82000.0 275.1034 44000.0 276.1222 5300.0 300.1232 59000.0 307.0966 27000.0 308.1036 12000.0 315.1222 5900.0 319.0974 4900.0 321.1125 30000.0 322.0816 3400.0 322.1197 61000.0 323.0907 21000.0 323.1287 16000.0 330.1467 60000.0 334.12 10000.0 335.0906 23000.0 335.1299 14000.0 336.0997 35000.0 337.1033 85000.0 338.1161 11000.0 339.122 85000.0 345.1328 8700.0 348.1023 13000.0 349.107 56000.0 350.1145 86000.0 351.084 96000.0 351.1228 390000.0 352.088 29000.0 352.1271 66000.0 353.138 50000.0 354.146 190000.0 355.1164 29000.0 360.1574 13000.0 361.1637 22000.0 362.1145 34000.0 365.1013 170000.0 365.139 3500.0 366.1092 300000.0 366.1464 45000.0 367.0629 3100.0 367.1175 730000.0 367.1705 13000.0 368.127 28000.0 369.1346 14000.0 370.1404 57000.0 371.1494 34000.0 377.1015 7200.0 378.1105 22000.0 379.1191 28000.0 380.1255 170000.0 381.0773 5300.0 381.1334 610000.0 381.176 4100.0 382.141 1900000.0 382.1832 11000.0 383.1128 200000.0 384.1218 4300.0 385.1648 170000.0 392.1239 4500.0 393.0961 28000.0 394.1047 15000.0 395.149 1500000.0 395.1954 2500.0 396.0853 6000.0 396.8714 3000.0 397.1248 28000.0 398.136 280000.0 399.1433 60000.0 401.1621 4600.0 407.1165 8200.0 408.1208 45000.0 409.128 69000.0 410.0721 5400.0 410.0874 2900.0 410.1362 680000.0 411.1075 250000.0 413.1112 7000.0 413.1594 1600000.0 423.1432 61000.0 425.1225 3100.0 426.1306 230000.0 426.189 3400.0 441.1004 2400.0 441.1542 730000.0 460.7765 3000.0 488.1689 9300.0 490.1505 13000.0 492.2006 23000.0 520.1969 49000.0 548.12 4300.0 END IONS BEGIN IONS SCANS=533 PEPMASS=538.2076 CHARGE=1 COLLISION_ENERGY=0.0 65.4961 2700.0 66.9267 2700.0 67.9693 2600.0 75.044 18000.0 77.5681 2300.0 79.7132 2400.0 81.0333 96000.0 84.3839 2200.0 90.0193 2600.0 91.0079 2200.0 91.0611 2300.0 91.8283 2500.0 96.0245 2200.0 98.0599 37000.0 98.5226 2300.0 105.0548 2700.0 105.5511 2700.0 110.0237 8500.0 111.8514 2300.0 118.8395 2700.0 119.506 2400.0 134.0602 13000.0 135.847 2500.0 136.7418 2100.0 138.0546 11000.0 139.7973 2200.0 150.0549 30000.0 173.525 48000.0 173.5415 14000.0 178.0497 53000.0 181.0859 120000.0 188.939 2400.0 191.7885 2600.0 195.0652 49000.0 206.0575 31000.0 208.7415 2700.0 211.2634 2800.0 221.081 310000.0 223.0604 14000.0 232.0958 3000.0 245.0814 4600.0 247.097 16000.0 270.5121 2500.0 273.0762 19000.0 276.1226 6400.0 300.1236 36000.0 310.1003 2600.0 321.1136 2600.0 322.1194 13000.0 323.0948 3500.0 332.6324 2600.0 335.0892 3200.0 336.0985 8100.0 337.1005 34000.0 338.1145 2900.0 339.1237 20000.0 349.1072 15000.0 350.1155 14000.0 351.0842 20000.0 351.1234 74000.0 351.9967 2400.0 352.1217 21000.0 353.1406 6300.0 354.1461 50000.0 355.1176 4200.0 365.1007 34000.0 366.1082 46000.0 366.1485 31000.0 367.1177 180000.0 370.1421 8800.0 380.1262 29000.0 381.133 130000.0 382.1413 360000.0 383.1131 49000.0 385.1649 44000.0 393.0978 3200.0 395.0999 13000.0 395.1493 180000.0 397.1251 4500.0 398.1358 52000.0 399.1422 7500.0 408.1226 2900.0 409.129 19000.0 410.1361 100000.0 411.1077 81000.0 413.1598 220000.0 423.1441 8800.0 426.131 51000.0 441.1544 93000.0 454.0001 2600.0 479.4773 2800.0 END IONS BEGIN IONS SCANS=534 PEPMASS=318.1341 CHARGE=1 COLLISION_ENERGY=0.0 49.0249 2300.0 49.0854 2600.0 50.6198 2400.0 51.1843 2200.0 54.554 2200.0 54.5642 2400.0 55.2696 21000.0 55.2716 4900.0 55.6971 2800.0 58.347 2600.0 59.3915 2800.0 60.1071 2300.0 61.381 2400.0 61.5481 2800.0 63.5813 2100.0 64.3996 2600.0 67.05 2500.0 68.305 2600.0 69.2304 2100.0 69.2979 2600.0 69.5592 2700.0 71.5748 2200.0 71.7893 2400.0 73.0274 2300.0 73.7964 2300.0 75.0707 2500.0 77.0762 2300.0 79.194 2600.0 80.3205 2100.0 83.1811 2300.0 84.6304 2500.0 85.8403 2400.0 89.6142 2200.0 89.7127 2300.0 91.0542 9000.0 95.0421 2300.0 96.3975 2300.0 98.0599 60000.0 99.1202 2500.0 99.6186 2800.0 102.0464 5300.0 102.9933 2500.0 103.0541 6500.0 105.0696 13000.0 106.8321 2700.0 107.0495 5200.0 111.5992 2300.0 112.4934 2400.0 113.0263 2600.0 117.812 2300.0 118.0413 15000.0 118.4471 2100.0 119.0489 34000.0 119.4879 2800.0 120.9664 2500.0 121.6937 2300.0 121.7688 2400.0 122.9342 3000.0 123.4853 2500.0 126.1848 2300.0 128.698 2400.0 130.0412 51000.0 131.0491 17000.0 131.8754 2200.0 132.057 38000.0 133.0288 2600.0 133.0646 58000.0 135.044 61000.0 135.0798 2800.0 135.9261 11000.0 138.9534 2200.0 144.0565 2700.0 146.035 6100.0 147.0439 260000.0 148.0518 26000.0 149.0593 48000.0 149.3014 2400.0 150.0676 36000.0 158.0344 2500.0 159.044 14000.0 160.0517 73000.0 160.1781 2100.0 161.0597 120000.0 162.0523 6900.0 162.0675 750000.0 162.0828 4200.0 163.0249 2800.0 163.0389 260000.0 163.0752 130000.0 163.9485 2600.0 165.0915 16000.0 167.0701 21000.0 172.0517 2400.0 173.5248 9200.0 173.5322 96000.0 173.5403 8500.0 174.0313 64000.0 174.4539 2300.0 175.0391 200000.0 176.0469 180000.0 177.0548 140000.0 177.2268 2200.0 178.046 4300.0 178.0625 710000.0 178.0805 3100.0 178.2322 2700.0 180.7873 2600.0 188.0466 65000.0 188.5958 2700.0 189.0545 330000.0 190.0225 3500.0 190.0337 3400.0 190.0624 3700000.0 190.0773 12000.0 191.0139 9400.0 191.0338 780000.0 191.0701 290000.0 191.2175 2300.0 192.0416 35000.0 193.0653 13000.0 193.0859 2800000.0 193.1064 15000.0 205.0499 20000.0 206.0246 3300.0 206.0344 9900.0 206.0574 1400000.0 206.0801 11000.0 220.3872 2500.0 221.0306 31000.0 221.0809 8600000.0 221.1002 8000.0 221.1201 15000.0 221.1319 19000.0 227.0305 2600.0 227.1946 2700.0 244.8707 2900.0 247.1098 3200.0 248.2289 2500.0 256.2666 2300.0 271.8933 3100.0 277.7099 2500.0 END IONS BEGIN IONS SCANS=535 PEPMASS=221.0811 CHARGE=1 COLLISION_ENERGY=0.0 43.0178 27000.0 43.5153 2700.0 49.035 2500.0 55.0504 4900.0 56.8599 2300.0 57.0695 2600.0 59.9913 2100.0 61.719 2400.0 62.345 2700.0 67.054 12000.0 68.9968 2500.0 69.0696 11000.0 69.1803 2100.0 71.0125 52000.0 72.8767 2600.0 73.4608 2400.0 77.0386 2400.0 78.0462 21000.0 79.054 48000.0 81.0696 10000.0 85.0435 2500.0 86.6803 2100.0 88.5534 2400.0 89.0376 2700.0 90.0465 3600.0 91.0539 60000.0 92.9712 2200.0 93.0074 2500.0 93.0698 8900.0 95.049 26000.0 95.0854 37000.0 96.4261 2800.0 102.0461 74000.0 103.0541 42000.0 103.3642 2300.0 104.0618 40000.0 104.9515 4600.0 105.0333 7100.0 105.0698 43000.0 107.0488 69000.0 107.0852 12000.0 107.97 2400.0 109.0645 2400.0 109.1011 22000.0 113.0594 84000.0 115.0543 3600.0 116.0624 4500.0 118.0411 50000.0 119.0489 130000.0 119.085 7100.0 120.0572 11000.0 121.0296 3000.0 121.0646 31000.0 121.101 2600.0 122.0726 10000.0 129.5522 2300.0 130.0412 130000.0 131.049 67000.0 132.0207 2900.0 132.0567 110000.0 133.0283 26000.0 133.0647 43000.0 134.0361 2700.0 134.0724 4200.0 135.0438 190000.0 137.0595 13000.0 139.0751 2400.0 144.0572 3200.0 145.0281 12000.0 145.0648 3600.0 146.0361 22000.0 146.4111 2800.0 147.0438 460000.0 147.1176 6000.0 148.0518 66000.0 149.0595 94000.0 150.0676 44000.0 157.0396 7000.0 158.036 5600.0 159.0077 9600.0 159.0441 15000.0 160.0518 120000.0 161.0237 15000.0 161.0598 99000.0 162.0675 320000.0 163.0232 6000.0 163.0389 570000.0 163.0552 3300.0 163.0752 59000.0 163.1117 2500.0 172.1248 2400.0 173.0234 3300.0 173.5231 4400.0 173.535 62000.0 174.0311 35000.0 174.9846 6300.0 175.0391 300000.0 176.047 77000.0 177.0547 83000.0 178.0626 290000.0 180.7751 2800.0 187.0408 2900.0 187.4121 2300.0 188.0471 40000.0 189.0542 12000.0 190.0431 5500.0 190.0625 390000.0 190.0809 4700.0 191.0143 2700.0 191.034 180000.0 191.0704 6800.0 192.0424 3100.0 193.0861 190000.0 203.1803 3800.0 205.0497 6300.0 206.0576 97000.0 221.0813 23000.0 221.1539 2800.0 230.5667 2500.0 END IONS BEGIN IONS SCANS=536 PEPMASS=657.2422 CHARGE=1 COLLISION_ENERGY=0.0 66.0822 2200.0 70.3943 2700.0 73.0243 6400.0 73.0275 15000.0 78.9676 2300.0 120.0416 32000.0 123.2837 2500.0 173.294 2600.0 173.5271 23000.0 188.0315 100000.0 221.0806 8800.0 269.0896 34000.0 279.0867 4300.0 296.0883 3800.0 297.0847 160000.0 310.0688 11000.0 324.0836 4300.0 325.0919 65000.0 340.0198 8500.0 340.1153 1800000.0 352.1161 3000.0 395.1467 15000.0 397.1727 3100.0 437.1679 11000.0 461.1693 3800.0 463.1364 120000.0 463.2105 3200.0 516.1961 7300.0 532.1916 10000.0 559.2032 13000.0 560.189 67000.0 592.1245 2300.0 641.2083 4500.0 657.2418 460000.0 END IONS BEGIN IONS SCANS=537 PEPMASS=322.1083 CHARGE=1 COLLISION_ENERGY=0.0 57.8927 2700.0 79.022 2400.0 88.0754 2900.0 103.0541 3000.0 104.8949 2300.0 113.2651 2900.0 131.049 31000.0 132.0524 22000.0 135.0439 30000.0 136.0472 18000.0 143.049 3500.0 149.0595 77000.0 149.0735 3300.0 150.0629 62000.0 151.5632 2300.0 161.0596 57000.0 162.063 65000.0 173.0598 20000.0 173.5294 11000.0 174.0632 22000.0 185.0595 4100.0 186.0627 4100.0 200.0793 4200.0 206.1024 3000.0 223.099 11000.0 232.0769 2600.0 233.0838 11000.0 234.0969 16000.0 236.0724 2800.0 241.5709 2700.0 249.0544 26000.0 249.079 4900.0 250.0609 4100.0 250.0867 15000.0 251.094 9900.0 261.0783 150000.0 262.0872 38000.0 263.0942 27000.0 264.066 24000.0 264.1095 15000.0 265.072 6900.0 274.0504 7400.0 276.0679 2500.0 277.0739 29000.0 278.0812 610000.0 279.0891 110000.0 279.1253 3000.0 280.0975 10000.0 289.0734 54000.0 290.0812 150000.0 292.0228 5400.0 292.0605 160000.0 292.1023 13000.0 293.0684 65000.0 294.0758 5300.0 294.1124 67000.0 304.0954 3000.0 306.0762 580000.0 307.0432 6100.0 307.0841 320000.0 322.1075 1000000.0 322.1956 8500.0 END IONS BEGIN IONS SCANS=538 PEPMASS=344.0897 CHARGE=1 COLLISION_ENERGY=0.0 50.1755 2300.0 53.1991 2100.0 54.6006 2000.0 58.688 2500.0 59.758 2200.0 66.9168 2100.0 70.0128 2100.0 70.413 2400.0 73.0281 3100.0 78.0403 2700.0 78.9812 2100.0 89.0595 6200.0 89.4323 2300.0 101.9023 2300.0 102.0917 2900.0 121.0642 3600.0 126.6119 2400.0 168.0546 2900.0 173.5246 10000.0 173.5332 43000.0 173.5429 4700.0 174.7614 2900.0 179.4126 2200.0 184.7393 2600.0 189.14 2300.0 190.8225 2800.0 201.5177 2600.0 216.8742 2300.0 226.654 2600.0 249.1342 2300.0 283.0617 3800.0 297.6001 2600.0 298.5577 2400.0 300.0633 15000.0 328.0584 120000.0 329.0665 34000.0 344.0407 8000.0 344.0893 300000.0 344.1338 4300.0 353.1429 2400.0 END IONS BEGIN IONS SCANS=539 PEPMASS=235.0967 CHARGE=1 COLLISION_ENERGY=0.0 43.0177 260000.0 57.0697 44000.0 64.0509 2200.0 66.4037 3100.0 66.928 2200.0 73.0281 47000.0 73.8421 2400.0 74.0315 13000.0 74.0658 2400.0 77.106 2100.0 82.6991 2400.0 83.2346 2600.0 84.1024 2200.0 86.8922 2700.0 88.2441 2400.0 91.0537 2300.0 93.3368 2600.0 94.1228 2300.0 95.1604 3000.0 105.0696 48000.0 110.0361 6300.0 112.2705 2300.0 114.4297 2800.0 118.6412 2300.0 119.0853 6400.0 123.0437 180000.0 127.1042 2200.0 129.0698 32000.0 133.0647 22000.0 137.0964 2700.0 140.0802 2800.0 147.0805 2700.0 148.8951 2500.0 149.6877 5500.0 149.7077 3000.0 151.0751 130000.0 157.0646 13000.0 170.0621 2600.0 173.5188 5600.0 173.5271 35000.0 173.5367 58000.0 173.5451 4500.0 175.0754 34000.0 178.7573 2300.0 179.1068 11000.0 191.9401 2300.0 224.1932 2400.0 233.6104 2400.0 235.1706 2500.0 235.2044 6800.0 240.1218 2400.0 END IONS BEGIN IONS SCANS=540 PEPMASS=252.1232 CHARGE=1 COLLISION_ENERGY=0.0 44.679 2300.0 45.0334 2300.0 46.877 2300.0 46.919 2100.0 48.4233 2200.0 51.2491 2200.0 51.6129 4300.0 52.2811 2300.0 53.5259 2000.0 55.0177 26000.0 56.7203 2100.0 57.9511 2700.0 59.2137 2100.0 60.0442 130000.0 60.0946 2300.0 61.7003 2100.0 62.1615 2400.0 65.0826 2400.0 67.2627 2200.0 67.4504 2600.0 70.5787 2200.0 73.0283 5400.0 76.0451 2700.0 77.4131 2300.0 78.6005 2700.0 79.0542 3400.0 81.0268 2400.0 81.0762 2600.0 84.8195 2600.0 88.2154 2400.0 104.9469 2300.0 105.0697 580000.0 105.0782 3100.0 110.0362 93000.0 111.3769 2400.0 114.3826 2500.0 115.0051 2600.0 116.7414 2100.0 120.2876 2300.0 123.0336 5200.0 123.0439 3100000.0 123.0524 14000.0 123.0802 43000.0 128.4812 2800.0 129.0697 190000.0 131.0494 6600.0 131.2776 2400.0 131.4033 2300.0 133.0647 470000.0 134.4084 2300.0 135.0438 32000.0 135.1349 2600.0 147.0803 45000.0 149.0597 14000.0 151.0646 15000.0 151.0752 7400000.0 151.1036 40000.0 151.6829 2500.0 157.0647 370000.0 160.0519 29000.0 161.1329 3100.0 170.5922 3100.0 173.5256 19000.0 173.5365 66000.0 175.0496 3500.0 175.0577 11000.0 175.0755 890000.0 175.0933 21000.0 184.0374 3400.0 193.086 150000.0 196.0607 110000.0 199.0729 2600.0 209.0596 12000.0 224.0927 12000.0 237.0552 2800.0 242.9261 2600.0 END IONS BEGIN IONS SCANS=541 PEPMASS=257.0785 CHARGE=1 COLLISION_ENERGY=0.0 46.7374 2400.0 47.1028 2100.0 47.8609 2500.0 49.3147 2400.0 53.6092 2000.0 55.1173 2300.0 56.3257 2300.0 56.5515 2700.0 56.9112 2800.0 58.6465 2300.0 61.1267 2300.0 62.2545 2300.0 62.6299 2200.0 63.1568 2200.0 63.708 2700.0 65.44 2500.0 67.5453 2000.0 73.028 9900.0 74.9629 2300.0 78.5836 2400.0 84.3362 2400.0 88.2274 2300.0 92.3691 2600.0 101.9817 2300.0 115.2569 2300.0 121.101 2400.0 122.7333 2500.0 122.9322 2900.0 125.1232 2300.0 132.0837 2200.0 134.8343 2200.0 135.3615 2300.0 136.2451 2600.0 139.2821 2300.0 141.8745 2500.0 142.6911 2200.0 150.234 2400.0 151.4302 2700.0 154.1213 2500.0 167.1236 3100.0 173.5302 83000.0 173.5433 8600.0 195.568 2400.0 205.8802 9500.0 229.7865 2600.0 238.7921 2400.0 242.651 2500.0 253.4232 2300.0 END IONS BEGIN IONS SCANS=542 PEPMASS=643.2266 CHARGE=1 COLLISION_ENERGY=0.0 65.0252 2600.0 66.5678 2600.0 69.8385 2300.0 73.4904 2100.0 82.4392 2300.0 94.4738 2100.0 95.0491 2500.0 108.4457 2200.0 119.0336 28000.0 120.0415 18000.0 147.0286 18000.0 173.5243 7000.0 173.5315 42000.0 173.5429 4100.0 215.0677 2800.0 217.0833 31000.0 221.0804 28000.0 229.0462 6200.0 255.8605 2500.0 259.1942 2700.0 275.1009 3300.0 279.0865 3500.0 282.1103 2900.0 297.0908 2400.0 318.2956 2400.0 324.0849 15000.0 325.0917 56000.0 326.0346 3400.0 326.0996 270000.0 340.115 300000.0 341.1235 29000.0 362.3222 2500.0 401.2767 3100.0 430.2971 2700.0 449.1181 2700.0 457.5725 3200.0 465.9429 2700.0 529.7254 2400.0 563.5421 2600.0 603.5651 2600.0 END IONS BEGIN IONS SCANS=543 PEPMASS=201.0912 CHARGE=1 COLLISION_ENERGY=0.0 43.2472 2200.0 49.4013 2100.0 50.03 2400.0 51.1922 2400.0 55.1201 2300.0 55.7068 2400.0 55.9341 110000.0 56.9346 43000.0 56.942 2600.0 59.1215 2200.0 60.5174 2400.0 60.7242 2400.0 60.9088 2200.0 66.27 2300.0 68.3778 2400.0 72.9368 23000.0 73.9372 3900.0 75.0023 2600.0 76.9327 2700.0 78.0568 2200.0 78.4805 2200.0 79.3495 2200.0 86.5817 2500.0 89.9389 2500.0 90.9474 31000.0 91.9479 8200.0 92.5452 2200.0 102.9484 3200.0 107.9499 14000.0 114.9479 12000.0 114.9716 6000.0 115.0541 40000.0 115.9793 9200.0 116.0617 2600.0 116.8582 2300.0 117.9593 7000.0 119.086 2600.0 123.5697 2200.0 128.062 22000.0 128.9507 25000.0 129.0696 77000.0 129.9524 24000.0 130.0776 110000.0 131.0853 3900.0 131.974 53000.0 132.329 2500.0 132.9584 2800.0 135.945 11000.0 136.9449 3100.0 140.0619 46000.0 141.0697 24000.0 143.0491 20000.0 145.1005 3800.0 147.9635 2400.0 149.6702 3500.0 149.6893 9700.0 149.985 9000.0 155.9746 3200.0 156.0569 20000.0 157.0433 3300.0 157.0647 580000.0 158.061 2800.0 158.0726 370000.0 159.1176 2500.0 168.0559 3300.0 171.0444 12000.0 173.5314 39000.0 174.8613 2700.0 185.0598 55000.0 186.0677 110000.0 201.0914 140000.0 201.1104 4200.0 END IONS BEGIN IONS SCANS=544 PEPMASS=231.1018 CHARGE=1 COLLISION_ENERGY=0.0 43.9363 2500.0 44.2961 2200.0 45.148 2300.0 47.1645 2300.0 53.4535 2300.0 53.5275 2200.0 55.0176 12000.0 59.9899 2500.0 67.415 2100.0 72.6941 2200.0 86.1037 2200.0 86.5946 2200.0 91.0803 2400.0 111.5048 2500.0 128.0619 12000.0 129.0695 35000.0 129.0787 2500.0 130.0771 4500.0 141.0696 9000.0 142.0773 6300.0 143.0851 18000.0 145.0644 28000.0 151.7653 2100.0 156.0571 13000.0 157.0645 78000.0 158.0724 57000.0 159.0802 20000.0 170.0724 23000.0 171.0804 17000.0 172.0882 120000.0 173.0596 130000.0 173.5258 6500.0 173.5368 26000.0 175.0759 3000.0 185.0598 3700.0 186.0674 30000.0 187.0752 47000.0 188.083 120000.0 189.0906 17000.0 194.6114 2300.0 198.0689 2400.0 200.0826 3800.0 201.0553 11000.0 201.091 83000.0 203.1065 22000.0 216.0788 19000.0 216.2197 2600.0 216.4366 2100.0 229.6114 2300.0 231.102 14000.0 240.0811 2200.0 END IONS BEGIN IONS SCANS=545 PEPMASS=597.2213 CHARGE=1 COLLISION_ENERGY=0.0 67.4399 2100.0 69.2834 2400.0 70.4552 2200.0 70.7399 2400.0 80.2378 2300.0 82.4149 2700.0 85.1307 2500.0 91.8269 2300.0 96.9382 2400.0 99.0699 2200.0 105.1746 2200.0 106.4459 2300.0 120.042 2500.0 135.3561 2900.0 149.6781 2600.0 149.6884 5800.0 149.7088 3700.0 159.9151 2400.0 173.5239 18000.0 173.5395 25000.0 184.6228 2500.0 193.74 2800.0 219.6734 2700.0 230.1158 2300.0 233.7334 2300.0 236.844 2400.0 264.3713 2400.0 269.0893 31000.0 280.0948 130000.0 297.0849 130000.0 318.2243 2500.0 340.1157 130000.0 363.886 2700.0 398.056 2500.0 426.1292 7700.0 456.1753 3100.0 472.1733 23000.0 500.1712 8300.0 539.2056 2500.0 597.2212 30000.0 END IONS BEGIN IONS SCANS=546 PEPMASS=741.2907 CHARGE=1 COLLISION_ENERGY=0.0 70.2539 2700.0 71.0492 2600.0 71.2864 2400.0 73.1898 2500.0 77.0388 3400.0 79.0541 10000.0 81.0333 25000.0 85.3184 2100.0 87.672 2200.0 91.0541 7200.0 92.706 2200.0 92.7846 2300.0 95.0492 15000.0 96.1125 2100.0 96.151 2300.0 102.6226 2500.0 103.0541 13000.0 107.049 17000.0 108.2852 3000.0 109.9822 2400.0 111.0437 3200.0 115.0542 66000.0 117.07 15000.0 119.9066 2300.0 121.0648 8200.0 123.044 7800.0 124.052 3200.0 128.0623 9400.0 129.0699 40000.0 131.049 39000.0 131.7847 2800.0 133.0279 6200.0 135.0314 3500.0 135.0439 1400000.0 136.0517 41000.0 137.0592 2800.0 139.0752 29000.0 143.049 150000.0 143.0867 3100.0 143.0999 2900.0 145.0646 220000.0 146.0718 3900.0 147.0439 16000.0 148.7585 2500.0 149.0233 20000.0 149.0596 29000.0 151.0096 3100.0 151.0387 50000.0 151.0647 4300.0 151.0753 570000.0 151.0891 4200.0 155.0609 3200.0 157.0647 68000.0 158.0725 24000.0 159.0441 55000.0 159.0802 3500.0 161.0459 3000.0 161.0596 92000.0 163.0384 3100.0 163.0764 3000.0 165.0549 13000.0 165.0906 14000.0 167.0702 42000.0 171.081 9400.0 172.0883 35000.0 173.0597 1500000.0 173.0948 4200.0 173.5331 32000.0 173.5415 6600.0 174.0676 180000.0 175.0393 14000.0 175.0753 50000.0 177.0549 14000.0 177.0911 81000.0 179.0705 12000.0 181.0663 3000.0 181.0843 5100.0 185.0455 3100.0 185.0598 500000.0 185.0785 3400.0 186.0676 12000.0 187.0754 120000.0 188.0832 79000.0 189.071 9000.0 189.0911 790000.0 191.0712 7800.0 191.1067 14000.0 193.0862 12000.0 197.0596 4300.0 199.0752 27000.0 201.0692 10000.0 201.0911 490000.0 201.1131 10000.0 203.0704 100000.0 203.1068 170000.0 205.0877 2500.0 209.0598 4100.0 211.0758 3000.0 213.0909 13000.0 215.0704 59000.0 216.0783 13000.0 219.0804 3700.0 219.1021 25000.0 223.0753 2700.0 224.0084 2700.0 225.0936 2600.0 231.0764 11000.0 231.1018 180000.0 233.0808 32000.0 234.1052 2500.0 237.0548 3200.0 239.071 9700.0 245.0966 11000.0 246.1041 13000.0 247.0761 6900.0 249.1143 3100.0 251.1057 3300.0 252.0781 100000.0 253.0503 6800.0 253.0861 14000.0 260.0836 5800.0 261.0909 43000.0 262.0985 23000.0 265.1228 14000.0 267.065 31000.0 267.1385 2600.0 268.0732 69000.0 273.091 26000.0 274.099 48000.0 275.0719 7300.0 275.1064 6900.0 277.0878 10000.0 277.1226 45000.0 278.0942 11000.0 280.0734 2900.0 282.0891 160000.0 283.097 150000.0 288.0784 9900.0 289.0863 35000.0 290.0941 25000.0 291.102 16000.0 292.1097 57000.0 293.0838 4300.0 293.1173 35000.0 295.0965 58000.0 295.1323 5100.0 303.1021 57000.0 304.1098 230000.0 304.1495 5500.0 305.0808 25000.0 305.1179 100000.0 308.1049 90000.0 309.1138 13000.0 320.1046 120000.0 321.8253 2700.0 322.1205 7800.0 323.1282 130000.0 325.1435 7300.0 335.1279 190000.0 335.1732 7800.0 353.1379 23000.0 491.9146 2400.0 591.7997 2500.0 622.7922 2600.0 END IONS BEGIN IONS SCANS=547 PEPMASS=282.0891 CHARGE=1 COLLISION_ENERGY=0.0 48.4799 2300.0 51.9759 2300.0 54.9257 2100.0 57.0696 4800.0 60.8527 2600.0 64.4317 2300.0 68.9695 2300.0 69.0695 6400.0 69.425 2400.0 70.9517 2300.0 72.1451 2100.0 83.0855 5800.0 88.5463 2300.0 97.1012 2100.0 101.2062 2500.0 128.1067 2400.0 132.0132 2800.0 132.6491 2600.0 134.096 36000.0 149.6809 4100.0 149.6913 4400.0 153.0697 38000.0 155.0849 2800.0 171.6535 2400.0 173.5288 25000.0 181.0646 110000.0 197.0603 7300.0 207.8872 12000.0 209.0598 96000.0 211.0754 150000.0 211.1361 5500.0 221.0597 53000.0 222.068 5600.0 224.0468 11000.0 225.0553 13000.0 235.8853 2500.0 237.0557 4400.0 238.0623 63000.0 239.0702 650000.0 239.0976 5800.0 249.0544 9700.0 267.0319 7600.0 267.065 260000.0 282.0888 180000.0 282.2216 95000.0 END IONS BEGIN IONS SCANS=548 PEPMASS=323.1281 CHARGE=1 COLLISION_ENERGY=0.0 55.2431 2400.0 60.046 2300.0 63.2548 2400.0 64.8662 2700.0 71.6075 2400.0 77.2159 2200.0 78.7251 2500.0 79.0537 13000.0 80.6902 2200.0 86.6844 2500.0 89.1894 2200.0 95.0486 8900.0 96.5484 2400.0 97.8162 2400.0 105.0333 2800.0 107.0488 3700.0 111.3217 2300.0 118.5415 2400.0 118.857 2700.0 130.3574 2300.0 133.682 2500.0 135.0437 510000.0 135.0534 6500.0 136.0515 57000.0 138.7821 2700.0 147.0438 14000.0 151.075 120000.0 158.0724 3600.0 159.0521 2500.0 167.7924 2300.0 173.528 23000.0 173.5375 17000.0 173.5455 5100.0 185.0597 32000.0 186.0679 5400.0 188.7027 2500.0 201.0907 58000.0 218.0724 3400.0 219.079 6600.0 222.1531 2300.0 224.5349 2500.0 231.0804 5500.0 233.0961 41000.0 234.1037 40000.0 235.0753 9300.0 239.6478 2700.0 247.0752 14000.0 247.7713 2700.0 248.0841 4000.0 249.0912 5400.0 249.7983 2400.0 250.0991 13000.0 261.0907 72000.0 262.0984 64000.0 263.0702 9800.0 263.1059 7400.0 264.1135 2600.0 265.0905 4700.0 265.1221 64000.0 267.0655 17000.0 274.0983 6700.0 276.0783 9200.0 276.856 6000.0 277.0861 29000.0 278.0936 31000.0 280.0732 9400.0 282.0886 13000.0 290.0948 3000.0 291.1017 22000.0 292.1096 170000.0 292.146 7200.0 293.0809 40000.0 293.1175 44000.0 295.0969 48000.0 308.1046 110000.0 323.128 27000.0 END IONS BEGIN IONS SCANS=549 PEPMASS=335.1281 CHARGE=1 COLLISION_ENERGY=0.0 50.086 2500.0 51.1231 2200.0 52.921 2100.0 53.7308 2300.0 58.118 2100.0 58.2879 2700.0 60.1467 2200.0 63.1227 2600.0 66.5441 2700.0 67.0969 2500.0 68.3873 2100.0 68.6087 2900.0 69.1587 2200.0 70.8388 2700.0 75.0438 37000.0 75.2592 2400.0 78.558 2200.0 83.0052 2500.0 91.0542 3600.0 96.6306 2200.0 98.0144 2200.0 105.6439 2200.0 119.6056 2100.0 122.9611 2500.0 123.5877 2500.0 131.3128 2500.0 135.0436 14000.0 147.0438 25000.0 151.0752 13000.0 152.9813 2800.0 158.5887 2400.0 161.058 5500.0 173.5274 34000.0 173.5392 29000.0 185.0594 11000.0 191.1062 22000.0 199.0751 98000.0 202.0787 23000.0 203.0855 19000.0 204.8959 2700.0 212.8648 5800.0 213.0906 20000.0 215.0852 29000.0 215.1066 3600.0 217.101 30000.0 219.0805 21000.0 230.0721 26000.0 230.874 21000.0 231.08 60000.0 232.0881 19000.0 233.0962 31000.0 234.1036 25000.0 235.0742 2900.0 239.07 7800.0 242.074 3200.0 243.0801 25000.0 244.0875 17000.0 245.0957 120000.0 246.1035 200000.0 247.075 81000.0 247.111 26000.0 248.0826 5500.0 248.1184 9000.0 249.0905 18000.0 251.1062 40000.0 257.0955 6000.0 258.0676 25000.0 259.075 71000.0 259.1081 4300.0 260.0826 79000.0 261.0905 160000.0 262.0668 3900.0 262.0983 170000.0 263.0711 16000.0 263.105 8000.0 264.4411 2600.0 267.0646 40000.0 271.0764 9800.0 272.0834 61000.0 273.0568 8900.0 273.0908 320000.0 274.0987 280000.0 275.0701 88000.0 275.106 43000.0 276.078 36000.0 276.1148 28000.0 277.0862 93000.0 277.1222 260000.0 279.0662 4500.0 279.1026 15000.0 279.1375 21000.0 280.0742 2900.0 282.0887 67000.0 287.0699 21000.0 288.078 160000.0 289.0469 3100.0 289.0859 650000.0 289.1173 11000.0 290.0584 7500.0 290.0936 170000.0 291.0646 26000.0 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119.0494 4800.0 119.5339 2100.0 119.8427 2500.0 121.0646 180000.0 121.8855 2100.0 122.0359 24000.0 122.0725 5500.0 122.2622 2600.0 127.3477 2200.0 128.2834 2300.0 131.0488 150000.0 134.0792 2300.0 135.0304 12000.0 135.0439 1200000.0 135.0532 3900.0 135.0613 2900.0 136.0508 85000.0 137.0596 160000.0 138.0671 40000.0 139.0749 8700.0 143.0489 8900.0 145.0644 24000.0 146.0724 65000.0 147.0443 4000.0 147.0801 49000.0 148.0516 80000.0 149.023 180000.0 149.0595 47000.0 149.0967 2700.0 149.6818 3100.0 149.6919 5700.0 150.0671 15000.0 150.3847 2300.0 151.0384 9700.0 151.0604 2300.0 151.0647 3000.0 151.0752 700000.0 151.0872 2600.0 152.0829 250000.0 152.097 4400.0 157.0647 2900.0 159.0447 2900.0 160.0518 27000.0 161.0597 97000.0 162.0676 14000.0 163.0402 2600.0 163.0754 53000.0 164.083 67000.0 165.0545 170000.0 165.0698 2700.0 165.0909 15000.0 166.0617 3400.0 166.0991 9600.0 167.0703 3300.0 173.0597 75000.0 173.5272 44000.0 173.5429 14000.0 174.0677 8000.0 175.0757 22000.0 176.0453 2600.0 176.0835 62000.0 177.0547 6800.0 177.0734 10000.0 177.0911 380000.0 178.0617 6300.0 178.0988 70000.0 186.0675 11000.0 187.0754 23000.0 188.0826 3200.0 189.0545 9400.0 189.091 93000.0 191.0704 10000.0 191.1051 3300.0 192.0415 48000.0 194.0937 3900.0 201.0545 26000.0 201.9956 2200.0 203.0703 16000.0 203.1068 33000.0 205.0505 7400.0 205.0858 5900.0 206.0573 12000.0 211.1425 2500.0 217.0859 42000.0 219.0647 6000.0 219.1021 3600.0 232.0721 3400.0 235.0958 3300.0 271.0962 38000.0 321.1115 5300.0 338.2482 2600.0 339.1232 4600.0 339.6053 2700.0 346.6095 2600.0 346.9544 3100.0 END IONS BEGIN IONS SCANS=552 PEPMASS=371.1489 CHARGE=1 COLLISION_ENERGY=0.0 54.7277 2600.0 55.018 5900.0 55.0544 5800.0 56.764 2400.0 57.07 2900.0 60.7781 7300.0 63.024 5100.0 65.0387 3100.0 67.0541 11000.0 68.7726 2100.0 71.0491 23000.0 75.0443 12000.0 77.039 35000.0 79.0542 84000.0 81.0699 6000.0 81.7127 2900.0 82.0733 2900.0 84.4878 2400.0 91.0541 45000.0 92.5953 2700.0 93.0335 4400.0 93.0696 4000.0 94.0727 2700.0 95.049 53000.0 95.0856 5300.0 96.0891 2400.0 101.0595 17000.0 103.0544 23000.0 104.0574 4200.0 105.0336 27000.0 105.0448 15000.0 107.0492 38000.0 108.0573 3200.0 111.044 24000.0 115.0549 7100.0 117.0697 42000.0 119.0491 22000.0 121.0647 370000.0 121.0747 9300.0 122.0355 3800.0 123.0439 19000.0 124.2316 5000.0 125.0594 7300.0 128.0621 3800.0 129.0542 6400.0 129.0698 19000.0 131.0491 150000.0 132.0526 24000.0 133.0286 9100.0 133.0647 19000.0 135.0128 18000.0 135.0197 47000.0 135.025 34000.0 135.044 11000000.0 135.054 26000.0 135.0634 36000.0 135.0682 120000.0 135.0814 9100.0 136.0501 95000.0 137.0596 31000.0 138.0658 9900.0 139.0751 34000.0 143.0491 11000.0 143.0861 3900.0 145.0648 230000.0 146.0725 220000.0 147.0439 180000.0 147.0804 120000.0 148.0518 17000.0 149.0234 71000.0 149.0457 9400.0 149.0596 500000.0 149.0955 18000.0 149.6815 4700.0 149.6926 5700.0 150.0269 26000.0 150.0647 10000.0 151.039 25000.0 151.0605 3500.0 151.0627 7500.0 151.0754 1500000.0 151.0877 3200.0 152.0793 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10000.0 203.107 340000.0 204.075 3300.0 204.1111 3600.0 205.0862 120000.0 206.0909 2800.0 209.0605 2500.0 213.0532 5700.0 213.0914 67000.0 215.0704 78000.0 215.0897 3700.0 216.0778 6400.0 217.0857 48000.0 218.0935 27000.0 219.0798 5300.0 219.1032 5000.0 220.0896 9400.0 223.0735 2300.0 224.0837 3400.0 225.0547 3700.0 225.0916 34000.0 230.071 3400.0 231.0805 27000.0 231.1021 270000.0 231.4897 2400.0 232.0884 13000.0 233.0965 25000.0 234.1046 16000.0 235.0754 3700.0 235.1117 160000.0 237.0541 3800.0 238.0613 2500.0 238.0997 3300.0 239.0708 15000.0 239.1061 3800.0 244.0885 3500.0 245.0961 120000.0 246.104 120000.0 246.1307 4600.0 247.0764 27000.0 247.111 5600.0 248.0837 25000.0 249.0914 6400.0 250.0998 7800.0 250.6525 4800.0 251.0709 4800.0 251.1067 17000.0 252.0784 110000.0 253.0501 12000.0 253.0862 42000.0 255.1014 4500.0 258.0668 5600.0 259.0752 11000.0 260.0827 28000.0 261.0587 3200.0 261.0914 140000.0 262.067 5100.0 262.0989 160000.0 263.0706 9900.0 263.1068 150000.0 264.1139 11000.0 265.0889 7100.0 265.1227 66000.0 265.1515 4400.0 266.0939 8300.0 267.0656 32000.0 267.1382 7100.0 268.0735 140000.0 271.0764 5100.0 271.1011 3300.0 272.0836 110000.0 272.1045 2900.0 273.0914 210000.0 273.1212 2100.0 274.0993 190000.0 274.1331 5000.0 275.0705 27000.0 275.1074 31000.0 276.0792 8700.0 276.1131 5700.0 277.0869 35000.0 277.1225 310000.0 277.159 3800.0 278.0945 61000.0 279.1018 32000.0 279.524 5300.0 280.0755 5800.0 280.1075 4600.0 280.8148 4900.0 281.0829 2800.0 282.0604 2600.0 282.0893 250000.0 283.0595 3700.0 283.0972 200000.0 288.0787 120000.0 289.0862 170000.0 290.0577 4000.0 290.0943 150000.0 290.1276 2500.0 291.1009 64000.0 292.0724 4900.0 292.11 120000.0 293.0821 36000.0 293.118 230000.0 294.0894 5700.0 294.1232 5000.0 294.6905 2600.0 295.0973 110000.0 295.1333 12000.0 296.1045 11000.0 297.1136 5200.0 302.0951 9600.0 303.0621 12000.0 303.1021 730000.0 304.11 470000.0 305.081 67000.0 305.1179 360000.0 306.0894 18000.0 307.0969 17000.0 308.0735 2500.0 308.105 190000.0 309.113 46000.0 310.1205 8500.0 319.0969 24000.0 320.1049 160000.0 321.1123 27000.0 322.1199 19000.0 323.1284 150000.0 323.1724 4800.0 325.1441 6500.0 333.1139 5200.0 335.1283 240000.0 338.1125 3100.0 353.1364 5400.0 END IONS BEGIN IONS SCANS=553 PEPMASS=393.1314 CHARGE=1 COLLISION_ENERGY=0.0 77.8638 2200.0 87.7853 2800.0 91.1219 2900.0 99.2615 2400.0 138.2042 2800.0 149.0235 2900.0 150.0265 3600.0 157.1986 3100.0 168.1738 2500.0 172.1904 2600.0 173.5205 5100.0 173.5382 29000.0 185.1178 2500.0 243.4988 2300.0 255.129 2700.0 255.5178 2500.0 393.1312 41000.0 END IONS BEGIN IONS SCANS=554 PEPMASS=388.1761 CHARGE=1 COLLISION_ENERGY=0.0 56.0854 2500.0 56.4513 3100.0 59.2955 2400.0 61.4338 3100.0 72.8367 2600.0 75.0439 13000.0 77.0392 13000.0 79.0543 18000.0 91.0541 13000.0 95.0491 16000.0 98.1794 3000.0 104.6613 2500.0 105.0338 4000.0 107.049 6600.0 107.9839 2600.0 117.0698 16000.0 121.0647 340000.0 125.0598 8500.0 126.5632 2700.0 131.0491 51000.0 133.0649 4400.0 135.0127 17000.0 135.021 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217.0862 38000.0 218.0942 38000.0 231.0795 9600.0 231.1023 14000.0 232.0877 4100.0 235.1119 130000.0 245.0959 49000.0 246.1039 22000.0 247.1107 3700.0 249.1124 18000.0 260.083 9000.0 261.0909 14000.0 262.0988 35000.0 263.1066 170000.0 271.0763 3200.0 272.0835 55000.0 273.091 130000.0 274.0989 79000.0 275.1074 10000.0 277.1223 160000.0 278.0945 8100.0 288.0784 52000.0 289.0859 24000.0 290.0939 51000.0 291.1019 52000.0 292.1101 9600.0 293.0841 16000.0 293.1173 430000.0 293.1479 3800.0 302.0931 4100.0 303.1016 1500000.0 304.1096 200000.0 305.0827 9000.0 305.1173 210000.0 306.0901 7800.0 320.1042 79000.0 321.1122 190000.0 323.1247 3100.0 325.1445 11000.0 333.1111 13000.0 335.1276 480000.0 344.0879 2400.0 353.138 76000.0 371.1484 15000.0 END IONS BEGIN IONS SCANS=555 PEPMASS=286.1442 CHARGE=1 COLLISION_ENERGY=0.0 50.2622 4800.0 50.264 21000.0 51.3615 2300.0 55.0178 17000.0 56.2332 2300.0 56.7538 2300.0 65.1188 2600.0 67.0541 6300.0 68.0945 2500.0 69.0697 400000.0 70.065 15000.0 71.6007 2500.0 77.0385 3000.0 82.6384 2600.0 83.0487 2400.0 84.0803 190000.0 84.9852 2100.0 86.0962 190000.0 97.7038 2300.0 98.0961 2800.0 103.0543 7300.0 109.0519 2600.0 110.7901 2500.0 112.0668 4700.0 112.0755 420000.0 114.0915 6000.0 115.0541 570000.0 117.0697 43000.0 117.8797 2800.0 118.9971 2800.0 122.0964 2700.0 127.0544 3300.0 131.0492 13000.0 133.493 2400.0 134.0962 36000.0 135.0439 1700000.0 135.0537 8900.0 135.0681 3800.0 143.049 760000.0 143.0588 3900.0 143.0625 4600.0 145.0647 31000.0 148.4277 3000.0 150.0912 42000.0 151.086 4200.0 151.0991 170000.0 157.0636 3400.0 157.1011 11000.0 159.0439 190000.0 161.0597 41000.0 164.1073 2700.0 171.0441 740000.0 173.0598 410000.0 173.5309 31000.0 173.5378 11000.0 185.0962 42000.0 189.0547 28000.0 201.0106 39000.0 201.0197 19000.0 201.0547 6000000.0 201.0898 38000.0 201.0986 46000.0 201.1104 10000.0 215.1067 28000.0 218.1182 13000.0 224.9335 2600.0 228.8449 2400.0 243.1438 2700.0 258.1489 17000.0 286.1442 260000.0 290.854 2900.0 END IONS BEGIN IONS SCANS=556 PEPMASS=409.1055 CHARGE=1 COLLISION_ENERGY=0.0 64.584 2100.0 72.8689 2300.0 79.6982 2200.0 80.9952 2800.0 81.8253 2800.0 89.8477 2200.0 148.8029 2500.0 173.5245 18000.0 173.5423 11000.0 180.1841 2200.0 187.3542 2200.0 217.5038 2200.0 233.8568 2400.0 237.7936 2400.0 256.8086 2500.0 395.8059 2400.0 END IONS BEGIN IONS SCANS=557 PEPMASS=416.2075 CHARGE=1 COLLISION_ENERGY=0.0 54.2773 2300.0 54.6293 2600.0 56.0621 2300.0 57.0543 2500.0 61.143 3000.0 61.4403 2800.0 61.93 2700.0 64.4444 2500.0 64.9309 2300.0 69.2977 2500.0 70.0885 2600.0 70.3024 2500.0 71.541 2200.0 76.0375 2800.0 78.6129 2800.0 80.2817 2300.0 81.3461 2800.0 82.5479 2200.0 83.9384 2800.0 92.851 2100.0 94.2437 2500.0 96.1386 2400.0 102.6091 2400.0 102.909 2200.0 115.2429 2400.0 120.131 2300.0 142.2036 2300.0 142.3933 2300.0 145.0937 2500.0 149.6682 2900.0 149.6868 10000.0 152.9341 2400.0 166.9559 2300.0 167.1409 2300.0 170.8985 2400.0 173.5305 130000.0 173.5447 8700.0 175.3706 2600.0 194.552 2900.0 198.7619 2300.0 210.9756 2400.0 219.4265 2300.0 225.3857 2700.0 233.811 2900.0 241.7008 2800.0 244.5836 2600.0 245.8505 2400.0 250.1075 2500.0 270.7401 2200.0 289.9318 2400.0 290.4001 2300.0 292.8149 2800.0 306.3849 2600.0 307.2819 28000.0 318.4079 2600.0 335.3113 2300.0 343.0803 2700.0 354.9639 2600.0 376.886 2500.0 426.2382 2700.0 END IONS BEGIN IONS SCANS=558 PEPMASS=383.1495 CHARGE=1 COLLISION_ENERGY=0.0 54.1219 2400.0 55.5171 2300.0 58.9801 2200.0 61.9823 2300.0 68.6298 2400.0 72.4276 2300.0 105.1055 2400.0 115.5259 2400.0 117.5144 2300.0 127.603 2500.0 135.0437 110000.0 147.9807 2400.0 149.0591 3700.0 150.3347 2200.0 157.0633 3800.0 166.0623 16000.0 173.06 8300.0 173.5255 11000.0 173.5411 14000.0 179.6313 2400.0 181.0861 29000.0 185.0596 9200.0 187.0752 12000.0 198.0665 2400.0 199.0766 2900.0 202.0987 39000.0 218.0939 13000.0 219.1022 3200.0 222.4384 2200.0 230.0947 8800.0 231.1015 68000.0 233.1175 9800.0 261.1119 26000.0 269.081 12000.0 275.0705 5500.0 276.0747 2700.0 276.1166 2900.0 277.0867 9200.0 279.1021 3600.0 282.0898 17000.0 289.0865 3300.0 290.0959 3600.0 291.068 3200.0 291.1023 17000.0 292.1099 7200.0 293.0819 8500.0 297.0758 50000.0 303.1024 12000.0 304.1099 17000.0 305.0817 13000.0 306.0887 3300.0 307.0956 13000.0 308.1039 11000.0 308.8999 6400.0 312.0993 47000.0 319.0972 28000.0 320.1079 2800.0 322.1203 47000.0 323.0914 22000.0 325.1074 13000.0 333.1116 10000.0 334.1201 43000.0 335.0919 19000.0 338.1155 43000.0 350.1149 13000.0 360.0298 2800.0 365.1381 7900.0 END IONS BEGIN IONS SCANS=559 PEPMASS=310.108 CHARGE=1 COLLISION_ENERGY=0.0 57.2756 3400.0 57.44 3700.0 60.0415 2100.0 62.2685 13000.0 62.2713 7400.0 69.2663 5200.0 69.2692 11000.0 71.1021 2800.0 72.0445 2500.0 72.7881 2300.0 73.7689 3800.0 73.7731 3700.0 83.5479 2200.0 86.7514 2600.0 88.0378 2600.0 89.3831 2300.0 100.3593 2900.0 117.879 3400.0 125.1674 2200.0 128.4082 2700.0 141.9945 2400.0 142.3226 2400.0 165.0703 4500.0 173.5299 42000.0 181.0645 12000.0 184.3969 2400.0 192.0813 22000.0 193.0892 13000.0 194.0968 11000.0 195.0436 4800.0 195.0807 8700.0 196.075 5200.0 203.0731 21000.0 204.0807 12000.0 207.0688 2700.0 209.0601 16000.0 220.0757 47000.0 221.0835 81000.0 222.0916 74000.0 223.9143 2400.0 224.0708 25000.0 231.0464 2500.0 231.068 230000.0 231.0884 2400.0 232.0758 120000.0 232.6406 3300.0 233.0859 3700.0 235.0629 41000.0 236.0723 4700.0 238.0859 4800.0 239.0942 19000.0 241.0743 9500.0 247.0615 5100.0 248.0471 2300.0 248.0706 230000.0 249.0174 30000.0 249.0299 19000.0 249.0783 6200000.0 249.1268 24000.0 249.1387 47000.0 249.1556 9000.0 249.173 5900.0 249.2703 3300.0 250.0861 320000.0 250.1162 7600.0 252.0355 8100.0 252.0653 240000.0 260.07 4200.0 261.0783 78000.0 263.0575 77000.0 264.0654 16000.0 264.1022 8000.0 265.073 53000.0 266.0809 72000.0 267.0876 52000.0 267.7339 2500.0 268.0584 5100.0 276.0659 42000.0 277.0024 19000.0 277.0165 15000.0 277.0733 3900000.0 277.1301 13000.0 277.1445 18000.0 278.0452 6700.0 278.0813 530000.0 278.1174 8000.0 279.089 150000.0 280.0605 650000.0 280.0883 6800.0 281.0682 54000.0 282.1142 8300.0 294.0761 350000.0 294.1147 7200.0 295.084 1600000.0 295.1242 4400.0 296.0918 48000.0 304.395 2500.0 310.0247 6500.0 310.1074 1800000.0 319.5869 2800.0 END IONS BEGIN IONS SCANS=560 PEPMASS=703.2982 CHARGE=1 COLLISION_ENERGY=0.0 70.0936 2700.0 73.0255 8100.0 73.0287 59000.0 73.1374 7900.0 73.1407 44000.0 73.8513 2200.0 76.1401 5200.0 76.1434 31000.0 78.1409 9300.0 78.1448 69000.0 78.4411 2400.0 80.3706 2500.0 89.543 2600.0 93.6621 2400.0 99.4892 2300.0 104.2512 2500.0 106.4026 2700.0 108.0292 2800.0 111.131 2900.0 116.8486 2500.0 123.114 2300.0 131.1565 2400.0 131.6959 2600.0 137.6426 2700.0 140.2791 2300.0 145.6417 2400.0 153.2855 2600.0 157.2042 2700.0 164.0916 2400.0 167.2474 2600.0 168.8214 2600.0 173.5262 46000.0 173.5378 68000.0 182.4478 2400.0 204.9237 2300.0 210.4547 2600.0 221.0806 12000.0 235.2644 2500.0 236.3644 2700.0 251.3943 2600.0 278.7636 2900.0 285.269 3400.0 293.6342 2400.0 297.7747 2600.0 383.0844 3000.0 460.412 2600.0 469.1494 40000.0 470.1598 3300.0 474.3347 2700.0 482.1632 2500.0 483.1667 51000.0 484.1774 7800.0 496.176 20000.0 497.1822 380000.0 498.1888 55000.0 499.1974 28000.0 510.1811 2900.0 511.1972 16000.0 515.1937 3200.0 524.1678 3800.0 525.2102 22000.0 526.2205 15000.0 528.164 28000.0 529.1719 30000.0 541.1693 6900.0 542.1795 29000.0 543.1863 6000.0 553.2117 2600.0 555.1874 20000.0 556.1956 320000.0 556.294 4000.0 557.2031 250000.0 569.2059 16000.0 570.2065 3200.0 573.2341 57000.0 578.6572 2900.0 584.2287 7300.0 585.2345 48000.0 597.209 11000.0 598.2168 2900.0 599.2479 21000.0 600.2565 30000.0 601.2275 25000.0 611.2137 6900.0 614.202 2800.0 625.2324 15000.0 627.246 31000.0 629.2243 190000.0 630.2323 330000.0 631.2467 7800.0 633.2543 140000.0 642.2362 2400.0 643.2383 14000.0 644.2485 88000.0 657.1599 3700.0 657.2556 1600000.0 657.44 3500.0 658.1334 15000.0 658.2629 1300000.0 658.3563 3300.0 658.3938 3400.0 659.2677 180000.0 674.2558 6300.0 675.2643 3400.0 685.1454 4500.0 685.2867 1100000.0 685.4235 3800.0 703.1885 3200.0 703.2968 1600000.0 END IONS BEGIN IONS SCANS=561 PEPMASS=635.2606 CHARGE=1 COLLISION_ENERGY=0.0 65.0766 2400.0 65.9533 2300.0 70.9297 2800.0 71.8809 2400.0 80.04 2100.0 86.8875 2900.0 86.9451 2500.0 90.5909 2200.0 98.0595 10000.0 105.0413 2700.0 106.2152 2200.0 110.6513 2200.0 116.0435 2300.0 117.665 2200.0 126.4711 2500.0 127.6923 2500.0 137.7499 2600.0 146.0959 2900.0 147.044 2300.0 152.6493 2400.0 156.3824 2600.0 162.0677 11000.0 173.5257 39000.0 173.5363 17000.0 173.5445 15000.0 178.0628 5800.0 189.0545 5400.0 190.0625 56000.0 191.0336 7400.0 191.0695 3400.0 193.0859 51000.0 206.0574 14000.0 221.0809 1600000.0 280.2769 2900.0 290.8369 2500.0 318.134 9200.0 410.0688 2500.0 434.7419 2700.0 491.7952 2500.0 575.233 4600.0 634.4406 2700.0 635.2565 4600.0 641.1904 2400.0 END IONS BEGIN IONS SCANS=562 PEPMASS=338.1027 CHARGE=1 COLLISION_ENERGY=0.0 61.8525 2600.0 73.259 2800.0 77.9252 6200.0 80.5152 3000.0 84.524 15000.0 84.5282 10000.0 100.2834 2900.0 168.0391 2800.0 173.5252 47000.0 173.5355 18000.0 173.5442 25000.0 206.3674 2700.0 209.0602 5400.0 220.0751 6600.0 221.0836 32000.0 222.0914 19000.0 231.068 22000.0 232.0763 8300.0 233.0829 3300.0 235.0643 5700.0 236.0461 4500.0 236.0707 7200.0 237.0561 6200.0 239.0925 7600.0 248.0713 34000.0 249.0542 5800.0 249.0786 410000.0 249.1079 17000.0 250.0862 110000.0 252.0661 23000.0 260.0713 9700.0 261.0782 11000.0 263.0572 24000.0 264.0413 150000.0 264.0666 70000.0 265.0495 320000.0 265.0733 31000.0 266.0815 6500.0 267.0879 11000.0 276.0665 16000.0 277.0737 1700000.0 278.0815 230000.0 279.0894 52000.0 280.0609 280000.0 281.0686 41000.0 282.0521 24000.0 282.1089 6200.0 290.0457 36000.0 291.0528 22000.0 292.0616 4500.0 292.0959 7000.0 293.0682 66000.0 294.0413 4700.0 294.0766 170000.0 295.0461 13000.0 295.0843 430000.0 296.0928 23000.0 304.0607 11000.0 305.0377 27000.0 305.0686 2700000.0 305.1499 4500.0 306.0415 14000.0 306.0766 280000.0 306.1167 7200.0 308.0557 1300000.0 309.062 4100.0 310.1079 270000.0 321.9814 22000.0 322.003 16000.0 322.0384 48000.0 322.0714 4100000.0 322.1595 26000.0 323.0452 21000.0 323.0792 1900000.0 338.0089 20000.0 338.0276 24000.0 338.1025 5400000.0 338.1777 9500.0 338.1985 11000.0 END IONS BEGIN IONS SCANS=563 PEPMASS=360.0845 CHARGE=1 COLLISION_ENERGY=0.0 56.3528 2200.0 56.6625 2400.0 62.2386 5500.0 64.814 2500.0 70.2616 4500.0 97.0332 2500.0 132.669 4900.0 173.5257 41000.0 173.544 13000.0 198.3626 4900.0 208.4004 2400.0 221.7029 2300.0 294.7558 2400.0 299.0537 10000.0 313.1644 2300.0 327.0474 7400.0 344.0525 120000.0 345.061 16000.0 360.0318 12000.0 360.0837 460000.0 360.1357 9600.0 END IONS BEGIN IONS SCANS=564 PEPMASS=370.1413 CHARGE=1 COLLISION_ENERGY=0.0 53.1491 2300.0 53.298 2100.0 55.0177 210000.0 57.535 2100.0 61.9376 2200.0 62.596 2300.0 63.0983 2500.0 65.1053 2100.0 69.0333 41000.0 71.2709 2200.0 76.8046 2100.0 77.0392 4500.0 79.054 14000.0 79.0808 2300.0 80.0981 2500.0 80.2898 2300.0 81.0334 15000.0 82.3847 2100.0 83.3746 2600.0 84.1687 2300.0 90.4809 2200.0 91.0541 26000.0 93.0701 3200.0 94.918 2300.0 95.0489 37000.0 98.2493 2300.0 102.7232 2200.0 103.054 210000.0 104.0624 5000.0 106.0414 3300.0 106.4383 2500.0 107.049 39000.0 109.0648 7400.0 111.0442 3300.0 115.0407 2300.0 115.0541 27000.0 115.3482 2900.0 116.0617 2400.0 117.0696 85000.0 118.9187 2400.0 119.0491 17000.0 120.0566 13000.0 121.0285 12000.0 121.0646 160000.0 122.036 190000.0 123.0437 51000.0 124.0524 3000.0 128.061 3200.0 128.3922 2500.0 129.0701 8800.0 130.0412 20000.0 131.0379 5000.0 131.049 1400000.0 131.0597 11000.0 131.0849 3300.0 132.0566 21000.0 133.0283 14000.0 133.0647 18000.0 135.0318 12000.0 135.0439 1800000.0 135.0552 13000.0 135.0684 3500.0 135.0804 41000.0 136.0509 120000.0 137.0594 69000.0 138.0559 3900.0 138.0673 580000.0 139.0751 110000.0 143.049 53000.0 145.0647 98000.0 146.0362 19000.0 146.0725 200000.0 147.0438 97000.0 147.0803 110000.0 148.0389 4900.0 148.0517 640000.0 149.0106 6900.0 149.0232 1400000.0 149.0348 7300.0 149.0596 120000.0 149.0961 17000.0 150.0307 40000.0 150.0674 180000.0 151.0387 130000.0 151.0531 4800.0 151.0752 1800000.0 151.0874 10000.0 152.0802 98000.0 155.0701 35000.0 156.0569 6300.0 157.0644 24000.0 158.0722 15000.0 159.0439 58000.0 159.0803 27000.0 160.0518 170000.0 160.087 5400.0 161.044 7300.0 161.0596 720000.0 161.0755 6100.0 161.0957 37000.0 162.0674 120000.0 163.0388 16000.0 163.0753 160000.0 164.0474 16000.0 164.0831 410000.0 165.0418 3500.0 165.0546 2700000.0 165.0686 11000.0 165.089 47000.0 166.0602 90000.0 166.0988 260000.0 166.4016 2800.0 167.0701 80000.0 171.0439 18000.0 172.089 7400.0 173.0597 120000.0 173.526 35000.0 173.5345 12000.0 173.5376 70000.0 174.0671 70000.0 175.0386 29000.0 175.0753 140000.0 176.0468 30000.0 176.0831 110000.0 177.0546 120000.0 177.0741 6600.0 177.091 1200000.0 177.1055 4600.0 177.6123 2700.0 178.0625 130000.0 178.0775 2400.0 178.0989 98000.0 179.0704 37000.0 180.078 65000.0 185.0598 24000.0 186.0674 64000.0 187.0387 2700.0 187.0753 100000.0 188.0466 40000.0 188.0835 37000.0 189.0547 120000.0 189.091 190000.0 190.0623 21000.0 191.0702 83000.0 191.1069 62000.0 192.078 170000.0 193.0859 100000.0 194.0937 170000.0 201.0547 230000.0 201.0889 5500.0 202.062 3900.0 202.099 27000.0 203.0702 160000.0 203.1068 140000.0 204.0781 61000.0 205.0859 140000.0 205.105 3200.0 208.0729 2600.0 213.0548 3500.0 217.086 110000.0 219.0653 37000.0 219.1017 98000.0 229.3311 2500.0 238.168 2600.0 241.7249 2800.0 243.2477 2400.0 263.3649 2600.0 267.1014 5400.0 267.678 2300.0 271.0965 340000.0 277.0857 2600.0 279.1011 4400.0 284.105 8700.0 290.0926 2300.0 291.1003 16000.0 293.1184 3100.0 296.1039 4300.0 296.2743 2700.0 297.1107 8300.0 303.1009 34000.0 308.1071 2400.0 309.1124 19000.0 312.063 2800.0 321.1124 93000.0 323.127 3300.0 333.1117 16000.0 337.1077 7700.0 339.1226 110000.0 343.5683 2900.0 348.6028 2500.0 351.1245 6100.0 369.1337 27000.0 376.5862 2400.0 378.6587 2500.0 END IONS BEGIN IONS SCANS=565 PEPMASS=282.0891 CHARGE=1 COLLISION_ENERGY=0.0 48.739 2100.0 53.3678 2400.0 56.3064 2600.0 57.0696 6400.0 58.6529 2500.0 61.2444 2400.0 61.8848 2400.0 62.0698 2300.0 62.6607 2300.0 63.3241 2400.0 64.5198 2600.0 65.0206 2800.0 69.0694 8800.0 72.8265 2300.0 76.617 2300.0 76.7344 2400.0 82.7582 2200.0 96.4754 2100.0 97.101 2600.0 102.3618 2400.0 106.3235 2400.0 108.3247 2300.0 109.3299 2100.0 113.6298 2400.0 113.8236 2300.0 114.9114 2500.0 120.1605 2200.0 121.4822 2800.0 131.9359 2300.0 134.096 88000.0 153.0696 93000.0 153.7134 2500.0 155.0851 3100.0 156.2124 2600.0 156.9629 2500.0 158.8916 2400.0 165.0702 5600.0 169.0647 3100.0 173.5245 26000.0 173.5371 63000.0 175.4448 2300.0 177.1238 2500.0 181.0646 260000.0 183.0808 11000.0 183.9686 2400.0 194.715 2700.0 197.0593 11000.0 203.5061 2600.0 207.8866 19000.0 209.0596 200000.0 210.0667 2400.0 211.0534 13000.0 211.0754 340000.0 211.0983 4000.0 211.135 27000.0 221.0597 120000.0 222.0662 8700.0 223.6247 2500.0 223.6746 2300.0 224.0465 31000.0 225.0544 36000.0 225.5755 2400.0 235.8822 3200.0 237.0546 9000.0 238.0625 140000.0 239.0701 1400000.0 244.9338 2200.0 249.0546 22000.0 267.0318 4600.0 267.0651 590000.0 267.0967 6500.0 273.0173 2500.0 281.3972 3300.0 282.0889 360000.0 282.2219 240000.0 END IONS BEGIN IONS SCANS=566 PEPMASS=393.1315 CHARGE=1 COLLISION_ENERGY=0.0 56.8152 2100.0 58.4466 2200.0 58.9179 2100.0 60.809 2200.0 62.6708 2400.0 62.8105 2300.0 67.3683 2400.0 70.9319 2500.0 73.4612 2300.0 75.3852 2500.0 79.0828 2900.0 80.6817 2200.0 81.0424 2200.0 89.3181 2500.0 118.9813 2300.0 119.4123 2300.0 120.0204 2500.0 125.1802 2900.0 126.7061 2700.0 128.563 2400.0 141.9415 2400.0 149.0231 15000.0 149.4453 2600.0 149.6871 7900.0 149.6957 3900.0 150.0264 12000.0 160.3044 2500.0 173.5295 36000.0 173.5385 18000.0 179.0058 2300.0 183.4441 2700.0 198.5214 2900.0 203.3902 2400.0 212.4758 2600.0 223.6416 2400.0 234.3411 2400.0 241.0804 2600.0 256.8571 2400.0 281.9948 2800.0 309.0718 2200.0 334.9219 2600.0 347.2818 2300.0 END IONS BEGIN IONS 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129.9526 23000.0 130.0775 180000.0 131.0853 44000.0 131.974 49000.0 132.9585 5700.0 133.101 11000.0 135.9451 16000.0 136.9466 3000.0 137.9628 3200.0 139.8985 2400.0 140.0619 71000.0 141.0696 34000.0 143.0491 29000.0 143.0853 14000.0 144.0932 16000.0 145.101 110000.0 146.1093 5300.0 149.684 4500.0 149.6945 5400.0 149.9847 6400.0 155.0499 3700.0 156.057 32000.0 157.0647 810000.0 157.1012 15000.0 158.061 2200.0 158.0725 520000.0 158.0848 3000.0 158.1088 9100.0 159.1167 57000.0 162.6636 2800.0 164.6333 2600.0 171.0435 15000.0 171.1169 5800.0 172.0525 3500.0 173.1327 11000.0 173.5283 32000.0 173.5426 5500.0 185.0599 72000.0 186.0676 140000.0 186.1403 5300.0 188.5989 2400.0 190.7523 2800.0 201.0913 190000.0 201.1105 4100.0 201.1639 12000.0 202.0642 2600.0 END IONS BEGIN IONS SCANS=568 PEPMASS=323.1282 CHARGE=1 COLLISION_ENERGY=0.0 49.9263 2500.0 51.5673 2200.0 52.1535 2300.0 52.3444 2400.0 54.4615 2100.0 57.3441 2200.0 59.9646 2400.0 62.5811 2500.0 72.3462 2300.0 79.0539 11000.0 82.9731 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33000.0 293.1177 33000.0 295.0969 47000.0 297.4461 2600.0 308.1047 97000.0 323.1282 24000.0 END IONS BEGIN IONS SCANS=569 PEPMASS=763.2727 CHARGE=1 COLLISION_ENERGY=0.0 76.5178 2200.0 77.1607 2800.0 83.9841 2400.0 92.4698 2500.0 93.2486 2500.0 94.4176 2500.0 96.0901 2500.0 100.2355 2400.0 100.7883 2500.0 102.0604 2200.0 104.5475 2500.0 122.6984 2900.0 132.293 2300.0 139.7861 2600.0 142.3534 2800.0 144.0563 2600.0 149.6821 3900.0 149.6924 4400.0 160.1606 2400.0 162.434 2500.0 173.522 14000.0 173.5362 78000.0 179.9712 2300.0 201.6233 2300.0 225.9035 2500.0 243.5724 2500.0 249.7516 2400.0 265.2819 2600.0 335.633 2500.0 347.6269 2600.0 358.3917 2400.0 376.5699 2500.0 393.1313 280000.0 427.0495 2600.0 484.4383 2900.0 610.662 2500.0 646.4857 3300.0 763.8313 2600.0 END IONS BEGIN IONS SCANS=570 PEPMASS=233.081 CHARGE=1 COLLISION_ENERGY=0.0 43.0177 8300.0 43.5263 2500.0 45.007 2500.0 45.3783 2100.0 47.6456 2400.0 54.6644 2200.0 55.0179 3100.0 58.4999 2300.0 61.8606 2600.0 66.8112 2100.0 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308.1045 6300000.0 309.1122 1500000.0 310.1196 200000.0 319.0965 870000.0 320.061 79000.0 320.1042 5200000.0 320.1369 19000.0 320.1488 19000.0 320.1687 6700.0 321.1124 39000.0 322.0808 20000.0 322.1201 500000.0 323.0889 100000.0 323.1279 2400000.0 323.1714 32000.0 325.1432 190000.0 332.5588 5100.0 333.1139 12000.0 335.082 72000.0 335.1276 3100000.0 335.1625 7500.0 338.1155 68000.0 353.1378 230000.0 END IONS BEGIN IONS SCANS=575 PEPMASS=741.2908 CHARGE=1 COLLISION_ENERGY=0.0 70.4097 2400.0 71.0489 28000.0 73.5939 2500.0 75.0438 2900.0 77.0389 18000.0 77.1789 3500.0 79.0541 53000.0 80.4544 3800.0 81.0334 100000.0 82.4506 5900.0 86.461 2300.0 86.5831 3000.0 87.3689 3000.0 88.9342 3500.0 89.8824 2400.0 90.062 3100.0 91.0542 32000.0 93.7526 2100.0 95.0493 39000.0 99.1268 2300.0 100.666 3200.0 103.0541 53000.0 105.0335 18000.0 105.0449 8500.0 107.049 42000.0 108.0569 3100.0 109.7213 2700.0 111.0439 9100.0 115.0542 250000.0 117.0697 58000.0 118.2261 3400.0 119.0492 4100.0 121.0646 38000.0 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160000.0 275.0721 13000.0 275.1068 37000.0 276.0788 2900.0 277.0889 31000.0 277.1224 190000.0 278.0588 2400.0 278.094 42000.0 279.1016 7600.0 282.0887 640000.0 283.0967 550000.0 283.1327 13000.0 288.0785 42000.0 289.0861 120000.0 290.094 100000.0 291.102 84000.0 292.1095 220000.0 293.0826 10000.0 293.1175 130000.0 295.0965 210000.0 295.1313 5400.0 296.1057 4000.0 303.1016 220000.0 303.1603 3100.0 304.1095 870000.0 304.1488 6300.0 305.0805 87000.0 305.1175 390000.0 305.1539 4600.0 305.6459 3000.0 308.1045 350000.0 309.112 59000.0 311.1288 3100.0 320.1043 450000.0 320.1447 13000.0 321.1146 4700.0 322.1202 32000.0 323.0871 5900.0 323.1278 510000.0 325.1418 23000.0 335.0817 5600.0 335.1276 700000.0 353.1384 96000.0 438.1565 2700.0 438.7866 3200.0 450.7149 3000.0 510.6321 5200.0 520.7301 3900.0 557.9916 4100.0 575.0297 4700.0 600.834 3600.0 681.1343 3400.0 702.9866 4000.0 END IONS BEGIN IONS SCANS=576 PEPMASS=488.0767 CHARGE=1 COLLISION_ENERGY=0.0 58.0955 2800.0 66.8461 2900.0 71.0566 2300.0 74.116 3100.0 74.5337 2500.0 76.1405 2600.0 83.8405 2200.0 84.1362 2300.0 85.9671 2700.0 96.065 2800.0 99.0572 2600.0 108.8932 2200.0 112.2301 2300.0 122.0362 3100.0 123.3552 2500.0 129.5008 2300.0 131.0488 74000.0 134.7534 2300.0 135.0437 99000.0 136.0504 2500.0 138.0675 20000.0 144.088 2400.0 145.0645 3300.0 148.0516 77000.0 149.023 190000.0 150.067 19000.0 151.0387 3000.0 151.075 86000.0 152.5051 2500.0 160.0518 15000.0 161.0594 110000.0 162.0667 2900.0 164.0831 86000.0 165.0544 180000.0 166.0989 20000.0 167.0687 3000.0 167.1501 2300.0 173.0595 3000.0 173.5249 31000.0 173.5401 52000.0 175.0762 7800.0 176.0829 32000.0 177.0552 13000.0 177.0909 140000.0 178.0623 37000.0 178.0988 6600.0 180.0774 3400.0 183.3623 2600.0 186.9447 2300.0 187.0755 11000.0 187.7981 2400.0 189.055 18000.0 189.0909 20000.0 191.0722 3200.0 191.1073 2400.0 192.0777 30000.0 193.0857 7300.0 193.306 2600.0 194.0937 51000.0 201.0542 3600.0 201.7891 2400.0 203.0709 7400.0 203.1064 34000.0 204.0781 9900.0 205.0857 17000.0 206.8407 2900.0 211.9758 3200.0 217.0867 6800.0 219.0652 20000.0 219.1021 11000.0 224.9574 2700.0 247.748 2500.0 260.2621 2500.0 271.0964 22000.0 279.5744 2700.0 281.9556 2500.0 290.6296 2400.0 310.1191 15000.0 316.1339 3000.0 321.1103 12000.0 333.7725 2700.0 338.1164 5600.0 339.1228 79000.0 340.2108 2900.0 369.1301 7800.0 373.5956 3000.0 387.8727 2500.0 410.1376 2400.0 475.0615 2600.0 END IONS BEGIN IONS SCANS=577 PEPMASS=219.1746 CHARGE=1 COLLISION_ENERGY=0.0 42.9097 2200.0 43.0177 86000.0 43.0541 7400.0 47.6929 2100.0 50.8636 2300.0 53.0385 9900.0 54.6675 2100.0 55.0174 2700.0 55.054 51000.0 57.0333 30000.0 57.0697 18000.0 58.194 2300.0 60.1425 2300.0 61.8255 2500.0 67.0539 49000.0 67.7646 2300.0 68.1278 2400.0 68.1573 2300.0 69.0333 14000.0 69.0696 440000.0 71.0487 150000.0 77.0387 3500.0 77.4452 2300.0 79.0539 71000.0 81.0696 100000.0 83.0488 15000.0 83.0851 20000.0 85.5278 2400.0 89.1706 2100.0 89.7861 2400.0 91.0539 98000.0 93.0695 350000.0 95.0488 22000.0 95.0852 52000.0 97.0643 16000.0 98.1563 2700.0 99.5638 2500.0 99.9779 2300.0 105.0443 2600.0 105.0695 140000.0 106.9663 2200.0 107.0773 3500.0 107.0852 160000.0 109.0645 19000.0 109.1008 54000.0 110.9431 2400.0 111.0798 3700.0 111.2281 2300.0 117.0696 27000.0 119.0852 120000.0 121.0646 15000.0 121.0922 3900.0 121.1009 140000.0 123.0805 6600.0 123.1165 28000.0 129.0696 5400.0 129.2448 2500.0 130.0775 9300.0 131.0853 48000.0 131.6152 2800.0 133.1009 61000.0 133.5393 2600.0 135.0802 13000.0 135.1167 22000.0 137.0591 3800.0 137.0957 3800.0 143.0851 5600.0 144.0922 2700.0 145.0648 9500.0 145.1009 90000.0 147.1172 4200.0 149.0958 42000.0 149.1322 92000.0 151.0748 2800.0 151.4933 2700.0 157.0643 7400.0 157.1011 6000.0 158.0723 19000.0 159.0439 9800.0 159.1166 62000.0 161.1322 77000.0 163.1115 54000.0 173.0596 7400.0 173.1321 6100.0 173.535 35000.0 173.5396 7200.0 174.0674 43000.0 175.1479 10000.0 177.1267 3100.0 181.5489 2500.0 184.1828 2300.0 188.0829 10000.0 189.0908 19000.0 201.0909 12000.0 201.1639 20000.0 203.1426 8100.0 219.1744 34000.0 END IONS BEGIN IONS SCANS=578 PEPMASS=302.1756 CHARGE=1 COLLISION_ENERGY=0.0 50.2052 2400.0 51.0233 11000.0 53.0385 16000.0 53.9806 2100.0 54.9604 2700.0 55.0177 250000.0 55.054 2600.0 56.0494 2200.0 57.0698 1900000.0 57.0727 5700.0 58.0651 6200.0 63.0394 3100.0 65.0386 3800.0 66.0463 81000.0 66.4981 2200.0 66.8852 2200.0 67.0541 300000.0 68.0619 850000.0 68.0656 3600.0 68.0665 6100.0 69.0697 22000.0 71.073 9700.0 71.4679 2400.0 72.0442 110000.0 72.0806 47000.0 74.0963 610000.0 75.5571 2400.0 77.0389 16000.0 79.0541 170000.0 80.3158 2300.0 81.0333 8200.0 81.0697 290000.0 81.6947 2400.0 82.065 5900.0 86.06 19000.0 86.0909 4600.0 86.0962 200000.0 87.1879 2600.0 90.6273 2500.0 94.0412 10000.0 95.049 93000.0 96.0443 63000.0 96.0807 19000.0 98.06 57000.0 99.0382 2400.0 100.0755 50000.0 102.0114 2300.0 102.0913 47000.0 103.0541 62000.0 104.6375 2500.0 104.7578 2400.0 105.0334 15000.0 105.044 2200.0 107.0492 32000.0 109.1901 2300.0 109.9572 2300.0 110.06 28000.0 111.068 29000.0 112.0756 63000.0 113.0837 3700.0 113.3662 2200.0 115.0542 37000.0 117.0697 6200.0 117.2087 2600.0 118.7189 2200.0 119.05 2300.0 123.044 160000.0 124.0755 94000.0 124.9677 2400.0 125.0834 30000.0 126.0912 16000.0 128.0622 63000.0 128.1069 180000.0 129.059 5100.0 129.0698 530000.0 129.0783 3000.0 129.0817 2800.0 131.0383 7200.0 131.049 450000.0 131.0609 2900.0 131.086 3800.0 133.0648 20000.0 133.7113 2400.0 135.0126 5800.0 135.0197 59000.0 135.0439 9900000.0 135.0536 49000.0 135.068 110000.0 135.0774 10000.0 137.0594 3300.0 139.099 14000.0 140.628 2300.0 142.1224 15000.0 143.049 110000.0 143.0855 140000.0 145.0646 65000.0 145.1011 19000.0 147.417 2700.0 147.9938 2500.0 149.0238 3300.0 149.0599 33000.0 152.1069 480000.0 152.1209 5400.0 153.0699 62000.0 154.1226 50000.0 155.0613 6600.0 155.0854 18000.0 157.0647 990000.0 159.044 100000.0 160.0518 38000.0 161.0437 5200.0 161.0597 570000.0 161.0754 3500.0 161.5641 2800.0 166.1227 23000.0 167.1137 5600.0 167.1304 690000.0 167.146 14000.0 169.0654 12000.0 171.0805 520000.0 172.0524 17000.0 173.0598 540000.0 173.0962 66000.0 173.5213 25000.0 173.5366 80000.0 175.0376 3100.0 175.0756 30000.0 180.1384 28000.0 181.0648 150000.0 183.0801 6100.0 184.8903 2600.0 185.045 2200.0 185.0597 360000.0 185.0789 5400.0 187.0362 9300.0 187.0451 6200.0 187.0558 4000.0 187.0754 4100000.0 187.0951 7900.0 187.1147 18000.0 189.091 14000.0 199.0753 240000.0 201.0548 120000.0 201.0911 340000.0 203.1077 9500.0 211.0756 110000.0 217.0857 6500.0 218.1283 2400.0 229.086 560000.0 236.5901 2500.0 272.0899 2500.0 302.1754 180000.0 END IONS BEGIN IONS SCANS=579 PEPMASS=731.2105 CHARGE=1 COLLISION_ENERGY=0.0 71.1596 2600.0 71.5777 2300.0 82.7433 2500.0 83.3424 2300.0 89.3388 2300.0 94.8337 2100.0 101.9433 2300.0 123.9065 2500.0 128.2958 2200.0 131.8024 2400.0 135.0432 4000.0 135.3118 2800.0 140.2057 3000.0 141.1878 2600.0 146.4109 2500.0 150.17 2600.0 151.4544 2400.0 159.2485 2300.0 172.1057 2500.0 173.5238 38000.0 173.5415 36000.0 173.5599 2600.0 174.0391 2300.0 176.9782 2800.0 218.4304 2300.0 253.2195 2500.0 299.2741 2300.0 377.0993 460000.0 377.1511 5200.0 550.9951 2700.0 END IONS BEGIN IONS SCANS=580 PEPMASS=377.1002 CHARGE=1 COLLISION_ENERGY=0.0 52.5857 2400.0 64.8625 2500.0 66.4661 2300.0 82.3327 2300.0 87.276 2500.0 87.7947 2200.0 87.9036 2100.0 93.3525 2200.0 103.843 2300.0 117.0936 2700.0 127.7168 2700.0 137.5672 2900.0 146.149 2400.0 151.7856 2500.0 152.2966 2300.0 161.6613 2400.0 164.1252 2200.0 173.5228 26000.0 173.5335 89000.0 173.5431 17000.0 183.7318 2600.0 216.1148 3000.0 253.4881 3200.0 284.9853 2300.0 314.3392 2300.0 325.7007 2500.0 363.4915 2800.0 377.098 8700.0 END IONS BEGIN IONS SCANS=581 PEPMASS=355.1176 CHARGE=1 COLLISION_ENERGY=0.0 51.0236 16000.0 53.0386 2800.0 54.0134 2200.0 60.5581 2500.0 61.7919 2300.0 63.0238 2900.0 64.812 2500.0 66.5046 2100.0 73.0284 2500.0 73.0986 2200.0 77.0389 51000.0 78.0464 27000.0 79.0495 4800.0 79.054 99000.0 79.9844 2400.0 80.5396 2500.0 91.0542 9100.0 93.8871 2300.0 95.0491 64000.0 95.114 2300.0 97.5404 2400.0 103.0541 260000.0 105.0333 39000.0 105.0446 23000.0 105.4889 2900.0 106.0411 14000.0 107.0491 89000.0 113.9639 3700.0 115.0544 16000.0 117.0691 3200.0 119.0491 58000.0 123.0437 5300.0 129.0699 46000.0 131.0262 6800.0 131.0491 3000000.0 131.0602 31000.0 131.0724 8800.0 131.0854 4000.0 132.0532 41000.0 133.0646 48000.0 134.0365 35000.0 134.999 3800.0 135.0127 11000.0 135.0197 97000.0 135.0249 32000.0 135.044 16000000.0 135.0539 50000.0 135.0634 34000.0 135.0676 200000.0 135.0772 33000.0 135.0815 8200.0 136.0482 300000.0 137.0557 83000.0 142.3143 2700.0 143.0491 33000.0 144.0524 3700.0 145.0648 19000.0 146.0367 8000.0 146.0687 2400.0 147.044 180000.0 148.0518 17000.0 149.0234 87000.0 149.0363 3300.0 149.0596 270000.0 151.0393 2900.0 151.6838 2600.0 157.0648 120000.0 159.0442 68000.0 159.6097 2600.0 160.0518 23000.0 160.3651 2300.0 161.0597 1400000.0 161.0716 3700.0 161.0753 11000.0 162.0655 30000.0 162.1607 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790000.0 289.1169 3400.0 290.8881 6500.0 304.0741 5700.0 307.0943 7500.0 308.9004 74000.0 319.0969 140000.0 330.6013 2600.0 337.1072 34000.0 340.0949 9900.0 355.1179 69000.0 END IONS BEGIN IONS SCANS=582 PEPMASS=337.1076 CHARGE=1 COLLISION_ENERGY=0.0 81.9063 3200.0 88.8872 2200.0 89.9419 2200.0 98.7078 2400.0 103.0539 31000.0 104.4507 2700.0 107.0489 10000.0 110.5061 2800.0 112.4717 2300.0 119.049 4600.0 129.5287 2500.0 131.0488 410000.0 131.0577 4500.0 133.0648 4300.0 135.0437 170000.0 135.0558 3200.0 147.0437 25000.0 149.0591 11000.0 159.0429 3000.0 161.0442 4800.0 161.0594 220000.0 163.0389 19000.0 173.0594 5600.0 173.5252 24000.0 173.5439 11000.0 175.0388 15000.0 176.0466 38000.0 177.0544 28000.0 187.0742 3200.0 189.0547 5500.0 203.0852 19000.0 231.08 46000.0 240.0097 2400.0 249.0897 4000.0 258.4724 2200.0 259.0746 17000.0 261.0903 130000.0 261.8389 2500.0 268.4039 2300.0 268.4379 2700.0 279.1013 3900.0 289.0858 110000.0 293.3932 2500.0 307.0948 3000.0 319.0958 31000.0 337.1069 22000.0 END IONS BEGIN IONS SCANS=583 PEPMASS=237.1851 CHARGE=1 COLLISION_ENERGY=0.0 43.0177 94000.0 51.9399 9800.0 55.0178 2800.0 55.054 43000.0 55.9342 21000.0 56.0494 12000.0 57.0331 2700.0 57.0698 23000.0 59.049 11000.0 59.5154 2200.0 64.0322 2400.0 64.4562 2400.0 67.0539 28000.0 69.0333 8900.0 69.0696 69000.0 71.0488 220000.0 73.8409 2900.0 79.0541 19000.0 81.0696 94000.0 81.5711 2400.0 83.0489 24000.0 83.0853 34000.0 83.2657 2400.0 84.1174 2300.0 85.0644 19000.0 91.0541 13000.0 93.0695 78000.0 95.0491 5400.0 95.0852 120000.0 97.0645 18000.0 97.1007 2600.0 99.0437 41000.0 100.6848 2700.0 101.0595 6600.0 101.7968 2900.0 105.0697 53000.0 107.0852 87000.0 109.0646 25000.0 109.1009 68000.0 111.0801 26000.0 119.0852 77000.0 121.1008 72000.0 123.0801 62000.0 123.1165 44000.0 123.7116 2400.0 126.9721 2700.0 131.0856 2900.0 131.951 2800.0 133.101 29000.0 135.1167 32000.0 135.7165 2700.0 137.0954 12000.0 137.1323 14000.0 141.5834 2400.0 145.101 14000.0 147.7081 2500.0 149.0962 2800.0 149.1322 12000.0 151.1114 240000.0 151.1483 8900.0 159.1167 31000.0 161.1323 78000.0 163.1094 2600.0 163.3782 2400.0 167.1429 49000.0 169.9336 6200.0 173.5232 20000.0 173.5411 24000.0 175.1501 2600.0 179.1429 300000.0 183.912 5400.0 185.9288 2400.0 194.3974 3100.0 201.1642 2900.0 217.6479 2400.0 239.4211 3100.0 242.5972 2300.0 END IONS BEGIN IONS SCANS=584 PEPMASS=354.1099 CHARGE=1 COLLISION_ENERGY=0.0 77.0388 4100.0 78.0414 5400.0 78.0463 100000.0 78.0509 2100.0 78.3582 2500.0 79.0541 12000.0 91.0541 3000.0 95.049 8300.0 103.0541 42000.0 104.0619 28000.0 105.0334 5700.0 106.0335 4800.0 106.0412 79000.0 107.0493 4700.0 115.0542 14000.0 117.0696 16000.0 119.0489 12000.0 122.0361 10000.0 124.0517 27000.0 130.0412 16000.0 131.049 280000.0 131.0578 4800.0 132.0467 3600.0 132.0567 46000.0 132.708 2800.0 133.0648 3900.0 135.0196 15000.0 135.0439 2400000.0 135.0632 18000.0 135.068 19000.0 135.0748 7100.0 136.0517 600000.0 137.0598 3200.0 143.0489 47000.0 144.057 6900.0 145.0648 11000.0 146.037 2500.0 147.0442 9600.0 148.0517 74000.0 149.0595 38000.0 151.039 5600.0 157.0647 7300.0 159.0439 8300.0 160.0192 2300.0 160.0517 110000.0 161.0441 4100.0 161.0595 120000.0 161.1881 2400.0 162.0674 150000.0 162.083 4500.0 163.0382 2800.0 171.0446 5000.0 172.052 7100.0 173.0596 510000.0 173.5203 5800.0 173.5383 12000.0 174.0671 12000.0 175.0387 13000.0 176.0458 2500.0 177.0541 7300.0 186.0673 15000.0 187.0753 59000.0 187.9504 2700.0 188.0464 8200.0 188.083 3700.0 189.0545 20000.0 191.0339 9600.0 191.0699 7800.0 192.0415 99000.0 201.0544 34000.0 205.0494 20000.0 206.0571 26000.0 218.0573 110000.0 219.0651 25000.0 232.0719 7300.0 252.0783 3700.0 253.0806 4500.0 281.0803 3400.0 283.0922 6500.0 305.1115 3700.0 326.0882 2800.0 END IONS BEGIN IONS SCANS=585 PEPMASS=337.1075 CHARGE=1 COLLISION_ENERGY=0.0 50.016 2200.0 51.0232 6100.0 51.8158 2300.0 52.513 2200.0 53.0386 11000.0 53.6885 2200.0 54.4409 2300.0 55.0178 22000.0 60.3941 2400.0 62.4067 2200.0 63.2798 2100.0 65.0384 9700.0 65.2743 2200.0 67.829 2600.0 67.8582 2500.0 69.4373 2100.0 71.049 360000.0 73.4173 2500.0 77.0387 20000.0 79.0541 100000.0 79.0901 2200.0 84.1155 3200.0 84.9319 2400.0 88.5783 2500.0 91.0542 43000.0 93.0334 12000.0 93.1611 2600.0 93.6506 2600.0 95.049 41000.0 95.4043 2300.0 100.536 2500.0 102.3665 2200.0 103.0541 160000.0 105.0334 26000.0 105.0445 9500.0 107.0491 76000.0 111.0439 52000.0 112.1137 2300.0 115.0542 47000.0 116.9828 2300.0 117.0698 34000.0 119.049 88000.0 123.0439 60000.0 124.4799 2400.0 125.6146 2600.0 127.0553 6200.0 128.0622 18000.0 129.0698 520000.0 131.0261 3100.0 131.0491 2100000.0 131.0668 5700.0 131.0724 8800.0 131.0854 24000.0 132.0574 2900.0 133.0283 160000.0 133.0646 29000.0 134.4385 2700.0 135.0316 3100.0 135.044 5900000.0 135.0559 3000.0 135.068 25000.0 137.0595 12000.0 139.0547 11000.0 143.0491 86000.0 145.0647 57000.0 146.0362 7400.0 147.044 300000.0 149.0233 110000.0 149.0327 2200.0 149.0459 6500.0 149.0596 460000.0 149.0699 2100.0 149.2235 2200.0 151.0389 95000.0 153.0697 33000.0 153.633 2800.0 155.0486 7400.0 155.084 2700.0 155.1261 2400.0 157.0526 2600.0 157.0648 620000.0 157.0762 2300.0 159.044 110000.0 159.0806 2500.0 160.4658 2400.0 161.0438 4600.0 161.0596 1200000.0 163.039 220000.0 165.0549 25000.0 165.0706 2500.0 167.0494 40000.0 172.0521 38000.0 173.0598 710000.0 173.0768 4300.0 173.5274 70000.0 173.5388 31000.0 173.5431 5400.0 174.0677 82000.0 175.039 270000.0 175.0756 89000.0 176.0469 190000.0 176.0647 4100.0 177.0548 290000.0 178.0818 2700.0 181.065 45000.0 182.87 2800.0 185.0398 5500.0 185.0598 2200000.0 185.079 5000.0 185.0987 3600.0 187.0575 8900.0 187.0755 710000.0 187.095 12000.0 189.0545 94000.0 189.071 4000.0 190.0782 16000.0 191.0856 75000.0 191.1458 2600.0 192.9121 2300.0 193.1013 27000.0 196.0269 2400.0 197.0597 380000.0 201.054 20000.0 201.0736 2800.0 202.0789 56000.0 203.0664 3200.0 203.0856 980000.0 203.1061 6800.0 205.0653 35000.0 205.1012 61000.0 206.0729 3200.0 206.8045 2600.0 207.0815 8200.0 209.0598 780000.0 210.0674 6200.0 211.0757 65000.0 211.3966 2400.0 213.0714 13000.0 215.0465 16000.0 215.0704 700000.0 215.0918 9800.0 217.0641 2700.0 218.0726 45000.0 219.056 3400.0 219.0806 470000.0 221.0599 6100.0 221.0963 130000.0 222.0685 18000.0 223.0756 47000.0 225.0548 77000.0 231.0537 9300.0 231.0805 1900000.0 231.1076 12000.0 231.2829 2600.0 232.8688 11000.0 233.06 50000.0 233.0962 130000.0 233.6464 2600.0 234.068 17000.0 235.0754 200000.0 237.0258 4100.0 237.0547 930000.0 237.095 6300.0 238.0625 17000.0 239.0705 70000.0 241.065 24000.0 242.0736 3300.0 243.0803 36000.0 246.0676 280000.0 247.0754 370000.0 247.1035 9500.0 248.0829 31000.0 248.3305 2700.0 249.0603 16000.0 249.0911 830000.0 249.1206 11000.0 250.6301 2600.0 251.07 47000.0 251.1064 68000.0 253.0498 30000.0 258.0674 2500.0 259.0753 650000.0 259.1065 8900.0 260.0836 32000.0 261.0611 20000.0 261.0908 2900000.0 261.1239 11000.0 262.0624 220000.0 262.0939 2400.0 263.0703 160000.0 263.1062 96000.0 264.079 13000.0 265.0508 3700.0 265.0847 13000.0 266.0234 16000.0 266.0574 1900000.0 266.0899 5800.0 267.0651 1600000.0 267.0986 5500.0 271.0755 100000.0 272.0832 15000.0 273.0909 50000.0 274.0625 390000.0 275.0017 3000.0 275.0704 33000.0 276.0782 75000.0 277.0861 970000.0 279.0282 3200.0 279.0655 770000.0 279.1006 120000.0 280.0735 55000.0 280.4632 2300.0 281.0804 30000.0 288.0774 24000.0 289.047 5100.0 289.0574 11000.0 289.0861 3300000.0 290.0577 110000.0 290.0928 12000.0 291.0654 120000.0 291.1016 32000.0 292.0733 110000.0 293.081 190000.0 294.0899 8800.0 295.0654 2900.0 299.1973 2500.0 303.0654 160000.0 304.0732 450000.0 305.0793 2700.0 306.0887 40000.0 307.0968 120000.0 309.1118 19000.0 317.079 4000.0 319.0966 450000.0 322.0477 6600.0 337.0669 3500.0 337.1072 130000.0 341.9952 2600.0 END IONS BEGIN IONS SCANS=586 PEPMASS=319.097 CHARGE=1 COLLISION_ENERGY=0.0 51.5691 2300.0 62.9157 2100.0 64.187 2200.0 66.7276 2400.0 74.7658 2700.0 83.0697 2200.0 103.1584 2600.0 108.2978 2600.0 109.3777 2700.0 135.0439 13000.0 147.0441 3700.0 150.2462 2300.0 163.0708 3700.0 173.5265 15000.0 173.5414 7500.0 179.0661 3000.0 190.0615 19000.0 191.0333 2400.0 191.0658 37000.0 192.0374 5700.0 192.0751 3300.0 193.0856 14000.0 194.0891 25000.0 202.079 3900.0 203.0853 69000.0 205.1008 10000.0 206.0574 5500.0 207.0609 12000.0 215.0858 6400.0 218.0727 4300.0 219.0799 2800.0 221.0808 41000.0 222.0842 89000.0 225.9976 2600.0 231.0804 140000.0 233.0962 19000.0 235.0752 24000.0 241.519 2600.0 245.4857 2400.0 246.0672 25000.0 247.076 3700.0 248.0839 3700.0 259.0752 36000.0 261.0583 5200.0 261.0907 160000.0 261.2159 2300.0 263.0744 5100.0 263.1064 32000.0 271.0765 4400.0 273.0906 11000.0 274.0623 32000.0 276.0784 2700.0 284.4814 2600.0 289.0861 140000.0 289.1219 3100.0 290.0577 25000.0 291.0651 26000.0 291.1008 11000.0 293.8459 2300.0 303.0651 25000.0 304.0731 33000.0 319.0965 45000.0 319.1336 2500.0 END IONS BEGIN IONS SCANS=587 PEPMASS=353.1023 CHARGE=1 COLLISION_ENERGY=0.0 54.9983 2100.0 56.7325 2300.0 67.5334 2100.0 77.0385 2300.0 79.0538 2400.0 86.3703 2800.0 96.5419 2400.0 117.0695 3700.0 117.8545 2500.0 135.0437 920000.0 135.0527 15000.0 136.0527 3100.0 139.0018 2600.0 143.0489 22000.0 149.023 100000.0 149.0367 2700.0 149.6855 4700.0 149.6955 3800.0 151.0748 18000.0 157.0645 2900.0 173.0596 41000.0 173.5251 4600.0 173.5376 4600.0 177.0932 2400.0 187.0751 3900.0 188.0829 11000.0 189.0917 2600.0 201.055 16000.0 201.0909 32000.0 203.0706 15000.0 203.1064 11000.0 231.102 9700.0 246.1037 3000.0 252.0777 21000.0 260.9713 2400.0 267.0654 8700.0 268.0728 18000.0 273.0902 3200.0 274.0989 4500.0 277.1218 9100.0 282.089 29000.0 283.0968 9800.0 289.086 9500.0 290.094 8000.0 292.1097 7800.0 293.1168 4800.0 295.0959 6500.0 303.1031 5700.0 304.1098 21000.0 305.0804 8200.0 305.1161 10000.0 308.1046 14000.0 320.1045 6900.0 323.0904 13000.0 353.102 3300.0 END IONS BEGIN IONS SCANS=588 PEPMASS=257.115 CHARGE=1 COLLISION_ENERGY=0.0 45.9153 2100.0 45.9683 2300.0 47.4723 2400.0 47.8131 2600.0 48.154 2300.0 49.3306 2400.0 49.4842 2100.0 50.3143 2200.0 50.3232 2200.0 50.6167 2400.0 51.088 2300.0 51.2938 2200.0 52.5852 2100.0 52.8698 2300.0 54.3412 2300.0 55.1663 2300.0 56.0876 2500.0 56.1703 2100.0 56.3955 2500.0 59.2415 2800.0 59.8707 2100.0 60.4795 2400.0 60.7311 2600.0 60.8334 2300.0 61.4622 2300.0 61.6807 2300.0 63.2371 2100.0 65.9281 2700.0 66.1473 2200.0 66.7638 2200.0 67.7939 2500.0 69.4894 2700.0 69.8553 2700.0 71.7129 2000.0 73.028 8500.0 73.1078 2200.0 73.7255 2300.0 73.8392 2300.0 76.5023 2200.0 76.9608 2600.0 77.4736 2200.0 77.5565 2200.0 80.9225 2400.0 82.0742 2800.0 82.7852 2500.0 83.0509 2200.0 83.8404 2400.0 92.5441 2600.0 93.1947 2300.0 93.8061 2700.0 95.3515 2400.0 96.2966 2200.0 103.0471 2400.0 103.4939 2800.0 104.2158 2500.0 106.7067 2300.0 109.1022 2300.0 110.2026 2600.0 110.5622 2500.0 115.6469 2400.0 119.2913 2400.0 127.4047 3100.0 130.8733 2200.0 132.2076 2300.0 135.1766 2900.0 146.9007 2700.0 147.6447 2700.0 149.9291 2800.0 151.6771 2200.0 152.671 2200.0 153.6455 2200.0 159.9459 2700.0 166.0191 2300.0 169.4611 2300.0 171.0858 2500.0 171.8957 2400.0 173.5287 150000.0 173.5429 26000.0 181.3611 2400.0 189.3435 2400.0 193.483 2400.0 204.2329 2700.0 205.8809 11000.0 207.2336 2300.0 209.86 2600.0 211.1134 2600.0 214.9753 2800.0 215.0393 2300.0 221.4903 2300.0 222.4696 2700.0 230.2893 2500.0 230.9701 2500.0 239.1054 6200.0 242.2967 2200.0 256.6807 2100.0 257.1149 24000.0 257.1513 11000.0 257.2652 4000.0 END IONS BEGIN IONS SCANS=589 PEPMASS=235.1332 CHARGE=1 COLLISION_ENERGY=0.0 43.0177 130000.0 44.4674 2800.0 46.3614 2600.0 48.042 2200.0 49.3735 2800.0 55.0176 4200.0 55.054 57000.0 55.4507 2500.0 56.485 2500.0 57.0332 8500.0 57.0698 4100000.0 57.073 14000.0 57.0746 7800.0 57.0764 6700.0 59.049 2900.0 59.263 2500.0 60.2128 2500.0 60.4482 2200.0 60.6886 2200.0 60.8507 2400.0 64.0436 2100.0 65.8443 2300.0 67.0541 4300.0 67.3144 2500.0 67.5494 2400.0 69.0333 2800.0 69.0695 7400.0 73.0281 89000.0 74.0315 16000.0 77.3142 2500.0 79.0538 29000.0 80.5041 2700.0 80.9819 2500.0 81.0696 12000.0 82.681 2200.0 83.0487 22000.0 84.4789 2100.0 86.019 2300.0 87.4038 2300.0 91.054 24000.0 91.5623 2200.0 93.0697 49000.0 94.5798 2300.0 94.795 2100.0 95.0489 15000.0 95.0855 17000.0 96.0532 2700.0 97.0648 2900.0 99.0434 2500.0 99.7592 2300.0 103.1818 2300.0 103.9727 2300.0 105.0697 58000.0 105.5589 2200.0 105.6996 2200.0 106.5182 2900.0 107.0488 22000.0 107.0854 23000.0 107.3237 2300.0 108.7492 2700.0 109.0647 13000.0 109.8068 2400.0 111.0799 31000.0 113.4778 2300.0 114.1008 2200.0 118.6914 2600.0 119.0851 51000.0 119.3531 2100.0 121.0645 32000.0 121.1009 34000.0 123.0437 240000.0 123.0803 20000.0 124.6695 2200.0 125.0052 2600.0 130.2565 2400.0 131.0856 2500.0 131.2183 2500.0 133.0646 61000.0 133.1009 15000.0 135.4389 2500.0 135.8453 2500.0 137.0598 9500.0 137.0958 17000.0 139.0447 2200.0 141.0542 2800.0 145.0643 2600.0 145.1011 2700.0 145.5687 2400.0 147.0803 66000.0 149.0961 31000.0 149.1313 2300.0 150.2971 2700.0 151.0752 310000.0 152.0789 16000.0 153.0802 22000.0 153.4896 2600.0 154.8222 2700.0 159.08 14000.0 159.5337 2200.0 161.0361 2800.0 161.0456 4100.0 161.0595 480000.0 161.096 23000.0 161.1327 15000.0 162.0674 180000.0 163.0754 6400.0 165.0908 31000.0 165.8491 2400.0 166.6477 2500.0 169.7906 2400.0 171.1164 4900.0 173.0958 6800.0 173.5267 54000.0 173.5375 88000.0 174.104 27000.0 175.0754 120000.0 175.1119 49000.0 176.6663 2200.0 177.0924 3100.0 179.0702 580000.0 179.1069 48000.0 179.1427 3600.0 180.0779 110000.0 181.0251 2500.0 189.0917 9200.0 189.1273 120000.0 189.7831 2300.0 193.0857 24000.0 193.1212 5600.0 199.1131 3000.0 202.0987 30000.0 207.137 8200.0 208.2127 2100.0 215.3935 2700.0 217.1224 38000.0 218.0522 2300.0 235.133 22000.0 235.1693 24000.0 235.2053 7200.0 235.6279 2300.0 236.5941 2300.0 238.701 2700.0 242.5287 2500.0 243.3119 2500.0 END IONS BEGIN IONS SCANS=590 PEPMASS=353.2689 CHARGE=1 COLLISION_ENERGY=0.0 51.158 2500.0 53.9382 2000.0 55.0179 2000.0 55.054 47000.0 57.0332 36000.0 57.0697 24000.0 65.0383 2900.0 67.0539 340000.0 69.0696 64000.0 71.0489 11000.0 71.0854 8400.0 75.0436 3000.0 77.3159 2200.0 79.0539 140000.0 80.2231 2400.0 80.2588 2200.0 81.0696 460000.0 81.0777 3300.0 83.0488 5900.0 83.0851 48000.0 85.0645 15000.0 91.054 60000.0 91.9528 2100.0 93.0695 240000.0 93.0766 3700.0 95.0493 2500.0 95.0852 390000.0 97.0644 17000.0 97.1011 15000.0 99.0801 5600.0 105.0695 61000.0 107.0773 4500.0 107.0852 200000.0 109.0646 9800.0 109.0928 4200.0 109.1008 230000.0 110.0984 2500.0 111.0801 11000.0 114.0799 2200.0 117.0694 35000.0 118.2054 2300.0 119.0852 70000.0 121.1008 200000.0 123.0801 3300.0 123.1165 110000.0 126.1464 2800.0 131.0852 96000.0 132.7263 2400.0 133.0921 2800.0 133.1009 75000.0 135.0437 54000.0 135.0797 2300.0 135.1165 170000.0 137.096 5300.0 137.1322 27000.0 139.112 3900.0 144.6595 2800.0 145.101 73000.0 147.1165 69000.0 149.1322 110000.0 151.0751 16000.0 151.1108 3200.0 151.1481 4600.0 157.0638 2600.0 159.1166 72000.0 161.1321 53000.0 163.148 57000.0 173.0598 3000.0 173.1325 74000.0 173.5221 15000.0 173.5354 48000.0 175.148 15000.0 177.1275 2700.0 177.1639 17000.0 184.2542 2600.0 187.1479 42000.0 189.162 2500.0 199.0761 2900.0 201.0911 25000.0 201.1636 10000.0 205.1574 2500.0 210.7473 2500.0 224.7777 2400.0 231.0985 3800.0 233.2267 10000.0 243.2104 43000.0 246.1033 2700.0 252.0785 18000.0 253.1242 2900.0 261.2211 120000.0 267.0651 7400.0 268.073 12000.0 277.1227 2900.0 282.0893 17000.0 283.0955 4300.0 289.0867 6600.0 295.0956 10000.0 304.1092 17000.0 305.1168 3400.0 320.1027 5800.0 335.2583 2600.0 END IONS BEGIN IONS SCANS=591 PEPMASS=694.4012 CHARGE=1 COLLISION_ENERGY=0.0 67.05 3800.0 67.0541 240000.0 67.3027 2100.0 69.0334 11000.0 69.0697 43000.0 71.049 15000.0 71.0855 7600.0 73.0282 44000.0 75.044 7300.0 79.0493 4800.0 79.0541 110000.0 81.0333 3800.0 81.0697 440000.0 83.0242 2400.0 83.0491 7100.0 83.0853 56000.0 85.0224 4200.0 85.0282 250000.0 85.0646 20000.0 90.1923 2300.0 91.0324 5000.0 91.0388 220000.0 91.0541 67000.0 93.0695 200000.0 95.0493 4100.0 95.0784 5900.0 95.0854 440000.0 95.0927 3100.0 97.0283 130000.0 97.0647 24000.0 97.101 38000.0 98.9332 2300.0 99.0438 14000.0 99.0802 27000.0 105.0697 76000.0 107.0772 9300.0 107.0853 210000.0 109.0644 6200.0 109.101 320000.0 111.0802 17000.0 111.1165 9000.0 112.5765 2400.0 113.096 8600.0 115.0387 9500.0 117.0697 44000.0 118.7127 2800.0 119.0854 110000.0 121.0911 4200.0 121.101 320000.0 123.0802 15000.0 123.1167 200000.0 125.0958 21000.0 127.0388 88000.0 131.0854 120000.0 133.101 140000.0 135.1064 6700.0 135.1167 340000.0 137.0962 23000.0 137.1323 81000.0 139.1117 19000.0 145.0494 100000.0 145.1011 140000.0 147.1167 150000.0 149.0959 7800.0 149.1324 290000.0 149.1464 7200.0 151.1117 20000.0 151.1479 25000.0 153.1274 18000.0 159.1167 160000.0 159.1317 3900.0 161.1325 160000.0 163.0601 34000.0 163.1121 14000.0 163.1326 4400.0 163.1481 190000.0 165.1275 30000.0 165.1635 3000.0 167.1429 3600.0 173.1326 220000.0 173.5307 47000.0 173.5441 5100.0 175.1482 51000.0 177.1277 19000.0 177.164 76000.0 179.1433 30000.0 187.1482 150000.0 189.1635 8600.0 191.1431 18000.0 193.1578 3500.0 195.1369 6800.0 201.1639 51000.0 203.1794 5600.0 205.1587 19000.0 215.1802 17000.0 217.1967 3800.0 219.1746 18000.0 223.1687 2800.0 233.2266 52000.0 237.1854 2600.0 243.2108 320000.0 261.1557 3400.0 261.2212 1000000.0 261.2545 4100.0 271.8958 2400.0 272.2688 2400.0 279.2325 54000.0 283.8885 2300.0 317.2473 5100.0 335.2585 220000.0 335.303 4500.0 353.2689 47000.0 387.5933 2300.0 388.4316 2600.0 392.8884 2400.0 593.2225 2800.0 598.2143 2500.0 END IONS BEGIN IONS SCANS=592 PEPMASS=314.1757 CHARGE=1 COLLISION_ENERGY=0.0 55.0177 170000.0 56.0494 9800.0 61.9011 5300.0 67.0542 8200.0 69.0697 320000.0 69.074 8300.0 70.065 7300.0 79.0539 7700.0 84.0806 580000.0 84.0863 9100.0 84.0893 6900.0 86.0895 20000.0 86.0962 3900000.0 86.1022 71000.0 86.1055 61000.0 86.1083 40000.0 86.112 19000.0 98.0962 13000.0 103.054 16000.0 112.0755 650000.0 112.0834 7600.0 115.0545 19000.0 127.0558 8000.0 128.0624 41000.0 128.1069 13000.0 129.0698 600000.0 131.0491 91000.0 131.0858 9800.0 135.044 660000.0 135.054 11000.0 140.0947 13000.0 140.1069 340000.0 140.1171 5000.0 143.0491 40000.0 143.0854 25000.0 145.0649 17000.0 153.0699 23000.0 153.9727 5500.0 154.1225 51000.0 155.0867 7100.0 157.0647 1200000.0 157.0765 18000.0 159.044 61000.0 160.052 21000.0 161.0597 92000.0 163.1967 5600.0 166.3805 5700.0 169.0652 11000.0 171.0806 240000.0 171.094 4100.0 172.0517 14000.0 173.0599 460000.0 173.529 33000.0 175.0757 16000.0 181.0648 59000.0 183.0805 17000.0 185.0599 340000.0 185.0753 4000.0 186.0692 6000.0 187.0245 12000.0 187.0358 39000.0 187.0755 6000000.0 187.1068 47000.0 187.1148 48000.0 187.126 17000.0 199.0756 190000.0 201.0551 130000.0 201.0913 280000.0 201.1131 11000.0 211.0757 90000.0 213.0917 23000.0 229.0863 850000.0 314.1757 41000.0 END IONS BEGIN IONS SCANS=593 PEPMASS=599.4105 CHARGE=1 COLLISION_ENERGY=0.0 63.2712 2200.0 64.7301 2400.0 66.3469 2500.0 67.054 45000.0 67.8198 2400.0 67.9744 2600.0 69.0333 38000.0 69.0695 42000.0 69.9296 2200.0 79.054 41000.0 79.1254 2000.0 81.0695 120000.0 83.0488 64000.0 83.0852 45000.0 83.9115 2200.0 85.0645 34000.0 85.9933 2700.0 86.7337 2700.0 91.0539 41000.0 91.2999 2500.0 93.0695 170000.0 95.0488 88000.0 95.0852 110000.0 97.0645 45000.0 97.4588 2600.0 102.7623 2300.0 103.4045 2600.0 103.6697 2700.0 104.7556 2200.0 105.0695 140000.0 105.2872 2500.0 107.0852 260000.0 108.7143 2200.0 109.0645 57000.0 109.1009 110000.0 111.0802 21000.0 111.1168 2600.0 113.0957 12000.0 114.0863 2300.0 117.0697 8300.0 118.9788 2400.0 119.0851 230000.0 120.2731 2700.0 121.0644 39000.0 121.0919 11000.0 121.1008 350000.0 123.0801 98000.0 123.1165 40000.0 125.0595 30000.0 125.0958 80000.0 128.4469 2200.0 129.0694 6500.0 131.0852 110000.0 133.0646 21000.0 133.0916 2500.0 133.1008 180000.0 135.0801 110000.0 135.1165 90000.0 137.0595 6700.0 137.0959 73000.0 137.1652 2600.0 139.0751 38000.0 139.0876 2800.0 139.1116 14000.0 141.0705 4300.0 141.1935 2200.0 143.0852 180000.0 144.0931 70000.0 145.1009 220000.0 147.0801 130000.0 147.1164 81000.0 149.0957 100000.0 149.132 11000.0 151.0751 170000.0 151.1116 10000.0 153.0908 34000.0 155.0849 29000.0 155.1062 3300.0 155.1712 2400.0 156.0932 21000.0 157.0865 3000.0 157.1008 240000.0 158.1091 11000.0 159.0803 64000.0 159.1166 160000.0 160.0887 2500.0 161.0959 110000.0 161.1323 70000.0 163.1114 96000.0 165.0755 3900.0 165.0908 420000.0 167.0892 3500.0 167.1065 150000.0 168.0938 5600.0 169.1012 110000.0 170.1083 12000.0 171.0809 2500.0 171.1167 190000.0 172.1251 7700.0 173.0961 53000.0 173.1323 120000.0 173.5217 14000.0 173.5358 140000.0 173.5448 5400.0 175.1117 70000.0 175.127 2400.0 175.1482 35000.0 177.0907 38000.0 177.1275 29000.0 179.1058 16000.0 179.1427 2600.0 180.093 4000.0 181.101 44000.0 181.1217 30000.0 182.1086 9400.0 183.1167 150000.0 184.1247 13000.0 185.0961 14000.0 185.1325 99000.0 187.1118 55000.0 187.1482 45000.0 189.1272 100000.0 190.1353 18000.0 191.1068 17000.0 191.1433 42000.0 193.1013 31000.0 193.1214 17000.0 194.1096 8200.0 195.1169 93000.0 195.1361 18000.0 196.1246 7000.0 197.1151 4400.0 197.1324 150000.0 198.1039 3000.0 198.1405 3500.0 199.1117 56000.0 199.1481 63000.0 201.1272 42000.0 201.163 11000.0 203.1072 3200.0 203.143 190000.0 205.1215 5700.0 206.1099 5700.0 207.1166 77000.0 207.1381 130000.0 208.1248 22000.0 208.1461 15000.0 209.0967 2700.0 209.1324 120000.0 209.1532 21000.0 210.1403 4100.0 211.1117 36000.0 211.1481 70000.0 213.1276 43000.0 213.1633 18000.0 215.1065 6500.0 215.1429 45000.0 217.1226 9200.0 217.1575 15000.0 219.1173 7600.0 219.1393 6600.0 220.1244 14000.0 221.1322 71000.0 221.1537 320000.0 222.1402 7000.0 223.1117 9200.0 223.1482 94000.0 225.1276 53000.0 225.1639 54000.0 226.7487 2700.0 227.143 36000.0 227.1801 14000.0 229.1223 22000.0 229.1586 11000.0 231.1394 6900.0 233.1324 37000.0 233.1537 420000.0 235.1481 61000.0 236.1544 2900.0 237.1251 7200.0 237.1475 7700.0 237.167 14000.0 239.1427 19000.0 239.1791 12000.0 241.1582 24000.0 243.138 8000.0 243.1749 3100.0 245.1306 10000.0 245.1559 2600.0 246.1413 6800.0 247.1471 37000.0 247.1714 21000.0 248.1553 8300.0 249.1296 3100.0 249.1637 41000.0 251.1437 20000.0 251.1792 38000.0 253.1594 15000.0 253.1919 3200.0 255.1752 5000.0 257.19 5800.0 259.1456 19000.0 259.172 8800.0 260.1558 5300.0 260.578 2300.0 260.9742 3100.0 261.1624 24000.0 262.7311 2300.0 263.1465 2700.0 263.1794 44000.0 265.1591 19000.0 265.1937 2800.0 267.1738 21000.0 269.1577 6400.0 269.1899 37000.0 271.1714 7900.0 273.1607 9400.0 273.1873 14000.0 274.1942 16000.0 275.1789 13000.0 277.1584 3600.0 277.1941 2900.0 279.1745 3700.0 281.1903 86000.0 283.1675 3000.0 285.1857 35000.0 286.1934 60000.0 287.2017 37000.0 289.1948 25000.0 291.1745 20000.0 291.212 6900.0 293.1907 14000.0 295.2065 17000.0 297.1877 3300.0 299.201 45000.0 307.2069 6300.0 309.2219 12000.0 311.2014 17000.0 312.2085 45000.0 313.2181 4300.0 317.1859 2900.0 325.2168 3400.0 331.2063 6400.0 333.2221 10000.0 337.215 3200.0 349.2162 19000.0 351.2337 7400.0 352.2404 14000.0 359.2361 3800.0 364.2405 36000.0 365.2481 8600.0 373.2505 7800.0 376.0547 2400.0 377.2464 12000.0 378.2538 3000.0 391.2675 3800.0 402.1107 3000.0 449.3085 6400.0 453.8662 2400.0 471.3291 6500.0 489.3352 15000.0 507.3471 140000.0 509.1846 2900.0 556.4135 2500.0 564.5301 2600.0 581.3879 2600.0 599.4104 53000.0 END IONS BEGIN IONS SCANS=594 PEPMASS=518.3245 CHARGE=1 COLLISION_ENERGY=0.0 60.0804 72000.0 61.9199 2200.0 63.4553 2300.0 64.2335 2800.0 71.0726 6100.0 72.6523 2400.0 76.7497 2200.0 76.7766 2600.0 82.3125 2500.0 82.8902 2500.0 86.096 380000.0 95.085 2500.0 98.9842 5900.0 104.1065 63000.0 108.1634 2600.0 124.5662 2700.0 124.9995 170000.0 125.3699 2500.0 155.3001 2400.0 159.9473 2400.0 165.7 2800.0 173.5209 18000.0 173.534 97000.0 173.5419 9400.0 173.7021 2200.0 183.8137 2600.0 184.0351 18000.0 184.0733 3800000.0 184.103 4900.0 184.1107 5700.0 184.1701 2600.0 195.4713 2400.0 203.4951 2500.0 212.3172 2300.0 214.4784 2100.0 218.9747 2200.0 234.616 2700.0 304.5765 2400.0 316.2156 2400.0 329.7106 2700.0 335.2576 9500.0 360.2928 2300.0 474.2836 2400.0 500.3162 6100.0 523.5347 2800.0 END IONS BEGIN IONS SCANS=595 PEPMASS=398.1758 CHARGE=1 COLLISION_ENERGY=0.0 60.683 2100.0 63.0235 2800.0 64.922 2100.0 66.3912 2600.0 66.5929 2300.0 77.0389 18000.0 80.8175 2100.0 82.0884 2300.0 91.0535 5900.0 95.0488 24000.0 100.3465 2500.0 102.0464 3600.0 102.7401 2400.0 103.0539 840000.0 103.0618 11000.0 103.0705 2900.0 105.0332 9900.0 105.0447 8700.0 105.0697 10000.0 115.9638 12000.0 129.5988 2500.0 131.0365 12000.0 131.0488 7400000.0 131.0609 120000.0 131.0687 72000.0 131.0737 43000.0 131.0788 14000.0 148.0755 11000.0 173.5249 11000.0 173.5342 19000.0 173.5441 5700.0 174.0916 17000.0 191.0854 230000.0 191.1058 5200.0 205.0645 3900.0 205.1014 3300.0 206.0963 12000.0 207.0806 21000.0 217.0636 6400.0 218.0963 28000.0 219.0555 5500.0 219.0804 470000.0 219.102 11000.0 220.0886 23000.0 233.0977 2300.0 234.0914 20000.0 236.0825 40000.0 236.1071 190000.0 245.0956 16000.0 247.0987 12000.0 250.0863 3600.0 251.1062 320000.0 262.084 3800.0 263.0953 3400.0 265.1086 3800.0 266.1175 150000.0 267.1165 9700.0 268.1324 3400.0 279.0867 2500.0 281.1327 7100.0 293.1328 18000.0 295.1122 25000.0 303.1176 6700.0 309.1259 9500.0 313.2475 2700.0 321.1272 47000.0 324.139 3500.0 337.123 8600.0 338.1547 10000.0 349.549 2600.0 366.1489 15000.0 377.9515 3000.0 398.1757 6300.0 END IONS BEGIN IONS SCANS=596 PEPMASS=350.2545 CHARGE=1 COLLISION_ENERGY=0.0 51.0275 2200.0 51.1249 2700.0 51.2267 2200.0 51.2934 2200.0 51.4973 2400.0 51.5629 2200.0 51.7031 2500.0 51.7176 2300.0 51.9229 2100.0 51.96 2200.0 52.151 2000.0 52.4608 2700.0 52.4983 2300.0 52.513 2400.0 52.71 2500.0 52.7312 2200.0 52.8134 2100.0 53.1988 2600.0 53.2339 2300.0 53.4255 2500.0 53.4424 2400.0 53.5173 2600.0 53.6867 2700.0 53.7131 2200.0 53.9858 2100.0 54.0664 2700.0 54.0867 2300.0 54.0976 2400.0 54.1902 2300.0 54.2928 2100.0 54.7351 2300.0 55.1637 2300.0 55.2857 2300.0 55.3614 2500.0 55.4494 2300.0 55.5123 2100.0 55.5441 4600.0 55.5537 2400.0 55.5759 2300.0 55.591 2200.0 55.699 2400.0 55.7811 2300.0 55.8598 2300.0 55.9324 2400.0 55.9508 2700.0 56.0041 2300.0 56.0492 950000.0 56.0969 2600.0 56.2281 2100.0 56.3822 2500.0 56.4658 2000.0 56.4936 2300.0 56.5619 2600.0 56.6698 2200.0 57.1699 2200.0 57.2768 2100.0 57.339 2300.0 57.355 2100.0 57.3973 4700.0 57.4317 2500.0 57.6277 2500.0 57.7072 2700.0 57.7368 2400.0 57.8697 2300.0 57.9655 2200.0 58.2581 2100.0 58.7666 2300.0 58.8427 2500.0 58.8696 2400.0 59.0312 45000.0 59.0732 2400.0 59.1753 2700.0 59.2001 2200.0 59.2484 5000.0 59.3136 2600.0 59.6234 2400.0 59.7446 2000.0 59.9538 4400.0 60.2302 2200.0 60.2981 2200.0 60.3066 2300.0 60.3821 2400.0 60.419 2600.0 61.0424 2400.0 61.3106 2800.0 61.4181 2300.0 61.4641 2400.0 61.6291 2200.0 61.9005 2200.0 61.919 2400.0 61.9729 2200.0 62.275 2300.0 62.3221 2200.0 62.3536 2300.0 62.4788 2500.0 62.6662 2200.0 62.9896 6100.0 63.0428 2200.0 63.3815 2300.0 63.3999 2500.0 63.4797 2500.0 63.5067 2600.0 63.5916 2300.0 64.4295 2100.0 64.5416 2300.0 64.6268 2600.0 64.854 2100.0 64.9719 2300.0 65.141 2500.0 65.2046 2300.0 65.9888 2200.0 66.2394 2400.0 66.3002 2500.0 66.5003 2300.0 66.885 2200.0 67.2 2300.0 67.2526 2000.0 67.4283 2700.0 67.5517 2400.0 67.7973 2200.0 68.1427 2600.0 68.962 2300.0 69.1515 2400.0 69.2848 2100.0 69.5272 2600.0 69.6183 2500.0 69.9043 2100.0 70.0567 5000.0 70.0924 2300.0 70.5454 2200.0 70.6574 2400.0 70.9491 2400.0 71.0952 2400.0 71.326 2200.0 71.4153 2600.0 71.4524 2300.0 71.5679 2300.0 71.6392 2300.0 71.6887 2300.0 71.948 2300.0 71.9585 2100.0 72.0836 4800.0 72.1061 2500.0 72.2597 2300.0 72.2689 2200.0 72.5334 4900.0 72.556 3100.0 73.3527 7000.0 73.6917 2200.0 73.8141 2400.0 73.9598 2200.0 74.0862 2500.0 74.2811 2500.0 74.3225 2300.0 74.3458 2300.0 74.8584 2200.0 74.9507 2300.0 75.0259 17000.0 75.0645 2600.0 75.1686 3200.0 75.5585 2000.0 75.6602 2200.0 76.1172 2400.0 76.145 2200.0 76.1892 2200.0 76.3601 2500.0 76.4722 2400.0 76.6266 2300.0 76.8053 2500.0 77.0414 260000.0 77.2633 2300.0 77.2937 3200.0 77.553 2200.0 77.7567 2700.0 78.1204 2300.0 78.2257 2300.0 78.3419 2300.0 78.4693 2400.0 78.5667 2600.0 78.5767 2300.0 78.6688 2500.0 79.0858 2700.0 79.1911 2300.0 79.2776 2300.0 79.3115 2300.0 79.706 2500.0 79.7907 2300.0 80.2672 2100.0 80.5631 2300.0 81.4355 2400.0 81.6724 2600.0 81.6957 2300.0 82.2124 3000.0 83.1941 2300.0 83.515 2100.0 83.5283 2100.0 83.7047 2300.0 83.8968 2600.0 83.9311 2300.0 83.9948 2300.0 84.0768 4800.0 84.1451 2500.0 84.2574 2300.0 84.3645 2200.0 84.5035 2400.0 84.5208 4400.0 85.0601 2300.0 85.3998 2300.0 85.6135 2200.0 85.8597 2300.0 85.8842 2800.0 85.9964 2300.0 86.0596 14000.0 86.6927 2200.0 87.0622 830000.0 87.5917 2800.0 87.9027 2500.0 88.1996 2200.0 88.5274 2700.0 88.6852 2100.0 88.9862 2800.0 89.0423 2100.0 89.0592 5300.0 89.0857 2100.0 89.4832 2100.0 89.535 2100.0 89.5735 2500.0 89.5929 2300.0 89.6431 2700.0 90.0485 2600.0 90.156 2500.0 90.1805 2700.0 90.2293 2500.0 90.5058 2100.0 90.5714 2200.0 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249.5053 2600.0 249.6656 2600.0 249.9931 2500.0 250.895 2300.0 250.9384 2400.0 252.0308 2500.0 257.0433 2500.0 257.8768 44000.0 258.8232 2600.0 259.2683 2400.0 261.4128 2600.0 262.55 2800.0 263.8472 2300.0 268.058 2600.0 268.0963 2200.0 268.7679 2600.0 269.8347 2800.0 270.0013 2200.0 272.1714 2500.0 274.2411 2600.0 274.9742 2400.0 275.8772 2500.0 276.207 2400.0 277.235 2200.0 277.6232 3100.0 279.3319 2500.0 279.488 2400.0 279.5427 2200.0 279.6365 2800.0 280.3845 3100.0 281.075 2500.0 284.5066 2700.0 285.2954 2600.0 285.8541 24000.0 286.821 2300.0 290.059 3000.0 290.5071 2500.0 290.6596 2400.0 293.0753 2400.0 293.3395 2600.0 296.2132 2400.0 296.4807 2700.0 297.901 2500.0 300.0857 2200.0 300.8087 2400.0 301.2012 2800.0 303.6741 2600.0 308.8664 12000.0 309.0964 2600.0 311.2056 2400.0 319.5931 2400.0 320.3986 2400.0 320.7358 2700.0 321.4904 2400.0 323.2941 2900.0 323.3368 2600.0 325.4007 2600.0 326.9865 2100.0 327.5533 2600.0 327.5681 3000.0 327.6856 2500.0 328.3119 2500.0 329.1792 2600.0 329.8425 2500.0 331.9803 2400.0 332.7671 2600.0 334.4041 2900.0 335.4877 2900.0 335.5607 2300.0 335.7388 2500.0 337.3741 3000.0 340.0941 2800.0 343.8904 2700.0 349.2422 2700.0 350.1245 2500.0 352.4677 2500.0 357.3807 2300.0 358.584 2500.0 360.4021 2400.0 END IONS BEGIN IONS SCANS=597 PEPMASS=299.092 CHARGE=1 COLLISION_ENERGY=0.0 47.0833 11000.0 48.6719 11000.0 51.9165 8800.0 57.3019 10000.0 62.0609 11000.0 64.0161 10000.0 64.5549 10000.0 66.088 9900.0 66.6513 10000.0 67.0177 20000.0 71.0151 13000.0 73.8699 9300.0 74.7716 210000.0 74.7753 50000.0 76.5144 11000.0 87.6789 9500.0 88.785 13000.0 98.9609 11000.0 124.0154 87000.0 124.083 9100.0 133.0647 660000.0 135.0443 81000.0 153.1485 11000.0 159.0439 210000.0 167.0339 980000.0 173.5288 110000.0 173.5387 98000.0 185.0443 110000.0 197.0598 43000.0 201.0544 57000.0 211.0752 35000.0 213.0565 28000.0 213.8484 14000.0 227.0708 35000.0 228.0782 14000.0 239.0705 150000.0 241.0511 28000.0 255.065 14000.0 256.0728 8400000.0 256.1061 19000.0 268.0741 24000.0 270.0852 16000.0 271.097 70000.0 284.0679 15000000.0 284.1426 35000.0 286.5095 11000.0 297.0784 47000.0 299.0112 380000.0 299.0275 290000.0 299.0912 64000000.0 299.153 370000.0 299.1715 460000.0 299.1943 180000.0 299.2167 37000.0 299.2392 21000.0 END IONS BEGIN IONS SCANS=598 PEPMASS=315.0869 CHARGE=1 COLLISION_ENERGY=0.0 48.1964 2300.0 49.1836 2400.0 50.2492 2200.0 51.2008 2100.0 51.8524 2600.0 52.5969 2100.0 52.6758 2300.0 52.7203 2600.0 53.4665 2300.0 53.6624 2300.0 54.4452 2200.0 54.6843 2300.0 57.951 2400.0 58.2817 3100.0 59.0313 2300.0 66.2115 2400.0 66.3426 2500.0 72.7825 2200.0 73.0279 9700.0 74.3055 2600.0 78.7733 3100.0 84.9593 6400.0 89.1124 2400.0 90.8747 2200.0 91.0536 2200.0 93.2236 2300.0 96.1532 2600.0 97.2818 2500.0 97.8324 2100.0 98.0751 2300.0 102.5436 2400.0 104.8616 2400.0 109.0075 2900.0 109.5634 2800.0 111.192 2700.0 111.8632 2400.0 121.0643 18000.0 121.367 2500.0 122.2517 2100.0 126.1442 2700.0 131.7908 2700.0 132.8959 2500.0 134.3795 2900.0 135.0435 98000.0 146.0748 2300.0 147.3432 2400.0 149.0595 9400.0 151.0386 15000.0 153.0541 120000.0 160.6707 2800.0 161.0594 3500.0 162.3875 2300.0 167.0336 120000.0 168.5397 2500.0 170.331 2500.0 173.527 35000.0 173.5373 85000.0 176.9006 2500.0 179.0336 59000.0 181.4573 2400.0 183.5353 2400.0 187.8234 2400.0 188.4073 2400.0 194.9108 5300.0 197.044 24000.0 227.071 4000.0 231.1553 2600.0 241.0853 3200.0 243.0652 11000.0 244.0725 64000.0 250.9005 2300.0 255.0655 15000.0 256.0737 4800.0 259.0957 29000.0 269.0801 2700.0 271.0607 14000.0 272.0677 240000.0 272.6737 2100.0 283.0599 23000.0 283.7748 2600.0 286.0833 40000.0 287.2388 2800.0 300.0629 460000.0 300.1019 4600.0 308.436 2500.0 315.0007 7100.0 315.0862 3200000.0 315.1306 4400.0 315.1494 3200.0 315.1945 3000.0 323.5969 2700.0 END IONS BEGIN IONS SCANS=599 PEPMASS=408.2665 CHARGE=1 COLLISION_ENERGY=0.0 55.0541 13000.0 55.7056 2400.0 58.427 2300.0 58.8584 2200.0 59.8275 2100.0 60.8224 2600.0 60.9696 2300.0 67.054 26000.0 69.0332 18000.0 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54000.0 147.1161 16000.0 148.0887 2400.0 148.9711 2300.0 149.0958 42000.0 149.6911 3600.0 155.0851 14000.0 156.093 11000.0 157.1009 62000.0 158.0731 2500.0 158.1088 7600.0 159.0802 140000.0 159.1165 52000.0 160.0882 10000.0 161.0959 42000.0 163.1109 11000.0 165.3541 2900.0 167.0856 4700.0 167.1065 58000.0 167.164 2400.0 169.1012 29000.0 170.1084 4200.0 171.0802 14000.0 171.1163 35000.0 172.0881 32000.0 173.0959 40000.0 173.1325 12000.0 173.5306 45000.0 173.5471 4200.0 174.104 2700.0 175.1115 17000.0 181.1014 16000.0 182.1083 6300.0 183.1169 19000.0 184.0881 2600.0 185.096 23000.0 185.1323 17000.0 186.4283 3100.0 187.1117 39000.0 189.128 7700.0 191.1071 3300.0 193.101 19000.0 194.109 7000.0 195.1174 21000.0 197.0971 9800.0 197.1322 28000.0 199.1123 15000.0 199.1476 10000.0 201.1273 13000.0 202.1343 2800.0 203.1437 8100.0 205.1223 13000.0 207.117 14000.0 208.124 6500.0 209.0977 4400.0 209.1327 18000.0 211.1119 22000.0 211.1481 11000.0 213.1274 35000.0 213.1636 2700.0 215.1428 13000.0 220.1458 7200.0 221.1321 12000.0 223.1123 2500.0 223.1475 5100.0 225.1277 18000.0 227.1435 18000.0 228.5742 3000.0 233.1316 3500.0 233.1536 63000.0 235.1118 8900.0 235.1493 6200.0 237.127 7900.0 239.143 11000.0 246.1613 27000.0 249.1279 2900.0 253.158 3700.0 255.1753 3400.0 267.1733 3000.0 271.1683 5900.0 273.1855 11000.0 282.9282 2300.0 285.1851 90000.0 297.1882 5900.0 299.2006 14000.0 335.202 9000.0 369.7441 2700.0 END IONS BEGIN IONS SCANS=600 PEPMASS=373.2531 CHARGE=1 COLLISION_ENERGY=0.0 55.0174 2600.0 55.054 25000.0 57.0697 3000.0 61.0511 2500.0 65.3253 2400.0 65.9082 2500.0 67.0539 40000.0 68.6233 2300.0 69.0696 26000.0 70.0063 2500.0 73.0822 2400.0 77.0382 3500.0 78.5005 2200.0 79.0539 51000.0 81.0696 92000.0 83.049 6600.0 84.8896 2400.0 90.7327 2100.0 91.0493 2400.0 91.0539 68000.0 93.0695 91000.0 95.0436 2900.0 95.0488 88000.0 95.0803 2100.0 95.0851 66000.0 97.0645 23000.0 103.0233 2200.0 103.0544 2800.0 105.0693 160000.0 107.0851 59000.0 109.0644 33000.0 109.1007 17000.0 115.0539 2400.0 117.0694 31000.0 119.0852 140000.0 121.0644 28000.0 121.1008 44000.0 128.0618 17000.0 129.0695 33000.0 130.0773 11000.0 131.0853 63000.0 133.0657 2600.0 133.1008 89000.0 135.0799 13000.0 139.4755 2600.0 140.8726 2800.0 141.0695 9900.0 142.0773 48000.0 143.0852 91000.0 144.093 20000.0 145.1009 90000.0 147.0801 2600.0 147.1166 17000.0 149.0959 13000.0 154.0781 3000.0 155.085 29000.0 156.093 36000.0 157.1009 110000.0 158.1087 21000.0 159.08 6700.0 159.1166 44000.0 161.0955 11000.0 165.0698 5800.0 167.0857 21000.0 168.0933 6500.0 169.101 65000.0 170.1087 17000.0 171.1166 54000.0 173.1325 33000.0 173.5282 42000.0 173.543 11000.0 179.0856 24000.0 179.1028 3000.0 180.0933 11000.0 181.1011 42000.0 182.1089 47000.0 183.1165 44000.0 184.1252 16000.0 185.0972 4200.0 185.1321 18000.0 192.0933 10000.0 193.101 40000.0 194.1087 28000.0 195.1166 58000.0 196.1245 25000.0 197.1324 50000.0 198.1401 5800.0 199.1484 16000.0 203.9821 2500.0 205.1015 8400.0 206.1087 25000.0 207.1168 65000.0 208.1249 26000.0 209.1323 49000.0 210.1403 7500.0 211.1486 23000.0 218.1092 3900.0 219.1168 23000.0 220.1247 25000.0 221.1325 59000.0 222.1404 21000.0 223.1482 26000.0 224.6698 2500.0 231.1171 8400.0 232.1244 12000.0 233.1325 34000.0 234.1398 18000.0 235.125 2300.0 235.1479 49000.0 236.1551 14000.0 237.1641 17000.0 245.1328 18000.0 246.139 14000.0 247.1477 31000.0 248.1551 14000.0 249.1637 54000.0 250.1713 2800.0 251.1804 2900.0 257.318 2400.0 258.1403 6500.0 259.1476 13000.0 260.1561 16000.0 261.1641 23000.0 263.1796 16000.0 264.1872 7300.0 265.1939 5900.0 269.1337 3300.0 271.1476 3000.0 273.1638 10000.0 274.1735 2400.0 275.1787 13000.0 277.1951 7000.0 283.1494 2800.0 284.155 2800.0 285.165 2500.0 289.1962 4900.0 299.1797 6200.0 317.1899 3200.0 373.2509 16000.0 END IONS BEGIN IONS SCANS=601 PEPMASS=391.2638 CHARGE=1 COLLISION_ENERGY=0.0 53.6201 2400.0 53.7396 2200.0 55.054 30000.0 57.0673 2800.0 57.0696 78000.0 58.9172 2400.0 59.0491 3100.0 59.9849 2500.0 63.4338 2600.0 64.8734 2600.0 65.0382 2400.0 67.0539 32000.0 69.0218 2200.0 69.0333 8800.0 69.0696 30000.0 71.0852 64000.0 73.261 2200.0 76.6618 2200.0 77.8715 2100.0 79.0539 48000.0 81.0696 120000.0 83.049 17000.0 83.0854 14000.0 85.0645 12000.0 87.5983 2300.0 91.0539 45000.0 93.0639 3700.0 93.0695 120000.0 95.0426 3300.0 95.0488 120000.0 95.0851 65000.0 97.0645 18000.0 98.9144 2400.0 105.0695 150000.0 107.0487 2600.0 107.0852 84000.0 109.0645 31000.0 109.1008 31000.0 111.0798 2300.0 112.9004 2100.0 113.5312 2300.0 115.0549 2800.0 117.0695 25000.0 119.0852 140000.0 121.0279 8500.0 121.0645 39000.0 121.1008 80000.0 123.08 15000.0 123.1167 11000.0 128.062 10000.0 129.0697 22000.0 130.0775 10000.0 131.0853 75000.0 133.0651 2900.0 133.1009 57000.0 135.08 17000.0 135.1166 11000.0 141.0699 9300.0 142.0775 22000.0 143.0852 86000.0 144.0932 17000.0 145.0644 4600.0 145.0889 4100.0 145.101 150000.0 146.0722 2500.0 147.08 23000.0 147.1166 41000.0 149.0231 690000.0 149.0958 18000.0 149.1328 4600.0 155.0852 31000.0 156.093 28000.0 157.1009 120000.0 158.1089 9000.0 159.0805 18000.0 159.1166 59000.0 161.096 27000.0 161.1324 8900.0 166.0781 2800.0 167.0334 4300.0 167.0854 16000.0 167.1062 2900.0 168.093 7000.0 169.1011 66000.0 170.1087 17000.0 171.081 6400.0 171.1167 67000.0 173.0958 19000.0 173.1325 66000.0 173.5328 47000.0 175.1117 18000.0 179.0855 17000.0 180.0938 6100.0 181.1011 44000.0 182.1091 24000.0 183.1166 72000.0 184.1246 14000.0 185.0957 3500.0 185.1324 37000.0 187.1114 11000.0 187.148 12000.0 189.1283 3100.0 191.1429 14000.0 192.0937 2900.0 193.1011 31000.0 194.1088 25000.0 195.1167 63000.0 196.1244 24000.0 197.0958 6200.0 197.1325 61000.0 198.1412 2400.0 199.1115 19000.0 199.1476 20000.0 201.1269 3200.0 206.1092 18000.0 207.1167 53000.0 208.1246 25000.0 209.1326 62000.0 210.1396 7600.0 211.1113 13000.0 211.1482 35000.0 213.1279 15000.0 215.1421 9500.0 216.0584 2400.0 217.1576 6000.0 218.1085 2700.0 219.1171 20000.0 220.1245 18000.0 221.1325 50000.0 222.1401 12000.0 223.1121 7200.0 223.1483 42000.0 225.1278 14000.0 225.1644 16000.0 227.1438 12000.0 231.1161 5800.0 232.124 4200.0 233.1321 30000.0 233.1547 16000.0 234.1404 17000.0 235.1484 37000.0 236.1558 7700.0 237.1274 4600.0 237.1637 25000.0 239.1429 3600.0 241.1595 2400.0 243.1163 3100.0 244.1246 2500.0 245.132 12000.0 246.1396 15000.0 247.1482 22000.0 248.1563 14000.0 249.1636 70000.0 251.1449 11000.0 251.1794 16000.0 253.158 3900.0 257.1329 3600.0 258.1399 5800.0 259.1478 14000.0 260.1546 3600.0 261.1639 21000.0 262.1687 3100.0 263.1791 21000.0 264.1869 9600.0 267.1745 28000.0 269.705 2600.0 273.1645 14000.0 275.1783 16000.0 277.1609 3300.0 277.1941 4700.0 279.1761 3500.0 281.1909 7100.0 282.1984 17000.0 283.2074 2900.0 287.18 4900.0 289.1958 12000.0 291.1746 9200.0 293.1888 9600.0 295.2059 3400.0 297.1855 28000.0 298.3142 2400.0 299.1811 3200.0 305.1909 3100.0 308.2144 4300.0 314.1997 3100.0 315.2094 3200.0 316.1808 2600.0 322.9916 2800.0 335.2005 3900.0 354.248 2500.0 373.2528 7400.0 391.2642 13000.0 END IONS BEGIN IONS SCANS=602 PEPMASS=696.4172 CHARGE=1 COLLISION_ENERGY=0.0 67.0539 52000.0 68.4625 2600.0 69.0696 28000.0 70.2788 2500.0 71.0852 12000.0 72.7335 2100.0 73.0281 11000.0 76.2591 2300.0 79.0539 15000.0 81.0693 140000.0 82.4208 2700.0 83.0851 39000.0 85.028 73000.0 85.0648 3200.0 85.1008 5600.0 86.874 2400.0 87.2009 2700.0 89.4514 2200.0 90.0803 2300.0 91.0386 57000.0 91.0539 11000.0 93.0696 23000.0 93.8078 2600.0 95.0851 130000.0 97.028 35000.0 97.0645 16000.0 97.1008 38000.0 99.0799 7700.0 105.0698 12000.0 106.6604 2700.0 107.0851 29000.0 109.0929 3400.0 109.1008 97000.0 111.0802 8200.0 111.1165 14000.0 113.0177 2300.0 113.0959 8300.0 119.0852 22000.0 121.1007 62000.0 123.1164 67000.0 125.0962 2900.0 125.132 3200.0 127.0386 27000.0 127.1117 2700.0 133.1008 43000.0 135.1165 43000.0 137.1321 30000.0 139.1114 2800.0 141.1269 7100.0 142.472 2300.0 145.0492 31000.0 147.1165 37000.0 149.1322 52000.0 150.8089 2800.0 151.1118 8500.0 151.1476 28000.0 153.1273 2700.0 155.142 8000.0 157.6038 2800.0 161.1323 49000.0 163.0601 8500.0 163.1479 48000.0 164.3511 2500.0 165.1272 3200.0 165.1635 27000.0 172.8626 2200.0 173.3316 2600.0 173.5229 19000.0 173.5374 35000.0 173.543 5500.0 175.148 46000.0 177.1638 8800.0 179.1422 2400.0 179.1795 20000.0 181.158 3000.0 182.4646 2200.0 189.1635 22000.0 193.1585 4400.0 198.5191 2300.0 203.1786 3000.0 217.1928 2900.0 245.2263 170000.0 249.3119 2200.0 252.2625 2600.0 259.0042 2500.0 263.2368 200000.0 296.9904 2700.0 337.2742 160000.0 337.3162 4200.0 342.3297 2800.0 366.8343 3200.0 381.9319 2500.0 577.9653 2600.0 594.4008 2800.0 611.5497 2600.0 625.6497 2800.0 654.4083 2600.0 700.0663 3100.0 END IONS BEGIN IONS SCANS=603 PEPMASS=231.1383 CHARGE=1 COLLISION_ENERGY=0.0 43.0178 180000.0 47.3787 2400.0 48.6402 2600.0 49.5945 2400.0 52.6296 2600.0 53.0385 16000.0 55.0177 98000.0 55.0541 140000.0 57.8925 2600.0 59.0491 28000.0 60.5402 2200.0 61.2681 2300.0 62.5296 2200.0 62.6575 2400.0 63.7831 2500.0 67.0541 76000.0 67.6718 2300.0 68.9658 2200.0 69.0333 71000.0 69.0698 26000.0 69.8303 2100.0 70.1843 2400.0 71.5995 2200.0 71.8382 2900.0 73.0279 2100.0 73.1461 2300.0 73.5106 2100.0 74.976 2500.0 75.6747 2500.0 77.4392 2200.0 78.4588 2200.0 79.054 240000.0 79.1336 2300.0 79.6844 2400.0 81.0696 650000.0 83.0489 18000.0 84.5681 2400.0 85.8854 2200.0 85.9739 2600.0 86.0213 2600.0 87.0439 21000.0 90.9494 2300.0 91.054 250000.0 91.1581 2100.0 91.2742 2100.0 92.301 2400.0 93.0696 260000.0 93.591 2800.0 94.3589 2600.0 95.0491 60000.0 95.0853 210000.0 96.026 2900.0 96.171 2300.0 97.0648 17000.0 97.9651 2500.0 99.3188 2500.0 101.0027 2500.0 101.682 2400.0 103.0538 23000.0 103.9186 2500.0 105.0616 16000.0 105.0696 1100000.0 105.0759 2100.0 105.0803 6300.0 105.7186 2300.0 107.0492 6000.0 107.0854 130000.0 107.9468 2200.0 108.4551 2700.0 109.0647 24000.0 111.0439 130000.0 111.0806 3200.0 112.6879 2300.0 115.054 42000.0 117.0697 460000.0 119.049 61000.0 119.0757 5300.0 119.0853 680000.0 121.0646 24000.0 122.0733 2500.0 123.0802 92000.0 125.0596 44000.0 128.0619 160000.0 128.2987 2300.0 129.0697 280000.0 130.0775 40000.0 131.0854 170000.0 133.054 4200.0 133.0646 460000.0 133.0757 11000.0 133.1011 170000.0 134.291 2400.0 135.0804 68000.0 136.8036 2500.0 137.0595 45000.0 140.6284 2400.0 141.0698 83000.0 141.296 2500.0 142.0659 4800.0 142.0776 560000.0 143.0727 5500.0 143.0853 870000.0 143.0978 5300.0 144.0934 52000.0 145.0645 33000.0 145.1011 330000.0 147.0803 29000.0 147.1156 2700.0 147.7541 2700.0 149.5607 2800.0 149.8992 2500.0 151.0753 230000.0 151.9343 2800.0 152.9122 2600.0 153.0699 9700.0 154.0777 2800.0 155.0853 180000.0 156.0931 390000.0 157.0639 2800.0 157.0846 12000.0 157.0887 2100.0 157.101 1500000.0 157.1156 18000.0 157.4026 2600.0 158.109 73000.0 159.0805 19000.0 159.1168 100000.0 161.0959 35000.0 161.1315 2300.0 163.0754 60000.0 165.0699 130000.0 166.1067 2400.0 167.0857 19000.0 169.1012 42000.0 170.109 890000.0 170.1257 4800.0 171.0805 110000.0 171.117 110000.0 172.0883 56000.0 172.125 26000.0 173.0963 16000.0 173.5293 120000.0 173.5399 41000.0 173.8939 2400.0 175.0754 41000.0 175.1124 12000.0 179.0856 6200.0 180.0934 150000.0 182.3112 2700.0 182.4987 2500.0 183.0804 100000.0 183.1167 9800.0 183.4947 2600.0 184.0884 58000.0 185.0956 44000.0 185.1131 3100.0 185.1325 1100000.0 185.1516 19000.0 186.1398 13000.0 187.1486 6200.0 189.0914 31000.0 191.2516 2700.0 195.1169 170000.0 197.0957 5200.0 197.6038 2600.0 198.104 250000.0 203.1429 5600.0 208.0374 2700.0 213.1275 460000.0 215.2694 2400.0 216.1155 2400.0 216.1633 2300.0 216.2934 2300.0 217.7238 3000.0 220.6388 2400.0 223.4744 2300.0 231.138 50000.0 239.1339 2200.0 240.9255 2500.0 241.502 2300.0 END IONS BEGIN IONS SCANS=604 PEPMASS=478.2935 CHARGE=1 COLLISION_ENERGY=0.0 59.1614 2300.0 59.8224 2400.0 61.51 2500.0 61.5486 2300.0 62.0597 10000.0 62.6551 2300.0 64.9351 2700.0 67.0538 810000.0 67.0581 3600.0 67.446 2300.0 68.3832 2300.0 69.0694 730000.0 69.0739 4100.0 70.5146 2600.0 70.6403 2000.0 71.0488 25000.0 71.0851 56000.0 79.0538 210000.0 81.0694 1200000.0 81.0777 7500.0 81.9822 2800.0 82.3718 2100.0 82.4684 2300.0 82.7163 2600.0 83.0487 33000.0 83.085 590000.0 84.0152 2400.0 85.0644 48000.0 85.1007 20000.0 89.3541 2600.0 91.0537 140000.0 91.4391 2500.0 91.7054 2400.0 93.0369 2500.0 93.0694 320000.0 93.0916 2600.0 94.3183 2300.0 95.0487 3000.0 95.085 1100000.0 95.0923 2200.0 97.0643 110000.0 97.0944 3400.0 97.1007 380000.0 99.08 52000.0 100.585 2400.0 101.0588 3000.0 101.2867 2600.0 101.9137 2800.0 105.0693 120000.0 107.085 250000.0 109.1006 590000.0 109.3216 2300.0 109.8656 2200.0 110.9107 2700.0 111.08 69000.0 111.1163 78000.0 112.0131 2500.0 112.3049 2600.0 113.096 3600.0 115.075 2400.0 116.7431 2500.0 119.0768 2700.0 119.085 170000.0 120.4991 2400.0 121.1006 280000.0 123.0799 31000.0 123.1163 320000.0 124.0153 9900.0 125.0957 51000.0 125.1318 3300.0 126.2999 2400.0 133.1006 240000.0 135.1163 180000.0 137.0955 31000.0 137.1319 130000.0 138.8425 2300.0 139.1115 32000.0 141.9279 2600.0 144.602 2300.0 147.1163 200000.0 148.8249 2900.0 149.1319 110000.0 150.2199 2400.0 151.1117 26000.0 151.1478 49000.0 153.1271 35000.0 159.117 2000.0 161.1319 150000.0 163.1339 3500.0 163.1476 100000.0 163.1624 3000.0 165.1276 11000.0 165.1632 8700.0 167.1419 5700.0 173.1083 2400.0 173.5213 9100.0 173.5312 180000.0 173.5408 29000.0 175.1478 120000.0 177.1638 13000.0 177.8848 2300.0 179.1425 9200.0 181.1583 6000.0 184.5241 2600.0 184.9177 3000.0 189.1634 47000.0 193.1579 3900.0 202.8766 2200.0 203.1787 8900.0 207.1744 2500.0 211.2844 2400.0 217.1954 2600.0 219.2101 3000.0 220.8081 2600.0 226.0426 2400.0 232.625 2300.0 239.2134 2300.0 240.7424 2500.0 244.7039 2200.0 245.2257 68000.0 247.0499 2400.0 249.1059 2300.0 252.1446 2800.0 259.3815 2300.0 263.2365 140000.0 264.9617 2600.0 270.4901 2800.0 278.1976 2700.0 284.287 2600.0 285.6924 2600.0 294.2894 2300.0 299.1428 3000.0 306.2788 190000.0 314.9211 2800.0 337.2259 17000.0 337.2735 3400000.0 402.4049 2500.0 426.7874 2400.0 434.6256 2700.0 437.3109 2300.0 459.1958 2300.0 END IONS BEGIN IONS SCANS=605 PEPMASS=324.1237 CHARGE=1 COLLISION_ENERGY=0.0 55.835 2300.0 64.5713 2400.0 66.2173 2200.0 71.8427 2600.0 83.7063 2500.0 87.9174 2300.0 91.9972 2300.0 97.6574 2500.0 98.135 2300.0 98.7689 2600.0 110.1236 2400.0 112.8294 2500.0 136.5787 2200.0 147.9435 2200.0 158.7475 2400.0 173.5233 5400.0 173.5342 40000.0 175.2205 2500.0 207.1033 4800.0 217.0872 2900.0 224.0701 7800.0 233.0824 2400.0 234.0922 20000.0 235.0992 72000.0 245.0833 3400.0 246.0923 2700.0 247.0981 3100.0 248.0708 31000.0 249.0782 6600.0 250.0865 10000.0 262.0619 2200.0 262.0861 110000.0 263.0939 140000.0 264.1019 100000.0 265.0746 4000.0 266.081 120000.0 272.0717 4800.0 273.079 7400.0 274.0874 11000.0 276.0655 130000.0 276.1009 3500.0 278.0817 28000.0 279.0889 5900.0 280.0969 74000.0 290.0812 85000.0 291.0518 4300.0 291.0893 620000.0 291.127 8300.0 292.0969 17000.0 293.1048 59000.0 293.8121 2300.0 294.037 5300.0 294.0764 700000.0 294.1144 2900.0 298.9684 2200.0 308.0561 2800.0 308.092 52000.0 309.0652 2400.0 309.0999 270000.0 324.0833 7300.0 324.1233 420000.0 END IONS BEGIN IONS SCANS=606 PEPMASS=520.3404 CHARGE=1 COLLISION_ENERGY=0.0 60.0805 330000.0 61.6608 2500.0 62.1588 2400.0 62.7141 2200.0 63.1088 2100.0 63.1551 2500.0 64.2047 2200.0 67.054 6600.0 69.0695 3000.0 69.7964 2300.0 69.8523 2500.0 71.0727 66000.0 72.6761 2800.0 74.8506 2600.0 77.5292 2600.0 77.7695 2400.0 81.0696 8900.0 81.4843 2100.0 83.0854 3200.0 84.6038 2200.0 85.8478 2600.0 86.0961 1800000.0 86.102 3100.0 86.3648 2800.0 86.4796 2500.0 88.0226 2700.0 89.62 2600.0 90.0411 2500.0 95.0853 18000.0 97.1004 2900.0 97.5675 2600.0 98.9841 56000.0 99.5157 2200.0 100.6013 2800.0 104.0996 3000.0 104.1066 290000.0 107.9108 2700.0 109.101 4700.0 122.8841 3000.0 124.9903 4100.0 124.9995 740000.0 125.0104 7100.0 132.2594 2700.0 133.763 2500.0 150.2355 2400.0 151.8318 2200.0 152.8458 2600.0 157.9262 2900.0 163.0155 2900.0 168.2201 2300.0 173.5251 40000.0 173.5365 170000.0 184.0136 3100.0 184.035 160000.0 184.0426 22000.0 184.0733 19000000.0 184.103 72000.0 184.1122 130000.0 184.123 25000.0 184.1551 2600.0 184.7521 2700.0 214.4616 2500.0 228.7249 2600.0 231.4336 2800.0 240.4646 2300.0 257.3974 2300.0 258.1089 22000.0 285.88 2600.0 299.2882 2500.0 299.2972 2500.0 321.3591 2700.0 321.3924 2500.0 332.4608 2700.0 333.3051 2800.0 337.1044 2600.0 337.2745 83000.0 340.1161 3500.0 342.8085 2500.0 353.1288 2500.0 368.5145 2400.0 404.0117 2300.0 412.1293 2400.0 415.3155 2300.0 429.7845 2500.0 434.5681 2700.0 441.7077 2500.0 443.2565 11000.0 476.1152 2800.0 502.3303 48000.0 END IONS BEGIN IONS SCANS=607 PEPMASS=537.3039 CHARGE=1 COLLISION_ENERGY=0.0 80.473 2300.0 83.1179 2600.0 85.1133 2700.0 113.1415 2100.0 119.6868 2600.0 129.4218 2200.0 134.3197 2300.0 149.6844 4600.0 149.6946 4100.0 168.7814 2200.0 173.5281 21000.0 173.5448 5000.0 185.0416 18000.0 194.529 2300.0 203.0523 42000.0 220.8679 2700.0 259.0782 26000.0 262.6661 2700.0 281.2952 9400.0 282.279 59000.0 375.2505 12000.0 467.0404 2500.0 537.303 1600000.0 END IONS BEGIN IONS SCANS=608 PEPMASS=353.2689 CHARGE=1 COLLISION_ENERGY=0.0 53.0018 2600.0 55.0177 10000.0 55.054 120000.0 57.0332 85000.0 57.0696 66000.0 65.0384 7700.0 66.8818 2200.0 67.0539 870000.0 67.0581 6200.0 67.0604 8700.0 69.0695 150000.0 70.7061 2500.0 71.0488 26000.0 71.0852 22000.0 73.6766 2100.0 75.0436 18000.0 75.0479 2500.0 75.8221 2400.0 77.0387 3900.0 79.0538 330000.0 81.0696 1100000.0 81.0763 18000.0 81.0781 8300.0 83.0488 9500.0 83.0851 100000.0 85.0644 34000.0 91.0483 3700.0 91.0537 150000.0 93.0695 590000.0 93.0766 3600.0 95.049 15000.0 95.0852 970000.0 95.0924 4000.0 95.096 6700.0 97.0644 44000.0 97.1008 59000.0 99.0802 23000.0 105.0448 3100.0 105.0695 170000.0 107.0851 490000.0 109.0645 17000.0 109.1008 570000.0 111.0801 23000.0 111.1165 2700.0 117.0695 89000.0 119.0851 180000.0 121.0911 10000.0 121.1008 480000.0 121.1097 3000.0 123.08 21000.0 123.1069 5400.0 123.1165 270000.0 125.0958 16000.0 127.6163 2500.0 131.0748 8400.0 131.0852 240000.0 133.0905 3600.0 133.1008 190000.0 135.0436 24000.0 135.0805 5800.0 135.1165 410000.0 135.1271 5400.0 137.0959 14000.0 137.1322 74000.0 139.1118 10000.0 145.1009 190000.0 147.1165 150000.0 149.0961 12000.0 149.1322 290000.0 149.1463 3900.0 151.0749 5800.0 151.1118 9700.0 151.1477 22000.0 152.8029 2500.0 153.1277 7200.0 159.1166 170000.0 159.516 2400.0 161.1182 7400.0 161.1323 140000.0 163.1119 13000.0 163.1479 140000.0 165.127 14000.0 167.1434 2200.0 167.7243 2300.0 173.1325 190000.0 173.518 3800.0 173.5269 11000.0 173.5338 40000.0 173.545 5000.0 175.1481 43000.0 177.128 10000.0 177.1639 46000.0 179.143 10000.0 187.148 100000.0 189.1647 3400.0 191.1436 12000.0 199.9703 2500.0 201.0911 8000.0 201.1638 31000.0 205.159 9700.0 215.18 6600.0 219.1741 10000.0 222.748 2600.0 223.1692 3200.0 233.19 5400.0 233.2263 15000.0 243.2108 110000.0 244.425 2500.0 252.0784 2600.0 261.1898 5300.0 261.2213 290000.0 261.2467 2600.0 279.2309 12000.0 282.0886 11000.0 283.0968 3400.0 292.8852 2700.0 304.1112 9400.0 320.1033 2300.0 END IONS BEGIN IONS SCANS=609 PEPMASS=327.2323 CHARGE=1 COLLISION_ENERGY=0.0 50.664 2400.0 53.0384 2500.0 55.0176 4700.0 55.054 35000.0 56.39 2500.0 57.0333 6400.0 57.0697 19000.0 59.0489 3100.0 67.0539 51000.0 69.0332 6000.0 69.0695 33000.0 70.6212 2200.0 71.0489 5700.0 77.0383 6700.0 79.0539 42000.0 81.0333 6900.0 81.0646 2300.0 81.0695 81000.0 83.0488 3600.0 83.0852 7600.0 85.0643 5600.0 85.1005 2200.0 91.0539 53000.0 93.0695 180000.0 95.0425 3400.0 95.0488 140000.0 95.0794 3500.0 95.0852 110000.0 95.987 2300.0 97.0645 34000.0 103.0087 2400.0 103.0539 2700.0 105.0695 130000.0 107.0851 83000.0 108.2363 2400.0 109.0643 26000.0 109.1009 49000.0 115.0539 2800.0 117.0694 37000.0 119.0851 130000.0 121.0644 37000.0 121.1008 73000.0 123.0802 14000.0 123.1166 9400.0 128.0621 5300.0 129.0694 13000.0 130.0768 2400.0 131.0852 74000.0 132.7653 2600.0 133.0826 2800.0 133.1008 100000.0 135.0798 17000.0 135.1166 24000.0 137.0956 2700.0 142.0775 21000.0 143.0851 41000.0 144.0932 13000.0 145.1009 110000.0 147.1165 36000.0 149.0956 11000.0 149.1324 3500.0 152.0615 6200.0 153.0699 6300.0 155.085 11000.0 156.0929 13000.0 157.1009 63000.0 158.1082 15000.0 159.0808 6000.0 159.1166 80000.0 160.1235 2500.0 161.0959 31000.0 161.1322 8200.0 163.1351 2700.0 167.0846 3200.0 169.101 27000.0 170.1081 6500.0 171.1168 36000.0 172.1238 4100.0 173.0962 7400.0 173.1323 36000.0 173.5323 41000.0 175.1472 12000.0 179.085 3100.0 181.1011 6900.0 182.1088 7300.0 183.1167 22000.0 184.1248 7300.0 185.1324 20000.0 187.1476 18000.0 189.1629 2800.0 194.1084 2600.0 195.1168 9600.0 197.1325 25000.0 199.1479 11000.0 201.1637 3500.0 207.118 2800.0 209.1324 18000.0 210.1391 2900.0 211.1474 10000.0 216.4739 2500.0 217.1556 2800.0 225.1638 8100.0 229.1015 2800.0 233.0363 12000.0 233.8989 2800.0 235.1497 3300.0 239.1789 3200.0 251.0479 6300.0 317.5234 2500.0 327.0786 15000.0 END IONS BEGIN IONS SCANS=610 PEPMASS=497.3114 CHARGE=1 COLLISION_ENERGY=0.0 58.0192 2400.0 61.0281 120000.0 63.8308 2300.0 67.0539 130000.0 69.0332 70000.0 69.0696 38000.0 71.0488 17000.0 73.0281 67000.0 79.0539 74000.0 81.0331 42000.0 81.0647 4600.0 81.0695 180000.0 83.0488 11000.0 83.0852 21000.0 85.0226 3600.0 85.028 150000.0 85.0646 3000.0 87.0436 9800.0 91.0386 99000.0 91.0538 38000.0 91.1067 2500.0 93.0695 100000.0 95.0488 12000.0 95.0852 150000.0 97.0281 120000.0 97.0645 5200.0 97.101 12000.0 99.0438 28000.0 101.0229 32000.0 103.0386 18000.0 104.8191 2300.0 105.0695 45000.0 107.0852 75000.0 109.028 29000.0 109.0643 4600.0 109.1008 74000.0 111.0437 3200.0 115.0388 12000.0 117.0698 20000.0 119.0852 48000.0 119.0936 2500.0 120.8223 2800.0 121.1008 83000.0 123.0797 3200.0 123.1166 28000.0 127.0386 59000.0 129.0541 8100.0 129.5511 2400.0 131.0853 35000.0 133.1009 40000.0 133.1362 2200.0 135.1166 55000.0 145.0493 7400.0 145.1009 28000.0 147.1167 28000.0 149.1321 30000.0 154.2341 2500.0 159.1164 25000.0 161.1324 24000.0 163.1479 11000.0 168.5292 2800.0 171.1184 2800.0 173.1323 27000.0 173.5205 10000.0 173.5301 24000.0 173.5382 38000.0 175.1489 8200.0 179.1445 2400.0 185.1326 5600.0 186.6005 2500.0 187.1477 13000.0 199.1445 2400.0 199.6676 2400.0 201.1633 3300.0 211.4397 2300.0 243.2113 4100.0 261.2213 20000.0 295.655 2600.0 317.2446 2200.0 332.6198 2400.0 333.7273 2500.0 335.2584 51000.0 345.5007 2700.0 361.9443 2300.0 365.1668 2500.0 385.2988 2600.0 489.5982 2500.0 END IONS BEGIN IONS SCANS=611 PEPMASS=618.4285 CHARGE=1 COLLISION_ENERGY=0.0 64.9321 2500.0 65.0389 3900.0 65.8521 2400.0 67.0541 33000.0 67.3225 2400.0 69.0333 29000.0 69.0697 45000.0 70.9379 2700.0 71.0489 23000.0 71.1845 2000.0 74.4376 2500.0 76.3459 2600.0 77.9004 2600.0 78.8235 2400.0 79.0541 47000.0 80.0173 2700.0 80.0622 6200.0 81.0697 150000.0 83.049 53000.0 83.0852 250000.0 84.6206 2400.0 85.0282 7300.0 85.0646 25000.0 87.0439 8500.0 87.497 2200.0 90.7984 2200.0 91.0541 53000.0 93.0696 180000.0 95.049 91000.0 95.0793 4300.0 95.0853 130000.0 97.0646 110000.0 97.1013 3300.0 99.0439 27000.0 99.0804 7800.0 102.575 3200.0 103.0539 2500.0 105.0697 190000.0 107.0492 13000.0 107.0853 270000.0 108.0935 3500.0 109.0646 58000.0 109.101 130000.0 111.0803 29000.0 113.0597 12000.0 113.096 65000.0 115.0546 4800.0 117.0697 33000.0 118.0775 3400.0 119.0763 7200.0 119.0853 260000.0 120.0934 14000.0 121.0647 33000.0 121.0909 4500.0 121.101 260000.0 123.0803 80000.0 123.1167 35000.0 125.096 120000.0 126.1039 3200.0 127.1117 3900.0 129.0697 22000.0 130.0776 6500.0 131.0854 130000.0 132.0933 24000.0 132.6838 2300.0 133.0647 11000.0 133.1011 220000.0 133.1125 3500.0 134.1088 8400.0 135.0803 60000.0 135.1168 52000.0 136.0881 2500.0 137.0959 41000.0 139.1116 95000.0 141.0696 9500.0 142.0774 21000.0 143.0854 140000.0 144.0932 31000.0 145.0649 12000.0 145.1011 310000.0 145.1142 6300.0 146.1085 17000.0 147.0804 56000.0 147.1167 120000.0 149.096 70000.0 149.1324 19000.0 151.0747 14000.0 151.1119 17000.0 153.0906 8700.0 153.1273 10000.0 155.0855 40000.0 155.1065 50000.0 156.0933 39000.0 157.0869 5600.0 157.1011 260000.0 157.1144 5200.0 158.1089 25000.0 159.0805 60000.0 159.1167 170000.0 160.0882 75000.0 161.0961 80000.0 161.1325 33000.0 163.1118 36000.0 165.0694 2800.0 165.0912 14000.0 165.1278 13000.0 167.0846 4600.0 167.087 15000.0 167.1067 130000.0 167.1429 18000.0 168.0932 7300.0 169.1013 100000.0 169.1193 4100.0 170.109 27000.0 171.081 10000.0 171.1006 9000.0 171.1169 190000.0 172.0883 3200.0 172.1247 20000.0 173.0963 54000.0 173.1326 110000.0 173.524 8100.0 173.5293 40000.0 173.5424 6300.0 174.1039 6900.0 175.1118 64000.0 175.1482 24000.0 176.1194 3400.0 177.0913 3200.0 177.1276 15000.0 179.0864 11000.0 179.1065 2300.0 179.1431 41000.0 181.1015 53000.0 181.1224 98000.0 182.1091 34000.0 183.1169 130000.0 183.1377 23000.0 184.1247 20000.0 185.0963 26000.0 185.1326 120000.0 186.1047 3700.0 186.1405 14000.0 187.1118 39000.0 187.1482 54000.0 188.1199 6800.0 189.1275 33000.0 190.135 8900.0 191.1431 54000.0 192.0921 3200.0 193.1013 30000.0 193.1208 6600.0 193.1573 2900.0 194.109 24000.0 195.1169 120000.0 195.1367 16000.0 196.1247 38000.0 197.0984 13000.0 197.1127 5700.0 197.1326 220000.0 198.14 19000.0 199.1121 37000.0 199.1482 85000.0 200.1193 4000.0 200.1565 7900.0 201.1276 29000.0 201.1634 15000.0 203.1432 39000.0 205.123 3300.0 205.1584 8000.0 206.1084 3800.0 207.1172 61000.0 207.1378 16000.0 207.7421 3100.0 208.1245 26000.0 208.1455 15000.0 209.1326 130000.0 209.1535 14000.0 210.1403 28000.0 211.1119 20000.0 211.1484 120000.0 212.1201 7400.0 212.1564 19000.0 213.1278 51000.0 213.164 36000.0 214.1345 2700.0 215.1433 74000.0 217.1586 15000.0 218.166 6400.0 219.1168 19000.0 219.1385 9000.0 220.1255 11000.0 221.1323 69000.0 221.1542 68000.0 222.1401 22000.0 223.1115 9600.0 223.1215 3000.0 223.1483 110000.0 224.1555 11000.0 225.1271 35000.0 225.1642 43000.0 226.1364 3700.0 226.1711 3700.0 227.1434 40000.0 227.1809 7500.0 228.1513 4500.0 229.159 14000.0 231.116 8600.0 231.1388 2700.0 231.1749 11000.0 232.1248 7500.0 233.1318 29000.0 233.154 220000.0 234.1389 14000.0 234.1635 3100.0 235.148 74000.0 235.1707 4400.0 236.1557 11000.0 237.1266 4300.0 237.1641 69000.0 239.1435 21000.0 239.1797 23000.0 240.1483 3400.0 241.1591 23000.0 243.1736 10000.0 245.131 17000.0 245.1558 8100.0 246.1373 7300.0 246.162 28000.0 246.3886 2400.0 247.1477 42000.0 247.1709 16000.0 248.1567 13000.0 249.1638 64000.0 250.1712 10000.0 251.1451 8700.0 251.1794 41000.0 252.1868 3600.0 253.1586 29000.0 253.1939 11000.0 255.1743 180000.0 257.1903 7500.0 258.1394 3600.0 259.1472 20000.0 259.1734 3400.0 260.1544 13000.0 261.164 60000.0 262.1721 8900.0 263.1494 3900.0 263.1793 46000.0 265.1616 12000.0 265.1954 29000.0 267.1745 25000.0 268.1833 5300.0 269.1901 24000.0 270.1988 13000.0 271.1715 14000.0 271.2045 3100.0 273.1602 12000.0 273.1855 29000.0 274.1716 9600.0 275.18 41000.0 276.1883 7500.0 277.1613 3900.0 277.1956 29000.0 279.1759 13000.0 281.1907 31000.0 282.1986 11000.0 283.2061 15000.0 285.1853 20000.0 286.1941 13000.0 287.1765 6400.0 287.2046 5200.0 288.1915 2500.0 289.1956 26000.0 291.1761 7600.0 291.212 15000.0 293.1906 12000.0 294.198 2500.0 295.206 31000.0 297.1865 9400.0 297.2212 3200.0 298.1945 5000.0 299.2012 27000.0 301.1961 21000.0 303.2107 7500.0 305.1912 3300.0 307.2063 13000.0 309.2211 9900.0 311.2018 15000.0 313.1977 3500.0 315.211 9100.0 316.2218 2600.0 317.1892 3200.0 317.2266 13000.0 319.2046 8200.0 321.2228 3200.0 325.2133 3700.0 327.2118 7200.0 329.2262 8700.0 331.2432 3400.0 333.2209 10000.0 335.238 7200.0 337.2538 8600.0 345.2218 12000.0 347.2374 9800.0 349.2522 12000.0 359.2366 8900.0 365.2463 15000.0 367.2652 2900.0 381.2611 3100.0 383.2632 6400.0 399.2673 15000.0 417.2723 3300.0 439.3021 2900.0 457.3129 3700.0 523.3633 3200.0 626.561 2500.0 END IONS BEGIN IONS SCANS=612 PEPMASS=532.3486 CHARGE=1 COLLISION_ENERGY=0.0 61.0284 34000.0 65.0387 8100.0 67.0541 680000.0 67.0577 2400.0 67.0586 4400.0 69.0335 8800.0 69.0698 130000.0 71.049 27000.0 71.0854 26000.0 73.0283 8100.0 73.7359 2700.0 75.044 22000.0 77.0388 3600.0 78.1166 2700.0 79.0541 270000.0 81.0698 1100000.0 81.0747 5700.0 83.049 14000.0 83.0854 130000.0 85.0283 67000.0 85.0647 51000.0 85.1012 8500.0 91.0388 44000.0 91.0484 3900.0 91.0541 140000.0 93.0698 520000.0 93.0755 3400.0 93.0767 5600.0 93.3737 2600.0 95.0491 22000.0 95.0853 1000000.0 95.0914 6200.0 97.0283 37000.0 97.0647 52000.0 97.1011 93000.0 99.0439 5300.0 99.0804 51000.0 102.4465 2700.0 105.0697 180000.0 107.0155 2800.0 107.0854 510000.0 109.0285 3200.0 109.0647 18000.0 109.1011 740000.0 109.1111 2500.0 109.1134 4200.0 111.0803 41000.0 111.1167 23000.0 113.096 25000.0 113.8008 2700.0 115.3321 2500.0 117.0697 100000.0 118.6022 2800.0 119.0854 260000.0 121.0912 5300.0 121.101 740000.0 121.1104 8700.0 121.2994 2400.0 123.0803 29000.0 123.1167 430000.0 125.096 32000.0 127.0386 12000.0 127.1119 4900.0 128.073 2600.0 130.8184 2800.0 131.0854 300000.0 133.1011 310000.0 133.1127 9600.0 135.0801 6600.0 135.1043 3100.0 135.1167 730000.0 136.7298 2900.0 137.0959 34000.0 137.1324 160000.0 137.9966 2500.0 139.1117 37000.0 141.4841 2800.0 145.0499 3700.0 145.1011 300000.0 145.1143 4400.0 147.1167 290000.0 149.0961 18000.0 149.1185 3900.0 149.1324 600000.0 149.1464 17000.0 149.5822 2600.0 151.1118 36000.0 151.148 44000.0 153.1272 35000.0 154.9643 2500.0 159.1167 360000.0 159.1318 6000.0 161.1163 3800.0 161.1324 330000.0 161.1479 4900.0 163.112 23000.0 163.1337 8400.0 163.1481 370000.0 165.1274 44000.0 165.1636 13000.0 167.1431 6900.0 173.1182 3100.0 173.1326 430000.0 173.1499 9300.0 173.5004 2600.0 173.5326 85000.0 173.547 4100.0 175.1482 110000.0 177.1275 31000.0 177.1639 120000.0 179.1434 51000.0 181.1231 4800.0 181.1585 6000.0 187.1481 270000.0 189.1639 19000.0 191.1433 35000.0 191.1799 2700.0 193.1581 11000.0 195.1374 3400.0 199.1333 3000.0 201.1639 95000.0 203.1792 12000.0 205.1589 46000.0 209.1536 14000.0 215.18 31000.0 217.1947 8300.0 219.1743 35000.0 223.169 11000.0 233.1894 7400.0 233.1994 3100.0 233.2266 83000.0 236.9581 2800.0 237.1847 3200.0 243.188 2000.0 243.2105 500000.0 243.2333 2100.0 261.2211 1600000.0 261.2456 8100.0 261.2546 5900.0 263.2367 3500.0 264.4438 2400.0 279.1974 4500.0 279.232 81000.0 317.2476 6300.0 335.2127 6100.0 335.2582 330000.0 350.6324 2900.0 353.2683 40000.0 370.2182 2700.0 383.1051 2900.0 408.9656 3500.0 486.5912 2900.0 533.68 2800.0 END IONS BEGIN IONS SCANS=613 PEPMASS=599.4103 CHARGE=1 COLLISION_ENERGY=0.0 65.0101 2300.0 67.0541 47000.0 67.1496 2300.0 69.0334 64000.0 69.0697 53000.0 71.1023 2300.0 71.8244 2300.0 73.7149 2800.0 73.8102 3200.0 73.8999 2400.0 74.0395 2700.0 77.039 3000.0 79.0541 62000.0 80.6242 2200.0 81.0697 220000.0 83.049 70000.0 83.0855 22000.0 85.0647 63000.0 87.8945 2400.0 90.145 2700.0 91.0542 70000.0 92.426 2300.0 93.0698 390000.0 95.049 83000.0 95.0853 280000.0 97.0646 68000.0 105.0617 2900.0 105.0697 280000.0 105.9164 2500.0 107.0854 250000.0 109.0647 100000.0 109.101 120000.0 110.6757 2700.0 111.0432 2300.0 111.0803 59000.0 115.0545 3100.0 117.0698 29000.0 119.0494 4500.0 119.0854 520000.0 119.0954 3400.0 120.1712 3100.0 121.0647 74000.0 121.0911 14000.0 121.101 540000.0 121.5713 2200.0 123.0803 240000.0 123.1167 42000.0 123.8676 2600.0 124.4711 2300.0 125.0596 180000.0 125.0956 9800.0 128.0623 7600.0 129.0697 30000.0 130.308 2300.0 131.0854 160000.0 132.4285 2300.0 133.0646 34000.0 133.0904 5200.0 133.1011 360000.0 133.1125 3300.0 135.0803 300000.0 135.0912 2200.0 135.1167 200000.0 137.0598 32000.0 137.096 400000.0 137.1077 4700.0 139.0753 120000.0 139.1116 11000.0 141.0703 6200.0 142.0777 32000.0 143.0854 190000.0 144.0927 4600.0 145.1011 470000.0 145.1143 4500.0 147.0672 5200.0 147.0803 810000.0 147.1167 120000.0 149.096 110000.0 149.1324 3100.0 151.0753 420000.0 151.0891 3800.0 151.1117 24000.0 153.0909 31000.0 155.0856 77000.0 156.0932 39000.0 157.0863 6300.0 157.101 580000.0 157.1124 5300.0 158.109 11000.0 159.0674 2600.0 159.0805 62000.0 159.1167 360000.0 159.1315 4400.0 160.1256 2600.0 161.0961 210000.0 161.1325 320000.0 163.0767 3100.0 163.1117 470000.0 163.1962 2900.0 165.0784 8200.0 165.091 4000000.0 165.1235 5100.0 167.086 11000.0 167.1065 3800.0 168.0936 23000.0 169.047 2600.0 169.1013 200000.0 170.1092 47000.0 171.0809 16000.0 171.1169 480000.0 171.1301 2300.0 173.0962 160000.0 173.1325 130000.0 173.5213 21000.0 173.5347 140000.0 174.1037 3500.0 175.1118 70000.0 175.1482 120000.0 177.0912 100000.0 177.1278 76000.0 179.0871 3700.0 179.107 45000.0 179.1431 48000.0 179.26 2600.0 179.4199 2700.0 181.0641 2700.0 181.1018 55000.0 181.1224 220000.0 182.1086 15000.0 183.1169 490000.0 184.1255 9900.0 185.0963 34000.0 185.1326 430000.0 185.1513 7100.0 187.1117 84000.0 187.1297 2600.0 187.1482 140000.0 188.1196 7000.0 189.1274 220000.0 190.1356 3500.0 191.1067 270000.0 191.1428 70000.0 193.102 22000.0 193.1221 19000.0 193.5077 3200.0 193.923 2600.0 194.109 12000.0 195.1169 120000.0 195.1379 80000.0 196.1248 45000.0 197.0982 7300.0 197.1326 190000.0 199.1118 79000.0 199.1482 59000.0 201.1274 68000.0 201.164 25000.0 203.1096 2600.0 203.1255 3800.0 203.1431 1600000.0 205.1223 23000.0 205.1588 3100.0 207.117 58000.0 207.1383 290000.0 208.1252 15000.0 209.0978 3700.0 209.1326 180000.0 209.1532 26000.0 210.1403 12000.0 211.1119 63000.0 211.1483 310000.0 211.171 3100.0 212.1575 6300.0 213.1277 92000.0 213.1632 14000.0 214.1353 3000.0 215.1073 11000.0 215.1431 67000.0 217.1227 15000.0 217.1591 23000.0 219.1173 9500.0 219.1389 22000.0 221.104 3500.0 221.1103 3000.0 221.1342 85000.0 221.1537 4300000.0 221.2036 3800.0 221.2511 2900.0 222.1404 3700.0 223.1115 11000.0 223.1485 84000.0 225.1273 72000.0 225.1639 71000.0 227.1433 63000.0 227.1797 54000.0 227.2027 2700.0 229.122 33000.0 229.1591 160000.0 230.131 4000.0 231.1383 120000.0 232.1229 2900.0 233.1317 28000.0 233.1542 73000.0 234.1618 18000.0 235.1478 59000.0 235.1711 13000.0 236.1563 2800.0 237.1274 47000.0 237.1641 51000.0 239.1428 47000.0 239.1792 57000.0 240.1526 6900.0 240.1853 2700.0 241.1231 6200.0 241.1579 28000.0 241.6242 3500.0 243.1382 51000.0 243.1745 14000.0 245.1302 4000.0 245.1551 21000.0 247.1432 9200.0 247.1693 900000.0 247.1991 22000.0 249.1288 5700.0 249.1645 36000.0 250.1691 3100.0 251.1429 35000.0 251.1791 52000.0 252.1898 2600.0 253.1587 31000.0 253.1937 14000.0 255.1383 26000.0 255.1738 17000.0 257.1541 39000.0 257.1879 6400.0 260.1565 3500.0 261.1604 14000.0 261.1862 44000.0 263.1431 6700.0 263.179 47000.0 265.1593 37000.0 265.1931 21000.0 267.1412 6800.0 267.175 22000.0 268.1829 3000.0 269.1575 19000.0 269.19 92000.0 271.1694 48000.0 272.1778 2700.0 273.1624 14000.0 273.1879 4000.0 274.1947 22000.0 275.1786 22000.0 277.1595 5300.0 277.1951 4700.0 279.1744 18000.0 281.1906 87000.0 283.1715 13000.0 283.2059 16000.0 285.1851 81000.0 286.1931 120000.0 287.2009 680000.0 287.2378 14000.0 289.1955 25000.0 291.1747 29000.0 291.209 3300.0 293.1901 51000.0 295.2065 25000.0 298.1936 18000.0 299.2008 220000.0 301.2173 21000.0 303.2116 3000.0 305.1899 3300.0 307.2061 28000.0 309.1847 50000.0 309.2221 12000.0 310.193 12000.0 311.2009 140000.0 312.2092 38000.0 313.2165 220000.0 317.1913 9100.0 321.1833 3600.0 321.223 6600.0 324.2089 20000.0 325.2169 120000.0 327.2321 310000.0 329.228 4600.0 333.2227 3600.0 335.2005 27000.0 339.2327 22000.0 347.237 30000.0 351.2346 7400.0 363.2312 17000.0 364.2397 17000.0 365.2475 200000.0 373.2515 33000.0 376.2385 6100.0 377.2487 3100.0 387.2537 6800.0 390.4112 3000.0 391.2633 190000.0 401.2857 9400.0 409.2664 3100.0 412.2595 2700.0 413.2686 210000.0 413.3221 2800.0 419.2948 260000.0 427.2344 2200.0 427.2846 460000.0 427.3505 7300.0 445.2908 3300.0 453.3 110000.0 472.3805 2400.0 472.7334 2600.0 479.3137 12000.0 486.8534 2900.0 492.3272 3100.0 504.3177 2900.0 507.3471 58000.0 519.3462 170000.0 526.6768 2600.0 535.882 2500.0 543.35 4000.0 581.3991 19000.0 589.5659 2600.0 599.4093 140000.0 END IONS BEGIN IONS SCANS=614 PEPMASS=478.2935 CHARGE=1 COLLISION_ENERGY=0.0 61.4223 2400.0 61.5965 2300.0 62.0597 83000.0 67.054 60000.0 69.0696 32000.0 70.1157 2200.0 75.255 2600.0 79.054 14000.0 80.258 2400.0 81.0695 83000.0 82.4632 2500.0 83.0851 29000.0 87.8222 2300.0 88.22 2400.0 91.0537 5200.0 93.0697 29000.0 93.283 2500.0 95.0851 73000.0 97.1007 17000.0 98.9842 19000.0 99.0794 2800.0 105.0696 8900.0 107.0853 25000.0 109.1009 35000.0 112.4038 2400.0 119.0852 8500.0 121.1009 30000.0 123.1165 21000.0 132.6251 2200.0 133.1007 15000.0 134.4756 2300.0 135.1167 19000.0 135.1944 2800.0 136.4146 2800.0 137.1322 10000.0 140.3049 2600.0 147.1162 12000.0 149.1317 4700.0 155.01 21000.0 161.1322 4700.0 161.9262 2400.0 163.1485 5100.0 173.0216 3000.0 173.524 19000.0 173.5374 43000.0 173.5443 6200.0 175.1478 5800.0 189.9952 2600.0 191.0805 2900.0 196.8277 2400.0 198.0532 3400.0 217.1736 2700.0 238.4011 2500.0 263.2362 17000.0 306.2791 76000.0 319.2696 2500.0 325.2352 2700.0 337.274 340000.0 337.3182 8700.0 338.8386 2600.0 343.7589 2300.0 344.4452 2500.0 362.0969 2500.0 END IONS BEGIN IONS SCANS=615 PEPMASS=520.3405 CHARGE=1 COLLISION_ENERGY=0.0 60.0805 100000.0 63.005 2300.0 64.2339 2300.0 65.424 2500.0 66.9473 2100.0 67.0539 9100.0 67.4082 2600.0 69.0695 9800.0 70.9422 2300.0 71.0727 22000.0 78.6208 2400.0 81.0695 19000.0 82.9006 2500.0 84.1556 2800.0 86.0961 390000.0 93.0695 2900.0 94.7939 2600.0 95.0852 12000.0 98.9841 4700.0 104.0975 2600.0 104.1067 1700000.0 104.1154 18000.0 104.1192 7600.0 104.1228 7600.0 107.0848 3400.0 109.1011 2700.0 123.1171 2400.0 124.9995 130000.0 163.0151 12000.0 163.316 2300.0 166.1078 2700.0 173.5236 18000.0 173.5334 25000.0 173.5417 11000.0 181.0265 6500.0 184.0352 5800.0 184.0733 2500000.0 184.0928 5200.0 207.2448 2400.0 223.887 2400.0 236.1429 2800.0 258.1104 36000.0 332.4041 2500.0 337.2745 45000.0 368.6182 2500.0 378.6516 2600.0 387.3564 2500.0 443.2575 19000.0 502.3307 78000.0 520.3419 25000.0 END IONS BEGIN IONS SCANS=616 PEPMASS=532.3486 CHARGE=1 COLLISION_ENERGY=0.0 60.4057 2300.0 67.0538 69000.0 68.0166 2500.0 69.0694 13000.0 71.0852 2300.0 78.3158 2700.0 79.0537 31000.0 81.0694 110000.0 83.0852 14000.0 85.0279 9300.0 85.0645 3100.0 85.9385 2700.0 88.2772 2200.0 91.0389 2700.0 91.0539 15000.0 93.0694 54000.0 95.0849 96000.0 97.0288 2600.0 97.1008 7100.0 99.0798 6200.0 105.0693 20000.0 107.085 57000.0 109.1007 79000.0 111.0802 6100.0 113.0955 2700.0 117.0695 7200.0 119.085 26000.0 121.1007 81000.0 123.1163 43000.0 125.0957 3200.0 131.0851 35000.0 133.1007 32000.0 135.1164 82000.0 137.0959 2400.0 137.1322 18000.0 139.1112 3000.0 145.1005 35000.0 147.1163 33000.0 149.0967 2800.0 149.132 70000.0 151.1113 2900.0 159.1165 40000.0 161.1319 32000.0 163.1478 43000.0 173.1324 44000.0 173.5326 46000.0 175.1481 14000.0 177.1635 16000.0 179.1425 2600.0 187.1477 32000.0 201.1647 8900.0 205.1586 7000.0 208.9367 2500.0 233.2266 10000.0 243.2103 61000.0 261.1896 5200.0 261.2209 200000.0 299.0627 2600.0 325.1267 2700.0 335.2581 21000.0 353.27 3200.0 372.1102 2700.0 END IONS BEGIN IONS SCANS=617 PEPMASS=353.269 CHARGE=1 COLLISION_ENERGY=0.0 52.7254 2500.0 55.054 14000.0 57.0334 8900.0 57.0696 9800.0 63.4802 2300.0 65.9637 2600.0 67.0538 98000.0 69.0696 21000.0 69.668 2500.0 71.0856 2600.0 73.0279 2100.0 74.1776 2200.0 76.0004 2400.0 79.0538 45000.0 81.0646 3100.0 81.0694 130000.0 83.0852 12000.0 84.0152 3200.0 91.0539 21000.0 93.0695 81000.0 95.0795 4700.0 95.0852 110000.0 95.1805 3000.0 97.0648 3200.0 97.1008 8900.0 105.0696 23000.0 107.0852 69000.0 109.1008 59000.0 117.0695 11000.0 119.0767 2600.0 119.0852 26000.0 121.1008 69000.0 121.5334 2600.0 122.0282 2500.0 123.1165 29000.0 131.0851 36000.0 133.1009 27000.0 135.0437 14000.0 135.1165 65000.0 137.1322 8200.0 145.101 29000.0 147.1165 25000.0 149.1322 44000.0 151.0757 3200.0 159.1165 25000.0 161.1323 22000.0 163.1475 20000.0 173.1324 27000.0 173.5289 42000.0 173.5447 6600.0 175.1482 7800.0 177.1633 5800.0 183.2465 2500.0 186.4872 2200.0 187.1479 13000.0 194.108 2200.0 201.0916 6100.0 201.1647 4100.0 243.2101 15000.0 252.078 2700.0 261.221 41000.0 268.0739 2700.0 270.6366 2600.0 282.0886 5800.0 304.1107 3700.0 305.1159 2600.0 END IONS BEGIN IONS SCANS=618 PEPMASS=203.1796 CHARGE=1 COLLISION_ENERGY=0.0 41.0385 8200.0 46.1439 2300.0 53.0564 2200.0 55.054 74000.0 56.8106 2500.0 57.0696 14000.0 58.7427 2300.0 59.9475 2300.0 65.0384 2300.0 65.7031 2400.0 67.0507 2800.0 67.0539 74000.0 69.0695 72000.0 70.1654 2200.0 70.9419 3600.0 72.3656 2600.0 79.0539 37000.0 81.0646 3300.0 81.0694 140000.0 83.0851 24000.0 87.9873 2500.0 91.0538 66000.0 93.0693 84000.0 95.0488 7200.0 95.0785 3300.0 95.085 200000.0 97.101 3600.0 99.5357 2500.0 103.054 3000.0 105.0617 4500.0 105.0694 240000.0 105.0781 2200.0 105.132 2400.0 107.0852 98000.0 109.1008 130000.0 111.9681 10000.0 117.0695 8200.0 119.0755 3300.0 119.0851 250000.0 119.0939 4700.0 119.2638 2400.0 121.1008 71000.0 123.0801 2500.0 123.1165 14000.0 131.0853 16000.0 133.1008 300000.0 133.1111 2500.0 133.9746 2600.0 135.1164 30000.0 145.1008 21000.0 146.1086 2500.0 147.1165 200000.0 148.1912 2300.0 157.2505 2500.0 159.1167 11000.0 160.1244 14000.0 161.1322 49000.0 173.5219 11000.0 173.5302 14000.0 173.542 21000.0 174.139 3800.0 175.1482 24000.0 196.6796 2600.0 202.0792 3400.0 203.0849 16000.0 203.1792 37000.0 210.413 2400.0 END IONS BEGIN IONS SCANS=619 PEPMASS=355.227 CHARGE=1 COLLISION_ENERGY=0.0 55.054 73000.0 57.0697 27000.0 59.2094 2600.0 59.9083 2700.0 62.0677 2000.0 63.1562 2400.0 63.9635 2500.0 65.2465 2500.0 65.7387 2700.0 66.8441 2000.0 67.0539 76000.0 69.014 2300.0 69.0695 120000.0 73.8899 2300.0 77.0386 2400.0 79.054 41000.0 80.0498 2300.0 80.4357 2200.0 81.0655 3200.0 81.0696 170000.0 83.0852 46000.0 85.6626 2600.0 89.1931 2300.0 90.3146 2400.0 91.0539 44000.0 92.7661 2900.0 93.0631 2800.0 93.0695 280000.0 95.0488 4400.0 95.0792 3400.0 95.0852 200000.0 97.1009 58000.0 101.0001 2700.0 101.4445 2200.0 103.6177 2300.0 103.6253 2600.0 105.0696 68000.0 106.0628 2400.0 107.0488 7900.0 107.0852 300000.0 109.0648 8300.0 109.0928 7400.0 109.1009 280000.0 119.0852 62000.0 121.0642 15000.0 121.0913 2400.0 121.1009 180000.0 123.1165 93000.0 126.0346 2500.0 131.0839 2100.0 133.101 52000.0 135.0438 36000.0 135.1055 8900.0 135.1166 280000.0 137.0595 2900.0 137.1324 11000.0 139.0252 2300.0 147.0438 16000.0 147.0801 21000.0 147.1166 85000.0 149.1324 90000.0 151.0388 3200.0 159.044 28000.0 159.0805 15000.0 160.5295 2400.0 161.0593 5600.0 161.1324 13000.0 163.1482 25000.0 165.0546 1700000.0 173.0596 44000.0 173.0963 3400.0 173.5211 13000.0 173.5359 76000.0 175.0758 3100.0 175.1484 32000.0 177.055 19000.0 177.1633 29000.0 179.0704 120000.0 179.0857 2400.0 185.0596 4600.0 187.0756 49000.0 189.055 56000.0 189.1641 50000.0 190.1712 23000.0 191.0703 53000.0 191.1794 58000.0 193.0857 20000.0 199.0756 22000.0 199.1131 3300.0 201.0911 34000.0 203.0704 90000.0 204.889 3400.0 205.0867 36000.0 211.0754 3700.0 213.0913 11000.0 214.8737 34000.0 215.107 2400.0 217.0863 36000.0 218.869 29000.0 225.0914 4800.0 227.1068 25000.0 229.0869 10000.0 230.8681 3300.0 231.1023 52000.0 239.1057 3900.0 241.1229 6700.0 243.1015 56000.0 245.1172 23000.0 253.1254 2800.0 253.2798 2500.0 257.1172 14000.0 257.2468 2200.0 259.1337 14000.0 267.1381 16000.0 271.134 12000.0 273.148 7000.0 280.9055 2900.0 283.5749 2500.0 285.148 15000.0 290.8903 11000.0 299.1638 9800.0 308.901 82000.0 312.7235 2600.0 313.182 2900.0 323.2057 4100.0 332.0762 2500.0 355.228 32000.0 END IONS BEGIN IONS SCANS=620 PEPMASS=313.1802 CHARGE=1 COLLISION_ENERGY=0.0 48.1499 2500.0 48.3484 2300.0 54.3094 2400.0 55.054 3100.0 55.2046 2400.0 55.543 2300.0 57.0332 3200.0 57.0697 12000.0 65.7946 2200.0 67.054 16000.0 69.0696 11000.0 71.0847 2200.0 79.0539 34000.0 81.0695 62000.0 84.7902 2400.0 91.0539 21000.0 93.0695 92000.0 95.0852 43000.0 102.8612 2400.0 105.0336 7200.0 105.0696 59000.0 107.0852 94000.0 109.0646 13000.0 109.1009 11000.0 114.9654 2400.0 119.0852 27000.0 121.0645 6200.0 121.1008 35000.0 133.0289 2400.0 133.1014 11000.0 135.0438 29000.0 135.1166 48000.0 137.0595 9300.0 145.1013 2800.0 145.7627 2400.0 147.0799 2700.0 147.1166 64000.0 148.1246 10000.0 149.1202 3000.0 149.1323 140000.0 153.9475 2800.0 159.0432 6300.0 159.0804 10000.0 159.733 2400.0 160.086 2600.0 161.0962 2500.0 161.1324 20000.0 162.0955 2500.0 165.0546 1000000.0 173.0593 6500.0 173.5221 15000.0 173.5408 30000.0 177.0546 3400.0 179.0704 22000.0 185.0606 2900.0 187.0754 15000.0 189.0547 17000.0 191.0696 3300.0 196.1299 2200.0 197.0968 2700.0 197.198 2400.0 199.076 8300.0 201.0917 9900.0 203.0703 13000.0 205.0864 7100.0 217.0857 13000.0 219.1002 3000.0 221.0938 3000.0 225.0907 12000.0 231.1022 7000.0 247.6853 2300.0 253.156 6200.0 281.1538 14000.0 313.1795 8500.0 END IONS BEGIN IONS SCANS=621 PEPMASS=299.1646 CHARGE=1 COLLISION_ENERGY=0.0 48.7386 2500.0 51.4422 2900.0 52.5752 2500.0 54.9181 2300.0 55.0177 5600.0 55.054 18000.0 56.9561 2100.0 57.0697 5000.0 58.0972 2400.0 61.452 2400.0 62.4179 2600.0 62.7028 2300.0 62.9728 2500.0 65.085 2400.0 67.054 18000.0 69.0696 13000.0 73.0284 2400.0 77.0384 13000.0 79.0539 34000.0 81.0653 2700.0 81.0696 80000.0 86.6735 2300.0 87.2447 2200.0 91.0539 34000.0 93.0695 75000.0 95.0489 15000.0 95.0852 38000.0 97.0645 16000.0 105.0334 3100.0 105.0696 42000.0 107.0488 79000.0 107.0852 75000.0 109.0645 32000.0 109.1009 14000.0 111.0801 35000.0 112.0757 2400.0 117.0696 14000.0 119.0487 2600.0 119.0854 19000.0 121.0645 31000.0 121.1008 12000.0 123.08 64000.0 123.1161 9500.0 127.0752 18000.0 128.3705 3000.0 131.0475 2600.0 131.0856 20000.0 133.0179 3300.0 133.0281 180000.0 133.0646 36000.0 133.1008 18000.0 134.0361 5700.0 135.0437 280000.0 135.0557 2900.0 135.1165 9000.0 137.0953 4700.0 142.1488 2700.0 145.0644 24000.0 145.1007 16000.0 146.1091 2600.0 147.0437 31000.0 147.0557 2800.0 147.0804 24000.0 147.1165 65000.0 149.0593 33000.0 149.1322 3100.0 151.0387 110000.0 151.1117 14000.0 155.0852 3300.0 158.0722 9700.0 159.0436 2600.0 159.0803 21000.0 159.1165 21000.0 161.06 7400.0 161.096 24000.0 165.0549 19000.0 165.1272 79000.0 171.0802 11000.0 173.0596 2700.0 173.0962 7000.0 173.5248 14000.0 173.5391 28000.0 175.0759 14000.0 175.1138 2700.0 177.0543 6500.0 177.1271 2900.0 183.0802 8000.0 185.0963 11000.0 187.0752 15000.0 188.4965 2600.0 189.0911 55000.0 197.0967 8200.0 199.0758 3600.0 201.091 48000.0 203.1054 2700.0 211.1128 2400.0 213.0915 2900.0 226.6842 2500.0 231.1035 3600.0 239.1054 3700.0 251.2261 2800.0 267.2425 2300.0 281.1534 6800.0 282.2795 7300.0 284.067 2600.0 299.0914 41000.0 299.1278 2500.0 299.1649 24000.0 END IONS BEGIN IONS SCANS=622 PEPMASS=618.4283 CHARGE=1 COLLISION_ENERGY=0.0 64.5696 2200.0 67.054 28000.0 67.8054 2300.0 69.0333 20000.0 69.0695 33000.0 71.0489 16000.0 72.0486 2200.0 72.4963 2500.0 73.7034 2400.0 74.2434 2300.0 79.0538 37000.0 79.2854 2600.0 81.0694 130000.0 82.8644 2500.0 83.0488 41000.0 83.0851 180000.0 84.0725 2500.0 85.0645 22000.0 87.044 7900.0 87.5466 2400.0 91.0538 38000.0 93.0695 130000.0 93.6514 2300.0 95.0488 68000.0 95.0794 2400.0 95.0852 93000.0 95.9599 2300.0 97.0644 81000.0 97.101 3100.0 99.0441 13000.0 99.0804 5900.0 105.0695 130000.0 107.0489 12000.0 107.0851 200000.0 109.0644 42000.0 109.1008 100000.0 111.0802 20000.0 111.1167 3200.0 113.0596 3100.0 113.0958 44000.0 115.0546 2700.0 117.0696 19000.0 119.0757 2700.0 119.0851 210000.0 120.0929 4000.0 121.0642 23000.0 121.1008 200000.0 123.0801 66000.0 123.1165 24000.0 124.0885 2700.0 125.0957 82000.0 128.0623 6400.0 129.0696 17000.0 130.0779 2700.0 131.0852 100000.0 132.093 19000.0 132.1489 2300.0 133.0646 6900.0 133.1008 170000.0 135.08 41000.0 135.1164 38000.0 136.0888 3200.0 137.0957 26000.0 139.1114 68000.0 139.1216 2700.0 141.0911 2500.0 142.0778 18000.0 142.8144 2700.0 143.0852 110000.0 144.0929 27000.0 145.0649 7300.0 145.1008 240000.0 146.1084 6500.0 147.0801 38000.0 147.1164 87000.0 149.0958 53000.0 149.1319 10000.0 151.0752 8700.0 151.1112 13000.0 153.0903 4200.0 153.1273 7000.0 153.1829 2400.0 155.0851 36000.0 155.1063 34000.0 156.0928 32000.0 157.0865 2900.0 157.1008 210000.0 158.1082 19000.0 159.0801 44000.0 159.1025 2800.0 159.1166 140000.0 160.0879 55000.0 161.0958 60000.0 161.132 21000.0 163.1114 23000.0 165.0915 8500.0 165.1268 10000.0 167.0843 2400.0 167.0877 12000.0 167.1064 120000.0 167.1423 6400.0 168.0924 2900.0 169.1011 85000.0 169.1191 3600.0 170.1087 22000.0 171.0812 2600.0 171.1004 8200.0 171.1167 150000.0 172.1247 6800.0 173.096 42000.0 173.1324 77000.0 173.5268 32000.0 173.5388 45000.0 174.1035 2900.0 175.1116 48000.0 175.1482 16000.0 177.127 8800.0 179.0855 10000.0 179.1068 2800.0 179.1428 34000.0 181.101 41000.0 181.1221 74000.0 182.1093 31000.0 183.1166 110000.0 183.1365 15000.0 184.1241 17000.0 185.0959 18000.0 185.1325 100000.0 186.1031 2700.0 186.1398 16000.0 187.1115 31000.0 187.1478 49000.0 188.0203 2900.0 189.1269 30000.0 190.1343 3700.0 191.143 48000.0 193.1011 20000.0 194.1091 16000.0 195.1166 82000.0 195.1365 3700.0 196.1243 27000.0 197.0987 8200.0 197.1323 180000.0 198.14 15000.0 199.112 29000.0 199.148 75000.0 200.1191 2700.0 201.1275 18000.0 201.1635 14000.0 203.1428 27000.0 205.1574 3500.0 206.1093 4800.0 207.1164 43000.0 207.138 23000.0 208.1244 21000.0 208.1457 6900.0 209.1323 110000.0 209.1535 13000.0 210.1403 20000.0 211.1122 14000.0 211.1481 99000.0 212.1195 3000.0 212.1556 17000.0 213.1272 36000.0 213.1638 28000.0 215.143 67000.0 217.1591 11000.0 219.117 7600.0 220.1244 12000.0 221.1319 51000.0 221.1538 56000.0 222.1407 16000.0 223.148 74000.0 224.1554 8200.0 225.1264 19000.0 225.1639 34000.0 227.1432 27000.0 227.1796 5900.0 229.1586 9800.0 231.1731 6700.0 233.1325 17000.0 233.1538 180000.0 234.1392 8800.0 235.1481 52000.0 236.1563 11000.0 237.1267 4400.0 237.1639 54000.0 239.1433 11000.0 239.1791 15000.0 241.1588 16000.0 245.1313 8000.0 245.1557 4800.0 246.1376 7800.0 246.1625 16000.0 247.1471 24000.0 247.1711 14000.0 248.1554 3300.0 249.1635 53000.0 250.1708 4300.0 251.1442 6800.0 251.179 30000.0 253.1591 20000.0 253.1948 6400.0 255.174 120000.0 257.1885 5500.0 259.1478 16000.0 260.1546 9600.0 261.1637 39000.0 263.1488 2400.0 263.1793 31000.0 264.1871 2900.0 265.1583 14000.0 265.1953 22000.0 267.1746 19000.0 268.1811 7700.0 269.1899 17000.0 270.1961 5300.0 271.2029 6400.0 273.1606 4500.0 273.1871 18000.0 275.1795 27000.0 277.1955 18000.0 279.1746 17000.0 279.2095 5800.0 281.1901 24000.0 282.1979 4200.0 283.2066 8800.0 285.1862 15000.0 286.1935 15000.0 287.1755 3700.0 287.2033 5400.0 288.0089 2400.0 289.1955 21000.0 291.1739 3200.0 291.2104 4700.0 293.19 14000.0 294.1957 3500.0 295.2061 19000.0 298.1935 5800.0 299.2027 18000.0 301.1944 14000.0 301.585 3100.0 303.2099 3900.0 307.2067 4200.0 311.2005 8700.0 313.1946 2900.0 315.2114 3300.0 317.2249 4400.0 321.2193 5900.0 331.2458 3100.0 333.224 3000.0 337.2539 7300.0 345.2203 3000.0 347.2355 3400.0 349.2507 3100.0 353.2481 2500.0 354.25 2900.0 359.2389 2600.0 361.2523 2800.0 365.2469 12000.0 373.2567 4100.0 399.2673 7800.0 450.2859 2600.0 457.3063 3300.0 575.4084 2500.0 600.1047 2300.0 END IONS BEGIN IONS SCANS=623 PEPMASS=599.4102 CHARGE=1 COLLISION_ENERGY=0.0 67.0538 6800.0 67.9201 2900.0 69.0334 3000.0 69.0697 12000.0 73.9858 2200.0 79.0537 2600.0 79.1844 2300.0 81.0696 42000.0 83.0487 7900.0 83.0849 6200.0 83.1191 2100.0 85.0643 11000.0 87.9212 2300.0 89.8027 3100.0 91.0533 2800.0 93.0696 49000.0 95.049 9900.0 95.0853 37000.0 95.5816 2200.0 97.0643 8200.0 97.0756 2600.0 105.0695 45000.0 107.07 2200.0 107.0852 52000.0 108.6838 2100.0 109.0646 15000.0 109.1007 25000.0 111.0803 2700.0 111.2212 2800.0 119.0852 73000.0 121.0645 6100.0 121.1007 77000.0 121.5321 2300.0 123.0801 37000.0 123.1165 3600.0 125.0591 23000.0 131.0852 26000.0 133.1008 63000.0 135.08 34000.0 135.1165 23000.0 137.0957 47000.0 139.0752 6200.0 141.9198 2600.0 143.085 31000.0 145.1008 79000.0 147.08 92000.0 147.1167 24000.0 149.0956 14000.0 151.0749 50000.0 155.0856 6900.0 156.0924 2700.0 157.1007 75000.0 159.1166 54000.0 161.096 26000.0 161.1318 36000.0 163.1115 54000.0 165.0756 4500.0 165.0908 430000.0 165.1065 5400.0 167.1064 6200.0 169.101 32000.0 171.1166 73000.0 173.0963 14000.0 173.1324 21000.0 173.5289 44000.0 173.5423 18000.0 175.1105 3000.0 175.1476 14000.0 177.091 8700.0 177.1277 3300.0 179.1436 3300.0 181.1009 6800.0 181.122 21000.0 183.1166 60000.0 184.1239 3000.0 185.1324 51000.0 187.1116 7300.0 187.148 13000.0 189.1269 27000.0 191.106 29000.0 191.1422 6800.0 193.1016 2800.0 193.1201 2800.0 195.1166 20000.0 195.1364 9700.0 196.1265 2900.0 197.132 31000.0 199.1121 3000.0 199.1479 4100.0 201.1269 7900.0 203.143 170000.0 207.1163 11000.0 207.1376 35000.0 207.4949 2600.0 209.1322 34000.0 211.1124 6000.0 211.1479 41000.0 213.1284 3200.0 215.1409 2700.0 221.1327 19000.0 221.1536 420000.0 223.148 12000.0 225.1269 3400.0 225.1632 7600.0 229.1584 16000.0 231.1369 15000.0 233.1538 14000.0 235.1472 3500.0 239.1405 6800.0 247.1693 72000.0 261.2152 2600.0 263.1769 3100.0 269.1892 8600.0 281.1908 6500.0 285.1867 11000.0 286.1937 9600.0 287.2008 79000.0 289.2037 2500.0 299.2009 23000.0 311.1999 9100.0 313.216 48000.0 320.1853 2800.0 325.2148 12000.0 327.2315 23000.0 364.2386 3400.0 365.246 14000.0 374.9988 2300.0 377.4676 2500.0 386.5625 2300.0 391.2622 13000.0 413.2686 6700.0 419.2931 18000.0 427.285 36000.0 427.3552 2500.0 453.2978 9200.0 464.7291 2600.0 466.3105 3400.0 507.347 28000.0 509.2549 2900.0 519.3446 8100.0 527.2557 3500.0 527.2679 7300.0 537.2509 2600.0 599.4079 9800.0 END IONS BEGIN IONS SCANS=624 PEPMASS=205.1954 CHARGE=1 COLLISION_ENERGY=0.0 41.0385 61000.0 43.0177 28000.0 43.0542 25000.0 46.1079 2100.0 47.8792 2400.0 49.875 2700.0 50.3413 2500.0 50.5538 2400.0 50.8304 2200.0 51.1156 2100.0 51.5774 2500.0 51.9709 2800.0 52.7485 2500.0 53.0384 15000.0 53.0635 2200.0 53.6527 2500.0 55.054 570000.0 55.1469 2300.0 55.9342 74000.0 56.1964 2400.0 56.6116 2300.0 57.0672 2300.0 57.0696 150000.0 57.5966 2600.0 58.1321 2400.0 58.9156 2700.0 59.8811 2600.0 60.8642 2300.0 61.9183 2000.0 64.7901 2200.0 64.9464 3100.0 67.0539 370000.0 67.1369 2300.0 69.0695 690000.0 71.0853 13000.0 71.5004 2100.0 71.9402 2100.0 72.9368 510000.0 73.0165 2400.0 73.0282 5000.0 75.2977 2400.0 77.0386 5700.0 77.3427 2300.0 78.3343 2300.0 79.0539 380000.0 79.7625 2300.0 81.0695 1300000.0 81.0778 3000.0 83.0852 180000.0 83.4278 2500.0 87.4355 2500.0 88.4507 2500.0 88.9448 2500.0 90.9473 380000.0 91.0539 150000.0 93.0695 1600000.0 93.0759 3600.0 93.8354 2300.0 95.049 36000.0 95.0851 750000.0 97.1008 92000.0 99.5551 2300.0 99.9476 96000.0 101.0368 2200.0 101.051 2700.0 101.4075 2400.0 105.0695 140000.0 107.0851 1000000.0 107.093 2400.0 107.8701 2300.0 107.9505 2300.0 108.958 19000.0 109.0642 8100.0 109.0927 9200.0 109.1008 540000.0 111.1165 8200.0 113.4175 2900.0 113.9549 23000.0 113.9634 1000000.0 115.9426 17000.0 116.6696 2200.0 119.0854 38000.0 119.5101 2300.0 121.0911 15000.0 121.1008 1700000.0 121.1096 3800.0 121.1112 18000.0 123.0801 680000.0 123.1165 220000.0 125.1416 2300.0 126.7327 2500.0 128.9506 8500.0 130.7547 2200.0 131.0065 2200.0 131.974 150000.0 133.0752 2600.0 133.101 4200.0 133.9534 17000.0 134.2393 2400.0 135.1057 5100.0 135.1165 390000.0 135.7225 2200.0 137.1324 16000.0 141.699 2300.0 143.3799 2400.0 147.1165 2700.0 149.1203 3200.0 149.1322 470000.0 152.2987 2700.0 154.9891 8100.0 163.1109 3100.0 163.1479 50000.0 173.0385 2400.0 173.5207 8800.0 173.5344 97000.0 174.3778 2500.0 175.495 2200.0 181.4495 2500.0 182.2106 2300.0 185.2526 2300.0 186.5117 2600.0 198.4708 2400.0 202.117 2700.0 205.1946 17000.0 210.4762 2400.0 215.5585 2900.0 END IONS BEGIN IONS SCANS=625 PEPMASS=299.1647 CHARGE=1 COLLISION_ENERGY=0.0 52.372 2300.0 52.8867 2400.0 54.1142 2500.0 55.0176 5000.0 55.0541 12000.0 55.5438 2200.0 59.1508 2400.0 64.6611 2200.0 67.0539 22000.0 69.0695 14000.0 75.8948 2800.0 77.0382 6900.0 79.0538 26000.0 81.0654 2300.0 81.0695 72000.0 82.3015 2400.0 83.649 2600.0 91.0539 28000.0 93.0695 60000.0 95.0488 11000.0 95.0852 38000.0 97.0646 11000.0 100.8276 2200.0 101.3878 2400.0 105.0695 34000.0 107.0487 49000.0 107.0851 45000.0 109.0646 18000.0 109.1007 18000.0 111.0802 10000.0 117.0697 6600.0 119.0484 2500.0 119.0853 16000.0 121.0643 17000.0 121.1005 9500.0 122.9245 2500.0 123.0799 29000.0 123.1163 13000.0 127.0752 6100.0 131.0849 15000.0 133.0279 150000.0 133.0644 35000.0 133.1011 14000.0 134.036 2600.0 135.0436 230000.0 145.0645 21000.0 145.1003 13000.0 146.1089 3200.0 147.0436 23000.0 147.0799 30000.0 147.1163 30000.0 149.0592 28000.0 149.0714 3200.0 151.0385 88000.0 154.1045 2700.0 157.0642 7900.0 158.0718 7100.0 159.0802 20000.0 159.1166 8500.0 161.0594 12000.0 161.0958 21000.0 165.1272 33000.0 171.0807 6500.0 173.0603 4400.0 173.0962 7800.0 173.5249 17000.0 173.5382 23000.0 173.5441 6100.0 175.075 13000.0 175.1113 5200.0 177.0542 13000.0 183.0809 7500.0 185.0957 8100.0 187.0751 16000.0 189.0904 29000.0 196.3156 2400.0 197.096 7200.0 197.3538 2800.0 199.0755 10000.0 201.0909 26000.0 205.0871 2400.0 211.1113 6300.0 213.0906 7600.0 231.1017 2400.0 235.6292 2600.0 243.1379 3200.0 246.8831 2300.0 269.1507 3000.0 281.1544 8400.0 282.2785 7900.0 284.067 7100.0 299.0913 42000.0 299.1642 26000.0 302.5746 2600.0 END IONS BEGIN IONS SCANS=626 PEPMASS=264.2325 CHARGE=1 COLLISION_ENERGY=0.0 46.0813 2500.0 47.5349 2300.0 47.6225 2300.0 48.4984 2200.0 48.9112 2100.0 49.4122 2300.0 51.9094 2600.0 52.1928 2800.0 52.5126 3000.0 53.7081 2500.0 54.3473 2100.0 55.0541 120000.0 55.8488 2400.0 57.0697 92000.0 57.079 2300.0 57.7449 2500.0 57.8516 2900.0 59.2143 2300.0 59.2435 2400.0 59.5029 2200.0 60.0403 3900.0 60.0442 3600000.0 60.0477 14000.0 60.0495 13000.0 61.529 2500.0 62.0965 2100.0 62.1637 2000.0 62.5531 3000.0 62.6107 2200.0 63.2561 2700.0 66.7856 2300.0 67.0539 120000.0 67.4702 2200.0 67.5841 2400.0 67.6054 2400.0 68.5949 2300.0 68.7177 2200.0 69.0695 360000.0 69.9401 2200.0 71.0852 19000.0 73.3998 2300.0 75.3221 5300.0 75.703 2700.0 76.1899 2400.0 78.8609 2300.0 79.0539 140000.0 79.169 2400.0 81.0695 1600000.0 81.0779 6300.0 81.7978 2200.0 82.6939 2100.0 83.0852 120000.0 83.2827 2200.0 84.9842 2300.0 85.4463 2500.0 85.7013 2400.0 89.2271 2900.0 90.7113 2200.0 91.054 34000.0 91.0696 2600.0 91.1984 2300.0 93.0695 860000.0 93.08 2400.0 93.46 2100.0 93.7408 2300.0 94.7366 2800.0 95.049 2600.0 95.0852 750000.0 97.1009 120000.0 97.8524 2500.0 99.623 2800.0 99.7354 2300.0 100.7656 2400.0 101.1238 2400.0 104.7359 2400.0 105.0697 39000.0 105.1368 2900.0 106.6647 2400.0 107.0852 650000.0 107.7607 2500.0 109.0927 8000.0 109.1008 680000.0 111.1166 35000.0 112.9835 2800.0 119.0853 8400.0 121.0911 10000.0 121.1008 4100000.0 121.1108 81000.0 123.1165 310000.0 125.9048 3100.0 133.0754 2500.0 134.9902 2500.0 135.1056 3100.0 135.1166 510000.0 136.5186 2100.0 137.1325 40000.0 137.6593 2300.0 139.3848 2300.0 141.0242 2200.0 143.0687 2500.0 143.1009 2900.0 146.2566 2600.0 147.1165 2300.0 147.3808 2500.0 149.1187 12000.0 149.1322 1400000.0 149.1462 35000.0 154.0448 2300.0 159.6176 2500.0 160.4654 2600.0 160.9837 2300.0 163.148 86000.0 163.1921 2300.0 167.9282 2400.0 172.8156 2300.0 173.5251 100000.0 173.5405 88000.0 174.7906 2400.0 176.6153 2400.0 177.1633 2600.0 180.0822 3000.0 188.2152 2400.0 189.1636 11000.0 201.6203 2300.0 201.6333 2600.0 202.9428 2300.0 205.1735 4200.0 205.1952 630000.0 206.1892 6100.0 206.9037 2500.0 208.1902 2300.0 209.2717 2400.0 211.1234 2300.0 218.3739 2900.0 218.5443 2300.0 219.4278 2400.0 223.3028 2800.0 223.4959 2400.0 236.0699 2700.0 248.5489 2400.0 258.8523 2400.0 263.3905 2500.0 264.2323 170000.0 266.6282 2300.0 END IONS BEGIN IONS SCANS=627 PEPMASS=355.227 CHARGE=1 COLLISION_ENERGY=0.0 55.054 29000.0 57.0696 9300.0 57.1806 2200.0 64.0727 2400.0 66.6923 2300.0 66.9409 2300.0 67.0539 25000.0 69.0695 40000.0 69.5082 2300.0 70.0274 2400.0 70.5678 2400.0 74.2722 2300.0 78.552 2700.0 79.0539 35000.0 81.0695 220000.0 83.0851 37000.0 84.4419 2600.0 89.2665 2100.0 91.0539 31000.0 93.0639 3200.0 93.0695 130000.0 95.0793 2800.0 95.0852 150000.0 97.0566 2600.0 97.101 23000.0 97.2841 2500.0 99.6631 2500.0 104.9527 2200.0 105.0337 5800.0 105.0696 43000.0 107.0852 200000.0 109.0648 4100.0 109.1009 170000.0 111.5654 2400.0 111.8433 2700.0 116.065 2400.0 117.2371 2400.0 119.0852 51000.0 121.0647 13000.0 121.1009 180000.0 123.1165 44000.0 123.6467 2400.0 129.9955 2200.0 133.101 56000.0 135.0437 27000.0 135.1166 280000.0 137.0599 9100.0 137.132 2900.0 142.4939 2600.0 145.1002 3200.0 147.044 17000.0 147.0803 13000.0 147.1166 29000.0 149.0594 3400.0 149.1323 92000.0 159.0441 28000.0 159.0809 12000.0 160.0859 2500.0 161.0593 6000.0 161.1318 12000.0 163.148 78000.0 165.0546 1500000.0 173.06 25000.0 173.0958 11000.0 173.5231 7000.0 173.5383 44000.0 174.1901 2500.0 175.0745 3700.0 175.1488 17000.0 177.0549 14000.0 177.1641 40000.0 179.0704 91000.0 185.0598 3500.0 185.1289 2500.0 187.0755 37000.0 189.0544 20000.0 189.1637 47000.0 190.1716 16000.0 191.07 36000.0 191.1795 55000.0 191.963 2300.0 193.0862 15000.0 201.0913 59000.0 203.0706 20000.0 204.8893 6800.0 205.0865 21000.0 207.1023 10000.0 213.0912 2900.0 214.8733 19000.0 215.1068 24000.0 217.0863 20000.0 218.8677 23000.0 219.1025 13000.0 220.8834 2400.0 227.1073 13000.0 231.1025 18000.0 233.1164 6100.0 239.1072 12000.0 241.1237 3800.0 243.1021 3000.0 245.1178 6700.0 251.9489 2400.0 253.1228 6300.0 257.1182 2400.0 258.8619 2400.0 259.1335 2800.0 267.1375 9700.0 273.1499 7300.0 275.166 2700.0 285.1494 4100.0 290.8906 10000.0 299.1628 3700.0 308.9008 50000.0 323.2004 11000.0 326.313 3000.0 355.2271 28000.0 END IONS BEGIN IONS SCANS=628 PEPMASS=411.2148 CHARGE=1 COLLISION_ENERGY=0.0 60.2982 2300.0 62.0041 2500.0 62.1468 2300.0 63.0519 2300.0 63.2006 2800.0 63.3833 2300.0 63.6888 2400.0 64.1256 2600.0 67.6932 2500.0 69.6908 2400.0 71.2496 2300.0 74.2731 2700.0 74.9062 2300.0 77.7409 2300.0 78.7723 2500.0 80.1531 2200.0 83.7461 2500.0 94.4819 2700.0 96.5711 2400.0 100.6726 2400.0 101.6628 2500.0 103.664 2100.0 104.8407 2300.0 106.0202 2300.0 109.7803 2500.0 110.3562 2300.0 119.2353 2400.0 120.6856 2200.0 123.2734 2500.0 124.9073 2200.0 127.9316 2500.0 129.9811 2100.0 135.6397 2100.0 138.2154 2200.0 149.67 3000.0 149.6907 5300.0 151.886 2500.0 162.0596 2500.0 173.5258 37000.0 173.5394 62000.0 175.9232 2300.0 176.2673 2800.0 179.0222 4700.0 188.1241 2400.0 199.5736 3100.0 213.1121 2800.0 233.8964 2800.0 253.5022 2800.0 290.8211 2500.0 309.0342 2800.0 309.111 2900.0 311.0836 4100.0 311.1252 550000.0 311.1688 3100.0 324.8521 2400.0 351.8542 2200.0 360.2663 2400.0 379.189 22000.0 411.2142 270000.0 413.1755 2700.0 END IONS BEGIN IONS SCANS=629 PEPMASS=689.2459 CHARGE=1 COLLISION_ENERGY=0.0 68.0769 2300.0 71.4699 15000.0 71.4731 4900.0 72.2681 2200.0 73.8571 2500.0 80.8306 2100.0 83.0075 2500.0 83.6949 2200.0 86.7325 2200.0 94.2346 2000.0 95.2003 2300.0 99.5501 2300.0 104.1689 2200.0 104.2565 2500.0 109.8703 2400.0 123.4786 2300.0 123.4914 2400.0 125.1067 2400.0 128.9392 2300.0 158.0413 2100.0 159.3585 2500.0 173.526 77000.0 173.5431 37000.0 181.4966 2400.0 182.6078 2600.0 234.5079 2600.0 258.9836 2700.0 262.0491 2700.0 282.0371 2500.0 399.1399 3300.0 400.1533 68000.0 401.1614 3100.0 414.1684 26000.0 415.1736 7600.0 427.1771 8600.0 428.1845 41000.0 429.1922 350000.0 429.2436 3500.0 441.1939 3800.0 442.1636 20000.0 443.1723 2500.0 444.1419 16000.0 447.2023 14000.0 450.305 2600.0 455.1707 70000.0 456.1796 37000.0 457.1867 140000.0 458.1941 29000.0 459.1663 13000.0 469.1875 4300.0 472.172 23000.0 473.1018 3700.0 473.1818 360000.0 473.2601 5100.0 474.1888 11000.0 475.1976 5000.0 480.1904 2500.0 482.1621 3000.0 483.1663 95000.0 484.2088 34000.0 485.181 9000.0 486.2274 4200.0 487.162 39000.0 491.1925 19000.0 497.1797 16000.0 499.1602 29000.0 500.1692 43000.0 501.054 3200.0 501.1765 650000.0 501.2424 2100.0 502.1847 170000.0 509.1842 10000.0 510.1581 3800.0 511.1952 58000.0 512.2038 37000.0 513.1389 2900.0 514.1867 18000.0 519.1835 20000.0 525.1765 2400.0 527.1558 120000.0 528.1587 2600.0 528.1754 4400.0 529.2138 18000.0 530.2517 250000.0 537.1762 20000.0 538.1816 4600.0 539.1924 270000.0 540.1948 150000.0 541.2421 3600.0 542.185 12000.0 543.2237 25000.0 555.2228 14000.0 556.2326 8400.0 557.2383 380000.0 558.247 590000.0 558.3915 3700.0 560.2278 14000.0 569.2031 40000.0 571.2151 11000.0 573.2261 24000.0 574.2408 270000.0 583.2162 34000.0 584.224 31000.0 585.1248 5500.0 585.2346 930000.0 586.2372 220000.0 587.2143 31000.0 597.2009 8100.0 599.2509 9300.0 600.2197 20000.0 601.2273 120000.0 602.2373 1900000.0 602.4639 11000.0 604.2172 3600.0 611.2107 11000.0 612.2208 9500.0 615.2421 150000.0 622.9518 3100.0 627.2485 4100.0 628.2154 27000.0 629.2235 65000.0 630.229 3400.0 643.1159 5300.0 643.2391 450000.0 671.2346 71000.0 END IONS BEGIN IONS SCANS=630 PEPMASS=583.4154 CHARGE=1 COLLISION_ENERGY=0.0 65.9705 2300.0 67.0539 71000.0 67.1798 2200.0 69.0334 11000.0 69.0696 100000.0 69.9117 2500.0 71.5991 2500.0 71.6639 2500.0 72.1339 2300.0 74.6614 3000.0 78.4427 2800.0 78.8343 2900.0 79.0539 72000.0 81.0695 260000.0 82.1101 2300.0 82.6625 2600.0 83.0488 44000.0 83.0852 64000.0 85.0645 45000.0 86.0062 2200.0 86.1595 2200.0 86.6415 2300.0 87.1407 2600.0 88.0523 2300.0 88.7092 2500.0 89.9858 2200.0 90.8684 2800.0 91.0539 74000.0 93.0695 340000.0 93.185 2300.0 95.0489 45000.0 95.0852 300000.0 95.9116 2300.0 97.0646 38000.0 105.05 2200.0 105.0695 270000.0 107.0851 410000.0 107.8337 2300.0 109.0646 60000.0 109.1008 260000.0 111.0799 21000.0 117.0695 33000.0 119.0765 9700.0 119.0851 700000.0 120.8886 2800.0 121.0641 17000.0 121.0923 3800.0 121.1008 450000.0 123.08 98000.0 123.1164 85000.0 125.0594 49000.0 129.0696 18000.0 131.0851 190000.0 133.0643 13000.0 133.0903 15000.0 133.1009 440000.0 135.0801 110000.0 135.0915 2500.0 135.1075 2800.0 135.1165 300000.0 135.2499 2400.0 135.3316 2300.0 137.059 3500.0 137.0958 130000.0 139.075 75000.0 139.1118 8200.0 142.0768 5600.0 143.0852 170000.0 144.0933 5300.0 145.0888 8800.0 145.1009 540000.0 147.0801 160000.0 147.1165 200000.0 149.0957 120000.0 149.1081 2400.0 149.1321 46000.0 151.075 220000.0 151.1113 10000.0 151.1477 6200.0 153.0907 32000.0 155.085 43000.0 156.093 30000.0 157.1008 380000.0 158.1084 8500.0 159.0804 32000.0 159.1166 380000.0 160.1252 5100.0 161.0958 88000.0 161.1323 140000.0 163.1115 140000.0 163.1474 2500.0 165.0908 630000.0 165.1262 2800.0 167.0852 2900.0 169.1011 180000.0 170.1091 16000.0 171.1166 300000.0 172.1248 2700.0 172.9016 2500.0 173.0961 49000.0 173.1324 310000.0 173.5251 4500.0 173.5283 120000.0 173.5424 34000.0 175.1118 53000.0 175.1312 2400.0 175.148 260000.0 177.091 51000.0 177.1095 3000.0 177.1272 39000.0 179.0863 3900.0 179.1054 7300.0 181.1013 57000.0 181.1214 50000.0 182.108 14000.0 183.1167 250000.0 184.1243 22000.0 185.0735 2600.0 185.0949 5200.0 185.1324 210000.0 187.1115 39000.0 187.1479 170000.0 189.1273 100000.0 191.1064 29000.0 191.1428 57000.0 193.1016 31000.0 193.122 12000.0 193.8848 2100.0 194.1083 14000.0 195.1166 160000.0 195.1361 34000.0 196.1245 34000.0 196.5226 2600.0 197.1323 230000.0 198.1395 3000.0 199.1119 37000.0 199.1482 110000.0 201.1275 35000.0 201.1637 130000.0 201.2344 2500.0 203.1074 2900.0 203.1429 270000.0 205.1223 17000.0 205.1588 3600.0 207.1168 73000.0 207.138 180000.0 208.1244 11000.0 209.1323 250000.0 209.1535 16000.0 210.1396 6700.0 211.1115 43000.0 211.1481 150000.0 212.1572 2700.0 213.1275 42000.0 213.1639 34000.0 215.1431 30000.0 217.1225 11000.0 217.1589 31000.0 219.1168 9800.0 219.1745 2800.0 220.1238 6100.0 221.1322 70000.0 221.1537 460000.0 222.1395 6100.0 223.1102 3800.0 223.1481 120000.0 224.1542 3400.0 225.1271 19000.0 225.1639 90000.0 227.143 59000.0 227.1795 22000.0 229.1221 39000.0 229.1589 15000.0 230.1663 2900.0 231.138 8100.0 233.1315 30000.0 233.1547 35000.0 235.1479 93000.0 237.1269 6400.0 237.1638 80000.0 238.1335 2600.0 239.1408 7900.0 239.1795 39000.0 241.1585 16000.0 241.1951 16000.0 243.1361 5800.0 243.174 14000.0 245.1306 2800.0 247.1463 31000.0 247.1708 32000.0 249.1638 58000.0 250.1715 12000.0 251.1435 6500.0 251.1794 36000.0 253.1581 3100.0 253.1951 11000.0 255.1377 7600.0 255.1734 6300.0 257.1902 6300.0 259.147 9600.0 259.2063 5800.0 259.2546 2600.0 261.1607 14000.0 261.1868 31000.0 263.1791 36000.0 265.1616 7600.0 265.195 75000.0 267.1385 2800.0 267.1739 20000.0 267.2094 9700.0 269.1512 2800.0 269.1894 27000.0 271.1697 4100.0 273.164 6700.0 275.1794 35000.0 277.1595 5700.0 277.1964 2700.0 279.175 2900.0 279.2112 3500.0 281.1902 11000.0 282.2785 6600.0 283.2055 76000.0 283.2826 23000.0 285.1851 86000.0 285.2162 2600.0 286.193 40000.0 287.2014 69000.0 289.1947 7200.0 291.1781 2800.0 291.2108 3400.0 293.1909 21000.0 293.2278 3200.0 295.2072 3300.0 296.0434 2700.0 297.2219 6800.0 299.2006 38000.0 303.1765 3900.0 303.2129 3100.0 305.1906 3100.0 311.199 28000.0 311.2377 7500.0 312.2094 3200.0 315.2115 2500.0 323.2055 2600.0 325.2166 7600.0 337.2184 2800.0 338.224 13000.0 349.2156 24000.0 352.6146 2400.0 353.2481 45000.0 357.2618 3000.0 357.8337 2700.0 364.2399 68000.0 375.2694 10000.0 377.2466 10000.0 385.2743 53000.0 399.2893 62000.0 425.3048 44000.0 438.3067 3300.0 451.3181 2900.0 451.4883 2300.0 473.3389 15000.0 477.3412 2900.0 491.2689 5200.0 491.3521 650000.0 491.4294 9500.0 504.3595 18000.0 556.9847 2800.0 574.2989 2800.0 583.4153 95000.0 END IONS BEGIN IONS SCANS=631 PEPMASS=205.1954 CHARGE=1 COLLISION_ENERGY=0.0 41.0385 170000.0 43.0177 4100.0 43.0541 91000.0 49.6685 2500.0 53.0384 76000.0 53.098 2200.0 55.054 1100000.0 55.0572 9800.0 55.9343 36000.0 57.0696 290000.0 57.4638 2500.0 58.8791 2200.0 62.0598 2300.0 63.0874 2200.0 63.9278 2100.0 65.0383 19000.0 66.2479 2300.0 66.7066 2300.0 67.0539 790000.0 67.0581 4800.0 67.7337 3000.0 67.9223 2100.0 68.7379 2600.0 69.0697 1700000.0 69.0739 15000.0 69.076 10000.0 71.0852 62000.0 71.5748 2800.0 72.5341 2600.0 72.9368 280000.0 73.4464 2200.0 74.9056 2300.0 75.9974 2500.0 76.5752 2300.0 77.0384 55000.0 79.054 1200000.0 79.0594 7200.0 81.0697 4500000.0 81.0781 25000.0 81.0782 71000.0 81.0806 13000.0 83.0852 300000.0 83.6063 2600.0 88.8478 2200.0 89.7196 2700.0 90.942 3000.0 90.9474 210000.0 91.0539 510000.0 92.2724 2400.0 93.0697 5400000.0 93.0765 27000.0 93.0801 67000.0 93.0831 16000.0 93.0873 7900.0 95.0489 140000.0 95.0853 1600000.0 95.0924 6700.0 95.2994 2600.0 96.6001 2400.0 97.0943 2800.0 97.1009 180000.0 99.0199 2100.0 99.9477 57000.0 103.0539 15000.0 105.0443 53000.0 105.0617 4700.0 105.0695 440000.0 106.0776 26000.0 107.0853 2200000.0 107.0929 9400.0 107.0969 18000.0 107.5879 2600.0 109.0645 60000.0 109.0928 16000.0 109.1009 950000.0 111.1166 31000.0 112.8035 2300.0 113.9634 570000.0 114.6771 2500.0 115.9429 3600.0 119.06 16000.0 119.0852 100000.0 121.1009 6500000.0 121.1096 96000.0 121.1185 41000.0 121.1209 17000.0 121.1275 8000.0 123.0801 380000.0 123.1165 430000.0 125.9606 2500.0 126.3159 2600.0 127.3089 2700.0 128.9514 2700.0 129.2522 2400.0 130.8366 2800.0 131.974 71000.0 133.0758 13000.0 133.1014 11000.0 133.9534 3000.0 135.1166 620000.0 135.1273 3200.0 137.1323 52000.0 137.2617 2600.0 141.9244 2800.0 145.5622 2300.0 147.1163 17000.0 149.1183 6200.0 149.1323 1200000.0 149.1447 22000.0 154.2625 2400.0 163.148 100000.0 173.5312 54000.0 173.5405 4600.0 176.4065 2500.0 177.9719 3300.0 205.1948 37000.0 END IONS BEGIN IONS SCANS=632 PEPMASS=264.2325 CHARGE=1 COLLISION_ENERGY=0.0 45.914 2300.0 47.3077 2700.0 51.0142 2200.0 51.0232 2400.0 51.3412 2300.0 53.0385 38000.0 54.4206 2000.0 54.4498 2300.0 55.054 490000.0 56.1255 2100.0 57.0697 260000.0 57.459 2700.0 58.5787 2100.0 60.0443 16000000.0 60.0479 93000.0 60.0513 55000.0 60.0533 25000.0 60.0537 150000.0 60.0556 10000.0 60.5062 2400.0 61.4431 2300.0 62.516 2400.0 65.0386 14000.0 66.4452 2700.0 67.0539 440000.0 67.7319 2800.0 68.5072 2400.0 69.0696 1300000.0 69.0738 9500.0 69.076 8000.0 70.1427 2900.0 71.0853 110000.0 72.6987 5000.0 74.4697 2800.0 77.0387 35000.0 79.0539 680000.0 81.0696 6300000.0 81.0782 38000.0 81.0786 110000.0 81.0805 21000.0 81.8747 2300.0 83.0805 8600.0 83.0852 390000.0 86.6375 3100.0 86.8393 2600.0 89.3142 2200.0 89.5651 2500.0 91.0481 8100.0 91.054 210000.0 93.0696 4000000.0 93.08 20000.0 93.08 40000.0 95.049 56000.0 95.0852 2200000.0 95.0925 15000.0 97.0943 6800.0 97.1009 360000.0 105.0444 18000.0 105.0696 210000.0 106.078 5200.0 107.0852 2300000.0 107.0945 4000.0 109.0644 4000.0 109.0928 5200.0 109.1009 1800000.0 109.1102 3800.0 111.1165 150000.0 111.688 2100.0 114.8274 5300.0 116.8216 5000.0 119.0853 51000.0 120.5478 2600.0 121.0898 6300.0 121.1009 17000000.0 121.1116 350000.0 121.1215 51000.0 121.1221 150000.0 121.1282 25000.0 121.1327 7900.0 122.1117 2800.0 123.0803 37000.0 123.1165 880000.0 124.312 2400.0 125.1321 7700.0 126.0303 2800.0 129.5037 2500.0 133.0758 4400.0 133.1009 7600.0 135.1055 5100.0 135.1166 1400000.0 135.1267 9700.0 137.1323 110000.0 147.1172 9400.0 149.1323 3900000.0 149.145 22000.0 149.1606 3900.0 159.0632 5800.0 160.8675 2900.0 161.1333 2900.0 163.148 300000.0 165.0365 2200.0 169.9498 2400.0 171.8872 2800.0 173.5288 66000.0 173.5414 24000.0 177.1634 18000.0 189.1646 3000.0 205.1952 560000.0 255.9059 2400.0 258.9587 3200.0 259.6519 2500.0 264.2322 68000.0 END IONS BEGIN IONS SCANS=633 PEPMASS=371.222 CHARGE=1 COLLISION_ENERGY=0.0 53.9955 2200.0 55.0541 23000.0 57.0569 2200.0 57.0697 17000.0 59.049 11000.0 59.5685 2100.0 60.1286 2300.0 65.4121 2400.0 67.0541 18000.0 68.2456 2800.0 68.4622 2300.0 69.0695 66000.0 69.218 2200.0 70.5805 2100.0 79.0539 5300.0 81.0696 54000.0 82.8822 2300.0 83.0493 2400.0 83.0853 13000.0 93.0696 49000.0 95.0851 73000.0 97.0644 25000.0 99.0804 2300.0 101.0593 35000.0 105.0696 35000.0 107.0489 31000.0 107.0852 59000.0 107.5494 2500.0 109.0645 4200.0 109.1008 60000.0 111.0436 27000.0 111.0802 3300.0 111.1165 48000.0 118.6872 2700.0 119.0852 23000.0 121.0647 9600.0 121.1008 39000.0 123.1164 20000.0 129.0544 17000.0 131.0856 3500.0 131.5626 2400.0 133.0281 37000.0 133.0647 14000.0 133.1009 33000.0 135.0437 89000.0 135.08 39000.0 135.1164 22000.0 136.4912 2800.0 137.1321 6300.0 143.0848 2600.0 145.0644 4100.0 145.1008 35000.0 145.9708 2600.0 147.0439 7200.0 147.08 19000.0 147.1164 28000.0 149.0595 51000.0 149.0961 5800.0 149.1322 34000.0 149.6721 2500.0 151.0386 21000.0 151.1114 6500.0 157.0645 9800.0 157.0994 3500.0 159.0434 2700.0 159.0799 11000.0 159.1176 4000.0 161.0962 4100.0 161.1328 2800.0 163.0756 3200.0 165.0544 310000.0 167.1426 6700.0 171.0802 2500.0 173.0596 22000.0 173.0969 2700.0 173.1328 6200.0 173.5284 61000.0 173.542 16000.0 175.0753 16000.0 175.1111 6200.0 175.1477 4000.0 179.0699 7300.0 182.6445 2300.0 185.0595 34000.0 185.0959 12000.0 186.2966 2300.0 187.0752 14000.0 187.1488 2800.0 188.1564 5800.0 189.0551 29000.0 189.0906 16000.0 189.1642 8700.0 191.07 9000.0 193.9335 2500.0 197.0972 2300.0 197.2578 2400.0 199.0763 2700.0 201.0905 33000.0 203.0702 35000.0 203.1066 5900.0 205.0862 31000.0 209.0972 3100.0 211.0757 3000.0 213.0911 63000.0 215.1077 8700.0 217.0861 78000.0 227.0698 3300.0 227.1057 3000.0 228.6764 2600.0 229.0859 24000.0 231.1018 28000.0 239.1051 3000.0 240.3225 2700.0 241.1225 2800.0 243.1016 11000.0 243.1386 3700.0 244.0469 3000.0 245.1179 4200.0 255.1371 3300.0 257.1172 60000.0 269.1198 3000.0 269.1519 3300.0 271.1326 4000.0 279.9292 2700.0 280.3512 2700.0 281.1552 6000.0 296.8279 2800.0 297.1509 2700.0 321.1848 22000.0 339.1956 89000.0 357.2061 35000.0 END IONS BEGIN IONS SCANS=634 PEPMASS=599.4102 CHARGE=1 COLLISION_ENERGY=0.0 63.4366 2700.0 67.054 13000.0 69.0332 13000.0 69.0696 6000.0 78.252 2500.0 79.054 5400.0 79.7924 2300.0 81.0695 56000.0 83.0489 13000.0 83.0854 11000.0 83.6373 2200.0 85.0648 6700.0 91.0542 19000.0 93.0695 81000.0 94.7863 2200.0 95.049 19000.0 95.0852 70000.0 97.0645 13000.0 97.1005 2900.0 104.0937 2300.0 104.7893 2300.0 105.0696 61000.0 106.9868 2400.0 107.0851 57000.0 109.0646 21000.0 109.1009 24000.0 111.0799 5200.0 114.8844 2600.0 115.3301 2100.0 115.7408 2400.0 117.0702 3000.0 119.0851 100000.0 121.0648 12000.0 121.1007 110000.0 121.6661 2700.0 123.0799 54000.0 123.1161 6300.0 123.155 2400.0 125.0594 37000.0 129.0697 5500.0 131.0852 29000.0 131.5155 2400.0 133.1008 72000.0 135.0801 64000.0 135.1165 41000.0 137.0957 79000.0 139.0751 28000.0 141.0707 2900.0 141.604 2600.0 143.0852 34000.0 143.1776 2400.0 145.1009 89000.0 147.0801 150000.0 147.1166 26000.0 149.0958 24000.0 149.8395 2400.0 151.075 84000.0 153.0913 5000.0 155.0845 12000.0 157.1009 100000.0 159.0801 3100.0 159.1165 74000.0 161.0959 37000.0 161.1321 62000.0 163.1115 94000.0 165.0907 730000.0 167.1076 5800.0 169.101 35000.0 170.1099 6300.0 171.1166 91000.0 173.0961 26000.0 173.1321 23000.0 173.5215 8500.0 173.5275 39000.0 173.5403 48000.0 175.1118 7600.0 175.1483 24000.0 177.0912 20000.0 177.127 8000.0 179.1063 5400.0 179.143 9600.0 179.818 2400.0 181.1024 8400.0 181.1222 44000.0 183.1168 88000.0 185.1322 75000.0 187.1118 20000.0 187.1478 25000.0 189.1271 42000.0 190.8349 2500.0 191.1066 42000.0 191.1429 13000.0 195.1172 25000.0 195.1364 3000.0 196.1241 3400.0 197.1321 41000.0 199.1126 7300.0 199.1481 3700.0 201.1278 10000.0 203.1429 290000.0 203.164 2500.0 205.1221 3500.0 207.118 2800.0 207.138 53000.0 209.1325 35000.0 209.155 2500.0 211.1124 2900.0 211.1482 54000.0 213.1277 12000.0 215.1431 12000.0 217.1573 2700.0 221.1341 18000.0 221.1536 720000.0 223.1491 14000.0 225.1267 8600.0 225.1637 15000.0 227.144 8500.0 227.1788 10000.0 229.159 28000.0 231.1378 24000.0 233.1539 17000.0 237.1658 8800.0 239.1427 3200.0 240.7392 2300.0 243.1386 6500.0 247.1437 3500.0 247.1692 150000.0 257.1544 3500.0 263.178 3700.0 267.8703 2600.0 268.1785 2800.0 268.4777 2900.0 269.1904 16000.0 271.1694 9700.0 273.1823 2400.0 281.1898 11000.0 283.7058 2800.0 285.1852 15000.0 286.1929 13000.0 287.2006 110000.0 289.1942 2800.0 291.1754 5800.0 293.1883 2500.0 297.4912 2300.0 298.1924 2400.0 299.2008 37000.0 309.184 2800.0 311.2005 27000.0 312.2089 3700.0 313.2164 35000.0 325.2162 14000.0 327.2321 51000.0 339.2896 12000.0 365.2464 29000.0 391.2628 23000.0 413.2697 32000.0 419.2948 39000.0 427.2848 70000.0 453.2999 11000.0 505.967 2800.0 507.3449 2800.0 519.345 23000.0 557.8373 2800.0 599.4114 19000.0 END IONS BEGIN IONS SCANS=635 PEPMASS=311.2585 CHARGE=1 COLLISION_ENERGY=0.0 49.1419 2500.0 53.0384 2800.0 55.0176 3500.0 55.0539 260000.0 57.0332 100000.0 57.0696 130000.0 58.8871 2400.0 67.0539 27000.0 69.0695 260000.0 69.0739 4800.0 71.0851 48000.0 71.6861 2200.0 78.7076 2300.0 79.0539 17000.0 80.9298 2300.0 81.0695 42000.0 83.0851 190000.0 85.1008 17000.0 93.0695 27000.0 95.0851 25000.0 96.2531 3100.0 97.0644 20000.0 97.0944 3500.0 97.1008 120000.0 107.0852 19000.0 109.1008 4600.0 111.0803 4500.0 111.1165 19000.0 113.5171 2600.0 121.101 21000.0 135.1167 14000.0 136.2436 2500.0 144.8543 3100.0 173.5273 51000.0 173.544 7200.0 175.5305 2500.0 209.1168 14000.0 215.7284 2600.0 225.9283 2800.0 246.95 8400.0 311.2598 2600.0 END IONS BEGIN IONS SCANS=636 PEPMASS=298.2382 CHARGE=1 COLLISION_ENERGY=0.0 55.0539 26000.0 57.0696 68000.0 59.7654 2300.0 60.7347 2300.0 62.3796 2100.0 63.0147 2600.0 64.6018 2300.0 68.4547 2200.0 71.0852 8900.0 76.8542 2800.0 79.0537 2600.0 83.0109 2200.0 83.0853 12000.0 83.1576 2200.0 85.1011 3000.0 89.0593 70000.0 91.0539 280000.0 93.6808 2800.0 95.6319 2300.0 101.0959 13000.0 106.1509 2400.0 107.0699 33000.0 108.2099 2800.0 119.0851 1100000.0 119.0936 17000.0 123.7454 2100.0 137.5153 2900.0 143.1003 2300.0 145.3641 2400.0 147.8305 2400.0 155.4461 2700.0 158.1902 2700.0 163.1327 13000.0 168.8308 2000.0 173.5196 7700.0 173.5298 38000.0 173.5428 13000.0 174.2766 2400.0 181.4631 2200.0 192.5168 2600.0 196.9294 3200.0 271.2422 2700.0 298.3472 61000.0 END IONS BEGIN IONS SCANS=637 PEPMASS=205.1954 CHARGE=1 COLLISION_ENERGY=0.0 41.0385 150000.0 43.0178 3600.0 43.0541 67000.0 53.0384 54000.0 55.0176 3800.0 55.0541 1600000.0 55.0572 14000.0 55.0587 12000.0 55.9342 25000.0 57.0696 430000.0 61.7686 3000.0 65.0383 14000.0 66.7253 2600.0 67.0539 900000.0 67.0582 4800.0 67.0603 4700.0 69.0697 2000000.0 69.0739 18000.0 69.0762 11000.0 69.0786 4000.0 71.0852 55000.0 72.0766 2800.0 72.9368 240000.0 73.0281 3100.0 73.3043 2500.0 75.9009 2300.0 77.0385 35000.0 79.0539 860000.0 79.0592 4900.0 79.062 5100.0 81.0696 2700000.0 81.0781 49000.0 81.0782 14000.0 81.0805 9100.0 83.0852 590000.0 83.0913 6400.0 85.7955 2400.0 90.9473 180000.0 91.0539 390000.0 91.0608 4800.0 91.312 2600.0 93.0696 3600000.0 93.08 58000.0 93.0801 17000.0 93.0832 12000.0 93.0875 3800.0 94.038 2200.0 95.0434 2900.0 95.0489 98000.0 95.0852 2000000.0 95.0919 10000.0 95.096 9600.0 97.0944 5000.0 97.1009 300000.0 99.9477 42000.0 103.0541 3400.0 105.0444 30000.0 105.0617 3200.0 105.0696 340000.0 106.0775 11000.0 107.0852 2800000.0 107.0927 13000.0 107.1018 17000.0 109.0645 52000.0 109.0928 5200.0 109.1009 1400000.0 109.1087 7800.0 110.2721 2400.0 111.1165 51000.0 113.9634 430000.0 113.977 3100.0 114.8024 2300.0 117.9584 2600.0 119.0602 21000.0 119.0852 110000.0 120.0934 8500.0 121.0747 6800.0 121.0908 8600.0 121.1009 3700000.0 121.1097 54000.0 121.1166 13000.0 121.1215 11000.0 121.1274 4600.0 123.0801 310000.0 123.1165 640000.0 123.1254 3000.0 123.1318 4200.0 130.9164 2300.0 131.9739 62000.0 133.0766 6000.0 133.1008 33000.0 133.9532 5900.0 134.1088 7200.0 135.1166 1200000.0 135.1266 15000.0 137.1323 77000.0 147.1164 33000.0 148.1238 2200.0 149.1322 1300000.0 149.1466 4900.0 161.1321 3600.0 162.1401 14000.0 163.148 170000.0 167.2892 2200.0 173.5244 21000.0 173.5376 56000.0 174.2564 2300.0 177.1641 2500.0 177.3878 2700.0 191.1288 2600.0 193.9711 2300.0 205.1597 2800.0 205.1951 89000.0 206.5422 2500.0 212.9419 2300.0 END IONS BEGIN IONS SCANS=638 PEPMASS=454.2935 CHARGE=1 COLLISION_ENERGY=0.0 57.0327 2600.0 57.0695 27000.0 58.1618 2100.0 58.7261 2300.0 62.0596 39000.0 67.0538 2500.0 69.0696 3700.0 69.0736 2300.0 71.0851 27000.0 75.273 2100.0 76.8734 2200.0 81.0694 7300.0 81.3667 2300.0 83.0852 7500.0 85.1008 15000.0 85.7517 2300.0 86.1827 2700.0 89.0593 12000.0 95.085 21000.0 97.1009 2400.0 109.1003 11000.0 116.1345 2200.0 116.3494 2400.0 117.598 2400.0 123.1161 3700.0 123.5684 2500.0 127.8846 2500.0 133.0855 2500.0 140.3272 2600.0 155.0098 22000.0 169.9215 2300.0 173.522 8600.0 173.5367 41000.0 175.495 2400.0 177.61 2800.0 191.6413 2400.0 192.2493 2400.0 199.7321 2400.0 239.2397 2700.0 257.0957 2300.0 265.1398 3000.0 282.2788 36000.0 313.2325 5400.0 313.2736 280000.0 394.9464 2500.0 414.7589 2900.0 421.0404 2900.0 462.242 2500.0 END IONS BEGIN IONS SCANS=639 PEPMASS=496.3405 CHARGE=1 COLLISION_ENERGY=0.0 60.0805 54000.0 60.6424 2300.0 61.8448 2500.0 63.1827 2400.0 65.9526 2500.0 66.1196 2200.0 68.3096 2800.0 71.0727 3600.0 72.7749 2000.0 83.0319 2400.0 86.0959 200000.0 89.0593 18000.0 91.1219 2600.0 93.7508 2500.0 103.6114 2800.0 104.1067 860000.0 104.1143 4100.0 105.8624 2800.0 112.0107 2500.0 121.0647 2900.0 122.7173 2300.0 124.9995 58000.0 128.8625 2400.0 133.0858 6300.0 136.4417 2500.0 141.4096 2300.0 146.8278 2400.0 152.75 2800.0 163.0149 7800.0 173.525 28000.0 173.5352 35000.0 173.5441 12000.0 174.2514 2500.0 179.1815 2700.0 184.0733 1200000.0 209.2447 2700.0 215.6861 2400.0 228.3575 2500.0 232.1491 2200.0 248.9954 2500.0 250.3371 2300.0 258.11 19000.0 288.6191 2300.0 313.2748 43000.0 315.62 2400.0 319.4391 2600.0 339.9919 3000.0 380.917 2500.0 390.683 2400.0 398.7138 2400.0 401.1197 2600.0 419.2509 2600.0 419.2572 7600.0 437.5553 3200.0 478.3307 33000.0 496.345 16000.0 END IONS BEGIN IONS SCANS=640 PEPMASS=205.1954 CHARGE=1 COLLISION_ENERGY=0.0 41.0385 12000.0 43.0541 4100.0 51.011 2300.0 53.0384 5600.0 55.054 91000.0 55.4183 2300.0 55.9342 7000.0 57.0696 24000.0 60.8898 2700.0 67.0501 3000.0 67.0539 56000.0 69.0695 130000.0 71.0852 4300.0 72.9368 49000.0 77.0382 3200.0 79.0539 86000.0 81.0695 320000.0 81.0778 3900.0 81.6814 2300.0 83.0852 25000.0 90.9473 38000.0 91.0539 41000.0 93.0695 390000.0 93.0759 3400.0 95.0489 12000.0 95.0851 120000.0 95.7239 2400.0 97.1009 15000.0 99.9477 10000.0 103.0543 3000.0 105.0445 4400.0 105.0695 33000.0 107.0851 170000.0 107.9504 3200.0 109.0645 2900.0 109.1008 70000.0 110.3221 2500.0 113.9633 94000.0 119.0597 3100.0 119.0855 4800.0 121.1008 490000.0 121.1096 5400.0 123.0801 57000.0 123.1164 32000.0 131.974 14000.0 135.1166 52000.0 137.1324 3100.0 149.1322 84000.0 163.1481 6200.0 173.5348 24000.0 191.5532 2800.0 205.1944 3000.0 END IONS BEGIN IONS SCANS=641 PEPMASS=264.2324 CHARGE=1 COLLISION_ENERGY=0.0 46.484 2300.0 51.7484 2200.0 52.4258 2200.0 53.0385 9700.0 53.5267 2700.0 55.054 140000.0 55.5194 2300.0 57.0697 84000.0 60.0403 9500.0 60.0442 3800000.0 60.0478 29000.0 60.05 41000.0 60.0512 19000.0 60.0533 9600.0 60.0579 2100.0 60.0592 2100.0 65.0387 3100.0 65.1872 2300.0 67.0501 3000.0 67.0539 130000.0 67.4591 2600.0 69.0696 390000.0 71.0852 37000.0 74.2827 2400.0 77.0387 3200.0 78.9599 2300.0 79.0539 210000.0 81.0696 1900000.0 81.0748 18000.0 81.0782 15000.0 81.0808 8200.0 83.0798 2500.0 83.0853 120000.0 91.0494 3000.0 91.054 63000.0 93.0698 1200000.0 93.0762 6600.0 95.049 17000.0 95.0853 710000.0 95.0918 3500.0 97.1009 110000.0 101.5664 2200.0 105.0697 60000.0 107.0852 730000.0 109.0642 2700.0 109.1008 600000.0 109.1086 4000.0 111.1166 51000.0 119.0851 15000.0 121.075 3600.0 121.0916 17000.0 121.1009 5500000.0 121.11 83000.0 121.1181 40000.0 121.1212 21000.0 121.1273 9700.0 121.1332 4400.0 123.0802 6000.0 123.1069 5400.0 123.1165 300000.0 124.2985 2400.0 135.1165 470000.0 135.1273 9400.0 136.9854 2700.0 137.1322 36000.0 147.1161 12000.0 149.1322 1300000.0 149.1464 3800.0 156.1375 2900.0 163.1479 99000.0 173.5326 61000.0 173.543 12000.0 177.1635 4700.0 178.2092 2600.0 187.7316 2500.0 189.1648 4800.0 205.195 270000.0 207.74 2500.0 233.9204 2500.0 264.232 52000.0 END IONS BEGIN IONS SCANS=642 PEPMASS=534.3642 CHARGE=1 COLLISION_ENERGY=0.0 61.0282 2900.0 61.3015 2700.0 63.5341 2200.0 65.8887 2400.0 67.0539 120000.0 68.3357 2500.0 69.0695 63000.0 70.5729 2200.0 71.0853 23000.0 74.7368 2900.0 75.0438 2600.0 75.8114 2200.0 76.5018 2600.0 79.0538 26000.0 80.8312 3000.0 81.0695 240000.0 83.0852 76000.0 85.028 11000.0 85.0646 3000.0 85.1011 8600.0 87.0002 2300.0 91.0541 12000.0 93.0695 46000.0 93.971 2300.0 94.7954 2200.0 95.085 250000.0 97.0281 5700.0 97.0645 22000.0 97.1008 63000.0 99.0802 12000.0 104.4057 2500.0 105.0696 23000.0 106.4337 2300.0 107.0852 53000.0 107.4921 2300.0 109.1008 170000.0 111.0802 14000.0 111.1164 20000.0 112.3304 2400.0 113.096 3700.0 117.5086 2700.0 119.0851 34000.0 121.1008 95000.0 123.1164 120000.0 125.096 3800.0 127.1114 3300.0 128.8275 2700.0 133.1009 60000.0 135.1165 62000.0 135.7448 2600.0 135.8124 2400.0 137.0961 2800.0 137.1321 41000.0 139.1108 6400.0 147.1164 50000.0 149.1322 63000.0 151.1478 35000.0 155.1432 3100.0 161.1321 82000.0 162.0531 2300.0 163.1479 67000.0 165.1274 7100.0 165.1634 29000.0 165.766 2600.0 172.8276 2500.0 173.5269 47000.0 173.542 36000.0 175.148 72000.0 177.1634 4900.0 178.482 2500.0 179.1445 2300.0 179.1793 22000.0 179.2581 2400.0 181.1586 2500.0 189.1633 27000.0 193.1597 2400.0 199.2201 2300.0 203.1789 6600.0 207.1744 2800.0 223.5892 2600.0 245.2262 220000.0 263.2366 220000.0 263.2662 4100.0 264.555 2800.0 280.4286 2300.0 281.6517 2300.0 337.2739 190000.0 348.3953 2400.0 371.0299 2700.0 389.6155 2400.0 408.0903 2700.0 418.8559 2800.0 443.7118 2300.0 505.7065 2700.0 END IONS BEGIN IONS SCANS=643 PEPMASS=205.1954 CHARGE=1 COLLISION_ENERGY=0.0 41.0384 30000.0 43.0177 5400.0 43.0542 13000.0 43.4779 2300.0 49.7954 2000.0 52.3749 2200.0 52.9298 2200.0 52.9505 2200.0 53.0384 2900.0 55.0539 200000.0 55.9341 30000.0 57.0697 46000.0 58.0487 2400.0 60.285 2400.0 61.4152 2000.0 64.2743 2400.0 67.0505 2800.0 67.0539 120000.0 68.3777 2300.0 69.0658 3100.0 69.0695 230000.0 72.9368 230000.0 73.162 2300.0 74.0317 2400.0 77.0386 5200.0 79.0539 150000.0 79.2653 2700.0 81.0695 540000.0 83.0852 43000.0 90.9422 2700.0 90.9473 170000.0 91.0539 69000.0 93.063 5600.0 93.0695 760000.0 95.0488 18000.0 95.0646 3200.0 95.0851 260000.0 95.4204 2200.0 97.1008 32000.0 97.4964 2500.0 98.0877 2600.0 99.9476 43000.0 105.0696 67000.0 107.0773 4100.0 107.0851 360000.0 108.9582 6000.0 109.0638 3200.0 109.1008 170000.0 109.422 2200.0 113.9549 9300.0 113.9633 440000.0 115.9425 7900.0 119.0853 17000.0 121.1008 880000.0 121.1097 2400.0 121.1111 11000.0 123.08 270000.0 123.1071 2300.0 123.1165 65000.0 127.4308 2500.0 128.9505 2400.0 129.4223 3000.0 131.9739 57000.0 133.1021 2900.0 133.9529 5000.0 134.0124 2400.0 135.1166 100000.0 137.1322 5300.0 138.1201 2200.0 139.9736 3300.0 141.9275 2200.0 149.1322 160000.0 149.6933 4600.0 154.9903 3200.0 158.2384 2600.0 163.1478 6600.0 164.8165 2400.0 168.1474 2300.0 169.921 2500.0 172.852 2800.0 173.5244 31000.0 173.5404 41000.0 182.4958 2400.0 185.9899 2600.0 END IONS BEGIN IONS SCANS=644 PEPMASS=371.222 CHARGE=1 COLLISION_ENERGY=0.0 52.732 2000.0 54.8118 2300.0 55.0176 7000.0 55.0541 16000.0 55.1359 2000.0 56.2092 2100.0 58.7084 2200.0 59.5547 2100.0 65.1612 2200.0 67.0539 17000.0 69.0332 77000.0 69.0696 14000.0 70.0413 2100.0 77.0384 2500.0 79.0539 12000.0 79.2202 2600.0 80.5218 2200.0 81.0696 62000.0 82.2674 2400.0 83.0491 2400.0 91.0539 15000.0 93.0697 35000.0 95.0491 12000.0 95.0851 46000.0 97.0645 31000.0 97.101 2800.0 101.0594 24000.0 105.0696 38000.0 105.9268 2500.0 106.545 2500.0 107.0487 70000.0 107.0851 62000.0 109.0645 38000.0 109.1009 60000.0 111.0436 44000.0 113.5785 2400.0 119.0854 24000.0 120.2268 2900.0 121.0645 23000.0 121.1007 37000.0 121.783 2200.0 123.0801 20000.0 123.1165 29000.0 125.0595 39000.0 125.0955 2700.0 126.6882 2500.0 129.0542 11000.0 131.0503 3100.0 131.0854 11000.0 133.0281 44000.0 133.0645 27000.0 133.1009 43000.0 135.0437 96000.0 135.0803 33000.0 135.1164 4900.0 137.0598 2700.0 137.0958 13000.0 143.0855 3200.0 145.0647 21000.0 145.1011 18000.0 147.0442 15000.0 147.0801 64000.0 147.1172 13000.0 147.1586 2400.0 149.0594 38000.0 149.0958 28000.0 151.0392 40000.0 151.1115 19000.0 157.0645 7700.0 158.0726 3700.0 159.0452 2500.0 159.0802 33000.0 159.1168 5200.0 161.0595 13000.0 161.0959 25000.0 163.0748 5200.0 163.112 5800.0 165.0544 300000.0 165.0698 3200.0 169.0615 2400.0 171.0809 17000.0 173.06 16000.0 173.0963 29000.0 173.1325 8900.0 173.5271 15000.0 173.5346 52000.0 173.5452 3800.0 175.0755 28000.0 175.1109 2500.0 175.1484 3600.0 177.0553 6900.0 177.0916 5900.0 179.07 6900.0 183.0811 6900.0 183.1484 2200.0 185.0968 11000.0 187.0752 32000.0 187.1496 3500.0 189.0911 50000.0 191.0707 12000.0 196.895 2600.0 197.0971 5900.0 199.075 6700.0 199.1114 6000.0 201.091 110000.0 203.0709 5400.0 205.0861 20000.0 209.0963 3000.0 211.1116 10000.0 213.091 6900.0 213.1275 7300.0 215.1072 8300.0 215.1436 4600.0 217.0862 35000.0 220.1478 2300.0 223.112 3500.0 224.547 2100.0 225.0927 2500.0 225.1277 20000.0 227.1066 3100.0 227.1433 14000.0 231.1022 12000.0 231.1992 2500.0 235.1133 2600.0 237.1264 11000.0 239.1078 3000.0 241.1223 3200.0 243.1382 21000.0 253.1223 28000.0 255.1382 26000.0 257.1189 2700.0 268.1828 3100.0 271.1333 17000.0 293.1893 3600.0 321.1853 10000.0 339.196 62000.0 351.7754 2800.0 357.2063 24000.0 371.2759 2900.0 END IONS BEGIN IONS SCANS=645 PEPMASS=618.4283 CHARGE=1 COLLISION_ENERGY=0.0 64.0975 2300.0 64.5323 2100.0 64.6615 2200.0 65.9802 2300.0 66.1844 2400.0 67.054 22000.0 67.1781 2400.0 69.0333 3000.0 69.0695 21000.0 71.049 4200.0 72.1583 2300.0 77.6461 2300.0 78.0102 2200.0 78.6238 2600.0 79.054 24000.0 79.3505 2200.0 81.0695 88000.0 81.606 2200.0 83.0489 25000.0 83.0852 87000.0 83.4442 2700.0 83.6794 2400.0 86.2843 2300.0 88.3788 2300.0 91.0541 24000.0 91.405 2900.0 92.5759 2400.0 93.0695 100000.0 95.0488 65000.0 95.0852 87000.0 97.0645 49000.0 101.3362 2300.0 105.0695 99000.0 107.0852 140000.0 109.0644 33000.0 109.1008 66000.0 110.9466 2400.0 111.0802 2800.0 111.5791 2400.0 113.0959 14000.0 113.7236 2600.0 114.5524 2400.0 117.0697 12000.0 119.0851 180000.0 120.093 2800.0 121.0645 23000.0 121.1009 120000.0 121.7845 2500.0 123.0802 28000.0 123.1165 17000.0 125.0958 38000.0 131.0852 63000.0 133.1008 130000.0 133.2895 2800.0 135.0803 23000.0 135.1165 45000.0 135.1816 2700.0 137.0962 4100.0 139.1113 42000.0 142.0773 4300.0 143.0852 60000.0 144.0931 13000.0 145.1008 180000.0 147.0802 19000.0 147.1165 73000.0 149.0958 34000.0 149.1312 3400.0 151.7178 3100.0 155.0856 8900.0 155.1061 7000.0 156.0932 8300.0 157.1009 150000.0 158.1084 2900.0 159.0803 19000.0 159.1165 120000.0 160.0875 17000.0 161.0957 43000.0 161.1316 11000.0 163.1113 25000.0 167.0872 2700.0 167.1065 46000.0 167.1425 3400.0 169.101 55000.0 171.1166 95000.0 172.125 2400.0 173.0962 22000.0 173.1325 69000.0 173.5258 35000.0 173.5355 120000.0 173.545 4400.0 175.1115 40000.0 175.148 33000.0 179.1429 4200.0 181.1013 14000.0 181.1219 56000.0 182.1083 11000.0 183.1168 62000.0 183.1364 2700.0 184.1246 3000.0 185.0955 6500.0 185.1323 67000.0 187.1122 17000.0 187.1481 36000.0 189.1272 10000.0 191.1431 14000.0 193.1004 3300.0 194.11 2800.0 195.1163 46000.0 196.1245 3700.0 197.1325 99000.0 197.5085 2600.0 199.112 5900.0 199.1478 47000.0 201.1265 2400.0 201.1632 15000.0 202.3785 2300.0 203.1437 11000.0 207.1167 27000.0 208.6033 2500.0 209.1324 62000.0 210.1392 7100.0 211.1124 2700.0 211.148 50000.0 213.1274 8500.0 213.1633 13000.0 215.1432 23000.0 217.1557 2800.0 219.1742 4400.0 221.1323 21000.0 221.1539 19000.0 223.1479 46000.0 225.1259 4200.0 225.1651 7900.0 227.1431 2800.0 227.5966 2400.0 228.1517 3000.0 230.4583 2300.0 233.131 4600.0 233.1538 72000.0 235.1475 35000.0 235.6129 2400.0 237.1637 24000.0 239.1784 3000.0 241.1581 3200.0 247.1467 6900.0 249.1634 17000.0 251.1055 2400.0 251.1794 5900.0 253.1582 7600.0 255.1742 52000.0 255.2378 2600.0 257.1927 2800.0 259.146 3200.0 261.164 7500.0 263.1791 8300.0 265.1947 3200.0 279.1741 2900.0 281.191 2400.0 291.1585 3100.0 295.205 6500.0 304.1313 2800.0 307.2086 2400.0 330.8963 2700.0 331.2404 3000.0 399.2722 2900.0 416.8901 2300.0 420.3867 2900.0 429.6388 2600.0 477.0559 2400.0 506.8117 2600.0 564.0316 3000.0 591.4614 2400.0 599.5714 2500.0 END IONS BEGIN IONS SCANS=646 PEPMASS=205.1954 CHARGE=1 COLLISION_ENERGY=0.0 41.0385 180000.0 42.0337 44000.0 43.0541 77000.0 44.0494 3200.0 51.023 12000.0 53.0018 2900.0 53.0132 6500.0 53.0384 190000.0 55.0541 2400000.0 55.0572 27000.0 55.0587 20000.0 55.9342 15000.0 57.0697 580000.0 65.0384 69000.0 66.0149 2900.0 66.046 9300.0 66.0499 3800.0 66.5929 2400.0 67.054 1700000.0 67.0582 12000.0 67.0604 15000.0 67.49 4200.0 69.0698 3600000.0 69.0739 38000.0 69.0761 26000.0 71.0853 130000.0 72.9368 240000.0 73.0284 6100.0 73.0456 2600.0 74.3088 2400.0 77.0384 100000.0 78.0468 5600.0 79.054 2600000.0 79.062 16000.0 79.062 44000.0 80.062 16000.0 81.0698 10000000.0 81.0781 64000.0 81.0795 240000.0 81.0806 34000.0 81.084 15000.0 83.0852 650000.0 83.0912 8100.0 85.1005 4600.0 87.0967 2400.0 90.2655 2500.0 90.9474 150000.0 91.054 1100000.0 91.0604 6800.0 91.0639 8300.0 93.0697 12000000.0 93.0807 82000.0 93.0818 250000.0 93.0831 42000.0 93.0874 19000.0 94.0774 3100.0 95.0489 310000.0 95.0853 3600000.0 95.0924 18000.0 95.096 41000.0 97.0944 6800.0 97.1008 410000.0 97.1988 2200.0 99.9477 37000.0 103.0543 37000.0 105.0444 110000.0 105.0617 9200.0 105.0696 950000.0 105.0783 22000.0 106.0774 62000.0 107.0686 3400.0 107.0853 4700000.0 107.0934 35000.0 107.102 11000.0 107.3674 2600.0 109.0645 110000.0 109.1009 2200000.0 109.1089 11000.0 109.1671 2200.0 111.1166 78000.0 112.8187 2500.0 113.6498 5300.0 113.9634 420000.0 115.9432 3000.0 119.0604 36000.0 119.0765 4000.0 119.0853 220000.0 119.1277 2400.0 121.0636 2900.0 121.0805 10000.0 121.0899 7300.0 121.1009 16000000.0 121.1101 67000.0 121.1141 360000.0 121.1275 21000.0 121.1275 83000.0 123.0801 400000.0 123.1165 910000.0 125.9346 2600.0 131.9741 58000.0 133.0758 54000.0 133.101 31000.0 133.9529 2400.0 135.1166 1300000.0 135.1269 17000.0 137.1322 100000.0 141.1374 2400.0 147.1168 47000.0 149.0233 18000.0 149.1185 9500.0 149.1323 2400000.0 149.1448 20000.0 150.0717 2500.0 151.6654 2300.0 154.9903 3500.0 157.0564 2200.0 161.1326 13000.0 162.1411 6000.0 163.1479 200000.0 173.5255 29000.0 173.54 50000.0 180.5688 2300.0 186.4362 2500.0 189.1844 4600.0 197.1696 2600.0 200.3753 4400.0 203.0006 2300.0 205.1954 90000.0 213.8651 2900.0 215.2242 2400.0 END IONS BEGIN IONS SCANS=647 PEPMASS=279.1597 CHARGE=1 COLLISION_ENERGY=0.0 46.9243 2100.0 46.9701 2100.0 47.0515 2300.0 48.2298 2300.0 48.6262 2100.0 48.9704 2300.0 49.8732 2000.0 52.1143 2100.0 53.5237 2800.0 55.575 2200.0 55.811 2300.0 57.0696 560000.0 59.7606 2200.0 61.609 2500.0 62.0557 2200.0 63.4829 2300.0 65.0384 17000.0 66.2519 2200.0 67.2992 2300.0 67.5513 2800.0 71.603 2400.0 72.9438 2500.0 73.028 2500.0 73.9887 2200.0 75.2715 2400.0 76.1122 2200.0 77.4042 2300.0 78.4245 2200.0 79.4744 2700.0 80.7365 2700.0 81.0693 5600.0 83.0481 2700.0 83.6999 2400.0 85.7148 2500.0 88.4863 2400.0 89.5918 2800.0 91.3941 2100.0 92.1503 2500.0 95.0853 3000.0 101.9398 2300.0 109.101 3000.0 111.0433 3100.0 113.1413 2400.0 114.8319 2500.0 121.0281 53000.0 121.0379 7000.0 132.6889 2300.0 137.0963 2500.0 139.95 2500.0 145.7292 2900.0 149.023 2500000.0 149.0347 14000.0 149.0512 3400.0 150.7982 2500.0 151.075 11000.0 167.0345 2800.0 173.321 2300.0 173.5254 38000.0 173.5389 43000.0 182.2212 2300.0 198.8824 2300.0 201.0465 89000.0 207.9839 2200.0 219.0571 510000.0 219.0813 9800.0 231.6882 2400.0 237.3184 2500.0 241.9252 2100.0 251.1423 2600.0 252.2191 2200.0 256.4821 2400.0 259.6272 2300.0 279.0937 370000.0 279.1246 7100.0 END IONS BEGIN IONS SCANS=648 PEPMASS=404.3529 CHARGE=1 COLLISION_ENERGY=0.0 55.0021 2500.0 55.0543 12000.0 55.1785 2300.0 55.2363 2100.0 56.9069 2300.0 57.0698 71000.0 59.5419 2400.0 59.7823 2200.0 60.5184 2200.0 60.7785 2100.0 61.4088 2400.0 64.6239 2500.0 65.1121 2300.0 65.2772 2300.0 65.9928 2100.0 67.0541 19000.0 67.7233 2400.0 69.0697 29000.0 69.215 2500.0 70.7397 2500.0 71.0853 48000.0 74.9328 2500.0 79.0735 2600.0 81.0697 40000.0 81.3981 2500.0 83.0853 34000.0 85.101 25000.0 86.3315 2400.0 89.0892 2300.0 89.2906 2500.0 89.3312 2600.0 90.3656 2200.0 95.0854 36000.0 95.5617 2500.0 97.101 26000.0 103.0541 46000.0 103.7543 2900.0 105.0698 25000.0 108.4759 2300.0 109.1009 13000.0 111.1161 2700.0 111.5424 2700.0 114.5677 2600.0 117.0696 38000.0 118.0334 2600.0 123.0438 170000.0 128.7167 2500.0 131.0379 3000.0 131.0489 290000.0 131.0854 51000.0 133.0648 42000.0 135.0803 2600.0 136.3392 2200.0 137.0595 240000.0 142.9068 2800.0 145.0646 270000.0 145.0768 2500.0 145.1008 3300.0 146.0958 2200.0 147.0801 5200.0 149.0318 3700.0 149.0458 3400.0 149.0595 3200000.0 149.0699 36000.0 149.3131 2500.0 150.6722 2500.0 151.0752 1900000.0 151.0955 7200.0 159.0803 430000.0 161.0959 58000.0 163.0592 29000.0 163.0752 1600000.0 163.0912 17000.0 164.7045 2200.0 165.0912 10000.0 166.0858 30000.0 173.0961 61000.0 173.3371 2300.0 173.5188 2800.0 173.5287 84000.0 173.5417 39000.0 177.0733 5500.0 177.091 580000.0 184.024 2600.0 187.1117 35000.0 191.1065 100000.0 201.1274 13000.0 205.1212 6400.0 215.1404 2700.0 215.3985 2400.0 222.1417 2600.0 228.226 2600.0 251.9616 2400.0 268.2995 23000.0 270.135 2600.0 278.847 2400.0 287.6671 2400.0 330.8197 33000.0 368.112 2600.0 369.3148 12000.0 387.3255 310000.0 404.293 4500.0 404.352 330000.0 END IONS BEGIN IONS SCANS=649 PEPMASS=205.1954 CHARGE=1 COLLISION_ENERGY=0.0 41.0385 40000.0 43.0541 22000.0 51.7318 2400.0 53.0385 13000.0 55.0541 410000.0 55.0572 5800.0 55.0586 4800.0 55.9342 9000.0 57.0697 110000.0 65.0383 28000.0 66.9363 2600.0 67.0539 210000.0 68.6091 2800.0 69.0696 410000.0 69.0761 4200.0 71.0854 9900.0 71.7727 2700.0 72.0914 2400.0 72.9332 3700.0 72.9367 90000.0 77.0384 7000.0 79.054 240000.0 79.0595 5200.0 81.0696 490000.0 83.0853 310000.0 90.9474 60000.0 91.0539 120000.0 93.0333 8100.0 93.0696 1100000.0 93.0762 8200.0 93.08 8900.0 95.0488 30000.0 95.0852 360000.0 95.0928 4700.0 97.1009 50000.0 97.7204 2200.0 99.9477 17000.0 100.2458 2400.0 101.1276 2200.0 105.0445 11000.0 105.0694 96000.0 106.0771 2800.0 107.0852 1100000.0 107.0927 4600.0 107.0944 5100.0 108.0937 2300.0 108.958 2900.0 109.0645 29000.0 109.1009 310000.0 111.0438 6500.0 111.1166 5200.0 113.9548 8300.0 113.9634 170000.0 115.9426 2700.0 119.0605 3800.0 119.0853 22000.0 121.0281 47000.0 121.0389 14000.0 121.1009 760000.0 121.1102 15000.0 123.0802 110000.0 123.1068 5000.0 123.1165 170000.0 131.9739 23000.0 133.0759 3800.0 133.1012 3500.0 133.9533 2600.0 135.1166 200000.0 136.7866 2700.0 137.1321 13000.0 147.1166 14000.0 149.0105 4900.0 149.0231 150000.0 149.1184 3600.0 149.1323 600000.0 154.9901 3900.0 162.1403 7400.0 163.148 35000.0 173.536 20000.0 182.5305 2200.0 205.1957 14000.0 END IONS BEGIN IONS SCANS=650 PEPMASS=393.2042 CHARGE=1 COLLISION_ENERGY=0.0 57.8902 2100.0 60.9098 2400.0 67.4581 2700.0 67.831 2400.0 71.1889 2300.0 71.282 2300.0 75.4654 2100.0 81.0695 7000.0 81.6425 2100.0 83.7285 2400.0 90.5955 2300.0 93.0696 16000.0 93.4142 2400.0 95.0489 7500.0 95.0851 11000.0 102.5165 2900.0 105.0695 16000.0 106.1025 2400.0 106.259 2500.0 107.0852 10000.0 108.0196 2400.0 109.1012 2700.0 114.7648 2500.0 119.0854 25000.0 119.1438 2200.0 121.1004 3700.0 121.1673 2500.0 122.6325 2400.0 131.0853 4000.0 133.1008 13000.0 143.0852 2500.0 143.1042 2400.0 145.1007 20000.0 147.1169 3100.0 149.023 15000.0 150.0266 16000.0 151.0275 2700.0 155.5091 2500.0 155.8644 2400.0 157.1009 7000.0 159.1163 8500.0 161.0959 2600.0 167.7121 2800.0 170.1121 2300.0 173.1329 3400.0 173.5245 35000.0 173.5366 77000.0 173.6607 2400.0 189.198 2500.0 197.1321 5900.0 198.7778 2400.0 261.5462 2600.0 322.2546 2900.0 341.0164 2500.0 352.4061 2400.0 385.5151 2700.0 393.2044 180000.0 END IONS BEGIN IONS SCANS=651 PEPMASS=371.222 CHARGE=1 COLLISION_ENERGY=0.0 55.0541 2700.0 67.0541 16000.0 69.0696 7700.0 79.0542 5500.0 81.0697 23000.0 85.0647 2600.0 90.0399 2400.0 91.054 5500.0 93.0333 5900.0 93.0696 14000.0 95.0489 4200.0 95.0853 11000.0 97.0646 140000.0 97.0721 3200.0 101.0596 4600.0 105.0696 12000.0 107.0489 42000.0 107.0853 33000.0 109.0646 15000.0 109.101 60000.0 111.0437 7800.0 115.0328 2000.0 119.0493 5000.0 119.0854 12000.0 121.0646 10000.0 121.1009 12000.0 123.0437 31000.0 123.0803 4500.0 123.1168 3400.0 127.0751 11000.0 129.0547 4400.0 131.0853 12000.0 133.0281 8300.0 133.0647 31000.0 133.1009 15000.0 135.0439 130000.0 135.0558 4000.0 135.0802 120000.0 135.1165 6700.0 137.0958 18000.0 143.0855 3200.0 145.0648 6800.0 145.1013 13000.0 147.0437 11000.0 147.0802 16000.0 147.1166 9500.0 149.0594 33000.0 149.0959 12000.0 149.1321 4700.0 149.9537 2600.0 151.0387 14000.0 151.1117 7600.0 157.1007 5300.0 159.0446 3500.0 159.0803 9400.0 159.1167 6700.0 161.0593 6500.0 161.0957 19000.0 161.1316 4300.0 163.1118 4600.0 163.1481 3500.0 165.0545 88000.0 171.0801 4400.0 171.1171 2900.0 173.0598 10000.0 173.0961 3500.0 173.1322 13000.0 173.5224 4800.0 173.5409 10000.0 175.0753 18000.0 175.1117 59000.0 175.148 6200.0 179.0699 7800.0 185.096 20000.0 186.1402 9200.0 187.0753 11000.0 187.1481 6900.0 189.0911 7200.0 191.1428 4600.0 199.1114 3400.0 199.1485 3100.0 201.0907 13000.0 203.1067 71000.0 204.1509 4900.0 205.0857 3700.0 205.1586 49000.0 207.1751 4200.0 213.0913 11000.0 215.1061 7700.0 225.1268 12000.0 231.1016 58000.0 233.1164 3600.0 237.1269 5200.0 241.123 4300.0 243.1375 17000.0 265.1205 2700.0 269.1184 3700.0 271.1318 3000.0 279.1388 4000.0 293.1904 3200.0 321.1852 22000.0 339.1949 100000.0 357.2064 3800.0 END IONS BEGIN IONS SCANS=652 PEPMASS=313.2741 CHARGE=1 COLLISION_ENERGY=0.0 48.249 2300.0 54.9998 2700.0 55.054 98000.0 55.4295 2400.0 56.2621 2300.0 57.0332 280000.0 57.0696 800000.0 57.0729 8100.0 57.0745 4100.0 57.8394 2200.0 63.719 2400.0 66.6876 2500.0 67.0506 2600.0 67.0539 110000.0 69.0695 110000.0 71.0852 430000.0 71.2221 2400.0 72.9142 2400.0 76.0987 2300.0 76.3944 2500.0 78.7745 2600.0 79.0542 5300.0 81.0696 140000.0 82.3117 2400.0 83.0852 110000.0 83.3012 2400.0 83.6132 2400.0 85.0644 5400.0 85.1008 210000.0 88.4928 2100.0 89.0594 33000.0 91.0538 7500.0 91.1879 2200.0 93.0699 7500.0 94.8297 2400.0 95.0852 240000.0 95.1472 2200.0 97.1009 47000.0 103.075 27000.0 109.1008 80000.0 114.1531 2400.0 115.5045 2100.0 116.8633 2400.0 121.1004 2900.0 123.1166 12000.0 137.1316 3100.0 138.7547 2100.0 141.1986 2300.0 150.4338 2300.0 152.3737 2500.0 159.9322 2400.0 161.2824 2700.0 161.6917 2400.0 165.0544 21000.0 167.0062 3000.0 173.5276 91000.0 173.5426 15000.0 194.9843 2300.0 206.6461 2600.0 214.7508 2500.0 241.517 2400.0 243.8504 2400.0 248.5272 2400.0 248.5964 2500.0 295.1705 2400.0 295.2573 2400.0 304.7907 2500.0 305.2124 2500.0 310.3064 2400.0 313.2724 8400.0 313.4336 2400.0 END IONS BEGIN IONS SCANS=653 PEPMASS=212.1437 CHARGE=1 COLLISION_ENERGY=0.0 41.0386 35000.0 42.0339 2500.0 42.8977 2600.0 43.0178 21000.0 43.0543 26000.0 44.9061 2100.0 44.9309 2500.0 44.9748 2000.0 47.4562 2600.0 47.5018 2400.0 49.242 2300.0 54.6814 2200.0 57.9082 2200.0 61.1685 2400.0 63.692 2300.0 65.0385 38000.0 65.5103 2500.0 68.4529 2200.0 71.087 2800.0 71.4887 2500.0 73.435 2200.0 73.5139 2200.0 74.2002 2400.0 76.3073 3100.0 77.0002 2300.0 79.0539 2900.0 80.6405 2200.0 82.664 2200.0 83.2669 2600.0 83.3726 2500.0 83.6367 2500.0 87.0731 2400.0 89.0126 2200.0 89.4717 2500.0 89.6591 2300.0 90.4827 2400.0 91.0541 60000.0 92.0493 1000000.0 92.0551 2400.0 92.5608 2400.0 93.0571 560000.0 93.0693 33000.0 94.0651 5600.0 95.3896 2300.0 98.7499 2400.0 100.7898 2300.0 104.9263 2200.0 106.0649 4800.0 107.0854 94000.0 108.6703 2200.0 115.0544 2800.0 117.0697 34000.0 119.0729 63000.0 119.0821 2100.0 119.9571 6300.0 120.0807 4200000.0 120.0889 10000.0 120.1011 2800.0 121.0251 2600.0 124.0839 14000.0 128.0619 2400.0 131.5398 2400.0 132.1019 2500.0 134.0861 4200.0 134.0963 300000.0 135.08 2700.0 135.0921 18000.0 135.1041 1200000.0 135.1164 19000.0 135.3704 2500.0 143.0854 36000.0 148.0247 2300.0 153.0565 2500.0 153.0698 76000.0 154.0653 2700.0 154.0939 5800.0 155.073 11000.0 155.1383 2200.0 155.9168 2400.0 161.5937 2900.0 168.0809 40000.0 169.072 3300.0 169.0886 730000.0 169.104 4600.0 170.0791 11000.0 170.0964 2400000.0 170.1137 9600.0 173.5236 23000.0 173.5338 110000.0 178.1956 2600.0 196.1125 3500.0 197.1184 64000.0 205.28 2400.0 207.1585 2400.0 210.1908 2400.0 212.0969 4600.0 212.1434 4600000.0 212.1902 3500.0 END IONS BEGIN IONS SCANS=654 PEPMASS=252.2324 CHARGE=1 COLLISION_ENERGY=0.0 44.0132 33000.0 44.0495 11000.0 53.0386 640000.0 55.0179 350000.0 55.0543 2000000.0 55.0568 18000.0 56.0495 67000.0 57.0336 30000.0 57.0699 3000000.0 57.0726 34000.0 58.0652 58000.0 59.0492 14000.0 60.0444 21000.0 61.7988 7400.0 65.0387 17000.0 67.0543 940000.0 68.0621 44000.0 69.0335 64000.0 69.0699 1400000.0 69.0734 11000.0 69.0745 12000.0 70.0651 130000.0 71.0491 30000.0 71.0855 86000.0 72.0444 260000.0 72.0807 140000.0 73.0648 73000.0 74.0964 170000.0 79.0543 390000.0 80.0495 28000.0 81.0335 1900000.0 81.0699 1400000.0 81.0743 17000.0 82.0651 47000.0 83.0437 11000.0 83.0491 240000.0 83.0856 620000.0 84.0444 370000.0 84.0809 92000.0 85.0525 21000.0 85.0647 16000.0 85.1012 20000.0 86.06 87000.0 86.0968 27000.0 86.6925 2500.0 91.0543 140000.0 93.07 250000.0 94.0651 45000.0 95.0492 710000.0 95.0856 1500000.0 95.9669 2600.0 96.0447 21000.0 96.0809 21000.0 97.0649 110000.0 97.1012 720000.0 98.0601 820000.0 98.0965 37000.0 99.0676 7100.0 99.0804 4700.0 100.0757 57000.0 100.1121 21000.0 105.07 180000.0 107.0856 140000.0 107.0936 4000.0 108.0808 38000.0 109.0649 290000.0 109.1013 410000.0 111.0677 11000.0 111.0805 42000.0 111.117 43000.0 112.0669 3900.0 112.0758 270000.0 112.112 31000.0 114.0915 30000.0 114.1279 31000.0 119.0765 13000.0 119.0857 220000.0 120.081 7500.0 121.1011 56000.0 122.0965 27000.0 123.0805 150000.0 123.117 23000.0 125.0969 10000.0 126.0915 240000.0 126.1279 17000.0 128.1071 65000.0 128.1435 210000.0 133.1015 68000.0 135.117 74000.0 136.112 9600.0 137.0962 54000.0 137.1326 120000.0 140.1072 120000.0 140.1435 11000.0 141.1151 15000.0 142.123 23000.0 151.1483 53000.0 152.107 37000.0 154.1228 250000.0 154.1592 31000.0 155.1306 13000.0 156.1386 11000.0 161.1327 110000.0 167.1306 33000.0 168.1386 88000.0 168.1749 15000.0 173.5314 100000.0 176.6467 7100.0 178.1595 51000.0 179.1435 130000.0 182.1544 43000.0 184.2061 36000.0 184.903 2600.0 196.17 670000.0 196.1909 5500.0 210.1863 9200.0 210.2217 18000.0 224.2378 30000.0 252.2326 1100000.0 END IONS BEGIN IONS SCANS=655 PEPMASS=409.2742 CHARGE=1 COLLISION_ENERGY=0.0 55.0177 13000.0 55.0539 150000.0 57.0697 62000.0 59.0489 23000.0 65.0387 3200.0 67.054 83000.0 68.8136 2200.0 69.0333 55000.0 69.0696 60000.0 69.5275 2200.0 71.0491 17000.0 71.1509 2400.0 71.8763 2400.0 77.0385 2200.0 79.0539 120000.0 81.0336 6400.0 81.0696 290000.0 82.853 3000.0 83.0489 48000.0 83.0854 18000.0 85.0646 29000.0 89.6016 2300.0 90.5395 2700.0 91.0482 4100.0 91.0538 170000.0 93.0631 3700.0 93.0697 400000.0 93.0769 3900.0 95.0489 470000.0 95.0548 2200.0 95.0853 260000.0 97.0646 85000.0 103.0542 2800.0 105.0447 6000.0 105.0697 850000.0 105.0774 15000.0 106.078 2800.0 107.0492 12000.0 107.0773 3800.0 107.0853 240000.0 109.0646 120000.0 109.101 81000.0 111.0436 3400.0 111.0803 22000.0 112.1594 2200.0 113.096 5900.0 115.0544 7200.0 117.0697 69000.0 119.0489 23000.0 119.0755 16000.0 119.0853 620000.0 119.095 20000.0 120.0934 23000.0 121.0553 4300.0 121.0646 170000.0 121.101 180000.0 123.0802 120000.0 123.1167 17000.0 125.0593 16000.0 125.096 9100.0 128.0625 16000.0 129.0697 52000.0 130.0776 20000.0 131.0854 190000.0 131.0966 3500.0 132.0932 20000.0 133.0646 61000.0 133.0745 3400.0 133.101 210000.0 135.0802 120000.0 135.1166 42000.0 135.1795 2700.0 137.0595 19000.0 137.0959 88000.0 139.112 3100.0 141.0698 15000.0 142.0776 81000.0 143.0854 150000.0 144.0932 43000.0 145.0648 16000.0 145.0873 2500.0 145.0909 2200.0 145.1011 430000.0 145.1143 9500.0 146.0729 3500.0 146.1086 29000.0 147.0803 210000.0 147.1167 580000.0 148.0882 12000.0 149.096 130000.0 150.1039 16000.0 151.0623 5100.0 151.0752 210000.0 151.0891 3600.0 153.0905 21000.0 155.0854 64000.0 155.1074 2800.0 156.0932 38000.0 157.0862 3300.0 157.1011 260000.0 158.0732 3000.0 158.1088 18000.0 159.0803 52000.0 159.1168 170000.0 160.0887 16000.0 161.096 97000.0 161.1325 54000.0 162.1022 3200.0 163.0752 6600.0 163.1117 58000.0 165.091 430000.0 167.0857 16000.0 167.1067 17000.0 168.0935 30000.0 169.1013 110000.0 170.109 35000.0 171.08 8700.0 171.1169 110000.0 171.1306 3400.0 172.0877 6500.0 172.1238 13000.0 173.0961 63000.0 173.1326 84000.0 173.5227 25000.0 173.5396 36000.0 174.1033 15000.0 175.1119 110000.0 175.1484 20000.0 177.0911 67000.0 177.1284 3400.0 178.099 50000.0 179.0859 11000.0 179.1065 2400.0 179.1443 2800.0 180.0935 11000.0 181.1013 38000.0 181.1182 9100.0 182.1091 28000.0 183.1169 110000.0 184.1246 12000.0 185.0959 18000.0 185.1325 68000.0 186.1049 4400.0 187.1117 47000.0 187.1482 30000.0 188.1185 3900.0 189.1274 65000.0 190.1324 2600.0 191.1064 8500.0 191.1425 15000.0 193.1011 24000.0 194.1091 22000.0 195.1169 54000.0 196.1246 32000.0 197.0971 6600.0 197.1327 54000.0 198.1391 3800.0 199.1121 31000.0 199.1482 25000.0 200.1193 12000.0 201.1276 72000.0 201.1631 18000.0 202.1318 2500.0 203.1432 160000.0 206.1104 6700.0 207.1167 25000.0 207.1384 70000.0 208.1247 9700.0 209.1328 50000.0 210.1402 11000.0 211.112 13000.0 211.1485 53000.0 213.1277 36000.0 213.1643 6100.0 215.1435 30000.0 216.1508 32000.0 219.1166 8000.0 219.1383 76000.0 220.125 10000.0 221.1322 23000.0 221.154 140000.0 223.149 27000.0 224.1555 3900.0 225.1279 12000.0 225.1641 28000.0 227.1431 18000.0 227.1795 4400.0 229.1593 24000.0 230.1287 2900.0 231.1163 2900.0 231.1385 24000.0 233.1306 13000.0 233.154 24000.0 234.1377 12000.0 234.1617 130000.0 235.1474 12000.0 236.1579 3100.0 237.1277 3600.0 237.1647 11000.0 239.1436 16000.0 239.1795 10000.0 241.1586 3800.0 243.1383 4100.0 247.1468 9200.0 248.1554 2700.0 249.1644 25000.0 251.1808 12000.0 253.1601 9700.0 254.1675 2900.0 255.1386 3400.0 255.1721 3200.0 261.1624 3200.0 263.1782 4300.0 267.1746 18000.0 268.1829 6000.0 269.1889 10000.0 271.17 8600.0 275.1833 3100.0 281.193 3800.0 285.1857 10000.0 286.1928 28000.0 287.2018 26000.0 300.2072 6500.0 312.2084 6000.0 319.6655 2500.0 329.2159 3300.0 345.8697 2400.0 347.2402 3400.0 369.8227 2400.0 409.2738 4600.0 END IONS BEGIN IONS SCANS=656 PEPMASS=657.2566 CHARGE=1 COLLISION_ENERGY=0.0 66.3582 18000.0 66.3611 5100.0 66.7102 2400.0 112.6137 2200.0 168.5534 2500.0 173.5216 11000.0 173.5372 46000.0 192.123 2700.0 220.664 2200.0 237.8922 2300.0 291.0912 2700.0 365.433 2600.0 396.94 2800.0 439.1406 8200.0 441.1921 47000.0 453.16 4500.0 467.1723 21000.0 468.1788 23000.0 469.1868 32000.0 481.1493 3800.0 495.1693 12000.0 496.1702 110000.0 497.181 20000.0 507.4714 2500.0 509.1837 20000.0 510.1921 2700.0 523.1977 9200.0 528.2371 10000.0 537.1681 2900.0 541.2416 13000.0 556.2298 10000.0 559.6758 3100.0 569.2372 160000.0 597.234 640000.0 598.2372 16000.0 599.3745 3600.0 601.2659 13000.0 625.2297 3700.0 628.2529 7200.0 629.2577 14000.0 657.2609 36000.0 657.3969 4600.0 END IONS BEGIN IONS SCANS=657 PEPMASS=391.2638 CHARGE=1 COLLISION_ENERGY=0.0 55.054 12000.0 57.0696 100000.0 58.6912 2600.0 60.5847 2200.0 61.2717 2200.0 61.8165 2400.0 62.8221 2400.0 65.0382 3700.0 67.054 15000.0 69.0696 15000.0 71.0852 88000.0 71.9915 2800.0 79.0539 38000.0 81.0696 60000.0 83.049 3200.0 83.0851 9200.0 83.8936 2600.0 85.0645 2700.0 91.054 30000.0 92.6343 2100.0 92.8909 2700.0 93.0695 93000.0 95.0437 2200.0 95.0488 88000.0 95.0851 37000.0 97.0646 9700.0 97.1031 2300.0 105.0695 75000.0 107.0852 65000.0 107.1981 2600.0 109.0646 14000.0 109.1009 24000.0 114.9388 2200.0 117.0696 16000.0 119.0852 78000.0 121.0284 2800.0 121.0643 22000.0 121.0881 2200.0 121.1008 51000.0 123.08 2400.0 129.0699 4400.0 131.0852 40000.0 133.0643 2800.0 133.1009 49000.0 133.9595 2300.0 135.0798 2900.0 135.1167 14000.0 142.0775 13000.0 143.0852 48000.0 144.0934 2600.0 145.1009 76000.0 147.0801 5400.0 147.1166 15000.0 149.023 930000.0 149.0957 2400.0 155.0852 15000.0 156.0403 2300.0 156.0925 18000.0 157.1008 76000.0 158.1091 5800.0 159.0803 2700.0 159.1167 57000.0 161.0959 18000.0 161.1322 10000.0 165.0712 2800.0 167.0339 9700.0 167.0846 3500.0 168.0941 3900.0 169.101 49000.0 170.1088 12000.0 171.1165 65000.0 172.1239 7300.0 173.097 9900.0 173.1322 24000.0 173.534 55000.0 179.0852 3700.0 181.1012 28000.0 182.1086 16000.0 183.1169 40000.0 185.1326 61000.0 187.148 38000.0 193.1015 17000.0 194.1087 7500.0 195.1169 60000.0 196.1246 17000.0 197.1324 54000.0 199.1112 12000.0 199.1478 12000.0 203.1443 3300.0 206.1092 9500.0 207.1168 34000.0 208.125 18000.0 209.1324 62000.0 210.1405 8700.0 211.1486 34000.0 213.1277 15000.0 213.1633 2700.0 217.1563 3300.0 219.1175 7900.0 220.1242 11000.0 221.1327 43000.0 222.1403 18000.0 223.1484 40000.0 224.1565 5100.0 225.1296 2500.0 225.1633 16000.0 231.1174 2700.0 232.1231 2800.0 233.133 16000.0 234.1402 7400.0 235.1481 29000.0 236.1555 12000.0 237.1632 20000.0 238.1709 9200.0 239.1426 3600.0 245.1321 6400.0 247.1482 16000.0 248.1582 3100.0 249.1638 73000.0 250.1717 3000.0 251.1445 2800.0 251.1788 19000.0 252.7919 2700.0 253.1949 4000.0 255.1736 3600.0 259.1479 7600.0 260.154 3000.0 261.1636 15000.0 262.1731 3000.0 263.1781 13000.0 264.1871 7800.0 265.1954 7800.0 267.1746 43000.0 273.1647 5600.0 275.1795 19000.0 277.1952 7600.0 278.4675 2300.0 282.198 19000.0 289.1954 10000.0 317.1888 2800.0 347.2362 3500.0 373.6614 2500.0 384.4745 2500.0 391.2098 14000.0 391.263 4600.0 394.8677 2400.0 END IONS BEGIN IONS SCANS=658 PEPMASS=409.2741 CHARGE=1 COLLISION_ENERGY=0.0 55.0177 19000.0 55.054 260000.0 56.314 2400.0 57.0333 16000.0 57.0696 110000.0 57.6606 2500.0 58.6529 2100.0 59.0489 50000.0 63.0009 2300.0 65.0385 8800.0 66.2301 2100.0 67.0507 3200.0 67.0539 180000.0 69.0332 100000.0 69.0696 110000.0 70.319 2300.0 71.0489 33000.0 73.1512 2700.0 77.0213 2300.0 77.0387 15000.0 78.654 2300.0 79.0494 3300.0 79.0538 240000.0 81.0332 25000.0 81.0696 580000.0 81.7877 2300.0 83.0488 89000.0 83.0853 33000.0 84.7642 2500.0 85.0645 64000.0 91.0539 310000.0 93.0696 810000.0 93.0768 6200.0 95.0489 930000.0 95.0572 7000.0 95.0852 520000.0 95.0927 4400.0 96.0567 2300.0 97.0644 190000.0 100.2472 2700.0 103.0541 14000.0 105.0441 7700.0 105.0696 1700000.0 105.0776 19000.0 105.1908 2500.0 106.0774 5500.0 107.0489 25000.0 107.0773 4800.0 107.085 510000.0 108.0568 5500.0 109.0573 4000.0 109.0645 230000.0 109.1008 280000.0 111.0433 5200.0 111.0802 43000.0 111.9836 2600.0 113.0598 2800.0 113.0959 11000.0 115.0541 17000.0 116.4338 2300.0 117.0609 2400.0 117.0696 140000.0 119.0489 41000.0 119.0582 2700.0 119.0755 10000.0 119.0852 1200000.0 119.0946 31000.0 120.093 45000.0 121.0553 12000.0 121.0645 340000.0 121.0911 7000.0 121.1009 370000.0 121.7202 2600.0 122.0722 6300.0 123.0801 260000.0 123.1167 27000.0 125.0594 31000.0 125.0956 11000.0 128.0618 25000.0 129.0696 90000.0 130.0774 38000.0 130.5589 2300.0 131.0748 12000.0 131.0853 370000.0 132.093 39000.0 133.0645 100000.0 133.1009 420000.0 133.1127 4300.0 134.0723 2400.0 134.109 2800.0 135.0801 240000.0 135.1166 85000.0 137.0594 35000.0 137.0958 170000.0 139.074 6600.0 139.111 5800.0 141.0698 31000.0 142.0775 160000.0 143.0853 300000.0 144.0569 2600.0 144.0929 79000.0 145.0649 34000.0 145.1009 890000.0 145.1161 14000.0 146.0729 12000.0 146.1084 47000.0 147.0802 380000.0 147.0942 4900.0 147.1165 1100000.0 147.1275 8900.0 148.0877 23000.0 149.0958 240000.0 149.132 10000.0 150.1034 35000.0 151.0621 4400.0 151.0751 440000.0 151.0892 10000.0 151.1111 3900.0 153.0907 38000.0 154.0775 5400.0 155.0852 120000.0 156.093 87000.0 157.0862 7700.0 157.1009 500000.0 157.1165 3400.0 158.0725 6400.0 158.1086 36000.0 159.0803 110000.0 159.1024 4700.0 159.1166 340000.0 160.0878 37000.0 161.0959 190000.0 161.1322 110000.0 163.0756 9900.0 163.1116 110000.0 165.0705 6600.0 165.0909 820000.0 165.1037 2300.0 166.0784 3000.0 166.0953 2500.0 167.0854 33000.0 167.1065 35000.0 168.0931 66000.0 169.1012 220000.0 170.1091 66000.0 171.081 21000.0 171.1167 240000.0 172.0882 12000.0 172.1242 33000.0 173.0961 120000.0 173.1324 180000.0 173.5278 76000.0 173.5348 18000.0 173.5452 18000.0 174.1037 32000.0 175.1117 210000.0 175.1481 46000.0 176.1177 6800.0 177.091 120000.0 177.1271 14000.0 178.0987 100000.0 179.0855 28000.0 179.1047 3600.0 180.0933 15000.0 181.1012 87000.0 181.1206 12000.0 182.1089 51000.0 183.1168 230000.0 184.1242 14000.0 185.0959 34000.0 185.1325 140000.0 186.1028 9500.0 186.1398 2800.0 187.1117 100000.0 187.1272 3100.0 187.148 53000.0 188.1191 2400.0 189.0925 2400.0 189.1273 140000.0 189.7785 2700.0 190.1345 15000.0 191.1066 14000.0 191.1424 42000.0 193.1012 46000.0 193.1206 8000.0 194.1088 33000.0 195.1168 120000.0 196.1246 61000.0 197.0966 15000.0 197.1325 110000.0 198.1395 23000.0 199.1117 68000.0 199.1482 43000.0 200.1192 23000.0 201.1273 150000.0 201.1636 32000.0 202.1346 2600.0 203.1226 3900.0 203.1431 290000.0 205.1011 3800.0 206.1091 26000.0 207.1167 58000.0 207.1382 140000.0 208.1246 26000.0 209.1324 100000.0 209.1536 3800.0 210.1407 8300.0 211.112 33000.0 211.1482 110000.0 213.1274 62000.0 213.1641 18000.0 213.4037 2600.0 214.1348 13000.0 215.1084 3000.0 215.1431 60000.0 216.1508 77000.0 217.1229 3800.0 217.159 4800.0 219.1173 14000.0 219.1382 140000.0 220.1249 28000.0 221.1322 51000.0 221.1538 270000.0 222.1391 10000.0 223.1122 6600.0 223.1482 59000.0 224.1547 3300.0 225.1269 26000.0 225.1639 54000.0 226.1351 3500.0 227.143 31000.0 227.1794 7300.0 229.1234 2700.0 229.1588 50000.0 230.128 2800.0 231.1152 3300.0 231.1382 56000.0 233.1309 20000.0 233.1542 46000.0 234.1391 17000.0 234.1615 260000.0 234.1888 2400.0 235.148 34000.0 236.1545 10000.0 237.1272 8500.0 237.1644 18000.0 239.1433 23000.0 239.1795 24000.0 241.1595 18000.0 243.1381 15000.0 246.1401 2700.0 247.1463 14000.0 248.1548 3300.0 249.1637 51000.0 251.1434 2600.0 251.179 23000.0 253.1589 27000.0 254.1649 3100.0 255.1387 8500.0 255.1744 6800.0 259.1473 4900.0 260.1569 4100.0 261.163 13000.0 263.1794 14000.0 267.1743 34000.0 268.1809 11000.0 269.19 26000.0 271.1697 24000.0 273.1631 3000.0 275.1799 3700.0 277.1964 2900.0 279.2132 2800.0 281.1903 9200.0 282.1977 7400.0 285.186 11000.0 286.193 58000.0 287.2008 62000.0 291.1758 2800.0 293.1916 3300.0 299.2014 2800.0 300.2081 15000.0 311.9152 2600.0 312.2083 6900.0 356.5939 2600.0 377.5165 2700.0 391.2625 2600.0 409.2755 15000.0 END IONS BEGIN IONS SCANS=659 PEPMASS=343.2272 CHARGE=1 COLLISION_ENERGY=0.0 51.346 2600.0 51.849 2200.0 54.2027 2100.0 55.054 98000.0 56.0654 2500.0 57.0697 66000.0 57.8658 2200.0 58.778 2600.0 59.0468 2700.0 60.5007 2100.0 61.4334 2800.0 61.7903 2400.0 62.5177 2500.0 62.7038 2600.0 63.47 2200.0 65.9623 2800.0 67.0539 110000.0 69.0695 440000.0 70.5625 2300.0 70.592 2300.0 71.5594 2200.0 71.9377 2400.0 72.5346 2500.0 74.0904 2500.0 76.9514 2500.0 79.0541 22000.0 79.3208 2200.0 81.0695 540000.0 83.0852 110000.0 84.0757 2500.0 84.1117 2500.0 91.054 21000.0 91.1628 2100.0 91.4401 2200.0 91.5177 2900.0 93.0696 47000.0 94.3016 2200.0 95.0489 7500.0 95.0852 550000.0 95.6367 2200.0 97.0949 3100.0 97.1009 130000.0 105.0696 17000.0 105.3809 2500.0 107.0489 110000.0 107.0851 42000.0 108.6148 2600.0 109.0927 12000.0 109.1009 490000.0 111.1166 18000.0 117.8008 2700.0 119.0491 16000.0 119.0849 2500.0 121.0648 29000.0 121.101 50000.0 121.3639 2500.0 123.1166 410000.0 124.0236 2300.0 131.1565 2400.0 132.1843 2600.0 133.0537 3400.0 133.0647 160000.0 135.1167 58000.0 137.1323 200000.0 138.3834 2500.0 138.6245 2200.0 145.0274 2500.0 145.0647 6300.0 147.0429 2800.0 147.0803 66000.0 149.1324 64000.0 151.0244 11000.0 151.0389 2400000.0 151.0515 17000.0 151.0594 3500.0 151.1484 4500.0 153.0544 2800.0 158.9876 2600.0 159.0443 2600.0 159.0802 20000.0 161.0608 2200.0 161.0961 150000.0 163.0393 46000.0 163.1481 2800.0 164.2899 2800.0 165.0547 460000.0 165.07 4300.0 171.4464 2400.0 173.061 3200.0 173.5243 11000.0 173.5334 140000.0 173.5447 17000.0 175.0392 24000.0 175.1119 56000.0 177.0397 2300.0 177.0548 120000.0 177.7501 2100.0 179.0704 92000.0 179.1792 3400.0 180.044 2400.0 183.257 2600.0 187.0753 27000.0 189.0546 68000.0 191.0703 66000.0 191.1791 19000.0 193.0861 57000.0 193.1943 5600.0 199.3375 2300.0 201.0911 35000.0 203.0705 27000.0 205.0861 43000.0 205.1959 6300.0 207.101 5800.0 217.0866 44000.0 219.102 39000.0 227.1057 5800.0 229.7833 2700.0 231.1021 35000.0 233.1161 9600.0 240.3496 2500.0 245.1174 21000.0 247.1336 38000.0 259.1335 38000.0 259.466 2300.0 261.1476 7400.0 273.1491 14000.0 287.1638 5400.0 289.1454 2500.0 290.0236 2500.0 290.5768 2900.0 299.4648 2700.0 301.8461 2400.0 325.2153 4500.0 336.8799 2800.0 342.9721 2300.0 343.2279 310000.0 343.2719 4200.0 END IONS BEGIN IONS SCANS=660 PEPMASS=205.1954 CHARGE=1 COLLISION_ENERGY=0.0 41.0386 290000.0 42.0337 140000.0 43.0541 130000.0 44.9044 12000.0 47.997 10000.0 50.9443 2900.0 51.0231 49000.0 51.1902 2400.0 53.002 19000.0 53.0384 510000.0 54.2647 4200.0 55.0543 6200000.0 55.0572 55000.0 55.0587 50000.0 55.9342 12000.0 57.0697 1400000.0 57.7618 3000.0 61.2577 11000.0 64.0657 2200.0 65.0385 160000.0 65.6367 2400.0 66.0461 17000.0 66.2322 2800.0 67.054 4200000.0 67.0582 22000.0 69.07 9300000.0 69.075 97000.0 69.076 54000.0 69.0786 25000.0 71.0852 300000.0 71.9291 4100.0 72.9368 300000.0 77.0384 310000.0 77.3592 11000.0 79.0543 7400000.0 79.0593 39000.0 79.062 56000.0 79.4773 4100.0 80.0619 50000.0 80.359 2300.0 81.0697 30000000.0 81.0784 190000.0 81.0792 650000.0 81.0806 110000.0 81.0908 14000.0 82.1477 2900.0 82.4796 13000.0 83.0852 1600000.0 90.9474 140000.0 91.054 3200000.0 92.0618 3800.0 93.0621 53000.0 93.0696 35000000.0 93.0763 170000.0 93.0814 860000.0 93.0832 110000.0 93.0878 55000.0 94.0773 5100.0 95.0489 900000.0 95.0853 9000000.0 95.0921 42000.0 95.0969 100000.0 95.88 3000.0 97.1009 1000000.0 98.3311 2800.0 99.9477 27000.0 100.7374 3100.0 102.803 4500.0 103.0541 150000.0 105.0445 300000.0 105.0617 27000.0 105.0696 2900000.0 105.0782 44000.0 106.0774 200000.0 107.0488 3300.0 107.0853 12000000.0 107.0927 43000.0 108.0933 21000.0 108.3866 2400.0 108.9582 2800.0 109.0646 320000.0 109.101 5200000.0 109.1102 11000.0 111.1166 190000.0 113.9548 4700.0 113.9634 470000.0 114.2856 2400.0 115.943 3300.0 116.5102 14000.0 116.8067 3500.0 118.8396 2300.0 119.0604 120000.0 119.0853 640000.0 120.0036 3100.0 120.0945 8300.0 121.0899 60000.0 121.1009 46000000.0 121.1121 980000.0 121.1221 160000.0 121.1231 470000.0 121.1273 66000.0 121.139 12000.0 122.3941 4400.0 123.0713 4000.0 123.0802 800000.0 123.1166 2400000.0 123.1259 2300.0 131.9742 54000.0 133.0759 210000.0 133.1012 75000.0 133.9524 3400.0 135.1166 3400000.0 135.1271 50000.0 135.9436 2300.0 137.1323 300000.0 140.2865 2900.0 147.1167 130000.0 149.0232 39000.0 149.1185 9700.0 149.1323 5900000.0 152.2046 3200.0 154.9905 5600.0 156.0025 2300.0 161.1333 16000.0 163.148 500000.0 165.337 2300.0 165.6118 10000.0 173.5253 18000.0 173.5374 120000.0 174.8727 2200.0 184.0488 2500.0 187.1268 2700.0 205.1953 220000.0 205.478 2500.0 212.386 2700.0 END IONS BEGIN IONS SCANS=661 PEPMASS=623.2508 CHARGE=1 COLLISION_ENERGY=0.0 65.6929 2200.0 66.8949 2500.0 67.2479 6800.0 67.2504 4600.0 69.9394 2400.0 70.3521 2400.0 70.791 2300.0 70.8498 2500.0 80.6857 2300.0 82.9107 2200.0 83.3349 2600.0 85.2948 2300.0 85.5301 2200.0 87.1205 2400.0 94.9985 2500.0 103.1302 2500.0 106.1228 2700.0 112.6563 2400.0 116.0325 2200.0 118.7059 2300.0 123.255 2900.0 133.6258 2200.0 148.661 2200.0 152.0089 3000.0 153.3601 2400.0 160.2935 2200.0 161.3647 2800.0 164.2809 2500.0 173.528 86000.0 173.5407 20000.0 225.2952 2600.0 251.678 2500.0 308.7775 2700.0 376.3563 2700.0 421.374 2700.0 434.2132 2800.0 435.2146 4800.0 436.2227 3700.0 444.1948 10000.0 445.2048 3400.0 461.1955 7300.0 462.2043 6600.0 462.2151 3100.0 463.2069 7700.0 471.2174 59000.0 472.1877 6400.0 473.1982 71000.0 474.2049 5800.0 475.2131 9600.0 483.2234 4200.0 485.1964 19000.0 486.206 20000.0 487.2129 12000.0 489.2248 58000.0 490.205 31000.0 490.2225 6000.0 491.2092 30000.0 492.2147 2800.0 499.2125 310000.0 500.1862 58000.0 501.2251 88000.0 502.1994 3000.0 503.2066 41000.0 505.2248 2700.0 507.2362 27000.0 508.2457 23000.0 511.2116 25000.0 513.1916 100000.0 514.2027 15000.0 516.2135 11000.0 517.2226 450000.0 517.2942 2200.0 518.2148 26000.0 518.2266 2700.0 519.2042 30000.0 521.2103 3000.0 527.2067 88000.0 528.2139 3600.0 529.2227 360000.0 531.2028 100000.0 532.207 4900.0 535.233 180000.0 536.2412 36000.0 545.2176 1400000.0 545.3179 7500.0 546.2201 5800.0 547.234 23000.0 549.2351 6700.0 555.2028 110000.0 562.2224 15000.0 563.2292 79000.0 564.2367 140000.0 573.2129 490000.0 577.244 210000.0 591.2239 110000.0 595.2554 53000.0 605.2391 420000.0 605.326 2200.0 623.2494 220000.0 END IONS BEGIN IONS SCANS=662 PEPMASS=600.4176 CHARGE=1 COLLISION_ENERGY=0.0 65.039 2500.0 67.054 10000.0 69.0333 3700.0 69.0696 24000.0 69.6796 2200.0 70.5545 2300.0 70.7738 2100.0 79.0539 12000.0 81.0695 43000.0 83.0489 9900.0 83.0853 21000.0 85.0648 3200.0 89.0595 8500.0 91.0541 15000.0 92.1283 2500.0 93.0695 64000.0 95.0491 2600.0 95.0851 50000.0 97.0644 13000.0 97.1015 3500.0 98.5855 2600.0 100.7801 2400.0 105.0695 46000.0 105.0769 3300.0 107.0851 78000.0 109.0646 7800.0 109.1008 45000.0 111.0797 2800.0 111.1163 2500.0 117.0692 8300.0 119.0851 100000.0 121.0644 10000.0 121.1008 110000.0 123.0808 3500.0 123.1164 18000.0 125.0597 2800.0 125.0955 14000.0 127.1432 2500.0 131.0852 41000.0 133.1008 71000.0 135.0802 13000.0 135.1165 44000.0 137.0957 5500.0 139.1114 15000.0 142.0772 3200.0 143.0852 31000.0 144.0939 3200.0 145.0646 5600.0 145.1008 93000.0 147.1164 28000.0 148.5116 2300.0 149.0958 25000.0 149.1321 12000.0 155.0848 6500.0 156.0932 3000.0 157.1009 55000.0 159.0803 13000.0 159.1165 64000.0 161.0964 12000.0 161.1322 16000.0 163.1117 13000.0 166.5688 2600.0 167.1064 85000.0 169.1008 23000.0 171.1165 40000.0 171.131 2400.0 173.1323 38000.0 173.518 2800.0 173.5315 86000.0 175.1119 12000.0 175.1479 36000.0 177.127 12000.0 178.9315 2400.0 181.1012 17000.0 182.107 2800.0 183.0079 2300.0 183.1168 32000.0 185.0958 3000.0 185.1323 24000.0 187.1478 21000.0 193.1024 4300.0 194.2463 2800.0 195.1165 25000.0 196.1241 5700.0 197.1137 3400.0 197.1322 33000.0 199.1103 2900.0 199.148 19000.0 201.1637 16000.0 203.1425 4100.0 207.1165 13000.0 209.1323 29000.0 211.1117 3800.0 211.1481 20000.0 213.1269 5300.0 213.1637 6500.0 217.1577 2800.0 219.1375 3500.0 221.1323 16000.0 221.1548 2500.0 223.1483 23000.0 225.1644 6000.0 227.1437 2400.0 233.1549 7700.0 235.148 8100.0 237.1639 10000.0 239.1796 8000.0 241.1594 2300.0 247.1471 12000.0 247.2422 6300.0 249.1625 6200.0 251.1795 3100.0 261.1633 3900.0 261.5549 2300.0 263.1797 5300.0 265.1953 6500.0 265.2522 12000.0 275.1788 3200.0 285.2184 3100.0 306.8998 2600.0 337.6905 2600.0 339.2906 12000.0 356.1843 2400.0 379.5291 2400.0 402.5135 3000.0 407.3105 2400.0 459.5454 2200.0 593.4709 2400.0 END IONS BEGIN IONS SCANS=663 PEPMASS=349.2528 CHARGE=1 COLLISION_ENERGY=0.0 54.8208 2500.0 55.054 25000.0 57.0697 10000.0 57.7284 2200.0 65.4916 2200.0 67.0539 39000.0 68.8048 2600.0 69.0695 32000.0 70.5837 2400.0 71.0488 4500.0 72.0827 2300.0 72.4475 2500.0 74.2379 2400.0 77.0383 2600.0 78.5753 2200.0 79.0538 34000.0 80.2069 2200.0 81.0696 63000.0 81.9051 2200.0 82.188 2600.0 83.0852 12000.0 86.1364 2400.0 91.0539 45000.0 93.0639 2700.0 93.0695 120000.0 95.0489 46000.0 95.0852 91000.0 97.0644 21000.0 105.0695 120000.0 105.4472 2400.0 107.0852 100000.0 109.0648 12000.0 109.1008 76000.0 117.0696 21000.0 119.0851 140000.0 121.0643 5400.0 121.1008 130000.0 123.0801 12000.0 123.1166 14000.0 129.0694 12000.0 131.0852 80000.0 132.0923 2500.0 133.1009 74000.0 135.0801 14000.0 135.1165 33000.0 142.0778 16000.0 143.0852 56000.0 144.0931 21000.0 145.1009 110000.0 146.1077 2600.0 147.0802 9400.0 147.1165 33000.0 149.0958 5400.0 155.0854 19000.0 156.0932 15000.0 157.1009 84000.0 158.1093 8500.0 159.1166 49000.0 160.8317 2800.0 161.0957 25000.0 161.1323 17000.0 167.0852 5400.0 168.0931 3000.0 169.1011 28000.0 170.109 15000.0 171.1167 45000.0 172.1245 11000.0 172.2857 2300.0 173.0962 4400.0 173.1323 34000.0 173.5286 32000.0 173.5383 16000.0 175.1113 3000.0 175.1479 10000.0 175.5508 2900.0 179.0853 8600.0 179.1426 3000.0 180.0933 2600.0 181.1009 14000.0 182.1084 4600.0 183.1168 28000.0 184.1248 3200.0 185.0957 2600.0 185.1325 33000.0 187.111 3500.0 187.148 24000.0 189.1288 2500.0 194.1086 14000.0 195.1168 24000.0 196.1245 4900.0 197.1322 28000.0 199.1486 11000.0 201.1633 2700.0 207.1156 5900.0 209.1328 25000.0 210.1407 6100.0 211.1486 14000.0 221.1308 3400.0 223.1482 9500.0 225.1642 14000.0 227.1427 3000.0 233.1322 2700.0 251.1797 9100.0 309.5614 2800.0 338.7448 2700.0 347.6337 2700.0 349.2532 12000.0 END IONS BEGIN IONS SCANS=664 PEPMASS=367.2632 CHARGE=1 COLLISION_ENERGY=0.0 55.054 41000.0 57.0696 29000.0 59.0489 9800.0 59.4118 2500.0 64.2837 2300.0 67.0539 62000.0 69.0332 21000.0 69.0695 49000.0 70.4559 2000.0 71.0489 18000.0 75.1246 2300.0 76.401 2100.0 79.0539 57000.0 80.6749 2300.0 80.9009 2200.0 81.0695 120000.0 83.0489 10000.0 83.0853 22000.0 85.0645 6800.0 88.7974 2200.0 90.21 2400.0 91.0484 3000.0 91.0539 66000.0 93.0693 180000.0 95.0488 73000.0 95.0849 170000.0 97.0645 40000.0 102.0475 2400.0 105.0695 160000.0 107.0494 2600.0 107.0773 3300.0 107.0851 150000.0 109.0643 33000.0 109.1008 110000.0 111.0802 8400.0 115.0545 2500.0 116.0618 2600.0 117.0694 35000.0 119.0852 230000.0 120.5757 2800.0 121.0645 26000.0 121.0921 7300.0 121.1008 140000.0 123.0803 16000.0 123.1167 24000.0 128.0619 12000.0 129.0697 25000.0 130.0776 5200.0 131.0852 160000.0 132.0939 2800.0 133.0651 2700.0 133.0904 3500.0 133.1009 160000.0 135.0801 39000.0 135.1166 44000.0 137.0957 11000.0 142.0774 28000.0 143.0852 95000.0 144.0928 27000.0 145.1009 180000.0 145.1138 3200.0 146.0722 9100.0 146.1073 9300.0 147.0802 28000.0 147.1165 58000.0 149.0959 24000.0 149.1321 3700.0 154.0771 2600.0 155.0854 25000.0 156.0926 27000.0 157.1008 140000.0 158.1084 20000.0 159.0806 16000.0 159.1165 110000.0 160.0891 3300.0 160.1241 2700.0 161.0959 120000.0 161.132 22000.0 163.1117 2600.0 167.0859 9800.0 168.0926 6300.0 169.101 49000.0 170.1087 21000.0 171.1166 76000.0 172.1237 15000.0 172.7208 2200.0 173.0961 18000.0 173.1323 77000.0 173.521 5300.0 173.5354 32000.0 175.1116 16000.0 175.1482 30000.0 179.0854 19000.0 180.0937 2700.0 181.1009 22000.0 182.1087 15000.0 183.1167 54000.0 184.1238 16000.0 185.0956 4300.0 185.1324 49000.0 186.1392 6300.0 187.1479 26000.0 192.9927 2400.0 193.1016 9000.0 194.1088 26000.0 195.1168 30000.0 196.1238 16000.0 197.1322 39000.0 199.148 24000.0 200.1556 3300.0 201.127 7300.0 201.1635 11000.0 203.804 2700.0 206.1899 2700.0 207.1172 7300.0 209.1324 36000.0 210.1381 5700.0 211.1481 23000.0 212.1571 2400.0 213.1284 7500.0 221.1317 4300.0 223.148 6700.0 225.1634 13000.0 227.143 3500.0 236.1552 3200.0 237.1631 8500.0 238.9835 2300.0 239.1807 4800.0 251.1788 4100.0 255.1734 2400.0 279.1737 3700.0 291.8649 3000.0 302.4102 2500.0 307.1965 2300.0 316.472 2600.0 END IONS BEGIN IONS SCANS=665 PEPMASS=618.428 CHARGE=1 COLLISION_ENERGY=0.0 67.0538 24000.0 69.033 14000.0 69.0694 20000.0 71.0487 8900.0 77.4071 2100.0 79.0539 29000.0 80.0616 5400.0 80.8521 2600.0 81.0694 110000.0 83.0486 34000.0 83.085 190000.0 85.0642 17000.0 85.3169 2600.0 86.7603 2400.0 89.7197 2500.0 91.0538 24000.0 93.0693 100000.0 95.0434 2500.0 95.0486 69000.0 95.085 89000.0 95.461 2800.0 97.0643 69000.0 99.0437 21000.0 105.0694 100000.0 106.0776 3300.0 107.085 150000.0 109.0643 43000.0 109.1006 66000.0 111.08 21000.0 113.0955 37000.0 117.0694 18000.0 119.085 180000.0 120.0927 22000.0 121.0643 23000.0 121.1007 140000.0 123.08 71000.0 123.116 18000.0 125.0592 22000.0 125.0956 61000.0 128.0619 2800.0 129.0695 15000.0 131.0851 87000.0 132.0928 18000.0 133.0645 3300.0 133.0905 6400.0 133.1007 130000.0 134.1083 12000.0 135.08 54000.0 135.1165 46000.0 136.0882 2300.0 137.059 4200.0 137.0957 35000.0 139.0748 12000.0 139.1112 55000.0 141.0909 2500.0 142.0775 13000.0 143.085 80000.0 144.0928 47000.0 145.1007 220000.0 145.114 3300.0 146.1077 13000.0 147.08 67000.0 147.1163 69000.0 149.0957 47000.0 149.1325 3400.0 150.1041 3500.0 151.075 47000.0 151.1112 9900.0 153.0905 17000.0 155.085 27000.0 155.1061 38000.0 156.0932 19000.0 157.1007 200000.0 158.1084 37000.0 159.08 27000.0 159.1164 140000.0 160.0878 77000.0 160.1239 3500.0 161.0957 54000.0 161.132 34000.0 162.1023 2600.0 163.1114 82000.0 165.0907 200000.0 165.1263 14000.0 166.0941 3600.0 167.0858 3400.0 167.1063 47000.0 168.114 3300.0 169.101 69000.0 169.117 2700.0 169.1226 2500.0 170.1088 24000.0 171.0807 3500.0 171.1013 9800.0 171.1166 140000.0 172.124 49000.0 173.096 36000.0 173.1324 78000.0 173.5234 20000.0 173.5389 41000.0 174.1028 3100.0 175.1115 54000.0 175.1478 19000.0 176.1189 8400.0 177.0904 12000.0 177.1269 16000.0 178.0982 11000.0 179.106 9500.0 179.1428 27000.0 180.1142 13000.0 181.1012 28000.0 181.122 120000.0 182.1089 13000.0 182.1259 3000.0 183.1165 81000.0 183.1375 25000.0 184.1236 18000.0 185.0961 14000.0 185.1322 95000.0 186.1396 10000.0 187.1114 46000.0 187.1271 2600.0 187.1302 2500.0 187.148 53000.0 189.1271 47000.0 190.1348 67000.0 191.1064 16000.0 191.1426 44000.0 193.1027 14000.0 193.1221 43000.0 194.1094 9000.0 194.1297 5900.0 195.1164 54000.0 195.1368 18000.0 196.1243 15000.0 197.1322 110000.0 198.1045 2800.0 198.1387 14000.0 199.1116 24000.0 199.1481 46000.0 200.1193 2600.0 201.1271 38000.0 201.1628 4100.0 202.1351 2400.0 203.1429 130000.0 204.1477 3100.0 205.1223 5200.0 206.1095 2900.0 207.1165 30000.0 207.138 56000.0 208.1248 9800.0 208.1456 51000.0 209.1323 87000.0 209.1533 14000.0 210.1395 13000.0 211.1116 20000.0 211.1482 68000.0 212.1194 4400.0 212.155 10000.0 213.127 32000.0 213.1636 23000.0 215.1432 28000.0 216.1509 13000.0 217.1233 8600.0 217.1584 5700.0 219.1162 7400.0 219.1382 30000.0 221.1324 29000.0 221.1536 340000.0 222.1392 4700.0 222.1594 3400.0 223.1483 52000.0 224.1557 10000.0 225.1262 17000.0 225.1484 44000.0 225.1669 13000.0 227.1429 20000.0 227.1798 17000.0 228.1513 3100.0 229.1587 21000.0 231.1381 36000.0 231.1735 3800.0 233.131 12000.0 233.1537 120000.0 234.1388 7700.0 234.1613 66000.0 235.1479 27000.0 237.127 17000.0 237.1638 40000.0 238.1695 3500.0 239.1429 12000.0 239.1794 18000.0 241.1588 16000.0 243.1376 3000.0 243.174 5200.0 245.1543 14000.0 246.1616 15000.0 247.1461 8000.0 247.1694 73000.0 249.1302 2400.0 249.1635 24000.0 251.1441 10000.0 251.179 25000.0 253.1585 23000.0 253.1918 6300.0 255.174 42000.0 257.1894 9800.0 259.1708 14000.0 260.1777 3100.0 261.1613 10000.0 261.1866 11000.0 263.1796 17000.0 265.1597 12000.0 265.1951 14000.0 267.1741 22000.0 269.1577 3400.0 269.1899 26000.0 271.1695 17000.0 273.1852 38000.0 274.1934 23000.0 275.1793 8400.0 277.1943 7000.0 279.1752 16000.0 281.156 2700.0 281.1898 24000.0 283.1711 14000.0 285.1857 20000.0 286.1929 61000.0 287.2009 410000.0 291.2113 9900.0 293.1899 8400.0 294.199 2900.0 295.1718 3700.0 295.2061 14000.0 297.1853 23000.0 298.1946 13000.0 299.2007 70000.0 300.2073 17000.0 303.1976 10000.0 307.2059 13000.0 308.5944 2500.0 309.1847 11000.0 309.2226 3000.0 310.1932 10000.0 311.2009 20000.0 312.2083 24000.0 313.2159 46000.0 315.2109 2800.0 319.2054 24000.0 321.2203 3300.0 323.1995 7100.0 325.2162 37000.0 326.2242 2900.0 329.2134 14000.0 333.2196 3800.0 334.2269 2700.0 337.2164 68000.0 339.2323 49000.0 352.2399 200000.0 353.248 47000.0 363.2291 3700.0 365.2478 92000.0 367.264 18000.0 377.2483 6900.0 379.2651 3000.0 391.2663 3900.0 395.2588 75000.0 404.8769 2600.0 438.3198 2800.0 440.2897 3800.0 480.3233 23000.0 523.3452 2900.0 525.3589 27000.0 526.3604 11000.0 538.3661 91000.0 603.4066 3300.0 END IONS BEGIN IONS SCANS=666 PEPMASS=655.3128 CHARGE=1 COLLISION_ENERGY=0.0 68.8082 2700.0 68.8119 2500.0 69.0398 2100.0 74.7924 2300.0 78.0213 2200.0 78.4348 2300.0 82.3461 2400.0 82.8247 2500.0 87.7992 2100.0 88.6985 2600.0 89.627 2100.0 100.2424 2300.0 101.4958 2900.0 101.9628 2300.0 107.952 2500.0 112.0262 2400.0 120.6302 2400.0 131.7962 2800.0 131.8931 2300.0 138.3925 2300.0 163.9611 2500.0 173.5251 57000.0 173.5334 29000.0 173.544 32000.0 178.4724 2700.0 187.3214 2500.0 227.1182 3200.0 239.1528 5300.0 246.8627 2400.0 269.1276 2700.0 275.8958 2700.0 327.1736 7800.0 334.1938 2500.0 351.6282 2400.0 355.2712 2600.0 384.1714 22000.0 389.2112 4000.0 390.2169 16000.0 402.2176 14000.0 406.2123 8400.0 407.2223 11000.0 412.1655 40000.0 419.2231 3300.0 420.2285 21000.0 421.236 26000.0 426.182 22000.0 427.1894 12000.0 433.2366 28000.0 434.2425 7100.0 435.2522 48000.0 436.2599 92000.0 444.1927 27000.0 447.2477 2700.0 448.2602 69000.0 449.233 2800.0 450.6787 2500.0 454.5166 3000.0 460.2275 8300.0 463.2128 46000.0 473.235 15000.0 474.2415 3500.0 475.2138 12000.0 477.2289 45000.0 487.2508 11000.0 488.2576 3700.0 491.2438 19000.0 492.2558 5400.0 505.2605 3800.0 509.2889 7200.0 515.2439 16000.0 517.226 10000.0 519.279 9200.0 520.2826 38000.0 531.2402 14000.0 532.2517 3400.0 532.2648 2600.0 533.259 35000.0 535.2343 19000.0 536.2439 16000.0 537.284 12000.0 546.2677 2800.0 547.2707 9300.0 549.2583 21000.0 553.2659 4100.0 559.2694 120000.0 561.2867 320000.0 561.3864 8800.0 563.2662 170000.0 564.2736 390000.0 565.2788 21000.0 577.2739 66000.0 578.2885 83000.0 580.2638 40000.0 581.2726 2900.0 587.2675 11000.0 591.2746 60000.0 593.3132 150000.0 594.2515 2900.0 595.29 46000.0 600.5212 2800.0 605.2755 100000.0 608.2603 42000.0 609.2805 3500.0 619.2915 300000.0 623.2855 29000.0 637.3023 160000.0 640.2848 58000.0 655.3082 34000.0 END IONS BEGIN IONS SCANS=667 PEPMASS=205.1954 CHARGE=1 COLLISION_ENERGY=0.0 41.0385 400000.0 42.0337 92000.0 43.0541 170000.0 48.8218 5600.0 51.023 25000.0 53.0021 3400.0 53.0205 5700.0 53.0384 370000.0 53.6504 2600.0 54.0048 5500.0 55.0178 2700.0 55.0541 5300000.0 55.0572 22000.0 55.0587 16000.0 55.5709 2600.0 55.9343 37000.0 57.0697 1300000.0 57.227 2700.0 57.6255 2200.0 58.8167 2500.0 60.7317 6100.0 65.0384 140000.0 66.0463 11000.0 66.0671 6200.0 67.054 3700000.0 67.0584 9100.0 68.9186 2100.0 69.0698 7600000.0 69.0738 27000.0 69.0764 23000.0 69.0786 8200.0 69.2675 2200.0 70.9566 2500.0 71.0853 250000.0 71.4352 2300.0 71.6189 6000.0 71.9403 2500.0 72.9368 430000.0 73.0283 9900.0 73.6 2500.0 74.737 2300.0 77.0385 220000.0 77.7352 2600.0 78.0463 2300.0 78.9524 2800.0 79.0541 5500000.0 79.0604 32000.0 79.0621 14000.0 79.065 7500.0 80.0619 21000.0 81.0697 22000000.0 81.0783 75000.0 81.0794 590000.0 81.0807 45000.0 81.0909 5700.0 81.7249 2400.0 82.8927 2400.0 83.0852 1500000.0 83.0924 13000.0 85.4615 2200.0 90.9474 260000.0 91.054 2400000.0 91.0602 5300.0 93.0621 28000.0 93.0696 26000000.0 93.0802 69000.0 93.0815 680000.0 93.0832 52000.0 93.0873 20000.0 93.0915 7800.0 95.0489 680000.0 95.0853 7500000.0 95.0937 76000.0 95.0992 12000.0 95.1147 2600.0 96.2912 2400.0 97.1009 920000.0 97.1729 2400.0 99.9479 53000.0 100.0731 2300.0 103.0541 87000.0 105.0444 230000.0 105.0696 2000000.0 105.0783 21000.0 106.0774 140000.0 107.0495 5800.0 107.0853 10000000.0 107.093 39000.0 107.0994 22000.0 107.102 16000.0 107.9504 2500.0 108.1808 2300.0 108.6825 2300.0 108.9576 8800.0 109.0645 250000.0 109.1009 4600000.0 109.1119 19000.0 111.1166 180000.0 113.9549 3500.0 113.9634 740000.0 114.4055 2500.0 114.5308 2600.0 115.9426 5600.0 117.07 2700.0 119.0603 90000.0 119.0768 4100.0 119.0853 480000.0 120.0933 2700.0 120.2495 2100.0 121.0794 19000.0 121.0898 35000.0 121.1009 33000000.0 121.1097 600000.0 121.1219 400000.0 121.123 79000.0 121.1274 25000.0 122.3808 2700.0 123.0802 780000.0 123.1069 12000.0 123.1166 2000000.0 126.653 2800.0 131.9742 100000.0 133.0758 130000.0 133.1012 82000.0 133.3061 2300.0 135.1166 2900000.0 135.1268 23000.0 137.1323 260000.0 138.4553 7200.0 141.3396 2200.0 146.612 2700.0 147.1167 110000.0 148.1241 3200.0 149.0232 47000.0 149.1184 3000.0 149.1324 4900000.0 149.1451 13000.0 150.3009 2400.0 151.3814 2400.0 158.9671 2300.0 161.1328 25000.0 162.1402 7300.0 163.148 440000.0 173.5267 240000.0 173.5416 130000.0 177.1649 3100.0 178.9452 2400.0 179.0601 6700.0 187.577 6700.0 197.7856 5300.0 205.1953 170000.0 210.8115 2800.0 211.2287 2200.0 215.9342 2700.0 END IONS BEGIN IONS SCANS=668 PEPMASS=303.1959 CHARGE=1 COLLISION_ENERGY=0.0 49.8252 2000.0 53.6163 2200.0 53.7083 2300.0 55.0542 3800.0 55.2184 2500.0 55.7458 2500.0 57.8988 2600.0 58.569 2500.0 60.8717 2100.0 67.054 7500.0 69.0696 23000.0 71.4463 2200.0 73.9734 2500.0 79.0539 54000.0 79.5252 2400.0 81.0695 17000.0 84.0238 2400.0 91.0538 7100.0 91.4456 2300.0 93.0695 34000.0 95.0852 3100.0 96.3791 2200.0 107.0851 26000.0 109.101 2400.0 121.2626 2300.0 121.9395 2400.0 123.08 3800.0 131.8271 2700.0 133.1012 2900.0 135.1162 7200.0 136.0513 18000.0 139.0145 2800.0 149.6886 5400.0 151.0751 34000.0 153.0916 2800.0 154.0624 10000.0 159.0808 4300.0 166.0624 150000.0 166.0768 4600.0 167.07 7300.0 173.5337 44000.0 176.0842 5800.0 181.0858 240000.0 185.0958 2600.0 188.0833 2500.0 189.0907 9700.0 190.0979 16000.0 190.6902 2300.0 192.5791 2300.0 195.101 3200.0 198.1044 2700.0 201.0913 10000.0 202.0984 12000.0 203.1079 3600.0 206.0945 2600.0 208.2061 2400.0 213.0909 24000.0 216.115 12000.0 217.0015 2700.0 219.1015 23000.0 228.1151 2700.0 229.1222 79000.0 232.1087 2600.0 232.6509 2700.0 245.1172 22000.0 247.1318 3000.0 251.0959 2200.0 272.1788 7300.0 293.7867 2600.0 END IONS BEGIN IONS SCANS=669 PEPMASS=454.2592 CHARGE=1 COLLISION_ENERGY=0.0 56.0657 2200.0 56.1472 2300.0 56.3366 2400.0 57.0697 10000.0 57.2867 2300.0 60.5512 2100.0 61.1324 2200.0 61.2158 2100.0 61.246 2300.0 61.4394 2200.0 61.9093 2400.0 62.1086 2200.0 62.1922 2600.0 62.8145 2100.0 65.2272 2500.0 67.0542 33000.0 69.0334 3000.0 69.0698 38000.0 69.449 2600.0 69.7527 3500.0 70.1088 2400.0 70.1977 2100.0 70.3878 2400.0 70.835 2200.0 71.0853 3000.0 71.1505 2200.0 71.3729 2500.0 71.6233 2300.0 72.0584 2100.0 72.403 2300.0 73.8094 2300.0 74.8329 2300.0 79.0541 17000.0 81.0334 14000.0 81.0698 130000.0 81.4355 2400.0 82.4956 2300.0 83.0492 5400.0 83.0852 17000.0 84.3149 2600.0 88.0404 2400.0 88.2192 2400.0 89.0595 110000.0 89.3888 2300.0 90.9761 2500.0 91.0542 19000.0 93.0698 180000.0 95.0489 5600.0 95.0854 58000.0 95.5431 2700.0 96.1967 2500.0 96.2645 2500.0 97.4564 2500.0 97.8501 2200.0 98.0599 2400000.0 98.0685 14000.0 99.3756 3100.0 102.4937 2500.0 105.0698 65000.0 106.6552 2400.0 107.0856 44000.0 109.0647 6500.0 109.1011 62000.0 109.3457 5000.0 110.0518 5500.0 110.0599 280000.0 110.924 2200.0 115.3266 2500.0 117.3061 2700.0 119.0493 8000.0 119.0855 72000.0 120.0206 2500.0 121.0646 5700.0 121.101 76000.0 121.816 2500.0 123.0803 3200.0 123.1167 76000.0 124.6803 2300.0 125.0965 3500.0 128.3499 2600.0 129.0699 18000.0 129.7222 2300.0 133.0291 2400.0 133.0646 120000.0 133.0858 35000.0 133.1011 25000.0 133.3139 2400.0 133.435 2300.0 134.9674 2500.0 135.0793 3000.0 135.1168 100000.0 136.0756 24000.0 137.0961 5600.0 137.133 7600.0 139.3391 2400.0 141.6975 2300.0 147.0802 87000.0 147.1168 170000.0 148.0515 21000.0 149.6874 5500.0 149.7175 2600.0 151.0753 6100.0 152.0595 3200.0 152.0705 590000.0 152.0847 9000.0 160.947 2400.0 161.1324 130000.0 162.0669 3000.0 163.1116 74000.0 164.0826 2400.0 165.0553 9000.0 166.0625 67000.0 167.0712 2200.0 168.2604 2300.0 169.0856 17000.0 171.117 24000.0 173.5265 160000.0 173.5404 130000.0 174.6414 2600.0 175.0758 26000.0 175.1121 11000.0 176.083 51000.0 178.1766 2400.0 179.0698 9400.0 180.0782 110000.0 181.0691 8400.0 181.0859 2500000.0 181.1019 11000.0 183.5512 2500.0 188.0838 5100.0 189.1274 190000.0 190.0624 99000.0 190.0987 9600.0 191.0705 31000.0 192.0799 2900.0 193.0488 5400.0 193.0858 46000.0 194.4542 2500.0 195.045 3300.0 195.0654 260000.0 195.1015 710000.0 202.0985 13000.0 203.0704 35000.0 204.0783 80000.0 204.115 2900.0 205.086 35000.0 206.0576 22000.0 206.0952 2900.0 207.1017 250000.0 208.0731 160000.0 209.1175 25000.0 215.1069 3200.0 216.1138 7300.0 216.3014 2600.0 218.1303 21000.0 219.1016 170000.0 220.0733 29000.0 221.0564 11000.0 221.0809 930000.0 221.1058 3700.0 221.118 80000.0 222.0853 2700.0 223.0708 3300.0 223.0965 500000.0 224.4139 2600.0 227.3242 2300.0 228.1143 7900.0 228.6059 2200.0 230.0944 15000.0 231.1018 110000.0 231.1372 2800.0 232.1102 17000.0 233.0805 17000.0 233.0925 2900.0 233.1172 120000.0 233.7751 2600.0 234.3289 2200.0 235.0963 480000.0 235.1324 22000.0 236.1023 5400.0 238.0409 2700.0 239.1076 3000.0 240.1151 11000.0 241.1225 49000.0 242.1307 14000.0 244.1094 17000.0 245.1172 170000.0 246.1238 8600.0 247.0964 17000.0 247.1327 84000.0 249.1482 38000.0 250.9823 2800.0 251.6561 2400.0 252.1122 2500.0 255.1022 21000.0 255.1407 5500.0 256.1091 39000.0 257.1168 48000.0 257.2513 3200.0 258.1253 29000.0 259.1021 3000.0 259.1327 180000.0 261.112 39000.0 261.1473 35000.0 265.667 2600.0 266.1301 19000.0 269.1175 16000.0 269.1523 9500.0 270.1253 6100.0 271.1329 59000.0 272.1405 28000.0 272.1748 3600.0 273.1127 85000.0 273.1481 130000.0 275.128 36000.0 282.1247 4900.0 282.1609 14000.0 283.1329 55000.0 283.1675 27000.0 284.1431 3900.0 284.1773 93000.0 285.1458 3400.0 287.1279 100000.0 287.162 32000.0 289.1446 14000.0 293.1546 2800.0 296.1403 4400.0 297.1489 40000.0 298.1562 34000.0 298.1927 53000.0 299.1279 79000.0 299.1643 12000.0 300.1724 28000.0 301.1432 130000.0 301.1779 11000.0 303.196 17000.0 308.1771 62000.0 311.1669 7700.0 313.1426 2400.0 313.1798 130000.0 314.1515 12000.0 314.1884 3500.0 315.1587 56000.0 315.1958 510000.0 315.2277 2200.0 324.1713 8800.0 325.1794 6000.0 326.1873 72000.0 329.1733 19000.0 329.2115 180000.0 339.1951 180000.0 342.1836 35000.0 352.8063 2900.0 357.1533 5600.0 357.1676 3500.0 357.2057 1800000.0 357.2568 5800.0 370.869 2600.0 374.9507 2600.0 395.1149 2400.0 402.4371 2800.0 405.3531 2400.0 405.4181 2400.0 454.0652 2600.0 END IONS BEGIN IONS SCANS=670 PEPMASS=476.2412 CHARGE=1 COLLISION_ENERGY=0.0 61.1937 2300.0 61.2233 2700.0 61.4986 2300.0 61.654 2300.0 61.9528 2200.0 62.4891 2200.0 62.7953 2200.0 63.348 2200.0 65.7027 2500.0 67.5399 2100.0 69.1717 2100.0 73.6781 2200.0 75.4976 3600.0 75.7288 2300.0 78.6686 2500.0 79.7005 2200.0 83.2816 2400.0 85.7509 2400.0 90.8153 2700.0 92.1664 2300.0 92.4047 2900.0 95.0701 2300.0 96.609 2200.0 98.2492 2200.0 103.1 2700.0 106.1821 2400.0 108.2093 2800.0 108.5357 2400.0 115.805 2700.0 119.034 14000.0 120.0417 21000.0 120.2225 2300.0 128.1103 2200.0 136.3583 2300.0 139.4753 2400.0 142.9607 2500.0 145.7175 2500.0 145.9775 2200.0 147.0287 15000.0 149.5355 2500.0 149.6232 2900.0 149.6879 5500.0 153.5843 2400.0 156.2146 2300.0 168.023 2800.0 173.526 53000.0 173.5376 99000.0 174.0523 52000.0 183.0795 2200.0 186.4025 2200.0 193.2947 2200.0 203.7849 2400.0 217.0835 22000.0 217.3623 2300.0 227.1924 3100.0 229.1105 3400.0 235.0079 2500.0 248.1877 2100.0 260.2031 2600.0 261.6698 2400.0 274.437 2600.0 274.6358 2600.0 282.1128 2600.0 292.5614 3100.0 304.3403 2800.0 309.2411 2200.0 309.9062 2500.0 317.8886 2500.0 321.4301 2400.0 325.0915 3100.0 336.7242 2700.0 338.036 2300.0 338.8126 2500.0 340.0679 4200.0 340.1153 960000.0 341.123 26000.0 369.4641 2600.0 379.1844 6800.0 386.3129 2900.0 431.9655 3100.0 441.3488 2900.0 460.6343 2800.0 476.2408 170000.0 485.7976 2500.0 END IONS BEGIN IONS SCANS=671 PEPMASS=653.2971 CHARGE=1 COLLISION_ENERGY=0.0 68.2613 2300.0 68.534 2700.0 71.253 2300.0 73.0213 2200.0 78.9558 2500.0 81.8545 2500.0 84.3404 2200.0 84.6446 2100.0 87.7833 2300.0 92.0637 2700.0 98.5276 2700.0 99.6962 2200.0 105.0981 2900.0 108.7482 2400.0 119.336 2400.0 147.4258 2200.0 149.3115 2700.0 163.1966 2400.0 173.524 30000.0 173.5374 61000.0 173.5442 7100.0 182.8053 2600.0 183.7831 2600.0 222.0773 3000.0 235.7735 2600.0 358.108 2900.0 436.2259 12000.0 446.2403 2800.0 449.1953 9500.0 450.2029 2600.0 463.2097 11000.0 464.2198 54000.0 465.2242 5300.0 467.1206 2600.0 475.211 7400.0 477.1931 11000.0 478.1996 7400.0 491.2098 6800.0 492.2119 34000.0 493.2222 3300.0 503.2467 3900.0 505.2255 3800.0 519.2375 2900.0 523.2369 12000.0 536.2911 2800.0 537.2079 3400.0 547.234 19000.0 549.2536 8200.0 550.2551 14000.0 551.2657 10000.0 552.2335 15000.0 564.2728 39000.0 565.2541 54000.0 565.2713 32000.0 575.2642 61000.0 577.8436 3100.0 578.2518 92000.0 579.2591 18000.0 583.2944 8800.0 592.2614 4000.0 593.1675 8400.0 593.2753 310000.0 596.2927 2600.0 606.2471 16000.0 607.2544 6800.0 609.2708 16000.0 610.2747 22000.0 611.2835 3400.0 621.269 26000.0 622.8051 2800.0 624.2905 46000.0 625.2943 21000.0 635.2856 57000.0 636.2742 5800.0 638.2728 170000.0 653.2964 270000.0 653.4194 4500.0 END IONS BEGIN IONS SCANS=672 PEPMASS=499.317 CHARGE=1 COLLISION_ENERGY=0.0 60.1743 3000.0 60.5104 2300.0 63.3701 2400.0 64.5935 2200.0 66.881 2400.0 68.8315 2200.0 70.3837 2300.0 71.2578 2500.0 72.2708 2300.0 72.7143 2700.0 73.8189 2500.0 74.3825 2400.0 78.3202 2300.0 78.753 2900.0 79.054 3000.0 81.0335 6500.0 81.0696 130000.0 81.9855 2200.0 83.1097 2500.0 83.3523 2500.0 86.9976 2500.0 89.0596 28000.0 90.766 2300.0 93.0697 36000.0 94.5831 2300.0 95.0853 21000.0 95.9367 4200.0 98.0598 1000000.0 98.0708 3200.0 100.1302 2400.0 100.3244 2400.0 100.4444 2600.0 100.9299 2100.0 101.3329 2600.0 105.07 3000.0 107.0851 2500.0 109.1011 5600.0 110.0517 4200.0 110.0598 240000.0 110.8328 2400.0 112.9297 2400.0 114.5402 2200.0 115.1402 2300.0 116.8598 2400.0 118.6929 2600.0 119.0856 3400.0 121.1012 3400.0 122.694 2300.0 123.1182 2300.0 125.0063 2200.0 125.2962 2700.0 128.4143 2500.0 131.5265 2700.0 133.0649 15000.0 133.0851 3100.0 133.4518 2100.0 135.1167 20000.0 135.7414 2300.0 137.1321 22000.0 139.9643 2300.0 140.068 3100.0 141.4136 2300.0 145.9058 2400.0 147.0806 7000.0 147.1165 25000.0 149.1682 2400.0 149.6694 3800.0 149.6899 12000.0 151.4373 2400.0 152.0561 4900.0 152.0704 1200000.0 152.0849 4600.0 153.7952 2200.0 161.1322 17000.0 169.7935 2700.0 172.6144 2600.0 173.5246 43000.0 173.5351 200000.0 173.5475 3900.0 178.6976 2500.0 180.0783 12000.0 181.0859 530000.0 181.102 2200.0 182.3216 2500.0 189.1277 43000.0 190.0625 30000.0 191.0699 3700.0 193.0856 3500.0 195.0653 47000.0 195.1013 150000.0 195.3857 2400.0 202.5456 2400.0 203.8448 2400.0 204.0787 3200.0 206.0576 3000.0 207.1018 25000.0 208.0731 34000.0 209.4381 2700.0 214.2229 2600.0 216.1152 2600.0 219.102 31000.0 221.0809 1100000.0 221.1185 9100.0 223.0967 210000.0 228.2795 2500.0 231.9298 2500.0 233.1164 19000.0 235.0965 110000.0 237.4999 2600.0 245.1168 21000.0 247.0969 2800.0 247.1326 18000.0 247.8385 2800.0 249.1483 2800.0 249.3075 2400.0 251.5509 2500.0 255.8833 2500.0 257.1178 2400.0 259.1322 23000.0 263.2768 2600.0 269.1828 2500.0 272.1777 2800.0 273.1131 11000.0 273.1476 17000.0 283.1297 2500.0 284.1768 6000.0 287.1281 12000.0 292.219 2500.0 301.1438 14000.0 303.1957 74000.0 304.9669 2400.0 308.1812 2500.0 308.2462 2600.0 313.1803 14000.0 315.159 7800.0 315.196 130000.0 326.1188 2400.0 326.186 3700.0 329.2117 56000.0 339.1956 37000.0 357.1673 3100.0 357.2061 730000.0 357.2566 11000.0 364.3046 2700.0 395.5104 2400.0 410.3533 2500.0 412.7327 2800.0 425.8279 2700.0 435.5302 2300.0 438.3363 2400.0 442.8694 2800.0 448.1729 3100.0 451.7095 3000.0 465.3929 2500.0 469.4545 2900.0 476.9292 2600.0 479.8723 2600.0 480.9402 2200.0 END IONS BEGIN IONS SCANS=673 PEPMASS=639.2455 CHARGE=1 COLLISION_ENERGY=0.0 73.9169 2200.0 75.4803 2200.0 82.701 2500.0 91.2412 2500.0 123.0671 2500.0 129.4031 2700.0 133.352 2900.0 173.5166 9200.0 173.5311 76000.0 173.5465 13000.0 189.3448 2800.0 253.0379 2500.0 284.1444 2900.0 321.6617 3000.0 330.1601 3200.0 342.121 2500.0 370.1547 10000.0 396.1716 2700.0 409.1412 2500.0 414.1439 37000.0 421.2024 10000.0 426.1421 8200.0 434.2092 39000.0 435.2171 20000.0 436.2249 14000.0 445.2408 3600.0 451.2121 4200.0 458.3523 2400.0 461.2335 2700.0 462.2405 5100.0 463.2465 30000.0 465.1918 100000.0 466.2001 11000.0 474.2033 8900.0 475.2133 3700.0 477.1917 2700.0 479.2079 130000.0 480.2154 120000.0 489.2254 40000.0 489.2979 6800.0 490.2355 15000.0 491.2412 33000.0 493.2216 10000.0 501.1909 10000.0 502.1991 12000.0 505.1875 29000.0 506.197 99000.0 507.2379 120000.0 508.2464 87000.0 515.2074 17000.0 516.2152 18000.0 517.134 9300.0 517.2226 430000.0 518.2291 38000.0 519.2029 33000.0 523.2292 46000.0 524.2413 29000.0 533.2171 22000.0 534.2263 13000.0 535.1384 3400.0 535.2328 330000.0 535.329 3500.0 536.2424 8800.0 537.213 76000.0 540.2363 18000.0 548.2063 6300.0 549.2425 3300.0 551.2283 95000.0 552.2361 570000.0 561.213 220000.0 561.315 4500.0 562.2206 30000.0 563.2281 12000.0 563.3489 23000.0 567.2621 2800.0 577.2479 5000.0 579.2236 290000.0 580.2313 30000.0 581.3604 43000.0 589.2072 3600.0 593.2382 59000.0 595.2548 36000.0 611.2503 16000.0 621.2332 120000.0 621.3671 4600.0 621.3945 8700.0 639.245 68000.0 639.4003 28000.0 END IONS BEGIN IONS SCANS=674 PEPMASS=409.2741 CHARGE=1 COLLISION_ENERGY=0.0 54.4861 2200.0 55.054 72000.0 55.7374 2100.0 57.0697 29000.0 57.9898 2100.0 58.8384 2100.0 59.0489 8200.0 60.9451 2300.0 65.7816 2300.0 67.054 53000.0 69.0332 30000.0 69.0696 24000.0 71.757 2700.0 71.9232 2800.0 73.1581 2100.0 73.1761 2300.0 73.956 2400.0 74.2958 2400.0 79.0539 54000.0 80.5536 2200.0 81.0653 2700.0 81.0695 160000.0 81.2753 2500.0 83.0488 35000.0 83.0856 11000.0 83.1809 2200.0 84.9453 2700.0 85.0646 12000.0 85.1687 2000.0 86.5714 2400.0 86.6067 2100.0 88.1675 2300.0 89.7465 2300.0 90.4855 2300.0 91.0539 80000.0 91.7768 2500.0 93.0695 240000.0 94.4858 2300.0 95.0425 3200.0 95.0488 240000.0 95.0852 150000.0 95.4343 2200.0 97.0498 2300.0 97.0645 70000.0 97.3896 3200.0 98.0772 2300.0 103.053 2300.0 104.737 2400.0 105.0695 410000.0 107.0483 2800.0 107.0851 140000.0 107.4667 2400.0 109.0645 65000.0 109.1008 57000.0 111.0801 7000.0 114.9215 2500.0 117.0696 31000.0 119.0485 7000.0 119.0768 4000.0 119.0852 300000.0 121.0645 92000.0 121.1009 100000.0 121.1865 2100.0 121.3457 2400.0 123.08 71000.0 123.288 2700.0 125.0966 2800.0 129.0695 19000.0 131.0852 100000.0 131.8313 2500.0 133.0647 26000.0 133.1008 120000.0 135.0802 63000.0 135.1166 27000.0 137.0957 46000.0 139.1131 2400.0 141.07 3000.0 142.0777 32000.0 143.0851 78000.0 144.0928 14000.0 144.6481 2500.0 145.0648 2900.0 145.1008 230000.0 146.1082 6600.0 147.0801 110000.0 147.1165 240000.0 149.0958 70000.0 151.0751 140000.0 153.09 6900.0 155.0854 32000.0 156.0932 17000.0 157.1009 140000.0 159.0804 29000.0 159.1166 110000.0 160.6299 2600.0 161.0959 50000.0 161.1322 19000.0 162.1302 2700.0 163.1115 26000.0 164.2085 2700.0 165.0907 240000.0 168.0934 10000.0 169.1012 68000.0 170.1078 12000.0 171.1167 70000.0 173.0958 29000.0 173.1323 42000.0 173.5165 5600.0 173.5273 55000.0 173.5364 110000.0 173.5465 7300.0 174.1023 2800.0 174.3999 2400.0 175.1115 48000.0 177.091 21000.0 178.0985 3200.0 181.1009 13000.0 183.1168 61000.0 185.1328 27000.0 187.1117 18000.0 187.1488 9200.0 188.44 2800.0 189.1273 42000.0 191.1443 2700.0 193.1015 6800.0 195.1169 24000.0 195.2719 2300.0 196.1236 13000.0 196.2505 2400.0 197.1325 35000.0 199.1115 9600.0 199.1479 6200.0 201.1273 30000.0 201.1632 2500.0 203.143 88000.0 207.1177 4400.0 207.1381 38000.0 209.1327 23000.0 211.1484 30000.0 213.1267 10000.0 215.1425 3900.0 216.151 7000.0 216.6012 2500.0 219.138 27000.0 221.1326 9300.0 221.1536 83000.0 223.1475 4400.0 225.1629 6700.0 229.1582 4300.0 233.1535 3000.0 234.1613 46000.0 239.1412 2500.0 249.1633 8700.0 253.159 2500.0 258.1942 3000.0 280.5752 2500.0 283.3543 2600.0 286.1931 18000.0 287.2015 3300.0 309.5574 2300.0 312.2101 2700.0 317.6024 2600.0 376.3655 2500.0 382.3468 2500.0 409.2739 6100.0 416.8551 2500.0 END IONS BEGIN IONS SCANS=675 PEPMASS=476.2411 CHARGE=1 COLLISION_ENERGY=0.0 58.8772 2300.0 62.2956 2900.0 64.913 2300.0 70.9703 2400.0 78.2107 2600.0 79.4157 2400.0 89.0595 3400.0 109.5614 2300.0 110.7448 2400.0 120.0413 3600.0 120.209 2700.0 120.6057 2500.0 128.1149 2200.0 128.5551 2400.0 134.4938 2500.0 136.4486 2200.0 137.4824 2600.0 149.6837 4200.0 149.7039 4100.0 172.9034 3200.0 173.5247 40000.0 173.5428 28000.0 182.3263 2300.0 190.9757 2400.0 220.9132 2600.0 226.9604 2400.0 288.912 2500.0 325.0929 3000.0 340.0685 3300.0 340.1153 240000.0 373.5704 2400.0 379.1854 2900.0 395.2322 2400.0 422.1228 2700.0 476.241 140000.0 476.3157 4100.0 END IONS BEGIN IONS SCANS=676 PEPMASS=454.2592 CHARGE=1 COLLISION_ENERGY=0.0 57.0697 2500.0 57.9523 2100.0 58.1927 2200.0 58.4837 2300.0 59.1849 2600.0 62.084 2100.0 62.5802 2700.0 63.9064 2600.0 67.0542 13000.0 68.1705 2400.0 69.0697 76000.0 70.449 2600.0 71.5248 2100.0 72.9689 2700.0 73.5785 2500.0 74.7569 2100.0 77.0624 2300.0 78.0218 2300.0 79.0541 24000.0 81.0696 180000.0 83.0852 16000.0 88.0625 2700.0 88.523 2400.0 89.0595 41000.0 90.4961 2700.0 91.0539 32000.0 91.3325 2800.0 93.0696 200000.0 94.1422 2300.0 95.0488 6800.0 95.0853 66000.0 96.7122 2300.0 97.1009 7900.0 98.0597 780000.0 98.0651 3300.0 99.8562 2600.0 104.129 2300.0 104.9531 2200.0 105.0696 69000.0 105.3011 2100.0 107.0853 45000.0 107.6178 2100.0 109.0644 2500.0 109.1009 62000.0 110.06 11000.0 119.0852 67000.0 121.065 8600.0 121.101 67000.0 122.5804 2500.0 123.0803 6600.0 123.1166 44000.0 128.4172 2600.0 133.0644 17000.0 133.0856 11000.0 133.1011 30000.0 135.1166 140000.0 135.8992 2300.0 137.0959 7900.0 137.1322 22000.0 140.0699 2800.0 143.9669 2700.0 144.7174 2500.0 145.1015 2900.0 147.0801 12000.0 147.1165 160000.0 148.0517 18000.0 149.0605 2700.0 149.6801 4700.0 149.6917 6500.0 150.0675 6700.0 151.0748 3100.0 151.6978 2500.0 152.0703 32000.0 154.0621 10000.0 158.0431 2500.0 161.1323 140000.0 162.0673 10000.0 163.0749 5700.0 163.1121 20000.0 164.0834 14000.0 164.2655 2500.0 165.0542 8700.0 165.0911 2600.0 166.0627 23000.0 167.0712 2900.0 169.0861 4300.0 171.1167 8600.0 173.5204 11000.0 173.5337 140000.0 173.5446 10000.0 174.6382 2800.0 175.039 2400.0 175.6407 2500.0 176.0833 26000.0 178.0613 3400.0 180.078 260000.0 181.0858 1200000.0 181.1001 9600.0 188.0828 3800.0 189.0919 5500.0 189.1275 120000.0 190.0623 80000.0 190.099 16000.0 191.034 5400.0 191.0698 8700.0 192.0788 2900.0 193.086 50000.0 194.0946 3800.0 195.0655 93000.0 195.1014 1000000.0 195.131 3600.0 202.0991 32000.0 204.078 44000.0 204.1142 5500.0 205.0858 31000.0 206.0571 47000.0 206.0934 27000.0 206.4363 2500.0 207.1017 110000.0 208.0731 62000.0 209.117 28000.0 215.1043 3300.0 216.1153 6900.0 218.0933 22000.0 219.1016 210000.0 219.124 4900.0 220.1085 3900.0 221.0808 1200000.0 221.118 110000.0 223.0966 82000.0 226.0978 2600.0 226.2116 2900.0 227.1077 3300.0 228.1146 28000.0 230.0925 8000.0 231.1016 50000.0 232.1094 18000.0 233.0808 25000.0 233.1171 110000.0 235.0963 54000.0 235.1321 17000.0 239.1067 2600.0 240.1133 18000.0 241.1224 44000.0 241.1503 2000.0 242.0927 3300.0 242.1303 22000.0 244.1089 27000.0 245.117 140000.0 246.125 22000.0 247.098 15000.0 247.1328 59000.0 249.1482 5900.0 255.1013 24000.0 255.1371 13000.0 256.1093 12000.0 257.1172 18000.0 258.0868 2800.0 258.1246 29000.0 259.1326 190000.0 261.1132 9600.0 261.1479 25000.0 269.1167 5900.0 269.1499 2700.0 270.1256 7100.0 271.1325 44000.0 272.1406 26000.0 273.1135 26000.0 273.1486 140000.0 275.1276 6500.0 282.1606 6300.0 283.1336 12000.0 283.1688 8700.0 284.1771 110000.0 285.1496 3700.0 285.1841 3800.0 286.1556 4300.0 287.1281 15000.0 287.1638 16000.0 289.1441 23000.0 289.1797 21000.0 297.1471 3300.0 297.1844 4000.0 298.1933 81000.0 299.1653 3900.0 300.174 22000.0 301.1428 33000.0 308.1771 17000.0 310.1534 3100.0 313.1804 23000.0 314.1875 11000.0 315.1632 8300.0 315.1958 410000.0 315.2273 2500.0 315.2379 4500.0 326.1874 13000.0 329.2115 150000.0 339.1953 40000.0 339.3181 2500.0 357.2062 370000.0 378.9836 2400.0 409.9447 2300.0 462.7778 2400.0 END IONS BEGIN IONS SCANS=677 PEPMASS=499.3169 CHARGE=1 COLLISION_ENERGY=0.0 67.5651 2600.0 69.0697 5000.0 72.3859 2800.0 74.8158 2500.0 77.5068 2500.0 80.3277 2900.0 81.0697 45000.0 83.0956 2300.0 89.0593 2200.0 89.4852 2500.0 93.0697 26000.0 95.0852 11000.0 96.2289 2500.0 98.0598 150000.0 98.0673 2900.0 98.3934 2400.0 105.0699 5700.0 106.703 2400.0 106.964 2400.0 109.1009 10000.0 115.4995 2600.0 119.0853 9700.0 119.4889 2400.0 121.1008 13000.0 122.0416 2200.0 123.1167 6700.0 135.1165 23000.0 137.1322 15000.0 142.8746 3000.0 143.2898 2400.0 143.4144 2300.0 147.1165 35000.0 152.0701 16000.0 161.1321 25000.0 163.112 6000.0 173.5227 18000.0 173.5399 37000.0 180.078 33000.0 181.0859 210000.0 189.1273 29000.0 190.0631 4100.0 193.0868 2500.0 195.0673 9300.0 195.1015 250000.0 203.2995 2200.0 204.0797 2500.0 205.0853 3300.0 207.1013 16000.0 208.0731 13000.0 209.1172 4100.0 219.1016 45000.0 221.0562 4800.0 221.0809 400000.0 221.1186 25000.0 223.0967 24000.0 226.5018 2700.0 231.1006 5900.0 233.1167 18000.0 235.0969 6800.0 235.132 2700.0 241.1228 3700.0 243.6982 2600.0 245.117 22000.0 247.0957 2400.0 247.1324 8000.0 257.119 2700.0 258.127 3200.0 259.133 32000.0 271.1339 7300.0 273.117 2800.0 273.149 25000.0 282.166 2500.0 284.1776 13000.0 289.1451 3300.0 289.1803 5200.0 298.1927 12000.0 301.1425 6400.0 313.1778 2800.0 315.1958 120000.0 326.1873 3900.0 329.2111 53000.0 339.1953 12000.0 341.5254 2800.0 357.2062 130000.0 412.7347 6600.0 419.233 5100.0 432.1989 2700.0 458.9088 2500.0 461.9738 2300.0 END IONS BEGIN IONS SCANS=678 PEPMASS=623.2505 CHARGE=1 COLLISION_ENERGY=0.0 67.2463 3600.0 67.2503 17000.0 69.2515 2500.0 88.4972 2900.0 93.6152 2300.0 120.9999 3000.0 130.4391 2300.0 131.2564 2200.0 136.2994 3100.0 136.3097 4700.0 146.7394 3000.0 148.9809 2100.0 168.3394 2200.0 173.5276 54000.0 173.5428 17000.0 188.6655 2300.0 231.5667 2600.0 273.143 2400.0 311.8321 2300.0 315.7685 2500.0 378.1457 2400.0 407.2213 3100.0 415.1869 2700.0 421.2021 15000.0 428.1999 3500.0 430.2163 4500.0 434.2115 4400.0 435.2176 17000.0 436.2254 10000.0 437.5781 2500.0 438.2099 2500.0 443.2225 19000.0 444.1953 34000.0 445.2028 13000.0 447.2223 3900.0 457.1967 4000.0 458.2102 17000.0 461.2014 2100.0 461.2362 3600.0 462.2061 17000.0 463.2124 19000.0 471.2173 120000.0 472.1833 5700.0 472.1931 24000.0 473.1981 160000.0 474.206 15000.0 475.2116 24000.0 480.255 12000.0 481.2056 2900.0 483.2178 13000.0 484.1855 3100.0 485.1962 25000.0 486.2049 45000.0 487.2127 22000.0 488.2181 8700.0 489.2264 100000.0 490.2062 32000.0 490.2322 30000.0 491.2107 46000.0 492.2107 7600.0 493.2239 3000.0 499.1255 4400.0 499.2129 770000.0 500.186 100000.0 501.2265 140000.0 502.1984 7600.0 503.2081 48000.0 504.2104 3600.0 505.2203 6500.0 507.236 36000.0 508.2461 52000.0 511.2126 43000.0 513.1923 70000.0 514.2003 37000.0 516.2142 29000.0 517.223 470000.0 517.2904 2100.0 518.2181 39000.0 519.2332 13000.0 521.2202 2600.0 527.2079 170000.0 528.2167 11000.0 529.1301 4200.0 529.2233 690000.0 530.1936 7400.0 531.2038 38000.0 532.2139 14000.0 533.2168 11000.0 535.2332 140000.0 536.24 41000.0 545.0241 16000.0 545.2183 3000000.0 546.2245 9200.0 547.233 27000.0 549.2432 4400.0 555.2031 260000.0 555.5806 2600.0 562.222 27000.0 563.2296 80000.0 564.2375 170000.0 567.2612 3500.0 573.2136 960000.0 577.2448 93000.0 591.2249 91000.0 595.2558 66000.0 605.24 610000.0 623.2504 180000.0 END IONS BEGIN IONS SCANS=679 PEPMASS=375.2685 CHARGE=1 COLLISION_ENERGY=0.0 52.1644 2200.0 52.2568 2300.0 53.0021 17000.0 53.0386 32000.0 53.1471 2200.0 55.0178 32000.0 55.0514 3700.0 55.0541 240000.0 55.3683 2300.0 57.0335 13000.0 57.0698 59000.0 57.384 2300.0 59.5976 3100.0 62.6924 2400.0 65.0386 25000.0 66.0069 2500.0 67.0541 400000.0 67.0585 3200.0 69.0334 33000.0 69.0657 3900.0 69.0698 250000.0 69.4237 2800.0 71.049 33000.0 74.3425 2100.0 77.0387 32000.0 79.0541 490000.0 79.0596 5800.0 80.0618 7800.0 81.0335 14000.0 81.0698 1000000.0 81.0746 4200.0 83.049 55000.0 83.0854 73000.0 85.0651 2200.0 89.9632 2500.0 90.4231 2700.0 91.0541 530000.0 91.0597 2800.0 91.0608 6100.0 92.1124 2600.0 93.0698 1500000.0 93.0753 8000.0 94.3963 2600.0 95.049 650000.0 95.0548 2800.0 95.0854 880000.0 95.0914 4500.0 96.3435 2200.0 97.0582 3800.0 97.0647 170000.0 103.0541 34000.0 104.1323 2200.0 105.0446 30000.0 105.0551 6300.0 105.0698 1500000.0 105.0767 12000.0 105.0867 2800.0 106.0777 18000.0 107.0491 22000.0 107.0772 4400.0 107.0855 960000.0 107.0922 4200.0 109.0647 200000.0 109.1011 520000.0 111.0804 3200.0 115.0543 25000.0 116.0621 18000.0 117.0606 4800.0 117.0698 250000.0 117.0792 3700.0 118.0778 11000.0 119.0496 20000.0 119.0597 7600.0 119.0854 1500000.0 119.0937 2200.0 119.0956 4100.0 120.0934 12000.0 121.0647 330000.0 121.0747 4900.0 121.0909 5400.0 121.1011 1300000.0 123.0803 93000.0 123.1167 100000.0 127.4376 2300.0 128.0621 73000.0 129.0698 160000.0 130.0777 85000.0 131.0755 7900.0 131.0855 820000.0 132.0935 46000.0 133.0646 35000.0 133.0765 23000.0 133.0891 8400.0 133.1011 860000.0 134.1096 6200.0 135.0804 57000.0 135.1168 270000.0 136.3406 2200.0 137.0962 6900.0 141.07 59000.0 141.7601 2500.0 142.0777 240000.0 142.0903 3400.0 143.0751 2000.0 143.0855 530000.0 144.0934 180000.0 145.0649 33000.0 145.0875 4200.0 145.1011 1300000.0 145.1141 5200.0 146.073 22000.0 146.1089 39000.0 147.0805 68000.0 147.1059 2400.0 147.1168 400000.0 149.0962 15000.0 149.1327 26000.0 153.0213 2500.0 153.0702 15000.0 154.078 30000.0 155.0855 170000.0 156.0934 160000.0 157.1012 830000.0 157.1164 10000.0 158.0727 15000.0 158.1091 110000.0 159.0806 70000.0 159.1169 640000.0 160.0881 17000.0 160.1244 11000.0 161.0962 190000.0 161.1325 110000.0 163.1121 6600.0 165.0702 30000.0 166.0777 18000.0 167.0857 69000.0 168.0935 57000.0 169.1014 320000.0 169.1178 8400.0 170.1091 100000.0 171.0814 9700.0 171.1169 370000.0 172.0885 16000.0 172.1248 69000.0 173.0962 52000.0 173.1328 300000.0 173.15 8600.0 173.5263 63000.0 173.5426 17000.0 174.1043 6200.0 175.1119 32000.0 175.1484 110000.0 175.3797 2800.0 178.0786 3000.0 179.0858 84000.0 180.0936 41000.0 181.1014 160000.0 182.1094 91000.0 183.1171 260000.0 184.1249 51000.0 185.096 21000.0 185.1328 180000.0 186.1404 33000.0 187.1119 46000.0 187.1485 160000.0 191.0858 2900.0 192.0937 32000.0 193.1014 91000.0 194.1093 86000.0 195.1171 220000.0 196.09 2600.0 196.1249 82000.0 197.0981 13000.0 197.1327 240000.0 198.1404 36000.0 199.1125 25000.0 199.1484 110000.0 200.1194 9800.0 200.1558 12000.0 201.128 12000.0 201.1638 34000.0 205.1013 28000.0 206.1094 47000.0 207.1173 88000.0 208.1248 45000.0 208.1444 2900.0 209.0988 6000.0 209.1329 190000.0 210.1407 68000.0 211.1127 15000.0 211.1485 130000.0 212.1561 12000.0 213.128 13000.0 213.164 46000.0 217.1004 3000.0 218.1102 4700.0 219.1169 28000.0 220.1253 48000.0 221.1329 78000.0 222.1404 21000.0 223.1487 100000.0 224.1561 31000.0 225.1267 5700.0 225.1641 69000.0 226.171 3300.0 227.1423 10000.0 227.1804 11000.0 231.1172 4600.0 232.1245 5000.0 233.1328 28000.0 234.1402 14000.0 235.1483 59000.0 236.1556 13000.0 237.1643 49000.0 238.1726 9700.0 239.1435 10000.0 239.1802 34000.0 240.187 8100.0 241.1952 6400.0 245.1329 13000.0 246.1406 13000.0 247.1482 20000.0 248.1545 3000.0 249.1293 2500.0 249.1637 29000.0 250.1735 2900.0 251.1798 77000.0 252.1872 6400.0 253.1592 18000.0 253.1958 32000.0 259.1478 6900.0 261.1648 13000.0 262.1711 6200.0 263.1471 3200.0 263.1792 21000.0 264.1891 3400.0 265.1952 20000.0 266.203 33000.0 267.2089 3200.0 271.1486 3200.0 275.1784 4200.0 277.1952 19000.0 279.21 15000.0 281.1894 3500.0 287.1807 5900.0 291.2111 12000.0 292.2181 3000.0 301.1949 8400.0 319.207 12000.0 347.2721 13000.0 357.2583 14000.0 375.268 55000.0 END IONS BEGIN IONS SCANS=680 PEPMASS=205.1954 CHARGE=1 COLLISION_ENERGY=0.0 41.0385 210000.0 42.0337 37000.0 43.0541 110000.0 50.1853 2300.0 50.8873 2400.0 51.0231 13000.0 51.2637 2500.0 53.0021 2400.0 53.0384 160000.0 53.7908 2700.0 54.0101 3000.0 55.0541 2200000.0 55.0572 15000.0 55.0587 13000.0 55.0606 6300.0 55.9343 23000.0 57.0697 530000.0 58.7343 3100.0 60.1948 2400.0 61.0484 2300.0 65.0385 44000.0 65.6119 2100.0 67.054 1500000.0 67.0585 6200.0 67.3587 2500.0 67.5395 2400.0 67.7339 2300.0 69.0697 3300000.0 69.0739 23000.0 69.0764 19000.0 69.2414 2200.0 69.458 2600.0 70.5212 4000.0 71.0853 110000.0 71.3022 2300.0 72.9369 240000.0 73.0284 7000.0 74.0317 2700.0 75.0152 2600.0 76.2644 2400.0 77.0385 110000.0 78.6846 2600.0 79.054 2400000.0 79.062 11000.0 79.062 29000.0 79.0651 5000.0 80.0619 6300.0 81.0696 9800000.0 81.0783 52000.0 81.0787 240000.0 81.0806 31000.0 81.084 13000.0 82.8183 2300.0 83.0852 620000.0 83.7595 2200.0 88.9574 2500.0 88.9987 2700.0 90.2377 4600.0 90.9474 160000.0 91.054 1100000.0 91.0603 5200.0 92.0615 4600.0 93.062 15000.0 93.0696 12000000.0 93.0801 52000.0 93.0812 250000.0 93.0832 39000.0 93.0914 6900.0 95.0425 6500.0 95.0489 310000.0 95.0853 3100000.0 95.0919 14000.0 96.3598 4500.0 97.1009 330000.0 99.9476 27000.0 103.054 36000.0 103.6269 2600.0 105.0445 97000.0 105.0615 8200.0 105.0696 940000.0 105.0768 4000.0 105.0783 10000.0 106.0774 57000.0 107.0853 4500000.0 107.0932 23000.0 107.1019 7800.0 108.0648 2700.0 108.9585 2800.0 109.0646 110000.0 109.0927 9700.0 109.1009 1800000.0 109.1086 5200.0 111.1166 62000.0 113.9548 6700.0 113.9634 460000.0 117.6129 2500.0 119.0603 42000.0 119.0768 6100.0 119.0853 210000.0 120.094 2700.0 121.028 3200.0 121.0899 40000.0 121.1009 15000000.0 121.1097 250000.0 121.119 130000.0 121.1213 41000.0 121.1333 15000.0 123.0802 400000.0 123.1069 8600.0 123.1166 810000.0 128.378 2500.0 131.9741 60000.0 133.0759 55000.0 133.1014 22000.0 135.1056 9500.0 135.1166 1200000.0 135.1267 13000.0 135.6358 2400.0 136.4553 4300.0 137.1323 87000.0 139.0779 2300.0 143.6599 4900.0 147.1168 39000.0 149.023 18000.0 149.1185 3200.0 149.1323 2200000.0 149.1451 21000.0 154.9891 3300.0 161.133 8600.0 162.1409 3100.0 163.148 180000.0 168.187 2300.0 173.526 35000.0 173.5382 70000.0 192.3981 2500.0 205.1417 2600.0 205.1609 2600.0 205.1954 65000.0 211.3511 2500.0 END IONS BEGIN IONS SCANS=681 PEPMASS=618.4278 CHARGE=1 COLLISION_ENERGY=0.0 67.0539 3600.0 67.5871 2500.0 69.0696 4600.0 69.4075 2300.0 79.0539 3900.0 81.0696 25000.0 83.049 4300.0 83.0805 3700.0 83.0852 55000.0 85.0646 4800.0 93.0695 24000.0 94.0012 2400.0 95.0489 13000.0 95.0852 21000.0 97.0645 10000.0 105.0695 21000.0 107.0851 34000.0 109.0644 7100.0 109.1009 14000.0 111.0802 6400.0 113.0958 4600.0 117.0689 3000.0 119.0852 41000.0 119.3217 2800.0 120.0934 3300.0 121.1008 31000.0 123.0801 17000.0 125.0595 5900.0 125.0958 14000.0 129.0699 3400.0 131.0853 17000.0 132.0928 4300.0 133.101 32000.0 135.0802 11000.0 135.1164 9200.0 137.0958 8200.0 139.0752 2700.0 139.1108 11000.0 143.0853 19000.0 144.0928 14000.0 145.1009 50000.0 146.1069 3700.0 147.0804 17000.0 147.1166 18000.0 149.0958 12000.0 149.1328 2700.0 151.0751 13000.0 153.091 3000.0 155.1063 5900.0 156.0934 4900.0 157.1008 45000.0 158.1085 7900.0 159.1168 41000.0 160.0879 18000.0 160.1238 3200.0 161.0959 15000.0 161.1326 6400.0 163.1114 26000.0 165.0909 65000.0 167.1073 4900.0 169.1011 16000.0 170.1085 5100.0 171.1167 35000.0 172.1241 14000.0 173.0961 6900.0 173.1323 14000.0 173.5327 43000.0 175.1118 9400.0 175.1485 3100.0 176.1183 2900.0 177.091 4300.0 177.1275 3400.0 178.098 3800.0 179.1065 3900.0 180.115 3100.0 181.1055 4000.0 181.1222 33000.0 183.1167 16000.0 183.1357 2700.0 185.1325 23000.0 187.1119 8400.0 187.1481 16000.0 189.1269 14000.0 190.1349 17000.0 191.107 5600.0 191.1429 5600.0 193.1221 12000.0 195.0984 2500.0 195.1166 16000.0 195.1369 5500.0 196.1248 4700.0 197.1325 23000.0 198.1377 2400.0 199.1117 7500.0 199.1476 7400.0 201.1271 6800.0 203.1432 37000.0 207.1173 4600.0 207.1386 22000.0 208.1253 2500.0 208.1457 15000.0 209.1326 21000.0 209.1525 3500.0 211.1115 4200.0 211.1482 17000.0 213.127 7600.0 213.1642 4500.0 215.1433 6400.0 219.1381 12000.0 221.1325 7900.0 221.1538 110000.0 223.1481 8200.0 225.1271 4300.0 225.1475 11000.0 227.1433 3400.0 227.1798 6400.0 229.1593 4700.0 231.1382 8200.0 233.1537 22000.0 234.1616 16000.0 235.1466 4900.0 237.129 2800.0 237.1634 9200.0 239.1438 4100.0 239.1804 4300.0 241.1604 2700.0 245.1553 4100.0 246.1624 6100.0 247.1696 19000.0 249.1631 3000.0 251.1791 3600.0 253.1589 5100.0 255.1732 3900.0 259.1702 6500.0 261.1869 4400.0 269.1558 4300.0 269.1899 5300.0 271.1705 7400.0 273.1849 11000.0 274.1933 6600.0 281.1896 3600.0 283.169 4000.0 285.1862 5200.0 286.1931 19000.0 287.2011 130000.0 299.2014 17000.0 300.2081 3600.0 303.1952 3000.0 305.1916 3700.0 310.1918 4100.0 311.2007 3200.0 312.2082 9400.0 313.217 14000.0 319.2075 7900.0 325.2173 14000.0 329.2123 2400.0 337.2162 15000.0 339.2321 11000.0 347.2383 2600.0 352.2402 61000.0 353.2479 12000.0 365.2479 27000.0 367.2616 5800.0 395.2589 19000.0 435.5926 2900.0 438.3163 2600.0 480.3242 6700.0 525.3581 7600.0 526.3642 4700.0 531.4224 2800.0 538.3661 31000.0 618.4241 2800.0 END IONS BEGIN IONS SCANS=682 PEPMASS=392.2715 CHARGE=1 COLLISION_ENERGY=0.0 55.054 14000.0 57.0696 22000.0 67.0539 19000.0 69.0333 6600.0 69.0696 20000.0 71.0853 11000.0 79.0543 39000.0 80.0617 20000.0 81.0332 4900.0 81.0654 2900.0 81.0696 69000.0 82.0409 7900.0 83.0489 12000.0 83.0853 6800.0 85.0645 7400.0 89.0594 2900.0 91.0539 44000.0 92.062 11000.0 93.0638 2900.0 93.0693 100000.0 95.0488 77000.0 95.0853 46000.0 96.0563 3100.0 97.0649 7200.0 105.0695 160000.0 106.0774 25000.0 107.0491 6900.0 107.0852 83000.0 108.0567 16000.0 109.0644 27000.0 109.1008 26000.0 117.0695 40000.0 118.0772 2900.0 119.0489 6600.0 119.0852 180000.0 120.0561 2900.0 120.093 40000.0 121.0565 2400.0 121.0646 31000.0 121.1009 49000.0 123.0802 27000.0 123.1165 5900.0 125.8053 2400.0 128.062 9900.0 129.0696 31000.0 130.0773 10000.0 131.0748 4000.0 131.0852 110000.0 132.093 34000.0 133.0646 16000.0 133.1009 120000.0 134.109 11000.0 134.273 2400.0 135.0803 20000.0 135.1164 21000.0 135.9602 2800.0 137.0961 3800.0 141.0697 7700.0 142.0774 18000.0 143.0852 110000.0 144.0931 34000.0 145.0645 11000.0 145.1009 220000.0 145.1143 9800.0 146.1089 9100.0 147.0803 28000.0 147.1165 42000.0 149.023 72000.0 149.0959 4200.0 149.1328 2300.0 150.0265 36000.0 154.8947 2700.0 155.0852 28000.0 156.0931 24000.0 157.1009 120000.0 158.1088 26000.0 159.0803 26000.0 159.1165 100000.0 160.0865 2600.0 160.1239 6700.0 161.0959 23000.0 161.1322 15000.0 163.1123 5100.0 164.9571 2500.0 167.0855 11000.0 168.0928 3400.0 169.101 49000.0 170.1088 14000.0 171.0807 11000.0 171.1167 89000.0 172.1241 11000.0 173.0961 24000.0 173.1325 59000.0 173.5268 29000.0 173.5454 4300.0 175.1117 11000.0 175.1481 24000.0 177.1272 12000.0 179.0853 6800.0 181.1009 26000.0 182.1087 12000.0 183.1167 52000.0 184.1243 6300.0 185.096 6700.0 185.1324 35000.0 186.1038 7500.0 187.1118 4100.0 187.1482 16000.0 189.1275 10000.0 191.1428 9600.0 193.1012 12000.0 194.1092 10000.0 195.1166 37000.0 196.1244 9100.0 197.0969 3300.0 197.1325 53000.0 198.1399 3400.0 199.1126 10000.0 199.1483 18000.0 201.1277 9400.0 201.1634 3800.0 203.1442 2800.0 206.1083 3000.0 207.1166 15000.0 208.1241 7900.0 209.1328 25000.0 210.1402 7600.0 211.1483 27000.0 211.1681 2700.0 213.1284 6500.0 213.1651 3400.0 215.1423 6000.0 217.1583 3000.0 221.1324 17000.0 223.1483 16000.0 224.1569 2600.0 225.1266 5800.0 225.1637 16000.0 233.1327 5800.0 235.1489 9500.0 237.1641 10000.0 239.1427 4100.0 239.1789 12000.0 249.165 8600.0 251.1787 8100.0 255.174 2800.0 257.1894 3900.0 261.1649 2300.0 263.178 4900.0 296.3436 2700.0 END IONS BEGIN IONS SCANS=683 PEPMASS=393.2789 CHARGE=1 COLLISION_ENERGY=0.0 53.002 8100.0 53.0384 6600.0 55.0177 9700.0 55.054 99000.0 55.9365 2200.0 57.0333 3800.0 57.0696 53000.0 59.0488 7700.0 62.5571 2100.0 62.5987 2400.0 63.6694 2300.0 65.0383 5300.0 66.6364 2100.0 67.0539 140000.0 67.6552 2500.0 69.0332 21000.0 69.0695 130000.0 71.0488 15000.0 71.0853 3500.0 74.4209 2200.0 75.3958 2200.0 77.0384 15000.0 77.5103 2400.0 77.7746 2300.0 79.0539 170000.0 80.0619 3100.0 81.0336 5000.0 81.0695 440000.0 81.0777 3400.0 83.0489 33000.0 83.0851 54000.0 84.9962 2200.0 85.0645 29000.0 85.1005 2300.0 91.0539 180000.0 93.0695 550000.0 93.0764 6300.0 95.0487 340000.0 95.0555 3700.0 95.0852 410000.0 95.0921 4000.0 96.0522 4500.0 96.0885 3000.0 97.0583 4500.0 97.0644 76000.0 97.1011 4800.0 99.0806 4200.0 103.054 4400.0 104.9334 2400.0 105.0442 8500.0 105.0695 490000.0 105.0783 6300.0 106.078 4500.0 107.0487 12000.0 107.0851 400000.0 108.056 3200.0 109.0644 120000.0 109.1008 200000.0 109.7637 2900.0 111.0803 15000.0 113.0956 2700.0 115.0542 7100.0 117.0609 3000.0 117.0695 100000.0 119.0488 11000.0 119.0591 3200.0 119.0755 2700.0 119.0852 610000.0 119.0946 6800.0 120.0925 14000.0 121.0645 160000.0 121.1008 310000.0 123.0801 38000.0 123.1069 3000.0 123.1165 70000.0 123.5477 2400.0 125.096 2700.0 128.0618 28000.0 129.0696 63000.0 130.0773 26000.0 131.0852 280000.0 132.0919 16000.0 133.0643 18000.0 133.1009 410000.0 133.1109 4300.0 134.1047 5200.0 135.0802 41000.0 135.1165 140000.0 137.096 16000.0 139.1117 5400.0 141.0696 23000.0 142.0774 96000.0 143.0852 230000.0 144.0927 63000.0 145.0645 14000.0 145.1009 520000.0 145.1134 12000.0 146.0721 9600.0 146.106 25000.0 147.0801 32000.0 147.1165 180000.0 148.1201 3100.0 149.0227 4800.0 149.0958 31000.0 149.1322 14000.0 150.0261 3100.0 151.0286 2700.0 151.1111 3700.0 153.0692 4000.0 154.0774 11000.0 155.0852 71000.0 155.4413 2400.0 156.093 66000.0 157.1009 400000.0 157.1133 2900.0 157.1168 4600.0 158.0718 3300.0 158.108 50000.0 159.0801 36000.0 159.1024 4100.0 159.1166 360000.0 159.1295 3400.0 160.0879 5300.0 160.1223 16000.0 161.0959 130000.0 161.1322 60000.0 163.1116 22000.0 163.1474 10000.0 165.0696 7900.0 166.0769 3200.0 167.0851 28000.0 168.0931 27000.0 169.1011 160000.0 170.1085 51000.0 171.081 6100.0 171.1167 190000.0 172.0879 4800.0 172.1238 46000.0 173.0959 27000.0 173.1324 190000.0 173.1499 3800.0 173.5223 11000.0 173.5365 70000.0 174.1025 3700.0 174.1376 11000.0 175.1117 30000.0 175.1309 4800.0 175.1481 95000.0 177.1274 6300.0 179.0857 34000.0 180.0932 14000.0 181.1011 66000.0 182.1087 38000.0 183.1167 130000.0 184.1237 28000.0 185.0959 9200.0 185.1324 100000.0 186.1398 26000.0 187.1115 37000.0 187.148 67000.0 189.1273 5000.0 191.1431 6900.0 192.0938 12000.0 193.1009 36000.0 194.1089 42000.0 195.1167 86000.0 196.1241 42000.0 197.0962 5400.0 197.1324 110000.0 198.1392 22000.0 199.112 8200.0 199.1478 56000.0 200.1194 3500.0 200.1562 6200.0 201.1273 10000.0 201.1638 37000.0 203.1424 4700.0 205.1012 7800.0 205.1576 3900.0 206.1092 17000.0 207.1169 44000.0 208.1239 20000.0 209.1324 94000.0 210.1396 31000.0 211.1125 6600.0 211.1482 72000.0 212.1199 2900.0 212.155 7600.0 213.1278 4700.0 213.1636 31000.0 215.1427 5400.0 219.117 6100.0 220.1246 21000.0 221.1325 31000.0 222.1397 14000.0 223.1119 2800.0 223.1482 45000.0 224.1552 16000.0 225.1285 4700.0 225.1639 29000.0 226.1708 7400.0 227.143 7300.0 227.1794 4700.0 229.1593 3200.0 233.1328 9600.0 234.1389 4600.0 235.1481 27000.0 236.1554 6500.0 237.164 21000.0 239.144 3900.0 239.1791 13000.0 240.185 5000.0 241.1599 6700.0 241.1944 8200.0 245.1313 2800.0 247.1482 8200.0 248.154 2900.0 249.1651 6400.0 251.1797 19000.0 253.1586 6900.0 253.195 6400.0 255.1749 5100.0 257.1895 5400.0 261.1632 3000.0 263.1801 6300.0 265.1946 9600.0 266.2035 3400.0 267.2117 3400.0 269.1893 3400.0 273.1638 3100.0 275.1808 4200.0 277.1954 3900.0 281.1901 4100.0 283.2058 3100.0 293.1881 2800.0 383.8691 2400.0 END IONS BEGIN IONS SCANS=684 PEPMASS=476.2411 CHARGE=1 COLLISION_ENERGY=0.0 66.897 2300.0 67.1135 2500.0 69.9864 2200.0 89.0596 2700.0 106.6238 2300.0 109.6747 2500.0 109.825 2100.0 117.0588 2300.0 120.0415 2800.0 134.0706 2500.0 139.1069 2400.0 149.6842 2600.0 149.695 3000.0 162.7295 2600.0 170.9719 2800.0 173.302 2200.0 173.5252 29000.0 173.5404 22000.0 174.0522 28000.0 190.3351 2500.0 214.084 5400.0 218.2737 2200.0 229.1069 8300.0 251.047 2900.0 307.6172 2600.0 315.8574 2800.0 325.0912 4300.0 340.0684 4100.0 340.1152 630000.0 346.3194 2800.0 376.7904 2800.0 377.3887 2200.0 379.1877 2600.0 431.1347 2300.0 438.803 3500.0 476.2409 46000.0 484.056 2500.0 END IONS BEGIN IONS SCANS=685 PEPMASS=303.1959 CHARGE=1 COLLISION_ENERGY=0.0 50.9828 2200.0 58.7907 2600.0 61.9734 2600.0 62.0917 3000.0 62.9631 2300.0 67.0538 3700.0 68.3881 2200.0 69.0695 16000.0 70.9396 2400.0 71.0125 11000.0 79.0538 45000.0 81.0695 13000.0 83.0852 2600.0 89.1977 2200.0 90.8246 2500.0 91.0541 4500.0 92.3051 2400.0 92.5402 2600.0 93.0696 22000.0 95.0493 3500.0 95.085 2300.0 97.0652 2200.0 97.3964 2200.0 100.6582 2400.0 107.0852 20000.0 109.1011 6900.0 115.9222 3000.0 121.1007 9100.0 133.1015 5000.0 135.1167 8000.0 136.0515 9900.0 143.0861 2800.0 148.051 2800.0 151.0752 23000.0 154.0613 4400.0 159.0798 3200.0 166.0476 2600.0 166.0623 99000.0 167.0707 4400.0 173.5207 6200.0 173.537 49000.0 175.0752 2900.0 177.1634 2800.0 181.0858 170000.0 182.8212 2500.0 188.0857 2200.0 189.0925 4000.0 190.0992 9400.0 197.2125 2600.0 202.0987 14000.0 205.0867 2700.0 206.0942 3000.0 207.0994 3000.0 212.1828 2500.0 213.0912 19000.0 215.1077 2600.0 216.1138 2700.0 219.1013 21000.0 229.1221 60000.0 232.1089 3000.0 233.1171 2500.0 245.117 11000.0 260.0374 2600.0 272.1773 6700.0 287.1759 2400.0 END IONS BEGIN IONS SCANS=686 PEPMASS=454.2591 CHARGE=1 COLLISION_ENERGY=0.0 59.9096 2300.0 67.0542 7600.0 67.2911 2600.0 69.0699 6700.0 71.6314 2600.0 74.9586 2800.0 75.3826 2400.0 77.4459 3000.0 79.0543 2300.0 79.6846 2200.0 81.0333 6500.0 81.0696 11000.0 86.2267 2300.0 89.0595 14000.0 91.0537 2500.0 93.0699 4700.0 98.0598 620000.0 98.0663 5600.0 105.0697 3600.0 109.1012 8500.0 110.0519 3300.0 110.0598 140000.0 119.0855 5500.0 119.7897 2700.0 121.101 5600.0 122.0172 2400.0 123.1163 9500.0 129.0694 6900.0 133.0646 31000.0 133.0854 4100.0 133.1005 7000.0 135.1167 6800.0 136.0764 3100.0 141.8498 2500.0 146.8319 2300.0 147.0801 14000.0 147.1165 20000.0 152.0704 290000.0 152.0846 7000.0 161.1319 5800.0 166.0626 15000.0 173.5291 63000.0 173.5458 8700.0 175.0746 4400.0 176.0835 8900.0 180.0775 2900.0 181.0859 320000.0 189.1273 20000.0 190.0631 4100.0 193.0849 3900.0 195.0647 11000.0 195.1018 7400.0 203.0706 8200.0 204.0781 17000.0 205.0854 3800.0 207.1018 46000.0 219.1021 26000.0 220.0732 8100.0 221.0809 100000.0 221.1174 3400.0 221.3599 2500.0 231.1016 21000.0 233.1171 19000.0 235.0966 110000.0 237.4292 2500.0 245.1173 17000.0 247.132 7100.0 255.102 2500.0 257.1175 7200.0 259.1324 13000.0 261.1128 8000.0 265.1205 2600.0 270.1263 2800.0 272.1756 2800.0 273.1122 18000.0 273.1452 5200.0 275.1284 7500.0 282.1239 2400.0 283.1346 8000.0 283.169 3000.0 284.142 3200.0 284.1762 15000.0 297.1501 11000.0 299.128 26000.0 299.1619 2500.0 301.1432 24000.0 301.1779 3200.0 303.1965 4600.0 308.179 11000.0 313.1803 30000.0 315.1958 41000.0 324.1762 3900.0 326.1864 4900.0 329.173 4200.0 329.2126 14000.0 339.1959 33000.0 342.1802 6400.0 357.2062 170000.0 357.2566 3500.0 395.5511 2700.0 398.1632 2700.0 430.4445 2400.0 END IONS BEGIN IONS SCANS=687 PEPMASS=499.317 CHARGE=1 COLLISION_ENERGY=0.0 61.5523 2300.0 65.9348 2200.0 76.8855 2300.0 78.0602 2900.0 79.0542 4700.0 81.0691 2700.0 89.0595 2800.0 90.9769 2900.0 93.2521 2600.0 95.0852 2800.0 98.0598 600000.0 98.0663 3500.0 110.0598 190000.0 110.0686 3400.0 112.5304 2100.0 114.5759 2100.0 118.9954 2300.0 123.3609 2500.0 126.4658 2800.0 130.5458 2300.0 133.0649 5400.0 135.1164 5800.0 147.0809 2500.0 152.0411 3000.0 152.056 7800.0 152.0705 920000.0 152.087 9600.0 153.8664 2300.0 160.4927 2700.0 163.1115 2700.0 166.0635 2500.0 173.5286 79000.0 173.545 8400.0 181.086 140000.0 189.1279 4800.0 193.879 2300.0 195.1021 3000.0 207.1017 12000.0 219.1018 6000.0 221.0813 130000.0 235.097 62000.0 236.2125 2600.0 247.1326 11000.0 248.2304 2500.0 266.129 2300.0 272.1772 3400.0 273.0318 2100.0 273.1454 2700.0 276.652 2700.0 299.1703 3400.0 301.1443 7900.0 303.1967 62000.0 315.1956 15000.0 338.6264 2400.0 339.1964 7400.0 340.2403 2500.0 342.1862 3100.0 357.2072 99000.0 391.3955 2500.0 392.9274 2700.0 400.8572 2500.0 474.1994 2800.0 499.3887 2600.0 END IONS BEGIN IONS SCANS=688 PEPMASS=842.5624 CHARGE=1 COLLISION_ENERGY=0.0 73.4439 2700.0 73.7584 2400.0 75.1002 2600.0 75.7542 2100.0 79.0538 160000.0 79.3764 2500.0 81.0127 2700.0 81.0695 430000.0 83.0488 12000.0 83.0852 110000.0 83.1182 2600.0 83.5694 2300.0 85.0646 16000.0 85.082 2700.0 87.262 2400.0 88.8049 2500.0 91.0538 110000.0 91.1574 2400.0 93.0695 270000.0 95.049 8800.0 95.0793 3700.0 95.0851 350000.0 96.3873 2400.0 97.0403 3300.0 97.0644 55000.0 97.1009 47000.0 99.08 17000.0 99.9275 2400.0 101.1829 2200.0 104.9112 2600.0 105.0695 120000.0 106.9382 2800.0 107.0488 4700.0 107.0851 250000.0 107.5882 2600.0 109.0644 26000.0 109.093 3000.0 109.1007 370000.0 109.8559 2100.0 110.1334 2400.0 111.0801 44000.0 112.9736 2700.0 117.0695 55000.0 117.6403 2500.0 119.0851 150000.0 119.0934 2500.0 121.0644 2900.0 121.0924 2900.0 121.1007 250000.0 123.08 8600.0 123.1163 93000.0 125.0957 60000.0 127.1646 2900.0 128.6585 2500.0 129.0699 3500.0 130.7999 2400.0 131.0851 120000.0 133.1007 200000.0 135.0802 14000.0 135.1164 200000.0 135.1274 2900.0 136.2472 2400.0 137.0958 28000.0 137.1324 7000.0 139.1114 3200.0 145.1007 130000.0 147.1164 160000.0 149.0958 57000.0 149.1321 210000.0 151.1113 12000.0 155.1062 82000.0 157.1008 14000.0 159.1164 160000.0 161.0965 2400.0 161.1321 90000.0 163.1116 37000.0 163.1478 42000.0 165.1271 16000.0 166.918 2400.0 169.1009 2500.0 171.101 4300.0 171.1164 19000.0 173.1168 59000.0 173.1325 92000.0 173.5195 6200.0 173.5279 240000.0 173.5316 11000.0 173.542 94000.0 174.1595 2500.0 175.1112 2400.0 175.1479 24000.0 176.2081 2500.0 177.1273 38000.0 177.1644 2700.0 179.1443 2800.0 179.9915 2500.0 183.1161 3700.0 184.0741 3200.0 184.2144 2400.0 185.133 3300.0 187.1128 2600.0 187.1482 37000.0 188.0118 2700.0 189.1115 8100.0 190.1911 2300.0 191.6558 2900.0 194.9013 2700.0 195.1376 57000.0 197.1316 7900.0 198.4792 2300.0 201.1265 3000.0 201.1633 5900.0 204.3204 2500.0 204.3584 2600.0 211.0924 2800.0 215.1399 3000.0 219.1746 3200.0 220.0951 2400.0 223.2844 2500.0 227.1279 57000.0 229.1433 250000.0 229.1949 13000.0 239.1791 20000.0 242.5318 2300.0 243.2105 39000.0 247.2054 7100.0 248.1956 2500.0 257.1895 68000.0 257.4979 2500.0 258.87 3000.0 259.2054 9600.0 261.2209 180000.0 269.1746 190000.0 272.6107 2300.0 273.1416 2700.0 275.2005 330000.0 293.21 15000.0 297.4712 2600.0 302.4374 2300.0 308.7344 2400.0 313.2705 2800.0 317.2467 7000.0 335.2581 1100000.0 335.3028 5600.0 349.2369 64000.0 352.1903 3000.0 360.9992 2500.0 367.2483 33000.0 380.9159 2300.0 383.7863 2900.0 394.5757 2600.0 401.2682 3000.0 412.5858 2400.0 419.7035 2800.0 419.7638 2700.0 427.054 2600.0 429.2946 2800.0 466.7544 2400.0 469.2999 2500.0 475.6265 2400.0 489.3578 95000.0 505.9389 2600.0 511.2623 2700.0 512.5786 2400.0 513.2507 2600.0 514.8116 2900.0 526.9104 2500.0 529.3886 200000.0 533.2722 8000.0 534.2753 19000.0 546.7482 2400.0 549.2696 6400.0 550.2693 13000.0 569.414 2800.0 592.9767 2700.0 600.205 3200.0 609.1868 2300.0 609.4536 22000.0 614.2218 2300.0 627.4531 2400.0 640.5194 3100.0 678.1052 2400.0 695.6945 3100.0 734.5626 2500.0 737.4755 2700.0 746.8295 2700.0 827.1888 3200.0 842.4719 47000.0 846.9481 3000.0 END IONS BEGIN IONS SCANS=689 PEPMASS=618.4279 CHARGE=1 COLLISION_ENERGY=0.0 64.7701 2400.0 66.0561 2300.0 67.0542 15000.0 69.0332 3100.0 69.0696 11000.0 71.049 3500.0 71.8984 2300.0 71.9202 2900.0 76.3193 2300.0 79.054 17000.0 79.4593 2400.0 81.0696 63000.0 83.0489 13000.0 83.0805 3500.0 83.0853 120000.0 85.0646 6300.0 86.9993 2200.0 91.0542 12000.0 93.0696 50000.0 95.0488 32000.0 95.0852 51000.0 97.0645 34000.0 99.0441 5900.0 101.6014 2500.0 105.0695 54000.0 106.0779 2900.0 107.0852 77000.0 109.0645 27000.0 109.1009 34000.0 111.0801 4500.0 112.5788 2400.0 113.0591 2700.0 113.0958 25000.0 117.0697 5900.0 119.0852 100000.0 120.0929 12000.0 121.0649 7400.0 121.0767 2600.0 121.1009 74000.0 123.0801 46000.0 123.1162 6400.0 125.0593 15000.0 125.0958 31000.0 129.0694 4100.0 131.0853 46000.0 132.0931 5700.0 133.101 71000.0 133.6221 2800.0 135.0802 26000.0 135.1166 32000.0 137.0961 23000.0 139.0753 9000.0 139.1113 29000.0 142.0779 2600.0 143.0853 37000.0 144.0931 28000.0 145.1009 130000.0 146.1087 11000.0 147.0801 41000.0 147.1166 36000.0 149.096 29000.0 151.075 35000.0 153.0909 5700.0 155.0852 8000.0 155.1064 19000.0 156.0935 6300.0 157.101 100000.0 158.1085 27000.0 159.0805 13000.0 159.1166 71000.0 160.0881 49000.0 161.096 27000.0 161.1325 21000.0 163.1116 51000.0 165.0909 150000.0 165.1269 10000.0 167.1068 14000.0 169.1009 33000.0 170.1086 12000.0 171.1021 7400.0 171.1169 77000.0 172.1243 30000.0 173.0964 17000.0 173.1325 43000.0 173.531 93000.0 173.5442 9900.0 175.1117 31000.0 175.1477 7700.0 177.0916 9600.0 177.1272 7300.0 178.0988 3200.0 179.1054 2800.0 179.1432 12000.0 180.1153 2700.0 181.1035 12000.0 181.1222 73000.0 182.1098 2600.0 182.1267 3000.0 183.1166 44000.0 183.1351 11000.0 184.1244 10000.0 185.0955 6700.0 185.1323 55000.0 187.1117 25000.0 187.1481 33000.0 189.1273 35000.0 190.1351 46000.0 191.1069 8200.0 191.1428 20000.0 193.1037 3500.0 193.1222 30000.0 195.1167 33000.0 195.1364 15000.0 196.1234 5700.0 197.0963 3600.0 197.1325 56000.0 198.1387 4000.0 199.1114 15000.0 199.1483 23000.0 201.1272 17000.0 203.1431 83000.0 207.1178 9900.0 207.138 45000.0 208.1263 3000.0 208.1459 35000.0 209.1324 45000.0 209.1524 12000.0 210.1387 6100.0 211.1126 9200.0 211.1483 35000.0 213.1272 14000.0 213.1637 12000.0 215.1433 15000.0 216.1504 8400.0 217.1587 2700.0 219.1382 24000.0 221.1322 16000.0 221.1537 240000.0 222.1561 3600.0 223.1479 28000.0 224.1551 3100.0 225.1269 8000.0 225.1485 34000.0 227.1431 8400.0 227.1798 16000.0 229.1591 13000.0 231.138 26000.0 233.1537 62000.0 234.1613 54000.0 235.1476 13000.0 235.1712 2800.0 237.1275 4700.0 237.1642 15000.0 239.1431 6800.0 239.1796 8300.0 241.1582 5900.0 241.1943 2800.0 243.1374 7900.0 245.1535 13000.0 246.161 9600.0 247.1467 2600.0 247.1692 54000.0 249.1647 12000.0 251.1415 2900.0 251.1784 11000.0 253.1594 3300.0 255.175 6200.0 256.1799 2600.0 256.4473 2900.0 257.188 2500.0 259.1707 9300.0 261.1596 4000.0 261.1869 9600.0 263.1792 2300.0 265.1594 7000.0 265.1937 2400.0 267.1756 3700.0 269.1535 2600.0 269.19 22000.0 271.1696 6900.0 273.1853 25000.0 274.1935 15000.0 281.1897 15000.0 283.1694 7700.0 285.1849 15000.0 286.193 37000.0 287.1714 2200.0 287.2009 310000.0 287.2373 7300.0 293.1893 3000.0 297.185 11000.0 299.2009 51000.0 300.2083 8600.0 301.345 2500.0 303.1979 2700.0 309.1851 3300.0 309.223 3200.0 310.1936 6000.0 311.2015 12000.0 312.2084 15000.0 313.2164 31000.0 319.2054 14000.0 321.2212 6300.0 325.2169 32000.0 329.2125 11000.0 337.2165 55000.0 339.232 41000.0 340.2409 2800.0 347.2325 2400.0 352.2396 150000.0 353.2474 35000.0 365.2474 59000.0 367.2619 14000.0 377.249 3100.0 395.2587 52000.0 480.3242 19000.0 503.7378 2400.0 511.3464 2500.0 525.3562 15000.0 538.3642 76000.0 618.5182 7100.0 END IONS BEGIN IONS SCANS=690 PEPMASS=600.4175 CHARGE=1 COLLISION_ENERGY=0.0 64.9442 2300.0 66.9586 2500.0 67.0539 7300.0 69.0331 2600.0 69.0696 6400.0 73.0645 11000.0 79.0543 3900.0 81.0696 19000.0 82.0368 2500.0 83.0488 3400.0 83.0851 7800.0 85.0648 2900.0 87.0436 47000.0 87.7684 2400.0 89.0593 740000.0 89.0663 5400.0 91.0538 6000.0 93.0695 35000.0 95.0487 12000.0 95.0852 24000.0 97.0645 14000.0 105.0694 26000.0 107.0693 2800.0 107.0852 41000.0 109.0647 7400.0 109.1008 27000.0 113.0954 3200.0 116.0094 2700.0 116.0323 2500.0 117.0906 2900.0 119.0852 42000.0 121.1008 43000.0 123.0803 21000.0 125.096 6800.0 129.0698 3000.0 131.0697 12000.0 131.0854 24000.0 133.0742 2900.0 133.0855 370000.0 133.1004 34000.0 134.8037 2500.0 135.0803 12000.0 135.1165 14000.0 137.0959 7200.0 139.1123 2900.0 139.8655 2400.0 143.0853 26000.0 144.093 3100.0 145.1008 45000.0 147.0801 8800.0 147.1166 17000.0 149.0959 15000.0 151.0761 3800.0 155.0849 4800.0 155.107 2600.0 157.1008 47000.0 158.1085 6200.0 159.0806 12000.0 159.1166 37000.0 161.0961 11000.0 161.132 3000.0 165.0906 7100.0 167.1065 18000.0 169.101 18000.0 170.1088 3000.0 171.1167 40000.0 173.0961 5300.0 173.1325 21000.0 173.524 41000.0 173.5427 28000.0 175.0961 2800.0 175.1118 8300.0 175.1481 8500.0 177.0969 3100.0 177.112 54000.0 181.1009 12000.0 183.1165 26000.0 185.132 21000.0 187.1119 3600.0 187.1479 8300.0 189.1267 3700.0 190.1351 2500.0 195.1172 20000.0 197.1321 26000.0 199.1111 3200.0 199.1478 10000.0 203.1442 4500.0 204.484 2700.0 207.1173 12000.0 209.1324 25000.0 211.1481 18000.0 213.1272 3900.0 213.1632 3700.0 215.1441 2600.0 220.892 3400.0 221.1328 15000.0 221.1546 10000.0 223.1477 17000.0 227.1418 3000.0 233.1538 21000.0 235.1474 6400.0 237.1645 7300.0 239.1481 3100.0 247.1447 2900.0 249.165 4300.0 251.1462 2800.0 251.179 3200.0 255.1741 21000.0 261.0247 2700.0 261.1628 2900.0 263.1774 6200.0 275.1809 3500.0 277.1932 2900.0 334.1079 2400.0 368.7173 2800.0 411.1591 2400.0 442.5897 2600.0 448.5576 2200.0 455.7804 2700.0 553.2837 2600.0 END IONS BEGIN IONS SCANS=691 PEPMASS=371.2585 CHARGE=1 COLLISION_ENERGY=0.0 52.2486 2200.0 52.9818 2200.0 54.1414 2200.0 55.2853 2200.0 57.0328 2200.0 57.0698 4600.0 57.4346 2600.0 58.3431 2200.0 60.5608 2400.0 63.3193 2300.0 67.8941 2300.0 68.9362 2300.0 71.0489 22000.0 71.0852 2600.0 71.9253 2200.0 72.2784 2500.0 75.2614 2500.0 75.3 2700.0 75.8995 2000.0 80.7283 2200.0 83.0491 2400.0 83.2926 2200.0 83.8151 2400.0 87.8462 2600.0 99.0797 2300.0 99.0879 2300.0 99.0962 2400.0 99.9349 2500.0 101.0593 34000.0 102.9056 2200.0 110.5229 2500.0 111.0439 33000.0 114.5784 2300.0 115.0858 2400.0 119.0854 18000.0 121.0644 2800.0 124.2805 2200.0 125.096 15000.0 127.1799 2200.0 129.0546 13000.0 133.1008 1500000.0 133.1113 15000.0 133.1246 2500.0 135.0444 5500.0 143.9195 2200.0 147.0799 34000.0 147.1166 18000.0 149.0833 2900.0 149.0992 2900.0 149.6851 4500.0 149.6954 3900.0 151.1114 120000.0 152.7281 2700.0 153.0906 270000.0 155.8857 2300.0 157.1008 25000.0 159.7577 2500.0 160.0885 11000.0 160.2406 2700.0 161.134 3200.0 164.5474 2500.0 164.6483 2300.0 166.2075 2200.0 168.2814 2500.0 171.1168 17000.0 173.1324 230000.0 173.5289 48000.0 173.5374 76000.0 174.4736 2100.0 175.1116 210000.0 175.148 240000.0 183.1172 7000.0 185.1323 26000.0 188.3085 2300.0 190.4418 2300.0 191.1061 11000.0 201.1274 61000.0 203.6897 2600.0 207.9777 2200.0 211.1118 11000.0 213.1639 6100.0 223.148 10000.0 229.1224 170000.0 241.1586 480000.0 241.1864 4700.0 276.2017 2500.0 279.8232 2300.0 283.2062 61000.0 290.4381 2600.0 295.5952 2200.0 305.7859 2400.0 306.6315 2300.0 308.2912 2800.0 310.4415 2200.0 311.2006 28000.0 329.2115 270000.0 329.8504 2500.0 332.5141 2400.0 363.7288 2900.0 374.9906 2500.0 END IONS BEGIN IONS SCANS=692 PEPMASS=794.5783 CHARGE=1 COLLISION_ENERGY=0.0 71.0489 67000.0 71.0854 76000.0 72.3542 2300.0 73.0282 3400.0 73.4288 2100.0 73.5527 2600.0 77.0387 6300.0 79.0541 930000.0 79.0586 2400.0 79.0595 4500.0 81.0334 3600.0 81.0697 3400000.0 81.0745 4500.0 82.4126 3100.0 83.049 94000.0 83.0852 930000.0 83.0913 4500.0 85.0282 120000.0 85.0645 130000.0 85.101 61000.0 85.559 2500.0 87.7153 2100.0 91.0388 59000.0 91.0482 5500.0 91.0539 560000.0 91.4343 2500.0 93.0697 1500000.0 93.0754 3400.0 93.0768 6400.0 95.049 86000.0 95.0853 3400000.0 95.091 6400.0 95.5837 2600.0 95.6903 2700.0 97.0282 71000.0 97.0646 250000.0 97.1009 630000.0 99.0439 3600.0 99.0802 150000.0 99.3127 2400.0 101.0598 6500.0 103.2221 2400.0 105.0444 9300.0 105.0618 3600.0 105.0696 660000.0 107.0772 14000.0 107.0853 1300000.0 109.0646 67000.0 109.093 9300.0 109.101 2000000.0 109.1084 2800.0 111.0445 2700.0 111.0801 180000.0 111.1166 160000.0 113.0959 68000.0 115.0755 5500.0 117.0696 200000.0 118.2744 2200.0 119.0769 6500.0 119.0853 850000.0 121.091 37000.0 121.1009 1600000.0 121.1108 20000.0 121.158 2300.0 122.7947 3800.0 123.0802 98000.0 123.107 11000.0 123.1166 1000000.0 123.1267 8300.0 125.0959 130000.0 125.1319 12000.0 125.7495 3200.0 127.0391 9700.0 127.0755 12000.0 127.1116 27000.0 129.0546 16000.0 129.0694 34000.0 130.1848 3000.0 130.835 2000.0 131.075 2900.0 131.0853 510000.0 133.0906 6700.0 133.1009 1000000.0 133.1127 10000.0 135.0804 19000.0 135.1057 3800.0 135.1166 1300000.0 135.1273 2600.0 135.4208 2400.0 137.0959 120000.0 137.1322 430000.0 139.0963 2600.0 139.1115 110000.0 141.1272 6200.0 142.9508 2900.0 143.0853 61000.0 145.0892 8800.0 145.101 510000.0 145.1137 6300.0 147.0801 2800.0 147.1037 9700.0 147.1165 900000.0 149.096 48000.0 149.12 3300.0 149.1323 930000.0 149.1462 7900.0 151.1116 100000.0 151.1479 180000.0 153.1271 92000.0 155.0854 9800.0 157.1011 90000.0 159.0698 2400.0 159.1024 4600.0 159.1167 530000.0 159.1292 2200.0 160.8336 3300.0 161.0974 4400.0 161.1323 800000.0 161.148 7700.0 163.112 53000.0 163.1479 600000.0 165.1273 70000.0 165.1635 66000.0 166.0494 2800.0 167.143 40000.0 169.0782 3500.0 169.1012 14000.0 170.3357 2400.0 171.1166 120000.0 173.1168 6500.0 173.1325 570000.0 173.5243 100000.0 173.5385 220000.0 174.9077 2500.0 175.1122 8800.0 175.1481 450000.0 177.1272 50000.0 177.1638 230000.0 179.1428 52000.0 179.1794 32000.0 181.1013 2600.0 181.1588 23000.0 183.1169 33000.0 185.1325 120000.0 185.3685 3200.0 187.148 320000.0 189.1637 170000.0 190.8213 2400.0 191.1425 38000.0 191.1794 60000.0 193.1587 45000.0 193.5516 2800.0 195.1725 3300.0 197.1323 18000.0 197.899 2200.0 199.1482 87000.0 201.1636 140000.0 203.1438 6800.0 203.1795 84000.0 205.159 49000.0 205.195 34000.0 207.1746 33000.0 209.1537 6000.0 211.1491 9100.0 213.1646 43000.0 215.1794 79000.0 216.0381 3600.0 217.1588 7200.0 217.1954 59000.0 218.3177 3000.0 219.1742 43000.0 219.2107 31000.0 221.1498 3100.0 221.1904 9900.0 225.1662 3800.0 229.1953 25000.0 231.1767 3800.0 231.211 22000.0 233.1906 17000.0 233.2263 87000.0 235.1703 3600.0 239.1792 6800.0 241.195 88000.0 243.2105 420000.0 245.2262 240000.0 247.2416 6200.0 257.1894 6500.0 257.2246 9300.0 259.2053 210000.0 261.1912 23000.0 261.221 1300000.0 261.2469 2400.0 262.4126 3400.0 263.2365 410000.0 263.2666 5200.0 267.2079 2800.0 269.2247 2900.0 271.2047 3000.0 271.2393 3500.0 273.2224 27000.0 275.2015 3800.0 275.2358 12000.0 277.2167 25000.0 279.2323 50000.0 282.2003 2600.0 285.2231 8700.0 285.2579 2900.0 287.2377 31000.0 289.2184 3100.0 289.2521 14000.0 291.2325 19000.0 295.2401 2900.0 297.2161 3500.0 299.2365 31000.0 301.2533 30000.0 301.2878 3200.0 303.2332 8100.0 305.2482 15000.0 313.2506 6900.0 315.2707 3200.0 317.2474 150000.0 317.2856 4300.0 319.2624 28000.0 323.2581 3600.0 329.2841 6500.0 333.2421 37000.0 335.2216 2700.0 335.258 3600000.0 335.3257 4000.0 337.2263 14000.0 337.2737 4500000.0 337.3213 14000.0 339.2893 130000.0 343.2585 3500.0 343.3028 2800.0 345.7156 2400.0 349.2298 2500.0 351.2968 2700.0 354.7741 3700.0 357.316 8500.0 357.5555 2500.0 371.3323 3300.0 379.1732 3900.0 415.3568 3500.0 420.459 3500.0 426.0496 2500.0 445.8975 3000.0 453.0999 2300.0 459.6405 4400.0 472.3727 2600.0 505.4401 3200.0 510.7032 2400.0 514.0461 3100.0 523.4509 80000.0 530.4066 2600.0 537.4794 3000.0 541.4616 37000.0 571.4711 2700.0 583.335 4600.0 597.4869 440000.0 597.7538 2700.0 615.4962 69000.0 646.0274 2600.0 656.8094 2600.0 END IONS BEGIN IONS SCANS=693 PEPMASS=609.2711 CHARGE=1 COLLISION_ENERGY=0.0 67.6959 26000.0 67.6989 7200.0 80.8461 2300.0 81.0692 5500.0 95.0849 2600.0 108.5687 2400.0 120.6935 2600.0 155.3164 2600.0 173.5249 41000.0 173.5413 35000.0 183.8149 2500.0 202.9509 2500.0 253.3758 2100.0 421.3088 2500.0 461.2317 5300.0 475.211 2800.0 477.2266 3300.0 477.7841 2300.0 485.2354 2500.0 487.2502 12000.0 503.2401 9000.0 519.2361 28000.0 521.2188 14000.0 531.1472 3600.0 531.2387 170000.0 532.2498 5400.0 549.2499 310000.0 563.2665 19000.0 577.2435 7900.0 580.2346 3400.0 581.2646 3300.0 581.2751 15000.0 591.2605 81000.0 609.2709 900000.0 END IONS BEGIN IONS SCANS=694 PEPMASS=602.4332 CHARGE=1 COLLISION_ENERGY=0.0 63.8949 2300.0 67.0539 22000.0 69.033 2800.0 69.0696 24000.0 71.0492 6500.0 79.0539 25000.0 80.0617 4100.0 81.0694 92000.0 83.0488 16000.0 83.0852 130000.0 85.0644 12000.0 87.0437 4300.0 89.0593 40000.0 90.0627 5100.0 91.0539 22000.0 93.0695 110000.0 95.0488 34000.0 95.0852 77000.0 96.8253 2400.0 97.0591 2500.0 97.0644 44000.0 97.1011 3100.0 99.0437 15000.0 99.0803 3000.0 105.0696 110000.0 106.0774 4100.0 107.0851 140000.0 108.0928 3500.0 109.0644 22000.0 109.1008 71000.0 111.0801 11000.0 113.0958 25000.0 117.0694 19000.0 117.533 2800.0 119.0755 4100.0 119.0852 230000.0 119.0936 2300.0 120.093 21000.0 121.0643 2900.0 121.1008 110000.0 123.08 51000.0 123.1164 22000.0 125.0957 39000.0 129.0696 11000.0 130.0773 3900.0 131.0764 2800.0 131.0852 78000.0 132.093 20000.0 133.0861 16000.0 133.1009 160000.0 133.1126 5100.0 134.0895 6700.0 134.1085 12000.0 135.0802 14000.0 135.1165 53000.0 137.0958 17000.0 138.1045 3600.0 139.1116 44000.0 142.0773 7900.0 143.0853 72000.0 144.0931 27000.0 145.0645 3000.0 145.1009 220000.0 145.1123 2400.0 146.1086 11000.0 147.0802 8300.0 147.1165 86000.0 149.0958 22000.0 149.1323 12000.0 150.1052 2900.0 151.0755 2300.0 151.1112 12000.0 151.1476 2200.0 153.0908 3100.0 153.1267 3000.0 153.7868 2200.0 155.0851 17000.0 155.1065 18000.0 156.0931 14000.0 156.4023 2700.0 157.1009 150000.0 158.1087 33000.0 159.0804 3500.0 159.1166 120000.0 159.1314 3700.0 160.0881 70000.0 160.1231 7200.0 161.0959 20000.0 161.1324 30000.0 163.1113 15000.0 163.1487 3800.0 165.1268 11000.0 167.0853 6900.0 167.1067 20000.0 168.1141 2700.0 169.1011 64000.0 170.1089 12000.0 171.1013 7000.0 171.1168 120000.0 172.1246 12000.0 173.0961 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233.1541 46000.0 235.1481 20000.0 237.1639 24000.0 238.1722 3000.0 238.3025 2600.0 239.1419 3300.0 239.1794 13000.0 241.1954 10000.0 243.1732 2700.0 246.1614 7200.0 247.1466 11000.0 247.172 3900.0 249.1637 19000.0 250.1734 3300.0 251.1791 15000.0 253.1622 3000.0 253.1945 9000.0 255.1751 4300.0 257.1897 10000.0 259.171 3200.0 259.206 5600.0 261.162 9100.0 263.1796 25000.0 265.1949 18000.0 267.21 7800.0 273.1854 7400.0 275.1793 3200.0 276.1872 5200.0 277.1956 8900.0 279.2114 3800.0 281.1934 3600.0 283.2075 6500.0 285.1842 6300.0 286.1931 15000.0 289.1964 4100.0 291.2116 8700.0 295.2083 2900.0 297.2208 2900.0 299.2012 13000.0 309.2221 3800.0 311.2368 3000.0 351.2699 8500.0 410.8864 3200.0 438.2458 2400.0 END IONS BEGIN IONS SCANS=695 PEPMASS=401.2842 CHARGE=1 COLLISION_ENERGY=0.0 53.6083 2100.0 55.054 18000.0 57.9585 2400.0 60.0811 2500.0 65.6311 2600.0 67.0539 23000.0 69.0696 28000.0 71.0487 24000.0 74.5045 2300.0 77.9733 2600.0 79.0538 27000.0 80.295 2200.0 81.0695 49000.0 83.0419 2600.0 83.0855 7500.0 91.0539 35000.0 93.0695 88000.0 95.0488 14000.0 95.0852 41000.0 98.8649 2300.0 101.8935 2100.0 105.0627 3700.0 105.0695 130000.0 107.0851 80000.0 109.0644 89000.0 109.1008 30000.0 111.08 13000.0 111.2225 2700.0 117.0696 34000.0 119.0851 160000.0 121.1008 41000.0 123.0803 6800.0 123.5976 2300.0 128.0616 4500.0 129.0694 24000.0 130.0774 7100.0 130.135 2700.0 131.0749 7400.0 131.0852 130000.0 133.1008 160000.0 135.0801 32000.0 135.1164 43000.0 137.0955 5300.0 137.5152 3000.0 139.3353 2200.0 140.6406 2300.0 141.0693 5300.0 142.0772 30000.0 143.0852 74000.0 144.0931 13000.0 145.1009 210000.0 147.0801 16000.0 147.1165 36000.0 153.2724 2400.0 155.0852 25000.0 156.0929 29000.0 157.1009 130000.0 158.1087 23000.0 159.1165 82000.0 161.0959 5900.0 161.1321 3000.0 165.0711 3800.0 166.3428 3100.0 167.0856 17000.0 168.0928 11000.0 169.1011 42000.0 170.1087 18000.0 171.1166 67000.0 172.1248 13000.0 173.1323 95000.0 173.5299 62000.0 173.546 10000.0 175.1478 20000.0 177.1489 2200.0 179.0852 14000.0 180.0935 6200.0 181.1015 23000.0 182.1091 15000.0 183.1167 49000.0 184.1252 11000.0 185.1325 34000.0 187.1483 34000.0 190.5661 2300.0 192.0914 3000.0 193.1013 16000.0 194.1085 18000.0 195.1166 44000.0 196.1241 9400.0 196.8769 2300.0 197.1324 38000.0 199.1478 30000.0 206.1089 18000.0 207.1165 21000.0 208.1244 6100.0 209.1324 47000.0 210.1386 3200.0 211.1486 16000.0 221.1328 25000.0 222.1404 5100.0 223.1485 14000.0 233.1334 4100.0 235.1484 11000.0 237.1638 17000.0 245.1327 3200.0 246.1396 6600.0 247.1476 3200.0 249.1647 2700.0 251.1796 6500.0 262.6397 2500.0 263.179 3200.0 273.1608 2700.0 287.1771 2500.0 291.0583 3100.0 356.5268 2600.0 378.199 2500.0 401.2817 3500.0 403.2453 2500.0 END IONS BEGIN IONS SCANS=696 PEPMASS=794.5782 CHARGE=1 COLLISION_ENERGY=0.0 71.0489 18000.0 71.0852 36000.0 71.3109 2400.0 71.4625 2200.0 72.2051 2000.0 72.2608 2600.0 72.3508 2300.0 72.3705 2700.0 72.849 2200.0 73.0641 2400.0 74.0128 2600.0 74.1477 2700.0 74.6336 2300.0 75.6255 2800.0 75.6883 2200.0 75.7661 2100.0 75.823 2500.0 76.4325 2200.0 76.5265 2200.0 76.9569 2800.0 77.0821 2100.0 77.476 2200.0 77.7275 2200.0 79.0538 590000.0 79.9785 2400.0 80.281 2400.0 80.3981 2400.0 81.0694 2200000.0 81.5648 2200.0 81.6305 2200.0 82.1208 2700.0 83.0488 29000.0 83.085 590000.0 85.0281 46000.0 85.0644 44000.0 85.1006 9500.0 85.2084 2400.0 86.1707 2600.0 87.7883 2300.0 88.8317 2500.0 91.0384 6800.0 91.0538 350000.0 91.0631 2400.0 91.5999 2200.0 92.0041 2700.0 92.7693 2600.0 93.0694 1000000.0 93.7722 2200.0 94.085 2400.0 94.1913 2700.0 95.049 26000.0 95.0785 3800.0 95.085 2200000.0 96.1772 2200.0 96.503 2300.0 97.0282 8000.0 97.0643 140000.0 97.1007 400000.0 98.1134 2300.0 99.08 62000.0 101.5717 2400.0 101.932 2300.0 103.5136 2400.0 104.7913 2600.0 104.932 2200.0 105.044 2600.0 105.0694 430000.0 106.045 2300.0 107.085 830000.0 109.0644 15000.0 109.1007 1300000.0 109.9536 2400.0 111.0801 100000.0 111.1164 87000.0 111.6523 2300.0 112.4883 2700.0 113.0956 21000.0 114.2975 2200.0 117.0693 120000.0 119.085 550000.0 121.0924 6200.0 121.1006 1100000.0 121.641 2500.0 123.0801 36000.0 123.1075 5300.0 123.1163 660000.0 123.3128 2600.0 125.0957 62000.0 127.0748 8300.0 128.8734 2600.0 129.0691 2600.0 131.0851 310000.0 132.7713 2800.0 133.0904 6300.0 133.1007 660000.0 133.5315 2400.0 133.8965 2300.0 134.7731 2300.0 135.1063 12000.0 135.1163 860000.0 136.4232 2300.0 136.5466 2600.0 137.0956 37000.0 137.1319 250000.0 137.4456 3000.0 137.8773 2900.0 138.709 2600.0 139.1112 43000.0 141.2081 2400.0 141.5291 2400.0 142.6127 2300.0 143.0589 2800.0 143.0857 16000.0 145.0495 2300.0 145.1007 310000.0 145.2669 2400.0 147.0214 2500.0 147.1163 590000.0 147.2033 2300.0 148.4093 2700.0 149.0951 8500.0 149.122 4800.0 149.132 580000.0 150.0056 2500.0 151.1114 34000.0 151.1477 91000.0 151.9703 2300.0 152.9881 2600.0 153.1269 31000.0 157.1008 31000.0 158.2239 2500.0 158.9622 2200.0 159.1164 350000.0 160.9474 2700.0 161.132 510000.0 163.1119 7600.0 163.1476 390000.0 164.7384 2600.0 165.1272 24000.0 165.1637 18000.0 167.1428 2900.0 169.7381 3200.0 171.1167 40000.0 173.1321 340000.0 173.5229 120000.0 173.5335 680000.0 173.5446 47000.0 174.0114 2400.0 175.1323 2400.0 175.1479 290000.0 175.1637 2500.0 177.1634 110000.0 179.1424 12000.0 181.1592 2700.0 182.0717 2900.0 183.1161 5100.0 183.3118 2700.0 183.8271 2800.0 184.0357 2400.0 185.1325 45000.0 185.2661 2600.0 185.3519 2300.0 187.1476 190000.0 188.1486 2800.0 189.1635 110000.0 189.8297 2700.0 190.3514 2400.0 191.1421 2800.0 191.1781 14000.0 191.6887 2700.0 192.5244 2400.0 197.1292 2600.0 199.0783 2200.0 199.1479 19000.0 200.9812 2700.0 201.1634 59000.0 202.373 2800.0 203.1799 25000.0 205.159 3300.0 205.1947 2400.0 206.1346 2800.0 210.1416 2300.0 210.2835 2900.0 212.4282 2900.0 213.1634 3100.0 215.1798 17000.0 215.4295 2500.0 216.3405 2500.0 217.1949 3100.0 219.1745 15000.0 219.211 5800.0 222.7521 2700.0 226.593 2900.0 229.3464 2400.0 229.7086 2200.0 230.5556 2300.0 231.2748 2300.0 233.2262 28000.0 241.1954 25000.0 243.2104 270000.0 245.1958 2800.0 245.2258 130000.0 257.9481 2300.0 258.1442 2400.0 259.205 110000.0 260.935 2900.0 261.2207 830000.0 263.2363 250000.0 263.6428 2300.0 265.0424 2400.0 266.7254 2300.0 270.8586 3000.0 271.1158 2700.0 275.2372 2800.0 279.6724 2300.0 280.1559 2400.0 280.975 3600.0 284.441 2400.0 291.2309 2700.0 294.7843 2500.0 297.5847 2400.0 299.2334 2400.0 300.5858 2900.0 301.7259 3000.0 303.0037 2500.0 311.6534 2600.0 313.2114 2900.0 316.6765 2600.0 317.2472 76000.0 317.5537 2300.0 319.2638 2900.0 327.2709 2900.0 333.2413 3100.0 335.258 2300000.0 335.3022 3900.0 336.0087 2700.0 337.2258 25000.0 337.2737 2800000.0 337.321 29000.0 339.2894 51000.0 340.3498 2600.0 340.4294 2300.0 347.9833 2300.0 363.7084 2500.0 366.6687 2400.0 368.3079 2500.0 368.5358 2600.0 371.3341 3300.0 378.5182 2500.0 388.5228 2400.0 394.1907 2700.0 405.0237 2400.0 406.2985 2500.0 423.5477 2700.0 426.2451 2500.0 426.9329 3100.0 427.011 2800.0 429.3247 2400.0 442.0508 2800.0 445.766 2500.0 452.9023 2600.0 460.245 2500.0 475.1053 2600.0 503.0587 2400.0 520.0181 2400.0 521.913 2700.0 523.45 16000.0 530.725 2400.0 534.963 2700.0 541.3246 3000.0 560.1764 2800.0 560.3926 3000.0 560.5637 3000.0 565.2043 2800.0 570.497 2800.0 572.1389 2800.0 580.6742 2600.0 584.9413 2700.0 587.3882 2400.0 597.4877 260000.0 604.209 2800.0 611.763 2200.0 615.5015 2800.0 616.5096 2700.0 620.1661 2500.0 627.8587 2500.0 633.5615 2700.0 651.405 2800.0 652.0803 2300.0 663.0712 2600.0 664.5915 2600.0 700.5663 2700.0 722.5486 2400.0 732.5524 2800.0 761.8511 2700.0 765.233 2400.0 799.0058 3200.0 END IONS BEGIN IONS SCANS=697 PEPMASS=799.5333 CHARGE=1 COLLISION_ENERGY=0.0 71.0122 8600.0 71.0486 15000.0 71.2792 2400.0 71.586 2500.0 73.0278 320000.0 73.2663 2700.0 73.3129 2400.0 73.5767 2700.0 74.2654 2600.0 74.9649 2100.0 76.2434 2300.0 78.5617 2700.0 78.9272 2200.0 78.9672 2200.0 79.0536 150000.0 80.3295 3100.0 80.3452 2100.0 81.0329 130000.0 81.0692 540000.0 83.0487 17000.0 83.0848 130000.0 85.0277 650000.0 85.0641 9000.0 87.0435 55000.0 88.8362 410000.0 88.8404 24000.0 90.9279 2600.0 91.0382 580000.0 91.0535 83000.0 91.2974 2400.0 93.0692 220000.0 93.2815 2400.0 94.6074 2500.0 95.0848 520000.0 96.0618 2400.0 97.0276 560000.0 97.0642 34000.0 97.1005 83000.0 98.7131 2600.0 99.0434 120000.0 99.08 12000.0 101.0225 240000.0 102.4211 2500.0 103.0382 110000.0 105.0692 81000.0 105.6989 2300.0 107.0847 190000.0 107.7436 2400.0 108.6523 2300.0 109.0276 120000.0 109.0645 2700.0 109.0939 3400.0 109.1004 300000.0 109.8518 2900.0 110.2193 2400.0 111.0799 13000.0 115.0383 58000.0 117.0539 5700.0 117.0701 3300.0 119.0849 100000.0 119.3521 2400.0 121.1004 240000.0 123.116 160000.0 123.1248 3800.0 124.0281 2300.0 124.4157 2700.0 125.7496 2400.0 126.4 2600.0 127.0298 3100.0 127.0381 380000.0 129.054 54000.0 129.8283 3700.0 131.0848 45000.0 133.1004 140000.0 133.8811 2500.0 134.6053 2800.0 135.1059 2700.0 135.1159 180000.0 136.8923 2700.0 137.1318 68000.0 139.1115 2500.0 145.0487 120000.0 145.1006 40000.0 147.1161 110000.0 147.722 2400.0 149.1316 130000.0 151.111 3700.0 151.1471 13000.0 153.1263 9200.0 159.0659 2700.0 159.1163 32000.0 161.1317 110000.0 162.294 2500.0 163.1473 74000.0 166.9769 2800.0 173.1321 44000.0 173.5223 11000.0 173.5313 410000.0 173.5422 31000.0 175.1479 66000.0 177.1285 2300.0 177.1638 12000.0 177.2883 2400.0 180.5889 2300.0 183.0649 63000.0 184.0731 17000.0 185.0258 6500.0 185.0413 420000.0 187.1476 12000.0 189.1629 13000.0 196.2687 2600.0 196.5939 2900.0 199.8741 5200.0 199.8939 5200.0 200.8174 2500.0 201.0747 41000.0 203.036 2400.0 203.0519 240000.0 220.7479 2700.0 224.9763 3200.0 227.3175 2300.0 237.9338 2800.0 241.0679 64000.0 243.057 3700.0 243.0831 610000.0 243.2104 20000.0 245.2256 78000.0 246.5556 2200.0 247.6646 2800.0 251.151 2500.0 259.0773 7000.0 261.2202 150000.0 263.2359 180000.0 301.2136 38000.0 303.2308 14000.0 327.7754 2300.0 332.1042 2300.0 335.2134 3500.0 335.2573 520000.0 335.2978 3700.0 337.2311 3900.0 337.2729 700000.0 337.3162 8800.0 344.8253 2800.0 351.3094 2300.0 353.155 2500.0 358.1671 2500.0 363.2529 26000.0 365.2673 36000.0 366.7649 2600.0 373.368 2300.0 381.877 2800.0 397.2874 3000.0 422.6605 2300.0 448.722 2300.0 477.3928 2500.0 479.2992 3500.0 481.3211 2900.0 484.0883 2600.0 497.3103 71000.0 498.4056 2900.0 499.325 72000.0 519.1998 3400.0 519.2924 7800000.0 519.4728 18000.0 520.75 2600.0 521.1276 4100.0 521.3077 8100000.0 521.4885 19000.0 530.5924 2600.0 564.5056 3000.0 566.7251 2100.0 594.2481 2500.0 619.4658 2600.0 637.4804 160000.0 653.251 2900.0 656.5039 3100.0 710.8896 2400.0 718.9642 3100.0 731.6379 2700.0 778.3073 2500.0 786.5027 2900.0 799.1846 13000.0 799.3593 6000.0 799.5321 9800000.0 799.879 21000.0 800.5216 3400.0 800.5409 5400.0 END IONS BEGIN IONS SCANS=698 PEPMASS=663.175 CHARGE=1 COLLISION_ENERGY=0.0 67.0143 4900.0 67.0174 24000.0 69.9163 2200.0 72.756 2400.0 79.0712 2200.0 79.3229 2200.0 81.0692 3500.0 83.0848 3000.0 101.3065 2300.0 103.0806 2300.0 111.2462 2500.0 121.2725 2800.0 149.6898 5800.0 153.2352 2300.0 171.5305 2300.0 173.5227 11000.0 173.5402 25000.0 197.0994 2500.0 325.2027 2300.0 337.5636 3000.0 378.4624 2700.0 458.8271 2500.0 473.0899 22000.0 475.0635 7600.0 475.1419 310000.0 487.1049 3500.0 490.128 11000.0 494.8284 2400.0 501.122 45000.0 502.1297 35000.0 503.1367 190000.0 515.1131 6900.0 518.1573 16000.0 519.1667 19000.0 522.4246 7100.0 529.1197 18000.0 530.1229 79000.0 531.1316 53000.0 532.1434 3300.0 534.1507 7100.0 534.1619 4400.0 543.1318 21000.0 546.1548 87000.0 547.1628 36000.0 557.1472 19000.0 562.1525 4400.0 569.1611 2800.0 575.1582 120000.0 588.1198 3200.0 603.1532 630000.0 603.2693 3500.0 606.142 19000.0 634.1736 8900.0 635.1716 4100.0 END IONS BEGIN IONS SCANS=699 PEPMASS=629.2374 CHARGE=1 COLLISION_ENERGY=0.0 65.8226 2300.0 77.903 2300.0 78.4572 2200.0 78.6833 2600.0 85.8531 2600.0 89.097 3100.0 97.6583 2300.0 108.7301 2700.0 114.2924 2300.0 122.092 2300.0 130.2538 2300.0 133.0133 2600.0 136.7987 2500.0 138.2989 20000.0 138.311 14000.0 138.9553 2400.0 145.195 2200.0 156.2554 2800.0 165.007 2400.0 173.5247 16000.0 173.5334 76000.0 173.5438 10000.0 174.7195 2300.0 184.8928 2500.0 192.7482 2400.0 209.8539 2500.0 214.4248 2400.0 216.8685 2400.0 226.623 2800.0 238.798 2600.0 256.8432 2600.0 268.6707 2300.0 357.8442 2600.0 435.1615 2500.0 496.1177 3600.0 496.1867 130000.0 509.1942 3000.0 510.2024 59000.0 524.2171 500000.0 525.2254 2700000.0 525.4087 5400.0 526.2238 2200.0 535.2111 30000.0 537.2034 2800.0 538.1965 68000.0 551.2064 25000.0 552.2178 7700.0 552.9612 12000.0 553.0202 59000.0 553.0596 45000.0 553.2205 9600000.0 553.3807 49000.0 553.4217 71000.0 553.4771 16000.0 554.2225 14000.0 565.0822 3000.0 585.2458 21000.0 597.2111 3800.0 611.7481 3000.0 END IONS BEGIN IONS SCANS=700 PEPMASS=606.248 CHARGE=1 COLLISION_ENERGY=0.0 67.3599 14000.0 67.3623 3400.0 75.2042 2300.0 77.0597 2300.0 87.275 2300.0 93.5047 2400.0 109.0568 2700.0 110.5199 2500.0 131.2033 2500.0 133.0696 2400.0 136.8017 2700.0 173.5221 8600.0 173.5356 69000.0 204.065 11000.0 237.1022 11000.0 245.4669 2600.0 250.1102 2800.0 263.1164 2500.0 264.5667 2500.0 360.512 2500.0 381.1411 2700.0 382.1548 4200.0 384.1716 6100.0 387.1584 2500.0 393.1468 7200.0 402.1817 13000.0 406.1213 3200.0 409.1501 2800.0 410.1504 3700.0 412.1298 3400.0 417.2093 3900.0 419.2243 7700.0 424.1299 14000.0 426.1476 10000.0 431.1826 3500.0 438.1448 39000.0 441.1677 75000.0 444.1923 2800.0 445.2027 59000.0 446.209 26000.0 447.2173 50000.0 448.2302 3600.0 453.167 6600.0 454.176 45000.0 459.1813 2500.0 459.2211 2100.0 463.25 8000.0 472.2274 2400.0 473.135 3400.0 473.1968 910000.0 474.2043 260000.0 475.2124 160000.0 477.2283 7800.0 487.2117 54000.0 488.2199 5800.0 490.2349 16000.0 491.2425 16000.0 491.2527 4800.0 499.2166 2700.0 500.2184 31000.0 501.2265 74000.0 502.2208 7500.0 502.2326 4800.0 503.2061 19000.0 504.2163 7000.0 505.2233 93000.0 506.231 57000.0 514.2065 3400.0 515.2063 17000.0 517.2186 13000.0 517.2297 3500.0 518.2282 56000.0 519.2337 100000.0 520.2479 12000.0 528.2103 2800.0 529.2204 15000.0 530.2262 19000.0 531.2027 81000.0 532.2089 9800.0 533.218 270000.0 534.2244 19000.0 535.2329 14000.0 545.2172 25000.0 546.225 190000.0 547.2336 2200000.0 547.4331 9400.0 559.1921 3200.0 560.2026 3600.0 561.2509 2900.0 563.2291 110000.0 563.3221 4400.0 565.6106 2600.0 573.2114 9500.0 574.2198 77000.0 577.2351 33000.0 578.2524 22000.0 579.2593 60000.0 588.2359 11000.0 589.2438 20000.0 591.2239 97000.0 605.2317 3100.0 606.1363 4500.0 606.2473 330000.0 606.4207 13000.0 607.2552 120000.0 END IONS BEGIN IONS SCANS=701 PEPMASS=607.2556 CHARGE=1 COLLISION_ENERGY=0.0 64.3612 490000.0 64.3642 99000.0 67.4716 1100000.0 67.475 190000.0 70.2899 17000.0 70.4406 12000.0 75.5162 13000.0 89.4585 14000.0 89.5828 21000.0 98.5837 19000.0 105.998 18000.0 125.6782 13000.0 136.8148 17000.0 149.7121 18000.0 151.8077 79000.0 151.8202 53000.0 167.5624 22000.0 173.5198 21000.0 173.5338 630000.0 181.1953 12000.0 184.721 22000.0 187.2105 19000.0 200.1373 18000.0 200.9558 15000.0 269.7246 17000.0 290.1036 18000.0 340.5361 20000.0 368.6559 13000.0 385.0736 19000.0 385.1823 17000.0 403.1896 44000.0 406.9666 12000.0 417.1693 110000.0 419.2223 260000.0 420.2278 47000.0 431.1859 120000.0 432.1947 130000.0 433.2035 380000.0 442.1753 73000.0 445.2032 430000.0 446.2106 1100000.0 447.2183 1100000.0 448.2252 130000.0 458.2127 21000.0 459.2173 290000.0 460.1927 28000.0 460.2292 30000.0 461.1987 260000.0 462.2402 130000.0 463.2482 94000.0 473.2003 400000.0 474.2046 1500000.0 475.2133 1300000.0 476.2211 170000.0 477.23 83000.0 478.2358 300000.0 479.2416 39000.0 487.2131 950000.0 488.2231 81000.0 489.2296 21000.0 490.2343 200000.0 491.2119 510000.0 501.2286 710000.0 502.2349 27000.0 503.2427 86000.0 504.2171 110000.0 505.2243 240000.0 505.4063 15000.0 506.2317 410000.0 507.2393 38000.0 517.2206 72000.0 517.2327 32000.0 518.2284 87000.0 519.2391 11000000.0 520.2493 72000.0 529.2239 420000.0 531.2385 47000.0 532.2104 150000.0 532.788 21000.0 533.2481 210000.0 534.2265 180000.0 536.2408 20000.0 537.2482 23000.0 539.1992 19000.0 547.038 100000.0 547.2343 18000000.0 548.2379 720000.0 550.2226 210000.0 551.2656 450000.0 557.2213 51000.0 561.2498 680000.0 563.2372 17000.0 564.2356 95000.0 575.2293 420000.0 578.2516 160000.0 579.2609 15000000.0 589.2454 640000.0 592.2352 35000.0 607.0236 190000.0 607.1352 37000.0 607.2555 31000000.0 608.2554 44000.0 END IONS BEGIN IONS SCANS=702 PEPMASS=655.3124 CHARGE=1 COLLISION_ENERGY=0.0 67.254 12000.0 68.8075 5800.0 68.8102 28000.0 69.7802 2300.0 70.8089 2700.0 70.8128 3500.0 76.3179 2400.0 79.9342 2400.0 81.6575 2100.0 81.8701 2200.0 89.9038 2500.0 89.9786 2500.0 95.5837 2300.0 96.7263 2100.0 102.2553 2600.0 139.5618 2400.0 142.0859 2500.0 168.8846 2500.0 171.8081 2600.0 173.5223 21000.0 173.5402 31000.0 186.8887 3000.0 253.1336 7000.0 292.1797 9200.0 384.1662 3200.0 385.8633 2400.0 389.2097 2500.0 400.2045 2600.0 407.2224 2800.0 420.2268 8600.0 421.2388 13000.0 424.1629 9500.0 427.1851 2700.0 432.2338 3000.0 433.2377 46000.0 434.2499 3500.0 435.2537 4100.0 436.2616 7800.0 445.2395 14000.0 446.2448 6500.0 447.2542 15000.0 448.2616 27000.0 449.2331 15000.0 459.2558 7300.0 460.2256 39000.0 461.229 5600.0 462.2079 6100.0 463.2126 140000.0 472.2266 11000.0 473.233 72000.0 474.2401 31000.0 475.2127 47000.0 476.2063 29000.0 477.2277 170000.0 478.2343 12000.0 485.232 16000.0 487.2488 54000.0 488.2552 27000.0 489.2269 18000.0 490.2359 13000.0 491.2437 89000.0 492.251 49000.0 493.2552 3300.0 494.2309 2900.0 503.2403 38000.0 504.2126 3800.0 505.2585 28000.0 506.2678 3100.0 507.213 2800.0 508.2127 3200.0 508.2864 16000.0 509.2907 32000.0 513.2276 4800.0 515.2433 74000.0 517.2238 47000.0 517.3035 3000.0 518.2314 16000.0 519.2731 43000.0 520.2829 110000.0 521.2222 7000.0 522.2166 2900.0 524.2717 2900.0 531.24 56000.0 532.2491 24000.0 533.2592 100000.0 534.2227 19000.0 535.2374 33000.0 536.2433 53000.0 537.2848 48000.0 538.2531 3100.0 540.2692 6300.0 546.2616 24000.0 547.2684 23000.0 549.2587 53000.0 550.2605 3700.0 550.2725 3100.0 552.2386 9400.0 553.2686 16000.0 559.2687 360000.0 560.2768 38000.0 561.2098 4900.0 561.2859 910000.0 562.2535 8300.0 563.265 500000.0 564.2728 1100000.0 565.2804 65000.0 567.2544 3700.0 575.2264 7700.0 577.2795 170000.0 578.2882 220000.0 579.2637 13000.0 580.2629 130000.0 587.2651 37000.0 588.2473 3000.0 590.2518 27000.0 591.2721 180000.0 593.3123 380000.0 593.4225 5700.0 594.2499 2800.0 595.274 3000.0 595.2902 3200.0 598.2644 3100.0 605.2752 230000.0 607.2546 12000.0 608.258 110000.0 609.2905 25000.0 619.2909 790000.0 619.3784 11000.0 620.2855 7200.0 622.2772 12000.0 637.2048 2000.0 637.3018 330000.0 637.4216 8700.0 640.2837 100000.0 655.2741 3400.0 END IONS BEGIN IONS SCANS=703 PEPMASS=618.4278 CHARGE=1 COLLISION_ENERGY=0.0 67.054 24000.0 67.8558 2300.0 68.2037 3100.0 69.0334 12000.0 69.0697 19000.0 71.0489 13000.0 72.7386 2400.0 75.0234 2300.0 76.1461 2500.0 79.054 29000.0 80.0617 2600.0 81.0696 120000.0 82.9136 2100.0 83.049 31000.0 83.0853 230000.0 84.0889 2800.0 85.0646 18000.0 86.7814 2500.0 88.2439 2700.0 88.6415 2300.0 89.0479 2700.0 91.0541 29000.0 93.0696 92000.0 95.049 75000.0 95.0853 88000.0 97.0645 69000.0 99.0439 15000.0 99.0804 5900.0 105.0696 100000.0 106.0776 4600.0 107.0853 150000.0 108.094 5100.0 109.0646 50000.0 109.1009 70000.0 111.0803 23000.0 113.0597 3600.0 113.0958 42000.0 117.0698 19000.0 118.1133 2700.0 119.0853 210000.0 119.0953 2800.0 120.0929 23000.0 121.0647 18000.0 121.1009 140000.0 121.1107 4800.0 123.0802 87000.0 123.1167 16000.0 123.294 2600.0 124.0868 2500.0 125.0595 30000.0 125.0959 56000.0 127.1117 5500.0 129.0697 20000.0 130.0767 2300.0 131.0853 86000.0 132.0931 22000.0 133.0647 6900.0 133.0904 3200.0 133.101 130000.0 134.1089 7400.0 135.0802 57000.0 135.1166 61000.0 137.0601 3600.0 137.0959 50000.0 139.075 22000.0 139.1115 50000.0 140.0623 2600.0 142.0778 11000.0 143.0853 77000.0 144.0931 56000.0 145.0461 2600.0 145.0651 7900.0 145.0888 4400.0 145.101 250000.0 145.1142 5200.0 146.1084 19000.0 147.0802 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183.138 25000.0 184.1243 23000.0 185.096 13000.0 185.1325 93000.0 186.1389 14000.0 187.1116 47000.0 187.1481 60000.0 189.1272 62000.0 190.135 92000.0 191.0876 2800.0 191.1064 22000.0 191.1429 44000.0 193.103 13000.0 193.1221 65000.0 194.1097 7800.0 194.1283 2700.0 195.1166 56000.0 195.1377 28000.0 196.1241 17000.0 197.0972 6200.0 197.1324 98000.0 198.1035 13000.0 198.1396 16000.0 199.1116 31000.0 199.148 42000.0 200.1187 2600.0 200.1551 6800.0 201.1271 35000.0 201.1658 2500.0 202.1345 3100.0 203.1431 170000.0 204.146 3100.0 205.1223 6000.0 205.1587 5900.0 207.1167 25000.0 207.1381 92000.0 208.1254 12000.0 208.1456 71000.0 209.1324 91000.0 209.154 17000.0 210.1391 15000.0 211.1119 19000.0 211.1482 70000.0 212.1543 7700.0 213.1274 42000.0 213.1638 21000.0 214.1354 2600.0 215.1426 26000.0 216.1514 13000.0 217.1228 13000.0 217.1583 7500.0 219.138 51000.0 220.1451 8500.0 221.133 29000.0 221.1537 480000.0 222.1582 17000.0 223.1482 50000.0 224.1543 18000.0 225.1262 19000.0 225.1486 63000.0 225.1688 6400.0 227.1425 20000.0 227.1796 28000.0 229.1213 6900.0 229.1586 26000.0 231.1378 43000.0 231.1747 2900.0 233.1317 9800.0 233.1538 110000.0 234.1377 4200.0 234.1612 99000.0 235.1477 23000.0 235.1707 4900.0 236.1541 4600.0 237.1272 24000.0 237.1637 41000.0 239.1428 19000.0 239.1791 21000.0 241.1586 20000.0 243.1379 18000.0 243.1738 8300.0 245.1542 21000.0 246.1617 18000.0 247.1463 9700.0 247.1693 110000.0 248.177 3800.0 249.1292 2500.0 249.1635 28000.0 250.1712 3000.0 251.1437 13000.0 251.1786 29000.0 252.1863 7500.0 253.1582 24000.0 253.1919 5500.0 255.1739 9300.0 257.1546 4100.0 257.191 3800.0 259.1692 27000.0 260.1768 8500.0 261.1851 25000.0 263.1428 6500.0 263.1793 8000.0 265.1587 14000.0 265.1951 8200.0 267.1741 22000.0 268.1824 6000.0 269.1554 13000.0 269.1898 39000.0 271.1694 24000.0 272.177 7000.0 273.185 49000.0 274.1926 33000.0 275.1762 3000.0 275.2038 3400.0 277.161 7900.0 277.1956 4900.0 279.1741 19000.0 281.1569 3000.0 281.1906 21000.0 283.1693 16000.0 283.2034 3600.0 285.185 36000.0 286.1927 84000.0 287.2007 590000.0 287.2379 4600.0 288.2054 2900.0 291.2099 10000.0 293.1883 7100.0 295.1694 4300.0 295.2067 8700.0 297.1847 37000.0 298.1932 9200.0 299.2006 110000.0 300.2078 22000.0 303.1963 16000.0 307.206 13000.0 309.185 17000.0 309.2211 9400.0 310.1931 13000.0 311.2003 24000.0 312.208 34000.0 313.2157 64000.0 319.2058 30000.0 321.2222 4900.0 323.2003 11000.0 325.216 61000.0 327.2339 3300.0 329.2122 27000.0 337.216 110000.0 339.2318 76000.0 340.2387 12000.0 347.238 8300.0 351.2372 3200.0 352.1904 4200.0 352.2394 280000.0 353.2472 67000.0 363.2331 3200.0 365.2469 120000.0 366.2548 2500.0 367.2626 28000.0 377.2478 12000.0 378.2513 3800.0 391.2608 12000.0 395.2582 110000.0 401.2702 3100.0 404.7182 2800.0 426.2755 2700.0 438.3141 6500.0 440.2891 5500.0 467.3163 4300.0 475.3174 8300.0 480.3227 37000.0 505.3308 2900.0 507.3416 3200.0 523.3445 3700.0 523.9589 2800.0 525.3571 37000.0 526.3591 17000.0 538.3645 140000.0 542.223 3200.0 568.6686 2500.0 603.4036 6600.0 618.4187 3700.0 END IONS BEGIN IONS SCANS=704 PEPMASS=662.4396 CHARGE=1 COLLISION_ENERGY=0.0 67.0539 160000.0 68.7063 2300.0 69.0695 150000.0 71.0488 21000.0 71.0852 22000.0 73.0644 6800.0 74.7076 2300.0 79.0538 46000.0 81.0645 4400.0 81.0695 270000.0 83.049 15000.0 83.0851 220000.0 85.0645 20000.0 85.1013 10000.0 91.0539 24000.0 93.0694 110000.0 94.2652 2400.0 95.0849 210000.0 97.0644 62000.0 97.1008 77000.0 98.1096 2300.0 98.9838 2700.0 99.08 16000.0 101.0594 14000.0 101.1919 2300.0 105.0694 21000.0 107.085 110000.0 109.1007 130000.0 111.08 64000.0 111.1163 9000.0 111.8207 3000.0 112.2287 2300.0 113.0951 2200.0 115.0749 20000.0 119.0851 22000.0 120.1241 2400.0 121.1007 91000.0 123.1165 89000.0 125.0957 41000.0 125.1323 11000.0 129.0908 12000.0 129.1013 2300.0 133.1007 39000.0 135.1164 38000.0 137.1321 27000.0 144.3913 2400.0 147.1166 30000.0 149.132 350000.0 149.1456 8800.0 151.148 12000.0 153.1274 8100.0 155.0099 22000.0 157.0074 2200.0 161.1323 29000.0 163.1479 27000.0 167.1427 190000.0 170.4805 3000.0 173.1326 2500.0 173.5292 24000.0 173.5389 15000.0 175.1478 27000.0 177.1633 5900.0 185.1532 30000.0 189.1639 7800.0 194.4064 2600.0 200.3086 2700.0 203.1783 3600.0 207.2292 2300.0 228.1956 80000.0 236.1136 2600.0 241.1794 180000.0 245.2262 26000.0 259.1897 54000.0 263.2362 64000.0 306.2784 20000.0 315.9813 2500.0 319.2638 3200.0 337.2734 62000.0 338.0286 2700.0 371.503 3100.0 429.3712 8400.0 438.1466 2400.0 447.382 12000.0 521.3519 2500.0 521.4195 390000.0 521.5096 11000.0 END IONS BEGIN IONS SCANS=705 PEPMASS=450.3194 CHARGE=1 COLLISION_ENERGY=0.0 56.6456 2300.0 59.9764 2200.0 67.2533 2300.0 67.3698 2200.0 67.9109 2200.0 68.6333 2200.0 69.0698 2900.0 69.4121 3200.0 69.6518 2700.0 69.991 2500.0 72.1374 2700.0 73.4958 2300.0 78.4473 2700.0 80.2023 2800.0 111.3227 2300.0 129.5705 2400.0 152.8022 2400.0 155.317 2800.0 163.6223 2600.0 173.5219 54000.0 173.5412 47000.0 225.4874 2500.0 232.4184 2300.0 252.1475 2800.0 265.4109 2500.0 358.3079 43000.0 360.3238 120000.0 376.3151 3800.0 404.3168 4900.0 450.3204 51000.0 END IONS BEGIN IONS SCANS=706 PEPMASS=375.2686 CHARGE=1 COLLISION_ENERGY=0.0 53.0384 10000.0 53.6649 2300.0 54.2354 2400.0 55.0177 11000.0 55.054 66000.0 57.0697 12000.0 57.2498 2300.0 58.8221 2100.0 59.8986 2200.0 60.2064 2400.0 60.426 2200.0 65.0385 7400.0 67.0539 110000.0 69.0333 6200.0 69.0695 72000.0 71.049 5400.0 77.0384 5300.0 77.3006 2200.0 77.3195 2200.0 79.0539 130000.0 81.0696 260000.0 83.0487 16000.0 83.0852 21000.0 90.9762 6200.0 91.0483 4200.0 91.0539 150000.0 93.0631 4400.0 93.0696 450000.0 93.0767 5600.0 95.0488 170000.0 95.0784 3400.0 95.0852 230000.0 97.0645 45000.0 99.9282 2500.0 102.1068 2300.0 103.0539 7300.0 103.2764 2200.0 105.0445 11000.0 105.0616 5400.0 105.0696 420000.0 105.0783 8000.0 107.0488 4500.0 107.0772 4900.0 107.0852 260000.0 109.0645 55000.0 109.1009 120000.0 115.054 8300.0 117.0696 78000.0 119.0755 7500.0 119.0852 400000.0 119.0932 2800.0 119.1264 2500.0 121.0553 3200.0 121.0646 97000.0 121.091 4700.0 121.1009 340000.0 121.1105 4900.0 123.0804 29000.0 123.1165 15000.0 128.0618 20000.0 129.0697 48000.0 130.0775 23000.0 131.0853 240000.0 132.0934 6500.0 133.0648 8900.0 133.0763 3300.0 133.101 220000.0 133.1126 7800.0 133.6161 2300.0 133.9843 2400.0 134.559 2200.0 135.0803 13000.0 135.1166 66000.0 141.0696 17000.0 142.0776 72000.0 143.0853 140000.0 144.0931 45000.0 145.101 340000.0 145.1144 5100.0 146.1086 12000.0 147.0802 16000.0 147.1166 93000.0 149.0956 2900.0 153.0691 3100.0 154.0761 3800.0 155.0854 44000.0 156.0931 43000.0 157.0863 8000.0 157.101 220000.0 157.1981 2500.0 158.1089 30000.0 159.0803 20000.0 159.1167 170000.0 161.0961 68000.0 161.1326 22000.0 161.9151 2400.0 164.9541 3000.0 165.0706 3100.0 167.0857 15000.0 168.0937 14000.0 169.1012 74000.0 170.0919 3000.0 170.109 22000.0 171.0807 2700.0 171.1169 84000.0 172.0886 3000.0 172.1245 14000.0 173.0961 8600.0 173.1327 82000.0 173.52 3300.0 173.5348 56000.0 175.1117 13000.0 175.1486 26000.0 179.0856 22000.0 180.0935 12000.0 181.1013 38000.0 182.1094 21000.0 183.1171 64000.0 184.1253 9200.0 185.0953 3500.0 185.1327 38000.0 187.1112 12000.0 187.1482 31000.0 189.1641 2500.0 193.1013 23000.0 194.109 22000.0 195.0998 2800.0 195.117 49000.0 196.125 25000.0 197.0979 2600.0 197.1326 54000.0 198.1412 3100.0 199.1485 37000.0 201.1638 9700.0 206.1089 11000.0 207.1177 21000.0 208.1243 12000.0 209.1121 2400.0 209.1327 45000.0 210.1412 6900.0 210.4746 2400.0 211.1485 28000.0 213.1641 6800.0 217.5684 2600.0 220.1249 15000.0 221.1328 20000.0 223.1484 26000.0 225.1641 5000.0 230.1528 2500.0 233.1319 3400.0 235.1486 11000.0 237.164 11000.0 239.1792 2800.0 247.1487 3000.0 249.1647 5800.0 251.18 6400.0 253.1962 3300.0 265.1946 5400.0 273.1641 5700.0 275.1795 6900.0 277.1934 3400.0 375.2707 17000.0 END IONS BEGIN IONS SCANS=707 PEPMASS=556.4427 CHARGE=1 COLLISION_ENERGY=0.0 63.6348 2200.0 63.9463 2400.0 64.5945 2200.0 66.786 2400.0 67.0322 2300.0 69.0698 7900.0 69.0899 2600.0 69.1444 2500.0 71.0852 160000.0 71.3 2200.0 71.345 2400.0 72.3587 2100.0 72.7277 2600.0 73.0645 49000.0 73.422 2600.0 76.0934 2300.0 79.1692 2300.0 80.2882 2500.0 85.1009 120000.0 87.0437 81000.0 88.0928 2600.0 88.3301 2500.0 88.3511 2300.0 89.0593 1400000.0 89.9783 2500.0 97.101 6000.0 97.8307 2500.0 101.4848 2500.0 103.6006 2900.0 107.5557 2300.0 108.0143 2400.0 109.0457 2300.0 109.6088 2500.0 114.6372 2700.0 115.7412 2600.0 116.5263 2400.0 116.5791 2500.0 117.0905 19000.0 120.4111 2500.0 122.5455 2300.0 123.211 2800.0 125.8813 2200.0 126.7182 2500.0 128.0425 2700.0 133.0856 610000.0 133.0974 2900.0 141.242 2400.0 143.6237 2100.0 144.9481 2200.0 154.5387 2700.0 156.841 2200.0 157.3581 2700.0 158.1411 2400.0 158.8014 2500.0 163.9922 2400.0 166.5834 2300.0 166.677 2600.0 173.5217 4300.0 173.5311 180000.0 173.5413 32000.0 173.6781 2500.0 176.5156 2300.0 177.1122 110000.0 180.6423 3100.0 181.4204 2800.0 186.3326 2500.0 187.1971 2300.0 188.0613 2300.0 197.7936 2200.0 204.8513 2200.0 206.3274 2800.0 207.1715 2500.0 220.3831 2200.0 221.1389 2800.0 222.0249 2700.0 239.2774 2600.0 242.16 2500.0 252.9249 2500.0 267.7156 2800.0 269.0202 2600.0 278.3387 3300.0 289.8536 2300.0 295.1055 2300.0 295.2356 2200.0 300.8463 2200.0 314.4137 2400.0 329.3949 2700.0 353.7488 2600.0 362.3131 2700.0 369.4335 2300.0 371.0482 2300.0 384.9138 2300.0 411.4056 3100.0 459.6488 2600.0 493.6261 2800.0 516.465 2400.0 533.567 2500.0 END IONS BEGIN IONS SCANS=708 PEPMASS=583.4153 CHARGE=1 COLLISION_ENERGY=0.0 65.0384 2500.0 67.0539 21000.0 69.0333 3000.0 69.0695 25000.0 74.4058 2600.0 79.0538 18000.0 81.0695 60000.0 83.0489 15000.0 83.0853 16000.0 83.3739 2500.0 85.0644 15000.0 91.0538 27000.0 93.064 2600.0 93.0694 91000.0 94.223 2700.0 95.0489 7700.0 95.0794 3400.0 95.0851 95000.0 97.0647 7400.0 105.0695 79000.0 107.0785 3600.0 107.0851 96000.0 109.0646 14000.0 109.1008 55000.0 111.08 6200.0 113.0966 2500.0 117.0696 14000.0 119.0768 4100.0 119.0851 140000.0 121.0644 3100.0 121.1008 120000.0 123.08 30000.0 123.1164 18000.0 125.0594 10000.0 129.0698 14000.0 130.0767 2500.0 131.0852 64000.0 133.0643 2900.0 133.1007 88000.0 133.5215 2400.0 135.0802 23000.0 135.1165 31000.0 137.0957 31000.0 137.6161 2200.0 139.075 2900.0 142.0773 14000.0 143.0852 65000.0 144.093 10000.0 145.0907 2700.0 145.1008 120000.0 147.0801 49000.0 147.1165 47000.0 149.096 14000.0 149.1324 12000.0 151.0749 57000.0 153.0911 3600.0 155.0853 17000.0 156.0933 18000.0 157.1008 130000.0 158.1087 16000.0 159.0808 9200.0 159.1166 72000.0 161.096 15000.0 161.1323 27000.0 163.0749 4300.0 163.1114 26000.0 165.0908 180000.0 167.0856 10000.0 167.1064 26000.0 168.0937 3400.0 169.1011 56000.0 170.1094 11000.0 171.1167 91000.0 173.0961 7800.0 173.1324 73000.0 173.5268 67000.0 173.5449 14000.0 175.112 9000.0 175.1479 21000.0 177.0913 7400.0 179.0857 11000.0 180.0928 2400.0 181.1011 29000.0 181.1203 12000.0 182.1086 14000.0 183.1167 65000.0 184.1247 11000.0 185.1323 67000.0 187.1112 6300.0 187.1479 18000.0 189.1273 24000.0 190.0534 2200.0 191.1425 19000.0 193.1009 14000.0 194.1086 22000.0 195.1166 46000.0 195.1347 2700.0 196.1244 13000.0 196.6345 2400.0 197.1323 66000.0 199.148 46000.0 201.1289 3300.0 201.1634 6500.0 201.4132 3200.0 203.143 90000.0 205.1007 5600.0 205.1604 3300.0 206.1088 6100.0 207.1166 43000.0 207.1381 26000.0 208.1244 16000.0 209.1324 80000.0 210.1404 3700.0 211.1482 40000.0 212.1542 2400.0 213.1273 5900.0 213.1642 18000.0 215.1429 7100.0 217.1584 7600.0 219.1174 12000.0 220.1241 6800.0 221.081 3300.0 221.1322 34000.0 221.1537 200000.0 222.1409 4900.0 223.1481 49000.0 224.1562 7600.0 225.1644 13000.0 227.1423 5700.0 229.1584 8400.0 231.1751 8300.0 232.1248 3300.0 232.6207 2500.0 233.1321 22000.0 233.1555 10000.0 234.1403 8600.0 235.1482 37000.0 236.1559 5600.0 237.1639 27000.0 239.1798 10000.0 241.4748 2700.0 245.1324 11000.0 246.1405 10000.0 247.1481 25000.0 248.1553 8700.0 249.1635 30000.0 251.1797 19000.0 253.1956 14000.0 255.174 4200.0 257.1898 6600.0 259.1468 14000.0 260.1552 11000.0 261.1634 28000.0 262.1719 7000.0 263.1796 21000.0 265.1949 20000.0 269.1897 8300.0 271.2059 9200.0 273.1633 12000.0 274.171 3600.0 275.1796 31000.0 277.1956 14000.0 279.1743 3500.0 279.2102 8300.0 281.1897 7500.0 281.2956 93000.0 282.2796 350000.0 283.2067 20000.0 283.2827 380000.0 286.1954 6900.0 287.2024 16000.0 289.1946 14000.0 291.1762 3200.0 295.2059 18000.0 297.2222 18000.0 299.1774 2900.0 299.306 100000.0 300.3093 110000.0 301.1954 11000.0 303.3488 2500.0 305.6135 2500.0 306.3665 2400.0 307.2039 3200.0 309.2233 2800.0 311.1786 2900.0 313.1968 2900.0 315.2105 4100.0 316.3167 2800.0 327.5506 2600.0 329.227 6600.0 347.237 4100.0 349.2539 5900.0 357.2608 2900.0 365.2451 10000.0 375.268 16000.0 403.3002 32000.0 491.3516 3000.0 503.3516 19000.0 520.004 2700.0 538.538 2900.0 565.404 22000.0 583.4148 22000.0 END IONS BEGIN IONS SCANS=709 PEPMASS=600.4179 CHARGE=1 COLLISION_ENERGY=0.0 63.6405 5100.0 66.5057 5300.0 67.0542 94000.0 69.0334 100000.0 69.0698 86000.0 71.0491 23000.0 74.1419 4400.0 79.0542 110000.0 80.0619 6800.0 81.0698 310000.0 82.8982 5200.0 83.0491 160000.0 83.0855 81000.0 85.0647 55000.0 87.044 17000.0 89.0597 100000.0 91.0543 140000.0 92.6938 5100.0 93.0699 560000.0 95.0491 210000.0 95.0855 390000.0 95.8176 5400.0 96.9698 5600.0 97.0647 120000.0 97.1014 5100.0 99.0444 11000.0 103.0551 8100.0 105.0698 490000.0 105.0766 3900.0 106.0777 29000.0 107.049 33000.0 107.0855 610000.0 107.0923 4200.0 108.0568 5900.0 108.093 13000.0 109.0648 180000.0 109.1012 250000.0 111.0438 20000.0 111.0804 100000.0 113.0962 33000.0 117.0698 76000.0 118.74 4400.0 119.0491 14000.0 119.0855 730000.0 119.097 18000.0 120.0933 53000.0 120.1032 5400.0 121.0648 120000.0 121.0909 8700.0 121.1011 740000.0 122.0727 24000.0 122.1048 17000.0 123.0804 380000.0 123.1169 84000.0 124.0886 7200.0 125.0596 120000.0 125.0961 140000.0 128.0626 19000.0 129.0699 83000.0 130.0774 18000.0 130.5652 5600.0 131.0855 310000.0 132.093 48000.0 133.0647 96000.0 133.0862 59000.0 133.1012 550000.0 134.0727 6700.0 134.1083 26000.0 135.0688 7300.0 135.0804 330000.0 135.1168 270000.0 136.0876 6900.0 137.0598 50000.0 137.0961 200000.0 139.0751 85000.0 139.1117 55000.0 141.0703 23000.0 142.0777 56000.0 143.0856 440000.0 144.0932 170000.0 145.0651 17000.0 145.1012 770000.0 145.1143 11000.0 146.0732 14000.0 146.1082 50000.0 147.0673 11000.0 147.0805 440000.0 147.1168 230000.0 148.0881 36000.0 149.0961 260000.0 149.1326 46000.0 150.1036 27000.0 151.0754 400000.0 151.1119 59000.0 152.0824 32000.0 153.0911 66000.0 155.0855 83000.0 155.107 29000.0 156.0932 100000.0 157.086 19000.0 157.1012 930000.0 157.1166 5800.0 158.1088 180000.0 159.0806 160000.0 159.1169 600000.0 160.0884 64000.0 160.1224 25000.0 161.0962 410000.0 161.1326 190000.0 162.1032 47000.0 163.0757 32000.0 163.1118 420000.0 164.1187 5900.0 165.0776 6900.0 165.0912 1200000.0 165.1258 13000.0 166.0946 31000.0 167.0705 9300.0 167.0863 21000.0 167.1068 270000.0 167.1422 6500.0 168.0936 5900.0 168.1101 12000.0 169.1014 260000.0 170.1089 120000.0 171.081 44000.0 171.117 610000.0 171.13 3900.0 172.0881 16000.0 172.1245 220000.0 173.0963 190000.0 173.1125 5700.0 173.1149 24000.0 173.1328 330000.0 173.529 100000.0 173.5423 10000.0 174.1036 35000.0 174.1391 34000.0 175.112 380000.0 175.1483 130000.0 176.1193 31000.0 177.0912 91000.0 177.1277 120000.0 178.0987 45000.0 179.087 34000.0 179.1069 130000.0 179.1433 17000.0 180.0949 13000.0 180.1149 71000.0 181.0855 39000.0 181.1016 120000.0 181.1226 170000.0 182.1088 45000.0 183.117 350000.0 184.124 84000.0 185.0959 74000.0 185.1326 480000.0 186.1038 32000.0 186.1399 67000.0 187.1119 160000.0 187.1483 130000.0 188.1192 33000.0 189.0939 7200.0 189.1276 310000.0 190.1352 270000.0 191.1069 96000.0 191.143 120000.0 193.1012 94000.0 193.1225 220000.0 194.1088 53000.0 195.1169 300000.0 195.1379 51000.0 196.1243 73000.0 197.0963 71000.0 197.1135 18000.0 197.1326 410000.0 198.1039 46000.0 198.1396 58000.0 199.1119 170000.0 199.1483 190000.0 200.1191 30000.0 200.155 17000.0 201.0913 11000.0 201.1276 180000.0 201.1635 27000.0 202.1354 25000.0 203.1082 38000.0 203.1432 830000.0 203.1648 11000.0 204.1468 8400.0 205.1024 13000.0 205.1229 63000.0 205.1594 6600.0 206.1091 27000.0 207.1168 190000.0 207.1384 370000.0 208.1242 78000.0 208.1459 87000.0 209.0976 16000.0 209.1326 330000.0 209.154 61000.0 210.1036 7800.0 210.1399 76000.0 211.112 110000.0 211.1484 250000.0 212.1188 50000.0 212.1554 28000.0 213.1063 7500.0 213.1276 210000.0 213.1639 79000.0 214.1354 29000.0 215.1065 65000.0 215.1435 120000.0 216.1507 53000.0 217.1225 54000.0 217.1593 48000.0 218.1666 13000.0 219.1169 44000.0 219.1383 190000.0 220.1239 40000.0 220.1458 8500.0 221.1324 170000.0 221.1539 1300000.0 222.139 47000.0 222.1593 26000.0 223.1116 61000.0 223.1484 230000.0 224.1192 6900.0 224.1551 39000.0 225.1275 150000.0 225.164 170000.0 226.1334 18000.0 226.1701 6700.0 227.107 5600.0 227.1432 110000.0 227.1798 39000.0 228.1511 21000.0 229.1224 56000.0 229.159 93000.0 230.1293 35000.0 231.1383 61000.0 231.1737 11000.0 232.1237 26000.0 232.1463 13000.0 233.1319 64000.0 233.154 490000.0 234.1395 29000.0 234.1606 160000.0 235.1482 200000.0 235.1715 28000.0 236.1557 45000.0 237.1257 65000.0 237.1491 320000.0 238.1716 25000.0 239.1433 100000.0 239.1795 80000.0 240.1501 28000.0 241.1257 13000.0 241.1589 97000.0 242.1633 5400.0 243.1381 66000.0 243.1731 35000.0 245.1315 40000.0 245.1548 40000.0 246.139 48000.0 246.1632 28000.0 247.146 76000.0 247.1701 170000.0 248.1397 7700.0 248.1552 22000.0 249.13 29000.0 249.1637 170000.0 250.1615 5500.0 251.1432 68000.0 251.1795 90000.0 252.1513 13000.0 252.1875 14000.0 253.1587 170000.0 253.1899 26000.0 254.1672 7100.0 255.1431 29000.0 255.1743 420000.0 255.2036 3700.0 256.1818 9200.0 257.1539 44000.0 257.1892 38000.0 258.1647 6000.0 259.1459 50000.0 259.1697 88000.0 260.1532 17000.0 261.1633 210000.0 261.1874 19000.0 262.1706 28000.0 263.1418 36000.0 263.179 120000.0 264.151 6000.0 264.1857 13000.0 265.1586 72000.0 265.195 60000.0 266.1668 14000.0 267.142 7600.0 267.1743 99000.0 268.1814 62000.0 269.1545 41000.0 269.19 100000.0 270.1966 25000.0 271.1695 170000.0 272.1801 17000.0 273.1586 11000.0 273.1855 89000.0 274.1928 120000.0 275.1447 13000.0 275.1796 62000.0 276.1514 5400.0 276.1856 31000.0 277.1592 39000.0 277.195 80000.0 279.1747 190000.0 279.2074 8900.0 281.156 31000.0 281.1905 150000.0 282.197 27000.0 283.171 27000.0 283.205 22000.0 284.1806 5900.0 285.185 160000.0 286.1929 260000.0 287.201 190000.0 289.1944 64000.0 291.1741 49000.0 291.2106 39000.0 293.1909 51000.0 294.1979 76000.0 295.171 32000.0 295.2062 150000.0 296.1763 9100.0 297.1851 150000.0 298.1937 32000.0 299.2008 230000.0 300.2105 25000.0 301.1946 46000.0 303.1961 620000.0 305.19 32000.0 305.2264 18000.0 307.2064 55000.0 309.1847 58000.0 309.2218 39000.0 310.1934 64000.0 311.2002 72000.0 312.2085 74000.0 313.216 150000.0 315.2106 26000.0 317.1899 21000.0 317.2274 6900.0 319.2059 110000.0 320.2122 6500.0 321.2219 32000.0 322.2293 40000.0 323.2004 27000.0 325.2164 190000.0 329.1885 6400.0 329.2275 25000.0 331.2047 23000.0 332.2133 6200.0 333.2221 32000.0 334.2317 13000.0 335.2009 14000.0 335.2392 6300.0 337.2163 350000.0 339.2324 27000.0 341.226 28000.0 345.2204 20000.0 347.2373 55000.0 349.2163 31000.0 350.2239 7300.0 351.2311 39000.0 352.1898 23000.0 352.2396 810000.0 352.2787 6200.0 353.2475 17000.0 359.2365 35000.0 362.2248 5800.0 363.2317 40000.0 365.2472 350000.0 369.259 6300.0 373.2585 6000.0 375.1802 6000.0 377.247 68000.0 378.2533 9300.0 379.2638 10000.0 381.2444 23000.0 383.2573 9000.0 387.27 26000.0 391.261 15000.0 399.2536 16000.0 401.2793 6000.0 405.2769 28000.0 419.2941 29000.0 420.3005 19000.0 421.2749 16000.0 437.3053 28000.0 439.2842 19000.0 469.3087 44000.0 487.3196 190000.0 493.3284 14000.0 502.3434 45000.0 503.3509 230000.0 505.3302 130000.0 507.3446 56000.0 508.3493 32000.0 520.3526 85000.0 567.3779 23000.0 583.4082 6700.0 585.3911 34000.0 600.409 17000.0 END IONS BEGIN IONS SCANS=710 PEPMASS=468.3901 CHARGE=1 COLLISION_ENERGY=0.0 57.0696 260000.0 58.0328 2500.0 59.0522 2100.0 62.0598 37000.0 62.3853 2100.0 62.4616 2200.0 64.7231 2400.0 65.7747 2400.0 65.8992 2300.0 69.0696 6800.0 69.2175 2600.0 70.2588 2200.0 70.4875 2500.0 70.6423 2500.0 71.0816 2700.0 71.0852 240000.0 71.6913 2400.0 72.7068 2500.0 72.9276 2300.0 73.0285 3100.0 73.0645 53000.0 74.179 2500.0 74.2247 2600.0 74.4437 2300.0 75.4227 2500.0 75.5181 2500.0 75.7171 2600.0 76.8783 3000.0 78.819 2300.0 81.0693 3000.0 81.8885 2200.0 82.4723 2100.0 83.0853 11000.0 84.0803 2700.0 85.0736 2200.0 85.1009 160000.0 85.5361 2400.0 87.0437 49000.0 89.0593 2200000.0 89.0652 3000.0 89.6243 2500.0 89.9627 2600.0 92.239 2600.0 93.7001 2300.0 95.0998 2500.0 97.101 14000.0 102.0912 46000.0 102.6038 2400.0 103.0772 2300.0 108.9409 2300.0 109.3227 2300.0 109.8004 2100.0 110.5479 2200.0 114.6219 2500.0 117.0906 6600.0 123.1158 2500.0 127.502 2300.0 130.0225 2400.0 131.0564 2800.0 133.0757 2300.0 133.0856 840000.0 133.3194 2500.0 140.3823 2500.0 153.6902 2400.0 154.6106 2200.0 165.8545 2300.0 166.8971 2800.0 167.4249 3400.0 173.5264 170000.0 173.5407 130000.0 174.0763 2100.0 177.112 120000.0 180.9183 2300.0 181.9723 2900.0 194.9673 2600.0 195.1227 20000.0 198.1596 2300.0 198.6374 2700.0 201.6724 2500.0 204.2524 2300.0 209.4137 2600.0 214.0156 2800.0 215.0929 2700.0 219.3402 2600.0 223.6161 3000.0 224.8169 2200.0 224.9581 2600.0 235.7531 2500.0 236.9223 2400.0 238.6338 2400.0 239.149 17000.0 252.2968 2300.0 263.0527 2500.0 273.8805 2300.0 278.0719 2800.0 283.1753 30000.0 293.5317 2300.0 301.5775 3000.0 303.2363 2600.0 309.9779 2300.0 311.2947 110000.0 324.871 2500.0 328.3196 7900.0 345.5169 2600.0 348.2979 2500.0 358.9326 2400.0 368.3524 230000.0 370.1462 3000.0 398.6151 2600.0 451.2588 2700.0 454.3332 2400.0 468.4413 26000.0 END IONS BEGIN IONS SCANS=711 PEPMASS=607.2559 CHARGE=1 COLLISION_ENERGY=0.0 64.3611 26000.0 64.3641 7500.0 67.4716 43000.0 67.475 13000.0 71.9271 2200.0 74.416 2200.0 75.2569 2000.0 77.4665 2200.0 80.1174 2400.0 84.2249 3600.0 92.4907 2400.0 103.2732 2800.0 114.8313 2400.0 125.1089 4200.0 136.8027 17000.0 136.8143 16000.0 149.043 2400.0 154.4131 2800.0 156.8804 3900.0 162.5833 2300.0 173.5259 56000.0 173.5358 49000.0 173.5439 16000.0 184.8444 3700.0 195.0664 2600.0 208.4838 2600.0 228.4022 2200.0 230.9463 2300.0 246.6128 2600.0 273.1955 2600.0 309.7601 3100.0 327.6839 2700.0 364.68 2500.0 395.6231 2900.0 417.1686 9000.0 418.2251 4300.0 419.2244 38000.0 420.428 2400.0 431.1875 20000.0 432.1933 14000.0 433.2027 27000.0 445.2023 43000.0 446.2102 99000.0 446.2711 5000.0 447.2183 180000.0 448.2288 9800.0 454.083 2500.0 459.2186 24000.0 460.1895 3500.0 461.1962 23000.0 462.2416 12000.0 463.2486 35000.0 473.1988 46000.0 473.2387 3700.0 474.2055 280000.0 475.2132 440000.0 476.2163 11000.0 477.2351 4000.0 478.234 18000.0 487.2126 110000.0 488.2208 22000.0 489.2231 4300.0 490.2366 59000.0 491.2409 55000.0 501.2286 120000.0 502.2319 9200.0 503.2428 38000.0 504.2177 9600.0 505.2243 34000.0 506.2316 60000.0 517.2245 27000.0 518.2309 23000.0 519.1447 5000.0 519.2391 1100000.0 529.2236 57000.0 532.2124 32000.0 533.255 19000.0 534.2234 9100.0 545.2162 4700.0 546.2419 2700.0 546.9254 6600.0 546.9811 11000.0 547.0379 60000.0 547.0774 51000.0 547.2341 8400000.0 547.4331 55000.0 548.2369 38000.0 550.2233 9300.0 551.2647 42000.0 561.2501 190000.0 564.2317 7800.0 575.2308 33000.0 576.4371 2900.0 578.2514 8000.0 579.1527 3300.0 579.2608 910000.0 579.3668 9300.0 589.2459 120000.0 607.1672 4200.0 607.2555 1400000.0 END IONS BEGIN IONS SCANS=712 PEPMASS=653.2975 CHARGE=1 COLLISION_ENERGY=0.0 76.0693 2200.0 77.0893 2200.0 82.1199 2300.0 82.3096 2600.0 83.0421 2200.0 83.2445 2800.0 84.0867 2300.0 84.2879 2500.0 87.4587 2600.0 89.3597 2400.0 91.2201 2200.0 95.087 2500.0 102.7197 2400.0 102.9787 2400.0 109.2208 2800.0 111.1118 2700.0 121.456 2900.0 129.0442 2400.0 134.0598 24000.0 150.3756 2800.0 159.4981 2900.0 161.99 2200.0 166.0853 2800.0 173.5228 21000.0 173.5354 110000.0 181.2847 2700.0 184.3219 2400.0 195.4821 2600.0 201.8114 2700.0 204.0649 17000.0 210.9771 2700.0 226.1472 3200.0 237.1384 8500.0 238.1463 13000.0 239.1542 9200.0 240.1625 3700.0 251.1544 9500.0 252.1627 3300.0 253.17 8300.0 263.791 3100.0 279.1497 48000.0 287.9718 2400.0 307.1068 5900.0 313.1177 8600.0 337.1091 2400.0 338.5232 2600.0 339.1328 19000.0 351.133 3400.0 361.7596 2600.0 375.1013 2400.0 410.2119 6100.0 414.9865 2400.0 430.174 2900.0 440.1616 3200.0 446.205 3400.0 450.206 2900.0 451.215 15000.0 457.2404 2600.0 458.2235 2800.0 460.1919 2600.0 468.2149 6900.0 477.1971 3600.0 478.1962 8600.0 478.2097 2800.0 479.2068 12000.0 482.2308 26000.0 483.2392 42000.0 486.2019 67000.0 487.2121 13000.0 488.2179 20000.0 505.2253 11000.0 508.2613 12000.0 509.2437 3400.0 509.2564 3900.0 510.2569 19000.0 515.2073 6100.0 516.01 2700.0 519.2381 4300.0 520.242 2800.0 523.2698 250000.0 529.2233 17000.0 533.2327 4000.0 533.2519 20000.0 534.2294 12000.0 535.2696 19000.0 536.2502 17000.0 537.2373 6600.0 540.2843 8800.0 547.2394 12000.0 549.2853 8200.0 550.2595 8100.0 551.2651 480000.0 552.2522 6000.0 555.2913 7200.0 561.2493 34000.0 564.2381 3200.0 565.2801 150000.0 568.2692 8000.0 575.2653 300000.0 577.2837 2700.0 578.2528 12000.0 579.2605 370000.0 580.269 14000.0 582.2803 9100.0 583.1832 5300.0 583.2915 540000.0 583.4 5100.0 593.2749 120000.0 594.2662 3900.0 603.2619 30000.0 607.2861 10000.0 609.3076 8600.0 610.2779 48000.0 611.2868 300000.0 621.2706 50000.0 625.3009 40000.0 635.2859 39000.0 638.2725 9400.0 649.6039 2600.0 653.296 25000.0 END IONS BEGIN IONS SCANS=713 PEPMASS=424.364 CHARGE=1 COLLISION_ENERGY=0.0 55.7953 2500.0 57.0696 310000.0 59.0486 3200.0 59.8956 2400.0 60.4035 2400.0 60.7397 2400.0 61.3202 2400.0 62.936 2200.0 65.0957 2400.0 65.4826 2300.0 69.0697 18000.0 69.262 2200.0 71.0852 250000.0 71.9534 2100.0 73.0645 37000.0 73.4462 4700.0 74.001 2300.0 75.5493 2200.0 76.2727 2200.0 78.9262 2100.0 80.2393 2100.0 82.3638 2600.0 82.7455 2400.0 83.0849 2900.0 83.2562 2600.0 83.894 2200.0 84.067 2100.0 85.0055 2400.0 85.1008 160000.0 87.0439 25000.0 87.5275 2300.0 87.7186 2200.0 89.0593 1900000.0 89.0652 2300.0 89.7566 2200.0 91.4911 2600.0 92.0531 2400.0 92.2726 2200.0 93.8517 2600.0 97.101 10000.0 100.0339 2500.0 100.8004 2400.0 101.3494 2400.0 104.338 2300.0 105.2651 2100.0 107.0697 5600.0 107.2876 2400.0 108.6317 2700.0 109.5739 2900.0 113.3729 2500.0 113.5195 2300.0 114.6738 2300.0 116.9388 2600.0 117.0906 2500.0 128.0866 2600.0 129.2242 2300.0 129.8001 3000.0 131.4767 2300.0 133.0747 11000.0 133.0856 750000.0 134.2226 2600.0 134.4502 2400.0 134.5662 2600.0 139.4966 2400.0 148.5542 2700.0 149.2584 2200.0 149.6876 5300.0 151.0964 34000.0 162.7305 2400.0 173.5296 160000.0 173.5432 18000.0 177.1121 66000.0 185.1848 2400.0 187.6159 2400.0 193.9125 2700.0 195.1225 39000.0 215.4473 2700.0 222.3839 2500.0 224.7673 2200.0 239.149 64000.0 240.0478 2800.0 273.3854 2200.0 283.7198 2500.0 284.5 2400.0 288.2279 3000.0 306.1639 2600.0 331.0921 2400.0 339.8968 2200.0 343.9305 2200.0 347.4132 2400.0 348.3145 3000.0 356.5352 2300.0 367.9304 2300.0 432.3266 2700.0 END IONS BEGIN IONS SCANS=714 PEPMASS=319.2849 CHARGE=1 COLLISION_ENERGY=0.0 54.1069 2400.0 55.054 2900.0 57.0697 300000.0 62.036 2300.0 63.0374 2300.0 65.1104 2200.0 67.6831 2400.0 67.901 2400.0 68.1747 2300.0 69.0697 5100.0 69.8797 2300.0 71.0853 160000.0 75.4571 2300.0 79.4103 2300.0 79.4347 2400.0 80.0895 2600.0 80.8406 2300.0 81.6891 2400.0 85.1008 76000.0 87.8677 2600.0 88.0759 2200.0 89.0594 340000.0 90.8797 2200.0 92.744 2900.0 94.9806 3100.0 100.7297 2600.0 103.2767 2400.0 108.2675 2400.0 115.3032 2600.0 116.8409 2400.0 122.3748 2300.0 123.4285 2900.0 131.5413 2200.0 133.5394 2200.0 136.0749 2500.0 139.6272 2300.0 172.8231 2200.0 173.5255 100000.0 173.5425 42000.0 174.6275 2600.0 180.2696 2400.0 190.0627 8500.0 191.066 22000.0 194.0894 10000.0 194.4836 2400.0 205.8562 2200.0 207.0612 8600.0 208.2703 2400.0 216.5015 2400.0 220.7884 2300.0 221.0814 24000.0 222.0842 67000.0 244.8355 2400.0 255.5582 2300.0 260.2122 2500.0 270.0915 2500.0 274.8164 2600.0 278.077 2500.0 290.5421 3100.0 308.5375 2400.0 END IONS BEGIN IONS SCANS=715 PEPMASS=625.2663 CHARGE=1 COLLISION_ENERGY=0.0 66.5039 3000.0 66.673 2300.0 67.3116 2200.0 72.1695 2300.0 73.0652 2900.0 73.7209 2300.0 73.7611 2600.0 87.3468 2200.0 89.9528 2100.0 95.3693 2300.0 111.7332 2200.0 121.6679 2200.0 127.2373 2700.0 129.8671 2300.0 148.0946 2200.0 149.6843 5100.0 149.7054 3300.0 161.0788 2500.0 173.5226 9700.0 173.5323 6800.0 173.5412 17000.0 237.4437 2300.0 298.7013 2400.0 405.2082 8900.0 420.1664 5600.0 420.2314 340000.0 421.2391 5100.0 424.2231 10000.0 430.454 2200.0 433.2404 18000.0 434.2475 36000.0 448.2265 47000.0 449.2339 88000.0 451.211 7300.0 452.2213 120000.0 459.219 54000.0 460.2261 150000.0 460.2951 4100.0 461.2374 3300.0 462.2058 42000.0 463.2123 21000.0 465.2289 72000.0 475.2138 140000.0 476.2214 64000.0 477.2291 430000.0 478.2379 3800.0 479.2445 9000.0 487.2146 7300.0 488.218 5100.0 489.229 7800.0 491.2117 8700.0 491.2407 8800.0 492.2522 160000.0 493.2562 36000.0 499.5382 2900.0 501.2288 5300.0 502.2329 8500.0 503.2434 82000.0 504.2476 10000.0 509.2175 11000.0 518.2319 52000.0 520.2147 3200.0 521.2213 230000.0 523.2339 34000.0 524.2351 2500.0 533.2183 29000.0 534.2268 7900.0 535.2344 110000.0 536.2421 150000.0 537.2497 17000.0 538.2569 18000.0 547.2343 37000.0 548.2416 11000.0 549.2505 71000.0 563.2659 20000.0 565.246 43000.0 579.251 3200.0 593.2402 24000.0 607.2534 3400.0 608.2639 45000.0 END IONS BEGIN IONS SCANS=716 PEPMASS=393.279 CHARGE=1 COLLISION_ENERGY=0.0 53.0269 2200.0 55.054 35000.0 55.0569 2100.0 56.8319 2200.0 57.0697 26000.0 61.4269 2200.0 61.7956 2300.0 62.2221 2500.0 65.3934 2300.0 66.176 2400.0 66.3937 2600.0 67.0539 49000.0 67.0575 2200.0 67.4876 2200.0 68.5703 2300.0 69.0695 53000.0 69.4584 2500.0 70.6887 2100.0 71.0354 2300.0 74.881 2400.0 78.0494 2200.0 78.7835 2600.0 79.0497 2300.0 79.0539 61000.0 80.0894 2200.0 81.0696 130000.0 83.0488 10000.0 83.0853 19000.0 84.6558 2300.0 85.0645 5700.0 86.8607 2300.0 88.6689 2400.0 89.0592 3000.0 91.0539 59000.0 93.0639 4100.0 93.0693 200000.0 95.0488 120000.0 95.0852 130000.0 96.1417 2300.0 97.0644 21000.0 103.2822 2200.0 105.063 2500.0 105.0695 160000.0 105.97 2200.0 107.0784 2900.0 107.0851 140000.0 109.0644 34000.0 109.1008 71000.0 115.0544 2900.0 117.0695 35000.0 117.9651 2400.0 119.0769 3500.0 119.0852 220000.0 121.0645 61000.0 121.1008 98000.0 123.0802 6700.0 123.1165 25000.0 128.062 5100.0 129.0694 15000.0 130.0777 7100.0 131.0852 94000.0 131.3699 2300.0 133.1008 140000.0 135.0805 15000.0 135.1164 45000.0 137.0961 2500.0 141.0698 2500.0 142.0773 33000.0 143.0852 76000.0 144.0929 16000.0 145.0656 2700.0 145.1008 190000.0 146.1056 10000.0 147.0802 7500.0 147.1164 56000.0 149.0228 11000.0 149.0951 3600.0 149.1327 2700.0 149.6879 5700.0 150.0262 3400.0 151.0276 4100.0 155.0853 22000.0 156.0927 20000.0 157.1008 120000.0 158.1079 15000.0 159.0805 6900.0 159.1165 130000.0 160.1213 6000.0 161.0957 46000.0 161.1323 19000.0 164.9934 2400.0 167.0854 5500.0 168.0929 6000.0 169.1011 48000.0 170.108 14000.0 171.1167 64000.0 172.1239 11000.0 173.0964 2700.0 173.1325 64000.0 173.5266 27000.0 173.5364 29000.0 175.1479 30000.0 175.4601 2400.0 179.0854 5400.0 181.101 18000.0 182.1084 2800.0 183.1167 43000.0 184.1236 6800.0 185.1325 30000.0 187.1483 16000.0 188.5358 2600.0 193.1012 7300.0 194.1084 3200.0 195.1168 26000.0 196.1239 9400.0 197.1323 43000.0 198.1385 3000.0 199.1475 17000.0 200.154 2700.0 201.1636 3900.0 207.1158 6300.0 209.1324 29000.0 210.1406 3300.0 211.1479 22000.0 213.1635 2900.0 221.1336 3100.0 223.0665 2600.0 223.1473 9800.0 225.1625 2900.0 235.1498 3100.0 237.164 3800.0 240.3939 2400.0 251.1804 2900.0 253.9305 2100.0 290.3325 3100.0 293.6641 2400.0 299.9688 2400.0 322.2513 2500.0 357.6625 2500.0 373.1754 2400.0 389.9727 2500.0 END IONS BEGIN IONS SCANS=717 PEPMASS=669.2923 CHARGE=1 COLLISION_ENERGY=0.0 66.5852 20000.0 67.6957 50000.0 67.6989 10000.0 69.3308 2300.0 69.696 13000.0 69.6995 2700.0 70.6499 2400.0 73.9054 2400.0 96.4643 2100.0 101.8061 2100.0 103.5361 2200.0 105.0739 2400.0 118.0549 2300.0 135.9486 2400.0 147.5027 2700.0 150.1962 2300.0 162.7768 2400.0 169.0732 2400.0 173.5258 56000.0 173.5421 39000.0 181.7703 2600.0 183.2104 2500.0 201.5503 2300.0 225.1379 12000.0 237.1375 2800.0 238.1462 16000.0 239.1543 11000.0 251.1539 18000.0 252.164 2700.0 253.1694 88000.0 261.1386 26000.0 266.7027 2400.0 267.1497 12000.0 275.8778 2900.0 279.1494 48000.0 280.1565 15000.0 287.0628 2700.0 333.1451 3600.0 375.1179 2500.0 411.2188 6000.0 420.1939 3000.0 421.2035 2600.0 422.2038 2400.0 422.2099 6200.0 435.1824 5000.0 438.2087 11000.0 439.2137 8900.0 440.2218 12000.0 442.2416 2800.0 446.1725 2600.0 448.1924 16000.0 449.1966 19000.0 450.2048 24000.0 452.2191 2900.0 458.2415 12000.0 465.1933 36000.0 466.1979 5400.0 475.2009 2500.0 476.1858 38000.0 479.2034 5900.0 480.217 23000.0 481.2228 4500.0 482.2555 2500.0 483.2015 10000.0 483.2774 17000.0 490.2014 3600.0 493.2243 20000.0 494.1882 3200.0 494.2474 3300.0 496.2503 18000.0 497.2215 3100.0 497.2589 2800.0 498.2238 32000.0 503.2074 3200.0 507.2357 2700.0 508.2109 160000.0 509.2209 2900.0 511.2014 6900.0 511.2691 120000.0 512.2829 3000.0 521.2518 59000.0 522.2488 15000.0 523.2666 31000.0 524.2441 33000.0 525.2485 14000.0 526.2223 34000.0 528.2739 44000.0 534.2309 5700.0 535.2327 17000.0 538.2618 11000.0 539.1285 3100.0 539.2651 440000.0 540.2692 7900.0 543.2963 380000.0 549.2493 110000.0 550.2443 27000.0 551.2647 20000.0 552.2358 11000.0 553.2586 31000.0 554.2656 4100.0 555.2967 61000.0 556.271 44000.0 566.2527 27000.0 567.2602 320000.0 571.2901 240000.0 577.2449 110000.0 578.2316 4900.0 580.2258 6400.0 580.2383 9400.0 581.266 270000.0 582.2625 26000.0 583.2898 29000.0 584.2635 68000.0 591.2626 3500.0 594.2414 9100.0 595.2559 120000.0 599.2865 580000.0 600.6401 2900.0 609.2711 1500000.0 610.274 3800.0 612.2597 24000.0 627.282 330000.0 636.2854 3600.0 END IONS BEGIN IONS SCANS=718 PEPMASS=691.2741 CHARGE=1 COLLISION_ENERGY=0.0 67.6961 26000.0 67.6985 7500.0 70.1381 38000.0 70.1414 9400.0 71.8753 2700.0 86.5764 2400.0 100.5314 2300.0 100.9432 2400.0 104.5292 2300.0 109.6252 2100.0 111.4333 2500.0 114.6796 2900.0 117.4379 2200.0 123.9184 2400.0 124.2613 2500.0 124.2836 2300.0 141.2001 2200.0 173.5337 93000.0 197.7307 2900.0 207.4918 2300.0 273.6088 2300.0 278.8765 2400.0 344.0521 2800.0 382.9576 2400.0 397.6734 2500.0 410.5779 2500.0 423.9503 2600.0 439.6412 2700.0 449.1934 5200.0 465.1905 9900.0 472.1856 21000.0 476.1845 11000.0 498.1662 2600.0 499.175 19000.0 508.2103 71000.0 512.1799 2500.0 527.2053 48000.0 530.1928 21000.0 531.2001 31000.0 548.2773 2700.0 549.2491 29000.0 550.2568 4400.0 559.2305 3300.0 572.2218 6500.0 577.2442 25000.0 581.2611 90000.0 599.2265 18000.0 609.2706 870000.0 631.2524 1200000.0 690.1907 2700.0 691.3876 12000.0 END IONS BEGIN IONS SCANS=719 PEPMASS=583.4151 CHARGE=1 COLLISION_ENERGY=0.0 63.3567 2400.0 67.054 32000.0 69.0333 9700.0 69.0695 34000.0 69.4991 2400.0 72.1431 2600.0 73.1348 2200.0 79.001 2200.0 79.0539 33000.0 81.0696 72000.0 83.0489 18000.0 83.0854 21000.0 85.0646 16000.0 91.054 34000.0 93.0697 120000.0 95.0489 21000.0 95.085 110000.0 96.1733 2400.0 97.0648 12000.0 103.0544 4100.0 105.0694 120000.0 105.0771 3200.0 106.991 2500.0 107.0853 120000.0 109.0644 21000.0 109.1009 67000.0 111.0803 9100.0 117.0696 22000.0 119.0854 200000.0 121.0642 10000.0 121.0913 2700.0 121.101 160000.0 121.7801 2400.0 123.0803 42000.0 123.1164 21000.0 125.0595 15000.0 125.0957 11000.0 128.0618 7700.0 129.0699 21000.0 131.0854 80000.0 133.101 120000.0 135.0804 26000.0 135.1167 43000.0 135.4908 2400.0 137.0959 36000.0 139.0752 3000.0 139.1114 7900.0 141.0712 4500.0 142.0777 24000.0 143.0854 83000.0 144.0936 5900.0 145.0889 4200.0 145.1011 160000.0 145.1139 2600.0 147.0802 52000.0 147.1168 56000.0 149.0958 24000.0 149.1326 14000.0 151.0752 78000.0 155.0857 23000.0 156.0934 22000.0 157.088 3800.0 157.1011 180000.0 158.1088 24000.0 159.1169 98000.0 161.096 19000.0 161.1324 34000.0 163.1118 33000.0 165.0756 3100.0 165.091 230000.0 165.1062 5100.0 167.0865 10000.0 167.1067 46000.0 168.0937 8700.0 169.1012 71000.0 170.1092 17000.0 171.1168 120000.0 172.1251 2800.0 173.0966 11000.0 173.1184 3100.0 173.1326 100000.0 173.5257 54000.0 173.5433 23000.0 175.1114 9900.0 175.1481 31000.0 175.8504 2400.0 177.0907 2600.0 177.1273 10000.0 179.0856 16000.0 180.0941 3600.0 181.1013 37000.0 181.1208 14000.0 182.1085 13000.0 183.117 91000.0 184.1246 17000.0 185.1326 91000.0 185.6671 2400.0 186.1388 2600.0 187.1115 8100.0 187.1485 32000.0 189.1278 32000.0 189.1646 2600.0 191.1082 3600.0 191.1431 31000.0 193.1012 25000.0 194.1093 27000.0 195.117 76000.0 196.1245 21000.0 197.1326 85000.0 198.1413 4100.0 199.1113 7900.0 199.1482 70000.0 200.851 2400.0 201.128 6500.0 201.1642 5000.0 203.1433 110000.0 205.1026 2600.0 206.1088 9300.0 207.1168 55000.0 207.1382 34000.0 208.1243 20000.0 209.1327 110000.0 209.1542 4800.0 210.1404 18000.0 211.1124 2600.0 211.1484 52000.0 213.1282 5000.0 213.1646 21000.0 215.1427 13000.0 217.1592 16000.0 218.109 3300.0 219.1175 17000.0 220.125 12000.0 221.1321 47000.0 221.1541 260000.0 222.1402 16000.0 223.1483 59000.0 224.1572 4700.0 225.1274 6700.0 225.1639 22000.0 227.1424 4000.0 227.1804 7400.0 229.1594 5000.0 231.1166 6100.0 231.175 13000.0 232.125 4800.0 233.1325 27000.0 233.155 14000.0 234.1409 8100.0 235.1481 48000.0 235.1707 2400.0 236.1559 9300.0 237.1641 33000.0 239.1445 6900.0 239.1797 20000.0 241.1595 3700.0 243.1158 2700.0 243.175 6100.0 244.124 2800.0 245.1324 21000.0 246.1399 17000.0 247.1481 33000.0 248.1559 13000.0 249.1641 34000.0 250.1709 13000.0 251.1437 2900.0 251.1796 25000.0 253.1599 3300.0 253.195 14000.0 257.1903 16000.0 258.14 3200.0 259.1481 20000.0 260.1559 19000.0 261.1636 42000.0 263.1799 24000.0 265.1658 2800.0 265.1953 28000.0 267.1749 7300.0 268.7911 2600.0 269.1897 17000.0 271.2058 13000.0 273.1635 16000.0 274.1717 6700.0 275.18 39000.0 277.1949 20000.0 279.1739 2700.0 279.2108 11000.0 281.1916 15000.0 281.2955 110000.0 282.2798 360000.0 283.2061 27000.0 283.2829 380000.0 286.1951 7100.0 287.1752 6600.0 287.2065 4500.0 289.1957 19000.0 290.2045 3800.0 291.2111 10000.0 293.1906 3300.0 295.206 25000.0 297.2234 18000.0 297.6292 2600.0 299.2014 3100.0 299.3062 100000.0 300.3095 120000.0 301.1959 11000.0 303.213 3400.0 307.2065 9000.0 314.2045 2600.0 315.2121 8300.0 316.2202 3900.0 317.2284 3400.0 329.2269 6700.0 331.2457 3500.0 333.2256 3500.0 341.229 2800.0 347.238 3600.0 348.2452 3900.0 349.2556 4800.0 352.239 5300.0 357.2585 3800.0 361.2498 4100.0 365.2448 5300.0 375.2689 19000.0 403.3004 36000.0 403.6674 2900.0 470.0737 2600.0 501.7298 2500.0 503.3526 23000.0 509.3402 6800.0 565.4055 22000.0 583.4171 33000.0 END IONS BEGIN IONS SCANS=720 PEPMASS=600.4178 CHARGE=1 COLLISION_ENERGY=0.0 65.019 4300.0 67.0541 120000.0 69.0334 130000.0 69.0698 110000.0 69.876 3200.0 70.6781 4600.0 71.0492 30000.0 71.1022 7400.0 72.4972 3600.0 77.0388 4400.0 77.6639 5200.0 79.0542 160000.0 81.0698 370000.0 83.049 190000.0 83.0854 130000.0 85.0646 81000.0 87.044 26000.0 89.0596 130000.0 91.0542 160000.0 92.0623 4400.0 93.063 8100.0 93.0698 640000.0 94.0777 6100.0 95.0491 240000.0 95.0854 490000.0 97.0647 150000.0 97.1011 11000.0 98.0677 5400.0 99.0804 11000.0 100.17 5700.0 103.0535 3500.0 103.3443 6500.0 105.0455 6600.0 105.0698 580000.0 106.0777 19000.0 107.0492 39000.0 107.0772 21000.0 107.0854 750000.0 107.0922 4800.0 108.089 7700.0 109.0647 240000.0 109.1011 320000.0 111.0438 25000.0 111.0804 110000.0 113.0962 46000.0 115.0542 4600.0 117.0697 85000.0 118.0767 6600.0 119.049 6300.0 119.0757 8500.0 119.0854 870000.0 120.0931 68000.0 120.7783 5300.0 121.0647 140000.0 121.091 16000.0 121.101 860000.0 121.1085 5800.0 122.0722 19000.0 122.1042 16000.0 123.0432 5800.0 123.0803 480000.0 123.1166 110000.0 123.1254 3700.0 125.0595 140000.0 125.096 190000.0 128.0623 40000.0 129.0697 110000.0 130.0777 25000.0 131.0854 370000.0 132.093 74000.0 133.0648 120000.0 133.0854 12000.0 133.0865 61000.0 133.1011 700000.0 133.1126 5900.0 134.1089 38000.0 134.6141 6000.0 135.07 11000.0 135.0803 380000.0 135.1167 330000.0 136.0885 21000.0 137.0596 62000.0 137.096 250000.0 138.1014 8200.0 139.0752 90000.0 139.1116 66000.0 141.0702 14000.0 142.0778 79000.0 143.0854 510000.0 144.0931 200000.0 145.0649 36000.0 145.1011 910000.0 145.1143 9500.0 146.0722 7400.0 146.1082 72000.0 147.0803 520000.0 147.1167 280000.0 148.0879 40000.0 149.096 310000.0 149.1322 54000.0 150.1036 29000.0 151.0753 480000.0 151.089 9200.0 151.1117 66000.0 152.0817 32000.0 153.07 7700.0 153.091 69000.0 155.0853 110000.0 155.1065 23000.0 156.0931 120000.0 157.0647 5800.0 157.0861 26000.0 157.1011 1200000.0 157.1147 16000.0 158.1086 200000.0 159.0803 220000.0 159.1168 750000.0 160.0878 120000.0 160.1232 44000.0 161.0961 510000.0 161.1325 210000.0 162.1034 55000.0 163.0756 33000.0 163.1117 530000.0 163.1471 9300.0 164.1182 20000.0 165.0911 1400000.0 165.1248 7400.0 166.095 37000.0 167.0709 7100.0 167.0864 6100.0 167.0865 36000.0 167.1067 340000.0 168.0933 12000.0 168.1095 16000.0 169.1013 310000.0 170.1087 140000.0 171.0809 62000.0 171.1001 13000.0 171.1169 720000.0 171.1305 6400.0 172.0886 27000.0 172.1243 230000.0 173.0963 230000.0 173.1326 400000.0 173.5211 14000.0 173.5308 170000.0 173.5417 51000.0 174.1035 35000.0 174.1386 28000.0 175.1119 460000.0 175.1483 150000.0 176.1194 26000.0 177.0909 97000.0 177.1276 150000.0 178.0986 44000.0 179.0865 47000.0 179.1066 160000.0 179.1228 8600.0 179.143 19000.0 180.0951 23000.0 180.1142 93000.0 181.0851 46000.0 181.1014 150000.0 181.1223 190000.0 182.109 70000.0 183.1168 430000.0 184.1239 110000.0 185.0959 89000.0 185.1326 610000.0 185.1515 8400.0 186.1038 39000.0 186.1401 86000.0 187.1117 210000.0 187.1483 160000.0 188.1197 42000.0 189.0915 7100.0 189.1275 350000.0 190.1351 300000.0 191.1066 110000.0 191.1431 140000.0 193.1011 96000.0 193.1223 280000.0 194.1091 55000.0 195.1168 370000.0 195.1378 65000.0 196.1242 93000.0 197.0965 72000.0 197.1154 18000.0 197.1326 460000.0 198.104 43000.0 198.1392 81000.0 199.1119 180000.0 199.1482 230000.0 200.1193 34000.0 200.1546 39000.0 201.1275 210000.0 201.1637 47000.0 202.1337 15000.0 203.1094 20000.0 203.1261 6400.0 203.1431 930000.0 204.1483 23000.0 205.1022 19000.0 205.1224 72000.0 205.1599 3900.0 206.1094 41000.0 207.1167 220000.0 207.1382 420000.0 208.1239 95000.0 208.1454 110000.0 209.0969 27000.0 209.1325 410000.0 209.154 74000.0 210.104 13000.0 210.1395 110000.0 211.112 130000.0 211.1484 340000.0 212.1196 61000.0 212.1547 43000.0 213.1275 240000.0 213.1638 96000.0 214.1352 41000.0 215.1068 70000.0 215.1431 140000.0 216.1505 59000.0 217.1224 63000.0 217.159 59000.0 218.1297 14000.0 219.1164 53000.0 219.1382 200000.0 220.1244 45000.0 220.1468 10000.0 221.1322 190000.0 221.1537 1500000.0 222.1394 62000.0 222.1597 41000.0 223.1116 59000.0 223.1483 290000.0 224.1192 20000.0 224.1551 52000.0 225.1274 170000.0 225.164 230000.0 226.1338 22000.0 226.1695 19000.0 227.1434 130000.0 227.1793 55000.0 228.1497 9800.0 229.1221 74000.0 229.1589 120000.0 230.1307 41000.0 231.1161 9500.0 231.1383 77000.0 231.1746 22000.0 232.1235 7800.0 232.1469 18000.0 233.1318 82000.0 233.1539 600000.0 234.1394 25000.0 234.1604 200000.0 235.148 240000.0 235.1712 21000.0 236.1558 53000.0 237.1256 69000.0 237.1489 350000.0 237.1649 20000.0 238.1347 21000.0 238.1708 30000.0 239.1431 110000.0 239.179 99000.0 240.1498 22000.0 241.1241 25000.0 241.1588 130000.0 241.1902 5800.0 242.1654 7200.0 243.1384 64000.0 243.1744 42000.0 245.1307 43000.0 245.1558 43000.0 246.1388 51000.0 246.1631 35000.0 247.1461 88000.0 247.1699 200000.0 248.1393 23000.0 248.1541 14000.0 249.1309 34000.0 249.1635 190000.0 250.1576 14000.0 251.1435 83000.0 251.1788 110000.0 252.1502 15000.0 253.1588 180000.0 253.1938 40000.0 254.1642 9900.0 255.1437 11000.0 255.174 500000.0 255.2029 5400.0 256.1825 15000.0 257.1542 47000.0 257.1887 39000.0 259.1437 44000.0 259.1695 110000.0 260.1541 31000.0 261.1632 230000.0 261.1876 23000.0 262.1686 18000.0 263.1435 35000.0 263.1789 130000.0 264.1842 22000.0 265.1587 79000.0 265.1957 68000.0 266.1643 8100.0 266.1995 5300.0 266.7908 7800.0 267.141 10000.0 267.1745 98000.0 268.1823 60000.0 269.1559 41000.0 269.1899 120000.0 270.1973 45000.0 271.1692 210000.0 271.2014 10000.0 272.177 8600.0 273.1581 40000.0 273.1849 100000.0 274.1927 140000.0 275.1445 3600.0 275.1795 66000.0 276.1872 33000.0 277.1594 45000.0 277.1951 88000.0 277.226 9500.0 279.1745 210000.0 279.2079 9300.0 281.1568 32000.0 281.1905 180000.0 282.1952 28000.0 283.171 35000.0 283.2051 40000.0 285.1851 190000.0 286.1927 320000.0 287.2005 240000.0 289.1591 6200.0 289.1945 86000.0 290.2007 13000.0 291.1749 57000.0 291.2109 64000.0 293.1541 7300.0 293.1911 50000.0 294.1972 80000.0 295.1707 36000.0 295.2059 190000.0 296.1765 7800.0 297.1847 190000.0 298.1927 29000.0 299.2004 240000.0 300.2094 21000.0 301.1927 41000.0 303.1957 720000.0 305.1884 25000.0 305.2252 4900.0 307.2057 79000.0 309.1847 81000.0 309.2211 52000.0 310.1934 68000.0 311.2005 92000.0 312.2081 97000.0 313.2156 170000.0 315.2095 18000.0 317.2257 16000.0 319.206 120000.0 321.222 21000.0 322.2288 39000.0 323.2003 28000.0 325.2157 180000.0 327.2091 10000.0 329.2252 11000.0 331.2052 27000.0 333.2216 39000.0 334.2284 11000.0 335.1994 7000.0 335.2398 9700.0 337.216 360000.0 339.2305 18000.0 341.2277 33000.0 345.2212 26000.0 347.2374 67000.0 349.2147 20000.0 350.22 12000.0 351.2311 48000.0 352.1899 16000.0 352.2393 950000.0 353.2412 17000.0 353.2484 3800.0 359.2365 44000.0 361.2547 13000.0 363.2307 34000.0 364.2393 8100.0 365.2467 440000.0 369.2591 7100.0 373.2536 20000.0 377.2473 89000.0 378.2545 17000.0 379.2667 7900.0 381.2418 18000.0 383.2612 9100.0 387.2673 24000.0 389.2424 6900.0 391.2631 28000.0 397.2732 5000.0 401.2707 8800.0 403.2595 7000.0 405.2782 33000.0 417.2824 6500.0 419.2931 36000.0 420.3021 15000.0 421.2768 6000.0 437.3038 17000.0 439.283 7500.0 469.3082 42000.0 487.3192 210000.0 489.3374 16000.0 493.3241 7000.0 502.344 25000.0 503.351 250000.0 505.3299 160000.0 507.3478 51000.0 508.3491 35000.0 520.3536 82000.0 522.8188 5800.0 562.3765 5500.0 567.3828 13000.0 585.392 39000.0 598.6126 3600.0 600.411 22000.0 END IONS BEGIN IONS SCANS=721 PEPMASS=280.2641 CHARGE=1 COLLISION_ENERGY=0.0 49.0739 2200.0 50.7193 2200.0 51.8721 2300.0 53.0386 110000.0 55.0179 68000.0 55.0542 260000.0 56.0495 6900.0 57.0337 3300.0 57.0634 2900.0 57.0699 590000.0 57.0724 8300.0 58.0652 9000.0 60.0444 2700.0 66.8537 2600.0 67.0541 190000.0 67.0585 5100.0 68.062 7600.0 69.0336 7500.0 69.0698 390000.0 69.0733 3800.0 69.0745 2500.0 70.0651 17000.0 71.0855 29000.0 72.0444 37000.0 72.0807 24000.0 73.0649 3300.0 74.0964 42000.0 79.0542 60000.0 81.0334 320000.0 81.038 4000.0 81.0698 260000.0 81.0743 2900.0 81.0756 3200.0 82.0651 7100.0 83.0491 44000.0 83.0854 190000.0 83.0903 3100.0 84.0444 60000.0 84.0807 15000.0 85.1012 8100.0 86.06 12000.0 86.0967 3900.0 87.7143 2200.0 91.0541 30000.0 93.0699 46000.0 94.0653 6200.0 95.0492 130000.0 95.0854 230000.0 95.6156 2400.0 96.0809 3500.0 96.5904 2500.0 97.0646 18000.0 97.0942 2900.0 97.1012 79000.0 98.06 140000.0 98.0961 3400.0 100.0757 9300.0 100.1122 3000.0 101.0961 4600.0 105.07 28000.0 107.0855 36000.0 108.0806 5600.0 109.0648 50000.0 109.1012 120000.0 111.0806 4900.0 111.1171 9100.0 112.0757 61000.0 112.1119 6200.0 114.0918 3400.0 119.0856 33000.0 121.1011 15000.0 123.0804 24000.0 123.1168 40000.0 125.0961 5600.0 126.0914 48000.0 128.107 18000.0 128.1162 2300.0 133.1013 29000.0 135.1167 4900.0 136.7315 2300.0 137.0962 15000.0 137.1327 4900.0 139.1117 3600.0 140.1071 30000.0 140.1439 3100.0 142.1229 6700.0 142.1584 2600.0 147.1169 11000.0 149.0237 9400.0 149.8577 2700.0 150.027 8600.0 151.1121 4900.0 152.1078 3200.0 154.1228 60000.0 156.1378 3900.0 156.1747 27000.0 161.1768 2300.0 163.1478 3700.0 165.1277 3900.0 165.1643 8800.0 167.1303 5900.0 168.1385 27000.0 173.5283 54000.0 173.5459 9400.0 179.18 4900.0 182.1543 15000.0 189.1635 7100.0 196.17 6300.0 206.1906 9200.0 207.1754 19000.0 212.2376 7500.0 219.0575 20000.0 220.0606 38000.0 224.2012 130000.0 238.2545 4200.0 252.271 2600.0 280.0972 42000.0 280.2639 340000.0 280.3002 5700.0 END IONS BEGIN IONS SCANS=722 PEPMASS=772.4765 CHARGE=1 COLLISION_ENERGY=0.0 73.6295 2400.0 78.5708 2600.0 79.0539 20000.0 81.0696 150000.0 82.4153 2400.0 83.0488 10000.0 83.0852 34000.0 83.0898 2600.0 83.1949 2000.0 85.0645 2400.0 85.2318 2500.0 86.0962 42000.0 89.5505 2400.0 91.0539 3600.0 92.4673 2800.0 93.0696 37000.0 95.0793 3300.0 95.0852 120000.0 97.0646 10000.0 97.1009 15000.0 98.7095 2900.0 101.0957 3600.0 105.0699 10000.0 107.0853 38000.0 108.1426 2800.0 109.0645 8300.0 109.1008 74000.0 111.0437 200000.0 111.08 6800.0 111.1168 2700.0 113.0594 4200.0 119.0852 27000.0 121.1008 62000.0 123.0806 8200.0 123.1165 58000.0 124.9997 11000.0 125.0595 45000.0 131.0856 7200.0 133.1009 53000.0 135.0805 16000.0 135.1166 88000.0 136.8667 2400.0 137.0594 1000000.0 137.0734 16000.0 137.096 3100.0 137.1321 65000.0 139.075 3300.0 143.0854 2400.0 145.1008 5400.0 147.1165 94000.0 149.0958 61000.0 149.1321 40000.0 151.0749 19000.0 151.1118 8300.0 151.148 2500.0 157.1015 5100.0 157.3416 2400.0 159.1166 7100.0 160.3781 2800.0 161.0959 66000.0 161.1323 47000.0 163.1115 49000.0 163.148 24000.0 165.0909 45000.0 165.1273 3600.0 167.107 19000.0 171.1168 6300.0 173.1329 3200.0 173.5209 29000.0 173.5369 160000.0 175.1116 72000.0 175.1482 31000.0 177.0903 7100.0 177.1276 10000.0 179.1065 63000.0 181.1222 19000.0 184.0544 5200.0 184.0732 520000.0 184.0881 2800.0 185.1335 2300.0 189.1273 21000.0 189.1633 6800.0 193.1223 49000.0 195.14 2800.0 197.132 2800.0 203.1462 3400.0 203.1794 200000.0 205.1952 34000.0 207.1377 6700.0 213.1299 5600.0 213.1637 75000.0 221.1902 74000.0 223.1479 22000.0 231.1743 390000.0 231.1942 2800.0 234.5591 3000.0 238.3631 3300.0 241.159 48000.0 245.2235 3200.0 249.1848 420000.0 259.1677 4700.0 263.2373 25000.0 277.1802 1600000.0 280.2178 2500.0 282.3394 2500.0 288.8931 2600.0 295.1907 180000.0 302.2141 3500.0 306.2796 37000.0 320.1806 2500.0 320.2225 150000.0 337.274 210000.0 338.2307 6200.0 346.9124 2400.0 351.2167 100000.0 395.4741 2600.0 401.5396 2600.0 402.6352 2800.0 470.1282 2600.0 508.1571 2500.0 520.8134 2800.0 527.717 2200.0 593.2844 2500.0 612.5421 2500.0 613.4466 210000.0 629.6804 3400.0 656.4883 4100.0 753.8434 2700.0 767.0106 2600.0 END IONS BEGIN IONS SCANS=723 PEPMASS=613.2663 CHARGE=1 COLLISION_ENERGY=0.0 67.0541 9100.0 81.0697 16000.0 83.0853 3000.0 93.0699 7400.0 95.0852 13000.0 105.07 2700.0 107.0852 7300.0 109.101 11000.0 111.2536 2400.0 119.0857 5700.0 121.101 9300.0 121.5874 2500.0 123.1167 2400.0 126.2126 2300.0 126.2297 2700.0 131.0855 3100.0 133.1012 8900.0 135.1168 8100.0 161.1324 7200.0 164.0391 2600.0 173.5231 27000.0 173.5373 61000.0 175.1488 2900.0 187.1487 3000.0 187.8981 2700.0 189.1643 3300.0 210.3876 2600.0 218.0825 3200.0 219.6296 2900.0 237.4446 2500.0 261.2219 2900.0 289.3985 2200.0 304.7243 2600.0 305.2454 2500.0 318.16 15000.0 326.3276 2400.0 330.3634 3200.0 335.2598 3200.0 353.3979 2300.0 384.876 2800.0 404.0742 2700.0 409.2026 9100.0 411.2197 9900.0 412.2282 11000.0 423.2187 23000.0 424.2261 40000.0 425.1981 46000.0 437.2339 24000.0 439.2138 54000.0 440.2214 100000.0 449.2266 3100.0 451.2513 2500.0 453.2289 26000.0 454.2358 17000.0 456.2124 8000.0 467.2462 13000.0 469.224 19000.0 481.2234 24000.0 482.2337 13000.0 483.2377 100000.0 484.2469 82000.0 494.2275 4500.0 495.2387 41000.0 496.2464 48000.0 497.2212 56000.0 498.2293 25000.0 509.2532 25000.0 510.2446 16000.0 511.2333 40000.0 512.2424 89000.0 526.2531 15000.0 527.2651 310000.0 527.3356 2300.0 537.2491 48000.0 542.2169 15000.0 543.2596 20000.0 554.2533 3500.0 555.2237 2900.0 569.276 140000.0 570.2478 270000.0 571.1747 5200.0 571.2554 1300000.0 572.261 3900.0 585.2696 17000.0 613.2662 27000.0 613.4761 5000.0 END IONS BEGIN IONS SCANS=724 PEPMASS=429.3732 CHARGE=1 COLLISION_ENERGY=0.0 55.054 18000.0 56.9776 2700.0 57.0696 280000.0 57.7199 2500.0 57.9822 2300.0 58.2166 2100.0 59.166 2700.0 60.0086 2200.0 61.7031 2500.0 63.0868 2300.0 63.7733 2100.0 64.5739 2200.0 66.189 2200.0 66.9556 2300.0 67.0541 24000.0 68.5734 2400.0 69.0244 2300.0 69.0695 70000.0 69.474 2500.0 69.6397 2300.0 71.0852 220000.0 72.7274 2100.0 73.5622 2200.0 73.85 2500.0 75.886 2500.0 76.2575 2900.0 77.4349 2300.0 78.5784 2500.0 80.7051 2100.0 80.7339 2500.0 81.0696 100000.0 81.3096 2500.0 81.8294 2300.0 83.0853 57000.0 84.3015 2500.0 84.6298 2300.0 84.9105 2100.0 85.1009 120000.0 91.3622 2100.0 93.0694 2300.0 94.2575 2100.0 95.0851 110000.0 97.1009 39000.0 99.7175 2200.0 100.392 2300.0 102.6119 2500.0 104.2407 2500.0 104.8397 2300.0 106.1606 2700.0 107.5243 2300.0 108.9211 2400.0 109.101 64000.0 111.0042 2400.0 111.1165 8500.0 119.2663 2400.0 121.0649 2700.0 121.1006 3100.0 123.1167 16000.0 125.6844 2600.0 126.7167 2700.0 131.5797 2500.0 131.753 2700.0 133.5743 2400.0 135.0801 22000.0 135.1165 11000.0 137.0599 2500.0 137.0958 46000.0 137.1323 7100.0 137.8811 2800.0 137.9741 2400.0 139.0751 42000.0 145.1015 3300.0 148.1783 2400.0 148.3443 2400.0 149.0959 190000.0 149.6812 3600.0 149.6919 4900.0 151.0753 2500.0 152.1655 2400.0 152.9917 2400.0 159.1168 29000.0 161.0964 3500.0 163.0748 5600.0 163.1117 330000.0 165.091 1900000.0 171.1159 2400.0 173.0961 13000.0 173.1329 38000.0 173.521 4500.0 173.5297 130000.0 173.5417 74000.0 175.1118 120000.0 177.091 250000.0 177.1072 7200.0 177.1276 47000.0 179.1066 36000.0 181.4649 2900.0 184.1444 2800.0 187.1117 59000.0 187.1487 5500.0 189.1274 56000.0 190.0984 3000.0 191.1067 270000.0 191.1449 2700.0 193.1755 2600.0 195.5267 2300.0 195.7909 2300.0 201.1277 72000.0 201.6438 2500.0 203.1071 2800.0 203.1433 15000.0 205.1226 250000.0 205.4408 2400.0 207.8233 2400.0 215.1435 37000.0 217.7231 2700.0 219.1383 130000.0 229.1597 5400.0 232.3619 2200.0 233.1539 59000.0 247.1697 27000.0 253.7988 2800.0 255.0557 2400.0 258.1124 2200.0 261.1851 10000.0 264.1908 2400.0 275.2007 11000.0 283.4357 2400.0 288.105 2800.0 289.2185 2500.0 297.0427 2600.0 297.954 2700.0 303.2324 3400.0 308.8483 2800.0 315.1501 2300.0 346.5037 2300.0 350.9571 2300.0 353.3543 2500.0 353.4807 3000.0 359.2973 2500.0 376.7278 2400.0 390.7038 3200.0 394.1142 2700.0 394.8616 2500.0 401.0728 2400.0 401.341 4000.0 426.685 2700.0 429.3204 190000.0 429.3769 32000.0 433.147 2600.0 END IONS BEGIN IONS SCANS=725 PEPMASS=600.4179 CHARGE=1 COLLISION_ENERGY=0.0 65.0516 2600.0 67.0541 27000.0 68.0335 2400.0 69.0334 24000.0 69.0697 30000.0 69.905 2400.0 71.0488 2600.0 73.0285 2700.0 73.7771 3100.0 74.7737 2800.0 76.4162 2200.0 78.15 2300.0 79.0542 37000.0 81.0698 88000.0 82.363 2200.0 83.049 49000.0 83.0854 22000.0 84.8273 2300.0 85.0646 17000.0 87.0437 8900.0 89.0596 130000.0 90.5192 2400.0 91.0541 36000.0 92.0628 2400.0 93.0697 150000.0 95.049 63000.0 95.0854 110000.0 96.1084 2200.0 97.0649 41000.0 100.955 2300.0 102.9296 2300.0 105.0698 130000.0 106.078 7400.0 107.0491 2700.0 107.0773 3500.0 107.0854 170000.0 107.0934 4700.0 109.0647 59000.0 109.1011 74000.0 111.0804 19000.0 113.0962 7700.0 117.07 27000.0 117.0915 2300.0 119.0497 2900.0 119.0854 210000.0 120.0935 7700.0 121.0648 29000.0 121.1011 220000.0 121.1104 6100.0 123.0804 100000.0 123.1166 24000.0 125.0597 60000.0 125.0959 35000.0 129.0698 21000.0 129.0967 2300.0 130.0774 5000.0 130.8648 2200.0 131.0854 91000.0 132.0931 12000.0 133.0648 21000.0 133.0859 64000.0 133.1011 160000.0 134.073 3700.0 134.1085 6200.0 135.0804 83000.0 135.1168 70000.0 136.0864 3200.0 137.0596 15000.0 137.096 60000.0 139.0754 35000.0 139.1114 22000.0 141.0706 2800.0 142.0777 18000.0 143.0854 120000.0 144.0931 49000.0 145.0654 7000.0 145.1011 250000.0 146.1089 11000.0 146.2811 2600.0 147.0803 120000.0 147.1167 73000.0 148.0876 8400.0 149.096 71000.0 149.1318 5300.0 150.1037 3100.0 151.0753 110000.0 151.1113 13000.0 153.091 19000.0 153.1286 4000.0 155.0853 23000.0 155.1061 3700.0 156.0933 20000.0 157.1011 290000.0 157.1127 2300.0 158.1084 40000.0 159.0806 53000.0 159.1167 170000.0 160.0882 22000.0 160.1247 3400.0 161.096 120000.0 161.1325 56000.0 162.1036 5700.0 163.0753 3700.0 163.1117 140000.0 165.091 380000.0 165.1255 2700.0 166.0944 5800.0 167.0886 8400.0 167.1067 73000.0 168.093 4300.0 169.1013 74000.0 170.1092 32000.0 171.0808 14000.0 171.1169 170000.0 172.0882 3400.0 172.1244 43000.0 173.0961 56000.0 173.1168 2300.0 173.1326 95000.0 173.5241 34000.0 173.5331 50000.0 173.5439 23000.0 174.1042 3600.0 175.1118 110000.0 175.1482 36000.0 176.1203 30000.0 177.0908 16000.0 177.1114 4300.0 177.1276 32000.0 178.0994 15000.0 179.0876 6100.0 179.1066 38000.0 180.1145 18000.0 181.0854 9100.0 181.1017 40000.0 181.1225 62000.0 182.109 6800.0 183.117 99000.0 184.124 25000.0 185.0961 20000.0 185.1327 140000.0 186.1044 8800.0 186.1402 15000.0 187.1118 47000.0 187.1481 35000.0 188.1205 7400.0 189.1276 83000.0 190.1352 71000.0 191.1064 30000.0 191.1431 39000.0 193.1015 23000.0 193.1225 57000.0 194.1087 13000.0 195.1169 100000.0 195.1375 21000.0 196.1246 22000.0 197.0967 13000.0 197.1152 6200.0 197.1326 110000.0 198.1034 9100.0 198.1394 15000.0 199.1118 45000.0 199.1485 58000.0 200.1177 5000.0 200.1533 3700.0 201.1273 50000.0 203.1094 4000.0 203.1432 220000.0 203.1646 10000.0 205.1225 15000.0 205.1569 2700.0 207.1167 55000.0 207.1383 120000.0 207.817 2800.0 208.1249 18000.0 208.1453 15000.0 209.1325 96000.0 209.1538 18000.0 210.14 20000.0 211.1119 32000.0 211.1482 64000.0 212.12 10000.0 212.1568 4200.0 213.1279 61000.0 213.1645 22000.0 214.1358 4500.0 215.1064 9400.0 215.1434 37000.0 216.1515 10000.0 217.1229 12000.0 217.1588 13000.0 218.1316 3600.0 218.1674 3300.0 219.1169 16000.0 219.1381 51000.0 221.1322 50000.0 221.1539 370000.0 222.1382 4100.0 222.1599 3000.0 223.1115 10000.0 223.1483 72000.0 225.1273 47000.0 225.1639 51000.0 226.1351 3600.0 227.1439 36000.0 227.1795 4600.0 229.1228 11000.0 229.1589 21000.0 230.1302 11000.0 231.1386 15000.0 232.1227 4000.0 233.1318 28000.0 233.1539 130000.0 234.1375 5200.0 234.1614 49000.0 235.1479 48000.0 235.1702 10000.0 236.1556 9600.0 237.1256 15000.0 237.1491 91000.0 239.1429 26000.0 239.1798 14000.0 241.1588 26000.0 243.1373 8500.0 243.1754 5500.0 245.1311 8100.0 245.1552 5200.0 246.1384 8900.0 247.1464 24000.0 247.1697 53000.0 248.1547 5000.0 249.1637 50000.0 251.1431 29000.0 251.1791 27000.0 253.1586 50000.0 253.1871 3700.0 255.142 10000.0 255.1742 110000.0 257.1537 16000.0 257.1891 12000.0 259.1441 11000.0 259.1701 24000.0 261.1631 51000.0 262.1695 8500.0 263.1422 5800.0 263.1785 32000.0 264.1865 2500.0 264.5416 2500.0 265.1584 14000.0 265.1933 16000.0 267.1743 25000.0 268.1829 9500.0 268.3292 2700.0 269.1563 10000.0 269.1895 28000.0 270.1946 3800.0 271.1698 55000.0 273.1583 7900.0 273.1868 24000.0 274.1931 26000.0 275.1781 13000.0 277.1609 2700.0 277.1955 17000.0 279.1746 53000.0 279.2675 2500.0 281.1902 50000.0 282.1963 7200.0 283.1709 7000.0 283.2053 4200.0 285.1853 40000.0 286.1927 99000.0 287.2004 40000.0 289.1948 18000.0 291.1761 12000.0 291.2091 11000.0 293.1897 9700.0 294.1984 13000.0 295.1716 4200.0 295.206 34000.0 297.185 42000.0 298.1933 4900.0 299.2006 50000.0 301.1922 5500.0 303.1958 120000.0 305.1906 3700.0 307.2057 17000.0 309.1846 26000.0 309.2205 10000.0 310.1925 19000.0 311.2003 30000.0 312.2083 23000.0 313.2169 39000.0 314.1985 2800.0 315.2099 4000.0 319.205 22000.0 322.2294 4900.0 323.1996 8000.0 325.2162 100000.0 333.2214 9800.0 337.2162 73000.0 339.2339 4500.0 341.2296 4400.0 347.2366 18000.0 349.2188 3000.0 351.2308 10000.0 352.2395 170000.0 353.246 5700.0 359.2358 11000.0 363.2317 4500.0 365.2473 180000.0 373.252 2500.0 377.2481 17000.0 378.2537 3300.0 387.2702 11000.0 391.2659 4600.0 391.465 3600.0 401.2816 3200.0 405.2813 3300.0 419.2953 3800.0 421.2725 3600.0 437.2997 3500.0 487.3197 36000.0 489.335 3600.0 502.3433 4000.0 503.3517 49000.0 505.331 27000.0 507.3461 38000.0 520.3536 15000.0 524.4359 2800.0 524.5599 2700.0 567.3817 5400.0 585.3911 7800.0 600.2161 2500.0 602.913 2800.0 END IONS BEGIN IONS SCANS=726 PEPMASS=669.2923 CHARGE=1 COLLISION_ENERGY=0.0 66.5855 3700.0 66.5888 3000.0 67.0326 2400.0 75.6804 2500.0 79.0838 2200.0 82.3261 2500.0 84.0345 2200.0 85.5446 2100.0 88.5288 2200.0 103.5557 2500.0 134.8097 3400.0 173.5243 53000.0 173.5432 33000.0 220.7018 2700.0 222.1268 3400.0 223.137 3100.0 224.1314 4100.0 226.1467 5900.0 237.1388 3200.0 239.1539 32000.0 240.1622 5900.0 253.132 5000.0 265.1333 13000.0 267.1497 21000.0 313.1194 9600.0 356.8283 2800.0 378.1671 2500.0 403.1657 2800.0 405.2858 2600.0 406.1788 8800.0 418.2455 3000.0 420.1956 19000.0 421.2008 18000.0 438.2039 4800.0 439.2117 13000.0 444.2286 37000.0 445.2357 4800.0 446.2442 2900.0 463.1884 17000.0 475.2139 17000.0 479.2079 8200.0 493.2248 29000.0 503.2046 5300.0 504.2275 8500.0 511.267 33000.0 521.2531 130000.0 522.24 23000.0 524.2443 29000.0 532.2221 17000.0 535.2336 33000.0 538.2638 3300.0 539.0739 4000.0 539.2655 2000000.0 546.5566 2500.0 549.2501 160000.0 550.2355 28000.0 552.2366 16000.0 563.2627 4300.0 564.2499 82000.0 566.2506 13000.0 567.2607 540000.0 574.2343 12000.0 576.2745 5600.0 581.2762 300000.0 584.2617 9500.0 591.2604 21000.0 592.248 3100.0 599.2868 260000.0 606.263 2800.0 609.2704 26000.0 623.2871 20000.0 626.2729 19000.0 636.2927 13000.0 641.2983 12000.0 651.2816 6100.0 END IONS BEGIN IONS SCANS=727 PEPMASS=600.4172 CHARGE=1 COLLISION_ENERGY=0.0 63.7358 2300.0 64.0582 2400.0 67.054 40000.0 67.3874 2400.0 69.0334 37000.0 69.0697 45000.0 71.0491 6300.0 73.0897 2300.0 76.0396 2600.0 78.9513 2100.0 79.0541 55000.0 80.1129 2200.0 81.0697 140000.0 83.0489 59000.0 83.0853 37000.0 85.0647 27000.0 87.0438 19000.0 88.9352 2100.0 89.0594 170000.0 89.6751 2100.0 91.0541 59000.0 93.0697 230000.0 95.049 83000.0 95.0853 170000.0 97.0646 63000.0 105.0697 210000.0 106.0779 2400.0 107.0495 5100.0 107.0853 250000.0 109.0646 78000.0 109.1009 120000.0 111.044 6000.0 111.0803 45000.0 113.0959 13000.0 117.0699 30000.0 117.0906 2500.0 119.0489 3000.0 119.0853 310000.0 119.7189 2500.0 120.0932 14000.0 121.0646 42000.0 121.1009 310000.0 121.2566 2200.0 122.1044 6200.0 123.0802 140000.0 123.1165 31000.0 125.0595 42000.0 125.0959 58000.0 129.0697 29000.0 131.0854 130000.0 132.0932 13000.0 132.7888 2400.0 133.0645 37000.0 133.0858 85000.0 133.101 250000.0 134.1076 6300.0 134.3022 2700.0 134.8381 2600.0 135.0803 120000.0 135.1167 100000.0 137.0597 16000.0 137.0958 86000.0 139.0751 33000.0 139.1112 20000.0 141.0703 7100.0 142.0779 19000.0 143.0853 170000.0 144.0931 59000.0 145.064 3100.0 145.101 310000.0 145.8097 2200.0 146.1072 13000.0 147.0802 160000.0 147.1165 100000.0 148.0873 13000.0 149.0959 100000.0 149.1328 13000.0 150.1037 3600.0 151.0751 130000.0 151.1112 17000.0 152.0811 2600.0 153.0908 21000.0 155.0853 37000.0 155.1068 11000.0 156.0931 38000.0 157.1009 370000.0 157.1163 2800.0 158.1085 51000.0 159.0803 66000.0 159.1167 230000.0 160.0878 45000.0 160.1224 5000.0 161.0959 140000.0 161.1324 73000.0 162.1036 7600.0 163.0752 7000.0 163.1115 140000.0 165.0909 440000.0 166.0943 27000.0 167.0853 2800.0 167.089 9200.0 167.1066 110000.0 168.094 5600.0 168.1099 2400.0 169.1012 110000.0 170.1081 36000.0 171.0798 12000.0 171.1168 240000.0 172.0881 7100.0 172.1243 72000.0 173.0962 69000.0 173.1324 140000.0 173.5238 64000.0 173.5424 73000.0 174.1032 3500.0 174.1382 7800.0 175.1118 130000.0 175.148 52000.0 176.1192 3100.0 177.091 25000.0 177.1111 11000.0 177.1274 41000.0 178.0992 13000.0 179.0882 5500.0 179.1066 48000.0 179.1429 6600.0 180.0946 3000.0 180.1146 24000.0 181.0857 14000.0 181.1014 55000.0 181.1222 60000.0 182.1088 19000.0 183.1167 150000.0 184.124 38000.0 185.096 26000.0 185.1324 190000.0 186.1051 2500.0 186.1394 23000.0 187.1115 69000.0 187.148 55000.0 188.1191 11000.0 189.1273 100000.0 190.1348 85000.0 191.1062 28000.0 191.1427 50000.0 193.1011 33000.0 193.1222 75000.0 194.1088 19000.0 195.1166 130000.0 195.1366 18000.0 195.5387 2600.0 195.6942 2800.0 196.1238 32000.0 197.0964 18000.0 197.1161 7800.0 197.1325 150000.0 198.1041 12000.0 198.1392 23000.0 199.1115 58000.0 199.1481 81000.0 200.1201 4000.0 201.1272 58000.0 201.1631 16000.0 202.1331 2900.0 203.1088 8000.0 203.143 270000.0 204.1468 7700.0 205.1226 16000.0 206.1097 3100.0 206.1296 3200.0 207.1166 61000.0 207.138 120000.0 208.1241 28000.0 208.1453 27000.0 209.1323 130000.0 209.1533 23000.0 210.1392 34000.0 211.1117 43000.0 211.1482 110000.0 212.1194 16000.0 212.1552 12000.0 213.1273 77000.0 213.1639 34000.0 214.1329 11000.0 215.107 16000.0 215.143 44000.0 216.1506 13000.0 217.1225 16000.0 217.1586 25000.0 219.1165 16000.0 219.1382 63000.0 220.1246 17000.0 221.1323 69000.0 221.1537 450000.0 222.1378 15000.0 222.1588 16000.0 223.1108 16000.0 223.1481 100000.0 224.1536 11000.0 225.1273 59000.0 225.1637 74000.0 226.1336 6600.0 227.1428 40000.0 227.1801 11000.0 227.2801 2500.0 228.1503 5800.0 229.1223 21000.0 229.1584 25000.0 230.1296 3500.0 231.1156 3500.0 231.1382 18000.0 231.1747 3700.0 233.1318 26000.0 233.1539 160000.0 234.137 8500.0 234.1604 55000.0 235.148 78000.0 235.171 3300.0 236.1554 14000.0 237.1254 22000.0 237.1487 98000.0 237.1662 8400.0 238.1677 3100.0 239.1432 32000.0 239.179 27000.0 240.1522 5400.0 241.1587 32000.0 243.1379 12000.0 243.1738 11000.0 245.1301 10000.0 245.1547 9400.0 246.1396 9800.0 247.1462 24000.0 247.1699 54000.0 249.1309 6800.0 249.1635 64000.0 250.1713 5500.0 251.1424 22000.0 251.1794 41000.0 252.1497 3400.0 253.1309 6300.0 253.1582 61000.0 253.1919 13000.0 255.1738 150000.0 255.2948 2500.0 256.1811 3000.0 257.1551 17000.0 257.1894 13000.0 259.1442 5000.0 259.1693 35000.0 260.1558 3800.0 261.163 72000.0 263.1428 13000.0 263.1788 44000.0 264.1843 5300.0 265.159 17000.0 265.1946 24000.0 267.1742 28000.0 268.1819 11000.0 269.1554 16000.0 269.1898 34000.0 270.1975 13000.0 271.169 52000.0 273.1592 4900.0 273.1863 23000.0 274.1928 55000.0 275.1791 8000.0 277.1609 11000.0 277.1949 29000.0 279.1745 53000.0 279.2054 3400.0 280.1824 3200.0 281.1899 59000.0 282.1954 5600.0 283.1719 4600.0 283.2053 15000.0 285.1852 54000.0 286.1925 85000.0 287.2008 65000.0 289.1579 3100.0 289.1953 24000.0 291.175 16000.0 291.2104 12000.0 293.1902 18000.0 294.1979 21000.0 295.1714 2900.0 295.2056 54000.0 297.1844 43000.0 298.1926 11000.0 299.2004 63000.0 300.2084 8500.0 301.1941 13000.0 303.1957 180000.0 305.1893 7100.0 305.2241 3000.0 307.2054 22000.0 309.1832 18000.0 309.2203 15000.0 310.1912 12000.0 311.2005 29000.0 312.2074 25000.0 313.2157 67000.0 315.2115 3900.0 319.2054 28000.0 321.2204 4000.0 322.2273 9500.0 323.199 5600.0 325.2157 53000.0 333.2216 9200.0 337.2158 97000.0 345.2221 6100.0 347.2371 14000.0 349.2143 6500.0 349.2568 3400.0 351.2315 3400.0 352.2391 260000.0 359.2344 11000.0 363.232 6600.0 365.2465 120000.0 366.2518 2700.0 368.794 2600.0 377.2472 22000.0 387.2681 12000.0 391.2624 2900.0 397.2561 2600.0 405.277 4200.0 419.2912 3800.0 437.3058 6200.0 463.2672 2500.0 469.3103 4200.0 487.3191 46000.0 487.3287 2800.0 490.3365 2700.0 502.3422 11000.0 503.3505 69000.0 505.3299 31000.0 507.3468 11000.0 508.3534 6600.0 520.353 23000.0 567.3788 5500.0 569.0071 2700.0 585.3939 4800.0 594.4513 2600.0 600.4103 3400.0 END IONS BEGIN IONS SCANS=728 PEPMASS=583.415 CHARGE=1 COLLISION_ENERGY=0.0 63.8847 2100.0 67.0539 12000.0 69.0331 3900.0 69.0694 16000.0 74.1413 2400.0 79.0539 9400.0 81.0694 30000.0 83.0487 7800.0 83.0853 9200.0 85.0646 3000.0 88.9646 2400.0 91.0541 11000.0 93.0694 52000.0 94.0966 2200.0 95.0487 7900.0 95.085 47000.0 97.0645 5100.0 105.0694 41000.0 106.0719 2600.0 107.085 54000.0 109.0641 7900.0 109.1007 29000.0 117.0693 3200.0 117.6647 2300.0 119.085 77000.0 121.1006 93000.0 123.0801 13000.0 123.1164 10000.0 125.0962 6800.0 129.069 2500.0 131.0849 29000.0 132.3567 2500.0 132.5556 2500.0 133.1006 57000.0 135.0798 4400.0 135.1163 27000.0 137.0957 19000.0 139.1113 6000.0 143.0852 30000.0 145.1006 68000.0 147.0798 19000.0 147.1164 22000.0 149.0957 16000.0 149.6811 4000.0 149.6917 5000.0 151.0752 25000.0 151.9601 2600.0 155.0851 4300.0 157.1007 60000.0 159.08 4500.0 159.1164 44000.0 161.0957 14000.0 161.1323 13000.0 163.1109 3700.0 165.0906 58000.0 167.0849 2500.0 167.0912 2500.0 167.1062 51000.0 169.1007 18000.0 170.1075 2900.0 171.1163 34000.0 171.1307 2600.0 173.096 3300.0 173.132 32000.0 173.5263 4200.0 173.5346 54000.0 175.1478 19000.0 180.3471 2500.0 181.1013 7000.0 183.1164 25000.0 185.1321 35000.0 187.1108 3000.0 187.1478 19000.0 189.1272 7100.0 191.1427 6500.0 195.1163 22000.0 196.1225 3900.0 197.1321 29000.0 199.1109 2700.0 199.1481 17000.0 200.1551 2600.0 203.1431 32000.0 207.1166 15000.0 207.1375 11000.0 208.1243 3200.0 209.132 33000.0 211.1476 20000.0 213.1632 2800.0 215.1438 6700.0 219.1163 2600.0 221.1319 15000.0 221.1536 79000.0 223.1475 21000.0 223.9696 2500.0 225.1632 7300.0 231.172 2600.0 233.1311 6800.0 233.1539 29000.0 235.1467 9500.0 237.1632 11000.0 247.1455 2900.0 249.1634 3100.0 253.6053 2200.0 261.1618 4100.0 263.1803 3100.0 273.1591 2700.0 275.1803 2200.0 281.2951 75000.0 282.2793 280000.0 283.2825 290000.0 285.1859 3100.0 286.1924 3000.0 287.2033 3100.0 295.2077 6500.0 297.2198 6800.0 299.3057 88000.0 300.3092 79000.0 327.8639 2500.0 349.2509 2700.0 375.2693 5100.0 403.3006 12000.0 503.3529 6500.0 520.5292 2300.0 538.5456 3500.0 565.4035 6200.0 583.409 19000.0 END IONS BEGIN IONS SCANS=729 PEPMASS=584.4225 CHARGE=1 COLLISION_ENERGY=0.0 64.1565 5000.0 67.0541 86000.0 69.0334 31000.0 69.0698 130000.0 71.0491 19000.0 72.6569 2900.0 77.0393 3300.0 79.0541 120000.0 80.3637 2600.0 81.0698 300000.0 83.0491 66000.0 83.0854 92000.0 85.0647 49000.0 87.0439 14000.0 88.3451 5500.0 89.0596 32000.0 91.0542 130000.0 91.7761 3000.0 93.0698 430000.0 93.0768 7900.0 95.0491 90000.0 95.0854 350000.0 97.0647 67000.0 97.1012 16000.0 97.4181 2900.0 99.0804 3600.0 103.0392 3600.0 105.0698 390000.0 106.0774 10000.0 107.0491 9900.0 107.0772 11000.0 107.0855 560000.0 108.0936 4000.0 109.0647 75000.0 109.1011 310000.0 111.0803 34000.0 113.096 16000.0 115.0534 3300.0 117.0698 80000.0 119.0755 23000.0 119.0855 800000.0 119.0955 18000.0 120.0932 53000.0 121.0648 53000.0 121.091 16000.0 121.1011 530000.0 121.1114 5000.0 122.1055 4200.0 123.0803 58000.0 123.1167 120000.0 125.096 57000.0 128.0622 12000.0 129.0698 53000.0 130.078 25000.0 131.0855 340000.0 132.0931 38000.0 133.0646 26000.0 133.0877 15000.0 133.1011 600000.0 133.1128 17000.0 134.0731 3300.0 134.1085 26000.0 135.0805 150000.0 135.1168 260000.0 135.1283 4300.0 137.0961 63000.0 137.1325 3900.0 139.1117 42000.0 141.0699 10000.0 142.0776 45000.0 143.0855 320000.0 144.0933 86000.0 144.1981 2900.0 145.0652 10000.0 145.0899 14000.0 145.1012 750000.0 146.1084 37000.0 147.0804 75000.0 147.1168 270000.0 148.0877 17000.0 148.1237 3000.0 149.0961 150000.0 149.1325 66000.0 151.1118 28000.0 151.1482 13000.0 153.0691 3500.0 155.0855 79000.0 155.1067 16000.0 156.0933 68000.0 157.0863 6000.0 157.1012 570000.0 158.1088 69000.0 159.0805 200000.0 159.1168 520000.0 160.0882 32000.0 160.1242 32000.0 161.0962 210000.0 161.1325 130000.0 162.1039 7300.0 163.1118 70000.0 163.1481 30000.0 165.09 3600.0 165.1271 6800.0 165.6156 3100.0 167.086 36000.0 167.1067 110000.0 168.0932 21000.0 168.109 8100.0 169.1014 230000.0 170.109 71000.0 171.0811 24000.0 171.117 410000.0 172.0888 7800.0 172.1245 59000.0 173.0962 85000.0 173.1148 2800.0 173.1327 470000.0 173.5241 37000.0 173.5379 69000.0 174.1035 8200.0 174.1399 28000.0 175.1119 120000.0 175.1483 280000.0 177.1276 55000.0 179.0858 31000.0 179.1442 3200.0 180.0935 11000.0 181.1014 120000.0 182.109 53000.0 183.117 350000.0 184.1246 54000.0 185.0962 34000.0 185.1326 300000.0 185.1515 4100.0 186.1041 18000.0 186.1404 55000.0 187.1119 66000.0 187.1483 240000.0 188.1189 15000.0 189.1276 66000.0 189.1639 21000.0 190.1353 24000.0 191.1433 77000.0 192.0944 5800.0 193.1014 83000.0 193.1203 19000.0 193.1592 5800.0 194.1091 68000.0 195.1169 280000.0 196.1245 76000.0 197.0966 35000.0 197.1326 420000.0 198.1401 42000.0 199.1122 74000.0 199.1482 240000.0 200.1551 15000.0 201.1277 77000.0 201.1639 130000.0 203.1433 82000.0 205.101 4900.0 205.1592 27000.0 206.1093 20000.0 207.1171 150000.0 208.1249 59000.0 209.0974 24000.0 209.1327 310000.0 210.1404 54000.0 211.112 48000.0 211.1484 260000.0 211.1712 4300.0 212.1195 23000.0 212.1559 28000.0 213.1277 100000.0 213.1642 99000.0 214.1349 7800.0 215.1435 53000.0 215.1796 4500.0 217.123 12000.0 217.1592 64000.0 218.1088 3500.0 218.1663 17000.0 219.1172 46000.0 219.1752 5700.0 220.1248 37000.0 221.1329 140000.0 221.1547 17000.0 222.1407 41000.0 223.1114 31000.0 223.1485 230000.0 224.1564 49000.0 225.1276 84000.0 225.1641 140000.0 226.136 4100.0 226.1714 9900.0 227.1432 64000.0 227.1797 32000.0 228.1473 6200.0 229.1591 33000.0 231.1169 11000.0 231.1748 17000.0 232.1247 11000.0 233.1317 56000.0 233.1541 320000.0 234.1396 29000.0 235.1484 150000.0 236.156 34000.0 237.128 27000.0 237.1324 9800.0 237.1639 160000.0 238.1729 10000.0 239.1436 41000.0 239.1796 100000.0 240.186 2900.0 241.1588 46000.0 241.1948 35000.0 243.1746 26000.0 245.132 40000.0 246.1401 33000.0 246.1641 11000.0 247.1482 78000.0 248.1556 27000.0 249.1298 12000.0 249.1638 120000.0 250.1715 27000.0 251.1454 21000.0 251.1793 85000.0 252.1868 20000.0 253.1587 79000.0 253.1954 53000.0 255.1445 5600.0 255.1743 500000.0 257.1901 52000.0 258.1404 11000.0 258.1964 3600.0 259.1474 39000.0 259.2051 4500.0 260.1553 32000.0 261.1638 120000.0 262.1714 16000.0 263.1462 10000.0 263.1795 87000.0 264.1875 17000.0 265.1614 23000.0 265.1951 61000.0 267.1746 38000.0 267.2092 28000.0 268.1828 23000.0 269.1907 44000.0 270.1984 21000.0 271.1457 5600.0 271.172 19000.0 271.2036 21000.0 273.1634 50000.0 273.189 19000.0 274.1715 15000.0 275.1797 69000.0 276.1873 16000.0 277.1613 17000.0 277.1955 43000.0 278.1994 3400.0 279.1751 49000.0 279.2099 24000.0 281.1904 49000.0 282.1965 3700.0 282.2778 11000.0 283.2057 41000.0 283.2828 29000.0 284.2141 8400.0 284.2867 14000.0 285.1598 4700.0 285.189 18000.0 285.2211 27000.0 287.1794 42000.0 289.1592 8800.0 289.1955 38000.0 291.1756 12000.0 291.2114 29000.0 293.1911 26000.0 293.2265 7000.0 295.2062 43000.0 297.1871 19000.0 297.2215 27000.0 299.2054 5700.0 299.3055 7500.0 300.3081 9100.0 301.1956 42000.0 301.3135 3400.0 303.174 3300.0 303.2111 23000.0 305.1907 11000.0 307.2055 24000.0 308.2159 3700.0 309.2222 4100.0 311.2382 3900.0 313.1941 11000.0 315.2106 19000.0 317.1917 8200.0 319.2058 23000.0 321.2222 7700.0 323.2392 8800.0 327.2111 21000.0 329.2266 22000.0 330.7422 3100.0 331.2423 7900.0 333.2214 12000.0 334.2319 7100.0 335.2367 9000.0 337.2537 4200.0 341.2276 3400.0 345.2213 55000.0 347.2365 23000.0 349.2522 23000.0 357.2198 4100.0 359.2383 3100.0 360.2452 21000.0 365.2462 14000.0 373.2532 4500.0 385.2541 6400.0 387.2714 3700.0 398.2594 6200.0 400.1882 5700.0 413.2867 11000.0 441.3078 3200.0 459.3242 14000.0 551.3879 8500.0 END IONS BEGIN IONS SCANS=730 PEPMASS=415.3 CHARGE=1 COLLISION_ENERGY=0.0 55.054 47000.0 55.0825 2300.0 55.1355 2400.0 57.0332 3100.0 57.0697 14000.0 65.0387 2500.0 66.9246 2500.0 67.0506 2900.0 67.0539 110000.0 69.0332 17000.0 69.0696 74000.0 71.0488 15000.0 76.1315 2300.0 77.0384 7300.0 79.0539 100000.0 81.0647 3400.0 81.0696 180000.0 83.0853 19000.0 86.3626 2700.0 91.0483 3900.0 91.0539 140000.0 91.0604 2200.0 93.0696 370000.0 93.0767 5000.0 95.0489 61000.0 95.0852 240000.0 97.0645 18000.0 99.9946 2400.0 103.054 8800.0 104.9436 2500.0 105.0449 2300.0 105.0616 8700.0 105.0696 350000.0 105.0781 5000.0 107.0488 3500.0 107.0852 320000.0 109.0646 34000.0 109.1009 190000.0 111.0798 3400.0 115.0544 5300.0 116.0617 9000.0 117.0697 59000.0 119.0756 10000.0 119.0853 430000.0 119.0935 3100.0 119.0955 8600.0 119.2118 2700.0 120.0931 4000.0 121.0646 20000.0 121.091 8400.0 121.101 400000.0 121.1095 2700.0 123.0803 41000.0 123.1166 32000.0 128.0617 17000.0 129.0698 39000.0 130.0775 23000.0 131.0748 4300.0 131.0854 320000.0 131.0968 5700.0 132.0933 13000.0 133.101 280000.0 133.1127 4600.0 135.0803 53000.0 135.1167 100000.0 141.0696 8000.0 142.0775 41000.0 143.0854 160000.0 144.0932 37000.0 145.0655 2900.0 145.1011 390000.0 145.1144 5300.0 146.0726 6200.0 146.1089 7900.0 147.0803 23000.0 147.1167 91000.0 149.0961 52000.0 149.1315 3000.0 154.0791 3400.0 155.0854 46000.0 156.0933 41000.0 157.0865 3100.0 157.1011 230000.0 158.1089 31000.0 159.0806 20000.0 159.1168 150000.0 161.0961 91000.0 161.1325 33000.0 163.1122 6000.0 165.0701 6900.0 167.0855 19000.0 168.0941 11000.0 168.4669 2600.0 169.1014 93000.0 170.1091 31000.0 171.1169 110000.0 172.1247 19000.0 173.0965 20000.0 173.1327 110000.0 173.5244 42000.0 173.542 32000.0 175.112 8900.0 175.1483 51000.0 179.0855 30000.0 180.0938 15000.0 181.1012 47000.0 182.1091 36000.0 183.1171 90000.0 184.1248 18000.0 185.0955 13000.0 185.1327 57000.0 186.1406 2800.0 187.1119 3700.0 187.1483 53000.0 189.1277 3000.0 193.1013 25000.0 194.1091 45000.0 195.117 71000.0 196.1249 22000.0 197.1327 91000.0 197.1653 2400.0 198.1403 9100.0 199.1125 8600.0 199.1483 48000.0 201.1273 8700.0 201.1639 14000.0 206.1097 8700.0 207.1171 25000.0 208.125 16000.0 209.1329 72000.0 210.1405 13000.0 211.1486 41000.0 213.1269 8800.0 213.1641 15000.0 213.8824 2400.0 215.1432 8200.0 219.117 7100.0 220.1252 10000.0 221.1328 24000.0 222.1403 7000.0 223.1486 39000.0 224.1255 2400.0 225.1641 13000.0 231.1171 5700.0 233.1326 9900.0 234.141 3600.0 235.1487 14000.0 237.1295 2600.0 237.1639 8200.0 239.1802 3600.0 245.1304 2500.0 247.1488 4400.0 249.1637 3600.0 251.1797 18000.0 253.1944 3400.0 261.1629 7000.0 263.1815 2800.0 266.2031 3800.0 266.5362 2800.0 267.2093 5600.0 295.5512 2500.0 306.2795 7200.0 347.9008 2600.0 383.5614 3000.0 415.305 7500.0 END IONS BEGIN IONS SCANS=731 PEPMASS=783.5729 CHARGE=1 COLLISION_ENERGY=0.0 71.0728 11000.0 71.6283 2300.0 72.2661 2700.0 72.5206 2700.0 72.556 2600.0 76.242 2300.0 78.0604 2200.0 86.096 290000.0 87.0994 33000.0 94.6484 2800.0 98.9841 17000.0 101.4443 2300.0 101.9942 2300.0 102.3007 2400.0 104.1066 30000.0 105.6145 2300.0 108.0719 2300.0 111.4163 2400.0 117.8776 2700.0 118.4527 2400.0 121.8189 2300.0 124.9995 150000.0 152.3177 2500.0 153.5339 2700.0 173.5198 8200.0 173.5284 120000.0 173.5392 39000.0 173.547 10000.0 174.5632 2400.0 184.0351 7900.0 184.0733 2900000.0 185.0766 370000.0 195.0612 2700.0 231.5514 2700.0 255.9224 2400.0 288.7493 2300.0 293.8051 2700.0 296.8878 2400.0 312.017 2800.0 362.6276 3000.0 397.1547 2400.0 410.4938 2700.0 418.3673 2700.0 448.5591 2600.0 533.2141 2600.0 726.6108 2800.0 728.2039 2700.0 757.7662 2600.0 END IONS BEGIN IONS SCANS=732 PEPMASS=932.6307 CHARGE=1 COLLISION_ENERGY=0.0 77.0387 25000.0 78.2512 2200.0 78.316 16000.0 78.5889 2300.0 79.054 750000.0 79.7012 2200.0 80.2603 2300.0 81.0333 49000.0 81.0697 3000000.0 81.0778 3500.0 81.4995 2500.0 82.1719 3700.0 83.0489 55000.0 83.0853 1100000.0 83.0941 2800.0 83.8118 2500.0 85.0225 5200.0 85.0281 1300000.0 85.0646 120000.0 85.101 910000.0 85.8777 4400.0 87.0435 6000.0 88.7723 3300.0 89.0595 100000.0 91.0326 4000.0 91.0388 900000.0 91.054 440000.0 92.9571 4600.0 93.0697 1200000.0 94.8754 2400.0 95.049 82000.0 95.0854 3600000.0 95.0923 4400.0 96.0443 35000.0 96.0963 4300.0 97.0214 4300.0 97.0282 710000.0 97.0646 130000.0 97.101 680000.0 99.0439 81000.0 99.0802 120000.0 99.1169 15000.0 100.2664 3100.0 101.0232 5600.0 101.0594 30000.0 102.9653 2200.0 103.0751 110000.0 105.0446 8000.0 105.0696 520000.0 107.0772 17000.0 107.0853 1100000.0 109.0281 52000.0 109.0646 44000.0 109.0927 4400.0 109.101 2300000.0 109.1094 8400.0 111.0803 94000.0 111.1166 190000.0 113.0959 53000.0 115.0388 53000.0 115.0544 2700.0 116.3553 4000.0 117.0546 3900.0 117.0697 210000.0 117.0907 48000.0 119.0756 3600.0 119.0853 680000.0 121.091 45000.0 121.1009 1500000.0 121.1099 2500.0 121.1107 6400.0 121.2039 2600.0 123.0802 68000.0 123.1069 5000.0 123.1166 1200000.0 125.0959 81000.0 125.1322 76000.0 127.0388 400000.0 127.0751 3000.0 129.0545 11000.0 129.3946 2300.0 131.0747 14000.0 131.0853 600000.0 131.1064 3900.0 133.101 790000.0 135.0803 11000.0 135.1056 8400.0 135.1166 1500000.0 135.1277 17000.0 137.0957 78000.0 137.1323 510000.0 139.1115 85000.0 139.1482 12000.0 141.0698 2900.0 143.0864 6000.0 144.0653 38000.0 145.0493 420000.0 145.101 620000.0 145.1214 7900.0 147.1038 5000.0 147.1166 720000.0 147.1297 5000.0 149.0957 42000.0 149.1183 14000.0 149.1323 1100000.0 149.1463 16000.0 151.1117 63000.0 151.1479 180000.0 153.1272 70000.0 156.8404 2300.0 157.1012 12000.0 157.486 4200.0 159.1024 21000.0 159.1167 700000.0 159.1325 5700.0 159.1382 5100.0 161.1183 6500.0 161.1323 710000.0 161.2345 2500.0 161.4302 2200.0 162.0766 3100.0 162.5862 2700.0 163.0599 110000.0 163.1121 48000.0 163.148 680000.0 164.4245 2600.0 165.1271 54000.0 165.1638 86000.0 167.143 17000.0 169.1017 6800.0 170.1716 3400.0 171.1169 41000.0 173.1325 810000.0 173.1498 11000.0 173.5203 7200.0 173.533 430000.0 173.5459 20000.0 175.1481 300000.0 175.1635 2500.0 177.1272 58000.0 177.1636 240000.0 178.1757 2400.0 179.1431 64000.0 179.1788 3100.0 181.1593 3400.0 183.1162 2500.0 185.1325 25000.0 186.8375 2400.0 187.148 470000.0 187.1665 9500.0 189.1637 58000.0 191.143 48000.0 191.1798 3100.0 193.1587 7300.0 193.8677 3000.0 195.1371 9900.0 199.1486 28000.0 201.1637 170000.0 201.1821 3700.0 203.1798 9700.0 205.1588 58000.0 206.1452 3600.0 206.8744 3800.0 209.154 6900.0 211.1479 3200.0 215.1794 60000.0 215.2 3500.0 217.1942 16000.0 219.1749 73000.0 219.2105 3000.0 221.2265 110000.0 223.1683 13000.0 225.5071 2500.0 233.2263 200000.0 235.1708 2400.0 237.1852 3400.0 237.2217 3100.0 239.2368 570000.0 239.9236 2400.0 241.1955 7700.0 243.2105 1100000.0 245.2258 4700.0 247.1716 4000.0 249.9734 2400.0 257.2472 710000.0 259.2055 44000.0 261.2209 4000000.0 261.2456 5400.0 261.2546 4400.0 272.2914 2400.0 275.2021 13000.0 277.2163 62000.0 279.1989 18000.0 279.232 110000.0 287.6415 2800.0 290.1893 2600.0 291.2316 70000.0 299.2372 57000.0 299.4754 2900.0 301.2176 2400.0 303.03 2400.0 305.249 3100.0 311.255 3200.0 313.1896 13000.0 313.2737 11000000.0 313.3571 6300.0 314.2876 2700.0 317.0869 2400.0 317.2476 510000.0 333.2417 17000.0 335.2214 9400.0 335.2579 6800000.0 336.2603 3200.0 345.9736 2400.0 353.2651 4700.0 374.1974 2400.0 383.0246 2700.0 383.564 2500.0 394.8692 2200.0 403.5456 2700.0 412.2527 3000.0 452.7477 2700.0 453.9497 2400.0 459.3342 3300.0 474.751 4500.0 477.9419 2500.0 481.4437 10000.0 490.2188 2600.0 499.4494 90000.0 519.4103 2300.0 558.6247 2700.0 572.8602 2600.0 573.4871 1400000.0 573.5901 4900.0 574.113 2500.0 591.5016 2500.0 607.3811 4500.0 624.3607 2500.0 626.3514 2900.0 641.8248 5300.0 697.0721 2600.0 699.7314 2900.0 753.0384 2600.0 776.2699 3100.0 803.2523 3100.0 817.1208 2900.0 860.8926 3700.0 895.9207 2400.0 END IONS BEGIN IONS SCANS=733 PEPMASS=583.415 CHARGE=1 COLLISION_ENERGY=0.0 67.0542 3200.0 68.2352 2300.0 69.0695 2800.0 69.8261 2400.0 73.363 2400.0 81.0695 12000.0 83.0852 12000.0 84.2525 2300.0 88.8651 2400.0 93.0695 17000.0 95.0486 2800.0 95.085 17000.0 96.7823 2200.0 96.9053 2200.0 97.0644 9200.0 103.6424 2400.0 105.0437 2700.0 105.0693 18000.0 107.085 24000.0 109.1007 9900.0 112.3704 2400.0 113.0958 4700.0 119.0851 26000.0 121.1008 28000.0 123.0799 6800.0 131.0851 9900.0 133.1008 17000.0 135.1165 10000.0 137.0948 3200.0 139.1111 5100.0 143.0851 4800.0 145.1007 23000.0 147.0802 4200.0 147.1164 13000.0 151.0747 8700.0 157.1009 18000.0 159.1166 13000.0 161.1326 4200.0 163.1126 3100.0 165.0909 29000.0 169.1018 7900.0 171.1169 15000.0 173.1323 11000.0 173.5201 12000.0 173.5381 49000.0 175.1481 3500.0 181.1013 2900.0 183.1163 11000.0 185.1323 11000.0 187.1477 3300.0 189.127 3000.0 195.1165 4700.0 197.1319 11000.0 199.1484 3800.0 203.1428 12000.0 207.1372 3100.0 209.1325 14000.0 211.1468 6900.0 221.1536 34000.0 223.1494 3700.0 237.1632 2700.0 249.1635 3900.0 250.4106 2800.0 265.1948 2700.0 267.1139 2400.0 275.1811 2800.0 281.2954 39000.0 282.2796 120000.0 283.2826 150000.0 295.2022 2600.0 299.3058 36000.0 300.3092 43000.0 403.2992 2600.0 454.4863 2800.0 503.3521 3900.0 583.411 6700.0 END IONS BEGIN IONS SCANS=734 PEPMASS=600.4171 CHARGE=1 COLLISION_ENERGY=0.0 67.0541 39000.0 69.0334 31000.0 69.0698 38000.0 71.0492 9200.0 74.2891 2600.0 76.5739 2400.0 77.0386 5500.0 78.2688 2300.0 79.0542 37000.0 80.0623 2400.0 81.0698 110000.0 83.0491 51000.0 83.0854 37000.0 85.0647 22000.0 87.0439 14000.0 87.3015 2600.0 89.0595 140000.0 91.0542 47000.0 93.0697 190000.0 93.0768 4400.0 95.0491 71000.0 95.0855 160000.0 96.0889 8100.0 96.5307 2400.0 97.0647 61000.0 97.101 3800.0 102.3664 2400.0 105.0619 3600.0 105.0698 160000.0 106.0781 4000.0 106.9701 2400.0 107.0498 3400.0 107.0853 210000.0 107.0934 5200.0 109.0647 62000.0 109.1011 89000.0 111.0441 6700.0 111.0805 34000.0 113.0958 22000.0 113.3097 2400.0 115.0543 3000.0 117.0699 30000.0 119.0497 4900.0 119.0854 250000.0 119.0956 3300.0 120.0928 13000.0 121.0648 39000.0 121.091 3400.0 121.1011 260000.0 121.1105 5000.0 122.0721 2900.0 122.1043 12000.0 123.0436 4200.0 123.0803 120000.0 123.1168 26000.0 125.0596 38000.0 125.0961 53000.0 128.0626 6900.0 129.0697 24000.0 130.0781 5400.0 131.0854 110000.0 132.0932 14000.0 133.0291 2600.0 133.0646 29000.0 133.0858 77000.0 133.1011 200000.0 133.1127 3900.0 134.1079 4500.0 134.3132 2700.0 135.0803 100000.0 135.1167 89000.0 135.1459 2300.0 136.0842 2500.0 137.0598 16000.0 137.096 75000.0 139.0755 23000.0 139.1118 35000.0 141.0703 3100.0 142.0778 21000.0 143.0854 140000.0 144.093 52000.0 145.065 8200.0 145.0893 2700.0 145.1011 270000.0 145.1142 4600.0 146.108 16000.0 147.0804 140000.0 147.1168 83000.0 148.0878 7500.0 149.096 73000.0 149.1324 6000.0 150.1031 6400.0 151.0753 130000.0 151.1117 21000.0 152.0812 4300.0 153.0911 16000.0 155.0856 30000.0 155.107 12000.0 156.0932 27000.0 157.086 5400.0 157.1011 320000.0 158.108 47000.0 159.0805 51000.0 159.1167 190000.0 160.0882 53000.0 160.1225 11000.0 161.0961 130000.0 161.1324 61000.0 162.1027 6800.0 163.0755 5000.0 163.1116 120000.0 164.1173 8100.0 165.0681 3700.0 165.0911 390000.0 165.1258 3500.0 166.0946 27000.0 167.0883 12000.0 167.1068 83000.0 169.1012 92000.0 170.1088 38000.0 171.0809 12000.0 171.1169 200000.0 172.0885 5900.0 172.1238 57000.0 173.0963 63000.0 173.1325 110000.0 173.5103 3000.0 173.531 99000.0 173.5395 26000.0 174.1038 5200.0 174.14 3600.0 175.1119 110000.0 175.1483 50000.0 176.1186 6100.0 177.0909 24000.0 177.1115 7400.0 177.1275 36000.0 178.0993 13000.0 179.0874 7200.0 179.1071 40000.0 179.1431 13000.0 180.097 4100.0 180.1148 21000.0 180.1476 2300.0 181.0853 8300.0 181.1016 43000.0 181.1222 56000.0 182.1088 17000.0 182.1264 3400.0 183.0804 2800.0 183.1169 120000.0 184.1233 27000.0 185.0963 24000.0 185.1326 150000.0 186.1037 7000.0 186.1401 25000.0 187.112 49000.0 187.1478 41000.0 188.1194 7100.0 189.0912 3600.0 189.1274 93000.0 190.135 67000.0 191.1069 25000.0 191.1429 45000.0 193.1017 34000.0 193.1224 66000.0 194.1088 9900.0 195.1168 110000.0 195.1385 16000.0 196.1237 29000.0 197.0967 16000.0 197.1152 3500.0 197.1326 140000.0 198.1044 12000.0 198.1383 20000.0 199.1118 51000.0 199.1482 59000.0 200.1191 5800.0 201.1277 51000.0 201.1631 4200.0 202.1339 2800.0 203.1089 2900.0 203.1432 240000.0 203.165 5100.0 204.147 22000.0 205.102 3400.0 205.1226 13000.0 205.1604 3100.0 206.1095 3200.0 206.1301 3700.0 207.1169 53000.0 207.1384 100000.0 208.1244 28000.0 208.1454 29000.0 209.0972 4600.0 209.1325 100000.0 209.1538 14000.0 210.1045 3200.0 210.1393 29000.0 211.1118 37000.0 211.1482 84000.0 212.1193 10000.0 212.1543 7600.0 213.1274 67000.0 213.1641 28000.0 214.1332 11000.0 215.1067 15000.0 215.1432 36000.0 216.1508 10000.0 217.1222 16000.0 217.1593 17000.0 218.13 6700.0 218.1659 4200.0 219.1169 13000.0 219.1385 54000.0 220.1242 8800.0 220.1463 5800.0 221.1324 57000.0 221.1539 430000.0 222.1371 5200.0 222.1575 31000.0 223.1121 13000.0 223.1483 88000.0 224.1546 12000.0 225.1276 44000.0 225.1641 54000.0 227.1433 37000.0 227.1808 6800.0 228.1501 3400.0 229.1226 15000.0 229.1591 25000.0 230.1313 5500.0 230.165 2600.0 231.1387 12000.0 231.1746 6500.0 232.1238 6200.0 233.1315 24000.0 233.1541 140000.0 234.1375 2900.0 234.1607 56000.0 235.148 55000.0 235.1708 3800.0 236.1549 9600.0 237.1257 13000.0 237.1492 72000.0 237.1661 3400.0 238.1348 3500.0 238.1709 9700.0 239.1432 24000.0 239.1791 22000.0 240.1509 4100.0 241.1588 24000.0 243.1385 12000.0 243.1752 5300.0 245.1304 10000.0 245.1546 12000.0 246.1383 6000.0 246.1618 7800.0 247.1313 2700.0 247.1454 19000.0 247.17 58000.0 248.1529 3900.0 249.1294 4800.0 249.1638 53000.0 250.1601 7300.0 251.1437 13000.0 251.1795 29000.0 252.1848 6800.0 253.1585 43000.0 253.1923 9600.0 254.1671 3100.0 255.1432 4800.0 255.1744 120000.0 256.1827 4400.0 257.1539 10000.0 257.1914 10000.0 259.1449 11000.0 259.1697 29000.0 261.1632 67000.0 262.1703 5500.0 263.1422 7600.0 263.1793 30000.0 265.1585 16000.0 265.1942 21000.0 267.1431 3700.0 267.1749 30000.0 267.2029 2700.0 268.1813 15000.0 269.1544 7900.0 269.1901 30000.0 270.1969 10000.0 271.1695 46000.0 272.1795 5100.0 273.1863 18000.0 274.1657 2900.0 274.1934 47000.0 275.1498 2900.0 275.1792 16000.0 276.1864 3900.0 277.1603 9500.0 277.1949 28000.0 278.1714 3100.0 279.1746 55000.0 279.2087 8200.0 280.1823 3400.0 281.1571 9700.0 281.1904 46000.0 282.1986 4100.0 283.1717 9800.0 283.207 4900.0 285.1856 51000.0 286.193 83000.0 287.2011 64000.0 289.0227 2600.0 289.195 17000.0 290.1997 2600.0 291.174 11000.0 291.2091 11000.0 293.1898 15000.0 294.1982 15000.0 295.1702 5800.0 295.2066 39000.0 296.1732 3000.0 297.1856 44000.0 298.1939 3800.0 299.2012 63000.0 300.2087 5300.0 301.1948 11000.0 303.1961 150000.0 305.1907 8900.0 306.235 2800.0 307.2065 15000.0 309.1845 20000.0 309.2229 11000.0 309.3401 2500.0 310.1926 15000.0 311.2022 15000.0 312.2089 19000.0 313.1857 2800.0 313.2165 59000.0 315.2105 7200.0 317.2269 4000.0 319.2056 30000.0 321.2221 3600.0 322.2299 6900.0 323.2003 8700.0 325.2167 43000.0 329.2301 3700.0 331.2062 3400.0 332.2139 2900.0 333.2217 7500.0 334.2313 2700.0 336.5795 2700.0 337.2166 92000.0 338.2222 3300.0 339.2321 6600.0 341.2288 3000.0 347.2369 16000.0 349.2158 8000.0 350.2186 3700.0 351.2331 13000.0 352.2394 210000.0 359.2372 7800.0 363.2323 11000.0 364.2377 3400.0 365.2477 110000.0 373.2551 3300.0 375.2738 3400.0 377.2482 19000.0 379.2622 3800.0 381.2429 3800.0 383.2619 3000.0 387.2682 6000.0 391.2627 4900.0 397.2725 3300.0 403.2595 4000.0 405.2825 6200.0 419.2962 4500.0 421.2733 5400.0 428.7787 2600.0 437.3062 4500.0 469.3078 6900.0 487.32 43000.0 502.3429 6000.0 503.3516 55000.0 505.3311 32000.0 507.3471 18000.0 508.3454 7200.0 520.3546 25000.0 567.381 3900.0 585.3961 6400.0 589.3093 3000.0 600.4176 3300.0 END IONS BEGIN IONS SCANS=735 PEPMASS=599.4101 CHARGE=1 COLLISION_ENERGY=0.0 64.2178 2500.0 65.2061 2500.0 67.054 17000.0 69.0334 10000.0 69.0698 11000.0 71.0492 2900.0 76.7699 2700.0 79.054 12000.0 81.0697 35000.0 83.049 17000.0 83.0854 20000.0 85.0646 10000.0 87.0436 2600.0 91.0541 8200.0 93.0697 55000.0 93.0762 4100.0 94.5737 2300.0 95.0489 20000.0 95.0853 42000.0 97.0646 36000.0 97.101 3300.0 105.0697 35000.0 107.0853 61000.0 109.065 13000.0 109.1011 24000.0 111.0801 10000.0 113.0959 23000.0 117.0696 2800.0 119.0853 61000.0 121.0649 13000.0 121.0921 3500.0 121.101 84000.0 123.0803 29000.0 123.1162 8400.0 125.0597 11000.0 125.0959 18000.0 129.0695 2600.0 131.0854 29000.0 133.0648 6900.0 133.1011 45000.0 135.0804 25000.0 135.1167 24000.0 137.096 31000.0 139.1116 24000.0 143.0855 37000.0 144.093 8800.0 145.1011 69000.0 147.0802 52000.0 147.1167 18000.0 149.096 18000.0 149.6863 5100.0 149.7075 2900.0 151.0751 46000.0 151.1111 2500.0 153.0909 3600.0 153.1275 8100.0 155.0857 9100.0 155.1062 9600.0 156.0931 3600.0 157.101 64000.0 158.1091 2500.0 159.0801 13000.0 159.1167 38000.0 159.2739 2400.0 161.0961 23000.0 161.1325 23000.0 162.6475 2400.0 163.1117 30000.0 165.091 190000.0 167.1066 30000.0 169.1012 27000.0 170.1092 3400.0 171.1169 43000.0 173.0958 11000.0 173.1328 26000.0 173.5287 35000.0 173.537 4100.0 173.5469 4300.0 175.1119 14000.0 175.1475 9800.0 177.0904 2900.0 177.1267 3200.0 179.143 12000.0 181.1023 11000.0 181.1224 30000.0 183.1169 32000.0 185.096 8100.0 185.1327 26000.0 187.1113 12000.0 187.1488 11000.0 189.1275 21000.0 190.1347 2800.0 191.1071 6700.0 191.1432 12000.0 193.1014 9500.0 193.1222 3300.0 194.1087 3300.0 195.1168 24000.0 195.1365 8700.0 197.1325 37000.0 199.1114 9500.0 199.1478 12000.0 201.1271 12000.0 201.1641 3700.0 203.1432 84000.0 205.1579 3100.0 207.1168 12000.0 207.1383 29000.0 208.1248 3900.0 209.1327 30000.0 211.1113 5700.0 211.1486 23000.0 213.1282 9400.0 213.1643 3200.0 215.1432 11000.0 219.1171 3500.0 221.1322 18000.0 221.1539 150000.0 222.1401 3600.0 223.1482 27000.0 224.5936 2400.0 225.1271 4600.0 225.1634 9800.0 227.1433 8600.0 227.5593 2600.0 229.121 3400.0 229.1591 8900.0 231.139 6500.0 233.1306 9000.0 233.154 62000.0 235.1481 15000.0 237.1665 3800.0 239.1434 5100.0 239.1804 4600.0 241.1566 2600.0 247.1447 5100.0 247.1696 20000.0 249.164 4800.0 251.1795 11000.0 253.1587 3000.0 255.1748 5800.0 257.189 2500.0 259.1482 3300.0 259.1721 4100.0 261.1636 5200.0 263.1801 13000.0 265.1946 6800.0 269.1899 12000.0 273.1869 6200.0 275.1797 4100.0 281.1904 15000.0 285.1865 9100.0 286.1925 11000.0 287.2012 24000.0 289.0461 2600.0 289.1984 2500.0 291.1743 4800.0 293.189 2900.0 295.2069 4700.0 298.1947 4800.0 299.2006 20000.0 311.2016 5300.0 312.2077 8600.0 313.2179 4900.0 349.2158 2800.0 364.2397 5800.0 365.2463 5500.0 378.6661 2500.0 391.2626 3000.0 413.2724 8400.0 439.9656 2400.0 507.344 14000.0 597.8586 2500.0 599.4095 10000.0 END IONS BEGIN IONS SCANS=736 PEPMASS=638.4397 CHARGE=1 COLLISION_ENERGY=0.0 65.6192 2200.0 65.8431 2500.0 67.0538 80000.0 68.3273 2100.0 69.0694 190000.0 69.9961 2900.0 71.0488 20000.0 71.0851 140000.0 73.0817 2300.0 75.2534 2400.0 76.6423 2600.0 79.0539 21000.0 81.0694 180000.0 83.0488 17000.0 83.085 310000.0 85.0645 20000.0 85.1007 120000.0 88.7498 2600.0 92.5293 2200.0 93.0693 81000.0 95.085 230000.0 97.0643 69000.0 97.1006 120000.0 97.2648 2400.0 99.0801 4200.0 99.1171 2600.0 99.2286 2400.0 99.9862 2600.0 100.5685 2400.0 101.0592 17000.0 104.7981 2300.0 107.0849 84000.0 109.1006 160000.0 111.0799 78000.0 111.1165 16000.0 115.0748 24000.0 121.1006 54000.0 123.1163 83000.0 125.0954 39000.0 125.1319 30000.0 125.6453 2500.0 127.3475 2800.0 129.0907 8300.0 134.4819 2400.0 137.1321 28000.0 143.1432 2500.0 146.9069 2600.0 148.4062 2600.0 149.1183 2700.0 149.1319 440000.0 149.1462 7000.0 149.6798 3400.0 149.6903 4700.0 149.9888 2400.0 151.1477 6100.0 153.8578 2400.0 154.5159 2100.0 155.0096 39000.0 167.1277 9700.0 167.1426 260000.0 173.5271 86000.0 173.5401 44000.0 185.1531 45000.0 185.2496 2500.0 186.0203 2900.0 195.5706 2100.0 196.8069 2500.0 202.945 2400.0 218.7561 2800.0 221.2257 20000.0 222.9452 2800.0 224.6627 2400.0 228.1955 86000.0 239.2365 95000.0 241.1794 230000.0 245.873 2500.0 257.2466 11000.0 259.1899 62000.0 282.2794 19000.0 284.8126 2700.0 309.879 2400.0 310.313 3000.0 313.2737 110000.0 393.2403 2600.0 496.4989 2700.0 497.3347 3400.0 497.4196 540000.0 497.5051 6400.0 578.2835 6700.0 END IONS BEGIN IONS SCANS=737 PEPMASS=721.4524 CHARGE=1 COLLISION_ENERGY=0.0 69.0696 15000.0 77.0384 2500.0 78.0284 2700.0 79.0539 97000.0 81.0331 2500.0 81.0696 90000.0 83.0489 9900.0 83.0851 19000.0 84.7962 2600.0 91.0539 53000.0 93.0695 130000.0 95.0488 18000.0 95.0852 76000.0 97.028 2400.0 97.0646 8000.0 97.1006 6100.0 105.0696 61000.0 107.0852 52000.0 109.0642 2500.0 109.1008 31000.0 109.1088 2400.0 117.0694 7600.0 119.0852 41000.0 121.1009 42000.0 123.0804 15000.0 123.1165 7500.0 129.0695 23000.0 131.0853 17000.0 133.1009 30000.0 135.1165 29000.0 143.0855 16000.0 145.0141 2700.0 145.1008 28000.0 147.1165 110000.0 148.9977 3200.0 149.132 19000.0 159.1164 5500.0 161.096 9500.0 161.1326 38000.0 167.2289 2200.0 169.1271 2800.0 171.1167 66000.0 173.1327 6900.0 173.5289 62000.0 173.5452 4800.0 177.7426 2400.0 189.1274 30000.0 199.1476 2500.0 207.1382 38000.0 224.6724 2400.0 243.2096 3800.0 261.2215 21000.0 281.1752 74000.0 292.166 2600.0 293.1803 3000.0 313.6723 2400.0 320.7377 2500.0 335.2586 52000.0 336.415 2600.0 389.2046 2400.0 441.2132 3300.0 478.3005 2600.0 521.3103 5000.0 541.3895 33000.0 574.2256 2800.0 585.745 2900.0 721.4508 14000.0 END IONS BEGIN IONS SCANS=738 PEPMASS=743.4345 CHARGE=1 COLLISION_ENERGY=0.0 69.033 30000.0 69.0369 4100.0 69.0695 10000.0 71.0489 3200.0 71.9037 2200.0 72.4671 2200.0 72.754 2200.0 73.0279 48000.0 73.7785 2200.0 79.0536 52000.0 80.2464 2200.0 80.5758 2500.0 81.033 22000.0 81.0692 100000.0 82.0726 2200.0 82.6033 82000.0 82.6066 17000.0 83.0851 16000.0 85.0278 92000.0 87.0436 2400.0 89.4949 2700.0 89.6259 2200.0 90.666 2200.0 91.0384 87000.0 91.0536 30000.0 93.0692 84000.0 95.0485 2600.0 95.0848 93000.0 97.0226 2500.0 97.0277 80000.0 97.1005 6500.0 99.0433 13000.0 101.0227 31000.0 102.3812 2500.0 103.0384 8900.0 105.0692 30000.0 107.0849 46000.0 109.0278 15000.0 109.1005 52000.0 111.042 2400.0 111.08 3000.0 115.0379 2500.0 116.6971 4700.0 117.4516 2500.0 119.0847 22000.0 119.096 5000.0 120.738 2800.0 121.1005 53000.0 123.1161 27000.0 124.7129 2300.0 127.0383 56000.0 129.07 3300.0 131.085 11000.0 133.1005 27000.0 135.1163 40000.0 137.1325 2600.0 140.1479 2600.0 141.4803 2300.0 142.037 2900.0 143.1348 2200.0 145.0488 16000.0 145.1004 14000.0 147.1162 53000.0 147.9259 2700.0 149.1314 18000.0 154.3751 3300.0 159.1165 6700.0 159.233 2500.0 161.0963 2300.0 161.1321 32000.0 163.148 2300.0 171.1004 2500.0 171.1161 42000.0 173.1318 8500.0 173.5176 3000.0 173.5322 180000.0 173.5455 9400.0 175.1475 3400.0 183.0646 3100.0 184.0726 6300.0 185.0415 48000.0 187.1489 3700.0 189.1268 8300.0 195.8407 2400.0 201.0751 2900.0 203.0523 21000.0 207.1376 34000.0 209.0569 2400.0 211.7025 2800.0 241.0692 3400.0 243.0831 95000.0 247.1296 130000.0 260.6 2400.0 261.2204 24000.0 275.6565 2400.0 278.9564 2500.0 281.1744 46000.0 301.2136 5900.0 303.1563 30000.0 309.1696 3400.0 325.134 2500.0 335.2575 130000.0 363.2511 4600.0 371.0277 2600.0 403.6929 3000.0 439.9418 3000.0 465.1302 2300.0 465.2091 1400000.0 465.2853 5100.0 467.3095 2800.0 497.31 10000.0 503.0266 3300.0 519.1995 3700.0 519.2924 1500000.0 519.3819 5700.0 524.1138 2500.0 563.3735 6400.0 581.3812 84000.0 602.5196 8400.0 602.5319 3100.0 606.1254 2900.0 730.8585 2500.0 743.2748 9100.0 743.4335 2300000.0 743.744 5600.0 END IONS BEGIN IONS SCANS=739 PEPMASS=631.2529 CHARGE=1 COLLISION_ENERGY=0.0 67.834 2200.0 67.8388 2000.0 70.6416 2100.0 74.2991 2200.0 80.6717 2200.0 85.6791 2800.0 90.5069 2100.0 93.3465 2300.0 99.0351 2900.0 100.0689 2300.0 107.2915 2500.0 111.5953 2300.0 149.133 2300.0 173.5207 5700.0 173.5316 54000.0 173.5393 18000.0 193.087 2500.0 194.7345 2500.0 204.9403 2600.0 215.007 2500.0 268.2389 2800.0 274.4606 2400.0 352.5226 2500.0 360.5081 2400.0 455.2159 2900.0 460.2223 2400.0 477.6374 2500.0 482.2106 4700.0 491.2413 11000.0 498.2014 2900.0 499.2101 13000.0 509.2301 15000.0 511.2472 17000.0 513.2242 3400.0 514.2364 3800.0 522.1988 8100.0 526.199 2500.0 531.2372 3000.0 533.2544 31000.0 537.2258 200000.0 540.213 19000.0 543.2714 20000.0 553.2202 7700.0 555.2364 100000.0 557.2152 3700.0 558.2238 12000.0 565.0618 2900.0 569.2532 7600.0 571.2327 16000.0 572.2382 46000.0 581.2158 320000.0 581.3212 5300.0 585.5312 3200.0 587.2634 59000.0 599.2249 7900.0 613.2423 17000.0 631.252 61000.0 END IONS BEGIN IONS SCANS=740 PEPMASS=738.4788 CHARGE=1 COLLISION_ENERGY=0.0 69.0695 54000.0 71.0491 3600.0 73.0647 3000.0 79.0538 310000.0 80.1794 2500.0 80.9479 2500.0 81.0332 10000.0 81.0694 300000.0 83.0488 36000.0 83.085 61000.0 84.8164 2100.0 85.0645 14000.0 90.1346 2200.0 91.0483 4300.0 91.0536 170000.0 92.9095 2400.0 93.063 3200.0 93.0694 420000.0 93.0766 4800.0 95.0488 61000.0 95.0784 2700.0 95.085 270000.0 95.0926 3600.0 96.8559 2200.0 96.9044 2200.0 97.0645 29000.0 97.1007 38000.0 98.1589 2500.0 99.0802 12000.0 105.0445 7200.0 105.0693 170000.0 107.0489 20000.0 107.0773 2700.0 107.085 180000.0 109.0644 36000.0 109.1007 110000.0 109.7612 3000.0 111.0799 19000.0 111.1162 2500.0 113.0956 3000.0 114.4468 2400.0 117.0696 36000.0 119.0766 2800.0 119.085 130000.0 120.9656 34000.0 121.0643 13000.0 121.0924 6100.0 121.1007 170000.0 121.4601 3100.0 123.0799 48000.0 123.1163 46000.0 125.0958 6200.0 127.0753 13000.0 129.0694 74000.0 129.5272 2300.0 131.085 47000.0 131.6505 2600.0 133.0919 2200.0 133.1007 110000.0 135.0799 2400.0 135.1163 110000.0 137.0956 6300.0 137.1322 18000.0 141.0908 7100.0 143.0852 39000.0 145.1008 100000.0 147.0802 16000.0 147.1039 4500.0 147.1163 350000.0 149.1321 63000.0 151.1477 2500.0 156.8594 2800.0 157.1001 2900.0 159.1164 53000.0 161.0959 35000.0 161.1321 160000.0 162.9525 2800.0 163.1111 13000.0 163.1475 24000.0 164.0078 29000.0 169.1008 3500.0 171.1033 2400.0 171.1164 260000.0 172.0172 2700.0 173.1322 34000.0 173.5234 47000.0 173.5384 63000.0 173.5439 11000.0 175.1479 21000.0 177.1278 2900.0 177.1628 3600.0 179.1429 12000.0 187.1138 3700.0 187.1478 17000.0 189.1269 120000.0 207.1377 190000.0 220.7003 2200.0 225.1484 5400.0 242.7141 2200.0 243.2102 31000.0 261.221 89000.0 263.2374 3300.0 281.1749 400000.0 281.2101 4300.0 304.2643 7700.0 306.2785 9700.0 317.2473 6000.0 335.2581 350000.0 337.2708 2300.0 348.101 2500.0 352.7203 2300.0 366.125 2400.0 420.7449 2300.0 446.1389 2800.0 467.8197 2300.0 527.5475 2500.0 541.3886 200000.0 541.4742 4400.0 575.5016 16000.0 597.4875 56000.0 END IONS BEGIN IONS SCANS=741 PEPMASS=609.2712 CHARGE=1 COLLISION_ENERGY=0.0 64.1375 34000.0 64.1395 12000.0 65.6931 24000.0 65.6959 87000.0 67.6941 42000.0 67.6976 150000.0 68.2793 7200.0 74.9322 6600.0 101.8527 4800.0 115.2147 5100.0 141.4365 7600.0 144.9567 5300.0 173.521 49000.0 173.5373 180000.0 200.2934 4100.0 237.1387 6600.0 238.1454 4900.0 239.154 47000.0 251.1521 9700.0 257.5132 6200.0 263.5922 4900.0 353.7094 8400.0 407.2232 50000.0 420.2294 56000.0 421.237 82000.0 422.2464 44000.0 428.6642 8200.0 434.2459 9400.0 444.2311 8900.0 447.1762 4900.0 448.2207 5100.0 449.2306 7900.0 457.2356 51000.0 459.2174 280000.0 460.2259 65000.0 461.1885 19000.0 461.1985 36000.0 462.2048 18000.0 463.2124 61000.0 472.2261 41000.0 473.2324 27000.0 474.2428 7600.0 475.2137 280000.0 476.2215 380000.0 477.2299 230000.0 478.2352 64000.0 485.2329 960000.0 486.2052 320000.0 487.2178 26000.0 487.2449 67000.0 488.2197 23000.0 489.2275 150000.0 490.2362 6100.0 493.2224 48000.0 494.2665 150000.0 497.2336 79000.0 499.2127 510000.0 499.2962 5900.0 500.2188 120000.0 502.237 37000.0 503.1584 8800.0 503.2434 1000000.0 504.227 110000.0 504.2428 120000.0 505.2275 140000.0 507.2245 5800.0 507.2361 14000.0 513.228 240000.0 514.2393 27000.0 515.2437 1400000.0 517.2228 430000.0 518.2307 130000.0 519.2405 33000.0 521.2516 640000.0 522.2563 52000.0 531.2383 3900000.0 532.2434 36000.0 533.2534 150000.0 534.2266 6000.0 535.2337 97000.0 536.24 40000.0 541.1302 5800.0 541.2228 390000.0 544.2084 8000.0 545.2532 24000.0 548.2415 110000.0 549.2493 990000.0 549.3468 8900.0 550.1584 41000.0 550.2571 1600000.0 550.3557 9500.0 559.0248 7100.0 559.2338 2600000.0 560.2489 5800.0 563.2649 640000.0 573.2518 15000.0 577.1387 7400.0 577.2442 880000.0 577.3497 4800.0 578.2533 5300.0 581.2743 120000.0 591.2601 3000000.0 594.246 49000.0 609.2704 4600000.0 END IONS BEGIN IONS SCANS=742 PEPMASS=625.2662 CHARGE=1 COLLISION_ENERGY=0.0 64.5764 2400.0 78.2475 2400.0 80.7709 2800.0 96.9383 2700.0 120.0803 2200.0 138.1702 2600.0 138.6883 2100.0 141.1236 2500.0 173.529 98000.0 173.5444 14000.0 221.7414 2200.0 241.9817 2300.0 244.5065 2500.0 280.5939 2600.0 283.4216 2300.0 310.9354 2700.0 364.8816 2800.0 371.4784 2300.0 405.2091 30000.0 406.2193 6600.0 419.2247 17000.0 420.2313 740000.0 421.2393 30000.0 424.226 31000.0 433.2395 40000.0 434.2472 91000.0 445.2022 4300.0 447.2154 9200.0 448.2262 110000.0 449.1281 3000.0 449.2339 210000.0 449.2999 3100.0 451.2127 36000.0 452.2212 250000.0 459.2188 120000.0 460.2261 340000.0 461.1978 3600.0 461.2386 8900.0 462.2057 97000.0 463.2131 52000.0 464.2231 3500.0 465.229 190000.0 466.2365 14000.0 475.2135 330000.0 476.2209 150000.0 477.2289 1000000.0 477.3095 9100.0 478.2355 19000.0 479.2451 32000.0 480.2547 10000.0 487.2134 16000.0 488.2191 15000.0 489.2274 25000.0 490.2355 4400.0 491.2127 40000.0 491.2398 12000.0 492.252 360000.0 493.2572 110000.0 501.2289 30000.0 502.2355 28000.0 503.1116 3000.0 503.2438 230000.0 503.3077 2500.0 504.2503 23000.0 505.2249 4100.0 505.2379 2700.0 507.2376 27000.0 508.2528 4900.0 509.2196 46000.0 518.2314 120000.0 519.2372 20000.0 520.2148 6600.0 521.2213 520000.0 523.1509 2100.0 523.2342 110000.0 531.2386 4700.0 533.2192 62000.0 534.2261 22000.0 535.2345 260000.0 536.2419 300000.0 536.3171 2500.0 537.2497 54000.0 538.2583 46000.0 547.2342 100000.0 548.2416 41000.0 549.2502 180000.0 563.2658 50000.0 565.2457 99000.0 567.3711 16000.0 579.2527 19000.0 580.2641 3300.0 593.241 60000.0 595.2632 3200.0 598.6135 3000.0 607.2543 7100.0 608.2635 110000.0 625.4158 6700.0 END IONS BEGIN IONS SCANS=743 PEPMASS=829.5075 CHARGE=1 COLLISION_ENERGY=0.0 107.0848 2700.0 126.0614 2700.0 141.0222 2500.0 173.5285 35000.0 180.621 2400.0 184.8832 2700.0 258.715 2700.0 333.2035 17000.0 387.0541 2700.0 519.2922 27000.0 551.2819 48000.0 551.3734 2500.0 605.9703 2500.0 667.4565 4600.0 829.5056 81000.0 END IONS BEGIN IONS SCANS=744 PEPMASS=236.1678 CHARGE=1 COLLISION_ENERGY=0.0 43.7559 2300.0 43.8184 2100.0 43.8465 2000.0 44.1413 2400.0 44.1554 2100.0 44.883 2200.0 44.9133 2500.0 45.0333 3000.0 45.0644 2800.0 45.8128 2300.0 45.8823 2200.0 46.1469 2200.0 46.3958 2200.0 46.4975 2300.0 46.5933 2400.0 46.8924 2100.0 47.1646 2800.0 47.1931 2000.0 47.2422 2300.0 47.5324 2600.0 47.914 2200.0 48.9568 2400.0 49.0071 2700.0 49.6248 2600.0 49.6697 2700.0 49.9838 2300.0 50.142 2100.0 50.2411 2200.0 50.4009 2200.0 51.3215 2300.0 51.7844 2300.0 52.1679 2500.0 52.2473 2200.0 52.2863 2500.0 53.0126 2200.0 53.1093 2700.0 54.2976 2300.0 54.5844 2600.0 54.6606 2200.0 54.8618 2400.0 55.0956 2200.0 55.5568 2100.0 56.0492 1700000.0 56.3058 2400.0 56.6249 2200.0 56.8806 2200.0 57.0002 2600.0 57.0333 200000.0 57.0697 110000.0 57.589 2100.0 57.779 2400.0 57.9107 4600.0 58.0649 2200.0 58.073 22000.0 58.2979 2500.0 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91.0548 2200.0 91.0715 2700.0 91.1676 2200.0 91.2284 2400.0 92.4028 2500.0 92.5876 2100.0 92.9481 2100.0 93.0363 64000.0 94.8568 2300.0 95.0153 6600.0 95.0867 2300.0 95.2698 2500.0 96.8446 2600.0 97.4091 2600.0 97.7099 2200.0 98.7703 2800.0 98.8604 2400.0 99.4347 2200.0 99.9525 2900.0 101.7115 2500.0 101.802 2400.0 103.0572 5400.0 103.8251 2100.0 104.0703 520000.0 105.0726 850000.0 105.3623 2300.0 105.6791 2300.0 106.6215 2600.0 106.8669 2700.0 107.0519 310000.0 107.293 2500.0 109.0312 38000.0 111.0096 2600.0 112.0843 2600.0 112.299 2800.0 113.8172 2700.0 113.8994 2800.0 114.2594 2700.0 114.347 2200.0 114.3659 2400.0 114.8552 2500.0 115.0935 220000.0 115.1061 2400.0 115.2253 2200.0 115.2914 2900.0 115.9107 2200.0 117.0728 15000.0 118.1821 2300.0 118.7693 2800.0 120.0708 2700.0 120.701 2500.0 120.9904 2500.0 121.0677 14000.0 124.4113 2400.0 124.7383 4900.0 129.842 2200.0 130.9582 2700.0 130.9844 2400.0 133.104 490000.0 133.1927 2400.0 134.2042 2800.0 135.0832 290000.0 136.2301 2200.0 136.3107 2500.0 137.2013 2300.0 137.6454 2300.0 139.21 2800.0 141.2943 2100.0 142.9583 2600.0 143.0884 30000.0 143.3672 2500.0 144.507 2200.0 145.368 2500.0 145.9099 2500.0 146.4943 3000.0 147.9745 2400.0 148.4533 2500.0 149.681 13000.0 149.6909 25000.0 150.6639 2300.0 154.3653 2600.0 157.1808 2300.0 157.6281 2400.0 164.1862 2200.0 164.3328 2200.0 166.4925 2600.0 166.6615 2700.0 167.169 2600.0 167.466 2300.0 168.8895 2300.0 168.9681 2700.0 169.4993 2300.0 170.231 2500.0 171.1205 11000.0 171.6895 2300.0 172.8082 2700.0 173.1716 2500.0 173.5236 120000.0 173.5362 410000.0 173.549 5000.0 174.4364 2300.0 175.9072 2300.0 178.1217 2800.0 179.0715 3000.0 179.7948 2300.0 180.1102 3900.0 181.9027 3000.0 184.0347 2500.0 184.1105 2300.0 188.5522 2300.0 190.284 2100.0 193.9139 2500.0 194.221 2600.0 194.8533 2500.0 199.6916 2400.0 201.3898 2800.0 202.4043 2900.0 204.4026 2500.0 213.0787 2500.0 228.4653 2300.0 230.7708 2600.0 233.091 3200.0 235.8972 2400.0 240.7742 2400.0 241.3473 2600.0 245.4602 2600.0 246.8131 2800.0 END IONS BEGIN IONS SCANS=745 PEPMASS=357.2427 CHARGE=1 COLLISION_ENERGY=0.0 51.031 2500.0 51.1941 5400.0 52.8802 2600.0 53.0022 47000.0 53.0387 58000.0 54.3602 5300.0 54.9852 2400.0 55.0542 1400000.0 57.0698 720000.0 57.4306 4300.0 59.0137 12000.0 62.1392 2300.0 63.2204 3000.0 64.4374 5700.0 65.0387 21000.0 67.0501 4800.0 67.0542 1500000.0 68.9757 2200.0 69.0699 5800000.0 69.0733 7800.0 69.4984 4500.0 69.9149 4600.0 70.2272 2100.0 70.6614 8900.0 70.7663 2600.0 70.8153 3800.0 71.0855 120000.0 72.8109 3000.0 74.8509 4300.0 77.0393 50000.0 78.0481 3000.0 79.0542 500000.0 81.0699 7400000.0 81.0742 14000.0 82.6882 2000.0 83.0855 1500000.0 83.0913 4700.0 83.5111 5900.0 85.1012 70000.0 85.233 2300.0 86.3657 2400.0 91.0543 240000.0 93.0698 930000.0 94.0425 2600.0 95.0495 79000.0 95.0855 7700000.0 95.0999 16000.0 97.1011 2500000.0 102.4464 5400.0 103.0546 2600.0 105.0255 3500.0 105.0336 170000.0 105.0448 5500.0 105.0698 540000.0 106.0421 34000.0 106.8665 4400.0 107.0492 290000.0 107.0855 1200000.0 107.207 2400.0 108.3635 4000.0 109.0648 220000.0 109.0898 13000.0 109.1012 7200000.0 109.1103 24000.0 111.1167 370000.0 113.3724 3800.0 114.3012 5000.0 115.0548 26000.0 115.964 2400.0 117.0697 55000.0 119.0492 17000.0 119.077 4700.0 119.0855 490000.0 119.9757 5500.0 121.0283 28000.0 121.0647 590000.0 121.0912 11000.0 121.1011 1200000.0 121.1112 10000.0 123.0809 17000.0 123.1168 7200000.0 123.1248 5700.0 123.1251 24000.0 125.1324 82000.0 129.0697 30000.0 131.0494 39000.0 131.0856 110000.0 132.0571 26000.0 133.0284 120000.0 133.0648 310000.0 133.1011 86000.0 135.0441 600000.0 135.0802 120000.0 135.1055 9300.0 135.1168 1800000.0 137.0597 290000.0 137.1204 26000.0 137.1324 2200000.0 137.22 2700.0 141.0708 2900.0 142.59 5200.0 143.0857 24000.0 143.5019 3400.0 144.0578 4100.0 145.0282 37000.0 145.0649 170000.0 145.1013 40000.0 146.0727 55000.0 147.0441 400000.0 147.0804 480000.0 147.1166 64000.0 149.0598 120000.0 149.1183 2900.0 149.1325 2300000.0 149.1464 44000.0 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189.0912 180000.0 189.1276 18000.0 191.0506 23000.0 191.0703 1800000.0 191.0893 11000.0 191.1795 720000.0 193.0861 1800000.0 193.1065 19000.0 193.1954 210000.0 194.8678 3500.0 195.0797 12000.0 197.0957 26000.0 199.0756 270000.0 199.1118 150000.0 201.0694 12000.0 201.0911 1600000.0 201.1116 11000.0 201.1244 42000.0 203.0489 3100.0 203.0704 1000000.0 203.1069 120000.0 205.0861 1300000.0 205.1953 510000.0 206.0814 55000.0 207.1017 1000000.0 209.0963 44000.0 211.112 15000.0 213.0912 430000.0 213.1276 190000.0 215.1068 390000.0 215.1429 35000.0 215.3645 5700.0 217.086 490000.0 217.1223 66000.0 219.0769 9200.0 219.1017 1000000.0 221.1176 450000.0 223.1124 24000.0 225.1274 8400.0 227.1067 440000.0 227.1433 160000.0 229.1224 320000.0 231.1018 570000.0 231.129 4500.0 231.1375 3400.0 233.1175 930000.0 235.133 410000.0 237.129 4500.0 241.1224 450000.0 241.1583 110000.0 243.1381 420000.0 245.1174 470000.0 247.1329 400000.0 249.1479 79000.0 249.1767 3200.0 251.1433 18000.0 255.138 260000.0 257.1535 110000.0 259.1329 360000.0 261.1484 880000.0 269.1539 240000.0 273.1486 410000.0 275.1357 3000.0 275.1644 380000.0 281.7283 5900.0 283.1691 57000.0 287.1645 170000.0 289.1804 140000.0 297.2217 45000.0 301.18 140000.0 307.206 33000.0 315.1964 39000.0 325.1812 3200.0 325.2164 1700000.0 325.2594 13000.0 357.1888 5400.0 357.2423 7900000.0 357.3155 8600.0 357.3453 5000.0 END IONS BEGIN IONS SCANS=746 PEPMASS=625.2662 CHARGE=1 COLLISION_ENERGY=0.0 64.5847 6900.0 66.4383 2600.0 67.4709 5500.0 69.4722 7900.0 69.4758 5700.0 73.2122 4100.0 77.2787 4000.0 79.6861 6200.0 82.8434 2300.0 85.3998 2600.0 90.577 2300.0 90.5889 2400.0 129.9458 2400.0 166.4727 2300.0 168.1945 2300.0 173.5265 28000.0 173.5354 140000.0 173.5454 10000.0 174.3545 2400.0 177.7279 2400.0 179.1002 3100.0 188.9941 5200.0 197.7994 5400.0 200.1777 2800.0 203.7645 4400.0 232.1306 3800.0 237.1391 3300.0 239.1555 6900.0 244.0315 2500.0 248.0787 2700.0 268.1217 6100.0 269.1278 5500.0 281.1277 17000.0 287.2703 2800.0 293.6461 4400.0 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910000.0 503.3076 8900.0 504.2477 220000.0 505.225 52000.0 506.2312 34000.0 507.2367 3500.0 509.2183 290000.0 509.2924 7200.0 511.2314 10000.0 519.2375 63000.0 520.2454 36000.0 521.1603 15000.0 521.2544 1500000.0 521.3285 2100.0 522.2609 120000.0 523.1448 16000.0 523.2336 640000.0 523.3026 3500.0 524.2352 7100.0 526.2574 110000.0 529.2219 4300.0 531.2412 11000.0 534.227 56000.0 535.2319 7900.0 535.2738 14000.0 536.2413 19000.0 537.2493 660000.0 538.2573 4200000.0 547.1361 4300.0 547.2338 610000.0 548.2411 110000.0 549.2501 81000.0 550.2209 23000.0 551.2279 14000.0 563.2653 29000.0 565.1399 14000.0 565.245 2200000.0 566.2522 310000.0 566.3439 5900.0 567.3702 15000.0 575.2331 11000.0 579.2598 120000.0 581.2763 510000.0 589.2447 10000.0 593.2383 7600.0 597.2568 6500.0 607.2551 390000.0 610.2321 7800.0 625.2657 740000.0 625.3906 11000.0 END IONS BEGIN IONS SCANS=747 PEPMASS=667.2765 CHARGE=1 COLLISION_ENERGY=0.0 67.4708 16000.0 67.4744 5400.0 68.3508 5500.0 69.0289 40000.0 69.032 13000.0 72.1383 12000.0 72.142 36000.0 74.1392 3000.0 74.678 5200.0 75.581 5500.0 92.2523 2700.0 93.8141 2400.0 95.151 6800.0 96.224 2400.0 102.737 2400.0 113.849 2900.0 124.328 2600.0 125.1165 6400.0 129.0708 5900.0 138.6369 5400.0 144.4602 2500.0 173.5221 24000.0 173.5328 65000.0 173.5414 30000.0 174.3476 5200.0 192.1009 2900.0 193.7881 2400.0 197.7945 5200.0 212.0979 5400.0 242.0622 2700.0 242.2051 6400.0 289.0856 3100.0 330.16 4400.0 344.9021 6600.0 358.7556 2700.0 370.1552 52000.0 374.1551 7500.0 382.1545 12000.0 407.2227 38000.0 414.1459 91000.0 420.1933 14000.0 420.5626 6000.0 421.2027 78000.0 424.2021 9600.0 426.1458 15000.0 434.2112 93000.0 435.2187 280000.0 435.2846 8500.0 436.2262 180000.0 442.2179 7200.0 446.2137 5800.0 447.2182 68000.0 448.2201 5200.0 449.2351 7700.0 451.2126 42000.0 460.2277 18000.0 461.2368 32000.0 462.2417 260000.0 463.2493 32000.0 464.2569 45000.0 465.1932 90000.0 466.2004 7600.0 471.2152 9300.0 474.1599 11000.0 475.2117 34000.0 477.1928 6200.0 479.1471 8700.0 479.2082 820000.0 479.2858 5800.0 480.2161 89000.0 487.2128 38000.0 488.2211 24000.0 489.199 65000.0 489.2241 93000.0 490.2324 59000.0 491.2452 25000.0 492.2132 20000.0 493.2233 40000.0 497.197 10000.0 498.1997 6900.0 499.2143 31000.0 501.1927 150000.0 502.2013 44000.0 503.2091 20000.0 505.1881 180000.0 506.1977 150000.0 507.2741 34000.0 508.2808 18000.0 515.1312 4400.0 515.208 540000.0 516.2157 220000.0 516.2966 5700.0 517.2237 1700000.0 517.3152 17000.0 518.2291 120000.0 519.2067 47000.0 521.2543 28000.0 523.2346 7300.0 525.195 29000.0 527.2079 5800.0 529.1923 3000.0 531.2366 13000.0 533.2308 43000.0 534.2558 27000.0 535.2684 270000.0 536.2783 270000.0 543.2049 22000.0 544.211 86000.0 545.2507 31000.0 547.2326 41000.0 548.2094 120000.0 549.2432 12000.0 551.2576 110000.0 552.2695 62000.0 557.2184 15000.0 561.2421 310000.0 562.2538 77000.0 562.3737 2900.0 563.266 2000000.0 564.2707 29000.0 565.2458 270000.0 571.2314 34000.0 573.2495 38000.0 575.2298 24000.0 578.2499 36000.0 579.2594 210000.0 580.1568 20000.0 580.1882 4300.0 580.2688 1500000.0 581.2744 6300.0 585.2081 3300.0 588.2386 5500.0 589.2452 1800000.0 590.1406 3300.0 590.1676 2400.0 590.2533 510000.0 590.3602 14000.0 591.2605 22000.0 593.2659 70000.0 595.2927 22000.0 603.227 41000.0 605.2763 41000.0 606.2495 12000.0 607.2557 480000.0 608.2563 4200.0 611.2726 7300.0 617.2405 62000.0 621.271 1300000.0 623.288 77000.0 631.255 72000.0 634.2438 6800.0 639.2819 47000.0 649.1652 6700.0 649.266 1200000.0 667.2765 51000.0 END IONS BEGIN IONS SCANS=748 PEPMASS=689.2584 CHARGE=1 COLLISION_ENERGY=0.0 83.2148 2900.0 84.0708 2500.0 86.277 2600.0 88.4959 2900.0 89.0592 7900.0 95.085 3000.0 114.1186 2800.0 126.3895 2600.0 133.0853 3400.0 157.4471 2600.0 173.5294 56000.0 173.5457 5000.0 201.1456 3100.0 274.9046 2800.0 280.0904 2300.0 369.9138 2300.0 407.2233 14000.0 420.1949 6600.0 434.2082 25000.0 435.2171 52000.0 448.2209 2200.0 456.1863 2600.0 463.249 16000.0 489.2284 10000.0 491.2398 4700.0 495.2156 4300.0 501.187 9500.0 511.2098 12000.0 512.1806 25000.0 517.2224 320000.0 517.314 3600.0 535.2366 25000.0 539.2046 9100.0 557.2513 19000.0 558.2569 3500.0 563.2645 1400000.0 567.2303 3200.0 581.2755 12000.0 585.2461 140000.0 601.2412 5600.0 602.2479 24000.0 612.2363 5900.0 613.2427 33000.0 615.2222 6000.0 629.2372 8100.0 630.2449 45000.0 645.2666 14000.0 END IONS BEGIN IONS SCANS=749 PEPMASS=448.3639 CHARGE=1 COLLISION_ENERGY=0.0 56.1302 2300.0 56.1387 2500.0 57.9214 2300.0 58.6192 2200.0 58.8512 2400.0 59.7031 2300.0 60.0278 2200.0 63.8521 2200.0 65.6 2500.0 66.3655 2000.0 66.7877 2200.0 70.7099 2400.0 76.001 2300.0 76.8103 2200.0 80.8778 2600.0 81.7383 2300.0 88.1315 2700.0 95.1567 2100.0 96.0153 2200.0 99.7379 2200.0 102.179 2100.0 105.9304 2400.0 106.3966 2400.0 107.7024 2500.0 118.4405 2600.0 149.8973 2600.0 151.3147 2400.0 151.5465 2500.0 155.9779 2600.0 169.0854 2500.0 171.1378 63000.0 171.1824 2500.0 173.5236 46000.0 173.5403 56000.0 173.9365 2400.0 180.1935 2400.0 188.0222 2200.0 196.7169 2500.0 197.0462 2900.0 198.7172 2200.0 216.3722 2300.0 234.7831 2500.0 258.3748 2500.0 269.4903 2500.0 435.8618 3000.0 458.4554 2500.0 END IONS BEGIN IONS SCANS=750 PEPMASS=600.4173 CHARGE=1 COLLISION_ENERGY=0.0 63.8156 2200.0 64.6578 2800.0 65.7149 2500.0 65.9186 2300.0 67.054 60000.0 67.1023 2300.0 69.0333 62000.0 69.0697 65000.0 71.0491 11000.0 71.8718 2300.0 72.4525 2300.0 74.055 2500.0 74.8355 2400.0 76.2235 2300.0 78.0466 2500.0 79.054 75000.0 80.0553 2200.0 81.0696 210000.0 82.387 2300.0 83.0488 100000.0 83.0852 80000.0 84.6463 2200.0 85.0646 45000.0 86.8268 3000.0 87.0438 32000.0 87.4927 2300.0 89.0593 320000.0 91.054 87000.0 93.0695 360000.0 93.6496 2300.0 95.0488 140000.0 95.0852 270000.0 95.3265 2200.0 96.0888 3000.0 97.0645 100000.0 97.1011 6300.0 98.8688 2300.0 99.4596 2700.0 105.0695 330000.0 106.0777 7300.0 107.049 6300.0 107.0773 3600.0 107.0852 420000.0 108.0913 5600.0 109.0645 140000.0 109.1009 190000.0 111.0802 72000.0 113.0959 34000.0 117.0696 55000.0 119.0488 5500.0 119.0771 2400.0 119.0852 500000.0 120.0933 29000.0 121.0645 74000.0 121.1008 500000.0 121.1115 2400.0 122.0721 8600.0 122.1049 9900.0 122.1444 2200.0 123.0801 260000.0 123.1166 62000.0 125.0595 74000.0 125.0957 100000.0 128.0622 9900.0 129.0697 49000.0 129.6196 2400.0 131.0853 210000.0 131.0958 2300.0 132.0929 34000.0 133.0644 58000.0 133.0762 2400.0 133.0857 150000.0 133.1009 390000.0 133.1114 4700.0 134.1079 10000.0 135.0327 2300.0 135.0801 210000.0 135.1166 180000.0 136.088 2700.0 137.0595 20000.0 137.0957 140000.0 139.0752 42000.0 139.1115 54000.0 140.2246 2500.0 142.0776 28000.0 142.4596 2900.0 143.0852 280000.0 144.0928 110000.0 145.0646 9000.0 145.1009 530000.0 146.1078 36000.0 147.0801 280000.0 147.1165 170000.0 148.0871 14000.0 148.1216 2400.0 149.0957 180000.0 149.1324 14000.0 150.1036 5900.0 150.4227 2600.0 151.0751 230000.0 151.1116 21000.0 152.0812 7400.0 153.0908 34000.0 155.085 62000.0 155.1065 8000.0 156.0929 65000.0 157.065 2800.0 157.0862 8300.0 157.1009 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187.1482 86000.0 188.119 16000.0 189.1272 190000.0 189.1626 2800.0 190.1349 170000.0 191.1068 46000.0 191.1428 78000.0 193.102 48000.0 193.1222 140000.0 194.1088 30000.0 195.1166 200000.0 195.1366 44000.0 196.1239 62000.0 197.0964 26000.0 197.1159 7400.0 197.1323 250000.0 198.1042 23000.0 198.1386 31000.0 199.1116 99000.0 199.148 130000.0 200.1179 10000.0 200.153 6500.0 201.1273 110000.0 201.1635 14000.0 202.1354 3200.0 203.1084 15000.0 203.143 520000.0 204.1475 19000.0 205.1221 39000.0 206.1089 11000.0 207.1166 120000.0 207.1381 220000.0 208.1238 48000.0 208.1454 67000.0 209.0968 7200.0 209.1323 220000.0 209.1532 43000.0 210.1388 66000.0 211.1117 67000.0 211.1481 180000.0 212.1186 23000.0 212.1538 19000.0 213.1274 120000.0 213.1635 43000.0 214.1333 12000.0 215.1068 29000.0 215.143 76000.0 216.15 19000.0 217.1229 29000.0 217.1588 29000.0 218.1664 5900.0 219.1169 20000.0 219.138 110000.0 220.1241 13000.0 220.1467 4200.0 221.1323 110000.0 221.1537 870000.0 222.1371 18000.0 222.1579 37000.0 223.1113 38000.0 223.1482 150000.0 224.1544 28000.0 225.1273 98000.0 225.1639 110000.0 226.1322 7100.0 226.1683 3300.0 227.1429 72000.0 227.1799 19000.0 228.1489 4000.0 229.1223 29000.0 229.1588 55000.0 230.131 10000.0 230.1661 2900.0 231.1151 3700.0 231.1384 27000.0 231.173 14000.0 232.1246 3400.0 233.1317 46000.0 233.1537 320000.0 234.1373 9700.0 234.1604 130000.0 235.1478 110000.0 235.1707 10000.0 236.1544 24000.0 237.1256 37000.0 237.149 160000.0 237.1668 4600.0 238.1696 7300.0 239.1432 68000.0 239.179 44000.0 240.15 11000.0 241.1254 5300.0 241.1584 56000.0 241.1934 3000.0 243.1382 28000.0 243.1743 20000.0 243.3534 2400.0 245.1308 12000.0 245.1552 16000.0 246.1379 9800.0 246.1623 10000.0 247.1468 41000.0 247.1698 110000.0 248.1381 3400.0 249.1259 5300.0 249.1635 94000.0 250.1571 3400.0 250.1685 3100.0 251.1431 37000.0 251.1785 59000.0 252.1497 10000.0 252.1837 7600.0 253.1585 100000.0 253.1916 19000.0 255.1443 2900.0 255.1739 240000.0 256.1802 6400.0 257.1544 22000.0 257.1888 20000.0 258.1385 3800.0 258.162 4200.0 259.1442 13000.0 259.1697 60000.0 260.1545 4300.0 261.1629 130000.0 262.1705 4000.0 263.143 15000.0 263.179 70000.0 264.1839 10000.0 265.1588 32000.0 265.194 31000.0 267.1745 55000.0 268.1821 32000.0 269.1555 13000.0 269.1897 56000.0 270.1964 20000.0 271.1694 92000.0 271.2 2800.0 272.178 3400.0 273.1583 7700.0 273.1872 47000.0 274.1927 66000.0 275.1447 2800.0 275.179 36000.0 277.1602 18000.0 277.1947 50000.0 278.1681 3600.0 279.1746 100000.0 279.2061 3200.0 280.1788 4000.0 281.1568 6800.0 281.1899 97000.0 282.195 8500.0 283.1698 15000.0 283.2059 11000.0 285.1851 94000.0 286.1677 2400.0 286.1927 170000.0 287.2008 130000.0 289.1943 28000.0 290.1982 2600.0 291.1759 14000.0 291.2108 22000.0 293.1899 20000.0 294.1982 32000.0 295.1703 9100.0 295.2061 82000.0 297.1849 91000.0 298.1938 12000.0 299.2004 130000.0 300.2054 15000.0 301.1935 18000.0 303.1961 340000.0 305.1897 6500.0 305.2273 4100.0 307.1685 2800.0 307.2056 35000.0 309.1843 39000.0 309.2215 9000.0 310.1921 25000.0 311.2004 42000.0 312.208 45000.0 313.2161 100000.0 315.2109 8300.0 319.2059 58000.0 321.2223 3900.0 322.2293 23000.0 323.2001 8900.0 325.2162 100000.0 331.206 8500.0 333.2213 3300.0 334.2271 4400.0 335.1976 3500.0 337.2161 180000.0 339.2314 3800.0 341.2252 2900.0 347.2368 29000.0 349.2146 3300.0 351.232 10000.0 352.2395 480000.0 353.2454 12000.0 359.237 9600.0 363.2302 14000.0 365.2471 220000.0 366.2537 3200.0 373.2519 2500.0 377.2473 42000.0 378.2531 4200.0 379.2666 2800.0 383.2581 2800.0 387.271 12000.0 397.2743 3000.0 399.2548 3900.0 403.265 2700.0 408.4413 2400.0 415.2754 3400.0 419.2928 3300.0 425.0023 2400.0 425.2719 3800.0 426.1522 2400.0 437.3026 5800.0 441.6528 2800.0 469.3129 10000.0 487.3216 88000.0 502.3433 7700.0 503.3516 120000.0 505.3314 67000.0 507.3469 42000.0 508.3508 30000.0 520.3548 59000.0 521.3512 2700.0 550.6197 2600.0 573.2586 2700.0 585.3969 11000.0 600.4128 13000.0 END IONS BEGIN IONS SCANS=751 PEPMASS=583.4151 CHARGE=1 COLLISION_ENERGY=0.0 66.3625 2700.0 67.0539 19000.0 69.0696 16000.0 74.6697 2100.0 75.82 2200.0 77.6879 2400.0 78.9904 2100.0 79.0539 23000.0 81.0696 55000.0 81.6367 2400.0 83.049 17000.0 83.0851 45000.0 85.0641 2600.0 88.35 2100.0 90.5245 2200.0 90.8449 2600.0 91.0539 27000.0 93.0695 70000.0 95.0488 15000.0 95.0852 61000.0 97.0644 37000.0 104.9213 2800.0 105.0695 71000.0 107.0852 93000.0 109.0647 5100.0 109.1008 45000.0 111.0801 2600.0 113.096 19000.0 117.0697 3300.0 119.0768 2700.0 119.0851 130000.0 121.1008 97000.0 123.0801 22000.0 123.1165 8600.0 125.096 12000.0 129.0691 7900.0 131.0852 48000.0 133.1008 76000.0 135.0802 5700.0 135.1166 31000.0 137.0956 14000.0 139.1113 35000.0 142.0766 2800.0 143.0853 38000.0 144.0925 2800.0 145.1009 100000.0 147.0803 17000.0 147.1166 56000.0 149.0966 7100.0 149.1328 5200.0 149.6845 5300.0 149.6945 3400.0 149.7704 2300.0 151.0749 3000.0 153.1262 5900.0 155.0851 18000.0 156.0935 4100.0 157.1008 96000.0 158.1083 6500.0 158.6223 2500.0 159.1165 53000.0 161.1318 17000.0 163.1113 9800.0 165.0911 34000.0 167.0858 2800.0 167.1064 10000.0 169.1011 33000.0 171.1166 55000.0 173.1325 47000.0 173.5339 66000.0 175.148 22000.0 179.0857 2700.0 179.141 2800.0 180.0937 2600.0 181.1015 18000.0 181.1214 18000.0 183.1169 44000.0 184.1248 3300.0 184.7695 2500.0 185.1323 34000.0 187.1477 17000.0 189.1287 2300.0 191.1436 9700.0 193.1014 3400.0 194.109 7100.0 195.1166 28000.0 196.124 7900.0 197.1321 44000.0 199.1481 28000.0 201.1262 2600.0 201.1632 6600.0 203.143 15000.0 205.1574 2600.0 207.1167 22000.0 207.1378 4300.0 208.1241 3300.0 209.1324 53000.0 210.14 3100.0 211.1128 2700.0 211.1485 24000.0 219.1168 2900.0 221.132 22000.0 221.1539 33000.0 223.1475 26000.0 225.1638 11000.0 233.1321 12000.0 233.1564 3000.0 235.1485 17000.0 237.1637 6500.0 245.1321 4200.0 246.1409 3200.0 247.1466 8700.0 249.1637 13000.0 251.1785 3600.0 259.1465 2900.0 261.1632 12000.0 263.1787 7700.0 265.1944 7100.0 267.0296 2700.0 267.1751 2700.0 269.1894 3100.0 273.1609 2500.0 275.1795 16000.0 281.1895 2800.0 281.2956 66000.0 282.2796 240000.0 283.2829 250000.0 285.1859 9000.0 291.7259 2500.0 299.2008 2700.0 299.3059 75000.0 300.3088 78000.0 385.7383 2600.0 394.7108 2500.0 435.7137 2600.0 449.8352 2200.0 491.3491 2700.0 494.7494 2700.0 532.9865 2500.0 540.6093 2800.0 583.4113 3000.0 END IONS BEGIN IONS SCANS=752 PEPMASS=279.0938 CHARGE=1 COLLISION_ENERGY=0.0 46.0109 2100.0 47.8154 2200.0 49.6179 2700.0 50.6342 2300.0 50.874 2400.0 55.0541 2800.0 56.6318 2300.0 57.0697 44000.0 57.8113 2700.0 59.5411 2300.0 61.9027 2100.0 61.963 2100.0 62.5264 2400.0 62.7185 2300.0 62.7435 2100.0 64.3886 2400.0 65.4462 2200.0 65.8514 2200.0 67.008 2200.0 67.0541 15000.0 69.5827 2100.0 70.2664 2200.0 70.9935 2000.0 73.0648 2400.0 75.0596 2200.0 75.8577 2500.0 78.409 2400.0 79.4665 2200.0 81.0698 22000.0 81.9555 2300.0 87.2893 2300.0 91.5051 2700.0 93.0691 2500.0 93.1294 3500.0 95.0495 2800.0 95.0854 12000.0 102.8576 2300.0 103.4901 2500.0 104.4013 2600.0 105.9643 2800.0 107.0857 3800.0 107.7931 2400.0 109.1013 6800.0 118.5942 2400.0 118.6064 2300.0 121.1005 3600.0 123.7465 2400.0 126.1238 2400.0 132.479 2200.0 137.6475 2500.0 141.5025 2900.0 143.699 2400.0 146.6905 2700.0 149.0232 490000.0 149.6899 5400.0 149.819 3000.0 151.0753 79000.0 156.5567 2500.0 157.8894 2500.0 159.8458 2500.0 164.1842 3000.0 167.6663 2500.0 169.4897 2200.0 173.0514 38000.0 173.5249 34000.0 173.5346 160000.0 173.5458 10000.0 182.8965 2600.0 184.1688 2300.0 187.0472 2400.0 191.0308 2500.0 201.0464 340000.0 203.6826 2300.0 206.0535 7600.0 219.0319 6300.0 219.0571 1900000.0 219.0819 40000.0 219.3651 2400.0 220.2932 2700.0 231.2909 2600.0 239.6154 3000.0 255.4837 2300.0 262.7467 2600.0 279.0579 22000.0 279.0935 1400000.0 279.127 13000.0 279.171 3300.0 279.2296 3100.0 279.6489 2900.0 END IONS BEGIN IONS SCANS=753 PEPMASS=282.2796 CHARGE=1 COLLISION_ENERGY=0.0 46.7356 2100.0 49.5396 2200.0 53.0386 5700.0 53.5536 2200.0 55.0176 42000.0 55.054 600000.0 55.0571 4800.0 57.0333 24000.0 57.0697 620000.0 58.0649 21000.0 60.0444 3600.0 64.1141 2300.0 67.0539 180000.0 67.59 2100.0 69.0331 12000.0 69.0696 960000.0 69.0738 6500.0 69.0761 4600.0 69.7969 2500.0 70.0649 9300.0 71.0489 20000.0 71.0852 270000.0 72.0441 36000.0 72.0805 78000.0 72.2822 2900.0 73.1104 2100.0 79.0539 92000.0 79.6614 2200.0 81.0695 310000.0 83.0488 47000.0 83.0852 670000.0 83.0909 3500.0 84.0805 15000.0 85.0644 12000.0 85.1008 97000.0 86.0597 130000.0 86.0961 39000.0 89.5764 3000.0 91.0538 5300.0 91.6289 2600.0 92.0749 2400.0 93.0696 200000.0 95.0852 300000.0 96.0809 2700.0 97.0582 3500.0 97.0644 180000.0 97.0901 3000.0 97.1008 470000.0 97.3978 2300.0 99.0801 4500.0 100.0601 2500.0 100.0753 210000.0 100.1117 7900.0 101.9611 2300.0 104.1128 2200.0 107.0852 170000.0 109.1009 150000.0 110.096 2300.0 111.0801 140000.0 111.1165 120000.0 111.1251 4700.0 113.3624 2300.0 114.091 140000.0 114.1275 3400.0 121.1009 190000.0 121.2168 2400.0 123.1165 37000.0 125.0959 77000.0 125.1322 9800.0 125.2704 2600.0 128.1067 54000.0 134.096 78000.0 135.1055 3900.0 135.1166 160000.0 137.1324 5700.0 139.1114 41000.0 142.1229 15000.0 149.1322 84000.0 151.1492 4900.0 153.1269 19000.0 155.0221 2400.0 156.1384 7000.0 158.1068 2400.0 163.148 33000.0 164.6706 2300.0 167.1421 6000.0 170.155 3400.0 173.5281 110000.0 173.5383 17000.0 173.5466 13000.0 177.1636 11000.0 191.1788 4300.0 195.1559 2900.0 205.1954 3100.0 207.8865 3900.0 210.1294 3700.0 211.135 21000.0 214.3465 2400.0 217.8709 3100.0 234.0793 2500.0 240.2689 31000.0 247.243 14000.0 265.2528 12000.0 278.9111 3000.0 282.1877 4000.0 282.2218 200000.0 282.277 13000.0 285.0625 2400.0 END IONS BEGIN IONS SCANS=754 PEPMASS=651.2819 CHARGE=1 COLLISION_ENERGY=0.0 66.8044 210000.0 66.8066 37000.0 67.2507 3600.0 70.3627 74000.0 74.1198 16000.0 100.9083 21000.0 104.5612 3300.0 110.9619 16000.0 131.2165 23000.0 137.3996 3100.0 138.2153 9100.0 143.3065 65000.0 143.3182 63000.0 146.6814 11000.0 173.5301 640000.0 173.5409 23000.0 228.9932 3400.0 289.8691 3600.0 359.1573 10000.0 393.205 4500.0 407.2247 4900.0 415.1892 42000.0 421.2027 12000.0 429.2113 78000.0 430.2167 4200.0 431.218 12000.0 435.2159 68000.0 436.2266 36000.0 443.2254 77000.0 444.1954 260000.0 445.1998 68000.0 455.2275 3500.0 456.2026 18000.0 457.2027 140000.0 458.21 240000.0 459.2173 150000.0 461.2266 13000.0 462.2443 9100.0 471.2175 360000.0 472.224 290000.0 473.1978 1300000.0 474.2067 6600.0 475.2109 20000.0 483.2166 4200.0 485.1979 180000.0 486.2051 550000.0 487.1495 4900.0 487.2125 5500000.0 488.2199 18000.0 489.2254 180000.0 490.1902 12000.0 490.2078 16000.0 491.2067 6200.0 498.2063 5500.0 499.2127 1900000.0 499.2954 4800.0 500.2147 360000.0 501.2274 520000.0 502.2075 4900.0 502.227 17000.0 503.2078 50000.0 505.2286 16000.0 511.2145 22000.0 513.1916 330000.0 514.201 110000.0 515.2001 4000.0 516.2166 120000.0 517.2252 980000.0 518.223 94000.0 519.2045 24000.0 527.2075 980000.0 528.136 21000.0 528.2162 260000.0 529.2232 800000.0 529.3157 4000.0 530.2272 4300.0 531.2065 54000.0 531.2347 130000.0 532.2131 6600.0 533.224 56000.0 535.2725 6100.0 536.2776 8100.0 544.2333 30000.0 544.2452 10000.0 545.2371 2100000.0 549.248 7200.0 555.2068 110000.0 557.2549 380000.0 558.2267 70000.0 559.2354 56000.0 563.2646 390000.0 564.2707 67000.0 573.0379 170000.0 573.0818 130000.0 573.2497 41000000.0 573.4197 72000.0 573.4628 280000.0 574.2536 120000.0 575.2604 79000.0 577.2509 4200.0 587.239 5400.0 589.2445 22000.0 590.2523 11000.0 591.258 18000.0 592.2717 29000.0 601.2445 6400000.0 605.2624 310000.0 619.2546 60000.0 623.2847 9800.0 633.1503 17000.0 633.2704 1900000.0 633.3628 17000.0 651.2838 110000.0 END IONS BEGIN IONS SCANS=755 PEPMASS=673.2638 CHARGE=1 COLLISION_ENERGY=0.0 67.9408 5800.0 68.1375 230000.0 68.1402 30000.0 68.2513 2800.0 69.5572 11000.0 71.2462 18000.0 71.2492 140000.0 72.8036 2600.0 72.8059 43000.0 74.8067 420000.0 74.8095 34000.0 76.3529 9800.0 76.9671 3800.0 78.2675 6800.0 80.6373 10000.0 80.8087 7100.0 80.894 9700.0 81.7671 6000.0 87.0434 12000.0 87.7444 2100.0 89.035 6400.0 89.0591 290000.0 89.1145 2300.0 90.0623 24000.0 91.1724 9200.0 92.857 13000.0 102.9216 5900.0 103.8786 6200.0 114.3276 2400.0 122.7554 8900.0 123.7045 12000.0 125.553 10000.0 130.8816 10000.0 133.0852 130000.0 134.0873 6300.0 141.752 3600.0 145.0731 6900.0 158.4293 6100.0 160.2413 12000.0 168.3094 2400.0 168.3235 2600.0 173.5324 500000.0 173.5458 26000.0 175.1846 11000.0 175.5126 2400.0 178.1142 6000.0 180.3284 11000.0 189.5905 2400.0 189.9128 13000.0 196.466 10000.0 204.521 2400.0 211.7305 6200.0 213.3717 6600.0 225.0673 5400.0 261.0767 6500.0 294.8493 5800.0 336.0174 6600.0 359.3191 12000.0 372.2763 11000.0 393.7952 3800.0 403.559 6800.0 434.0812 6900.0 443.184 3500.0 444.8248 7600.0 457.1998 89000.0 458.208 57000.0 484.2207 4200.0 486.2354 4300.0 496.1853 47000.0 497.1928 40000.0 510.2056 9800.0 512.1821 31000.0 513.1894 95000.0 514.1975 97000.0 522.1642 38000.0 523.0624 9900.0 523.1871 31000.0 523.2037 30000.0 524.2211 11000.0 525.2223 10000.0 527.2123 2700.0 529.2208 14000.0 529.5708 3600.0 531.2025 91000.0 535.1733 200000.0 536.1795 8000.0 538.0699 6000.0 540.1767 220000.0 541.1827 10000.0 549.1786 5900.0 550.2 66000.0 551.205 1800000.0 551.3012 8100.0 552.2126 130000.0 552.9803 4100.0 553.185 390000.0 554.1917 170000.0 555.2041 96000.0 557.1741 31000.0 557.2594 19000.0 565.2191 11000.0 567.1946 15000.0 567.2121 2900.0 569.2484 190000.0 572.2006 23000.0 573.2501 100000.0 575.2652 150000.0 577.1849 49000.0 579.2367 8800.0 583.2303 20000.0 585.2124 22000.0 585.2222 120000.0 595.2162 260000.0 597.2471 820000.0 597.353 12000.0 597.6241 12000.0 599.2213 30000.0 601.2452 69000.0 609.2091 11000.0 613.2415 6600000.0 614.2498 990000.0 614.3651 4200.0 615.2544 19000.0 623.2259 350000.0 627.2224 3100.0 627.2369 7500.0 629.2725 440000.0 633.2718 95000.0 641.1119 41000.0 641.2366 4200000.0 642.2427 10000.0 645.2415 14000.0 645.2475 90000.0 655.1347 19000.0 655.1534 5200.0 655.2523 1300000.0 655.3785 6400.0 656.2614 55000.0 658.2443 2900.0 673.2623 11000000.0 673.5272 8300.0 674.2676 5400.0 END IONS BEGIN IONS SCANS=756 PEPMASS=689.2377 CHARGE=1 COLLISION_ENERGY=0.0 71.0714 2400.0 76.0237 2500.0 78.8226 2300.0 79.6567 2500.0 79.7287 2400.0 87.3416 2300.0 89.0595 21000.0 91.576 2800.0 98.7787 2400.0 104.7122 2500.0 108.5038 2300.0 111.7977 2500.0 114.3449 2600.0 115.9974 2300.0 133.0859 5100.0 163.1384 2400.0 169.964 2700.0 173.5247 17000.0 173.5339 92000.0 173.5434 10000.0 224.2589 2400.0 228.9642 2700.0 307.8921 2800.0 353.6892 2500.0 370.4028 2700.0 388.2347 2300.0 391.3879 2600.0 428.3987 2200.0 436.0749 2500.0 462.2109 2400.0 485.2538 3000.0 537.231 3200.0 543.1336 10000.0 559.2087 7100.0 563.2621 3200.0 577.2197 2800.0 585.2506 3600.0 593.21 5700.0 602.2531 4900.0 603.1989 7500.0 629.1693 8300.0 641.327 2800.0 END IONS BEGIN IONS SCANS=757 PEPMASS=780.5538 CHARGE=1 COLLISION_ENERGY=0.0 71.0726 440000.0 71.0851 2300.0 71.5701 2500.0 71.7148 2200.0 72.7426 2300.0 72.9249 2200.0 73.1433 2200.0 73.5445 2200.0 73.8747 2200.0 74.2036 2400.0 74.2267 2600.0 74.3147 2300.0 74.6091 2400.0 74.9647 2300.0 75.1532 2100.0 75.3095 2000.0 75.5149 2300.0 75.6185 2300.0 75.7214 2700.0 75.9267 2600.0 77.127 2200.0 77.162 2200.0 78.4512 2300.0 79.0541 8400.0 79.8164 2900.0 79.8259 2500.0 79.9815 2300.0 80.1931 2200.0 80.2896 2500.0 81.0696 100000.0 81.2599 2300.0 81.2737 2500.0 81.4142 2600.0 81.4349 4400.0 82.9514 2600.0 83.0852 21000.0 83.2934 2300.0 85.0636 2400.0 85.1384 2200.0 85.6095 2500.0 85.9015 2800.0 86.0961 8400000.0 86.1026 2800.0 86.1054 19000.0 86.2365 2500.0 87.4156 2600.0 87.7816 2400.0 87.9103 2200.0 88.2597 2400.0 88.4587 2400.0 88.6506 2400.0 88.8262 2900.0 89.9163 2500.0 90.1289 2100.0 91.0536 2300.0 91.1835 2300.0 91.6846 2300.0 92.4683 4900.0 93.0696 4200.0 93.2092 2400.0 94.016 2700.0 95.0852 110000.0 97.1003 3200.0 97.2269 2900.0 97.5967 2500.0 97.7432 2400.0 98.3811 2300.0 98.984 400000.0 99.1481 2300.0 99.3609 2800.0 99.6853 2500.0 100.1603 2200.0 100.9039 2300.0 102.5282 2300.0 103.337 2500.0 104.1066 810000.0 106.2002 2600.0 106.5286 2400.0 109.1007 36000.0 109.2579 2300.0 109.5214 2400.0 109.6053 2300.0 110.6206 2800.0 111.0348 2300.0 112.3962 2700.0 112.5352 2400.0 113.1076 2300.0 114.1952 2200.0 115.2667 2800.0 115.5789 2400.0 116.1428 2500.0 116.4873 2300.0 116.5616 2200.0 116.7467 2700.0 117.8876 2300.0 118.9957 2400.0 119.4474 2400.0 119.5002 2200.0 120.4218 2600.0 120.7081 2400.0 120.765 2400.0 120.982 2100.0 121.1011 2800.0 121.4043 2300.0 121.8362 3100.0 122.8148 2700.0 122.8884 2200.0 123.1168 12000.0 124.2564 2700.0 124.604 2300.0 124.9891 48000.0 124.9995 3800000.0 125.0085 2300.0 125.0104 89000.0 126.7994 2600.0 128.3675 2400.0 130.8104 3000.0 132.6889 2700.0 133.1002 2300.0 135.2206 2900.0 137.1628 2600.0 137.2582 2500.0 139.6038 2300.0 140.7153 2600.0 141.8128 2300.0 146.9682 3100.0 146.9814 1100000.0 146.9952 2600.0 147.593 2600.0 149.6817 8000.0 149.6921 9000.0 151.0 2500.0 153.608 2600.0 154.0107 2600.0 154.9455 2500.0 155.2151 2200.0 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2400.0 263.2366 3000.0 266.0683 2800.0 267.4118 2600.0 267.9314 3100.0 275.611 2400.0 278.1642 2100.0 287.7996 2600.0 291.7987 2600.0 294.9874 2700.0 295.825 2400.0 302.4054 2500.0 305.8598 2400.0 305.8795 3300.0 314.3692 3000.0 319.2086 2700.0 320.9272 2300.0 340.6665 2600.0 346.517 2500.0 346.5389 2400.0 348.674 2400.0 352.0481 2700.0 367.6254 2900.0 370.3127 2600.0 376.3138 2400.0 382.413 3000.0 382.4683 2500.0 384.5884 2400.0 405.1566 2800.0 408.5906 2700.0 413.441 2300.0 416.2304 2600.0 424.3359 2400.0 433.1103 2500.0 438.8775 2700.0 441.2372 2400.0 441.2464 2800.0 442.7159 2600.0 443.2568 6000.0 465.24 26000.0 466.4083 2400.0 483.8034 2800.0 490.8473 2400.0 500.3166 13000.0 502.3284 33000.0 507.2908 2500.0 508.912 2800.0 528.9943 2500.0 532.3139 2500.0 550.2344 2600.0 550.942 2300.0 573.2486 3200.0 575.5048 170000.0 584.586 2400.0 586.7496 2800.0 592.3725 2700.0 592.4824 2600.0 594.159 2800.0 595.3376 2400.0 597.4878 240000.0 604.0056 2800.0 615.0386 2500.0 652.2268 11000.0 657.2272 2800.0 669.6068 2700.0 670.9802 2600.0 673.0823 2800.0 715.2656 3200.0 727.975 2700.0 754.9731 2500.0 758.1958 2900.0 761.2 2500.0 779.7233 2500.0 780.859 2600.0 END IONS BEGIN IONS SCANS=758 PEPMASS=840.5465 CHARGE=1 COLLISION_ENERGY=0.0 78.4662 2300.0 78.8519 2300.0 79.0539 76000.0 80.0423 2100.0 80.1137 2200.0 81.0333 3400.0 81.0695 140000.0 81.2331 2500.0 81.7258 2200.0 83.049 4400.0 83.0852 33000.0 85.0645 3200.0 86.0961 18000.0 89.4776 2200.0 91.0539 59000.0 93.0695 110000.0 95.0489 13000.0 95.0852 130000.0 95.3056 2400.0 97.0645 35000.0 97.1009 20000.0 98.0979 2500.0 98.6686 2400.0 99.0804 2600.0 100.7639 2300.0 104.1062 6200.0 104.2612 2400.0 105.0695 63000.0 107.0851 78000.0 109.0646 5000.0 109.1008 95000.0 111.0803 5800.0 117.0694 16000.0 119.0851 66000.0 120.7673 2700.0 121.0647 3700.0 121.1008 75000.0 122.2951 2500.0 123.0797 3100.0 123.1167 17000.0 124.9995 8800.0 125.0957 9000.0 126.4547 2200.0 131.0852 33000.0 133.1009 62000.0 135.0802 3100.0 135.1166 47000.0 137.0958 13000.0 137.1324 5400.0 143.8062 2500.0 145.1008 44000.0 147.1164 54000.0 149.0958 35000.0 149.1321 23000.0 149.6703 2800.0 149.682 4200.0 149.6918 19000.0 149.7122 3600.0 157.1014 5900.0 159.1164 41000.0 161.1323 28000.0 163.1113 12000.0 163.1482 3600.0 170.8729 2800.0 171.116 6200.0 173.1321 27000.0 173.5193 6300.0 173.5337 120000.0 175.1486 7100.0 179.1431 8500.0 184.0731 240000.0 185.1324 5700.0 193.4155 2400.0 193.7545 2200.0 203.181 2800.0 203.8941 2300.0 209.5186 2300.0 219.3247 3000.0 227.1284 7200.0 240.3658 2400.0 247.2064 7400.0 257.19 19000.0 261.2216 7300.0 275.2004 74000.0 291.1974 5300.0 298.0662 2700.0 335.2586 110000.0 344.2574 2600.0 349.2381 17000.0 353.2691 2900.0 364.2545 2400.0 400.3654 2700.0 456.8634 3000.0 471.2944 2700.0 525.6053 2800.0 565.1072 2500.0 584.2589 3100.0 590.379 2600.0 635.4553 2900.0 691.1631 2800.0 759.2472 2500.0 806.5645 2900.0 821.411 2700.0 840.4965 3200.0 END IONS BEGIN IONS SCANS=759 PEPMASS=609.2714 CHARGE=1 COLLISION_ENERGY=0.0 64.1371 56000.0 64.1399 28000.0 65.6941 260000.0 65.6977 69000.0 66.2399 10000.0 67.6953 260000.0 67.6989 65000.0 68.9546 12000.0 87.2943 5000.0 89.7408 5000.0 107.817 5100.0 108.2459 17000.0 118.3361 13000.0 132.8152 25000.0 134.7775 5500.0 137.639 10000.0 147.2798 15000.0 173.5286 330000.0 173.5422 110000.0 189.0253 16000.0 192.2954 18000.0 219.3464 16000.0 224.131 7800.0 237.1384 8400.0 238.1463 11000.0 239.1548 90000.0 243.3606 11000.0 251.1542 42000.0 263.5247 5700.0 266.8346 5100.0 404.2147 6900.0 405.2068 6900.0 407.2234 160000.0 420.231 150000.0 421.2382 230000.0 422.2462 120000.0 429.2086 8000.0 430.2187 51000.0 433.242 21000.0 434.2467 11000.0 444.2317 83000.0 446.2449 5700.0 447.1825 58000.0 448.2192 25000.0 448.2668 11000.0 449.2346 97000.0 456.1937 6100.0 457.2392 200000.0 458.2056 5500.0 458.249 6600.0 459.2186 1000000.0 460.226 180000.0 461.2002 140000.0 462.2045 44000.0 463.2143 140000.0 470.2127 32000.0 472.225 160000.0 473.2334 97000.0 474.2392 31000.0 475.2149 580000.0 476.2226 970000.0 477.2299 580000.0 478.2363 180000.0 479.2419 56000.0 485.2335 3300000.0 485.3498 24000.0 486.2055 960000.0 487.2449 240000.0 488.223 58000.0 489.2282 380000.0 490.233 8400.0 491.2435 54000.0 492.2535 40000.0 493.2278 26000.0 493.2409 33000.0 493.2557 39000.0 494.2679 440000.0 497.2335 220000.0 499.2136 660000.0 500.2211 350000.0 501.227 84000.0 502.2367 180000.0 503.2437 1500000.0 504.244 590000.0 505.2542 140000.0 507.2165 12000.0 507.2344 74000.0 513.2286 810000.0 514.2353 74000.0 515.2442 4600000.0 516.2148 45000.0 517.2234 310000.0 518.2308 250000.0 519.2392 120000.0 520.2101 31000.0 521.2521 1300000.0 522.2519 190000.0 526.2598 27000.0 530.1953 25000.0 531.0509 100000.0 531.2389 14000000.0 532.2434 99000.0 533.2548 340000.0 534.2245 61000.0 535.2351 180000.0 536.2402 96000.0 541.1286 36000.0 541.2233 1300000.0 544.2104 60000.0 545.2538 44000.0 547.2727 10000.0 548.2423 430000.0 549.1774 14000.0 549.2501 2000000.0 549.3469 20000.0 550.1569 36000.0 550.2577 3400000.0 550.3564 33000.0 553.2834 5900.0 559.2345 8700000.0 563.2653 310000.0 573.2531 28000.0 576.2412 24000.0 577.0902 16000.0 577.1381 35000.0 577.2451 1800000.0 577.3521 11000.0 579.2269 7400.0 580.2322 42000.0 581.2766 210000.0 591.2606 8100000.0 594.2471 170000.0 609.271 8200000.0 END IONS BEGIN IONS SCANS=760 PEPMASS=608.2634 CHARGE=1 COLLISION_ENERGY=0.0 87.2365 2700.0 89.0593 7400.0 102.9268 2300.0 103.11 2600.0 103.9615 2200.0 117.0904 3100.0 134.3581 2300.0 138.7508 2400.0 154.0553 2300.0 173.5191 2900.0 173.5346 71000.0 185.4912 2200.0 200.8907 2200.0 267.6403 2400.0 367.5969 2600.0 419.217 2800.0 420.2308 120000.0 421.2366 6300.0 433.2403 3800.0 434.244 10000.0 445.2425 3500.0 446.2461 5700.0 447.2175 22000.0 448.2201 9300.0 448.2294 3100.0 449.2335 30000.0 452.2215 31000.0 459.2106 4500.0 459.2209 15000.0 460.2254 48000.0 462.2055 14000.0 465.2275 11000.0 473.2004 2800.0 474.2409 37000.0 475.2128 460000.0 476.2203 100000.0 477.23 140000.0 478.2301 3700.0 484.2272 2700.0 485.2346 15000.0 487.2188 15000.0 488.2202 24000.0 489.2275 32000.0 491.2371 3300.0 492.2501 48000.0 493.2195 2300.0 499.2128 7700.0 501.228 18000.0 502.2355 98000.0 503.2438 960000.0 504.2476 65000.0 515.2429 21000.0 516.2125 2700.0 517.2234 26000.0 518.2296 19000.0 519.2347 6200.0 520.2397 8700.0 520.2473 4600.0 521.2526 400000.0 530.2281 14000.0 531.238 63000.0 533.219 17000.0 534.2273 3100.0 535.2333 55000.0 536.242 31000.0 547.2356 16000.0 548.2398 130000.0 549.2497 370000.0 549.3469 10000.0 550.2578 18000.0 558.2274 4600.0 559.2344 41000.0 563.2679 5300.0 565.247 15000.0 577.2451 6300.0 580.2632 14000.0 591.2614 41000.0 593.2407 17000.0 608.2608 33000.0 609.2719 34000.0 END IONS BEGIN IONS SCANS=761 PEPMASS=631.2532 CHARGE=1 COLLISION_ENERGY=0.0 73.1387 2400.0 75.8011 2300.0 84.965 2500.0 89.0594 4600.0 107.4227 2300.0 133.0852 2800.0 134.3011 2700.0 134.3112 2500.0 173.5298 27000.0 205.1536 2400.0 217.1681 2700.0 249.1118 4400.0 447.2525 3900.0 455.2191 5000.0 461.2782 2900.0 469.2348 13000.0 470.2445 8600.0 482.2096 4800.0 483.2503 12000.0 491.2424 6800.0 496.2206 6800.0 497.2323 5200.0 499.2052 5900.0 507.1881 2500.0 508.1871 8400.0 509.2289 11000.0 511.2464 76000.0 513.225 5500.0 514.2371 8100.0 515.2424 13000.0 522.2017 23000.0 527.241 13000.0 531.2452 3000.0 533.2545 38000.0 536.2134 3800.0 537.2256 960000.0 540.214 12000.0 541.2496 4400.0 543.2706 12000.0 553.2189 9100.0 555.2365 110000.0 557.2115 4500.0 558.2202 5500.0 569.2523 18000.0 570.2297 2800.0 571.2322 13000.0 572.2399 21000.0 581.1339 4600.0 581.2159 230000.0 585.5349 4800.0 587.2628 56000.0 591.2631 5700.0 599.2313 3500.0 613.2398 17000.0 631.253 27000.0 END IONS BEGIN IONS SCANS=762 PEPMASS=986.6051 CHARGE=1 COLLISION_ENERGY=0.0 79.0539 100000.0 79.8474 2100.0 81.0332 14000.0 81.0696 180000.0 83.0488 20000.0 83.0852 22000.0 85.028 41000.0 85.0645 3000.0 85.1428 2300.0 91.0386 20000.0 91.0539 88000.0 92.2631 2600.0 93.0639 3200.0 93.0695 150000.0 95.0488 16000.0 95.0793 3700.0 95.0852 150000.0 97.028 25000.0 97.0646 16000.0 97.1009 13000.0 100.3437 2400.0 102.2173 2400.0 105.0695 93000.0 107.0851 110000.0 108.0725 2400.0 109.0641 3300.0 109.1008 110000.0 111.0801 7100.0 111.1169 3400.0 117.0695 43000.0 118.3768 2600.0 119.0851 98000.0 121.0644 5000.0 121.1008 120000.0 123.0797 9300.0 123.1164 23000.0 125.096 2800.0 127.0386 15000.0 129.0543 5200.0 129.0695 14000.0 129.5932 2700.0 131.0852 85000.0 133.1008 130000.0 135.0801 2400.0 135.1073 2400.0 135.1165 93000.0 137.096 6900.0 141.9649 2500.0 142.1985 2400.0 143.0852 15000.0 143.4181 2500.0 145.0493 8500.0 145.062 2400.0 145.1008 76000.0 147.1165 100000.0 149.0958 8000.0 149.1321 48000.0 157.1009 20000.0 159.1166 83000.0 161.1322 67000.0 163.1108 5300.0 163.1482 14000.0 169.1023 2600.0 171.1164 34000.0 173.1325 55000.0 173.5256 71000.0 173.536 100000.0 173.5452 20000.0 175.1312 2300.0 175.1479 23000.0 177.1268 2900.0 183.1166 7300.0 185.1324 22000.0 187.1477 16000.0 189.1649 2900.0 197.1318 5900.0 197.747 2400.0 199.1482 21000.0 201.1077 2500.0 201.1643 2800.0 203.1429 3100.0 211.8674 3000.0 231.2098 4500.0 239.1788 9100.0 241.1952 41000.0 243.2098 6300.0 253.6027 2800.0 257.1895 9500.0 259.2054 130000.0 261.2205 27000.0 275.2007 17000.0 276.2472 3000.0 277.2173 3300.0 293.2112 13000.0 315.2326 10000.0 333.2429 63000.0 335.2584 160000.0 336.253 2800.0 396.2238 2600.0 411.3658 2600.0 425.1259 2300.0 435.85 2500.0 490.1713 2800.0 559.7965 2300.0 597.0234 2500.0 612.9799 2500.0 618.2137 2500.0 640.1785 2900.0 703.845 2900.0 782.0909 2400.0 794.093 2900.0 813.8112 2700.0 826.7396 2600.0 833.9926 3000.0 839.7541 2800.0 873.6842 2400.0 937.8972 2600.0 954.306 2700.0 985.3211 2500.0 END IONS BEGIN IONS SCANS=763 PEPMASS=748.4763 CHARGE=1 COLLISION_ENERGY=0.0 69.0696 15000.0 71.0851 22000.0 71.3412 2500.0 75.7024 2400.0 79.0538 2800.0 81.0694 46000.0 83.0849 28000.0 85.1008 18000.0 87.9954 2500.0 95.085 47000.0 97.1007 9100.0 104.5097 2200.0 107.0849 10000.0 109.1006 35000.0 111.0436 93000.0 111.0801 2900.0 111.116 3000.0 119.0845 4900.0 121.1007 24000.0 123.1164 25000.0 125.0593 23000.0 133.1009 17000.0 135.0803 3200.0 135.1162 33000.0 137.0592 470000.0 137.07 2100.0 137.0772 3200.0 137.132 28000.0 139.4205 2700.0 140.0677 51000.0 147.1163 36000.0 149.0957 28000.0 149.1321 14000.0 149.6881 5100.0 149.7083 3500.0 151.1118 9400.0 159.4804 2600.0 160.7429 2200.0 161.0959 36000.0 161.132 18000.0 162.9172 2300.0 163.1113 26000.0 163.1467 3900.0 165.0906 19000.0 165.1266 2900.0 167.106 7000.0 173.5282 78000.0 173.5414 30000.0 175.1113 28000.0 175.1477 7900.0 177.1271 6500.0 179.1063 33000.0 181.1214 7100.0 189.1265 3000.0 191.8291 2300.0 193.1218 29000.0 193.8934 2100.0 203.1791 99000.0 205.1945 9800.0 207.1373 2900.0 213.0795 2700.0 213.1635 36000.0 221.1897 40000.0 231.1741 200000.0 239.2363 3100.0 241.1585 21000.0 249.1567 4100.0 249.1845 230000.0 259.1655 2400.0 259.9731 2600.0 269.4054 2600.0 273.0797 2400.0 277.1798 820000.0 282.2791 21000.0 295.1907 92000.0 313.2737 150000.0 320.2217 72000.0 340.1655 3100.0 351.2165 57000.0 423.4271 2400.0 507.1234 3000.0 589.447 130000.0 593.5206 2700.0 670.1998 2400.0 742.7817 2900.0 END IONS BEGIN IONS SCANS=764 PEPMASS=657.2921 CHARGE=1 COLLISION_ENERGY=0.0 81.9826 2300.0 98.14 2900.0 99.3093 2400.0 109.0493 2400.0 114.4907 2400.0 129.6068 2400.0 136.9167 2600.0 151.3469 2200.0 152.5498 2600.0 173.5267 60000.0 173.5416 26000.0 203.1183 5200.0 225.8352 2500.0 253.1685 6100.0 295.1784 3100.0 300.7368 2900.0 309.5676 2500.0 311.1748 4300.0 318.1596 10000.0 320.1746 3200.0 332.1762 8700.0 351.1698 22000.0 390.1829 16000.0 409.1947 2800.0 409.203 5600.0 410.2075 9000.0 411.194 9200.0 418.1729 3000.0 422.2165 5100.0 424.2253 14000.0 425.2341 22000.0 430.2532 3200.0 437.2354 14000.0 450.2033 26000.0 451.2134 7100.0 452.2116 5900.0 452.2213 10000.0 453.2277 5900.0 455.2556 3400.0 457.2362 100000.0 464.222 13000.0 465.2302 12000.0 466.2478 6100.0 469.2259 12000.0 470.2509 2800.0 479.2441 16000.0 480.2386 21000.0 481.258 3800.0 482.272 18000.0 483.2726 30000.0 484.2791 24000.0 493.2539 23000.0 494.2422 4900.0 495.2391 17000.0 497.2558 26000.0 498.2676 13000.0 507.2275 3200.0 507.2379 12000.0 508.2586 24000.0 509.2877 19000.0 510.2623 130000.0 511.2703 84000.0 517.257 59000.0 521.2523 4300.0 522.2643 11000.0 523.2403 12000.0 524.2614 3800.0 524.2771 13000.0 525.2833 170000.0 526.2903 100000.0 527.263 42000.0 528.2567 15000.0 529.2486 2800.0 535.2689 21000.0 536.2541 32000.0 537.2531 4300.0 538.2566 41000.0 539.2666 14000.0 541.2807 55000.0 551.2646 27000.0 552.2749 3300.0 553.2805 220000.0 554.2548 13000.0 555.2581 28000.0 563.269 3700.0 565.252 8700.0 567.2599 15000.0 568.2517 7200.0 569.2754 6000.0 570.2832 13000.0 571.2912 26000.0 581.2755 27000.0 585.2719 18000.0 589.2844 3100.0 595.2907 15000.0 596.275 13000.0 597.2602 3200.0 598.2768 8600.0 613.3033 47000.0 614.2747 3000.0 615.2829 22000.0 651.3504 2500.0 657.2747 3200.0 END IONS BEGIN IONS SCANS=765 PEPMASS=584.4224 CHARGE=1 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139.1113 10000.0 142.0773 12000.0 143.0851 84000.0 144.0929 22000.0 145.1009 200000.0 146.1072 10000.0 147.08 20000.0 147.1164 73000.0 149.0957 34000.0 149.1322 8100.0 155.0852 23000.0 156.0928 11000.0 156.914 2600.0 157.1008 150000.0 158.1079 24000.0 159.0801 41000.0 159.1166 140000.0 160.0886 5700.0 160.1232 3800.0 161.0958 49000.0 161.1324 33000.0 163.1114 15000.0 165.0908 20000.0 167.1068 21000.0 169.101 56000.0 170.1082 13000.0 171.1167 100000.0 172.1243 16000.0 173.0958 15000.0 173.1324 110000.0 173.5285 91000.0 173.5424 25000.0 174.1375 3100.0 175.1117 30000.0 175.148 67000.0 177.1119 140000.0 177.1278 18000.0 179.0852 2400.0 180.1148 2800.0 181.1008 33000.0 181.1183 2500.0 182.1093 9000.0 183.1167 84000.0 184.1239 17000.0 185.0958 4000.0 185.1323 73000.0 186.14 11000.0 187.1119 13000.0 187.1288 2400.0 187.148 51000.0 189.1269 15000.0 190.1355 5900.0 191.1429 15000.0 191.9968 2600.0 193.101 16000.0 193.1206 4000.0 194.1088 9900.0 195.1171 64000.0 196.1241 14000.0 197.0976 8000.0 197.1323 100000.0 198.138 13000.0 199.1118 18000.0 199.1478 55000.0 200.1551 2900.0 201.1279 14000.0 201.1632 25000.0 203.1429 36000.0 207.1169 29000.0 207.1373 4100.0 208.1238 13000.0 208.1454 3100.0 209.1325 74000.0 210.1382 6200.0 211.1117 8600.0 211.1482 58000.0 212.1544 2600.0 213.1259 15000.0 213.1641 27000.0 215.1425 18000.0 216.1503 2500.0 217.1584 9800.0 219.1167 3500.0 221.1328 42000.0 221.154 27000.0 222.1399 13000.0 222.3696 2900.0 223.1113 3400.0 223.1481 55000.0 224.1536 6300.0 225.1274 19000.0 225.1639 32000.0 227.143 8900.0 227.5597 3100.0 229.1593 2700.0 231.4148 2400.0 233.1312 10000.0 233.1538 63000.0 234.1396 3200.0 234.1637 3000.0 235.148 38000.0 236.1537 2800.0 237.1295 2900.0 237.1635 37000.0 239.1463 16000.0 239.179 23000.0 241.1586 5200.0 241.1957 4700.0 247.1473 16000.0 247.1703 3800.0 248.1557 12000.0 249.1635 29000.0 250.1718 5800.0 251.1451 3000.0 251.1785 15000.0 253.1587 16000.0 253.1943 9400.0 255.1744 93000.0 257.1888 9100.0 259.1462 6700.0 259.17 3700.0 261.1632 20000.0 263.1792 22000.0 265.162 3300.0 265.1946 13000.0 266.2052 3200.0 267.1758 9400.0 267.2109 3600.0 267.6358 2300.0 269.1909 8000.0 271.2068 2900.0 273.189 3700.0 274.1921 4200.0 275.179 12000.0 277.1946 7700.0 279.1753 6900.0 279.2101 3300.0 281.1913 7200.0 282.2776 12000.0 283.176 3500.0 283.2062 6700.0 283.2828 30000.0 284.2862 13000.0 287.0411 2300.0 287.1764 2600.0 287.2023 5600.0 289.198 3200.0 297.1854 3300.0 299.2018 7600.0 299.3098 3100.0 300.3089 9400.0 327.2029 12000.0 337.2168 5600.0 339.2278 2600.0 345.2184 3900.0 350.0861 2700.0 351.2332 3500.0 352.2401 10000.0 353.2462 5500.0 360.2413 2700.0 365.2474 8300.0 366.2545 4500.0 367.2565 2300.0 371.2264 11000.0 442.8611 2500.0 450.9619 2800.0 502.3092 2500.0 504.3631 8400.0 551.3864 2700.0 END IONS BEGIN IONS SCANS=766 PEPMASS=591.2607 CHARGE=1 COLLISION_ENERGY=0.0 65.6949 250000.0 65.6976 68000.0 71.0851 2400.0 74.3811 2500.0 76.6178 2200.0 77.6136 2700.0 77.9612 2800.0 80.3847 2400.0 95.9042 2500.0 103.2774 2200.0 106.5952 2700.0 112.7473 2300.0 116.7795 2600.0 126.8429 2300.0 147.808 13000.0 147.822 12000.0 154.3024 2800.0 173.5222 27000.0 173.5324 38000.0 173.5413 38000.0 208.7007 2400.0 226.9857 2800.0 240.0339 2800.0 249.5225 2500.0 296.1861 2900.0 301.0438 2600.0 313.2737 4600.0 412.9143 3100.0 415.1892 3500.0 429.2062 9700.0 431.2235 2600.0 444.2306 19000.0 445.2391 22000.0 446.2452 10000.0 448.2617 35000.0 457.2351 3100.0 458.2456 13000.0 459.2178 34000.0 459.2565 23000.0 460.2191 2800.0 461.2383 3600.0 472.2254 49000.0 472.6832 3100.0 473.233 130000.0 474.2406 78000.0 475.2481 29000.0 476.2451 2900.0 485.233 51000.0 486.2379 11000.0 486.2536 4700.0 487.2487 510000.0 488.2543 15000.0 489.2273 44000.0 490.236 17000.0 496.4072 3500.0 500.2202 9700.0 501.2315 3800.0 502.2406 3000.0 503.2414 73000.0 504.2487 16000.0 505.2568 2900.0 513.2279 8800.0 515.2433 91000.0 517.2239 17000.0 518.2308 65000.0 519.2712 19000.0 531.0496 3900.0 531.2382 1500000.0 532.2462 590000.0 547.27 22000.0 548.2471 3300.0 549.2505 11000.0 559.2337 42000.0 563.2642 45000.0 576.2376 32000.0 590.2579 7000.0 591.0352 40000.0 591.2596 7700000.0 591.4326 18000.0 591.4833 37000.0 591.6028 4000.0 592.2572 9800.0 END IONS BEGIN IONS SCANS=767 PEPMASS=589.2453 CHARGE=1 COLLISION_ENERGY=0.0 65.469 23000.0 65.4721 120000.0 65.4905 2200.0 75.843 2600.0 82.1746 2300.0 90.8842 2100.0 91.6451 2000.0 95.5011 2600.0 98.87 2400.0 118.4966 3100.0 119.4494 2400.0 127.9686 2300.0 137.2718 2200.0 140.5991 2500.0 147.3057 9100.0 159.7553 2500.0 163.1587 2300.0 173.5311 75000.0 173.5447 5700.0 187.4626 2400.0 192.541 2300.0 214.1005 2500.0 222.2911 2800.0 236.1759 2600.0 272.3448 2300.0 325.3731 3600.0 331.9691 2500.0 442.2161 19000.0 443.2219 19000.0 444.2277 3200.0 446.2449 18000.0 456.2312 12000.0 457.1973 20000.0 457.2456 9300.0 469.1999 3400.0 470.2097 33000.0 471.217 79000.0 472.2252 43000.0 473.2327 26000.0 483.217 44000.0 484.2278 12000.0 485.2329 320000.0 486.2416 12000.0 487.2128 38000.0 488.2176 14000.0 498.207 3000.0 501.2271 53000.0 502.2327 18000.0 513.2282 52000.0 515.2077 7000.0 516.2135 34000.0 517.2635 11000.0 529.2225 960000.0 530.1394 5200.0 530.2305 330000.0 530.3247 6000.0 539.2117 3700.0 545.2551 14000.0 547.2278 2800.0 557.2169 25000.0 561.249 30000.0 589.2442 3600000.0 589.425 200000.0 END IONS BEGIN IONS SCANS=768 PEPMASS=824.5519 CHARGE=1 COLLISION_ENERGY=0.0 72.5281 2100.0 73.0281 2900.0 75.159 2200.0 77.0384 13000.0 79.0537 400000.0 81.0331 89000.0 81.0694 820000.0 81.0964 2300.0 81.656 2200.0 83.0487 96000.0 83.0804 2600.0 83.085 160000.0 83.1632 2200.0 85.0279 53000.0 85.0644 47000.0 91.0377 2400.0 91.0537 270000.0 93.063 3600.0 93.0693 630000.0 95.0486 73000.0 95.085 640000.0 97.0279 40000.0 97.0643 140000.0 97.1006 84000.0 97.499 2500.0 99.0437 12000.0 99.0799 46000.0 99.0869 2300.0 99.6097 2300.0 102.0857 2700.0 105.0444 3000.0 105.0693 250000.0 107.0488 28000.0 107.085 470000.0 107.3413 2600.0 109.0282 22000.0 109.0643 58000.0 109.1006 380000.0 111.0437 7200.0 111.0799 81000.0 113.0959 16000.0 114.0343 2500.0 114.7527 2300.0 116.2247 2300.0 117.0694 140000.0 119.0766 17000.0 119.085 320000.0 121.0643 35000.0 121.0913 2500.0 121.1006 470000.0 123.0801 50000.0 123.1163 150000.0 125.0955 58000.0 127.0387 41000.0 129.0543 9600.0 129.0694 36000.0 131.0748 3000.0 131.085 240000.0 133.0642 3200.0 133.0905 3800.0 133.1006 390000.0 135.08 47000.0 135.1057 11000.0 135.1163 420000.0 137.0956 55000.0 137.1319 29000.0 139.111 25000.0 141.0692 7600.0 143.0851 49000.0 145.0493 2400.0 145.0889 3600.0 145.1006 250000.0 147.0803 13000.0 147.1163 250000.0 149.0956 130000.0 149.12 3100.0 149.1319 340000.0 151.1113 46000.0 151.1477 6300.0 153.126 2900.0 155.0847 13000.0 155.1059 13000.0 157.0646 2300.0 157.1007 71000.0 159.0816 3000.0 159.1026 3000.0 159.1164 300000.0 160.7279 2300.0 161.0959 6500.0 161.132 130000.0 162.4591 2300.0 163.1112 99000.0 163.1475 60000.0 165.1271 33000.0 169.1006 20000.0 171.1012 8100.0 171.1164 64000.0 173.045 6900.0 173.1167 7100.0 173.132 160000.0 173.5198 5000.0 173.5291 180000.0 173.5414 70000.0 174.7771 2700.0 175.1105 11000.0 175.1479 60000.0 177.1267 79000.0 177.1438 2500.0 177.1638 8600.0 179.1426 30000.0 181.1219 20000.0 183.1163 38000.0 184.0727 2300.0 185.132 53000.0 187.112 9100.0 187.1475 66000.0 187.9499 2500.0 189.1122 3100.0 189.1637 16000.0 190.679 2400.0 191.143 10000.0 193.1567 2600.0 195.1191 5600.0 195.1374 91000.0 197.1322 31000.0 199.1482 30000.0 201.1258 2900.0 201.1637 32000.0 203.1426 11000.0 205.376 2600.0 208.5806 2400.0 209.1318 2700.0 211.1479 9300.0 213.1643 7700.0 215.1786 5300.0 215.7406 2500.0 217.1228 2600.0 217.1594 4000.0 219.138 3200.0 219.174 17000.0 227.1272 22000.0 228.7699 2300.0 229.1425 15000.0 229.1949 27000.0 235.1694 6600.0 239.1792 45000.0 241.195 4700.0 243.2101 50000.0 247.205 30000.0 255.1586 77000.0 257.1894 99000.0 259.2052 11000.0 261.2207 160000.0 267.1587 8800.0 269.1743 170000.0 275.2003 270000.0 277.1497 2600.0 278.2367 2500.0 291.1958 8200.0 292.1987 3900.0 304.4644 2400.0 309.2055 13000.0 314.2397 2300.0 317.2476 14000.0 331.2237 3700.0 335.2579 930000.0 337.2738 17000.0 349.2372 68000.0 360.6524 2400.0 363.5677 2300.0 365.3052 16000.0 367.2501 2800.0 379.9044 2300.0 398.6815 2600.0 433.663 2400.0 434.9537 2400.0 455.0991 2800.0 489.3567 3000.0 515.3719 61000.0 529.3887 210000.0 550.7359 2700.0 569.4207 6200.0 597.1699 2600.0 609.4522 11000.0 645.6032 2700.0 669.8094 2700.0 END IONS BEGIN IONS SCANS=769 PEPMASS=829.5073 CHARGE=1 COLLISION_ENERGY=0.0 73.028 60000.0 73.748 2300.0 79.0538 53000.0 80.2586 2600.0 81.0331 31000.0 81.0694 120000.0 83.0489 3800.0 83.0852 12000.0 85.0279 130000.0 85.4293 2200.0 87.0437 6700.0 91.0385 110000.0 91.0538 32000.0 92.1666 160000.0 92.1711 24000.0 93.0694 73000.0 94.1514 2400.0 95.0485 6500.0 95.085 120000.0 95.8113 2700.0 97.0279 120000.0 97.0646 8900.0 97.1007 2900.0 98.7878 2600.0 99.0435 18000.0 99.0803 2200.0 101.0228 54000.0 103.0385 19000.0 103.7241 2200.0 105.0695 22000.0 107.0849 61000.0 109.0281 32000.0 109.0643 3000.0 109.1006 57000.0 110.8192 2400.0 111.0802 2600.0 115.0383 13000.0 117.0691 13000.0 119.085 42000.0 121.0634 2300.0 121.1006 71000.0 123.0804 3700.0 123.1161 21000.0 127.0386 69000.0 129.0537 3900.0 131.085 21000.0 133.1005 45000.0 135.1164 61000.0 135.3026 2300.0 137.0955 4100.0 145.0493 20000.0 145.1006 28000.0 145.8727 2800.0 147.0811 3400.0 147.1163 33000.0 149.1319 33000.0 149.6718 3200.0 149.6823 4800.0 149.6932 5400.0 157.1008 2900.0 159.1165 29000.0 161.1324 14000.0 163.1476 11000.0 173.132 23000.0 173.528 120000.0 173.5455 15000.0 183.0647 9600.0 184.0722 2400.0 184.6671 2300.0 185.0417 78000.0 187.1476 5900.0 203.0524 25000.0 219.5743 2300.0 223.3848 2300.0 224.3772 2300.0 227.0916 2600.0 234.0645 2500.0 234.892 2300.0 235.1296 3200.0 241.0684 8000.0 243.0835 150000.0 251.1241 3500.0 259.0775 5700.0 261.2208 43000.0 275.2 5700.0 298.0102 3200.0 301.216 2500.0 303.1941 9800.0 307.5274 2500.0 333.2035 790000.0 333.2488 8200.0 335.258 170000.0 336.8306 2300.0 341.7664 2500.0 359.5538 2700.0 363.2519 4100.0 389.2293 57000.0 392.5123 2500.0 413.1755 3400.0 428.0931 2500.0 439.1942 100000.0 453.2095 180000.0 465.2072 2800.0 466.9966 2400.0 469.203 21000.0 479.2252 4300.0 493.2399 11000.0 497.311 24000.0 519.2002 5000.0 519.2253 16000.0 519.2928 3000000.0 519.4749 4900.0 521.3076 25000.0 549.3397 14000.0 551.1851 8000.0 551.2826 1800000.0 551.3812 3000.0 551.478 3700.0 552.2816 3700.0 552.2941 2600.0 568.5945 2700.0 569.3848 3400.0 591.3207 2700.0 607.189 2600.0 641.5445 2800.0 649.4444 43000.0 657.6707 2800.0 667.4538 160000.0 717.4179 150000.0 731.4334 210000.0 747.4286 37000.0 757.4444 3200.0 763.1093 2900.0 771.4635 17000.0 829.5065 4100000.0 830.5122 3400.0 END IONS BEGIN IONS SCANS=770 PEPMASS=685.2867 CHARGE=1 COLLISION_ENERGY=0.0 68.2426 2200.0 76.8089 2400.0 79.3565 2200.0 81.4219 2500.0 82.1998 2300.0 85.1594 2300.0 85.7182 2300.0 85.8657 2500.0 97.8785 2900.0 101.5865 2800.0 101.6324 2300.0 105.4419 2400.0 106.9284 2300.0 108.8175 2500.0 109.6264 2300.0 115.4255 2900.0 121.3259 2600.0 129.081 2500.0 130.1757 2200.0 133.1284 2500.0 134.3678 2500.0 135.1511 2300.0 146.7283 2400.0 149.0545 2700.0 149.6785 2900.0 149.6893 6500.0 149.6998 2700.0 150.5961 2700.0 153.0339 2500.0 156.9906 2100.0 158.751 2500.0 166.8512 2300.0 173.528 94000.0 173.5395 39000.0 181.2508 2400.0 201.0292 3000.0 203.0307 2500.0 210.2559 2600.0 211.6935 2600.0 214.6929 2400.0 220.3445 2300.0 223.4283 2500.0 224.4972 2800.0 240.6496 2200.0 243.9904 2200.0 245.2283 2700.0 257.6508 2800.0 261.2387 2500.0 267.0532 2600.0 284.5462 2400.0 305.4597 2500.0 306.9187 2400.0 307.2252 2400.0 321.2508 2500.0 333.3622 2400.0 362.193 2600.0 375.1714 2400.0 410.2089 16000.0 411.2181 33000.0 423.2192 3100.0 424.2237 5000.0 425.2305 14000.0 437.2344 7100.0 452.2103 2600.0 453.2302 5500.0 465.2251 7900.0 466.2349 16000.0 479.3913 2700.0 494.2674 20000.0 495.2748 3500.0 497.2194 9300.0 498.2186 3800.0 507.2365 3500.0 509.2568 5700.0 510.2625 95000.0 511.2695 120000.0 512.278 430000.0 517.2567 6500.0 521.2531 19000.0 522.2527 2700.0 525.2821 34000.0 526.2912 85000.0 536.2576 3100.0 537.2647 4600.0 537.2801 12000.0 538.2565 66000.0 539.2655 100000.0 540.24 2900.0 542.2833 7500.0 544.2702 2700.0 553.2807 120000.0 554.2882 150000.0 564.2581 3300.0 567.2554 7100.0 580.2737 4300.0 581.2762 110000.0 582.2819 3800.0 583.2486 2700.0 595.261 2700.0 598.2785 27000.0 599.2863 3000.0 605.2779 7100.0 613.2996 39000.0 623.2852 11000.0 641.2973 31000.0 642.0474 2600.0 647.7911 2700.0 685.4411 12000.0 END IONS BEGIN IONS SCANS=771 PEPMASS=234.0974 CHARGE=1 COLLISION_ENERGY=0.0 43.5936 2100.0 43.6072 2000.0 43.8978 2800.0 44.084 2300.0 44.3361 2500.0 44.4058 2300.0 44.4673 2200.0 44.9024 2300.0 45.0333 1400000.0 45.0769 2500.0 45.3837 2300.0 46.0234 2000.0 46.4489 2400.0 46.4703 2200.0 46.7762 2300.0 46.9275 2600.0 47.3347 2400.0 47.4555 2300.0 47.5159 5200.0 48.0617 2100.0 49.039 2600.0 49.0919 2300.0 49.2304 4700.0 49.4819 2300.0 49.6818 2500.0 50.062 2100.0 50.2725 2300.0 50.5716 2200.0 50.65 2200.0 50.7952 2500.0 51.2143 2300.0 51.5802 2500.0 51.6271 2400.0 52.1293 2100.0 52.1919 2100.0 53.1111 2300.0 53.6295 2100.0 54.0537 2400.0 54.4973 4900.0 54.7008 2400.0 54.7886 2500.0 56.038 2500.0 56.3851 2200.0 56.7047 2300.0 56.7137 2300.0 56.8773 2400.0 56.9165 2100.0 56.9289 2200.0 57.6172 2300.0 57.6205 2400.0 58.0645 2900.0 58.3743 2100.0 58.7998 2300.0 59.1142 2200.0 59.5004 2400.0 59.7065 2700.0 60.1683 2300.0 60.2233 2100.0 60.3937 2300.0 61.4006 2300.0 61.73 2200.0 61.7992 2500.0 61.9618 2100.0 62.1722 2100.0 62.4272 2300.0 62.9868 2100.0 63.1159 2200.0 63.4183 2400.0 63.5365 2600.0 63.8494 2400.0 63.9014 2500.0 64.1286 2400.0 64.1831 2300.0 64.3351 2200.0 64.535 2300.0 67.2241 2500.0 67.6951 2200.0 68.1597 2600.0 68.3623 2100.0 68.7391 2600.0 68.7484 2500.0 69.6677 2300.0 69.7895 3000.0 69.8049 2700.0 70.0549 2400.0 70.0649 120000.0 70.8422 2400.0 71.2983 2200.0 71.3402 2300.0 71.3757 2200.0 72.4317 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113.5403 2400.0 114.0809 2300.0 114.0912 38000.0 114.8296 2600.0 115.4455 2600.0 116.062 2400.0 116.0703 480000.0 116.1975 2300.0 116.7623 2400.0 118.0398 2400.0 118.511 2400.0 119.0279 2400.0 119.3727 2200.0 121.0096 2400.0 122.0748 2200.0 123.8987 2600.0 127.1631 2400.0 128.3111 2300.0 129.1656 2300.0 129.4817 2500.0 130.0755 2600.0 130.0937 2700.0 131.8623 2800.0 131.9176 2300.0 133.7717 2500.0 135.2661 2800.0 135.801 2400.0 136.1495 2500.0 138.8815 2500.0 139.548 2600.0 146.9102 2300.0 148.0106 3000.0 149.6695 3700.0 149.6865 44000.0 149.6968 7500.0 150.9615 2800.0 151.0751 64000.0 152.0784 150000.0 153.3762 2400.0 153.4403 3300.0 155.849 2800.0 155.9152 2500.0 157.431 2400.0 158.0484 3000.0 160.1083 2400.0 161.0288 2900.0 163.1299 2500.0 163.9007 2500.0 166.9277 2800.0 167.0139 2600.0 169.3932 2300.0 171.5632 2900.0 173.5212 6100.0 173.5232 230000.0 173.5365 580000.0 173.5594 5400.0 174.6743 2400.0 177.2602 2200.0 178.5467 2200.0 180.0951 2600.0 181.1352 2900.0 181.7435 2600.0 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282.9391 2500.0 283.1761 5000.0 497.3945 5200.0 END IONS BEGIN IONS SCANS=784 PEPMASS=609.2704 CHARGE=1 COLLISION_ENERGY=0.0 64.1362 2600.0 67.6946 2600.0 67.6969 18000.0 73.1962 2200.0 74.6638 3000.0 91.6817 2200.0 99.4273 2300.0 107.0852 2500.0 108.1346 2800.0 115.0622 2400.0 118.783 2800.0 119.1282 2600.0 149.6839 11000.0 149.6946 8200.0 149.7056 6800.0 173.5226 8800.0 173.5323 5300.0 173.5362 37000.0 284.3261 2400.0 292.1808 19000.0 305.0201 2800.0 309.5731 2600.0 337.2962 2400.0 421.2393 5400.0 433.2406 6900.0 449.2295 6400.0 459.2184 74000.0 460.2258 18000.0 461.2362 7300.0 462.2057 3000.0 463.2136 160000.0 465.2382 2800.0 473.2318 2700.0 475.214 31000.0 476.2151 43000.0 477.2301 48000.0 480.251 25000.0 481.2613 36000.0 485.2333 62000.0 486.2037 9500.0 487.2491 20000.0 489.2257 11000.0 490.2274 3700.0 491.2452 33000.0 492.2514 25000.0 499.2114 7000.0 500.2197 3100.0 503.2436 110000.0 504.2147 3000.0 504.2331 8700.0 505.2553 21000.0 506.225 11000.0 507.2371 7500.0 508.2402 12000.0 509.2539 23000.0 513.2266 6800.0 515.244 110000.0 517.2234 28000.0 518.2307 22000.0 519.2449 3400.0 519.2565 2500.0 520.2128 2700.0 520.2403 3000.0 521.2494 55000.0 522.2578 4000.0 531.1461 9100.0 531.2392 380000.0 532.2467 19000.0 533.2544 210000.0 534.223 38000.0 535.2346 260000.0 536.2421 160000.0 541.2234 21000.0 547.1953 4500.0 548.2394 14000.0 549.2496 260000.0 550.2578 100000.0 559.2347 170000.0 562.2185 32000.0 563.2659 23000.0 565.2809 52000.0 566.2504 12000.0 569.0058 2600.0 577.2448 210000.0 579.2208 3100.0 580.2299 3400.0 581.2712 19000.0 591.2607 270000.0 594.2451 58000.0 609.271 450000.0 END IONS BEGIN IONS SCANS=785 PEPMASS=607.2552 CHARGE=1 COLLISION_ENERGY=0.0 65.4047 2300.0 67.5244 2200.0 72.393 2600.0 107.2053 2600.0 111.3005 2300.0 173.5205 14000.0 173.5383 50000.0 222.5515 2500.0 237.1385 3400.0 251.1214 3400.0 328.3976 2500.0 355.9943 2200.0 380.8912 2300.0 436.7724 2400.0 446.2091 2600.0 447.219 3900.0 454.1742 11000.0 458.2139 2900.0 459.2282 2500.0 461.2332 2800.0 473.2322 4200.0 474.2025 7800.0 475.2153 4700.0 475.2308 2500.0 485.1931 3100.0 487.2084 6800.0 488.2215 3800.0 489.2234 7400.0 491.2057 4600.0 501.2269 18000.0 502.2029 7500.0 503.2443 27000.0 504.2184 2900.0 505.2195 8200.0 515.208 6500.0 516.2183 2800.0 519.2371 27000.0 529.2231 17000.0 531.239 16000.0 532.2118 2800.0 533.2165 4000.0 534.2288 11000.0 537.0652 2700.0 547.2343 140000.0 548.2416 41000.0 557.2191 8400.0 563.2626 3400.0 575.2296 39000.0 579.261 15000.0 589.2427 3700.0 607.2556 77000.0 607.4212 2900.0 END IONS BEGIN IONS SCANS=786 PEPMASS=457.3502 CHARGE=1 COLLISION_ENERGY=0.0 56.6645 2600.0 56.7749 2400.0 57.3326 2300.0 57.5543 2400.0 58.1712 2100.0 58.5091 2300.0 62.0315 2300.0 62.8535 2200.0 63.1053 2400.0 70.2726 2200.0 73.6565 2300.0 75.1079 2300.0 75.2746 2400.0 75.735 2200.0 76.0191 2400.0 77.6431 2200.0 77.7481 2600.0 78.0257 2600.0 78.9745 2300.0 79.3041 2300.0 88.434 2300.0 91.066 2300.0 92.2829 2500.0 94.1445 2400.0 95.6813 2600.0 96.2724 2100.0 99.1671 2400.0 99.6224 2300.0 103.1683 2300.0 113.2175 2500.0 139.2465 3100.0 141.8824 2200.0 145.8263 2300.0 148.469 2700.0 149.6702 2900.0 149.681 4500.0 149.6908 11000.0 151.5893 2500.0 165.7539 3100.0 173.5231 31000.0 173.5318 26000.0 173.5402 56000.0 181.6564 2800.0 186.5734 2500.0 187.5005 2300.0 261.1302 13000.0 282.0934 2500.0 284.529 2800.0 291.9035 2600.0 295.8712 3000.0 338.6106 2900.0 388.8661 2600.0 390.4782 2400.0 453.39 2600.0 457.2736 19000.0 457.35 2400000.0 END IONS BEGIN IONS SCANS=787 PEPMASS=453.3983 CHARGE=1 COLLISION_ENERGY=0.0 57.0697 3600.0 59.6754 2800.0 67.6426 2500.0 71.0853 3000.0 87.0437 3900.0 89.0592 180000.0 89.0655 3800.0 90.0577 2700.0 90.0626 38000.0 103.5073 2600.0 104.4422 2200.0 107.0702 3800.0 133.0854 81000.0 134.089 24000.0 151.0961 5500.0 173.5203 3800.0 173.5385 15000.0 177.1117 8000.0 195.1226 4900.0 196.1248 3200.0 239.1485 11000.0 240.1521 6400.0 319.2003 2500.0 347.3362 2300.0 END IONS BEGIN IONS SCANS=788 PEPMASS=759.573 CHARGE=1 COLLISION_ENERGY=0.0 71.0728 4200.0 86.0961 190000.0 86.1025 4300.0 87.0994 25000.0 95.0851 2600.0 98.9839 8400.0 104.1066 18000.0 124.9995 92000.0 126.0026 2700.0 135.9316 2500.0 144.927 2600.0 153.4008 2400.0 173.5249 18000.0 173.5396 23000.0 180.2381 2300.0 184.0352 9200.0 184.0733 2100000.0 184.103 5300.0 184.1121 9800.0 185.0505 2600.0 185.0766 290000.0 245.7511 2500.0 312.9821 2300.0 416.5186 2500.0 431.5018 2400.0 759.4279 2800.0 END IONS BEGIN IONS SCANS=789 PEPMASS=758.5695 CHARGE=1 COLLISION_ENERGY=0.0 70.7941 2200.0 70.9921 2200.0 71.0726 190000.0 71.8643 2300.0 72.659 2600.0 72.8933 2400.0 72.908 4600.0 73.0465 15000.0 75.5635 2300.0 75.5719 2300.0 75.6984 2300.0 76.2334 4400.0 76.6828 2300.0 76.7043 2500.0 77.2408 2200.0 77.6998 2600.0 77.7398 2700.0 77.7538 2700.0 79.2652 2200.0 79.797 2400.0 80.8623 2400.0 81.0698 5000.0 81.1035 2200.0 81.3055 3600.0 81.4327 2500.0 81.494 2600.0 81.5289 4500.0 84.324 2400.0 84.8248 2100.0 85.7006 2400.0 86.096 3900000.0 86.1023 3700.0 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157.7558 2500.0 158.5651 2400.0 160.4346 2400.0 160.6052 2200.0 160.8972 2300.0 163.6245 2600.0 165.4177 2500.0 166.0264 2300.0 167.0553 8400.0 171.379 2300.0 172.1232 2300.0 173.5241 370000.0 173.5383 560000.0 173.9842 2500.0 175.1709 2200.0 176.7903 2600.0 180.0883 2400.0 181.9297 2900.0 183.9487 2300.0 184.0136 7300.0 184.024 6400.0 184.035 240000.0 184.0425 19000.0 184.0732 41000000.0 184.1031 100000.0 184.1121 180000.0 184.123 35000.0 184.145 9900.0 184.7319 2400.0 185.0767 140000.0 185.1197 2500.0 186.0776 35000.0 190.0332 2400.0 191.5498 2200.0 192.8828 2400.0 194.227 2400.0 195.5092 2800.0 196.1825 2600.0 197.3054 2400.0 198.9149 2500.0 199.5731 2500.0 200.1978 2600.0 200.5831 2500.0 201.0338 2300.0 202.1187 2500.0 203.8069 2300.0 206.5892 2700.0 206.6091 2300.0 211.4036 2500.0 212.7793 2200.0 215.1229 2500.0 215.3143 2600.0 216.4641 2300.0 218.8786 2400.0 219.2489 2800.0 219.4895 2900.0 220.1756 2100.0 221.02 2700.0 223.5563 2300.0 225.0432 9900.0 225.1216 2300.0 230.653 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498.2758 2500.0 502.3335 3200.0 518.4486 2600.0 527.5348 2400.0 530.0026 2500.0 530.4404 3100.0 540.9172 2900.0 548.5548 2700.0 552.8876 2900.0 553.3553 2500.0 572.0468 2600.0 585.3878 2700.0 588.6595 3000.0 597.2927 2900.0 608.7272 3100.0 647.7231 2500.0 651.3852 2400.0 652.3825 3200.0 671.1947 3200.0 674.2781 2300.0 680.7303 2700.0 714.9096 5600.0 720.7181 2400.0 737.5146 2500.0 757.9864 2700.0 758.7286 2500.0 761.2037 2600.0 767.3091 2800.0 END IONS BEGIN IONS SCANS=790 PEPMASS=716.5224 CHARGE=1 COLLISION_ENERGY=0.0 67.9986 2400.0 68.1433 2300.0 68.2164 2300.0 68.7648 2300.0 68.872 2600.0 69.036 2300.0 69.0695 300000.0 69.7729 2600.0 70.6219 2200.0 70.6424 2300.0 71.0012 2300.0 71.0486 2300.0 71.0852 480000.0 71.1285 2200.0 72.7835 2300.0 73.0281 110000.0 73.0646 5200.0 74.5569 2600.0 74.7187 2500.0 75.0807 2300.0 75.369 2500.0 76.1862 2500.0 78.0078 2100.0 78.9707 2400.0 79.0539 160000.0 79.8508 2600.0 80.0831 2200.0 80.0993 2100.0 80.4092 2400.0 80.4768 2100.0 81.0153 2600.0 81.0695 1200000.0 81.3691 2200.0 82.0835 2700.0 83.0852 490000.0 83.1275 2200.0 83.2642 2200.0 83.5727 2500.0 83.8183 2000.0 84.3973 2600.0 85.0641 11000.0 85.1008 400000.0 85.1798 2300.0 86.0383 2800.0 86.3262 2300.0 87.0436 46000.0 87.9632 2600.0 88.5064 2300.0 89.0592 440000.0 90.5394 2400.0 91.0539 70000.0 91.2287 2700.0 91.4628 2300.0 91.8222 2000.0 93.0695 250000.0 93.0905 2800.0 93.2101 2200.0 93.36 2500.0 93.7127 2300.0 94.2202 2100.0 94.7366 2500.0 95.0082 2800.0 95.0851 1300000.0 96.1602 2100.0 96.3188 2400.0 97.0643 9100.0 97.1008 290000.0 97.6326 2400.0 99.0801 11000.0 99.7349 2500.0 100.4336 2700.0 100.6273 2600.0 101.9156 2200.0 102.2977 2400.0 102.4035 2300.0 104.2888 2300.0 105.0116 2300.0 105.0694 65000.0 105.5459 2500.0 105.8063 2100.0 105.8988 2400.0 106.4033 2300.0 107.0851 180000.0 107.1487 2400.0 107.5417 2800.0 108.0108 2400.0 108.3286 2800.0 108.8434 2300.0 109.1008 680000.0 110.6985 2400.0 110.7728 2400.0 111.0798 11000.0 111.1165 55000.0 111.9369 2500.0 113.0951 2400.0 113.8308 2500.0 114.2567 2200.0 116.5805 2500.0 117.3544 2800.0 119.0851 73000.0 120.3883 2800.0 121.1008 230000.0 121.1821 2300.0 122.2213 2200.0 123.1164 440000.0 124.453 2400.0 125.0956 2900.0 125.1321 8800.0 126.4057 2400.0 126.8982 2500.0 126.9127 2500.0 127.1104 2400.0 129.5272 2500.0 130.7688 2200.0 130.8589 2300.0 131.0701 5600.0 132.889 2700.0 133.0854 190000.0 133.1009 110000.0 135.099 2700.0 135.1165 150000.0 137.1321 180000.0 138.3481 2500.0 138.9494 2500.0 139.355 2100.0 143.0677 2600.0 143.8676 2100.0 143.887 2800.0 146.0079 2300.0 147.1164 91000.0 148.5191 2900.0 149.132 65000.0 149.6879 37000.0 149.6974 3200.0 149.8968 2500.0 150.7867 2700.0 151.1477 47000.0 151.7819 2200.0 153.1265 17000.0 153.1869 2700.0 155.0099 8600.0 156.1038 2900.0 158.1177 2600.0 161.1322 76000.0 162.7343 2300.0 163.1478 47000.0 164.0916 2700.0 164.4752 2400.0 165.1637 11000.0 166.1757 2200.0 167.3941 2200.0 167.5936 2200.0 167.702 2300.0 168.694 2200.0 169.0801 2300.0 171.2242 2400.0 171.9465 2500.0 173.5143 3200.0 173.5242 16000.0 173.5298 400000.0 173.542 120000.0 173.5534 3500.0 175.148 59000.0 177.1117 20000.0 177.1646 2500.0 180.5535 3000.0 181.3994 2600.0 182.1811 2400.0 183.04 2400.0 188.6855 2400.0 189.1632 2700.0 189.5597 2300.0 190.4684 2600.0 193.9954 2600.0 194.6079 2300.0 197.4326 2400.0 202.0613 2700.0 203.1788 2500.0 206.2687 2500.0 210.5452 2300.0 210.8956 2300.0 213.2902 2400.0 216.1422 2400.0 217.317 2800.0 218.1834 2700.0 221.2268 13000.0 222.9127 2600.0 226.4146 2300.0 229.6614 2500.0 232.3888 2500.0 234.6832 2600.0 237.9634 2500.0 238.5622 2800.0 239.2366 170000.0 245.2258 19000.0 249.9818 2900.0 251.1828 2300.0 252.6499 2700.0 259.5567 2400.0 261.2231 3000.0 262.253 15000.0 262.3032 2400.0 263.2361 140000.0 263.2595 5400.0 264.8881 2500.0 268.275 2600.0 276.7149 2400.0 280.5891 2500.0 282.2793 51000.0 286.318 2600.0 290.6279 2600.0 301.7164 2600.0 306.2792 250000.0 307.5021 2500.0 307.5738 2600.0 311.5699 2900.0 313.274 120000.0 314.3589 2500.0 314.3831 2400.0 314.7646 2800.0 317.0927 2300.0 330.0018 2600.0 332.4828 2700.0 337.2734 94000.0 340.8206 2800.0 356.4203 2400.0 356.8652 2800.0 361.5662 2400.0 365.4274 2300.0 378.0869 2600.0 381.6018 2400.0 387.4032 2600.0 387.6505 2900.0 393.3732 2800.0 393.7509 2500.0 393.9296 2500.0 394.355 2400.0 401.7914 2400.0 404.642 2500.0 405.3759 2600.0 406.559 2500.0 406.8868 2800.0 407.0698 2600.0 412.4703 2700.0 413.2047 2500.0 416.5734 2700.0 422.8932 2500.0 437.5087 2300.0 438.4325 2300.0 439.697 2500.0 441.593 2400.0 455.6075 2700.0 463.3105 2800.0 475.9422 2600.0 492.1132 2800.0 493.4934 2800.0 494.3549 2300.0 497.3583 2500.0 503.5542 3000.0 516.6235 2700.0 528.4865 2400.0 536.754 2600.0 551.6639 2700.0 553.2613 2700.0 554.0922 2700.0 566.7211 2700.0 573.4891 74000.0 575.4055 7200.0 575.5034 1200000.0 575.6008 3800.0 582.8725 2600.0 607.0582 2800.0 614.0221 2600.0 641.746 2700.0 650.6205 2500.0 653.3632 3000.0 658.2759 3600.0 682.624 2700.0 717.6682 2300.0 END IONS BEGIN IONS SCANS=791 PEPMASS=827.4916 CHARGE=1 COLLISION_ENERGY=0.0 73.0281 11000.0 75.5892 2500.0 79.0538 13000.0 81.0694 18000.0 83.0849 3400.0 85.0279 21000.0 91.0385 14000.0 91.0537 3200.0 91.9402 5000.0 91.9441 24000.0 93.0693 15000.0 95.085 18000.0 97.0279 20000.0 97.1007 3000.0 99.044 2600.0 100.7638 2700.0 101.0226 5400.0 107.085 15000.0 109.1005 12000.0 119.0848 2400.0 121.1005 10000.0 125.0953 3600.0 127.0384 7200.0 133.1019 2400.0 141.1751 2600.0 147.1163 3400.0 173.5208 18000.0 173.5344 67000.0 173.5413 15000.0 183.0658 2500.0 185.0419 14000.0 187.9097 2700.0 227.1272 7900.0 243.0835 35000.0 258.5496 3100.0 260.8489 2400.0 261.2214 6100.0 289.1938 2400.0 291.1952 13000.0 331.1878 90000.0 335.2585 26000.0 337.2716 2900.0 338.1385 3000.0 338.2767 3200.0 387.2149 8900.0 490.0255 3000.0 497.3039 3500.0 519.2926 510000.0 519.381 6300.0 549.2665 270000.0 571.0659 2700.0 656.6649 2500.0 665.4386 26000.0 827.3099 5600.0 827.4902 550000.0 827.6812 3500.0 END IONS BEGIN IONS 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556.2091 26000.0 557.2358 2800.0 557.2529 3900.0 558.2629 6800.0 559.2349 190000.0 560.2418 29000.0 561.2497 50000.0 563.2603 32000.0 573.2481 71000.0 574.2576 600000.0 575.0568 22000.0 575.266 4100000.0 575.3472 4700.0 576.2467 3200.0 576.2619 8000.0 577.2483 8400.0 579.2646 4300.0 585.2485 27000.0 587.23 45000.0 588.238 7000.0 589.2442 9400.0 591.2599 190000.0 601.2452 26000.0 602.136 9900.0 602.2532 730000.0 602.3643 4500.0 603.2592 16000.0 605.2655 58000.0 606.274 28000.0 607.2864 85000.0 615.2563 3400.0 616.2674 12000.0 617.2773 28000.0 619.2556 260000.0 619.3665 4800.0 633.2722 16000.0 634.2791 380000.0 634.4604 31000.0 635.2868 200000.0 END IONS BEGIN IONS SCANS=795 PEPMASS=657.269 CHARGE=1 COLLISION_ENERGY=0.0 66.4833 2800.0 66.8185 3000.0 70.6332 2400.0 71.4522 3700.0 72.9184 3300.0 73.0293 160000.0 73.0322 16000.0 73.2594 3300.0 75.9832 3100.0 76.4532 2800.0 77.162 2200.0 77.4737 2500.0 78.3045 3300.0 78.6336 2800.0 82.0261 2500.0 87.7355 3400.0 88.0602 3400.0 90.397 2800.0 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179.0535 7500.0 179.0704 510000.0 179.1068 330000.0 179.1428 15000.0 181.086 330000.0 185.0962 67000.0 185.1325 10000.0 187.1118 28000.0 188.0834 49000.0 189.0734 6500.0 189.0912 550000.0 189.1275 130000.0 191.0713 19000.0 191.1067 170000.0 191.1433 2800.0 192.0782 60000.0 193.0653 16000.0 193.0861 870000.0 193.1219 72000.0 193.1968 2300.0 195.1016 110000.0 199.1117 47000.0 199.1485 4400.0 201.1277 11000.0 202.0992 21000.0 203.1069 500000.0 203.1426 46000.0 205.1225 100000.0 206.0937 33000.0 207.0835 2000.0 207.1018 900000.0 207.1382 57000.0 207.1759 3100.0 213.1279 24000.0 215.143 11000.0 217.1226 320000.0 217.1581 11000.0 219.1383 28000.0 220.109 2600.0 221.1174 360000.0 221.1543 23000.0 227.143 5400.0 231.1382 120000.0 231.1634 2900.0 231.1758 7900.0 233.1539 3700.0 235.133 180000.0 235.1599 3400.0 235.1709 2700.0 241.1588 5100.0 245.1538 45000.0 245.191 4400.0 249.1486 69000.0 259.1691 23000.0 261.1801 2700.0 263.1641 39000.0 269.1932 3100.0 273.1855 18000.0 277.1802 41000.0 277.2133 6600.0 283.9964 3200.0 287.2004 13000.0 291.1959 36000.0 291.3027 3100.0 301.2155 10000.0 305.2109 37000.0 319.2263 29000.0 333.2413 3900.0 347.2595 2600.0 361.2716 11000.0 375.2912 20000.0 375.3589 3500.0 385.3465 47000.0 389.3427 3300.0 402.3112 6100.0 403.3601 14000.0 413.3417 46000.0 416.3281 28000.0 431.3521 160000.0 END IONS BEGIN IONS SCANS=798 PEPMASS=822.5365 CHARGE=1 COLLISION_ENERGY=0.0 74.5333 2300.0 79.0538 16000.0 81.0694 29000.0 83.0489 2900.0 83.085 8400.0 91.0538 9000.0 93.0694 26000.0 95.0484 2700.0 95.0795 2200.0 95.085 30000.0 97.0278 6800.0 97.1008 10000.0 105.0694 8200.0 107.0486 2700.0 107.0851 20000.0 109.1006 22000.0 117.0689 3400.0 119.085 8800.0 121.1008 18000.0 123.0805 2900.0 123.1169 4300.0 125.0955 11000.0 131.0851 7600.0 133.1007 8700.0 135.1166 10000.0 137.1325 2300.0 145.1007 10000.0 147.0796 4300.0 147.1159 9100.0 149.0953 3100.0 149.1318 9400.0 157.7185 2900.0 159.1164 7800.0 161.1319 3600.0 163.1486 3200.0 165.0904 3100.0 171.1011 3100.0 173.1319 5600.0 173.5368 34000.0 175.1136 3000.0 189.1115 4000.0 223.1328 25000.0 243.2115 3200.0 261.2211 8100.0 273.1849 17000.0 291.1575 3300.0 291.1955 160000.0 335.2583 51000.0 365.2327 11000.0 625.449 11000.0 656.7913 2800.0 811.713 2500.0 END IONS BEGIN IONS SCANS=799 PEPMASS=681.3289 CHARGE=1 COLLISION_ENERGY=0.0 69.9239 2300.0 70.6281 2400.0 71.6818 2300.0 94.0767 2600.0 109.0634 2500.0 139.8509 2300.0 151.2516 2500.0 173.5188 4500.0 173.5372 59000.0 225.1392 5700.0 226.1458 4200.0 239.1537 5500.0 290.1378 2800.0 294.9744 2400.0 422.1484 2900.0 446.2116 5600.0 447.2183 4500.0 451.2829 5200.0 454.1767 9600.0 459.2194 5500.0 472.1845 3700.0 473.2264 3100.0 474.2043 10000.0 475.2201 3300.0 487.2121 34000.0 489.2257 6500.0 501.2273 15000.0 502.2028 15000.0 515.2077 26000.0 519.2388 16000.0 529.2236 43000.0 533.2535 8800.0 534.2271 14000.0 547.2407 32000.0 561.2488 3100.0 575.2651 720000.0 576.2719 4000.0 583.9219 3100.0 603.2604 54000.0 607.2833 4200.0 635.2862 79000.0 646.9149 3200.0 END IONS BEGIN IONS SCANS=800 PEPMASS=615.2582 CHARGE=1 COLLISION_ENERGY=0.0 68.4896 2200.0 81.0695 3700.0 89.0592 70000.0 90.1715 2200.0 93.0692 9300.0 95.0488 12000.0 95.0851 14000.0 95.1576 2500.0 97.0641 2700.0 105.0693 2300.0 107.085 11000.0 107.2692 2700.0 109.1003 2900.0 119.0851 16000.0 121.1007 14000.0 123.08 12000.0 125.0591 31000.0 133.0854 29000.0 133.1003 13000.0 134.8042 14000.0 134.8162 12000.0 135.0796 4000.0 136.577 2200.0 137.0954 2900.0 143.0843 7700.0 145.101 18000.0 147.0802 12000.0 150.2494 3000.0 151.0747 32000.0 157.1009 11000.0 159.1166 9600.0 161.0953 8800.0 161.1324 2900.0 163.1114 57000.0 165.0904 56000.0 171.1169 14000.0 173.1323 4900.0 173.5262 49000.0 173.5413 53000.0 179.1063 2800.0 181.1217 81000.0 183.1172 2500.0 185.1326 3200.0 189.128 12000.0 191.1425 3300.0 197.1328 5100.0 198.3016 2900.0 199.1123 9400.0 203.1429 26000.0 207.1376 18000.0 211.1465 5800.0 217.6695 2400.0 221.1533 78000.0 227.1417 7500.0 233.1523 6000.0 243.1389 3000.0 245.813 2600.0 247.1697 10000.0 271.1707 3000.0 285.1849 3000.0 286.1914 12000.0 287.2004 11000.0 297.1835 2400.0 300.2108 7400.0 312.2077 27000.0 349.1802 2400.0 352.2386 2800.0 407.2569 14000.0 494.3347 2800.0 495.2533 9000.0 509.1962 3700.0 510.1129 2800.0 510.2026 360000.0 510.2889 5100.0 511.2457 6000.0 523.218 3300.0 524.2185 140000.0 537.2301 10000.0 538.2323 8700.0 539.048 46000.0 539.0868 31000.0 539.2411 7400000.0 539.394 23000.0 539.4356 39000.0 539.4905 16000.0 540.2431 9100.0 571.2647 23000.0 581.0372 3000.0 583.2274 9400.0 615.4037 16000.0 END IONS BEGIN IONS SCANS=801 PEPMASS=592.2685 CHARGE=1 COLLISION_ENERGY=0.0 64.4444 2300.0 65.805 4600.0 65.8092 21000.0 66.0303 2500.0 72.0936 2100.0 73.0282 3500.0 77.9784 2200.0 91.0714 2300.0 91.2528 2100.0 91.4325 2200.0 96.0359 2700.0 96.7253 2300.0 101.0329 2800.0 111.536 2400.0 112.3027 2200.0 116.0702 6000.0 128.16 2300.0 141.8264 2800.0 155.3744 2600.0 162.0758 12000.0 164.6237 2600.0 167.0704 11000.0 173.5222 28000.0 173.5327 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61000.0 560.2422 69000.0 562.2229 34000.0 563.2293 21000.0 564.2663 26000.0 565.2807 6000.0 577.2451 170000.0 577.3502 3300.0 592.2671 670000.0 593.2761 160000.0 END IONS BEGIN IONS SCANS=802 PEPMASS=593.2767 CHARGE=1 COLLISION_ENERGY=0.0 64.5444 21000.0 65.9167 360000.0 65.9208 1300000.0 66.7092 8200.0 71.399 17000.0 81.9419 17000.0 86.2625 18000.0 87.9132 7500.0 98.2098 21000.0 110.5297 21000.0 133.3074 55000.0 133.3193 130000.0 134.4801 23000.0 148.3123 88000.0 148.325 80000.0 173.5247 190000.0 173.538 330000.0 194.3828 9100.0 214.721 8600.0 294.0371 8700.0 415.5414 8100.0 417.2072 41000.0 419.2322 8900.0 431.1865 440000.0 432.193 61000.0 433.2382 590000.0 434.247 140000.0 445.2023 240000.0 446.211 310000.0 447.2173 660000.0 447.2734 20000.0 449.2371 35000.0 459.2181 670000.0 460.1504 18000.0 460.2248 2800000.0 461.1599 48000.0 461.2331 2700000.0 462.2407 210000.0 463.2158 54000.0 473.2332 690000.0 474.2402 170000.0 475.2567 25000.0 476.2567 370000.0 477.2636 210000.0 487.248 600000.0 488.257 80000.0 489.2622 240000.0 491.2407 250000.0 492.2515 760000.0 493.258 110000.0 503.2441 130000.0 504.2374 10000.0 504.2479 62000.0 505.2249 1200000.0 506.2559 25000.0 507.2764 22000.0 515.244 380000.0 517.2569 130000.0 518.2311 240000.0 519.2397 260000.0 520.2447 240000.0 531.2508 9500.0 532.9608 29000.0 533.0638 360000.0 533.1025 160000.0 533.2543 58000000.0 533.4012 230000.0 533.4463 330000.0 533.4987 82000.0 533.5542 48000.0 534.2588 600000.0 543.2383 37000.0 547.2705 690000.0 549.2267 19000.0 549.2465 34000.0 549.26 11000.0 550.2578 120000.0 551.2652 27000.0 558.158 9900.0 561.2493 530000.0 563.2303 25000.0 564.2371 770000.0 564.3244 12000.0 565.2806 1800000.0 568.585 22000.0 575.265 990000.0 578.2525 190000.0 593.0539 270000.0 593.0975 200000.0 593.2756 40000000.0 593.4533 150000.0 593.4998 280000.0 END IONS BEGIN IONS SCANS=803 PEPMASS=600.4175 CHARGE=1 COLLISION_ENERGY=0.0 65.0342 2100.0 65.2173 2600.0 66.7096 2600.0 67.0542 74000.0 67.81 2600.0 69.0334 69000.0 69.0698 84000.0 69.8449 5600.0 71.0493 4000.0 71.302 2400.0 74.087 2200.0 75.4261 2900.0 75.7886 3700.0 75.9991 2600.0 76.036 3600.0 76.5459 3000.0 78.89 4100.0 79.0541 110000.0 80.0621 10000.0 80.4737 3600.0 81.0328 3000.0 81.0697 310000.0 82.0731 8800.0 83.049 100000.0 83.0854 46000.0 85.0646 71000.0 87.0443 5900.0 87.739 2300.0 88.2096 3400.0 89.0596 210000.0 91.0542 140000.0 92.0621 12000.0 93.0697 490000.0 94.0728 19000.0 94.1703 2700.0 94.7406 2200.0 95.049 180000.0 95.0854 330000.0 96.0573 3400.0 96.0887 18000.0 97.0647 89000.0 99.0803 5200.0 99.1058 3300.0 99.2063 3600.0 101.8937 2100.0 103.713 2600.0 105.0697 490000.0 106.0777 26000.0 106.0787 3500.0 107.0493 6100.0 107.0854 380000.0 107.4122 2700.0 108.0901 14000.0 109.0647 150000.0 109.1011 170000.0 110.1041 3000.0 110.3789 3900.0 111.044 11000.0 111.0804 54000.0 111.285 2300.0 113.3862 2400.0 115.0539 3800.0 116.4538 2300.0 117.0697 76000.0 117.3846 2200.0 118.0776 3000.0 119.0487 9100.0 119.0758 14000.0 119.0854 880000.0 119.0954 5500.0 120.0918 71000.0 121.0646 87000.0 121.0911 5200.0 121.101 650000.0 121.1093 2100.0 122.0725 11000.0 122.1043 44000.0 123.0803 320000.0 123.1167 58000.0 124.0842 13000.0 125.0491 4300.0 125.0595 440000.0 125.0958 8500.0 125.6301 2700.0 126.0623 9500.0 128.062 6500.0 129.0699 60000.0 130.0778 6100.0 131.0854 290000.0 132.0931 99000.0 133.0649 51000.0 133.086 110000.0 133.1011 540000.0 134.1082 92000.0 135.0803 320000.0 135.1167 250000.0 136.0847 21000.0 136.12 3400.0 137.0598 32000.0 137.096 300000.0 137.132 3200.0 137.2213 3300.0 138.1001 35000.0 139.0752 120000.0 139.1117 31000.0 140.0786 2800.0 141.0694 12000.0 142.0777 49000.0 143.0854 300000.0 144.0929 120000.0 145.0646 6200.0 145.1011 890000.0 145.1143 21000.0 146.0723 8900.0 146.1068 76000.0 146.9372 2700.0 147.0803 580000.0 147.0933 3700.0 147.1166 190000.0 148.0844 79000.0 148.122 16000.0 149.096 230000.0 149.1321 10000.0 150.1033 34000.0 151.0752 340000.0 151.1119 38000.0 152.0804 47000.0 153.0907 25000.0 155.0853 110000.0 156.0931 74000.0 157.1011 700000.0 158.1078 170000.0 159.0804 130000.0 159.1168 540000.0 160.088 34000.0 160.1233 92000.0 161.0961 250000.0 161.1324 240000.0 161.1461 2800.0 162.1021 33000.0 162.1359 46000.0 163.0761 19000.0 163.1117 900000.0 163.127 3200.0 164.1161 55000.0 165.0771 4500.0 165.091 2600000.0 165.1095 9400.0 166.0795 5100.0 166.0945 430000.0 166.1105 6000.0 167.0861 24000.0 167.1066 21000.0 167.3969 3800.0 168.0933 13000.0 169.1012 250000.0 170.1082 99000.0 171.0809 28000.0 171.1169 500000.0 172.0893 8400.0 172.1234 160000.0 173.0962 190000.0 173.1326 240000.0 173.5225 22000.0 173.5331 230000.0 173.5431 11000.0 174.1018 19000.0 174.1378 16000.0 175.1117 260000.0 175.1483 130000.0 176.119 39000.0 176.1512 11000.0 177.0911 120000.0 177.1109 17000.0 177.1275 96000.0 178.0987 100000.0 179.0876 11000.0 179.1066 61000.0 179.1431 30000.0 180.0972 5800.0 180.1143 140000.0 181.085 4800.0 181.1019 87000.0 181.1224 920000.0 182.1085 53000.0 182.1259 15000.0 183.1169 380000.0 184.1224 110000.0 185.0963 55000.0 185.1326 390000.0 185.1514 5100.0 186.1036 28000.0 186.1377 95000.0 187.1117 150000.0 187.1482 140000.0 188.1184 25000.0 188.1518 9700.0 189.1275 280000.0 190.135 350000.0 191.0875 4000.0 191.1067 220000.0 191.1429 93000.0 192.1111 36000.0 193.1026 44000.0 193.1223 250000.0 194.1086 26000.0 195.1168 200000.0 195.138 92000.0 196.1238 69000.0 196.1423 5900.0 196.3422 3500.0 197.0973 31000.0 197.1324 350000.0 198.1034 23000.0 198.1384 59000.0 199.1119 140000.0 199.1479 120000.0 200.1185 23000.0 200.1538 7200.0 201.1275 190000.0 201.1631 41000.0 202.1341 26000.0 203.1091 9800.0 203.1432 1100000.0 204.1466 250000.0 205.1221 40000.0 205.1593 11000.0 206.1091 4600.0 206.1299 19000.0 207.1167 88000.0 207.1382 370000.0 207.1585 7100.0 208.1245 33000.0 208.1454 190000.0 209.0964 4000.0 209.1326 230000.0 209.1534 21000.0 210.1384 66000.0 211.112 69000.0 211.1483 300000.0 211.1684 2500.0 212.1177 26000.0 212.1544 110000.0 213.1273 130000.0 213.1639 69000.0 214.1337 32000.0 215.1071 22000.0 215.1435 110000.0 216.1507 100000.0 217.1225 35000.0 217.1593 29000.0 218.1293 9900.0 219.1157 9500.0 219.1381 230000.0 220.1245 9200.0 220.1468 14000.0 221.1341 85000.0 221.1538 2800000.0 222.1572 630000.0 223.1117 35000.0 223.1482 130000.0 224.1183 6100.0 224.1539 25000.0 225.1273 110000.0 225.1641 140000.0 226.1344 17000.0 226.1698 23000.0 227.1432 100000.0 227.18 52000.0 228.1486 11000.0 228.1844 4200.0 229.1221 27000.0 229.1587 150000.0 230.1307 8800.0 230.1635 36000.0 231.1383 88000.0 231.1751 13000.0 232.1445 35000.0 232.1774 2900.0 233.1314 42000.0 233.1539 180000.0 234.1399 20000.0 234.1614 460000.0 235.1477 63000.0 235.1705 36000.0 236.1531 7500.0 237.1277 66000.0 237.1637 77000.0 238.1339 17000.0 238.17 23000.0 239.1434 75000.0 239.1793 85000.0 240.1505 25000.0 240.1869 170000.0 241.1236 20000.0 241.1588 82000.0 242.1675 3800.0 243.1382 89000.0 243.1723 9000.0 244.1431 8100.0 245.1544 70000.0 246.162 7300.0 247.1444 7100.0 247.1694 760000.0 247.1993 4400.0 248.1744 220000.0 249.132 13000.0 249.1634 67000.0 250.1688 7200.0 251.1429 70000.0 251.1787 73000.0 252.1489 8300.0 253.1302 4400.0 253.1585 94000.0 253.1939 27000.0 254.1638 4700.0 255.1395 24000.0 255.174 57000.0 256.1456 16000.0 256.1801 30000.0 257.1533 51000.0 257.1865 15000.0 258.1571 4500.0 259.1446 3400.0 259.1692 140000.0 260.1506 5200.0 260.177 84000.0 261.1578 9900.0 261.1852 96000.0 263.1479 4300.0 263.1788 67000.0 264.1845 10000.0 265.1581 46000.0 265.1934 44000.0 266.1663 9100.0 267.1421 3100.0 267.174 68000.0 268.1815 7600.0 269.1542 74000.0 269.1891 67000.0 270.1606 3200.0 270.194 19000.0 271.1695 120000.0 272.1769 26000.0 273.1857 78000.0 274.193 370000.0 275.1769 15000.0 277.1596 8300.0 277.1938 33000.0 279.1743 88000.0 279.2092 28000.0 280.1818 5700.0 281.1524 3200.0 281.1902 140000.0 282.1957 26000.0 283.1699 38000.0 283.2045 9500.0 284.1766 21000.0 285.1849 110000.0 286.1925 190000.0 287.167 8000.0 287.2008 530000.0 288.204 130000.0 289.1953 31000.0 291.1749 26000.0 291.21 18000.0 292.1802 7700.0 293.1902 50000.0 294.1952 23000.0 295.1721 5000.0 295.2065 39000.0 297.1849 140000.0 297.2199 25000.0 298.1922 18000.0 299.2007 530000.0 300.2078 110000.0 301.2184 6800.0 305.1912 6400.0 307.2056 80000.0 309.1845 52000.0 309.2217 26000.0 310.1927 63000.0 311.2004 150000.0 312.2083 220000.0 313.2163 480000.0 314.2199 52000.0 315.2076 3900.0 318.2003 4700.0 319.2055 52000.0 321.2208 9200.0 322.2282 12000.0 323.1998 26000.0 324.2071 11000.0 325.2163 590000.0 326.2224 72000.0 327.1979 4000.0 327.232 200000.0 328.2355 70000.0 333.2219 5900.0 334.2287 9900.0 336.2039 4400.0 337.216 180000.0 338.2212 4900.0 338.2612 8400.0 339.2319 160000.0 340.169 3800.0 340.1953 4500.0 340.2396 1200000.0 347.2365 9700.0 348.242 4700.0 349.2132 3500.0 351.2318 59000.0 352.2396 550000.0 353.2467 13000.0 363.2319 22000.0 365.2471 300000.0 366.2521 64000.0 374.2526 2800.0 376.2343 3000.0 377.2476 43000.0 378.2545 4700.0 379.2627 63000.0 385.2362 22000.0 387.2563 52000.0 391.264 90000.0 392.2673 68000.0 395.0955 2500.0 402.2848 3400.0 405.2787 88000.0 411.2525 56000.0 413.269 200000.0 414.1276 4400.0 414.2719 51000.0 419.2942 93000.0 420.3 130000.0 425.2025 4200.0 425.2684 650000.0 425.33 4300.0 426.2764 110000.0 427.2844 550000.0 427.3501 5800.0 428.2874 130000.0 428.6857 2700.0 429.2822 4400.0 439.282 14000.0 440.2918 930000.0 440.3466 3200.0 440.3584 4200.0 453.2984 16000.0 454.3027 34000.0 487.3195 35000.0 493.3307 23000.0 505.3289 75000.0 505.406 4000.0 507.3459 26000.0 508.3481 26000.0 516.9064 2800.0 519.345 3400.0 520.3522 140000.0 535.8594 2800.0 545.1984 3000.0 554.4011 2600.0 567.3805 14000.0 581.111 4500.0 582.4059 3100.0 585.3927 78000.0 600.4129 76000.0 605.4372 3900.0 609.4781 2800.0 END IONS BEGIN IONS SCANS=804 PEPMASS=599.4101 CHARGE=1 COLLISION_ENERGY=0.0 67.054 4200.0 69.0334 4400.0 69.0695 6000.0 69.7538 2400.0 75.2282 2300.0 79.0542 2900.0 81.0696 15000.0 83.0489 3700.0 83.0854 5100.0 85.0646 3500.0 90.493 2600.0 91.0541 5000.0 93.0695 22000.0 95.049 7700.0 95.0852 20000.0 97.0646 7700.0 105.0696 19000.0 107.0852 22000.0 109.0646 7100.0 109.1008 7600.0 113.0961 2600.0 117.0693 3200.0 119.0852 31000.0 121.0645 3600.0 121.1009 34000.0 123.0801 18000.0 123.1165 4400.0 125.0593 12000.0 131.0851 10000.0 133.0641 3000.0 133.1009 20000.0 135.08 16000.0 135.1166 12000.0 137.0606 3400.0 137.0958 22000.0 139.075 7500.0 143.0854 13000.0 145.101 27000.0 147.0801 47000.0 147.1164 6600.0 149.096 10000.0 151.0751 23000.0 153.0906 3000.0 155.0848 6600.0 156.093 4700.0 157.1009 39000.0 159.0808 4400.0 159.1166 18000.0 161.096 11000.0 161.1322 19000.0 163.1115 31000.0 165.0909 230000.0 165.1036 2400.0 167.1061 2900.0 169.1009 13000.0 170.1087 3100.0 171.1167 32000.0 173.0961 10000.0 173.1325 10000.0 173.5345 26000.0 175.1117 5800.0 175.1487 7400.0 177.0907 5600.0 177.127 3900.0 179.1073 3300.0 179.1427 4700.0 181.1024 3500.0 181.1224 12000.0 183.1169 29000.0 185.1324 24000.0 187.1477 7100.0 189.1274 14000.0 191.1066 15000.0 191.1437 4700.0 195.1165 9100.0 195.1363 5300.0 196.1263 2400.0 197.0979 3200.0 197.1324 15000.0 199.1117 5300.0 199.1477 4600.0 201.1273 5100.0 203.143 97000.0 207.1165 6000.0 207.1382 14000.0 209.1324 13000.0 211.1124 4900.0 211.1482 17000.0 213.1284 4900.0 215.1441 5900.0 221.1346 7100.0 221.1537 230000.0 223.1488 4800.0 225.1272 6300.0 225.1642 4900.0 227.1424 3600.0 227.1798 4400.0 229.1232 3700.0 229.1583 9200.0 231.1388 6500.0 233.1546 5100.0 235.1478 3900.0 237.1273 3400.0 237.1642 4700.0 239.1782 2500.0 247.1438 2700.0 247.1692 49000.0 249.1638 3200.0 251.1432 4400.0 251.1781 2500.0 263.179 5100.0 263.8222 2300.0 265.1582 2900.0 267.173 3400.0 269.1901 4700.0 271.1707 4200.0 281.1908 3900.0 285.1854 4500.0 286.1922 3900.0 287.2012 38000.0 293.1904 4300.0 295.2077 4200.0 299.2011 12000.0 309.1862 3600.0 310.1919 2800.0 311.2012 9600.0 313.2179 12000.0 325.2176 7900.0 327.2328 14000.0 335.2045 2800.0 365.2483 13000.0 391.2635 8100.0 413.2704 9500.0 419.2956 14000.0 427.2855 25000.0 453.2996 6500.0 507.3503 2500.0 519.3483 7600.0 599.4095 8100.0 END IONS BEGIN IONS SCANS=805 PEPMASS=434.2819 CHARGE=1 COLLISION_ENERGY=0.0 57.0697 24000.0 59.049 10000.0 67.0541 5100.0 68.667 2500.0 69.0331 2700.0 69.0696 5500.0 79.054 3400.0 81.0696 33000.0 85.0646 13000.0 89.0341 2200.0 91.0541 9800.0 93.0696 33000.0 94.7147 2200.0 95.0488 17000.0 95.0851 20000.0 95.3232 2300.0 96.755 2400.0 97.0643 6600.0 105.0627 4000.0 105.0696 120000.0 107.0852 26000.0 108.3976 2500.0 109.0645 67000.0 109.1009 8300.0 111.0803 3800.0 117.0693 5600.0 119.0852 140000.0 121.0645 11000.0 121.1008 38000.0 123.0802 40000.0 125.0594 18000.0 129.0701 3500.0 130.3509 2300.0 131.0853 37000.0 133.0648 7100.0 133.1008 48000.0 135.0801 52000.0 135.1166 11000.0 137.0599 7500.0 137.0959 31000.0 142.0765 2500.0 143.0853 36000.0 144.0936 3100.0 145.1009 67000.0 147.0802 110000.0 147.1164 11000.0 148.0876 7000.0 149.0959 38000.0 149.6819 5500.0 149.6934 5300.0 150.1035 3000.0 151.0752 45000.0 155.0851 18000.0 156.0931 12000.0 157.1009 66000.0 159.0802 18000.0 159.1166 48000.0 161.096 38000.0 161.1323 22000.0 162.1037 7200.0 163.0744 3100.0 163.1119 29000.0 164.1204 2400.0 165.0909 220000.0 167.0861 6200.0 168.0937 11000.0 169.1012 35000.0 170.1092 13000.0 171.1169 62000.0 173.0961 24000.0 173.1324 16000.0 173.5267 11000.0 173.5352 23000.0 175.1117 47000.0 175.1479 3200.0 177.0911 26000.0 177.1289 3100.0 178.0989 13000.0 179.1067 2900.0 181.1014 16000.0 181.1221 7700.0 182.1075 3000.0 183.1169 130000.0 184.1238 3900.0 185.0962 4700.0 185.1325 24000.0 187.1118 28000.0 187.1483 15000.0 188.1205 3200.0 189.1274 24000.0 190.1352 30000.0 191.1069 37000.0 191.1438 2500.0 193.1028 9500.0 193.1224 28000.0 195.1169 29000.0 196.1244 11000.0 197.0966 3500.0 197.1324 29000.0 199.112 28000.0 201.1272 29000.0 202.1338 2800.0 203.1433 73000.0 207.1171 15000.0 207.1384 28000.0 209.1323 26000.0 210.1392 2700.0 211.112 18000.0 211.1485 56000.0 213.1273 31000.0 214.134 2600.0 215.1075 3200.0 215.143 13000.0 216.1517 6200.0 219.1382 32000.0 221.1323 14000.0 221.154 99000.0 222.1401 2700.0 223.1127 3700.0 223.1486 8000.0 225.1272 23000.0 225.1641 26000.0 227.1441 9900.0 229.1226 8800.0 229.1588 18000.0 230.1305 33000.0 233.1314 3300.0 233.1544 11000.0 234.1615 19000.0 235.1491 7500.0 237.1261 3000.0 237.164 8000.0 239.1436 21000.0 239.1789 6000.0 240.1515 7200.0 241.159 2700.0 243.1386 19000.0 247.1694 28000.0 249.1638 3400.0 251.1446 3600.0 251.1794 3000.0 253.1596 17000.0 255.1379 4600.0 259.1693 8700.0 265.1575 2500.0 267.1731 2900.0 268.182 20000.0 270.4082 2700.0 271.1698 20000.0 273.1617 4100.0 275.1785 3500.0 281.1899 18000.0 285.1857 4200.0 286.1933 100000.0 287.2015 13000.0 291.1755 3400.0 295.2043 2700.0 297.1849 9500.0 299.2011 33000.0 309.1826 2800.0 311.2005 14000.0 312.2089 15000.0 313.217 24000.0 315.2103 3000.0 327.1966 7100.0 335.2011 15000.0 337.2176 8200.0 355.2278 31000.0 373.2531 12000.0 391.2643 81000.0 391.3138 3700.0 397.0024 2600.0 419.2598 4500.0 END IONS BEGIN IONS SCANS=806 PEPMASS=761.1888 CHARGE=1 COLLISION_ENERGY=0.0 70.6448 2200.0 80.7479 2200.0 86.0962 4600.0 89.0592 3800.0 91.913 2500.0 99.7762 2500.0 116.7568 2400.0 121.0503 2300.0 143.9239 2700.0 148.3262 2700.0 149.6865 11000.0 149.6973 7600.0 173.5227 14000.0 173.5327 12000.0 173.5422 17000.0 184.073 63000.0 185.077 13000.0 186.0775 7300.0 235.0194 2600.0 279.6432 2500.0 327.2959 2600.0 335.1139 2700.0 343.0356 2500.0 387.1494 2700.0 417.7068 2500.0 433.2405 11000.0 447.2199 3800.0 459.2176 21000.0 460.2257 35000.0 461.2337 37000.0 468.6784 2800.0 473.2328 3700.0 476.2599 3200.0 477.2639 2500.0 487.2491 8100.0 492.2535 15000.0 505.2263 15000.0 515.2421 6200.0 533.2542 1700000.0 534.2592 5700.0 547.2711 19000.0 561.2501 12000.0 564.2353 11000.0 565.2808 62000.0 575.2653 32000.0 592.2677 25000.0 593.054 12000.0 593.2753 2600000.0 595.2793 11000.0 650.1749 3000.0 END IONS BEGIN IONS SCANS=807 PEPMASS=641.2969 CHARGE=1 COLLISION_ENERGY=0.0 66.4751 34000.0 66.4772 13000.0 66.5864 180000.0 66.5896 52000.0 66.9797 7000.0 70.858 5100.0 76.5184 4300.0 81.2928 4600.0 95.879 4000.0 96.2914 5300.0 106.8136 7300.0 110.9986 5500.0 112.328 4000.0 112.3498 6200.0 137.2184 4300.0 147.3331 3700.0 149.8153 14000.0 173.5209 11000.0 173.5286 100000.0 173.5411 36000.0 239.1543 10000.0 246.112 32000.0 261.3122 6700.0 264.731 4200.0 278.1647 6600.0 304.1438 4600.0 316.7363 6200.0 318.1597 80000.0 332.1778 4500.0 381.206 10000.0 397.2081 27000.0 409.2016 55000.0 410.2125 16000.0 411.2184 62000.0 412.2255 76000.0 421.2001 8700.0 422.2086 39000.0 423.2183 190000.0 424.2233 500000.0 425.1981 250000.0 435.2167 17000.0 436.2247 17000.0 437.233 120000.0 438.2029 35000.0 439.2132 270000.0 440.1602 3700.0 440.2209 540000.0 449.6644 5100.0 450.2037 22000.0 451.245 5600.0 452.2173 42000.0 453.2279 140000.0 454.2351 55000.0 455.2466 7100.0 464.2193 43000.0 465.2223 13000.0 465.2355 11000.0 466.247 7200.0 467.2492 32000.0 468.2587 24000.0 469.2235 73000.0 477.2295 27000.0 481.2249 100000.0 482.2319 91000.0 483.2003 15000.0 483.2784 26000.0 484.2475 64000.0 491.2438 8700.0 494.2475 5000.0 494.258 33000.0 495.2468 86000.0 496.2468 280000.0 497.2219 380000.0 498.2264 71000.0 501.2655 21000.0 505.2583 5400.0 508.235 6300.0 508.252 10000.0 509.2539 75000.0 510.2575 71000.0 511.2694 720000.0 512.2777 360000.0 519.2374 9000.0 521.2604 7900.0 522.257 63000.0 523.2684 190000.0 524.2749 170000.0 525.2537 88000.0 526.2624 38000.0 527.2668 94000.0 528.2854 7300.0 537.2732 110000.0 538.2549 380000.0 539.2646 220000.0 540.2734 290000.0 543.2933 10000.0 547.2669 14000.0 550.2572 6200.0 551.2637 17000.0 553.274 72000.0 554.2854 160000.0 555.2192 11000.0 555.2972 1300000.0 555.4411 6800.0 565.2813 230000.0 566.2491 62000.0 567.2624 6400.0 568.2674 6900.0 569.2793 62000.0 570.2506 110000.0 571.2764 190000.0 576.2865 5200.0 582.2837 60000.0 583.2564 56000.0 584.2639 28000.0 597.3073 460000.0 597.4141 9300.0 598.1939 18000.0 598.2788 1500000.0 599.0654 17000.0 599.287 5700000.0 613.3018 71000.0 641.2967 75000.0 END IONS BEGIN IONS SCANS=808 PEPMASS=663.2793 CHARGE=1 COLLISION_ENERGY=0.0 79.8468 2400.0 89.4507 2400.0 113.1271 2600.0 118.6758 2400.0 118.8608 2500.0 119.0849 2400.0 121.0997 4300.0 125.0588 7200.0 132.3129 2500.0 133.0995 3100.0 134.784 2500.0 141.7642 2300.0 142.966 2700.0 145.1003 2800.0 147.0797 3200.0 163.111 10000.0 165.0898 6000.0 173.535 80000.0 176.5329 2100.0 180.5347 2400.0 181.1212 5100.0 182.1246 3400.0 183.1163 2700.0 207.1382 3200.0 221.1531 5500.0 269.2261 2500.0 286.1908 2400.0 310.2124 2700.0 318.1594 13000.0 334.9964 2500.0 341.1498 65000.0 346.9832 2300.0 355.22 3500.0 381.369 2800.0 407.2546 7400.0 423.2184 100000.0 431.1838 10000.0 434.4071 2500.0 439.2027 7200.0 445.1999 77000.0 446.2083 66000.0 449.234 18000.0 450.2382 2900.0 458.2084 18000.0 459.2155 250000.0 459.2847 7600.0 460.2227 29000.0 463.2505 14000.0 471.2164 16000.0 472.2235 11000.0 473.2312 20000.0 477.2261 3600.0 477.265 2600.0 482.2121 5900.0 485.2313 88000.0 486.2373 55000.0 487.2107 22000.0 489.1625 4000.0 491.2463 3400.0 491.5969 2600.0 492.5615 3100.0 495.2547 33000.0 497.2314 78000.0 499.2399 8000.0 500.2546 61000.0 503.2809 9900.0 504.2136 37000.0 509.2568 2500.0 513.2253 24000.0 514.2341 29000.0 515.2399 9100.0 517.2194 15000.0 518.2289 470000.0 519.1472 5200.0 519.237 330000.0 522.2579 3900.0 523.2711 76000.0 528.2503 19000.0 531.2354 7300.0 536.2401 2800.0 541.2213 160000.0 543.2695 20000.0 545.2524 96000.0 546.26 32000.0 547.2668 4200.0 551.2649 39000.0 558.2265 26000.0 559.259 3200.0 560.2745 4200.0 565.2813 93000.0 569.2582 3000.0 573.1431 3600.0 573.2477 280000.0 573.3513 9300.0 587.2634 190000.0 589.1769 6900.0 619.2896 72000.0 663.4657 23000.0 END IONS BEGIN IONS SCANS=809 PEPMASS=299.2011 CHARGE=1 COLLISION_ENERGY=0.0 67.0542 6500.0 67.3104 2300.0 68.5184 2400.0 69.0329 2400.0 71.8842 2500.0 73.0282 8400.0 79.0539 12000.0 81.0696 57000.0 85.0645 46000.0 91.0542 13000.0 93.0191 2300.0 93.0697 25000.0 95.0852 16000.0 95.1508 2600.0 96.4148 2800.0 97.0273 2300.0 97.0646 3600.0 101.3111 2400.0 103.3844 2600.0 105.0697 36000.0 106.313 2500.0 107.0853 32000.0 109.0647 22000.0 111.0439 3400.0 117.0693 3300.0 119.0852 66000.0 121.0648 5400.0 121.1009 12000.0 121.1776 2700.0 123.0803 24000.0 129.0697 5600.0 131.0851 28000.0 133.0642 6200.0 133.101 47000.0 135.0803 34000.0 135.1173 3100.0 135.7467 2200.0 137.0594 24000.0 137.0959 7800.0 143.0853 29000.0 144.0931 12000.0 145.1008 38000.0 146.0725 6900.0 147.08 46000.0 147.1157 2800.0 148.0268 2300.0 148.088 5000.0 149.0959 21000.0 149.6902 5600.0 150.9515 2800.0 151.0751 100000.0 152.9865 2700.0 155.0851 6000.0 156.0929 6300.0 156.3131 2200.0 157.101 52000.0 158.1074 3500.0 159.0805 15000.0 159.0991 2900.0 159.1166 31000.0 160.0891 2200.0 160.1054 3500.0 161.0959 22000.0 165.0909 40000.0 168.8618 2500.0 169.1012 26000.0 170.1088 2600.0 171.1165 35000.0 173.0958 19000.0 173.1323 13000.0 173.268 2200.0 173.5214 7400.0 173.5324 110000.0 173.5467 5100.0 175.1121 18000.0 177.0911 41000.0 181.115 2900.0 182.108 3200.0 182.6514 2500.0 183.117 33000.0 184.1246 2800.0 186.1042 3200.0 187.1117 12000.0 188.1201 5400.0 189.1284 6900.0 191.1075 2900.0 193.1012 3300.0 194.108 3200.0 195.1158 32000.0 196.1234 6000.0 197.0951 5300.0 197.1322 27000.0 199.1121 30000.0 200.1187 9900.0 201.0926 2400.0 201.1271 23000.0 203.1429 8400.0 207.1169 6800.0 209.1328 15000.0 210.1374 2700.0 211.1121 3100.0 211.1486 2700.0 213.1274 37000.0 214.1356 6700.0 218.1294 2800.0 219.8236 2600.0 221.1292 10000.0 221.6279 8900.0 222.1328 2700.0 223.1476 7700.0 225.1263 13000.0 227.1038 2400.0 227.1429 7000.0 228.1322 26000.0 229.1221 16000.0 231.1368 2800.0 233.6343 2400.0 234.1334 7900.0 234.636 15000.0 235.1471 3000.0 237.1635 2900.0 239.1414 2500.0 241.1237 5100.0 241.1578 7400.0 243.1381 87000.0 243.6397 7500.0 247.1501 5600.0 249.1649 2700.0 251.1429 2600.0 253.1593 4000.0 255.1359 5600.0 257.1544 2800.0 260.4546 2600.0 262.1649 14000.0 271.1702 5000.0 281.1526 2800.0 282.2799 10000.0 285.1869 2500.0 291.8777 2500.0 299.0909 37000.0 299.1257 5100.0 299.1627 9700.0 299.2015 30000.0 299.2378 42000.0 313.9702 2500.0 333.2265 2600.0 334.1867 2300.0 347.9002 2500.0 388.3049 2300.0 422.168 2600.0 450.2637 2500.0 473.4591 2800.0 560.5996 2800.0 565.5994 2600.0 END IONS BEGIN IONS SCANS=810 PEPMASS=607.2921 CHARGE=1 COLLISION_ENERGY=0.0 67.4741 89000.0 67.4777 240000.0 76.8958 2400.0 91.7807 2700.0 96.5214 2100.0 97.4884 2200.0 102.4482 2600.0 102.5471 10000.0 116.5331 2800.0 142.8804 11000.0 145.049 2400.0 151.817 29000.0 151.8288 23000.0 152.0752 2500.0 163.0316 2600.0 164.9449 2900.0 169.3143 2700.0 173.5199 4100.0 173.5342 160000.0 182.2766 2400.0 188.2295 2800.0 317.5583 2700.0 405.2095 3100.0 431.1861 37000.0 432.1936 3400.0 433.2398 43000.0 434.2469 50000.0 435.2542 16000.0 445.2033 4500.0 446.2094 37000.0 447.2174 150000.0 459.2177 95000.0 460.2241 380000.0 461.2328 260000.0 462.2402 73000.0 473.2331 99000.0 474.2304 3400.0 474.2424 5400.0 476.2554 30000.0 477.2701 3100.0 478.2317 4000.0 487.249 82000.0 489.2636 95000.0 491.2422 24000.0 492.2481 23000.0 504.2124 4500.0 505.2259 86000.0 506.2388 56000.0 506.2538 8700.0 507.2738 72000.0 515.2456 34000.0 517.2585 94000.0 518.231 26000.0 519.1623 3500.0 519.239 94000.0 520.2442 24000.0 532.2074 2900.0 533.2543 3900000.0 534.2581 290000.0 535.2699 2000000.0 547.2355 4600.0 550.2534 3700.0 561.2542 100000.0 563.3061 28000.0 565.2815 20000.0 578.2514 120000.0 579.2939 110000.0 589.2815 44000.0 592.267 61000.0 607.0625 48000.0 607.2913 7900000.0 607.4695 7300.0 607.5245 14000.0 END IONS BEGIN IONS SCANS=811 PEPMASS=653.2974 CHARGE=1 COLLISION_ENERGY=0.0 74.8839 2300.0 87.3715 2400.0 93.5774 2400.0 108.9735 3300.0 116.0944 2800.0 141.305 2400.0 156.9287 2400.0 171.1291 2500.0 173.5262 34000.0 173.5428 9300.0 213.7589 2500.0 218.7256 2700.0 220.4082 2400.0 245.8504 2200.0 266.2087 2600.0 420.2316 8000.0 465.2184 3000.0 477.2663 12000.0 479.244 20000.0 491.2085 8000.0 492.2129 30000.0 493.2598 10000.0 494.2679 15000.0 503.2437 160000.0 504.2473 67000.0 505.2237 3700.0 505.2339 2700.0 519.2299 2200.0 520.1314 30000.0 521.2541 100000.0 522.2576 14000.0 534.2294 4400.0 537.25 19000.0 547.2332 53000.0 548.2415 7000.0 563.2675 2900.0 565.2444 1600000.0 566.2507 20000.0 575.2325 3100.0 579.2601 22000.0 594.2807 35000.0 607.2556 53000.0 653.1834 9400.0 653.2955 47000.0 END IONS BEGIN IONS SCANS=812 PEPMASS=657.2691 CHARGE=1 COLLISION_ENERGY=0.0 71.33 2500.0 71.4537 2600.0 72.3462 2300.0 73.0281 43000.0 73.0322 10000.0 74.0468 2400.0 77.455 2500.0 79.2686 2300.0 93.7712 2400.0 100.9274 2200.0 113.3579 2500.0 123.2959 2200.0 128.489 2800.0 150.5723 2400.0 173.5239 21000.0 173.5358 57000.0 173.5441 7700.0 246.8581 2600.0 276.4243 2800.0 280.5375 2500.0 317.2854 2900.0 337.8051 2700.0 439.0823 2400.0 466.9698 3000.0 493.7986 2800.0 498.1982 5400.0 541.1833 3100.0 553.2213 43000.0 597.2511 14000.0 643.1121 2500.0 653.2824 2400.0 656.7162 2400.0 657.2677 1200000.0 END IONS BEGIN IONS SCANS=813 PEPMASS=635.287 CHARGE=1 COLLISION_ENERGY=0.0 65.4697 3900.0 67.4749 4300.0 67.4783 4500.0 70.585 6600.0 70.5895 5500.0 95.0431 2300.0 101.3141 12000.0 110.2588 12000.0 140.8576 2300.0 141.6648 2300.0 143.8099 37000.0 143.8233 32000.0 173.5373 160000.0 177.1967 2400.0 195.6899 2900.0 215.567 2500.0 226.6592 2500.0 417.1684 4500.0 417.2135 16000.0 419.2237 76000.0 431.1813 22000.0 432.1949 4100.0 433.2005 4100.0 442.1751 5300.0 445.2025 62000.0 446.2105 120000.0 447.2191 380000.0 448.226 3200.0 459.2164 58000.0 460.2195 16000.0 461.1989 24000.0 473.1997 160000.0 474.2053 570000.0 475.2138 1200000.0 476.2176 9100.0 478.2321 4400.0 487.2136 460000.0 488.2212 87000.0 489.2313 3800.0 491.2449 19000.0 501.2291 420000.0 502.2366 35000.0 503.2413 46000.0 506.2335 62000.0 507.2395 4200.0 515.2026 6200.0 517.2251 100000.0 518.2309 20000.0 519.2428 150000.0 529.2244 220000.0 530.2314 23000.0 531.2412 210000.0 532.2312 3900.0 533.249 61000.0 534.2278 150000.0 545.2237 25000.0 546.2375 21000.0 547.2627 1300000.0 548.2386 4600.0 557.2215 7300.0 560.2417 69000.0 561.2508 610000.0 574.9953 31000.0 575.0545 120000.0 575.1814 190000.0 575.2662 17000000.0 575.4318 18000.0 575.4803 24000.0 576.1596 2900.0 576.2691 250000.0 579.27 86000.0 589.2461 390000.0 592.2622 4100.0 603.259 120000.0 606.2775 4300.0 607.2911 710000.0 620.2603 7300.0 635.1602 2700.0 635.1904 11000.0 635.2874 1100000.0 END IONS BEGIN IONS SCANS=814 PEPMASS=634.2796 CHARGE=1 COLLISION_ENERGY=0.0 71.8055 2400.0 73.4399 2500.0 109.3131 2600.0 129.1769 2400.0 129.9301 2100.0 168.2073 2800.0 173.525 35000.0 173.5436 19000.0 204.066 3500.0 208.5326 2500.0 222.3264 2700.0 237.1039 2700.0 270.4842 2800.0 296.7384 2300.0 383.1642 3000.0 412.1304 3200.0 430.8851 2500.0 438.1461 13000.0 441.1693 30000.0 445.203 30000.0 446.2089 3800.0 447.2184 14000.0 454.1781 14000.0 459.2157 3500.0 461.2335 2700.0 462.6381 2800.0 473.135 2200.0 473.1978 340000.0 474.2064 68000.0 475.2136 61000.0 487.2128 40000.0 500.2193 8200.0 501.1981 65000.0 502.2354 30000.0 505.2254 22000.0 506.233 12000.0 514.2032 3400.0 515.209 24000.0 517.2205 4600.0 519.222 5800.0 529.2259 16000.0 530.2322 4900.0 531.2379 15000.0 533.1365 3400.0 533.2201 410000.0 534.2625 2900.0 535.9294 2700.0 546.2513 3400.0 546.2623 2400.0 547.2414 41000.0 556.2154 3200.0 559.234 31000.0 560.2516 3000.0 561.2499 4100.0 563.2568 4500.0 573.2458 9000.0 574.2575 83000.0 575.266 620000.0 587.2288 4200.0 591.2592 33000.0 601.2515 3900.0 602.2537 110000.0 602.3542 4500.0 605.2777 13000.0 619.2548 46000.0 634.2793 64000.0 635.2911 3500.0 END IONS BEGIN IONS SCANS=815 PEPMASS=600.4177 CHARGE=1 COLLISION_ENERGY=0.0 67.0539 51000.0 67.5758 2200.0 69.0333 28000.0 69.0696 46000.0 71.013 2700.0 71.049 12000.0 73.0645 2800.0 77.0388 2800.0 79.0539 81000.0 80.0618 16000.0 81.0645 3900.0 81.0695 210000.0 81.1993 2100.0 81.6937 2400.0 83.0445 2500.0 83.0488 81000.0 83.0852 45000.0 85.0646 37000.0 87.0437 9700.0 89.0593 130000.0 91.0539 89000.0 92.062 10000.0 92.4242 2200.0 93.0695 260000.0 94.0779 5000.0 95.0427 2900.0 95.0488 140000.0 95.0795 3500.0 95.0851 180000.0 97.0644 79000.0 97.101 6000.0 98.7878 2500.0 99.0441 7800.0 101.0595 2300.0 105.0695 280000.0 106.0775 21000.0 107.0486 3600.0 107.0851 280000.0 108.0932 4700.0 109.0644 91000.0 109.0858 2400.0 109.1008 150000.0 110.0722 6500.0 111.0434 6800.0 111.0801 36000.0 113.0959 18000.0 113.1817 2200.0 114.0681 3300.0 117.0695 65000.0 118.0776 8000.0 119.0755 10000.0 119.0852 570000.0 119.0956 12000.0 120.093 50000.0 121.0646 40000.0 121.0922 3700.0 121.1008 290000.0 122.0723 4100.0 122.1051 2900.0 123.0801 180000.0 123.1164 38000.0 125.0503 4300.0 125.0593 180000.0 125.0958 31000.0 128.0622 10000.0 129.0697 39000.0 130.0774 15000.0 131.0748 5000.0 131.0852 220000.0 132.093 66000.0 133.0647 14000.0 133.0857 64000.0 133.1009 320000.0 134.1087 30000.0 135.0802 110000.0 135.1165 120000.0 136.0878 9900.0 137.0594 11000.0 137.0957 120000.0 138.1037 17000.0 139.075 21000.0 139.1115 36000.0 141.0696 7000.0 142.0775 30000.0 143.0852 200000.0 144.093 81000.0 145.065 14000.0 145.0889 8000.0 145.1009 590000.0 146.0707 2600.0 146.1082 41000.0 147.0801 140000.0 147.1165 150000.0 148.0882 2700.0 149.0959 86000.0 149.1323 19000.0 150.1036 11000.0 151.0752 67000.0 151.1117 21000.0 151.1478 2400.0 152.0802 2700.0 153.0904 20000.0 153.1256 2400.0 154.0654 2400.0 155.0853 55000.0 155.1064 21000.0 156.0929 59000.0 157.0837 7800.0 157.1009 390000.0 157.1124 2200.0 158.1085 83000.0 159.0802 57000.0 159.1024 5300.0 159.1166 310000.0 160.0878 59000.0 160.1236 23000.0 160.3652 2500.0 161.096 94000.0 161.1323 80000.0 162.1026 6800.0 163.1115 280000.0 165.0908 420000.0 166.0943 51000.0 167.0857 11000.0 167.1066 5000.0 168.0933 8600.0 169.1011 140000.0 169.3143 2300.0 170.1087 47000.0 171.0808 10000.0 171.1167 260000.0 172.1243 62000.0 173.0962 60000.0 173.1324 190000.0 173.5211 45000.0 173.5396 99000.0 174.1039 3100.0 174.1387 2800.0 175.1116 84000.0 175.1264 2500.0 175.1482 100000.0 176.1179 6100.0 176.6667 2700.0 177.0909 26000.0 177.1272 44000.0 178.0987 19000.0 179.087 12000.0 179.1064 20000.0 179.1429 11000.0 180.0937 5800.0 180.1142 26000.0 181.1016 59000.0 181.1222 190000.0 182.109 30000.0 183.1167 190000.0 184.1237 38000.0 185.0961 25000.0 185.1324 190000.0 185.151 2600.0 186.1397 29000.0 187.1116 49000.0 187.148 86000.0 189.1272 81000.0 189.1642 3200.0 190.135 77000.0 191.1068 35000.0 191.1429 68000.0 192.1511 3700.0 193.102 37000.0 193.1223 120000.0 194.1087 18000.0 195.1167 130000.0 195.1368 23000.0 196.1243 47000.0 197.0988 4300.0 197.1128 4300.0 197.1324 200000.0 198.1053 3100.0 198.1397 30000.0 199.1118 52000.0 199.148 78000.0 200.1182 9700.0 200.156 5800.0 201.1274 60000.0 201.1636 36000.0 203.1081 4600.0 203.143 210000.0 203.4512 2500.0 204.1472 30000.0 205.1234 2900.0 205.1586 10000.0 206.1101 5400.0 207.1167 59000.0 207.1381 78000.0 208.1245 21000.0 208.1454 33000.0 209.097 3400.0 209.1324 170000.0 209.1538 5300.0 210.1398 24000.0 211.1118 28000.0 211.1482 150000.0 212.1187 3100.0 212.1551 26000.0 213.1275 51000.0 213.1636 35000.0 214.1349 10000.0 215.1069 9500.0 215.1429 45000.0 216.1503 25000.0 217.1217 10000.0 217.1586 26000.0 219.1166 8500.0 219.1382 55000.0 220.1245 5300.0 220.1453 2900.0 221.1322 60000.0 221.1537 460000.0 221.1784 5000.0 222.1573 63000.0 223.1118 7500.0 223.1481 98000.0 224.1563 14000.0 225.1274 36000.0 225.1638 66000.0 226.1359 6600.0 226.1713 4900.0 227.1429 34000.0 227.1797 9200.0 228.1499 4100.0 229.1584 34000.0 229.191 2700.0 230.1641 2900.0 231.1385 24000.0 231.1736 7500.0 233.1143 3900.0 233.1331 3400.0 233.1543 37000.0 234.1396 3500.0 234.1614 98000.0 235.1482 55000.0 236.1551 2800.0 237.1269 22000.0 237.1639 64000.0 238.1714 8900.0 239.1434 19000.0 239.1792 47000.0 240.1874 23000.0 241.159 18000.0 241.1957 6500.0 243.1384 14000.0 243.1731 7900.0 245.1545 9500.0 247.1476 16000.0 247.1695 120000.0 248.1763 20000.0 249.164 41000.0 250.1719 3600.0 251.1423 10000.0 251.1796 33000.0 252.1868 3200.0 253.1582 29000.0 253.1952 9900.0 255.1738 10000.0 257.1532 6900.0 257.1884 9300.0 259.1699 32000.0 259.2044 9000.0 260.1763 3500.0 261.1613 17000.0 261.1881 8400.0 263.1471 7500.0 263.1794 40000.0 264.1852 3300.0 265.1606 13000.0 265.195 30000.0 266.2028 2600.0 267.1747 22000.0 267.2113 8700.0 269.1558 15000.0 269.1889 21000.0 270.1977 4500.0 271.1693 31000.0 271.2061 6200.0 273.1867 19000.0 274.1933 74000.0 275.179 19000.0 277.1586 3100.0 277.1958 19000.0 279.1743 22000.0 279.2098 9700.0 281.1902 32000.0 283.1693 6600.0 283.2059 8300.0 285.1865 29000.0 285.2209 9800.0 286.1929 45000.0 287.2005 90000.0 288.2043 6000.0 289.1969 7700.0 291.2096 6000.0 293.1905 4100.0 294.5488 3000.0 296.2124 3400.0 297.1855 30000.0 297.2213 15000.0 298.1942 4400.0 299.2009 110000.0 300.2093 19000.0 303.2093 9000.0 304.2011 2300.0 305.2258 4900.0 307.2055 13000.0 309.1838 6300.0 310.1917 3700.0 311.2009 26000.0 312.2081 41000.0 313.2159 83000.0 319.2066 6300.0 323.199 2800.0 323.2382 23000.0 325.2165 97000.0 326.2228 3400.0 327.2329 24000.0 329.224 3400.0 337.2164 51000.0 338.2614 69000.0 339.2315 34000.0 340.2399 170000.0 347.2384 2700.0 351.2306 3400.0 352.2397 120000.0 353.2436 3900.0 363.562 3400.0 365.2476 59000.0 377.2446 5100.0 379.2637 10000.0 387.2533 9200.0 391.2652 7400.0 405.2777 6400.0 413.2699 29000.0 419.2948 7900.0 420.3027 15000.0 425.2692 110000.0 426.2764 16000.0 427.2856 92000.0 430.3243 30000.0 440.2928 170000.0 470.675 3000.0 476.3657 14000.0 487.3156 2700.0 505.3325 13000.0 507.3471 3200.0 508.35 11000.0 520.3531 20000.0 564.3828 2800.0 568.4301 20000.0 585.3954 6800.0 600.4187 7400.0 END IONS BEGIN IONS SCANS=816 PEPMASS=653.2973 CHARGE=1 COLLISION_ENERGY=0.0 75.1234 2300.0 112.768 2300.0 166.0646 2600.0 173.5212 8800.0 173.5399 19000.0 175.2823 2500.0 185.4997 2300.0 217.401 2300.0 405.2144 3400.0 420.231 86000.0 421.2401 7400.0 424.2262 5200.0 433.2418 5700.0 434.2447 9400.0 447.2161 3200.0 448.2205 7700.0 449.2344 21000.0 452.2194 25000.0 459.2187 15000.0 460.2254 37000.0 461.2398 3500.0 462.2047 11000.0 463.2115 2800.0 465.2278 20000.0 475.2135 30000.0 476.2206 19000.0 477.1487 3900.0 477.2282 110000.0 488.222 2900.0 489.2325 4600.0 491.2304 2700.0 492.251 43000.0 501.2244 5300.0 502.2311 9000.0 503.2422 19000.0 504.2556 3200.0 507.241 2800.0 518.2313 14000.0 521.2178 57000.0 521.2929 7800.0 535.2332 30000.0 536.2415 40000.0 537.2475 4400.0 547.2507 3500.0 549.2852 27000.0 551.2629 7500.0 561.2513 3200.0 563.2695 6400.0 575.2646 9100.0 576.2689 16000.0 577.2791 17000.0 593.2742 6000.0 607.2888 5100.0 608.2955 7700.0 621.2689 4400.0 636.2927 10000.0 END IONS BEGIN IONS SCANS=817 PEPMASS=824.5523 CHARGE=1 COLLISION_ENERGY=0.0 73.0282 3600.0 73.5804 4300.0 74.4899 2800.0 75.1705 2600.0 77.0384 11000.0 79.0538 450000.0 81.0332 51000.0 81.0695 680000.0 83.0488 69000.0 83.0852 130000.0 85.0282 52000.0 85.0646 39000.0 86.5343 2300.0 87.0436 2200.0 88.7152 2800.0 90.1631 2100.0 91.0388 9000.0 91.0485 3100.0 91.0539 310000.0 93.0695 600000.0 95.0489 69000.0 95.0852 600000.0 95.6265 2400.0 97.028 49000.0 97.0645 75000.0 97.1009 62000.0 98.6786 2600.0 99.0436 4000.0 99.0802 35000.0 99.1511 2800.0 100.473 2400.0 103.138 2400.0 103.1704 2300.0 105.0695 320000.0 107.0487 20000.0 107.0852 410000.0 109.0645 39000.0 109.0928 3600.0 109.1008 350000.0 111.0431 3200.0 111.0802 38000.0 111.9063 2200.0 113.0964 3700.0 115.0543 4100.0 117.0618 2600.0 117.0695 150000.0 119.0757 2800.0 119.0852 380000.0 121.0642 13000.0 121.0914 12000.0 121.1008 440000.0 122.3534 2700.0 123.08 38000.0 123.1165 100000.0 125.0958 33000.0 125.1957 2300.0 127.0386 28000.0 129.0542 16000.0 129.0696 61000.0 131.0749 3100.0 131.0852 260000.0 132.1246 2400.0 133.0645 8100.0 133.0905 4600.0 133.1009 450000.0 133.1128 4900.0 135.0802 37000.0 135.1166 310000.0 137.0958 40000.0 137.1322 17000.0 137.7774 2400.0 138.9001 2400.0 139.1116 18000.0 139.6448 2400.0 141.0695 6100.0 143.0854 61000.0 145.1009 260000.0 145.1633 2300.0 147.0803 6200.0 147.1041 2600.0 147.1165 340000.0 149.0958 47000.0 149.1322 200000.0 151.1118 20000.0 155.0841 5800.0 155.1063 10000.0 157.1008 100000.0 158.2993 2300.0 159.0811 2600.0 159.1166 290000.0 161.0966 11000.0 161.1323 220000.0 163.1118 30000.0 163.1478 53000.0 165.1273 5800.0 169.1009 20000.0 169.2522 2500.0 171.1018 2500.0 171.1167 120000.0 173.1178 3200.0 173.1324 180000.0 173.5191 22000.0 173.5332 230000.0 173.5462 7600.0 174.8505 2500.0 175.1121 3400.0 175.148 80000.0 177.1276 23000.0 179.1428 5400.0 183.1169 38000.0 185.1325 100000.0 187.1479 67000.0 189.1636 10000.0 191.1427 4200.0 193.6879 2300.0 195.1383 6700.0 197.1325 27000.0 199.148 73000.0 201.164 32000.0 202.2376 2900.0 203.143 8000.0 205.1576 2800.0 211.1486 10000.0 213.1638 31000.0 217.1581 10000.0 219.1744 9400.0 224.3697 2400.0 229.1959 7500.0 231.1728 2400.0 231.2105 29000.0 234.4676 2300.0 235.1711 3900.0 239.1787 16000.0 241.195 140000.0 243.2109 25000.0 257.1898 43000.0 259.2054 410000.0 261.221 83000.0 271.7361 2800.0 275.2012 70000.0 277.2163 12000.0 277.6296 2900.0 277.6394 3200.0 289.2147 2500.0 293.2118 87000.0 294.8957 2700.0 296.7598 2500.0 307.2671 2600.0 310.244 2500.0 315.232 25000.0 323.0296 2500.0 323.542 2600.0 333.2425 190000.0 335.2582 460000.0 336.2625 2700.0 337.2651 3500.0 349.2361 3100.0 412.6738 2700.0 416.8531 2700.0 471.0158 2300.0 480.1902 2500.0 525.7731 2300.0 535.6514 2500.0 539.4589 2700.0 559.2403 2400.0 569.414 3400.0 611.4657 14000.0 632.2296 3100.0 651.0586 2800.0 728.5739 2600.0 751.9543 3000.0 771.8162 2900.0 END IONS BEGIN IONS SCANS=818 PEPMASS=829.5074 CHARGE=1 COLLISION_ENERGY=0.0 73.0281 22000.0 73.791 2100.0 73.8952 2400.0 78.1534 3900.0 78.1579 4700.0 78.9919 2500.0 79.0538 21000.0 81.033 13000.0 81.0694 56000.0 81.2717 2300.0 82.6008 3600.0 82.6044 26000.0 83.0852 5100.0 83.3959 2200.0 85.0278 45000.0 85.1593 2100.0 87.0508 26000.0 87.0539 3500.0 87.9795 2800.0 89.3932 2200.0 90.3843 2400.0 90.9158 2800.0 91.0385 41000.0 91.054 8600.0 93.0694 32000.0 94.9855 2300.0 95.085 39000.0 97.0281 57000.0 97.0892 2800.0 99.0435 3200.0 101.0227 11000.0 101.8608 2800.0 103.0382 3600.0 105.0696 14000.0 105.3823 2200.0 106.1081 2300.0 106.9072 2400.0 106.9316 2600.0 107.0852 19000.0 107.5678 2500.0 108.4579 2400.0 109.0279 2700.0 109.1008 25000.0 109.7366 2400.0 114.1872 2300.0 118.1819 2100.0 119.0848 2600.0 120.8695 2200.0 121.1003 25000.0 123.1172 9100.0 127.0384 22000.0 127.2187 2500.0 133.1009 3200.0 135.1159 14000.0 145.1014 2700.0 147.116 8200.0 147.649 2500.0 149.1327 9200.0 149.6815 7000.0 149.6915 10000.0 153.3261 2400.0 154.1302 2900.0 159.0654 2500.0 159.1162 3700.0 161.1325 5500.0 161.5265 2600.0 163.5646 2100.0 167.1063 2300.0 171.1158 2800.0 173.1319 3100.0 173.5234 34000.0 173.5342 180000.0 173.5434 12000.0 173.9438 2500.0 181.3383 2400.0 183.6372 2500.0 185.0418 74000.0 190.0449 2300.0 201.0358 13000.0 203.0517 7400.0 220.5653 2400.0 226.8842 2500.0 227.1288 2500.0 241.0677 10000.0 243.0835 94000.0 247.1299 25000.0 259.8218 2900.0 261.2203 10000.0 287.1619 21000.0 301.0893 68000.0 306.7919 2500.0 313.0902 2900.0 315.1049 51000.0 315.1925 2700.0 327.1032 3000.0 327.2281 2800.0 331.1879 9000.0 333.203 58000.0 335.2575 61000.0 339.616 2700.0 343.1406 3300.0 351.0359 2300.0 355.1361 3500.0 357.1514 5300.0 359.9273 2600.0 369.1506 11000.0 371.1676 69000.0 373.1107 58000.0 379.3342 2800.0 383.1678 10000.0 385.1833 36000.0 387.1264 9400.0 413.1801 5400.0 415.0974 2600.0 423.1993 27000.0 425.1782 110000.0 425.2166 17000.0 429.173 25000.0 430.6182 3000.0 435.7151 2300.0 439.1857 2600.0 443.1895 13000.0 453.2063 4200.0 454.7294 2800.0 457.2053 12000.0 463.2259 9500.0 465.2096 190000.0 469.2035 16000.0 469.3326 2300.0 470.9035 2400.0 473.8995 2700.0 475.23 2900.0 483.2172 10000.0 483.3445 3300.0 493.2339 3400.0 497.2359 6200.0 497.3106 4500.0 505.2406 120000.0 509.2357 16000.0 519.2927 1000000.0 520.2959 18000.0 521.298 21000.0 523.2532 5700.0 523.3491 2500.0 533.2706 65000.0 534.0808 2500.0 537.2618 8300.0 541.3558 4400.0 549.2687 7500.0 551.2822 120000.0 553.297 9900.0 563.2772 3200.0 563.3713 4000.0 581.3815 10000.0 591.3149 200000.0 593.326 10000.0 597.4636 2600.0 605.3298 48000.0 607.3502 2800.0 613.4908 2600.0 619.3459 26000.0 626.5969 2400.0 633.3588 58000.0 636.8063 2900.0 639.3459 2500.0 647.3745 67000.0 649.4414 2400.0 661.3913 55000.0 673.381 7400.0 687.3987 7400.0 691.4053 6000.0 701.4223 110000.0 703.2628 5100.0 703.4022 500000.0 713.4209 15000.0 715.4464 3200.0 726.4763 2700.0 731.4275 16000.0 741.453 26000.0 743.2746 3600.0 743.4331 820000.0 743.5887 4800.0 744.4056 3000.0 749.4306 2900.0 755.4679 21000.0 783.2975 4200.0 783.4639 570000.0 811.496 73000.0 829.5039 170000.0 END IONS BEGIN IONS SCANS=819 PEPMASS=599.4103 CHARGE=1 COLLISION_ENERGY=0.0 67.054 14000.0 69.0333 10000.0 69.0696 9500.0 70.3302 2200.0 71.049 5200.0 71.9338 2200.0 79.054 16000.0 81.0696 44000.0 81.802 2100.0 83.0488 10000.0 83.0853 20000.0 84.623 2300.0 85.0645 11000.0 85.3098 2200.0 87.0437 4900.0 89.0596 2500.0 91.054 12000.0 93.0695 78000.0 95.0488 21000.0 95.0852 58000.0 95.9713 2400.0 97.0645 44000.0 105.0695 48000.0 107.0852 74000.0 109.0646 23000.0 109.1009 36000.0 111.0803 12000.0 113.0957 22000.0 117.0697 8400.0 119.0852 92000.0 121.0644 12000.0 121.1009 96000.0 123.0801 51000.0 123.1165 5400.0 125.0596 21000.0 125.096 15000.0 129.069 6100.0 131.0853 35000.0 133.0645 2900.0 133.1009 59000.0 134.7551 2500.0 135.0802 34000.0 135.1165 34000.0 137.0596 6000.0 137.0957 50000.0 139.0753 11000.0 139.1113 23000.0 141.4513 2400.0 143.0853 36000.0 144.0935 3700.0 145.1009 98000.0 147.0802 83000.0 147.1163 33000.0 149.0957 19000.0 151.0751 62000.0 151.1113 7500.0 153.09 2900.0 153.127 9200.0 155.0853 14000.0 155.1063 14000.0 156.0931 8100.0 157.1009 97000.0 158.1087 3500.0 159.08 6600.0 159.1166 63000.0 161.096 31000.0 161.1323 31000.0 163.1116 50000.0 164.9971 2300.0 165.0909 340000.0 167.1067 14000.0 169.101 34000.0 170.109 7800.0 171.0797 2900.0 171.1167 66000.0 172.2615 2500.0 173.0962 18000.0 173.1326 35000.0 173.5281 43000.0 173.5451 9000.0 175.1113 20000.0 175.1479 22000.0 177.0906 8300.0 177.1268 12000.0 179.143 14000.0 181.1017 13000.0 181.1223 38000.0 182.1078 3300.0 183.1167 53000.0 185.0963 2900.0 185.1323 50000.0 187.1112 14000.0 187.1479 18000.0 189.1275 29000.0 191.1062 14000.0 191.1425 7400.0 193.1017 6700.0 193.1219 3200.0 195.1167 33000.0 195.1376 15000.0 196.125 7400.0 197.1325 50000.0 199.1116 9700.0 199.1484 12000.0 201.1276 11000.0 203.1431 150000.0 203.1644 3700.0 205.1584 7100.0 207.117 17000.0 207.1381 37000.0 208.1249 9000.0 209.1325 37000.0 211.1124 8500.0 211.1484 34000.0 213.1276 11000.0 213.1637 3800.0 215.1436 10000.0 217.1236 4900.0 219.3885 2500.0 220.1245 3300.0 221.1333 14000.0 221.1537 330000.0 222.1404 4000.0 223.1484 25000.0 225.1277 4900.0 225.1642 11000.0 227.1426 7000.0 227.1804 3200.0 229.1221 6200.0 229.1587 15000.0 231.1395 3100.0 233.1306 3600.0 233.1539 14000.0 235.1481 18000.0 237.127 6800.0 237.1644 13000.0 239.1411 4600.0 241.1585 6600.0 243.1742 3700.0 245.1542 3500.0 247.1455 2600.0 247.1693 57000.0 248.1538 3100.0 249.165 8100.0 251.1445 4500.0 251.179 8700.0 255.1384 2600.0 261.1609 3300.0 261.1881 3200.0 263.1804 4300.0 265.1954 3100.0 267.1746 3700.0 269.191 5400.0 271.1707 4100.0 275.1786 4000.0 279.1754 3200.0 281.1904 8300.0 283.1716 2900.0 285.1847 19000.0 286.1936 21000.0 287.2008 50000.0 289.1955 4300.0 291.1773 3500.0 293.1915 2600.0 297.1843 3100.0 298.1937 8400.0 299.2009 30000.0 311.202 9200.0 312.207 8800.0 313.2163 15000.0 325.2171 10000.0 327.2323 15000.0 347.2357 3400.0 347.5928 2700.0 364.2396 6100.0 365.2481 16000.0 387.2586 2800.0 391.2625 8600.0 413.2706 17000.0 419.2966 8500.0 426.8123 2500.0 427.2846 17000.0 441.9625 2300.0 453.2972 2700.0 507.3472 48000.0 519.3478 4800.0 527.4471 2700.0 599.4109 12000.0 END IONS BEGIN IONS SCANS=820 PEPMASS=780.5537 CHARGE=1 COLLISION_ENERGY=0.0 71.0726 7500.0 71.324 2300.0 71.3817 2200.0 73.5277 2200.0 73.8543 2500.0 77.6908 2200.0 81.0694 11000.0 82.0327 2300.0 82.2619 2300.0 82.4598 2900.0 85.6959 2400.0 86.0961 280000.0 87.8644 2300.0 91.3257 2700.0 95.0853 3900.0 97.061 2300.0 98.9839 7700.0 101.7824 2600.0 104.1068 24000.0 104.8966 2500.0 124.6083 2300.0 124.9996 110000.0 146.9815 120000.0 173.5206 13000.0 173.5319 140000.0 180.3097 2700.0 184.0352 3800.0 184.0733 2300000.0 195.366 2400.0 201.5991 2400.0 216.8859 2500.0 217.5763 2100.0 220.3674 3100.0 231.4682 2300.0 232.0138 2500.0 235.3181 2300.0 262.2534 15000.0 278.8469 2300.0 299.3138 2500.0 326.5239 2700.0 359.0281 3400.0 374.674 2900.0 476.1272 2500.0 490.6158 2600.0 553.6021 2900.0 575.5035 14000.0 597.4869 28000.0 648.0811 2500.0 700.4622 2900.0 END IONS BEGIN IONS SCANS=821 PEPMASS=535.2705 CHARGE=1 COLLISION_ENERGY=0.0 69.7821 2200.0 121.5463 2700.0 138.5106 2500.0 173.5165 2600.0 173.5294 66000.0 173.546 8100.0 208.6768 3000.0 213.7012 2300.0 240.2592 3400.0 279.2464 2400.0 280.2612 2600.0 294.9753 2400.0 304.3607 2200.0 405.2065 2900.0 433.2012 13000.0 434.2452 35000.0 435.2542 98000.0 447.2175 74000.0 448.221 18000.0 461.2329 28000.0 462.2362 81000.0 463.2853 19000.0 489.2556 3000.0 489.2666 3400.0 500.492 3100.0 506.2311 45000.0 507.2747 240000.0 517.2604 17000.0 520.2452 18000.0 535.2695 1800000.0 535.5164 3600.0 END IONS BEGIN IONS SCANS=822 PEPMASS=827.4919 CHARGE=1 COLLISION_ENERGY=0.0 73.0279 13000.0 75.5852 2200.0 79.0539 29000.0 81.0331 7900.0 81.0694 63000.0 82.9281 2800.0 82.9868 2100.0 83.0492 2700.0 83.0852 14000.0 85.0279 35000.0 87.0437 2400.0 90.1687 2300.0 91.0385 24000.0 91.0537 15000.0 93.0694 37000.0 95.0851 58000.0 97.028 31000.0 97.064 3400.0 98.659 2400.0 99.0436 3000.0 102.4414 2500.0 105.0693 15000.0 107.085 26000.0 109.0277 3100.0 109.064 3200.0 109.1006 31000.0 117.0694 4200.0 119.0851 18000.0 121.1008 30000.0 121.6664 2400.0 123.1161 6400.0 125.0957 2500.0 127.0384 18000.0 131.0853 12000.0 133.1008 31000.0 135.1165 22000.0 145.1008 3500.0 147.1162 17000.0 149.132 13000.0 149.6832 5600.0 149.6936 4500.0 159.1161 6300.0 161.1321 3600.0 167.6153 2600.0 173.1321 8000.0 173.537 100000.0 175.6691 2600.0 179.5064 2900.0 183.46 2400.0 184.0732 2800.0 185.0423 21000.0 188.5969 2500.0 193.1215 8100.0 195.5787 2800.0 213.329 2300.0 217.5463 3200.0 237.0455 2400.0 243.0838 42000.0 260.2089 2900.0 261.2241 2900.0 270.1804 3300.0 273.1794 3000.0 275.2011 2800.0 313.1769 73000.0 331.1878 210000.0 335.2583 35000.0 337.2732 28000.0 338.276 14000.0 386.3588 2300.0 387.2142 2900.0 397.8145 2600.0 451.1938 57000.0 488.2908 2700.0 491.2221 6800.0 495.4072 2400.0 506.8096 2400.0 519.2925 560000.0 519.3824 4400.0 531.2561 150000.0 532.4124 3500.0 549.2668 140000.0 591.314 39000.0 595.6996 2600.0 633.3608 2800.0 646.989 3200.0 647.4229 6900.0 665.4358 9500.0 691.6677 3000.0 715.4 15000.0 729.4162 99000.0 757.4139 3200.0 759.566 2800.0 769.4483 6800.0 799.4988 3200.0 809.48 230000.0 827.4891 230000.0 END IONS BEGIN IONS SCANS=823 PEPMASS=870.5657 CHARGE=1 COLLISION_ENERGY=0.0 78.3716 2200.0 81.643 2700.0 173.5312 32000.0 191.6997 3300.0 459.2176 40000.0 460.2249 20000.0 461.2341 3200.0 491.2462 3700.0 492.2509 17000.0 503.2417 5400.0 505.2239 8000.0 516.2503 6500.0 519.2379 53000.0 520.2463 16000.0 531.238 68000.0 532.2462 13000.0 533.2537 57000.0 548.266 4500.0 560.2392 7700.0 577.2419 8900.0 591.26 37000.0 592.1577 4100.0 592.2673 90000.0 593.2762 8400.0 832.4004 2700.0 870.5668 6700.0 END IONS BEGIN IONS SCANS=824 PEPMASS=584.4224 CHARGE=1 COLLISION_ENERGY=0.0 63.2037 2300.0 65.0387 3100.0 65.5617 2200.0 65.8456 2400.0 66.2403 2600.0 67.0541 32000.0 69.0334 18000.0 69.0697 45000.0 73.0281 10000.0 79.054 50000.0 80.062 24000.0 81.0697 160000.0 83.0489 29000.0 83.0854 28000.0 85.0646 20000.0 87.0438 14000.0 89.0594 270000.0 90.9764 2300.0 91.0541 55000.0 91.8154 2500.0 92.062 4400.0 93.0696 210000.0 94.078 11000.0 95.049 60000.0 95.0853 150000.0 96.0886 3600.0 97.0647 29000.0 105.0696 220000.0 106.0776 30000.0 107.0853 210000.0 108.0882 2700.0 109.0646 49000.0 109.1009 110000.0 111.0802 16000.0 115.8673 2400.0 117.0697 45000.0 118.0772 4100.0 119.0756 7300.0 119.0853 420000.0 120.0931 31000.0 121.0646 22000.0 121.0917 8800.0 121.1009 280000.0 122.072 2900.0 122.1044 8300.0 122.4726 2700.0 123.0802 150000.0 123.1166 33000.0 125.0596 43000.0 125.096 3800.0 129.0696 31000.0 131.0853 180000.0 132.0931 54000.0 133.065 6800.0 133.0858 130000.0 133.101 280000.0 134.1076 17000.0 135.0802 81000.0 135.1166 110000.0 136.0878 4100.0 136.1205 2400.0 137.0602 6600.0 137.0959 91000.0 138.1038 28000.0 139.0752 30000.0 139.1115 16000.0 142.0776 23000.0 143.0853 170000.0 144.0929 73000.0 145.0887 4400.0 145.101 540000.0 145.1203 3500.0 146.1072 41000.0 147.0802 130000.0 147.1166 140000.0 148.088 8400.0 148.1211 3600.0 149.096 67000.0 149.1323 17000.0 150.1023 3100.0 151.0752 85000.0 151.0893 2300.0 151.1117 31000.0 152.0815 2800.0 153.0905 13000.0 154.5883 2500.0 155.0854 38000.0 156.0931 43000.0 157.1009 400000.0 157.1165 2800.0 158.1086 130000.0 159.0803 33000.0 159.1167 320000.0 160.123 29000.0 161.0959 77000.0 161.1323 96000.0 162.1033 8300.0 163.1116 130000.0 164.1175 3600.0 165.0909 480000.0 166.0943 21000.0 167.0857 6500.0 167.1068 31000.0 168.0932 3800.0 169.1011 100000.0 170.1085 49000.0 171.1168 250000.0 172.1242 81000.0 173.096 42000.0 173.1325 180000.0 173.5287 120000.0 173.5399 28000.0 173.7299 2700.0 174.1389 33000.0 175.1117 85000.0 175.148 100000.0 176.1192 13000.0 177.0911 24000.0 177.1115 21000.0 177.1276 39000.0 177.4812 3000.0 178.0983 19000.0 179.0856 2800.0 179.1064 5900.0 180.1144 50000.0 181.1012 50000.0 181.1222 84000.0 182.1079 20000.0 182.1417 2500.0 183.1168 160000.0 184.1239 33000.0 185.0958 18000.0 185.1148 4300.0 185.1324 180000.0 186.1037 3600.0 186.1389 37000.0 187.1118 45000.0 187.148 92000.0 188.1189 6500.0 189.1273 87000.0 190.1351 110000.0 191.1065 42000.0 191.143 66000.0 193.1021 26000.0 193.1223 78000.0 194.1089 11000.0 195.1168 110000.0 195.1366 20000.0 196.1235 38000.0 197.097 8600.0 197.1323 160000.0 198.1038 11000.0 198.1388 38000.0 199.1121 42000.0 199.1478 66000.0 200.1193 2800.0 200.1551 7100.0 201.1274 50000.0 201.1637 42000.0 203.1095 4500.0 203.143 290000.0 204.147 19000.0 205.1228 3900.0 207.1164 47000.0 207.1382 100000.0 208.1239 24000.0 208.1455 58000.0 209.1325 140000.0 209.1529 13000.0 210.139 37000.0 211.112 29000.0 211.1482 120000.0 212.1199 4100.0 212.1546 20000.0 213.1274 38000.0 213.1642 40000.0 214.1338 7300.0 214.1713 2500.0 215.1431 27000.0 216.1509 13000.0 217.1221 3600.0 217.1588 20000.0 219.1169 7300.0 219.1381 44000.0 220.1476 2800.0 221.1328 50000.0 221.1538 570000.0 222.137 8600.0 222.1586 15000.0 223.1481 100000.0 224.1174 2500.0 224.1541 19000.0 225.1276 33000.0 225.1638 66000.0 226.1714 5900.0 227.1435 33000.0 227.1789 22000.0 229.122 3100.0 229.1589 28000.0 231.1377 15000.0 233.1312 16000.0 233.1545 30000.0 234.1384 6000.0 234.1612 91000.0 235.148 44000.0 236.154 13000.0 237.1272 34000.0 237.1635 57000.0 238.1694 23000.0 239.1434 21000.0 239.1796 35000.0 239.8537 2400.0 241.1583 26000.0 241.1953 10000.0 243.139 9100.0 243.1727 3100.0 244.1446 2900.0 245.1545 24000.0 247.1453 14000.0 247.1694 110000.0 248.1541 4000.0 249.1633 47000.0 250.1695 4100.0 251.1444 17000.0 251.179 46000.0 252.1479 5500.0 252.1848 2600.0 253.1588 30000.0 253.1927 12000.0 255.174 18000.0 256.1798 3100.0 257.1537 3700.0 257.1895 2500.0 259.145 3100.0 259.1692 89000.0 259.2012 3400.0 260.1776 16000.0 261.1612 12000.0 261.1859 13000.0 263.1438 9400.0 263.1788 39000.0 264.1541 2800.0 264.1856 2800.0 265.1589 14000.0 265.1948 34000.0 266.2027 69000.0 267.1741 27000.0 268.1802 6800.0 269.1561 11000.0 269.1896 18000.0 271.1693 33000.0 272.1775 10000.0 273.1859 29000.0 274.193 71000.0 275.1789 12000.0 277.1602 9300.0 277.1944 14000.0 279.1752 18000.0 279.2101 11000.0 281.1904 34000.0 283.2059 11000.0 283.2825 2600.0 285.1852 46000.0 286.1924 70000.0 287.2006 190000.0 289.1967 10000.0 291.1742 5300.0 291.2103 12000.0 293.1897 9400.0 295.1695 3200.0 296.1776 3200.0 296.2144 3800.0 297.1848 34000.0 297.2217 11000.0 298.1915 3000.0 299.2006 74000.0 300.2078 35000.0 307.2004 3100.0 308.491 2700.0 309.1851 25000.0 309.2219 18000.0 310.1927 20000.0 311.2012 26000.0 312.2081 22000.0 312.2471 7600.0 313.2164 25000.0 315.2087 3000.0 319.2063 28000.0 323.1999 7100.0 325.216 59000.0 326.2253 2800.0 333.2188 5000.0 334.2277 3600.0 335.2366 3000.0 337.2164 130000.0 338.2224 3300.0 339.2315 19000.0 347.2373 7900.0 348.2456 3600.0 349.2138 3900.0 350.2251 2800.0 351.2313 34000.0 352.2397 280000.0 353.247 74000.0 354.2522 17000.0 363.2318 3600.0 364.2379 6500.0 365.2472 180000.0 366.2559 54000.0 375.9521 2700.0 383.2578 12000.0 391.2652 3400.0 397.2737 29000.0 398.2822 16000.0 404.3077 26000.0 411.2886 12000.0 412.2978 29000.0 423.2883 3000.0 425.3054 25000.0 431.2873 3300.0 438.3102 11000.0 448.2971 13000.0 453.3182 2600.0 474.3482 2800.0 477.331 3000.0 489.3357 23000.0 491.3518 75000.0 492.3548 81000.0 504.3597 180000.0 512.4713 3000.0 569.3982 6800.0 584.4206 19000.0 END IONS BEGIN IONS SCANS=825 PEPMASS=813.5126 CHARGE=1 COLLISION_ENERGY=0.0 73.0278 63000.0 73.6361 2500.0 74.5853 2100.0 75.5078 2200.0 75.6305 2100.0 76.068 2300.0 76.1769 2500.0 79.0265 2500.0 79.0536 59000.0 80.8688 2600.0 81.0329 35000.0 81.0692 120000.0 82.6324 2400.0 83.0487 8900.0 83.0849 24000.0 85.0276 150000.0 85.1009 3300.0 87.0436 12000.0 90.3893 140000.0 90.3936 19000.0 91.0382 130000.0 91.0535 34000.0 92.3049 2300.0 93.0691 100000.0 93.1803 2300.0 95.0483 2300.0 95.0847 120000.0 97.0276 140000.0 97.1004 4300.0 99.0436 28000.0 101.0226 61000.0 101.1153 2300.0 101.6404 2400.0 103.0385 17000.0 103.4049 2200.0 103.9869 2500.0 104.4308 2200.0 105.0692 40000.0 107.0847 78000.0 107.3553 2300.0 108.6217 2700.0 109.0277 24000.0 109.0645 2500.0 109.1004 73000.0 115.0384 10000.0 116.2851 2200.0 117.0694 5000.0 119.0847 62000.0 121.1004 86000.0 123.1159 24000.0 127.0381 87000.0 129.0539 9200.0 129.8301 2200.0 131.0849 36000.0 133.1003 65000.0 135.116 81000.0 137.1316 2500.0 138.92 2300.0 143.0839 3000.0 145.0489 19000.0 145.1003 31000.0 146.6958 2900.0 147.116 49000.0 148.0025 2600.0 149.1317 39000.0 153.282 2700.0 157.1001 3100.0 159.116 38000.0 161.1316 39000.0 163.1478 11000.0 171.117 4100.0 173.1318 26000.0 173.5282 190000.0 173.5441 35000.0 174.9842 2200.0 175.1473 15000.0 183.065 4000.0 184.0727 30000.0 185.0412 100000.0 185.0749 2600.0 185.1307 3700.0 185.1561 2400.0 187.1476 6800.0 192.1287 2400.0 199.1445 2500.0 201.0363 7800.0 201.0749 2700.0 203.0518 37000.0 203.3698 2900.0 231.2103 2700.0 235.6669 2300.0 241.0685 13000.0 241.1953 3200.0 243.0831 200000.0 243.2103 4700.0 256.3856 2600.0 259.2052 56000.0 261.2204 49000.0 287.2032 2300.0 299.1976 25000.0 301.0887 32000.0 301.2142 6000.0 313.0873 2900.0 313.274 35000.0 314.2764 25000.0 315.1038 22000.0 317.2079 210000.0 323.2897 2700.0 333.2421 40000.0 335.2573 200000.0 339.8165 2500.0 341.1228 2700.0 357.2408 2700.0 363.254 3900.0 371.1669 11000.0 373.1102 25000.0 373.2344 35000.0 377.8758 2600.0 385.1844 12000.0 397.1805 2600.0 399.2545 3100.0 401.7305 2800.0 419.5729 2500.0 425.2131 17000.0 428.3698 2700.0 429.1721 15000.0 439.2228 2500.0 465.2092 51000.0 467.2234 2600.0 469.2062 9000.0 470.994 2500.0 483.2176 4600.0 486.9359 2600.0 497.3104 25000.0 516.4214 2700.0 517.2777 22000.0 519.2006 3800.0 519.2924 3100000.0 520.2888 3500.0 523.249 4000.0 535.1926 11000.0 535.2872 2100000.0 535.3818 15000.0 552.5071 4900.0 563.2827 3100.0 578.3056 8800.0 591.3144 94000.0 605.3271 21000.0 619.3442 26000.0 633.3517 19000.0 633.4554 20000.0 647.3522 13000.0 647.3715 7600.0 651.4596 110000.0 661.3937 20000.0 665.0187 2800.0 666.8761 2600.0 675.405 33000.0 701.422 13000.0 703.4402 14000.0 715.4343 26000.0 742.7803 3000.0 743.4353 100000.0 743.7706 2500.0 795.4973 10000.0 813.1603 5800.0 813.5116 3600000.0 END IONS BEGIN IONS SCANS=826 PEPMASS=611.4676 CHARGE=1 COLLISION_ENERGY=0.0 65.3547 2400.0 67.0539 220000.0 68.7324 2300.0 69.0696 84000.0 71.0494 2900.0 71.0852 6200.0 79.0495 3300.0 79.0539 150000.0 80.5932 2100.0 81.0695 310000.0 81.1553 2300.0 83.0489 5800.0 83.0852 65000.0 85.0646 13000.0 91.0539 110000.0 91.7549 2800.0 93.0694 260000.0 95.0004 2500.0 95.0489 12000.0 95.0852 290000.0 97.0644 19000.0 97.1009 37000.0 99.08 6800.0 100.6933 2500.0 101.1184 2500.0 104.4202 2800.0 105.0695 150000.0 107.0775 3000.0 107.0852 180000.0 108.6559 2300.0 109.0645 12000.0 109.1008 160000.0 111.0802 12000.0 113.9388 2400.0 117.0696 66000.0 118.1925 2400.0 119.0852 190000.0 121.1008 200000.0 123.0803 8200.0 123.1164 52000.0 125.0958 8700.0 129.0697 32000.0 131.0853 130000.0 133.1008 210000.0 133.6644 2800.0 135.1055 7000.0 135.1165 160000.0 137.0951 3400.0 137.1322 13000.0 139.1112 6100.0 143.0852 50000.0 145.1009 150000.0 147.1165 210000.0 149.0959 3700.0 149.1321 97000.0 149.6852 4600.0 149.6952 3900.0 151.1116 7100.0 155.0856 12000.0 157.1009 79000.0 159.0792 2600.0 159.1166 170000.0 159.1312 3000.0 161.1322 150000.0 163.1123 6200.0 163.1478 33000.0 167.8018 2300.0 168.7478 2400.0 169.1008 23000.0 171.1167 110000.0 171.7483 2700.0 173.1324 130000.0 173.5239 31000.0 173.5354 120000.0 175.1119 3200.0 175.1481 70000.0 177.1258 3700.0 177.1646 4400.0 181.1013 3900.0 183.1168 47000.0 185.1324 94000.0 185.1495 3800.0 187.1481 57000.0 189.1278 5600.0 189.164 21000.0 190.1067 2500.0 195.1171 14000.0 197.1323 41000.0 198.7604 3000.0 199.148 78000.0 200.1591 2400.0 201.1638 38000.0 207.7198 2400.0 209.1324 15000.0 211.1481 32000.0 213.1637 42000.0 215.1792 23000.0 217.1941 4900.0 221.1317 6600.0 223.1481 13000.0 225.1638 18000.0 227.1792 15000.0 229.1947 12000.0 231.2105 19000.0 237.1644 2800.0 239.1793 16000.0 241.1951 82000.0 243.2095 11000.0 252.0994 2200.0 253.1967 6900.0 257.1887 19000.0 259.175 4200.0 259.2054 210000.0 259.2361 2900.0 261.2214 35000.0 264.056 2700.0 267.2101 3000.0 271.2085 2800.0 273.2216 2500.0 275.2006 6200.0 283.2812 2700.0 285.2213 3400.0 287.2373 2900.0 297.2208 6700.0 299.2362 9900.0 311.2366 9800.0 313.2531 4200.0 315.233 3500.0 317.2495 2600.0 325.2536 3900.0 333.2428 48000.0 335.2582 91000.0 337.2532 3900.0 339.2688 10000.0 349.0735 2100.0 351.4283 2700.0 353.2849 12000.0 367.2981 6900.0 371.2998 3000.0 394.2626 2600.0 405.26 2600.0 449.3426 2800.0 519.4191 46000.0 529.3964 3000.0 537.4299 9300.0 541.3914 3600.0 542.6165 2600.0 544.9203 3200.0 593.4541 10000.0 611.4679 140000.0 END IONS BEGIN IONS SCANS=827 PEPMASS=653.2975 CHARGE=1 COLLISION_ENERGY=0.0 67.9945 2300.0 70.1427 2700.0 73.1621 2400.0 81.5497 2700.0 88.0977 2700.0 106.4932 2200.0 110.4182 2500.0 116.8133 2100.0 125.8747 2500.0 125.9981 2300.0 126.6553 2600.0 128.5506 2600.0 133.8872 3000.0 161.554 2600.0 166.7035 2700.0 173.5218 10000.0 173.5343 79000.0 197.3633 2400.0 211.1201 2500.0 228.1462 2600.0 297.1235 2700.0 318.3719 2400.0 321.5282 2400.0 328.3874 2200.0 391.1923 10000.0 405.2077 32000.0 406.215 7400.0 419.2249 20000.0 420.1647 5100.0 420.2313 960000.0 421.2393 54000.0 424.226 36000.0 426.8539 2600.0 432.2354 3200.0 433.2393 83000.0 434.2469 120000.0 446.2521 3700.0 447.2523 7100.0 447.2615 11000.0 448.2278 120000.0 448.2786 5400.0 449.2341 260000.0 451.2149 7000.0 452.2213 320000.0 459.2187 150000.0 460.2259 400000.0 461.2322 29000.0 462.2059 110000.0 463.2133 65000.0 465.2289 250000.0 474.2375 12000.0 474.2456 3600.0 475.2135 350000.0 476.2206 170000.0 477.1471 4900.0 477.2289 1300000.0 477.3076 6500.0 478.2382 11000.0 479.2449 24000.0 480.2556 3800.0 487.2134 40000.0 488.2188 18000.0 489.2284 32000.0 490.2356 4100.0 491.2137 16000.0 491.239 21000.0 492.252 460000.0 493.225 28000.0 493.2471 3800.0 501.2287 68000.0 502.2358 59000.0 503.2437 230000.0 504.2497 33000.0 505.2556 3300.0 507.2398 18000.0 518.2315 160000.0 519.2386 3800.0 519.2478 10000.0 520.1359 6000.0 520.2819 3900.0 521.2184 690000.0 521.2925 84000.0 522.3028 10000.0 523.2344 4300.0 533.2521 4600.0 534.2294 13000.0 535.1649 2100.0 535.2344 330000.0 535.3283 3200.0 536.2421 440000.0 537.2499 51000.0 545.2592 3600.0 547.247 37000.0 547.2619 10000.0 548.2794 3700.0 549.2855 290000.0 551.2662 120000.0 559.2714 13000.0 561.2503 59000.0 562.2602 7700.0 563.2654 77000.0 564.2709 6200.0 565.2762 54000.0 566.2897 43000.0 575.2652 110000.0 576.2717 69000.0 577.2814 150000.0 593.2753 73000.0 603.2635 3100.0 607.288 41000.0 608.2941 9500.0 621.2715 59000.0 635.2856 8600.0 636.2934 88000.0 END IONS BEGIN IONS SCANS=828 PEPMASS=600.4174 CHARGE=1 COLLISION_ENERGY=0.0 67.0541 19000.0 69.0334 37000.0 69.0698 39000.0 69.2396 4200.0 76.3387 9200.0 79.054 45000.0 81.0698 150000.0 83.049 60000.0 83.0854 18000.0 85.0646 45000.0 87.0443 2900.0 87.319 7200.0 87.9228 7700.0 89.0596 58000.0 91.0541 78000.0 92.0621 3000.0 93.0638 5500.0 93.0697 240000.0 93.3756 2600.0 94.0727 4900.0 95.049 74000.0 95.0793 5200.0 95.0854 180000.0 96.0571 2900.0 96.0889 11000.0 97.0648 45000.0 101.2342 4700.0 101.2418 4300.0 102.2934 2300.0 104.76 8300.0 105.0697 260000.0 106.0775 18000.0 107.0494 2800.0 107.0854 210000.0 108.0884 10000.0 108.9954 3400.0 109.0646 88000.0 109.101 84000.0 111.0803 31000.0 113.0962 7400.0 115.0543 3700.0 115.3073 2400.0 117.0698 37000.0 119.0492 9100.0 119.0755 2600.0 119.0854 470000.0 119.0956 9600.0 120.0917 36000.0 121.0647 46000.0 121.101 350000.0 122.1043 31000.0 123.0803 180000.0 123.1168 32000.0 124.084 5500.0 125.0595 270000.0 125.0966 7700.0 126.0627 3000.0 128.0625 3800.0 129.0698 28000.0 130.0776 3800.0 131.0854 140000.0 132.0932 52000.0 133.0645 40000.0 133.0861 34000.0 133.1011 270000.0 134.1083 49000.0 135.0803 190000.0 135.1167 130000.0 136.0841 3200.0 136.1203 5800.0 137.0594 29000.0 137.0961 180000.0 138.0996 13000.0 139.0751 72000.0 139.1118 8600.0 141.0707 3700.0 142.0782 12000.0 143.0855 160000.0 144.0928 66000.0 145.065 3900.0 145.0906 3200.0 145.1011 440000.0 145.1143 5200.0 146.1066 44000.0 147.0803 370000.0 147.1168 98000.0 148.0844 62000.0 148.1213 9900.0 149.0961 140000.0 150.1038 26000.0 151.0752 230000.0 151.1115 10000.0 152.0802 24000.0 153.0907 18000.0 155.085 58000.0 156.0928 42000.0 157.101 420000.0 157.1122 4000.0 158.1075 110000.0 159.0803 83000.0 159.1168 330000.0 159.1316 6300.0 160.0876 14000.0 160.1232 55000.0 161.096 140000.0 161.1324 170000.0 162.1013 13000.0 162.136 20000.0 163.0766 2500.0 163.1117 600000.0 164.0826 2800.0 164.1159 39000.0 165.091 1700000.0 165.1037 9200.0 165.1247 3600.0 165.4994 2400.0 166.0944 270000.0 167.0855 9900.0 168.0938 6700.0 169.1012 140000.0 170.1082 54000.0 171.0807 4700.0 171.1168 280000.0 172.1233 110000.0 173.0962 130000.0 173.1123 4500.0 173.1155 4700.0 173.1325 130000.0 173.5228 75000.0 173.5418 88000.0 174.1016 17000.0 174.1369 9900.0 175.1118 170000.0 175.1481 56000.0 176.1193 18000.0 176.1514 5400.0 177.0908 77000.0 177.1069 3600.0 177.1276 55000.0 178.0985 81000.0 178.1314 11000.0 179.0892 8300.0 179.1068 53000.0 179.1432 13000.0 180.0971 4900.0 180.1143 80000.0 181.1026 35000.0 181.1223 610000.0 181.1368 3300.0 182.1083 28000.0 182.1254 24000.0 183.1168 240000.0 184.1225 69000.0 185.096 26000.0 185.1325 230000.0 186.1036 20000.0 186.1375 46000.0 187.1118 100000.0 187.1482 85000.0 188.1181 15000.0 188.1501 3200.0 189.0909 9700.0 189.1274 170000.0 190.1349 230000.0 191.1066 150000.0 191.1431 51000.0 192.1125 12000.0 192.1475 3900.0 193.1023 15000.0 193.1224 180000.0 194.1089 8300.0 195.1168 110000.0 195.1383 60000.0 196.1236 44000.0 196.1423 3000.0 197.0973 20000.0 197.1324 180000.0 198.1037 13000.0 198.138 25000.0 199.112 88000.0 199.1481 59000.0 200.1186 5600.0 200.1536 2700.0 200.6958 8600.0 201.1274 120000.0 201.1642 12000.0 202.1335 6000.0 203.1431 760000.0 203.1644 14000.0 203.1748 4000.0 204.1144 7400.0 204.1465 160000.0 205.1224 19000.0 206.1299 6100.0 207.1171 55000.0 207.1383 240000.0 208.1241 25000.0 208.145 130000.0 209.1325 120000.0 209.1529 27000.0 210.139 40000.0 211.1119 48000.0 211.1482 170000.0 212.1193 12000.0 212.1543 65000.0 213.1275 94000.0 213.1636 50000.0 214.1342 17000.0 215.108 13000.0 215.1431 82000.0 216.1508 80000.0 217.1217 27000.0 217.1593 11000.0 218.1297 13000.0 219.1165 11000.0 219.1381 170000.0 220.1457 14000.0 221.0733 7600.0 221.1341 42000.0 221.1537 1900000.0 222.1352 20000.0 222.1572 400000.0 223.1112 26000.0 223.1483 80000.0 224.1192 5800.0 224.1526 21000.0 225.1276 71000.0 225.1639 82000.0 226.1336 13000.0 226.1695 13000.0 227.1432 54000.0 227.1799 28000.0 228.1485 5000.0 228.1827 3200.0 229.1222 32000.0 229.159 94000.0 230.1284 5600.0 230.1636 30000.0 231.1381 66000.0 231.1757 4000.0 232.1442 26000.0 233.1311 33000.0 233.154 110000.0 234.1391 5100.0 234.1613 340000.0 235.1469 38000.0 235.1705 34000.0 236.1526 9600.0 237.1275 50000.0 237.1638 48000.0 238.1347 5000.0 238.1706 23000.0 239.1432 43000.0 239.1801 61000.0 240.1506 10000.0 240.1599 5000.0 240.1869 110000.0 241.1218 11000.0 241.1583 45000.0 242.1642 5000.0 243.1376 57000.0 243.175 11000.0 245.154 44000.0 246.1613 6100.0 247.1693 520000.0 247.199 12000.0 248.1506 4200.0 248.1745 140000.0 249.1635 39000.0 250.1357 6300.0 250.1706 8900.0 251.1429 45000.0 251.1787 40000.0 252.1501 5400.0 253.1276 2500.0 253.1582 60000.0 253.1929 4600.0 254.1662 11000.0 255.1378 28000.0 255.1735 31000.0 256.1815 7300.0 257.1541 45000.0 257.1863 5300.0 258.1588 5100.0 259.1694 92000.0 260.1182 2400.0 260.1766 70000.0 261.1591 12000.0 261.1851 60000.0 263.1443 10000.0 263.1785 35000.0 264.1877 4100.0 265.1587 38000.0 265.1941 13000.0 266.1654 13000.0 266.199 2700.0 267.1436 3000.0 267.1742 45000.0 268.1817 4800.0 269.1537 49000.0 269.1896 52000.0 270.1941 12000.0 271.1696 78000.0 272.1761 18000.0 273.1852 55000.0 274.1929 250000.0 275.1777 6100.0 277.1587 5700.0 277.1953 10000.0 279.1748 54000.0 279.2092 11000.0 280.1815 6100.0 281.1539 15000.0 281.1902 78000.0 282.1944 23000.0 283.1701 26000.0 283.2023 5600.0 284.176 4500.0 285.1852 74000.0 286.1926 140000.0 287.2007 350000.0 288.2038 80000.0 289.1939 21000.0 291.1747 16000.0 291.2095 12000.0 293.1901 31000.0 294.1968 17000.0 295.1708 11000.0 295.2056 31000.0 296.1777 4000.0 297.1851 93000.0 297.2199 25000.0 298.1932 26000.0 299.2008 380000.0 300.2071 77000.0 305.1909 10000.0 306.1971 3500.0 306.5211 3000.0 307.2062 58000.0 309.1848 38000.0 309.2211 26000.0 310.192 45000.0 311.2003 100000.0 312.2077 150000.0 313.179 12000.0 313.2162 330000.0 314.2198 35000.0 319.2065 30000.0 321.2217 4200.0 323.2007 24000.0 324.2057 8800.0 325.2161 390000.0 326.2225 47000.0 327.2325 120000.0 328.2355 39000.0 333.2205 4300.0 335.1986 11000.0 335.2383 5000.0 336.2008 3800.0 337.2165 120000.0 339.2315 120000.0 340.2039 4400.0 340.2396 790000.0 340.2868 11000.0 345.2185 2900.0 347.2379 11000.0 349.2135 3900.0 351.2329 41000.0 352.2395 370000.0 353.2463 13000.0 359.2354 3600.0 363.2307 15000.0 364.2383 9500.0 365.247 180000.0 366.2521 44000.0 367.2242 3800.0 373.2522 3800.0 375.2353 3300.0 377.246 27000.0 379.2635 43000.0 385.2353 26000.0 387.2544 45000.0 390.2535 2800.0 391.2636 65000.0 392.2684 49000.0 395.263 3100.0 397.271 3300.0 400.2619 11000.0 403.2635 2500.0 405.279 54000.0 407.2582 3200.0 411.2535 49000.0 413.2686 140000.0 414.2701 33000.0 419.2944 69000.0 420.2987 75000.0 425.2683 420000.0 426.2765 76000.0 427.2844 360000.0 428.287 80000.0 439.2826 9500.0 440.2316 3600.0 440.2919 630000.0 440.3462 3800.0 453.2992 16000.0 454.3044 26000.0 487.3176 15000.0 493.3266 13000.0 505.3329 47000.0 507.3465 12000.0 508.3499 16000.0 520.352 99000.0 567.3805 3700.0 585.3928 51000.0 594.8237 5200.0 600.411 46000.0 END IONS BEGIN IONS SCANS=829 PEPMASS=808.5572 CHARGE=1 COLLISION_ENERGY=0.0 72.9563 2300.0 77.0388 15000.0 78.8987 2200.0 79.0541 430000.0 80.8625 2300.0 81.0697 830000.0 81.0743 2200.0 83.0491 26000.0 83.0854 160000.0 85.0283 22000.0 85.0648 42000.0 86.0963 3100.0 88.4877 2600.0 90.5499 2800.0 91.0393 8900.0 91.0541 320000.0 93.0631 3900.0 93.0698 700000.0 93.0769 5700.0 94.4776 2800.0 95.049 51000.0 95.0786 4600.0 95.0854 820000.0 97.0285 3300.0 97.0647 63000.0 97.101 83000.0 99.0803 42000.0 103.0397 3400.0 105.0444 4000.0 105.0617 3500.0 105.0697 430000.0 107.049 12000.0 107.0854 530000.0 107.0921 2200.0 109.0647 29000.0 109.0927 4900.0 109.101 460000.0 110.4408 2400.0 111.0804 46000.0 111.1168 10000.0 112.43 2400.0 112.5164 2300.0 113.096 9700.0 113.38 2500.0 117.0698 190000.0 119.0755 9800.0 119.0854 570000.0 119.0956 4100.0 121.0645 7200.0 121.091 15000.0 121.101 620000.0 121.1115 3500.0 123.0804 41000.0 123.1167 160000.0 125.096 26000.0 129.0545 14000.0 129.0699 71000.0 129.9221 2400.0 131.0747 4900.0 131.0854 360000.0 131.1434 2500.0 133.0647 3200.0 133.0907 10000.0 133.1011 690000.0 133.1149 8600.0 135.0804 23000.0 135.1055 3700.0 135.1167 540000.0 135.1286 5700.0 137.096 36000.0 137.1325 38000.0 139.0747 2200.0 139.1116 21000.0 140.9382 2300.0 141.0701 7200.0 143.0855 100000.0 145.1011 430000.0 145.1141 3800.0 146.9815 13000.0 147.0808 11000.0 147.1056 2200.0 147.1167 680000.0 149.0959 49000.0 149.1324 320000.0 149.1447 4500.0 149.6622 2400.0 151.1116 17000.0 151.1489 6400.0 153.1275 5800.0 155.0721 2200.0 155.0856 25000.0 157.1011 150000.0 159.1168 450000.0 161.0966 10000.0 161.1325 490000.0 161.1478 3600.0 163.1116 37000.0 163.148 110000.0 163.5795 3100.0 164.6411 2300.0 165.1276 17000.0 169.1013 45000.0 171.1004 3800.0 171.1169 240000.0 173.0964 2700.0 173.1326 330000.0 173.5234 15000.0 173.5347 190000.0 173.544 16000.0 175.112 21000.0 175.1482 210000.0 177.1274 30000.0 177.1639 23000.0 179.1442 2700.0 181.1015 10000.0 183.1169 53000.0 184.0733 29000.0 185.1325 220000.0 187.1124 9000.0 187.148 130000.0 189.1277 28000.0 189.1639 34000.0 191.1429 15000.0 195.1168 18000.0 195.8706 2500.0 197.1327 46000.0 199.114 5200.0 199.1483 140000.0 201.1278 3100.0 201.164 57000.0 203.1436 18000.0 203.1795 7300.0 205.1595 3100.0 207.853 2800.0 209.1329 20000.0 210.801 2400.0 211.1107 3100.0 211.1483 31000.0 213.164 70000.0 213.5597 2700.0 215.1796 35000.0 217.1594 11000.0 217.1951 13000.0 217.3083 2900.0 223.1478 7900.0 225.1282 2700.0 225.1636 16000.0 227.1805 14000.0 229.195 20000.0 231.1734 17000.0 231.1869 3100.0 231.2109 110000.0 235.1691 3300.0 237.164 8300.0 239.1791 37000.0 241.195 350000.0 243.2105 58000.0 244.9707 2400.0 247.1701 2600.0 253.1954 4100.0 253.261 2600.0 257.1897 71000.0 259.1804 6900.0 259.2054 1000000.0 261.2212 160000.0 263.2379 3700.0 271.206 12000.0 273.2205 13000.0 275.2009 33000.0 275.2323 2700.0 277.2164 38000.0 283.2053 6200.0 285.2208 8200.0 289.2169 21000.0 295.2066 2700.0 297.222 6900.0 299.2383 4800.0 301.2169 19000.0 303.2321 11000.0 313.2161 4000.0 315.2323 66000.0 325.2542 2800.0 327.2677 3700.0 333.2058 2700.0 333.2426 400000.0 333.2873 3000.0 335.2581 890000.0 336.2626 2600.0 337.2706 7200.0 339.2699 3400.0 340.6796 2800.0 349.2322 7800.0 351.2546 10000.0 367.2249 11000.0 379.2979 3200.0 426.3686 2700.0 449.9368 2400.0 519.4192 26000.0 541.3837 2600.0 593.4559 12000.0 611.4649 56000.0 614.6127 2600.0 END IONS BEGIN IONS SCANS=830 PEPMASS=599.4102 CHARGE=1 COLLISION_ENERGY=0.0 67.0539 10000.0 69.0334 2800.0 69.0695 5700.0 70.0093 2300.0 74.1282 2200.0 78.5765 2500.0 79.0542 2900.0 81.0695 27000.0 83.0488 8600.0 83.0853 12000.0 87.0444 2400.0 91.0538 8200.0 93.0694 44000.0 95.0488 11000.0 95.0851 40000.0 97.0646 17000.0 104.3414 2800.0 105.0695 32000.0 107.0851 39000.0 109.0643 13000.0 109.1007 23000.0 109.9317 2500.0 113.096 7200.0 117.0695 5300.0 119.0851 55000.0 121.0644 5500.0 121.1008 62000.0 123.0802 24000.0 123.1173 4700.0 125.0595 10000.0 125.0959 5400.0 131.0853 23000.0 133.1008 43000.0 135.0802 19000.0 135.1164 22000.0 137.0959 25000.0 137.1318 2300.0 139.0755 3300.0 139.1114 14000.0 143.0853 21000.0 145.1009 57000.0 147.0801 40000.0 147.1163 21000.0 149.0959 14000.0 151.0262 2500.0 151.0751 30000.0 151.1111 2900.0 153.0908 2800.0 155.0858 3400.0 157.1008 44000.0 159.0806 5500.0 159.1166 35000.0 161.096 15000.0 161.1321 22000.0 163.1116 31000.0 165.0908 170000.0 167.1065 28000.0 169.1008 19000.0 171.1166 40000.0 173.0961 9000.0 173.132 20000.0 173.5262 44000.0 173.5354 48000.0 173.5463 9200.0 175.1478 4000.0 177.0911 3400.0 177.1276 5700.0 179.143 4600.0 181.1221 18000.0 183.1166 28000.0 185.1326 25000.0 187.1113 7300.0 187.1485 3800.0 189.1273 20000.0 191.106 3600.0 193.0326 2200.0 195.1169 14000.0 195.1371 5500.0 196.1244 4500.0 197.1321 24000.0 199.112 3000.0 199.1483 6100.0 203.143 77000.0 207.1169 7100.0 207.1377 17000.0 208.1247 2900.0 209.1331 20000.0 211.1481 20000.0 212.3659 2500.0 213.1275 3500.0 215.1434 5600.0 221.1317 8400.0 221.1536 180000.0 223.1486 13000.0 225.1268 3800.0 225.162 3400.0 229.1593 3100.0 231.1388 2800.0 233.154 17000.0 234.1598 9600.0 235.1482 7600.0 237.1638 6200.0 247.1693 35000.0 249.165 2600.0 249.9474 2300.0 251.1789 7700.0 267.1744 2700.0 269.1892 2800.0 273.1861 3400.0 285.1862 10000.0 286.1937 21000.0 287.2012 26000.0 299.2007 18000.0 304.6459 2500.0 311.1998 4200.0 313.2174 8300.0 327.2304 3600.0 367.595 2500.0 404.7153 3200.0 413.2701 2600.0 419.2967 3400.0 427.2845 6800.0 434.6273 2800.0 507.3462 14000.0 562.8354 2700.0 599.4084 7000.0 END IONS BEGIN IONS SCANS=831 PEPMASS=434.2819 CHARGE=1 COLLISION_ENERGY=0.0 57.0697 9900.0 59.0489 3200.0 63.2782 2400.0 64.9456 2700.0 78.9056 2200.0 79.0539 2800.0 81.0695 15000.0 85.0645 7500.0 86.7228 2300.0 91.0542 2700.0 93.0696 15000.0 95.0489 4300.0 95.0852 10000.0 97.0648 3500.0 105.0626 2800.0 105.0695 58000.0 107.0851 13000.0 109.0644 41000.0 111.0802 3000.0 115.698 2600.0 117.0694 3200.0 119.0851 63000.0 121.0646 5400.0 121.1009 16000.0 123.08 16000.0 125.0594 6800.0 131.0854 16000.0 133.0639 2600.0 133.1007 26000.0 135.08 24000.0 135.1165 3500.0 137.0956 14000.0 143.0851 20000.0 145.1008 32000.0 147.0801 46000.0 147.1163 3400.0 148.1039 2400.0 149.0958 19000.0 149.6843 4200.0 150.9865 2400.0 151.0749 22000.0 155.0846 11000.0 157.1008 29000.0 159.0802 7900.0 159.1166 20000.0 161.0959 19000.0 161.1326 9300.0 163.1118 13000.0 165.0908 100000.0 169.1009 18000.0 170.1085 5400.0 171.1166 26000.0 173.0961 14000.0 173.1329 11000.0 173.5314 20000.0 175.1117 20000.0 177.0908 11000.0 180.1136 2500.0 181.1009 9000.0 182.1087 2900.0 183.1167 59000.0 185.0964 3300.0 185.1322 11000.0 187.1116 13000.0 187.1489 6600.0 189.1272 17000.0 189.6381 2400.0 190.1352 14000.0 191.1067 18000.0 193.1027 5000.0 193.1219 12000.0 194.1062 2500.0 195.1164 14000.0 196.1246 6900.0 197.1327 15000.0 199.112 13000.0 200.1189 3600.0 201.127 12000.0 203.143 40000.0 207.1174 8000.0 207.138 15000.0 209.1324 15000.0 211.112 8900.0 211.1482 27000.0 213.1277 13000.0 215.1434 4400.0 219.1384 16000.0 221.1328 4400.0 221.1536 49000.0 223.1479 5800.0 225.1262 3900.0 225.1638 13000.0 229.1237 2700.0 229.159 7100.0 230.1304 9800.0 231.1381 2900.0 233.1537 3700.0 234.1609 3600.0 235.1473 8000.0 237.1283 3000.0 239.142 3100.0 243.1376 9600.0 247.1449 3900.0 247.169 11000.0 253.1595 7300.0 259.1718 2700.0 268.1821 8400.0 271.1692 12000.0 275.1788 3200.0 279.1759 2800.0 281.1886 3400.0 285.1869 3200.0 286.1931 41000.0 287.2023 6300.0 299.201 16000.0 311.1982 3400.0 312.2076 6600.0 313.2159 9900.0 335.2 7200.0 354.2204 3600.0 355.227 13000.0 373.2541 3100.0 391.08 2600.0 391.2632 32000.0 419.2607 4400.0 END IONS BEGIN IONS SCANS=832 PEPMASS=435.2887 CHARGE=1 COLLISION_ENERGY=0.0 57.0697 4100.0 57.2699 2600.0 64.3367 2400.0 69.0696 3300.0 79.054 4500.0 81.0696 8800.0 85.0644 3600.0 89.0595 4400.0 91.0541 3100.0 93.0696 16000.0 95.0489 5200.0 95.0852 14000.0 105.0695 19000.0 107.0852 11000.0 109.0562 5600.0 109.0644 130000.0 109.1004 2900.0 111.0802 4700.0 117.069 2700.0 119.0851 21000.0 120.089 3600.0 121.065 3300.0 121.101 8600.0 123.08 11000.0 125.0585 2900.0 131.0853 12000.0 133.101 12000.0 135.0801 13000.0 135.1167 2600.0 137.0959 5900.0 143.0853 9000.0 145.1008 14000.0 147.0799 15000.0 147.1166 4800.0 149.0958 6800.0 151.075 29000.0 155.0851 3200.0 156.0925 3300.0 157.1007 16000.0 159.0801 3100.0 159.1168 8300.0 161.0955 8200.0 161.1327 3400.0 162.1009 2600.0 163.1114 4700.0 165.0908 25000.0 166.0945 9200.0 169.101 15000.0 171.1171 9500.0 173.0961 5000.0 173.1321 4000.0 173.5345 17000.0 175.1117 5600.0 177.0915 5100.0 181.1017 6200.0 182.1076 4000.0 183.1168 16000.0 184.1199 5700.0 185.1325 5600.0 187.1113 4900.0 189.1275 11000.0 193.102 2700.0 195.1167 8600.0 197.1319 11000.0 199.1115 3600.0 201.1269 6400.0 203.1432 11000.0 204.1459 2900.0 207.1181 4100.0 207.1379 9200.0 209.1321 5600.0 211.1479 5300.0 212.1537 6200.0 213.1265 4500.0 213.1625 3500.0 221.154 6700.0 227.1447 2800.0 229.1221 3800.0 230.1274 3800.0 231.1351 2500.0 271.1693 4200.0 286.1929 9000.0 287.1994 3700.0 309.1896 2600.0 312.2071 4100.0 392.2677 5300.0 409.642 2400.0 433.702 2400.0 END IONS BEGIN IONS SCANS=833 PEPMASS=583.4152 CHARGE=1 COLLISION_ENERGY=0.0 67.054 14000.0 69.0333 7800.0 69.0696 21000.0 71.0488 3200.0 71.9163 2300.0 78.1092 2200.0 78.6824 2100.0 79.0539 23000.0 79.8012 2500.0 81.0695 75000.0 83.0489 13000.0 83.0852 15000.0 85.1637 2500.0 91.0539 22000.0 93.0695 89000.0 93.2831 2700.0 95.0489 27000.0 95.0852 58000.0 96.8465 2600.0 97.0647 17000.0 104.3244 2300.0 105.0695 98000.0 107.0852 87000.0 109.0646 15000.0 109.1008 73000.0 111.0802 13000.0 112.6975 2500.0 114.3824 2600.0 117.0697 5200.0 119.0852 130000.0 121.0648 7400.0 121.1008 140000.0 123.0802 29000.0 123.1165 20000.0 123.9729 2400.0 125.0591 13000.0 129.0699 5400.0 131.0852 51000.0 133.1009 99000.0 135.0801 23000.0 135.1165 47000.0 137.0595 2600.0 137.0957 41000.0 139.0754 14000.0 139.1115 18000.0 143.0854 41000.0 144.0926 12000.0 145.0888 3800.0 145.1009 160000.0 147.0802 30000.0 147.1165 84000.0 149.0959 18000.0 149.132 5900.0 151.0752 51000.0 151.1115 12000.0 153.091 5300.0 155.0852 6700.0 156.0933 7000.0 157.1009 85000.0 158.1077 5700.0 159.0804 11000.0 159.1167 71000.0 161.096 23000.0 161.1322 26000.0 163.1114 39000.0 165.0908 120000.0 167.1063 3800.0 169.1012 56000.0 170.1088 6000.0 171.1167 64000.0 173.0964 13000.0 173.1323 65000.0 173.5221 21000.0 173.5322 11000.0 173.5407 35000.0 175.1121 14000.0 175.1483 25000.0 177.0905 5400.0 177.1273 9000.0 179.1058 2300.0 181.1009 17000.0 181.1218 13000.0 183.1169 44000.0 184.1237 5600.0 185.0961 3200.0 185.1325 39000.0 187.112 9000.0 187.1481 19000.0 189.1274 26000.0 191.1065 5900.0 191.1431 16000.0 194.1085 2400.0 195.1169 34000.0 196.1245 13000.0 197.1325 54000.0 199.1115 6900.0 199.1481 20000.0 201.1276 12000.0 201.1631 5600.0 203.143 51000.0 203.4109 2300.0 205.1244 2700.0 207.1175 15000.0 207.1382 42000.0 208.1258 2600.0 209.1324 53000.0 211.1133 9600.0 211.1483 48000.0 213.1268 7000.0 213.1642 3400.0 215.1061 2500.0 215.1438 3900.0 220.1248 2600.0 221.1324 15000.0 221.1537 94000.0 222.1411 3000.0 223.1134 3000.0 223.1481 27000.0 224.1195 2900.0 225.1278 6400.0 225.164 17000.0 227.1432 14000.0 227.1799 3100.0 229.1223 7200.0 231.1375 3400.0 233.1545 13000.0 235.1477 26000.0 237.1266 7400.0 237.1635 32000.0 239.1425 2600.0 247.1456 9000.0 247.1708 14000.0 249.1636 7000.0 251.1792 2700.0 255.1727 2600.0 261.1589 3400.0 261.1866 17000.0 263.1815 3400.0 265.1598 3900.0 265.195 7900.0 269.1896 6100.0 281.2943 3600.0 282.2793 41000.0 283.2827 38000.0 285.1846 25000.0 286.1939 10000.0 287.2012 26000.0 291.2105 3100.0 299.2022 13000.0 299.3063 12000.0 300.3084 3100.0 311.2016 11000.0 329.226 2400.0 335.2396 3100.0 337.2159 3200.0 340.781 2400.0 349.2162 10000.0 351.2299 4200.0 352.2393 6200.0 353.2478 57000.0 361.2648 2600.0 364.2404 24000.0 434.214 2900.0 436.527 2400.0 454.9714 2500.0 473.338 7700.0 491.3521 140000.0 504.3631 3000.0 583.4136 27000.0 END IONS BEGIN IONS SCANS=834 PEPMASS=584.4223 CHARGE=1 COLLISION_ENERGY=0.0 63.9463 2200.0 66.8634 2400.0 68.19 2300.0 69.3535 2300.0 69.9257 2600.0 71.0853 6000.0 72.2838 2700.0 73.0281 16000.0 75.5541 2500.0 75.6593 2900.0 81.0697 18000.0 87.0438 14000.0 88.9407 2500.0 89.0593 230000.0 89.4778 2200.0 91.0537 2300.0 91.7122 2800.0 92.7732 2100.0 93.0695 25000.0 95.0492 5600.0 95.0852 12000.0 97.5029 2300.0 101.3897 2300.0 105.0696 27000.0 107.085 21000.0 109.1009 14000.0 111.3318 2100.0 114.0829 2500.0 119.0853 46000.0 121.1009 25000.0 123.0802 12000.0 126.6077 2400.0 127.5037 2600.0 130.5206 2500.0 131.0851 11000.0 133.0856 140000.0 133.1004 34000.0 135.0801 7600.0 135.1168 9400.0 137.0956 2600.0 143.0852 19000.0 145.1009 61000.0 147.0803 9500.0 147.1165 20000.0 157.1008 39000.0 158.1091 11000.0 159.1168 27000.0 163.112 6500.0 165.091 43000.0 169.1016 6500.0 171.1168 25000.0 173.1323 20000.0 173.5238 32000.0 173.5398 55000.0 175.1118 3300.0 175.1488 7900.0 177.1118 18000.0 177.1287 2400.0 177.2065 2500.0 181.101 3000.0 183.1175 17000.0 185.1324 14000.0 191.1435 2400.0 193.1235 3000.0 197.1322 19000.0 203.1425 18000.0 207.1386 3300.0 209.1324 6200.0 210.4134 2500.0 211.1486 10000.0 213.1619 3100.0 221.1327 3000.0 221.154 43000.0 223.1481 7500.0 227.4021 2500.0 237.165 3300.0 257.1877 2800.0 259.1685 11000.0 265.1004 2600.0 266.2031 2600.0 287.2008 16000.0 332.3561 2800.0 337.2158 9500.0 352.2395 22000.0 353.2487 3800.0 365.2488 9300.0 385.9086 3300.0 395.0779 3000.0 504.3602 3300.0 539.1588 2600.0 559.4808 2500.0 END IONS BEGIN IONS SCANS=835 PEPMASS=613.266 CHARGE=1 COLLISION_ENERGY=0.0 64.9587 2700.0 66.0712 2100.0 67.0542 3900.0 68.9192 2200.0 70.5176 2200.0 73.028 15000.0 78.909 2200.0 79.0541 4500.0 81.0695 11000.0 83.0859 2500.0 89.0593 13000.0 93.0695 10000.0 93.2791 2500.0 95.0851 10000.0 96.0886 2700.0 99.1442 2600.0 100.3145 2500.0 105.0696 9600.0 107.0854 14000.0 109.101 12000.0 115.8543 2300.0 119.0853 22000.0 121.1012 14000.0 123.1169 2500.0 126.0751 2400.0 126.2021 2400.0 131.085 5500.0 133.1008 14000.0 134.1046 2500.0 135.1161 2900.0 143.0851 3000.0 145.1009 17000.0 146.1036 2700.0 147.1164 11000.0 148.1202 2800.0 149.6823 3200.0 149.6925 5200.0 149.7034 3500.0 157.1014 12000.0 159.1174 2500.0 160.1182 3400.0 166.5043 2500.0 171.1168 2800.0 172.1222 3200.0 173.1326 3800.0 173.5263 36000.0 173.5417 17000.0 185.1322 9700.0 195.1157 2700.0 197.133 3400.0 211.1504 3000.0 225.8105 3000.0 251.1183 2900.0 259.0667 3100.0 260.2082 2700.0 279.1494 39000.0 345.9432 2600.0 354.1831 2400.0 358.1925 14000.0 369.2072 63000.0 370.2148 4900.0 377.2006 2400.0 379.1929 5900.0 397.2028 46000.0 398.2109 12000.0 407.2238 5500.0 408.2283 8900.0 409.2029 3000.0 410.1678 2800.0 421.2026 7600.0 423.2213 11000.0 424.2296 7400.0 425.1289 6400.0 425.1449 7500.0 425.198 560000.0 426.2048 8000.0 433.2044 7000.0 435.2163 24000.0 436.2235 3700.0 437.1982 58000.0 438.2029 36000.0 439.2137 9000.0 440.2337 7000.0 441.19 4900.0 442.2399 3000.0 448.1902 31000.0 450.2037 15000.0 451.2127 480000.0 452.219 170000.0 453.1958 34000.0 453.2224 58000.0 458.2441 35000.0 461.1978 67000.0 462.131 2300.0 462.2052 200000.0 462.2801 2800.0 463.2129 48000.0 465.191 14000.0 467.2424 6100.0 469.2588 20000.0 470.2663 73000.0 476.1851 32000.0 479.2103 48000.0 480.2161 71000.0 481.254 52000.0 482.2578 13000.0 483.2405 18000.0 487.1495 2900.0 489.1928 52000.0 491.2093 21000.0 495.2389 16000.0 496.2103 13000.0 497.2507 73000.0 498.2622 300000.0 506.1936 11000.0 507.207 37000.0 508.2236 7100.0 509.2499 77000.0 510.2271 25000.0 511.2334 78000.0 512.2006 28000.0 521.2183 13000.0 522.2251 17000.0 524.2409 43000.0 525.2492 230000.0 526.2577 1500000.0 535.234 110000.0 536.2295 4400.0 537.2318 4900.0 537.2438 11000.0 538.2172 3500.0 539.2293 13000.0 540.246 9800.0 541.2773 3100.0 549.2203 5200.0 552.2373 6600.0 553.2449 1000000.0 554.2484 34000.0 557.2769 6600.0 567.2442 7100.0 567.2558 14000.0 568.2288 21000.0 568.246 5500.0 569.2762 36000.0 570.257 4700.0 580.2159 11000.0 581.2226 8000.0 585.2679 15000.0 595.2561 38000.0 596.2395 110000.0 598.2447 7300.0 613.2663 98000.0 END IONS BEGIN IONS SCANS=836 PEPMASS=870.5658 CHARGE=1 COLLISION_ENERGY=0.0 81.2567 2100.0 85.3848 2500.0 120.9391 3200.0 127.7096 2800.0 146.2695 2500.0 172.9718 2600.0 173.5197 8700.0 173.5376 55000.0 274.3145 2400.0 299.8331 2800.0 449.23 2800.0 459.2176 200000.0 460.2252 90000.0 461.2329 17000.0 464.3071 2300.0 473.2267 3800.0 485.2296 4100.0 486.2408 5400.0 487.2202 7800.0 488.258 5500.0 491.2437 22000.0 492.2515 79000.0 500.9707 2500.0 503.2443 29000.0 505.2237 37000.0 515.246 4500.0 516.2511 23000.0 517.2229 8100.0 518.2323 3900.0 519.2384 230000.0 520.2468 52000.0 531.2383 300000.0 532.2459 37000.0 533.1176 3700.0 533.2541 270000.0 534.2632 3500.0 547.2737 4600.0 548.2782 24000.0 549.252 9700.0 559.2321 14000.0 560.2405 49000.0 564.2681 6800.0 577.2441 36000.0 591.2599 150000.0 592.1581 4700.0 592.2672 400000.0 593.2749 29000.0 855.5472 3200.0 870.5647 28000.0 END IONS BEGIN IONS SCANS=837 PEPMASS=871.5729 CHARGE=1 COLLISION_ENERGY=0.0 78.6525 3100.0 82.249 3400.0 82.5761 2300.0 82.688 2400.0 83.0852 16000.0 84.6086 2600.0 85.1009 3200.0 85.9178 2600.0 88.9329 2400.0 89.0945 2500.0 89.2446 2800.0 89.356 2600.0 90.4627 2300.0 96.0311 2700.0 96.5366 2300.0 96.8458 2500.0 97.1008 4500.0 109.5882 2200.0 111.9992 2300.0 127.2768 2300.0 128.2437 2700.0 128.3452 2300.0 130.2389 2500.0 133.3081 2600.0 141.2296 2400.0 145.079 2900.0 148.3129 18000.0 148.3248 14000.0 153.3868 2500.0 153.4191 2500.0 156.3845 2400.0 165.0892 2400.0 173.5233 22000.0 173.5332 100000.0 173.5421 22000.0 181.1579 2500.0 192.3922 2200.0 203.4464 2900.0 210.9773 2800.0 216.8087 2600.0 230.3023 2900.0 230.7472 3200.0 237.5133 2900.0 263.7076 2600.0 320.7367 2800.0 334.3294 2800.0 342.5092 2400.0 362.3214 2400.0 415.1957 2300.0 420.4778 2300.0 431.1794 2900.0 437.606 2300.0 447.2169 2500.0 459.218 470000.0 460.2237 350000.0 460.2925 3400.0 461.2314 160000.0 462.2409 16000.0 471.3392 2600.0 473.2338 36000.0 474.2383 2600.0 476.2559 8800.0 477.2689 3900.0 487.2476 36000.0 488.2231 3000.0 488.2526 4900.0 489.2592 8800.0 489.266 2400.0 491.2435 71000.0 492.2514 160000.0 493.2543 62000.0 503.2411 8500.0 504.2479 25000.0 505.2243 95000.0 506.224 22000.0 515.2443 24000.0 516.2499 23000.0 517.244 43000.0 518.2309 21000.0 519.2386 310000.0 520.244 320000.0 521.2501 59000.0 531.2387 170000.0 531.3273 4500.0 532.2437 380000.0 533.0666 26000.0 533.2543 5200000.0 534.2574 230000.0 547.2713 20000.0 548.2758 37000.0 549.2621 15000.0 549.2763 7500.0 560.2414 120000.0 561.2473 120000.0 562.2188 4100.0 564.247 41000.0 565.2805 94000.0 575.2643 41000.0 577.2443 91000.0 578.2498 43000.0 591.2605 86000.0 592.0458 7100.0 592.2676 3500000.0 592.3795 6200.0 593.0536 32000.0 593.0972 11000.0 593.2752 7500000.0 593.4517 12000.0 593.4994 23000.0 594.277 27000.0 612.0107 3400.0 615.9713 3200.0 753.1719 2900.0 778.7983 3000.0 788.9424 2700.0 811.5292 6300.0 811.5495 3500.0 871.57 250000.0 871.7482 2500.0 878.252 2700.0 END IONS BEGIN IONS SCANS=838 PEPMASS=806.5417 CHARGE=1 COLLISION_ENERGY=0.0 73.0167 2400.0 77.0385 3100.0 79.0539 200000.0 81.0336 2800.0 81.0697 510000.0 83.049 39000.0 83.0854 82000.0 85.0647 28000.0 85.6263 2100.0 86.0959 2600.0 91.0541 230000.0 93.0697 290000.0 93.5541 2200.0 95.0127 18000.0 95.0489 36000.0 95.0854 380000.0 95.1852 2800.0 97.0646 220000.0 97.101 54000.0 97.74 2200.0 98.3402 2000.0 99.044 7400.0 99.0804 19000.0 101.0594 2900.0 103.0534 2700.0 105.0617 4700.0 105.0697 470000.0 105.0782 2600.0 107.049 59000.0 107.0853 200000.0 109.0647 54000.0 109.101 180000.0 109.2822 2200.0 110.5425 2300.0 111.0804 27000.0 111.1169 5400.0 113.0593 4200.0 113.096 5200.0 117.0697 76000.0 119.0476 2500.0 119.0755 3300.0 119.0854 360000.0 121.065 10000.0 121.101 210000.0 123.0441 3600.0 123.0803 42000.0 123.1167 68000.0 124.9887 2300.0 125.0961 30000.0 126.8236 2200.0 127.0758 3200.0 127.3204 2400.0 129.0698 17000.0 131.0854 230000.0 132.0218 2200.0 133.0655 3000.0 133.0924 2200.0 133.101 540000.0 133.1127 9000.0 135.0801 41000.0 135.1167 160000.0 137.096 43000.0 137.1327 16000.0 139.0751 16000.0 139.112 2800.0 141.0702 11000.0 143.0856 25000.0 145.065 8800.0 145.1011 240000.0 147.0809 4300.0 147.1167 260000.0 149.0959 92000.0 149.1323 110000.0 151.0746 3200.0 151.1114 25000.0 153.1271 9400.0 155.0854 16000.0 157.101 39000.0 158.6959 2700.0 159.1167 180000.0 161.0966 6700.0 161.118 4600.0 161.1325 110000.0 163.1117 43000.0 163.1477 32000.0 165.0907 26000.0 165.1275 15000.0 169.1017 26000.0 171.1169 45000.0 173.1326 89000.0 173.5238 86000.0 173.5413 90000.0 175.1121 12000.0 175.1482 30000.0 177.1276 55000.0 179.1251 2700.0 179.143 250000.0 179.8498 2300.0 180.1165 2600.0 183.1171 36000.0 184.0737 5300.0 185.1329 34000.0 187.1118 43000.0 187.1483 24000.0 189.1641 3600.0 191.1443 6800.0 191.482 2700.0 193.1225 8800.0 195.1382 10000.0 197.1322 30000.0 201.1279 2900.0 201.1638 40000.0 203.1435 12000.0 205.122 22000.0 207.1368 5900.0 209.1533 6900.0 211.148 7100.0 215.1434 2500.0 219.1377 7000.0 219.149 8100.0 219.1744 750000.0 219.1998 11000.0 223.1327 18000.0 229.1949 34000.0 233.1534 8300.0 239.1796 35000.0 243.21 9800.0 247.1717 6400.0 247.2052 60000.0 257.1898 110000.0 261.2211 48000.0 264.2108 3000.0 275.1658 5400.0 275.2008 940000.0 275.2264 2300.0 275.2361 4000.0 279.16 14000.0 285.549 2900.0 293.2108 27000.0 321.1307 2800.0 333.9424 2600.0 334.0114 2600.0 335.2582 1200000.0 349.2369 150000.0 371.7031 2700.0 443.9252 2400.0 481.0618 2500.0 515.559 2700.0 587.6212 2800.0 609.4503 220000.0 625.9579 2400.0 END IONS BEGIN IONS SCANS=839 PEPMASS=811.4971 CHARGE=1 COLLISION_ENERGY=0.0 73.028 28000.0 74.2056 2200.0 77.5314 2300.0 79.054 26000.0 79.3556 2400.0 81.0332 5500.0 81.0694 62000.0 82.2096 2700.0 83.0852 3000.0 85.0279 67000.0 87.0435 2400.0 90.1647 82000.0 90.1699 14000.0 90.2569 2300.0 91.0386 52000.0 91.0536 15000.0 91.0842 2600.0 93.0695 39000.0 95.0849 54000.0 97.0279 57000.0 97.0643 2600.0 97.1014 2500.0 98.2243 2500.0 99.0437 8300.0 101.0229 21000.0 105.0696 19000.0 107.0851 24000.0 109.0278 5500.0 109.1007 29000.0 115.0388 3400.0 115.5076 2700.0 115.5628 2700.0 117.0689 2800.0 118.7051 2400.0 119.0849 29000.0 121.1009 27000.0 123.1162 4200.0 124.6458 2300.0 125.1672 2400.0 127.0384 38000.0 131.0853 17000.0 133.1006 24000.0 135.1165 21000.0 142.1965 3000.0 142.9826 2400.0 145.0492 3900.0 145.1003 12000.0 147.1164 8000.0 149.0956 5500.0 149.1325 5400.0 151.4683 2700.0 152.7172 2500.0 159.1165 5500.0 161.1323 13000.0 162.1763 2500.0 173.1325 2800.0 173.5236 69000.0 173.5395 140000.0 177.87 2400.0 179.1423 16000.0 183.1169 2300.0 184.0728 15000.0 185.0417 41000.0 187.1461 2800.0 201.0742 2700.0 202.8868 2400.0 203.0526 11000.0 219.174 24000.0 221.2047 2600.0 223.2639 2200.0 241.0676 2900.0 243.0836 91000.0 259.6677 2400.0 261.2212 21000.0 269.7774 2400.0 275.2002 34000.0 285.1814 2800.0 301.2135 5000.0 315.1928 610000.0 334.0689 2300.0 335.2579 89000.0 335.2991 2700.0 336.4156 2400.0 349.239 3400.0 371.2189 55000.0 378.2071 2600.0 380.2767 2200.0 383.3644 2800.0 465.6983 2300.0 469.3661 2900.0 477.2029 2400.0 497.3159 7100.0 519.1146 3700.0 519.1984 5000.0 519.2241 11000.0 519.2924 1700000.0 521.8826 2800.0 533.1769 13000.0 533.2715 1200000.0 533.3667 8800.0 546.1979 2400.0 572.4286 2700.0 617.3507 2700.0 631.4348 31000.0 649.3344 2400.0 649.4444 97000.0 670.7371 2300.0 697.999 2600.0 767.282 2300.0 811.4954 2200000.0 811.6308 4100.0 END IONS BEGIN IONS SCANS=840 PEPMASS=789.5152 CHARGE=1 COLLISION_ENERGY=0.0 71.4054 2300.0 76.2854 2400.0 77.3838 2200.0 79.0539 38000.0 79.136 2200.0 80.71 2500.0 81.0695 100000.0 83.0487 6500.0 83.0853 15000.0 84.3345 2400.0 86.8329 2300.0 90.8822 2400.0 91.0539 48000.0 92.0596 2500.0 93.0695 70000.0 95.0126 3400.0 95.0851 78000.0 97.0644 47000.0 97.1012 3000.0 105.0695 92000.0 105.3429 2300.0 107.049 11000.0 107.0852 47000.0 109.0648 7300.0 109.1008 36000.0 111.0801 2400.0 117.0697 17000.0 119.0852 68000.0 121.1008 48000.0 123.08 2800.0 123.1166 9600.0 131.0852 36000.0 133.1009 110000.0 135.0803 3700.0 135.1164 32000.0 137.0963 2700.0 137.1319 2900.0 143.0861 3100.0 145.1008 41000.0 147.1164 57000.0 149.0953 15000.0 149.1322 17000.0 159.1165 30000.0 161.1325 18000.0 162.5415 2300.0 163.1117 4800.0 165.0902 3100.0 169.101 3000.0 171.1164 3000.0 173.0429 2300.0 173.1329 12000.0 173.5222 49000.0 173.5393 94000.0 173.5441 9100.0 175.1478 3400.0 177.1271 7800.0 179.1428 38000.0 180.7399 2500.0 182.2946 2400.0 183.1165 2600.0 184.0723 5700.0 185.4917 2500.0 187.1115 3900.0 205.1208 3200.0 211.7893 2400.0 213.6046 2300.0 217.4867 2300.0 219.1742 100000.0 232.3289 2600.0 246.3853 2200.0 246.9475 2700.0 247.2056 8100.0 257.1899 7900.0 259.1255 2200.0 261.2211 3000.0 263.9665 2400.0 275.2006 120000.0 283.6164 2300.0 298.6985 2500.0 309.0251 2300.0 315.9683 2500.0 319.0833 2800.0 333.1981 2600.0 335.2583 140000.0 345.38 2500.0 349.2381 15000.0 566.288 4100.0 609.4527 7200.0 693.9716 3000.0 706.5137 2500.0 750.8487 2800.0 END IONS BEGIN IONS SCANS=841 PEPMASS=568.4265 CHARGE=1 COLLISION_ENERGY=0.0 62.5747 3200.0 67.0539 80000.0 69.0332 16000.0 69.0696 100000.0 71.049 18000.0 71.0859 6000.0 73.028 9900.0 74.5578 3700.0 75.7032 3300.0 79.0539 110000.0 80.0619 15000.0 81.0696 350000.0 82.0729 31000.0 83.0489 49000.0 83.0852 52000.0 85.0645 32000.0 86.4591 3500.0 89.0592 5400.0 91.054 130000.0 92.0619 3800.0 93.0695 460000.0 94.0728 34000.0 95.0488 180000.0 95.0852 280000.0 96.0885 22000.0 97.0645 47000.0 97.1012 10000.0 103.0543 8100.0 104.3747 4000.0 105.0444 12000.0 105.0696 520000.0 106.0731 54000.0 106.59 6200.0 107.0852 440000.0 108.0881 29000.0 109.0645 44000.0 109.1009 290000.0 110.1045 32000.0 111.0802 56000.0 116.6631 3400.0 117.0697 69000.0 118.0778 20000.0 119.0757 18000.0 119.0853 920000.0 119.0944 14000.0 120.0902 67000.0 121.0644 9200.0 121.0911 4600.0 121.1009 490000.0 122.0728 6900.0 122.1045 63000.0 123.0802 130000.0 123.1166 78000.0 124.12 13000.0 125.0958 36000.0 128.0622 15000.0 129.0698 50000.0 130.0772 14000.0 131.0748 9500.0 131.0853 320000.0 132.0928 100000.0 133.101 630000.0 133.1127 14000.0 134.1052 76000.0 135.0802 65000.0 135.1167 240000.0 136.1202 35000.0 137.0959 120000.0 138.1031 35000.0 139.1116 35000.0 141.0689 12000.0 142.0779 37000.0 143.0854 280000.0 144.0927 99000.0 145.1011 910000.0 145.1143 16000.0 146.1061 100000.0 147.0803 33000.0 147.1167 380000.0 148.1203 59000.0 148.5787 4400.0 149.096 79000.0 149.1323 48000.0 151.1117 54000.0 151.149 9900.0 155.0854 77000.0 156.0931 79000.0 157.1011 490000.0 158.1075 120000.0 159.0806 17000.0 159.1168 430000.0 160.1215 61000.0 160.771 6400.0 161.096 79000.0 161.1324 100000.0 163.1117 42000.0 163.1478 20000.0 165.0915 6900.0 167.0855 23000.0 168.6966 3500.0 169.1013 230000.0 170.1076 75000.0 171.1169 390000.0 171.1331 13000.0 172.1227 73000.0 173.0963 32000.0 173.1327 350000.0 173.5272 63000.0 173.5378 70000.0 174.1373 34000.0 175.1115 21000.0 175.1483 250000.0 176.152 12000.0 177.1273 62000.0 179.085 20000.0 181.1014 97000.0 182.1084 55000.0 183.117 280000.0 184.1232 55000.0 185.0945 6900.0 185.1327 290000.0 186.1392 81000.0 187.1126 11000.0 187.1483 170000.0 188.1522 22000.0 189.1277 48000.0 189.164 5700.0 191.1433 110000.0 192.1482 7300.0 193.1011 50000.0 194.1089 51000.0 195.117 190000.0 196.1238 95000.0 197.1325 330000.0 197.1528 5000.0 198.1384 82000.0 199.1122 9400.0 199.1483 170000.0 200.1537 34000.0 201.1277 46000.0 201.1639 92000.0 203.1435 44000.0 205.1595 9500.0 206.1102 4100.0 207.117 95000.0 208.1241 51000.0 209.1328 300000.0 210.1385 53000.0 211.1486 250000.0 212.1536 53000.0 213.1281 20000.0 213.1643 62000.0 215.1441 17000.0 217.1593 57000.0 219.1175 12000.0 220.1251 14000.0 221.1329 110000.0 221.1519 6400.0 222.1388 38000.0 223.1487 160000.0 224.1549 60000.0 225.1641 85000.0 226.1701 18000.0 227.1442 5900.0 227.1799 15000.0 229.1584 20000.0 231.1744 24000.0 233.1323 29000.0 234.1378 21000.0 235.1484 90000.0 236.154 30000.0 236.1965 4400.0 237.1641 96000.0 238.1709 19000.0 239.1798 74000.0 241.1959 40000.0 243.175 7700.0 246.1404 12000.0 247.1482 42000.0 248.1538 26000.0 249.164 72000.0 250.1684 21000.0 251.1792 51000.0 252.1856 15000.0 253.1946 31000.0 255.174 28000.0 257.1903 26000.0 259.149 12000.0 259.2045 20000.0 260.1552 4700.0 261.1642 38000.0 262.1707 19000.0 263.18 54000.0 264.1842 14000.0 265.1955 57000.0 267.2111 25000.0 269.1906 6500.0 270.1972 3900.0 271.2057 12000.0 273.1623 6500.0 275.1788 28000.0 276.1857 11000.0 277.1957 49000.0 278.2028 15000.0 279.2109 25000.0 281.1907 20000.0 283.2067 34000.0 285.222 19000.0 287.1787 14000.0 291.2114 20000.0 295.207 4400.0 296.2136 6000.0 297.2223 18000.0 303.2139 7400.0 305.2277 27000.0 323.2383 60000.0 331.2423 4100.0 335.238 6400.0 338.2615 46000.0 347.2301 4300.0 349.2517 12000.0 351.2702 8500.0 378.5384 6600.0 415.3034 16000.0 430.3262 12000.0 454.1918 6600.0 473.2769 4200.0 547.12 4000.0 564.4832 7500.0 END IONS BEGIN IONS SCANS=842 PEPMASS=585.4275 CHARGE=1 COLLISION_ENERGY=0.0 67.054 3300.0 69.0698 5600.0 73.5641 2200.0 79.0542 5400.0 81.0697 14000.0 83.0487 3300.0 83.0854 3200.0 87.0436 2800.0 89.0596 11000.0 91.0541 6100.0 93.0697 20000.0 94.0727 3200.0 95.0489 3800.0 95.0853 8800.0 95.425 2500.0 97.0651 5200.0 105.0697 19000.0 107.0853 18000.0 109.1009 14000.0 109.1083 2200.0 117.0697 3500.0 119.0854 26000.0 120.089 6600.0 121.1009 24000.0 123.0803 11000.0 131.0853 10000.0 133.0854 3300.0 133.101 20000.0 134.105 3800.0 135.117 8600.0 137.0962 2900.0 139.1118 4100.0 143.0853 11000.0 144.0925 4100.0 145.101 34000.0 146.1049 6400.0 147.1167 13000.0 149.0957 4400.0 154.6168 2400.0 157.101 17000.0 158.1058 5600.0 159.1166 18000.0 160.0876 6300.0 161.0922 3000.0 161.1325 3100.0 167.1067 16000.0 169.1013 6100.0 170.1064 2400.0 171.1167 11000.0 171.5995 2500.0 172.1222 3500.0 173.1326 8400.0 173.5329 26000.0 175.149 5700.0 181.1014 2500.0 183.1166 5500.0 184.1206 2500.0 185.1326 8200.0 186.1359 3100.0 187.1484 5100.0 191.1428 3100.0 195.1165 6300.0 196.125 3100.0 197.1323 12000.0 199.1478 5900.0 207.1171 3500.0 209.1321 8000.0 211.1477 7700.0 221.1325 2800.0 221.1547 2700.0 223.1471 5100.0 225.1635 3100.0 226.1688 2700.0 509.043 2900.0 533.9009 2500.0 END IONS BEGIN IONS SCANS=843 PEPMASS=583.4152 CHARGE=1 COLLISION_ENERGY=0.0 65.0384 8000.0 67.0541 72000.0 68.1375 2200.0 69.0334 48000.0 69.0697 82000.0 71.0489 48000.0 74.0557 2300.0 76.9073 2900.0 77.0388 8300.0 79.0494 3100.0 79.0541 110000.0 81.0697 340000.0 83.0489 73000.0 83.0853 170000.0 85.008 3100.0 85.0286 6900.0 85.0646 25000.0 87.044 13000.0 91.0541 120000.0 93.0697 400000.0 95.049 97000.0 95.0853 310000.0 95.0925 2400.0 97.0647 280000.0 97.1011 12000.0 101.0596 2500.0 103.0545 7700.0 104.0614 4600.0 105.044 2700.0 105.0697 650000.0 105.0761 4000.0 107.0491 7700.0 107.0854 410000.0 109.0646 56000.0 109.101 260000.0 111.0803 60000.0 113.096 160000.0 115.0541 10000.0 117.0697 47000.0 119.0487 2500.0 119.0756 5800.0 119.0854 640000.0 119.0926 4400.0 119.0954 5200.0 120.0937 5500.0 121.0646 45000.0 121.101 510000.0 121.1086 2600.0 123.0803 140000.0 123.1166 70000.0 125.0596 14000.0 125.096 100000.0 128.0623 4200.0 129.0697 30000.0 130.0775 9300.0 131.0747 4400.0 131.0854 190000.0 132.0933 7400.0 133.0647 9000.0 133.1011 370000.0 133.1127 7200.0 135.0247 3800.0 135.0803 58000.0 135.1167 150000.0 137.0959 120000.0 139.0751 13000.0 139.1015 2800.0 139.1117 320000.0 141.0699 3900.0 142.0778 26000.0 143.0854 180000.0 144.0932 31000.0 145.0653 3900.0 145.0886 6800.0 145.1011 540000.0 145.1203 3200.0 146.109 3700.0 147.0804 59000.0 147.1167 550000.0 149.0961 51000.0 149.1325 28000.0 151.0752 51000.0 151.1115 47000.0 153.0911 21000.0 153.1273 75000.0 155.0854 64000.0 155.1065 58000.0 156.0935 36000.0 157.0864 6200.0 157.1011 350000.0 157.1168 4000.0 158.1085 23000.0 159.0806 31000.0 159.1168 230000.0 160.0882 4700.0 161.0961 61000.0 161.1324 76000.0 163.1117 86000.0 163.1469 7000.0 165.091 120000.0 165.1276 19000.0 167.0854 12000.0 167.1065 14000.0 167.1431 3900.0 168.0936 10000.0 169.1013 170000.0 169.1179 6000.0 170.1089 31000.0 171.0812 7100.0 171.1169 230000.0 172.1247 17000.0 173.096 42000.0 173.1326 160000.0 173.5224 20000.0 173.5325 25000.0 173.5411 33000.0 175.1121 32000.0 175.1482 86000.0 177.091 11000.0 177.1278 21000.0 179.0861 18000.0 179.1433 69000.0 180.0933 8000.0 181.1015 85000.0 181.1225 180000.0 182.1087 30000.0 183.117 170000.0 184.1249 19000.0 185.0959 32000.0 185.1326 150000.0 186.1406 7600.0 187.1116 33000.0 187.1482 79000.0 188.7135 2900.0 189.1276 40000.0 191.1064 2600.0 191.1431 41000.0 193.1014 39000.0 193.1204 5700.0 194.1092 32000.0 195.1169 140000.0 195.1381 48000.0 196.1248 68000.0 197.0992 7900.0 197.1326 210000.0 198.1407 11000.0 199.1124 20000.0 199.1483 98000.0 199.8557 2500.0 200.1555 3400.0 201.1278 24000.0 201.1639 42000.0 203.1432 87000.0 205.1589 57000.0 206.1089 14000.0 207.1169 72000.0 207.1385 56000.0 208.1247 34000.0 208.1451 8100.0 209.1102 3000.0 209.1327 240000.0 209.1516 2700.0 210.1405 22000.0 211.1126 15000.0 211.1484 170000.0 213.1277 20000.0 213.1642 26000.0 214.135 4900.0 215.1433 28000.0 215.1777 2900.0 217.1593 20000.0 219.1172 20000.0 219.1747 11000.0 220.1244 19000.0 221.1323 100000.0 221.1542 170000.0 222.1406 32000.0 223.1124 9400.0 223.1485 120000.0 224.1201 2500.0 224.1563 11000.0 225.1281 18000.0 225.164 52000.0 227.1435 31000.0 227.1811 4100.0 229.1593 15000.0 231.1163 4900.0 231.1739 4500.0 233.1325 27000.0 233.1546 24000.0 234.1399 14000.0 235.1484 87000.0 235.1706 2500.0 236.1553 6200.0 237.1273 19000.0 237.1642 71000.0 238.1363 5200.0 239.1435 13000.0 239.1794 20000.0 241.1593 17000.0 241.1945 5800.0 243.1753 28000.0 245.131 13000.0 245.1542 27000.0 245.1884 3200.0 246.1375 4900.0 246.1619 32000.0 247.1466 26000.0 247.1699 100000.0 248.1566 13000.0 249.1253 2700.0 249.1366 3300.0 249.1639 46000.0 251.1469 5100.0 251.1793 28000.0 253.1578 13000.0 253.1933 8000.0 255.1391 3100.0 255.1734 10000.0 257.1896 14000.0 259.1446 5200.0 259.1723 12000.0 260.1567 2800.0 260.179 9500.0 261.1632 28000.0 261.1888 14000.0 262.1715 14000.0 263.1472 3400.0 263.1793 44000.0 265.1607 11000.0 265.1952 26000.0 267.175 14000.0 267.2096 4700.0 269.1908 29000.0 271.1718 11000.0 272.1793 11000.0 273.1875 20000.0 275.1796 45000.0 276.1886 5500.0 277.1561 2600.0 277.1667 3900.0 277.196 38000.0 279.1761 4300.0 281.1905 11000.0 281.295 3200.0 282.2801 11000.0 283.171 8700.0 283.2052 16000.0 283.2827 12000.0 285.1857 120000.0 285.218 2600.0 286.194 18000.0 287.2014 41000.0 289.196 16000.0 291.175 4700.0 291.2098 10000.0 293.1907 11000.0 297.1857 16000.0 298.1936 35000.0 299.2013 81000.0 300.2085 3500.0 300.3076 3600.0 301.1953 4600.0 303.2135 9000.0 306.1966 4900.0 307.2065 4300.0 309.1853 13000.0 309.2242 4000.0 311.2011 46000.0 312.2073 8500.0 313.217 16000.0 321.2232 3800.0 324.2097 12000.0 325.2151 3600.0 335.2375 5900.0 337.219 6000.0 339.2337 8700.0 349.2163 31000.0 351.0088 2800.0 351.2318 14000.0 352.2412 9900.0 353.248 55000.0 363.2307 10000.0 364.2405 55000.0 365.2487 3700.0 375.2309 4500.0 377.2473 27000.0 390.2544 7400.0 415.3048 3100.0 417.2649 2600.0 425.3038 2600.0 427.2984 2700.0 445.31 13000.0 491.3523 130000.0 545.2259 2600.0 565.4034 5500.0 583.4152 37000.0 END IONS BEGIN IONS SCANS=844 PEPMASS=567.4202 CHARGE=1 COLLISION_ENERGY=0.0 63.9283 13000.0 65.0383 13000.0 67.0539 150000.0 69.0332 55000.0 69.0664 11000.0 69.0696 140000.0 71.0488 50000.0 79.0495 16000.0 79.0539 250000.0 79.4813 13000.0 81.0696 680000.0 83.0488 77000.0 83.0853 70000.0 83.6807 11000.0 85.0646 29000.0 91.0482 21000.0 91.0539 270000.0 93.0696 780000.0 93.0768 18000.0 95.0489 140000.0 95.0852 390000.0 97.0645 130000.0 97.1008 25000.0 103.0543 16000.0 105.0696 1100000.0 105.0769 16000.0 105.0782 26000.0 107.049 17000.0 107.0731 15000.0 107.0772 24000.0 107.0852 740000.0 109.0645 79000.0 109.0927 24000.0 109.1009 550000.0 110.5979 14000.0 111.0801 150000.0 115.0544 14000.0 117.0696 110000.0 119.0852 1300000.0 119.0935 20000.0 120.093 16000.0 121.0646 32000.0 121.1009 1100000.0 121.1094 16000.0 122.0733 17000.0 123.0801 89000.0 123.1165 140000.0 125.0958 86000.0 128.0622 27000.0 129.0695 63000.0 130.0776 29000.0 131.0853 400000.0 132.0926 15000.0 133.0652 16000.0 133.0763 18000.0 133.1009 1000000.0 133.111 20000.0 135.0803 72000.0 135.1166 420000.0 137.0958 310000.0 137.1074 11000.0 137.1328 21000.0 139.1116 80000.0 141.0699 25000.0 142.0775 40000.0 143.0852 360000.0 144.0931 72000.0 145.1009 1100000.0 145.1122 20000.0 146.1084 23000.0 147.0801 88000.0 147.1165 850000.0 147.1275 11000.0 149.0959 71000.0 149.1322 45000.0 151.1114 120000.0 155.0851 110000.0 156.0932 70000.0 157.1009 650000.0 157.1127 11000.0 158.1091 54000.0 159.0798 33000.0 159.1166 530000.0 160.1243 15000.0 161.0958 100000.0 161.1323 140000.0 163.1116 50000.0 163.1472 21000.0 165.0903 14000.0 165.127 13000.0 167.0857 47000.0 168.093 21000.0 169.1011 290000.0 170.1089 63000.0 171.0805 19000.0 171.1168 420000.0 172.1245 27000.0 173.096 48000.0 173.1324 330000.0 173.5314 140000.0 175.1116 35000.0 175.1482 200000.0 177.1269 16000.0 179.0858 56000.0 181.1011 110000.0 182.109 66000.0 183.1168 260000.0 184.1241 37000.0 185.1324 280000.0 186.1401 24000.0 187.1118 19000.0 187.1481 170000.0 189.1271 38000.0 189.1629 20000.0 191.1431 30000.0 192.0933 16000.0 193.1012 77000.0 194.1089 78000.0 195.1167 260000.0 196.1246 100000.0 197.1126 23000.0 197.1325 340000.0 198.1395 33000.0 199.1117 17000.0 199.1482 210000.0 201.1285 17000.0 201.1638 67000.0 203.1425 41000.0 205.1581 17000.0 206.1094 36000.0 207.117 130000.0 208.1249 64000.0 209.1324 310000.0 209.1509 8000.0 210.1407 48000.0 211.1482 290000.0 211.1708 14000.0 212.1563 24000.0 213.1275 37000.0 213.1643 42000.0 215.1427 22000.0 217.1586 15000.0 219.1171 16000.0 220.1238 31000.0 221.1325 180000.0 221.1551 9600.0 222.1401 46000.0 223.1484 200000.0 224.154 27000.0 225.1638 92000.0 225.1875 15000.0 227.1432 27000.0 227.1797 21000.0 229.1582 27000.0 231.1154 17000.0 232.1248 14000.0 233.1326 53000.0 234.1399 33000.0 235.1486 110000.0 236.1556 22000.0 237.164 91000.0 239.143 19000.0 239.1791 42000.0 241.195 20000.0 245.1317 27000.0 246.1405 25000.0 247.1477 73000.0 248.1554 34000.0 249.1637 70000.0 251.1797 60000.0 253.1603 14000.0 253.1951 31000.0 257.1319 13000.0 259.1478 38000.0 260.1559 25000.0 261.1638 60000.0 262.1711 26000.0 263.1802 59000.0 264.1858 13000.0 265.1942 43000.0 267.176 16000.0 267.2106 19000.0 269.1899 21000.0 273.163 26000.0 274.1712 20000.0 275.1799 53000.0 276.1856 14000.0 277.1953 56000.0 281.1919 13000.0 285.1658 16000.0 287.1793 16000.0 289.1952 37000.0 290.2049 13000.0 291.2119 17000.0 299.1783 19000.0 301.1944 22000.0 303.214 14000.0 315.2088 23000.0 317.2277 17000.0 341.2267 13000.0 343.2402 17000.0 355.2453 15000.0 411.305 20000.0 END IONS BEGIN IONS SCANS=845 PEPMASS=584.4218 CHARGE=1 COLLISION_ENERGY=0.0 67.0539 47000.0 69.0333 27000.0 69.0695 57000.0 70.3857 3300.0 71.0489 27000.0 71.0853 2800.0 73.028 3200.0 77.0384 6800.0 79.0539 81000.0 79.477 2300.0 80.0619 22000.0 81.0696 230000.0 81.6369 2200.0 82.073 12000.0 83.0488 41000.0 83.0852 72000.0 84.0885 6900.0 84.1596 2800.0 85.0645 20000.0 87.0437 15000.0 89.0594 150000.0 91.054 76000.0 92.062 4400.0 93.0695 310000.0 94.0729 10000.0 95.0489 100000.0 95.0852 180000.0 96.0885 10000.0 97.0645 120000.0 98.0678 10000.0 103.0545 3100.0 105.0447 2700.0 105.0696 350000.0 106.0728 21000.0 107.0488 7000.0 107.0852 290000.0 108.0563 2700.0 108.0881 14000.0 109.0645 42000.0 109.0928 2700.0 109.1009 210000.0 110.1042 11000.0 111.0801 37000.0 113.0959 62000.0 114.0996 3000.0 115.0544 3100.0 117.0695 50000.0 119.0754 4900.0 119.0852 470000.0 119.093 2800.0 119.0955 10000.0 120.0911 33000.0 121.0646 28000.0 121.091 4100.0 121.1009 320000.0 121.1097 2900.0 122.1044 29000.0 123.0802 200000.0 123.1165 44000.0 124.0837 3500.0 125.0596 3900.0 125.0958 54000.0 128.0624 7500.0 129.0695 33000.0 130.0776 16000.0 131.0853 200000.0 132.0928 47000.0 133.0646 6900.0 133.0858 65000.0 133.1009 330000.0 133.1128 6300.0 134.107 28000.0 135.0803 51000.0 135.1166 110000.0 136.086 4900.0 136.1201 7300.0 137.0959 77000.0 137.1333 4200.0 138.1033 31000.0 139.1115 110000.0 140.1149 17000.0 142.0773 21000.0 143.0853 200000.0 144.0926 60000.0 145.0647 22000.0 145.101 580000.0 145.1142 8600.0 145.6926 2600.0 146.0728 3400.0 146.1066 56000.0 147.0802 43000.0 147.1166 250000.0 148.12 42000.0 149.0958 47000.0 149.1322 26000.0 150.1022 3600.0 151.0752 11000.0 151.1116 31000.0 153.0902 4400.0 153.1274 18000.0 155.0852 55000.0 155.1061 46000.0 156.093 52000.0 157.1009 350000.0 158.1082 86000.0 159.0806 45000.0 159.1166 290000.0 160.0882 260000.0 160.1036 5700.0 160.1215 24000.0 161.0959 62000.0 161.1323 61000.0 162.1002 4700.0 163.1116 57000.0 163.1474 6200.0 163.3852 3100.0 164.1172 4100.0 165.091 57000.0 165.1268 6500.0 166.0946 3400.0 167.0856 13000.0 167.1066 59000.0 168.0926 8100.0 169.1011 140000.0 170.1079 44000.0 171.1008 3800.0 171.1168 250000.0 172.1233 35000.0 173.0963 27000.0 173.1324 150000.0 173.5229 15000.0 173.5318 89000.0 173.5433 23000.0 174.1371 19000.0 175.112 40000.0 175.1482 64000.0 176.1206 3000.0 176.1515 5200.0 177.1109 7500.0 177.1272 17000.0 179.0859 13000.0 179.1434 23000.0 180.0939 4600.0 180.1461 5100.0 181.1012 59000.0 181.1224 72000.0 182.1082 32000.0 182.1259 5200.0 183.1168 160000.0 184.1229 43000.0 185.0963 20000.0 185.1325 170000.0 186.1387 38000.0 187.112 28000.0 187.1481 67000.0 188.1181 4400.0 189.1276 44000.0 190.1334 7900.0 191.1431 44000.0 193.1011 32000.0 193.1208 11000.0 194.1086 25000.0 195.1167 140000.0 195.1371 25000.0 196.1237 47000.0 196.4696 2600.0 197.1324 230000.0 198.1386 41000.0 199.1124 18000.0 199.1482 99000.0 200.1535 15000.0 201.1277 25000.0 201.1637 27000.0 202.1335 4200.0 203.1431 57000.0 204.1476 7100.0 205.1591 15000.0 207.1167 59000.0 207.1372 27000.0 208.1238 27000.0 208.1449 5400.0 209.1325 160000.0 210.1385 46000.0 211.1133 18000.0 211.1483 140000.0 212.1541 25000.0 213.1274 26000.0 213.1636 46000.0 214.1335 3700.0 215.1429 14000.0 217.1588 9400.0 219.1158 3400.0 220.1256 10000.0 221.1323 67000.0 221.1541 91000.0 222.1379 24000.0 222.1577 8400.0 223.1483 110000.0 224.154 29000.0 225.1274 16000.0 225.1641 70000.0 226.1708 16000.0 227.1434 19000.0 227.1803 3200.0 229.1585 13000.0 231.1171 4000.0 231.1381 3300.0 231.1703 2900.0 233.1318 26000.0 233.1551 20000.0 234.1377 11000.0 234.16 2600.0 235.1483 57000.0 236.1542 16000.0 237.164 57000.0 238.1676 8500.0 239.1439 13000.0 239.1792 29000.0 241.1587 10000.0 243.1752 7300.0 245.131 3800.0 245.1544 3700.0 246.1612 33000.0 247.146 25000.0 247.1702 29000.0 248.1511 4100.0 248.1754 5100.0 249.1643 39000.0 250.1689 6900.0 251.1796 27000.0 251.352 2800.0 252.1849 3100.0 253.159 10000.0 253.1955 16000.0 255.1746 13000.0 257.1909 4100.0 258.1396 2800.0 259.1699 13000.0 260.1785 5000.0 261.1624 29000.0 263.1798 39000.0 264.1841 8300.0 265.1949 22000.0 266.201 12000.0 267.1763 8100.0 269.1895 5900.0 271.1705 20000.0 273.1863 9500.0 274.1936 3300.0 275.1785 25000.0 276.1836 6100.0 277.195 15000.0 278.1989 5400.0 279.2107 5200.0 281.1886 4000.0 283.2058 10000.0 285.1861 21000.0 286.1922 40000.0 287.2012 29000.0 289.1956 9700.0 291.2109 11000.0 297.1854 11000.0 298.1935 6500.0 299.1999 35000.0 300.206 9200.0 310.192 4200.0 311.2023 16000.0 312.2067 10000.0 321.2198 4000.0 325.2171 7200.0 337.2159 12000.0 339.2292 6100.0 345.2591 3300.0 352.2396 29000.0 353.248 13000.0 354.2518 6200.0 365.2456 31000.0 366.2566 6300.0 409.2767 3400.0 446.3151 3700.0 459.3012 3100.0 491.3615 4600.0 492.3582 20000.0 492.6389 2900.0 526.8341 3700.0 545.2681 2400.0 553.075 2300.0 584.4188 4200.0 END IONS BEGIN IONS SCANS=846 PEPMASS=613.4236 CHARGE=1 COLLISION_ENERGY=0.0 67.0539 27000.0 69.0333 4000.0 69.0696 40000.0 70.9707 2700.0 71.0491 2900.0 79.0539 53000.0 81.0695 140000.0 83.0489 22000.0 83.0852 22000.0 84.0317 2500.0 85.0646 3400.0 86.486 2600.0 87.2105 2200.0 89.4703 2300.0 91.0539 58000.0 93.0695 180000.0 94.0733 3300.0 95.0488 38000.0 95.0852 100000.0 97.0645 22000.0 97.1011 5600.0 99.0437 8400.0 105.0695 230000.0 106.0724 3100.0 107.0851 170000.0 109.0644 29000.0 109.1008 130000.0 111.0802 16000.0 117.0696 27000.0 119.076 9900.0 119.0852 310000.0 119.0951 8600.0 121.0645 8900.0 121.1008 220000.0 122.1043 7600.0 123.08 45000.0 123.1164 42000.0 125.0956 29000.0 129.0696 17000.0 131.0852 110000.0 132.0925 25000.0 133.1008 250000.0 133.1126 3300.0 134.1048 9900.0 135.0801 29000.0 135.1165 92000.0 136.1203 2700.0 137.0959 49000.0 138.1028 6700.0 139.1112 16000.0 142.0777 13000.0 142.4554 2400.0 143.0851 90000.0 144.0927 16000.0 145.0892 2800.0 145.1009 310000.0 146.1051 26000.0 147.0801 18000.0 147.1165 190000.0 149.0955 27000.0 149.1322 16000.0 151.1114 23000.0 155.0851 27000.0 156.0928 22000.0 157.1008 180000.0 158.1066 31000.0 159.0803 9300.0 159.1166 160000.0 159.9436 2500.0 160.1209 8100.0 161.0958 27000.0 161.1321 38000.0 163.1116 14000.0 163.148 12000.0 165.0697 3300.0 167.0855 7600.0 167.1067 2700.0 169.101 79000.0 170.1074 22000.0 171.0808 2700.0 171.1166 120000.0 172.1223 18000.0 173.0959 10000.0 173.1323 120000.0 173.5222 18000.0 173.5328 43000.0 173.542 16000.0 174.1359 8500.0 175.1116 16000.0 175.1481 67000.0 177.1272 3600.0 179.0845 4500.0 180.6527 2700.0 181.101 35000.0 182.1084 18000.0 183.1168 77000.0 184.1233 26000.0 185.1324 73000.0 186.1374 16000.0 187.1121 5800.0 187.1479 50000.0 188.1523 2300.0 189.1277 14000.0 191.1429 25000.0 193.1012 16000.0 194.1086 17000.0 195.1165 73000.0 196.1235 30000.0 197.1323 100000.0 198.1378 24000.0 199.1133 7700.0 199.1479 95000.0 200.1525 6900.0 201.128 7100.0 201.1637 28000.0 203.1412 9100.0 205.7311 2700.0 206.1104 3100.0 207.117 32000.0 208.1237 22000.0 209.1323 88000.0 210.1381 29000.0 211.148 91000.0 212.1527 20000.0 213.1275 11000.0 213.1637 24000.0 215.1427 7300.0 217.1587 31000.0 219.1175 7600.0 220.1252 7300.0 221.1325 49000.0 222.1385 14000.0 223.1479 67000.0 224.154 18000.0 225.1252 2600.0 225.1634 29000.0 226.1687 8000.0 227.1426 8100.0 227.1778 3000.0 228.15 3000.0 231.5155 3000.0 233.1318 16000.0 234.1391 8500.0 235.1481 37000.0 236.1546 12000.0 237.1637 37000.0 238.168 14000.0 239.1443 4000.0 239.1785 17000.0 241.194 3600.0 245.1321 7100.0 247.148 22000.0 248.1546 8700.0 249.1635 22000.0 250.1689 8700.0 251.1793 23000.0 252.186 9400.0 253.1933 15000.0 257.1891 2700.0 259.1486 5500.0 260.1551 7900.0 261.1628 19000.0 262.1717 8000.0 263.1792 25000.0 264.1838 7300.0 265.195 23000.0 269.1902 11000.0 271.2082 3700.0 273.1624 3100.0 274.1733 4300.0 275.1798 14000.0 276.1866 10000.0 277.1947 15000.0 281.1888 4300.0 283.2056 9600.0 287.1783 3500.0 289.1969 11000.0 291.211 6300.0 295.2058 9700.0 298.1914 3600.0 299.1952 5000.0 314.2034 2500.0 317.2267 3600.0 333.2219 3100.0 348.2462 3700.0 391.2589 2800.0 417.1725 2500.0 429.3153 3300.0 512.2758 3000.0 END IONS BEGIN IONS SCANS=847 PEPMASS=629.4198 CHARGE=1 COLLISION_ENERGY=0.0 65.1955 2300.0 67.054 16000.0 67.538 2800.0 69.0695 7400.0 69.1309 2300.0 70.8596 2600.0 79.0541 18000.0 81.0696 43000.0 81.1388 2500.0 83.0488 4500.0 83.0854 3700.0 89.0593 32000.0 91.0538 17000.0 93.0695 45000.0 93.2469 2300.0 95.0488 10000.0 95.0851 25000.0 97.0645 15000.0 97.2676 2300.0 100.138 2300.0 100.4685 2600.0 105.0695 53000.0 105.6171 2700.0 107.0851 48000.0 109.0644 14000.0 109.1009 48000.0 111.6779 2200.0 117.0701 6000.0 118.9178 2400.0 119.0852 70000.0 121.0247 2300.0 121.1008 64000.0 123.0803 9400.0 123.1167 10000.0 125.0956 8400.0 125.2557 2700.0 126.0329 2100.0 129.0689 3300.0 131.0852 32000.0 133.0855 14000.0 133.0893 3000.0 133.1009 68000.0 135.081 5000.0 135.1166 21000.0 137.0958 19000.0 139.1112 13000.0 143.0852 30000.0 144.0933 2500.0 145.101 79000.0 147.081 7400.0 147.1164 24000.0 151.076 3800.0 151.111 3700.0 156.093 3800.0 156.2626 2600.0 157.1008 52000.0 159.1167 34000.0 161.0959 11000.0 161.1319 9200.0 163.1116 13000.0 167.1078 3300.0 169.1011 29000.0 171.1167 30000.0 173.1326 22000.0 173.5285 47000.0 173.5384 27000.0 175.1118 3300.0 175.1479 13000.0 181.102 6900.0 183.1168 27000.0 185.1324 21000.0 186.9973 2500.0 187.1472 5000.0 189.1268 3200.0 191.1433 3400.0 191.9778 2700.0 193.0858 2500.0 195.1171 19000.0 196.1245 6200.0 197.1323 27000.0 199.1483 13000.0 201.1638 3300.0 207.1169 9200.0 209.1326 26000.0 211.1484 16000.0 221.1325 11000.0 223.1482 17000.0 223.9691 2700.0 225.1638 8400.0 235.1478 6900.0 237.1642 8900.0 249.1636 4000.0 259.1432 2300.0 261.1651 2700.0 263.1792 2700.0 275.1802 2400.0 300.0621 2900.0 376.125 2600.0 398.446 2500.0 402.0728 2700.0 412.0632 2500.0 507.4015 2600.0 553.2368 2800.0 598.4518 2400.0 635.7117 2800.0 END IONS BEGIN IONS SCANS=848 PEPMASS=630.4266 CHARGE=1 COLLISION_ENERGY=0.0 67.0538 3900.0 69.0696 3000.0 70.0772 2200.0 71.0489 3600.0 74.5191 2900.0 79.054 5600.0 81.0695 16000.0 83.0853 2500.0 89.0594 9200.0 91.054 2800.0 93.0696 23000.0 95.0489 6400.0 95.0852 11000.0 97.1414 2600.0 105.0695 23000.0 107.0851 22000.0 107.5158 2300.0 109.0647 9000.0 109.1008 18000.0 117.0693 4400.0 117.1773 2200.0 119.0851 39000.0 119.9619 2500.0 120.0887 2300.0 121.1007 21000.0 123.0799 12000.0 125.0593 2600.0 125.0962 4900.0 131.0853 15000.0 132.0933 3600.0 133.1007 29000.0 135.0806 6600.0 135.1165 9100.0 137.096 5000.0 143.0854 18000.0 144.092 3400.0 145.1008 44000.0 147.1165 15000.0 149.0955 6400.0 151.1104 3100.0 155.0848 4000.0 157.1008 19000.0 158.1069 6800.0 159.1162 16000.0 161.0962 3200.0 161.1329 3600.0 163.1107 6900.0 169.1012 11000.0 171.1165 14000.0 173.1324 13000.0 173.5315 44000.0 175.148 9300.0 181.1019 2800.0 181.1217 3300.0 183.1165 13000.0 185.1321 8500.0 187.1483 2700.0 190.6258 2600.0 190.6846 2400.0 191.1429 3700.0 195.1161 9000.0 197.1321 10000.0 199.1118 2600.0 199.1488 5300.0 201.128 3000.0 207.1161 3800.0 209.1328 7900.0 211.1484 6200.0 212.4924 2600.0 213.1625 6700.0 218.4745 2500.0 221.1331 3800.0 223.1476 5000.0 225.1634 2800.0 252.1838 2700.0 286.1885 2600.0 558.7722 2500.0 END IONS BEGIN IONS SCANS=849 PEPMASS=566.4117 CHARGE=1 COLLISION_ENERGY=0.0 63.2242 2200.0 67.054 13000.0 67.5864 2200.0 69.0697 11000.0 70.1956 2300.0 71.0491 5100.0 72.4141 2400.0 78.3476 2200.0 79.0539 17000.0 80.0617 6100.0 81.0696 38000.0 82.2681 2400.0 83.049 3600.0 83.0854 11000.0 87.1276 2500.0 91.0539 15000.0 93.0696 56000.0 95.0489 19000.0 95.0853 41000.0 97.0644 24000.0 105.0695 68000.0 105.4417 2400.0 107.0852 62000.0 109.0645 6700.0 109.1009 42000.0 110.1045 2500.0 111.0802 12000.0 113.0959 18000.0 113.9882 2700.0 117.0698 13000.0 119.0767 3000.0 119.0852 99000.0 121.0643 3200.0 121.1008 54000.0 123.0801 29000.0 123.1165 7600.0 125.0958 7400.0 130.0773 3200.0 131.0851 43000.0 132.0933 10000.0 133.1008 67000.0 135.0804 7600.0 135.1168 26000.0 137.0961 13000.0 139.1114 20000.0 143.0852 46000.0 144.0928 15000.0 145.1009 120000.0 146.1083 4000.0 147.0803 10000.0 147.1165 37000.0 149.095 3400.0 151.1122 3200.0 152.5439 2800.0 155.085 8300.0 155.1067 3100.0 156.0931 16000.0 157.1008 78000.0 158.1087 10000.0 159.0801 15000.0 159.1166 56000.0 160.0877 6500.0 161.0958 14000.0 161.1323 3400.0 162.0478 2400.0 167.0853 5700.0 169.1009 36000.0 170.1085 11000.0 171.0806 2700.0 171.1165 41000.0 173.0964 8200.0 173.1324 38000.0 173.5072 2900.0 173.53 65000.0 173.5438 9400.0 175.1103 2700.0 175.1478 16000.0 179.1428 7800.0 181.1016 20000.0 181.1217 16000.0 183.1166 46000.0 184.1234 10000.0 185.096 6400.0 185.1323 37000.0 187.1106 4400.0 187.1483 18000.0 189.1265 4200.0 191.1436 4300.0 192.5698 2600.0 193.1006 3500.0 194.1093 3400.0 195.1166 44000.0 196.1237 13000.0 197.1323 55000.0 198.1393 5700.0 199.1124 5800.0 199.1481 23000.0 200.1192 3400.0 201.1269 5700.0 203.143 15000.0 207.1169 22000.0 208.1251 5000.0 209.1326 36000.0 210.1393 7400.0 211.1123 2700.0 211.1481 30000.0 213.128 9600.0 213.1624 8600.0 215.1424 11000.0 219.1178 4100.0 221.1322 25000.0 221.1535 22000.0 222.1403 3300.0 223.1479 25000.0 225.128 13000.0 225.1641 12000.0 227.1437 6200.0 231.117 4200.0 233.1319 7700.0 235.1478 18000.0 237.1295 2600.0 237.163 11000.0 239.1417 2900.0 239.1791 2900.0 247.1472 14000.0 249.1632 13000.0 251.1475 2600.0 251.1793 9900.0 253.1589 3900.0 254.4491 2600.0 261.1632 16000.0 263.1776 9400.0 265.1944 2700.0 275.18 10000.0 279.2171 2300.0 281.1907 11000.0 282.2802 3300.0 283.2067 2600.0 283.283 3300.0 287.203 2600.0 298.1921 3900.0 299.2014 8300.0 310.308 5900.0 311.3165 3500.0 332.2477 2400.0 386.6606 2600.0 536.8918 2600.0 END IONS BEGIN IONS SCANS=850 PEPMASS=612.4175 CHARGE=1 COLLISION_ENERGY=0.0 64.493 2600.0 64.8053 2100.0 65.3313 2200.0 67.0537 12000.0 68.6482 2900.0 69.0697 13000.0 69.3136 2400.0 70.1481 2600.0 71.5235 2300.0 73.0281 13000.0 73.784 2300.0 74.3933 2400.0 76.5689 2100.0 79.0539 20000.0 80.0616 2800.0 80.6609 2500.0 81.0024 2600.0 81.0696 59000.0 81.0743 2400.0 83.0489 7800.0 83.0853 15000.0 84.1768 2400.0 84.3249 2500.0 84.7553 2200.0 89.0595 12000.0 90.9362 2300.0 91.054 25000.0 93.0202 2600.0 93.0695 74000.0 95.0489 46000.0 95.0851 36000.0 97.0644 8200.0 99.0437 34000.0 99.0814 2500.0 99.8256 2600.0 101.1928 2700.0 102.3823 2500.0 105.0695 100000.0 106.0776 2500.0 107.0852 100000.0 109.0408 2700.0 109.0644 13000.0 109.1008 43000.0 109.2047 2500.0 110.7815 2900.0 111.08 2800.0 117.0696 18000.0 119.0851 150000.0 120.0929 11000.0 121.0647 11000.0 121.1009 90000.0 122.1093 2500.0 122.2311 2400.0 123.0712 2200.0 123.0801 100000.0 123.1161 2900.0 125.0958 47000.0 129.0701 4000.0 129.8257 2800.0 131.0852 78000.0 132.093 54000.0 133.1009 150000.0 134.1085 5000.0 135.0799 10000.0 135.1166 26000.0 135.9643 2700.0 136.3532 2400.0 137.0957 26000.0 138.1036 23000.0 138.1827 2400.0 141.0691 3100.0 143.0852 81000.0 144.093 28000.0 145.0888 8200.0 145.1009 250000.0 146.1087 12000.0 146.4084 2400.0 147.0802 11000.0 147.1164 85000.0 149.0956 33000.0 151.1109 9900.0 155.0855 20000.0 156.0931 21000.0 157.0879 4100.0 157.1009 160000.0 158.1085 39000.0 159.0804 5700.0 159.1165 110000.0 160.1242 10000.0 161.0959 37000.0 161.1321 11000.0 163.1115 7600.0 169.101 78000.0 170.109 19000.0 171.1167 110000.0 172.1244 16000.0 173.0958 9900.0 173.1325 84000.0 173.528 93000.0 173.5405 41000.0 175.1122 9800.0 175.1483 13000.0 181.1008 25000.0 182.1097 3800.0 183.1167 77000.0 184.1246 18000.0 185.1324 90000.0 186.1404 6700.0 187.1113 7200.0 187.1479 24000.0 189.1272 22000.0 189.5451 2400.0 191.1428 45000.0 193.1007 11000.0 194.1085 14000.0 195.1165 81000.0 195.1365 2300.0 196.1241 28000.0 197.1323 120000.0 198.1401 18000.0 199.1121 6400.0 199.1481 76000.0 201.1288 6200.0 201.162 3000.0 203.1424 3000.0 203.1841 2600.0 207.1167 25000.0 208.1253 13000.0 209.1323 110000.0 210.1401 20000.0 211.1482 100000.0 213.1275 11000.0 213.1642 9700.0 215.1424 3700.0 217.1601 2700.0 220.1265 3000.0 221.1323 32000.0 222.14 10000.0 223.1481 69000.0 224.156 14000.0 225.1268 7000.0 225.1636 28000.0 227.1436 11000.0 229.1584 3100.0 233.1323 6200.0 233.1548 6600.0 233.752 2400.0 235.1481 21000.0 237.1638 73000.0 239.1422 11000.0 239.1781 2600.0 241.1621 2600.0 247.1488 11000.0 249.1635 22000.0 250.343 2500.0 251.1787 16000.0 252.1868 8600.0 253.1946 12000.0 261.1634 19000.0 263.1785 22000.0 265.1932 10000.0 273.1667 3000.0 275.1793 7200.0 276.1864 2800.0 277.195 12000.0 283.1693 3100.0 283.2072 3800.0 287.1818 3400.0 298.1931 44000.0 329.2259 5300.0 390.2551 28000.0 436.295 3000.0 446.8841 2900.0 528.3614 13000.0 538.3205 2600.0 615.9606 3400.0 END IONS BEGIN IONS SCANS=851 PEPMASS=600.4161 CHARGE=1 COLLISION_ENERGY=0.0 69.0332 3400.0 69.0695 3300.0 79.0206 2400.0 79.0538 5300.0 81.0697 23000.0 83.0492 4700.0 83.0853 4900.0 85.0647 3300.0 88.8461 2300.0 89.0594 42000.0 91.054 10000.0 93.0696 30000.0 95.0489 10000.0 95.0854 23000.0 96.4889 2100.0 97.0647 9200.0 105.0697 29000.0 107.0853 26000.0 109.0645 9800.0 109.1009 14000.0 111.0805 3500.0 112.2567 2900.0 113.4288 2200.0 117.0698 3600.0 119.0853 58000.0 121.0652 4200.0 121.1009 41000.0 122.1043 4700.0 123.0802 16000.0 123.1166 3000.0 125.0596 20000.0 131.0852 21000.0 132.0932 2200.0 133.064 2500.0 133.086 22000.0 133.1009 39000.0 134.1079 2500.0 134.6264 2300.0 135.0801 17000.0 135.1168 15000.0 137.096 19000.0 138.0988 2400.0 139.0754 3000.0 143.0851 22000.0 145.1009 53000.0 146.106 3400.0 147.0802 37000.0 147.1167 17000.0 148.0843 4300.0 149.096 13000.0 151.0752 20000.0 151.1124 2700.0 152.0795 2400.0 153.0926 4000.0 155.0857 5400.0 156.0921 4000.0 156.6785 2500.0 157.1011 43000.0 158.1051 9200.0 159.0804 3900.0 159.1167 33000.0 160.1213 2700.0 161.0959 11000.0 161.1323 16000.0 163.1116 47000.0 165.091 140000.0 166.0943 30000.0 168.0933 2300.0 169.101 17000.0 170.1079 4700.0 171.1167 35000.0 172.1223 8600.0 173.0958 7500.0 173.1322 16000.0 173.5201 5100.0 173.5364 43000.0 175.1115 11000.0 175.1486 8400.0 177.0914 5000.0 177.1283 4200.0 181.1035 5300.0 181.1222 40000.0 182.1261 4000.0 183.1168 26000.0 184.1213 7700.0 185.1324 22000.0 186.1364 4600.0 187.1119 11000.0 187.1472 5900.0 189.1274 13000.0 190.1349 13000.0 191.107 10000.0 191.1427 8100.0 193.1225 16000.0 194.1079 6700.0 195.1171 11000.0 196.1237 4000.0 197.132 21000.0 198.1377 3700.0 199.1107 4300.0 199.1475 3600.0 201.1275 11000.0 203.1431 59000.0 204.1462 18000.0 207.1176 4600.0 207.1375 17000.0 208.1441 8100.0 209.1327 14000.0 210.1389 3300.0 211.1118 6500.0 211.1483 16000.0 212.1522 5100.0 213.1277 8100.0 215.1419 4500.0 216.1495 3900.0 219.1385 8200.0 221.1325 8300.0 221.1537 150000.0 222.157 44000.0 223.1489 8500.0 225.1274 6900.0 225.1634 8000.0 227.1433 4600.0 229.1226 3800.0 229.1585 5600.0 233.1542 7000.0 234.1619 17000.0 235.1468 4600.0 237.1641 4700.0 239.1428 2900.0 239.1802 3200.0 240.1861 3600.0 241.1585 2500.0 247.1691 39000.0 248.1739 13000.0 249.1657 2700.0 251.1434 4000.0 251.1782 5500.0 253.1589 3400.0 255.5271 2600.0 259.17 4700.0 261.1865 3100.0 263.1785 2700.0 265.161 3800.0 267.1739 2700.0 271.1696 3500.0 273.1837 4000.0 274.193 10000.0 281.1897 7700.0 285.1864 2600.0 286.1937 11000.0 287.2005 31000.0 288.2022 7000.0 293.1895 2900.0 297.1855 4400.0 299.2008 24000.0 300.2064 4400.0 307.203 2900.0 309.2798 4700.0 311.201 4300.0 312.2061 7900.0 313.2155 19000.0 314.2224 3500.0 325.216 26000.0 326.2199 4100.0 327.2322 10000.0 328.2343 5800.0 337.2156 7400.0 339.231 3900.0 340.2394 42000.0 351.2304 2900.0 352.2394 22000.0 365.2462 13000.0 366.2523 3900.0 391.2643 4000.0 392.266 3500.0 406.3339 2600.0 413.2702 10000.0 420.2982 8300.0 425.2689 25000.0 427.284 23000.0 428.2877 6800.0 428.6165 2600.0 440.2925 33000.0 454.2995 3700.0 481.8927 3000.0 520.3521 5100.0 542.572 2400.0 600.4097 3700.0 END IONS BEGIN IONS SCANS=852 PEPMASS=599.41 CHARGE=1 COLLISION_ENERGY=0.0 63.3311 2300.0 67.0542 21000.0 69.0336 18000.0 69.0697 19000.0 71.0494 3100.0 79.0543 22000.0 81.0699 78000.0 81.9849 2400.0 83.0492 28000.0 83.0854 15000.0 85.0283 2400.0 85.0647 23000.0 87.0442 2500.0 91.0542 25000.0 93.0699 120000.0 95.0492 25000.0 95.0855 83000.0 97.0648 33000.0 105.0699 91000.0 107.0855 86000.0 109.0648 26000.0 109.1012 46000.0 111.0803 19000.0 113.0961 4000.0 117.0697 13000.0 119.0856 150000.0 121.0647 17000.0 121.1012 160000.0 123.0804 66000.0 123.117 19000.0 125.0597 44000.0 125.0961 12000.0 129.0701 7600.0 131.0856 52000.0 132.9713 2300.0 133.0645 6400.0 133.1012 110000.0 135.0804 74000.0 135.1168 54000.0 137.0961 86000.0 139.0755 28000.0 139.1112 17000.0 142.0775 7600.0 143.0855 53000.0 144.0931 3900.0 145.1012 140000.0 145.1141 3000.0 147.0805 180000.0 147.0934 5000.0 147.1168 43000.0 149.0962 35000.0 151.0754 96000.0 151.1115 12000.0 153.091 12000.0 153.1283 2900.0 155.0855 23000.0 156.0935 12000.0 157.1012 150000.0 158.1098 2600.0 159.0804 16000.0 159.1169 94000.0 160.126 3700.0 161.0962 54000.0 161.1327 77000.0 163.1118 110000.0 165.0783 11000.0 165.0912 870000.0 165.1251 2800.0 167.1073 3300.0 168.052 2500.0 168.0932 4700.0 169.1013 57000.0 170.1086 12000.0 171.117 130000.0 173.0963 42000.0 173.1328 45000.0 173.5271 34000.0 173.5407 30000.0 174.1037 2800.0 175.1118 20000.0 175.1482 33000.0 177.091 21000.0 177.128 21000.0 179.1068 9600.0 179.1241 2400.0 179.1429 13000.0 181.1018 20000.0 181.1225 55000.0 182.1094 3300.0 183.1171 120000.0 185.0961 5700.0 185.1328 100000.0 187.1121 23000.0 187.1482 36000.0 187.7612 2600.0 189.1276 51000.0 191.0884 3500.0 191.1069 57000.0 191.1425 17000.0 193.1021 8300.0 194.1092 3000.0 195.1169 41000.0 195.1382 20000.0 196.1244 12000.0 197.1327 58000.0 198.1405 2500.0 198.6922 2500.0 199.1121 21000.0 199.1484 17000.0 201.128 17000.0 201.1641 3100.0 203.1433 350000.0 203.1648 4400.0 205.1207 3300.0 207.1177 15000.0 207.1385 62000.0 208.1248 5200.0 209.1328 57000.0 211.1127 16000.0 211.1485 75000.0 212.1179 2400.0 213.128 21000.0 213.163 2700.0 215.1433 20000.0 217.158 5800.0 219.1389 3600.0 221.1338 26000.0 221.1539 850000.0 223.1121 2800.0 223.1484 26000.0 225.1277 17000.0 225.1642 21000.0 225.2357 2600.0 227.1434 18000.0 227.1796 12000.0 229.1226 10000.0 229.1586 34000.0 231.138 24000.0 233.1317 9400.0 233.1544 20000.0 234.1623 8300.0 235.1483 16000.0 236.1551 3500.0 237.1273 3800.0 237.1643 17000.0 239.1433 15000.0 239.1792 11000.0 243.14 6900.0 243.173 6800.0 245.1544 6400.0 247.1431 10000.0 247.1695 190000.0 248.1546 2600.0 249.1634 11000.0 251.1434 9300.0 251.179 7900.0 253.1587 7600.0 255.1382 5300.0 255.1761 3000.0 257.1547 11000.0 260.1534 2900.0 261.1609 8300.0 261.1872 6900.0 262.6438 2500.0 263.1784 20000.0 265.1578 6700.0 265.1963 7200.0 267.1743 3400.0 269.1534 2500.0 269.1903 20000.0 271.1712 13000.0 272.1773 6600.0 275.1799 5100.0 277.1962 6300.0 281.19 18000.0 283.1698 3600.0 285.1863 20000.0 286.1931 31000.0 287.2011 140000.0 289.1945 10000.0 291.1743 3900.0 293.19 13000.0 295.2064 7300.0 298.1926 9800.0 299.2013 49000.0 301.2169 3300.0 302.3251 2400.0 307.2062 3400.0 309.1848 5000.0 311.201 29000.0 312.2093 10000.0 313.2168 40000.0 324.2104 7400.0 325.2159 21000.0 327.2324 48000.0 335.2 5900.0 363.2316 2900.0 365.2477 38000.0 373.2521 6600.0 391.2117 2600.0 391.263 37000.0 405.0207 2900.0 413.2684 45000.0 419.295 40000.0 427.2843 92000.0 453.3002 19000.0 507.3506 9600.0 512.2527 2800.0 517.216 2600.0 519.3458 31000.0 527.0642 2700.0 545.0072 2500.0 581.399 5700.0 599.4094 26000.0 599.5038 3800.0 END IONS BEGIN IONS SCANS=853 PEPMASS=234.0973 CHARGE=1 COLLISION_ENERGY=0.0 43.0486 2200.0 43.4549 2000.0 43.5703 4200.0 43.6985 2100.0 44.2711 2300.0 44.9535 2200.0 45.0333 990000.0 45.1681 2200.0 45.337 2400.0 45.558 2800.0 45.6758 2300.0 46.0439 2400.0 47.3794 2700.0 48.0995 2600.0 50.0204 2800.0 50.8281 2100.0 51.0936 2100.0 51.1655 2200.0 51.8096 2300.0 52.0425 2400.0 52.0857 2500.0 52.4184 2100.0 52.7703 2300.0 53.0005 2300.0 53.045 2500.0 53.0502 2100.0 54.0852 2500.0 54.7347 2800.0 55.2201 2300.0 56.8061 2300.0 57.8555 2700.0 58.9757 2400.0 59.9872 2500.0 60.1293 2300.0 60.8268 2000.0 61.5923 2500.0 61.6895 2400.0 62.3602 2400.0 63.8582 2000.0 66.1895 2400.0 66.2393 2400.0 66.5204 2500.0 66.69 2100.0 66.8876 2400.0 67.1196 2400.0 67.2912 2500.0 67.4524 2200.0 67.7277 2400.0 68.0607 2500.0 68.2827 2700.0 68.4055 2100.0 68.791 2200.0 70.0649 82000.0 70.6443 2200.0 70.713 2100.0 71.8841 2300.0 72.6547 2400.0 72.7682 2400.0 72.9736 2200.0 73.0283 12000000.0 73.0351 20000.0 73.0353 9500.0 73.0379 4100.0 73.408 2200.0 76.6288 2400.0 77.1065 3100.0 77.929 2200.0 78.5417 2400.0 78.6268 2400.0 78.65 2300.0 78.818 2600.0 78.8956 2800.0 79.1328 2300.0 79.4824 2200.0 79.9686 2100.0 80.2132 2400.0 80.5634 2400.0 81.1706 2600.0 81.9889 2300.0 82.2332 2400.0 82.7117 2700.0 83.0922 2400.0 84.1186 2700.0 85.4515 2500.0 86.2875 2300.0 86.4427 2100.0 87.4483 2400.0 87.5292 2400.0 88.0752 5300.0 88.0989 2600.0 88.3001 2800.0 88.4454 2400.0 90.0288 2300.0 90.0557 2200.0 90.5152 2900.0 90.5632 2400.0 91.0574 2800.0 91.0753 2500.0 92.797 2300.0 93.5966 2400.0 95.2076 2200.0 95.6456 2500.0 98.8457 2300.0 98.8701 2200.0 101.4513 2200.0 103.4077 2400.0 103.989 2400.0 104.8282 2300.0 105.2384 2100.0 108.0557 2400.0 108.1604 2600.0 108.7373 2300.0 109.8841 2700.0 111.0582 2400.0 111.7187 2400.0 112.4897 2300.0 114.0911 47000.0 114.1665 2400.0 115.1837 2400.0 116.0703 340000.0 118.048 2600.0 118.1953 2500.0 118.9482 2200.0 120.1578 2200.0 120.5504 2400.0 121.3823 2700.0 121.6779 2300.0 123.0906 2300.0 125.1898 2500.0 125.3704 2300.0 127.1017 2500.0 127.4138 2400.0 129.275 2300.0 133.3313 2600.0 135.1661 2300.0 136.9979 2400.0 137.2906 2600.0 138.1629 2400.0 139.7137 2300.0 140.8808 2400.0 140.9544 2400.0 141.0175 2500.0 142.1369 2600.0 142.2185 2600.0 142.8779 2300.0 147.2 2600.0 149.6884 5700.0 149.6992 3600.0 149.7192 2600.0 151.0751 46000.0 152.0785 100000.0 155.8563 2200.0 157.7961 2500.0 162.3478 2500.0 164.9929 2200.0 168.3019 2300.0 170.0709 2500.0 171.5229 2200.0 173.4452 2800.0 173.5038 4300.0 173.5184 6100.0 173.5266 270000.0 173.541 220000.0 173.5701 4600.0 173.6608 2400.0 175.6172 2400.0 177.5785 2800.0 178.202 2500.0 178.892 2500.0 179.2704 2400.0 181.1216 2600.0 182.0463 2600.0 185.126 2300.0 187.8844 2500.0 188.0916 300000.0 189.2927 2600.0 190.3435 2400.0 190.7096 2500.0 191.8577 2200.0 192.0576 2200.0 193.7045 2400.0 194.8505 2800.0 196.1325 2600.0 202.4616 2300.0 204.0922 2200.0 204.791 2600.0 209.3129 2400.0 213.6014 2300.0 214.4439 2400.0 220.0561 2400.0 221.7136 2200.0 223.5273 2400.0 224.7023 2500.0 226.2804 2400.0 226.5024 2500.0 228.4837 2400.0 234.1864 2300.0 234.2211 30000.0 239.28 2500.0 243.787 2900.0 END IONS BEGIN IONS SCANS=854 PEPMASS=341.1385 CHARGE=1 COLLISION_ENERGY=0.0 55.0177 3900.0 55.0752 2700.0 55.3838 2100.0 57.069 2100.0 61.6717 2200.0 64.8917 2500.0 69.8435 2200.0 72.1129 2200.0 73.5907 2200.0 77.0386 2500.0 78.4698 2400.0 79.0539 14000.0 81.0334 3200.0 81.069 2300.0 86.0598 6900.0 91.0538 14000.0 93.7577 2500.0 95.0488 17000.0 95.0847 2500.0 96.6099 2400.0 99.7101 2200.0 103.0539 18000.0 105.0696 39000.0 106.041 2800.0 107.049 21000.0 109.0647 2600.0 110.9546 2600.0 115.0542 3900.0 117.0695 6800.0 119.0491 8600.0 121.0646 25000.0 121.909 2500.0 123.0437 23000.0 124.1235 2500.0 125.003 3100.0 129.0698 6900.0 131.0489 170000.0 133.054 4300.0 133.0646 230000.0 133.0764 5200.0 134.036 63000.0 135.0438 1100000.0 135.056 5300.0 137.0592 15000.0 143.0491 4800.0 143.085 8700.0 145.0644 41000.0 149.0462 2800.0 149.0595 160000.0 151.9119 2300.0 157.0646 14000.0 159.0441 3900.0 159.081 3400.0 160.0514 8700.0 161.0369 3200.0 161.0596 180000.0 161.0752 2500.0 163.0749 12000.0 169.0648 4800.0 171.0803 20000.0 173.0598 50000.0 173.5254 26000.0 173.5413 8100.0 174.066 3600.0 175.0755 11000.0 182.5873 3200.0 185.0594 12000.0 186.0675 15000.0 187.0753 56000.0 197.06 9900.0 199.0759 3500.0 201.0914 20000.0 203.0705 4200.0 207.0806 3100.0 207.1163 3400.0 209.0608 2600.0 209.0975 3300.0 211.076 3100.0 213.0925 3000.0 217.1027 3300.0 221.0976 3600.0 227.0694 3100.0 229.0861 13000.0 232.5334 3000.0 235.1127 17000.0 245.0971 6900.0 247.1112 2800.0 248.0836 2700.0 255.2136 2500.0 263.1068 11000.0 293.1168 5700.0 308.1059 20000.0 319.6915 2800.0 323.1286 20000.0 326.1161 23000.0 341.1394 120000.0 341.2833 3400.0 345.7422 2500.0 END IONS BEGIN IONS SCANS=855 PEPMASS=323.1282 CHARGE=1 COLLISION_ENERGY=0.0 51.0233 8000.0 53.0388 4400.0 55.0178 24000.0 55.3875 2300.0 56.8251 2500.0 66.6896 2500.0 69.0339 3000.0 69.2725 2500.0 71.9894 2500.0 73.0284 3200.0 76.9309 2700.0 77.0388 14000.0 79.054 49000.0 80.7791 2500.0 81.0333 3100.0 91.054 53000.0 93.0698 14000.0 95.0489 26000.0 103.054 150000.0 104.3586 2400.0 105.0332 12000.0 105.0446 4600.0 105.0697 230000.0 105.0767 2100.0 105.0781 3400.0 107.049 100000.0 115.0542 32000.0 117.0697 29000.0 119.0489 38000.0 120.0572 3500.0 121.0646 200000.0 123.0803 5500.0 128.0622 12000.0 129.0698 16000.0 131.0489 1200000.0 131.0581 6700.0 131.0608 3100.0 132.0568 18000.0 133.0646 1700000.0 133.0743 8400.0 135.0439 3400000.0 135.0536 18000.0 135.0632 13000.0 135.0679 21000.0 135.0751 3700.0 135.0815 4600.0 137.0598 16000.0 141.0692 2800.0 143.049 62000.0 143.0853 25000.0 144.0567 8700.0 145.0646 210000.0 148.0517 10000.0 149.0457 4600.0 149.0595 540000.0 149.0704 2500.0 151.0751 4600.0 156.0883 2300.0 157.0646 88000.0 159.044 28000.0 159.0809 2500.0 160.0518 62000.0 161.0595 1300000.0 161.0727 12000.0 163.0753 48000.0 169.0645 13000.0 171.0443 4800.0 171.0804 65000.0 172.052 12000.0 173.0597 220000.0 173.5254 21000.0 173.5425 15000.0 174.0675 14000.0 175.0754 47000.0 179.0855 3600.0 181.0656 3200.0 182.0734 2700.0 184.8954 2700.0 185.0598 110000.0 186.0676 130000.0 187.0754 170000.0 194.0741 3300.0 195.08 3400.0 199.0751 16000.0 201.091 47000.0 202.0783 8900.0 207.0805 14000.0 207.1169 24000.0 215.0858 2600.0 217.1011 39000.0 219.0804 3000.0 220.0883 27000.0 221.0968 8600.0 223.0749 3900.0 233.0964 14000.0 235.0744 8800.0 235.1119 150000.0 241.0826 3000.0 245.0961 81000.0 247.1112 4000.0 248.0832 36000.0 251.069 2900.0 261.0923 8500.0 263.1065 150000.0 265.0873 4600.0 265.122 9200.0 275.1065 4900.0 278.0945 17000.0 291.1006 4800.0 291.8394 2500.0 293.1175 86000.0 296.8578 2700.0 308.1046 240000.0 323.082 3000.0 323.1283 380000.0 326.1166 3100.0 END IONS BEGIN IONS SCANS=856 PEPMASS=653.297 CHARGE=1 COLLISION_ENERGY=0.0 67.4783 4400.0 70.5864 23000.0 70.589 9300.0 86.9937 3600.0 94.6703 3800.0 130.6677 3000.0 141.5775 3400.0 147.7201 6300.0 173.5193 17000.0 173.5372 100000.0 237.8998 7400.0 357.145 3700.0 368.1756 5300.0 405.2114 11000.0 407.2232 130000.0 412.1648 4800.0 416.2313 21000.0 420.2307 100000.0 421.2385 310000.0 422.2464 340000.0 428.2321 4200.0 433.2388 45000.0 434.2446 6600.0 435.2536 23000.0 446.2452 4000.0 447.2576 6200.0 448.2614 130000.0 449.2281 15000.0 449.2715 25000.0 450.2772 130000.0 451.2128 140000.0 452.2182 9100.0 459.2522 6000.0 461.234 40000.0 465.1519 6600.0 465.2282 660000.0 466.2352 110000.0 467.2549 3200.0 474.2399 4800.0 475.2183 28000.0 475.2472 21000.0 476.2548 47000.0 478.2357 7500.0 479.2444 30000.0 487.2114 42000.0 488.2194 29000.0 489.2275 22000.0 491.208 85000.0 492.2171 200000.0 493.2188 8800.0 493.2571 24000.0 494.2661 4900.0 501.2283 140000.0 501.3081 11000.0 502.2354 64000.0 503.2436 1000000.0 503.3333 6000.0 504.2474 490000.0 505.2238 28000.0 507.2732 39000.0 515.2191 7700.0 519.2544 4700.0 520.256 9700.0 520.2709 6700.0 521.29 560000.0 522.2978 350000.0 530.2306 26000.0 532.2593 8400.0 534.229 75000.0 535.2781 9500.0 537.2494 150000.0 538.2592 13000.0 547.2593 100000.0 548.2707 36000.0 549.2856 1500000.0 550.2897 210000.0 551.2651 330000.0 557.2565 8200.0 559.267 14000.0 564.2721 24000.0 565.2794 280000.0 566.2885 2100000.0 574.2587 5700.0 575.2653 850000.0 576.2724 220000.0 577.2805 29000.0 578.2461 5800.0 579.2771 28000.0 581.2874 7000.0 589.2535 16000.0 591.2966 21000.0 593.2756 720000.0 594.2801 230000.0 601.1774 7900.0 603.2597 39000.0 607.2903 370000.0 609.3064 240000.0 617.2759 42000.0 620.2632 4000.0 623.249 4300.0 635.2861 730000.0 635.406 16000.0 638.2684 6100.0 653.2961 210000.0 653.4182 7300.0 END IONS BEGIN IONS SCANS=857 PEPMASS=652.2897 CHARGE=1 COLLISION_ENERGY=0.0 72.0853 2300.0 102.2465 2500.0 151.2885 2200.0 173.538 24000.0 222.864 3100.0 259.7971 2600.0 348.6403 2800.0 406.2151 2900.0 420.2293 8100.0 421.24 4100.0 447.2571 3200.0 449.2682 5700.0 475.2473 11000.0 488.2211 8600.0 491.2067 3400.0 492.2162 10000.0 501.2282 4200.0 503.2432 560000.0 505.2266 8400.0 521.2877 16000.0 537.2479 7500.0 547.2662 4200.0 549.187 4700.0 549.2854 170000.0 565.2802 87000.0 575.264 5900.0 593.2753 210000.0 END IONS BEGIN IONS SCANS=858 PEPMASS=870.5657 CHARGE=1 COLLISION_ENERGY=0.0 117.8971 2300.0 127.0554 2300.0 173.5193 7100.0 173.5276 22000.0 173.5383 32000.0 221.4857 2600.0 287.385 2400.0 434.2449 3300.0 447.2537 3200.0 448.7699 2800.0 459.218 270000.0 460.2258 130000.0 461.2328 28000.0 473.2344 4300.0 486.2393 8200.0 487.2166 12000.0 487.2443 2800.0 488.254 13000.0 489.2374 3800.0 491.2437 28000.0 492.2518 92000.0 501.228 6400.0 503.2443 33000.0 505.2245 44000.0 506.275 3100.0 515.2461 12000.0 516.2517 35000.0 517.2267 18000.0 518.2319 4900.0 519.1458 5500.0 519.2392 320000.0 519.3324 4600.0 520.2476 83000.0 531.1461 4800.0 531.2389 410000.0 532.2467 54000.0 533.1626 5900.0 533.2546 370000.0 548.2771 32000.0 549.2483 8100.0 559.2337 21000.0 560.2414 64000.0 562.2153 4000.0 563.2604 4700.0 564.2759 4400.0 577.2453 39000.0 591.2608 200000.0 592.1579 4600.0 592.268 520000.0 593.2757 51000.0 625.4969 3300.0 838.5188 4200.0 838.54 5700.0 855.5471 3900.0 870.5662 40000.0 END IONS BEGIN IONS SCANS=859 PEPMASS=871.5726 CHARGE=1 COLLISION_ENERGY=0.0 76.5967 2800.0 78.2813 2600.0 79.318 2900.0 83.0851 18000.0 83.2026 3200.0 86.0344 2400.0 90.3064 2600.0 96.8407 9800.0 97.1008 17000.0 99.8987 2400.0 104.5295 2600.0 107.1317 2600.0 110.0171 2300.0 113.2686 2400.0 119.3253 2600.0 129.9708 2800.0 133.3089 12000.0 133.3182 13000.0 135.9726 2400.0 139.3855 3200.0 148.0608 8800.0 148.0726 4400.0 148.3123 9500.0 148.3255 25000.0 155.7028 2900.0 157.2782 2600.0 158.0006 2400.0 161.6117 2800.0 165.0796 3000.0 173.5266 110000.0 173.5423 52000.0 194.2691 3100.0 215.1328 3000.0 225.8965 2500.0 242.5596 2600.0 259.9907 3200.0 260.9164 2800.0 263.261 2700.0 296.361 2700.0 310.0641 2900.0 322.713 2400.0 328.8342 3100.0 407.2365 2700.0 431.1868 9500.0 433.2405 28000.0 434.2466 3100.0 445.2024 13000.0 446.2087 7400.0 447.2112 18000.0 456.0517 2600.0 459.1576 2600.0 459.2179 830000.0 460.1504 5000.0 460.2236 660000.0 461.231 300000.0 462.2376 36000.0 473.233 62000.0 474.24 10000.0 475.2493 2700.0 476.2549 24000.0 477.2544 3700.0 486.24 4200.0 487.2459 59000.0 488.2156 15000.0 488.2412 2300.0 488.2606 7200.0 489.2291 2700.0 489.256 19000.0 490.2619 3200.0 491.2431 120000.0 492.251 280000.0 493.2543 110000.0 501.2299 3500.0 502.2248 3200.0 503.2426 36000.0 504.2463 52000.0 505.2245 160000.0 506.2287 55000.0 515.2425 47000.0 516.25 43000.0 517.2391 69000.0 518.2291 47000.0 519.149 9000.0 519.2387 560000.0 520.1528 7600.0 520.2437 590000.0 521.2507 96000.0 531.2385 310000.0 532.2435 670000.0 532.3365 14000.0 533.0117 5100.0 533.0661 45000.0 533.2542 8800000.0 533.401 17000.0 533.4455 20000.0 534.2579 450000.0 546.243 2600.0 547.2709 29000.0 548.2771 61000.0 549.2564 7800.0 549.2706 50000.0 550.2537 18000.0 551.2617 2900.0 555.0651 2800.0 559.2373 11000.0 560.2412 220000.0 561.2476 200000.0 563.2313 22000.0 564.2495 95000.0 565.2799 170000.0 573.7711 2600.0 575.2649 74000.0 577.2445 160000.0 578.2503 80000.0 579.2494 3500.0 591.2602 170000.0 592.0477 33000.0 592.2676 5900000.0 592.4393 5000.0 592.491 11000.0 593.0533 84000.0 593.0972 46000.0 593.2752 13000000.0 593.4525 49000.0 593.499 88000.0 594.2787 45000.0 667.9307 2800.0 713.0066 2600.0 804.9289 3100.0 811.5564 14000.0 821.7227 3200.0 839.5339 6400.0 856.549 3200.0 871.5707 440000.0 END IONS BEGIN IONS SCANS=860 PEPMASS=610.6251 CHARGE=1 COLLISION_ENERGY=0.0 65.3032 2200.0 67.5251 2500.0 70.2853 2400.0 70.5353 2100.0 71.8035 2300.0 72.2232 2300.0 72.3739 2200.0 73.4896 2500.0 73.7188 2300.0 75.8 2500.0 75.9592 2300.0 79.4149 2300.0 81.2636 2500.0 81.8775 2300.0 82.6897 2400.0 84.1779 2500.0 86.194 2600.0 86.3926 2300.0 94.8892 2400.0 96.5846 2100.0 101.0184 2300.0 102.0772 2200.0 102.9965 2100.0 103.766 2400.0 104.3724 2300.0 105.7691 2600.0 105.9982 2100.0 106.275 2400.0 107.0591 2100.0 107.9136 2700.0 108.2279 2400.0 109.3833 2400.0 111.6054 2300.0 111.769 2900.0 112.7308 2600.0 112.8624 2700.0 115.0459 2500.0 116.1698 2300.0 120.3053 2600.0 121.3555 2400.0 124.0865 2800.0 125.0708 2600.0 128.8136 2500.0 129.7524 2200.0 130.346 2400.0 135.0901 2900.0 138.3564 2700.0 142.7481 2400.0 145.1729 2300.0 145.4664 2200.0 146.5238 2700.0 147.6664 2200.0 149.6877 14000.0 149.6961 3500.0 151.3288 2500.0 158.8325 3100.0 170.2855 2500.0 173.5224 24000.0 173.531 220000.0 173.5424 46000.0 179.6403 2300.0 209.7989 2200.0 215.8631 2500.0 221.6458 2300.0 223.3222 2700.0 225.4226 2500.0 226.3603 2400.0 245.1218 2700.0 249.4484 2800.0 255.3085 2600.0 274.5496 2600.0 275.2386 2300.0 281.2954 540000.0 282.2427 29000.0 282.2792 2300000.0 282.3162 23000.0 283.2865 2800.0 283.9033 2900.0 299.3058 520000.0 303.5646 2400.0 309.2882 10000.0 309.3267 570000.0 309.363 3600.0 310.2675 15000.0 310.2793 4400.0 310.3106 2300000.0 310.3518 13000.0 310.3703 3700.0 320.6311 2500.0 327.3369 470000.0 333.4936 2700.0 381.7379 2500.0 396.5428 2300.0 559.7508 2600.0 565.5683 6400.0 571.3445 2500.0 589.4516 2900.0 594.0964 2600.0 595.0941 2600.0 610.3439 8800.0 END IONS BEGIN IONS SCANS=861 PEPMASS=659.2843 CHARGE=1 COLLISION_ENERGY=0.0 66.5827 5200.0 66.5868 4600.0 69.6933 3400.0 69.6968 2900.0 73.2511 7100.0 73.2561 5900.0 89.0594 7900.0 133.0856 3500.0 173.5222 12000.0 173.5406 20000.0 288.7334 2500.0 293.6254 2300.0 482.2053 3700.0 483.2175 5600.0 498.2 3600.0 499.2131 7500.0 500.2194 3300.0 508.1897 4800.0 510.2393 5400.0 517.2205 5700.0 521.1926 13000.0 522.1987 4400.0 526.1959 10000.0 536.2155 6400.0 537.2252 71000.0 539.2046 19000.0 540.212 9200.0 541.2164 6700.0 543.2776 3400.0 555.2646 9000.0 559.2677 7200.0 561.2877 4400.0 581.233 8400.0 583.2675 44000.0 587.2651 7800.0 599.2621 190000.0 599.3742 5500.0 600.27 41000.0 601.2759 5700.0 609.2471 41000.0 615.2922 21000.0 619.2889 9800.0 627.2569 160000.0 628.2676 4500.0 641.273 83000.0 642.2748 3600.0 659.2833 330000.0 END IONS BEGIN IONS SCANS=862 PEPMASS=637.3014 CHARGE=1 COLLISION_ENERGY=0.0 65.2507 190000.0 65.2539 32000.0 68.8093 130000.0 68.8125 24000.0 70.8108 58000.0 70.8133 8300.0 76.4578 9200.0 82.5793 10000.0 87.1572 9500.0 89.5212 9400.0 90.1865 7100.0 100.6543 5800.0 139.8112 52000.0 139.8239 45000.0 140.0998 8600.0 140.4849 12000.0 147.2643 8700.0 172.3585 7000.0 173.5203 24000.0 173.5283 120000.0 173.5395 110000.0 173.5471 9000.0 239.1552 7900.0 247.442 5500.0 256.5115 7400.0 304.2236 8000.0 316.0206 7100.0 334.3954 7400.0 406.2146 23000.0 407.2235 250000.0 420.2311 120000.0 421.2373 400000.0 422.2467 350000.0 429.2057 24000.0 430.2216 14000.0 433.2393 37000.0 434.2445 72000.0 435.2524 51000.0 443.2198 12000.0 443.2307 7100.0 444.2309 81000.0 445.245 10000.0 447.2482 10000.0 448.2158 9800.0 448.2631 65000.0 449.2663 65000.0 450.2266 9400.0 450.2792 33000.0 453.2233 30000.0 457.2383 76000.0 458.2459 150000.0 459.2185 1200000.0 460.2247 130000.0 461.229 100000.0 462.2051 10000.0 463.212 71000.0 472.2262 280000.0 473.2337 2300000.0 474.2386 32000.0 475.2169 220000.0 476.2184 610000.0 477.2271 270000.0 478.2324 280000.0 485.2335 990000.0 486.2091 350000.0 487.247 260000.0 488.2233 64000.0 489.2274 130000.0 490.2336 52000.0 491.2441 35000.0 492.2512 37000.0 493.2543 94000.0 497.2345 56000.0 499.2133 570000.0 500.2213 140000.0 501.2278 39000.0 502.2356 120000.0 503.2435 1200000.0 504.246 740000.0 505.2256 95000.0 513.2287 590000.0 514.2364 240000.0 515.2444 720000.0 515.3282 16000.0 517.2251 330000.0 518.2304 140000.0 519.2389 140000.0 521.2196 45000.0 521.2844 14000.0 522.2217 130000.0 522.2986 92000.0 530.2338 21000.0 531.2443 930000.0 532.2448 53000.0 533.2534 8000.0 535.2623 26000.0 536.2391 110000.0 537.2439 62000.0 541.224 120000.0 543.2756 220000.0 544.2488 56000.0 545.2559 53000.0 547.2698 14000.0 548.2775 14000.0 549.2853 1300000.0 550.2892 1200000.0 559.0069 22000.0 559.0651 170000.0 559.2705 27000000.0 559.4288 38000.0 559.4772 110000.0 560.2753 77000.0 561.2849 86000.0 562.2539 13000.0 563.2682 51000.0 572.2411 47000.0 573.2514 12000.0 575.2657 58000.0 576.2729 190000.0 577.2795 350000.0 578.1819 13000.0 578.2865 890000.0 587.1826 25000.0 587.2658 5500000.0 591.2891 450000.0 605.2762 520000.0 609.2837 89000.0 619.2916 3700000.0 622.2753 44000.0 637.3025 1300000.0 END IONS BEGIN IONS SCANS=863 PEPMASS=636.2951 CHARGE=1 COLLISION_ENERGY=0.0 78.3759 2600.0 81.2896 2200.0 84.6031 2400.0 85.4538 2300.0 87.0436 10000.0 89.4551 2300.0 110.6308 2600.0 111.1917 2200.0 147.9388 2700.0 152.8977 2400.0 153.1293 2400.0 161.4364 2400.0 162.5115 2500.0 171.4568 2700.0 173.5192 8800.0 173.5366 86000.0 178.5023 2300.0 189.6493 2800.0 192.8577 2400.0 270.8943 2500.0 283.4525 2800.0 291.6269 2400.0 304.7704 2600.0 413.8291 2400.0 420.2308 100000.0 421.2384 9300.0 433.2388 21000.0 434.2482 13000.0 447.2179 16000.0 448.2612 28000.0 449.2332 24000.0 452.2201 29000.0 458.2463 6700.0 459.2185 15000.0 460.2253 40000.0 462.2041 17000.0 463.2067 2800.0 463.2185 3000.0 465.2286 3500.0 474.2416 31000.0 475.2129 230000.0 476.2203 60000.0 477.2281 130000.0 485.2356 2400.0 487.2112 6400.0 488.2206 6500.0 489.2297 12000.0 492.2513 47000.0 493.2231 4400.0 499.2044 3300.0 501.2248 11000.0 502.2362 86000.0 503.2436 310000.0 503.3321 2700.0 513.2292 6300.0 516.2184 3100.0 517.2208 15000.0 518.231 9700.0 521.2184 65000.0 530.2336 4100.0 535.2342 41000.0 536.2418 33000.0 548.2773 16000.0 549.2856 510000.0 559.267 2800.0 561.2506 6400.0 563.2675 5400.0 575.2666 9200.0 576.272 43000.0 577.281 200000.0 577.384 5500.0 586.2573 15000.0 611.1716 3300.0 621.2695 3600.0 636.285 6200.0 636.3015 3400.0 END IONS BEGIN IONS SCANS=864 PEPMASS=341.1386 CHARGE=1 COLLISION_ENERGY=0.0 51.0233 2600.0 51.7051 2600.0 55.0177 19000.0 55.2074 2500.0 55.7713 2400.0 59.5542 2500.0 69.0329 2300.0 77.0387 16000.0 77.8153 2300.0 79.054 43000.0 81.0331 9600.0 81.0696 10000.0 83.6819 2400.0 85.4748 2600.0 86.0597 11000.0 91.0539 34000.0 92.5178 2600.0 93.0698 10000.0 95.0488 47000.0 95.8603 2500.0 98.5491 2200.0 100.7132 2500.0 103.0539 72000.0 105.033 16000.0 105.0449 4100.0 105.0696 120000.0 106.0411 7000.0 107.0488 67000.0 108.3031 2400.0 109.0643 7000.0 111.0795 3200.0 115.0543 17000.0 117.0695 29000.0 119.0489 20000.0 121.0281 10000.0 121.0646 74000.0 123.0437 62000.0 125.0487 2200.0 128.0618 4200.0 128.6954 2500.0 129.0697 25000.0 130.0777 2800.0 131.0489 520000.0 131.0852 3100.0 132.0566 3800.0 133.0646 630000.0 133.0758 6900.0 133.1016 2600.0 134.036 170000.0 135.0439 3200000.0 135.0537 25000.0 135.0677 37000.0 135.0753 3400.0 135.0814 2800.0 136.8185 2500.0 137.0593 32000.0 137.2727 2600.0 143.049 16000.0 143.0851 29000.0 144.057 6400.0 145.0645 110000.0 148.0522 10000.0 149.0595 490000.0 157.0647 54000.0 159.0439 20000.0 159.0805 9500.0 160.0518 30000.0 161.0438 11000.0 161.0596 510000.0 161.0746 13000.0 161.0931 2200.0 163.0754 43000.0 165.0545 2500.0 169.0648 14000.0 171.0804 56000.0 173.0597 130000.0 173.5244 18000.0 173.536 35000.0 173.5432 4500.0 174.0668 25000.0 175.0754 44000.0 179.0859 2600.0 181.0647 6700.0 183.0796 8500.0 185.0596 41000.0 186.0674 50000.0 187.0753 160000.0 195.0805 4200.0 197.0595 31000.0 197.0943 3500.0 199.0754 14000.0 201.0909 56000.0 203.07 28000.0 204.6718 2900.0 207.0806 9600.0 207.1168 8600.0 209.0601 3300.0 211.0754 7500.0 212.7321 2600.0 213.0909 5000.0 217.1019 17000.0 220.0886 13000.0 221.0955 10000.0 222.8655 2600.0 223.0752 7800.0 225.0925 5500.0 227.0696 12000.0 229.086 38000.0 235.1117 54000.0 245.0958 31000.0 247.1111 7300.0 248.0829 8000.0 263.1064 50000.0 265.0862 2700.0 265.1198 4900.0 275.1039 3000.0 278.0931 3100.0 293.1166 29000.0 295.1343 3500.0 308.1049 51000.0 323.128 47000.0 326.1152 100000.0 341.1383 370000.0 341.1854 5000.0 347.0853 2500.0 END IONS BEGIN IONS SCANS=865 PEPMASS=323.1282 CHARGE=1 COLLISION_ENERGY=0.0 49.1179 2400.0 51.0234 15000.0 52.561 2200.0 53.0387 3600.0 53.2755 2200.0 55.0178 88000.0 57.6996 2500.0 61.031 2300.0 61.0556 4800.0 62.8005 2900.0 62.9767 2100.0 65.0387 4500.0 68.1439 3100.0 69.0336 2300.0 73.0284 3000.0 75.7381 2600.0 76.2307 2700.0 77.0389 39000.0 79.0541 160000.0 79.1002 2500.0 81.07 2600.0 82.4005 3300.0 82.6226 2600.0 83.3208 2700.0 84.8552 2400.0 88.2431 2500.0 91.0541 160000.0 92.4192 2900.0 93.0698 50000.0 95.049 91000.0 99.49 2700.0 103.054 480000.0 105.0335 38000.0 105.0443 21000.0 105.0697 730000.0 105.0758 4100.0 107.049 320000.0 111.4895 4900.0 115.0542 94000.0 117.0698 120000.0 119.049 120000.0 120.057 5200.0 121.0646 640000.0 122.6093 2400.0 123.0436 7100.0 123.0805 23000.0 128.0619 27000.0 129.0697 72000.0 131.0261 5500.0 131.049 3800000.0 131.0595 55000.0 132.0567 44000.0 133.0647 5400000.0 133.0745 24000.0 133.0901 16000.0 135.0212 37000.0 135.0315 2200.0 135.0439 11000000.0 135.053 36000.0 135.0679 96000.0 136.0521 4100.0 137.0596 50000.0 139.814 3600.0 141.0702 11000.0 143.049 210000.0 143.0854 81000.0 144.057 23000.0 145.0515 3200.0 145.0646 660000.0 147.8355 5100.0 148.0518 29000.0 149.046 9600.0 149.0596 1800000.0 149.071 2700.0 149.0722 13000.0 150.3292 2400.0 151.0752 27000.0 152.5498 2000.0 153.0695 12000.0 156.0572 5300.0 157.0647 280000.0 159.0438 100000.0 160.0519 200000.0 161.0191 2700.0 161.0294 5600.0 161.0438 7600.0 161.0596 4300000.0 161.073 14000.0 161.0912 19000.0 162.0681 5900.0 163.0754 170000.0 164.0326 2300.0 164.6451 2600.0 169.065 51000.0 171.0442 21000.0 171.0804 210000.0 172.0518 35000.0 173.0598 640000.0 173.5212 11000.0 173.5301 120000.0 173.5442 6800.0 174.0677 40000.0 175.0755 140000.0 179.0852 3500.0 185.0597 340000.0 186.0676 430000.0 187.0593 6700.0 187.0754 530000.0 192.094 14000.0 193.064 5500.0 193.1029 3300.0 193.4975 2400.0 194.073 13000.0 199.0759 42000.0 201.091 150000.0 202.078 25000.0 207.0807 61000.0 207.117 58000.0 210.2138 2500.0 217.1013 160000.0 217.8663 2700.0 219.0804 19000.0 220.0884 90000.0 221.0962 33000.0 223.0776 4400.0 227.5196 2500.0 229.1013 4000.0 231.081 3000.0 233.0963 46000.0 234.673 2500.0 235.0739 11000.0 235.0781 40000.0 235.1119 480000.0 237.0917 3000.0 241.4535 2600.0 241.4717 2600.0 245.07 6200.0 245.0962 270000.0 247.0741 4400.0 247.112 23000.0 248.058 2800.0 248.0833 100000.0 251.1056 3700.0 261.0907 17000.0 263.1066 490000.0 264.0756 5400.0 265.0873 7100.0 265.1223 10000.0 265.7325 2400.0 275.107 34000.0 278.0942 54000.0 289.0864 2600.0 291.1016 2900.0 293.1174 270000.0 305.1187 3400.0 308.0716 4100.0 308.1047 770000.0 317.7413 3300.0 321.5409 2400.0 323.0817 4700.0 323.1283 1200000.0 323.1644 2600.0 323.1724 22000.0 323.192 6400.0 326.1145 11000.0 END IONS BEGIN IONS SCANS=866 PEPMASS=871.5724 CHARGE=1 COLLISION_ENERGY=0.0 77.5552 2700.0 83.0848 18000.0 85.1007 2300.0 88.3047 2300.0 91.9641 2100.0 93.5334 2400.0 95.8813 3400.0 96.8426 9200.0 97.5206 2400.0 113.8275 4200.0 117.2932 2300.0 133.3083 7100.0 133.3183 12000.0 143.3039 2200.0 148.0615 2800.0 148.0726 3200.0 148.3127 13000.0 148.3243 13000.0 157.0075 2500.0 173.5274 51000.0 173.5365 47000.0 177.1161 2300.0 206.5068 2900.0 218.5299 2700.0 221.7522 2400.0 257.198 3700.0 344.0567 3300.0 348.136 2100.0 431.1821 2900.0 433.2395 16000.0 434.2416 3300.0 445.2057 6900.0 447.2131 15000.0 459.2174 600000.0 460.2227 540000.0 461.2301 240000.0 462.2387 33000.0 473.2323 39000.0 474.239 7500.0 475.2451 4900.0 476.2546 14000.0 477.2481 3300.0 478.3554 3100.0 485.232 2800.0 486.2402 19000.0 487.2437 44000.0 488.2209 24000.0 488.2501 4200.0 489.2586 20000.0 489.2699 4100.0 491.2435 82000.0 492.2505 210000.0 493.2545 110000.0 501.2281 6700.0 503.2428 29000.0 504.2465 51000.0 505.2239 99000.0 506.2281 47000.0 515.241 30000.0 516.2488 41000.0 517.247 57000.0 518.229 32000.0 519.1479 7000.0 519.2383 460000.0 519.3285 4300.0 520.1119 3400.0 520.151 4700.0 520.2428 520000.0 521.249 91000.0 531.2381 320000.0 532.1483 8500.0 532.2427 610000.0 532.3362 3900.0 533.0142 3700.0 533.0659 8200.0 533.2538 5400000.0 533.3527 3600.0 533.4451 11000.0 534.257 410000.0 547.2716 23000.0 548.2784 51000.0 549.2684 40000.0 550.2522 13000.0 559.233 15000.0 560.2402 140000.0 561.2468 140000.0 562.2278 9600.0 563.2339 12000.0 564.2484 60000.0 565.279 100000.0 575.2523 3700.0 575.2647 38000.0 577.2448 100000.0 578.2487 73000.0 591.26 150000.0 592.0467 6900.0 592.2672 3700000.0 592.3811 3900.0 592.4902 8300.0 593.0535 46000.0 593.0961 11000.0 593.2748 7700000.0 593.4477 34000.0 593.499 50000.0 593.5624 7200.0 594.2756 29000.0 697.5482 4500.0 811.5534 12000.0 839.5442 15000.0 856.5468 5800.0 871.5705 290000.0 END IONS BEGIN IONS SCANS=867 PEPMASS=870.566 CHARGE=1 COLLISION_ENERGY=0.0 88.0185 2300.0 92.7004 2100.0 93.5066 2300.0 96.1774 2100.0 102.4121 2300.0 108.1365 2300.0 110.0206 2200.0 112.0323 2200.0 113.9509 2500.0 113.96 2300.0 133.5384 2400.0 140.1817 2400.0 148.0751 2300.0 173.526 6500.0 173.5378 27000.0 183.8424 2400.0 188.6861 2700.0 259.3507 2400.0 328.9689 2600.0 367.1147 2600.0 433.2387 12000.0 434.2465 2900.0 447.2579 6600.0 459.2175 620000.0 460.1506 4000.0 460.225 280000.0 461.233 55000.0 464.8045 2400.0 472.973 3100.0 473.1938 3000.0 473.2395 4400.0 474.2407 4300.0 475.2513 5300.0 485.2349 9000.0 486.2408 29000.0 487.2166 39000.0 488.2521 32000.0 489.2625 7500.0 489.2682 2700.0 491.2429 67000.0 492.2514 220000.0 501.23 18000.0 503.2439 81000.0 504.2465 2800.0 505.2235 110000.0 515.2431 20000.0 516.2511 72000.0 517.2252 33000.0 518.2298 15000.0 519.1467 5400.0 519.2386 730000.0 519.3316 7900.0 520.2471 190000.0 531.2384 870000.0 532.2462 120000.0 533.2541 790000.0 547.2688 7000.0 548.2775 72000.0 549.2491 22000.0 553.0486 2700.0 559.234 44000.0 560.2414 140000.0 562.2241 6500.0 563.2667 4800.0 564.2722 16000.0 574.2588 2900.0 575.2652 3400.0 577.2442 100000.0 591.2601 450000.0 592.2675 1200000.0 592.3806 5600.0 593.2753 75000.0 838.5373 21000.0 855.5398 9900.0 870.5637 88000.0 END IONS BEGIN IONS SCANS=868 PEPMASS=205.1954 CHARGE=1 COLLISION_ENERGY=0.0 41.0385 100000.0 43.0178 5200.0 43.0541 63000.0 44.09 2100.0 46.7352 2400.0 48.8283 2600.0 49.9027 2000.0 50.3496 2600.0 51.5205 2700.0 52.571 2500.0 53.0385 33000.0 53.4747 2400.0 54.5975 2600.0 55.054 510000.0 56.3135 2600.0 57.0697 130000.0 58.8938 2300.0 59.5185 2300.0 60.1506 2400.0 60.6211 2400.0 60.6432 2600.0 61.9648 2300.0 62.5948 2500.0 63.4634 2400.0 64.2583 2900.0 65.0385 6200.0 65.5267 2400.0 67.0539 350000.0 68.6448 2200.0 69.0001 2300.0 69.0696 750000.0 69.0738 4600.0 69.5099 2400.0 71.0852 17000.0 72.937 21000.0 73.6236 2400.0 74.6709 2200.0 75.5923 2300.0 77.0386 28000.0 78.3217 2600.0 79.0539 590000.0 79.0595 5400.0 79.4892 2500.0 79.776 2600.0 80.0618 2700.0 81.0696 2400000.0 81.076 20000.0 81.0783 12000.0 83.0852 120000.0 85.5513 2400.0 88.872 2200.0 90.9475 15000.0 91.0539 280000.0 93.0696 2900000.0 93.0785 24000.0 93.0802 11000.0 93.0835 4800.0 93.0886 2100.0 95.0488 69000.0 95.0852 730000.0 95.0927 5400.0 95.3869 2700.0 97.1009 77000.0 103.0542 3400.0 105.0445 19000.0 105.0617 2600.0 105.0696 240000.0 106.0754 6200.0 107.0852 1000000.0 109.0644 16000.0 109.0928 7400.0 109.1009 420000.0 111.1162 2500.0 113.9635 50000.0 116.0769 2400.0 116.4163 2600.0 117.0697 38000.0 117.3531 2800.0 118.382 2400.0 119.0853 64000.0 119.6562 2300.0 121.1009 3800000.0 121.1097 65000.0 121.1215 16000.0 123.0801 260000.0 123.1165 190000.0 128.0616 3300.0 129.0696 120000.0 133.0756 5700.0 133.101 6400.0 135.044 4300.0 135.1166 270000.0 137.1325 18000.0 142.3638 2200.0 144.0572 6200.0 145.0645 100000.0 145.1016 2400.0 147.0799 12000.0 147.1162 6200.0 149.1199 3000.0 149.1323 500000.0 149.1464 3500.0 154.5445 2400.0 155.6734 2900.0 157.0647 60000.0 162.1357 6500.0 163.1483 47000.0 164.1372 2700.0 171.0087 2700.0 173.5224 31000.0 173.5379 99000.0 174.0676 28000.0 174.3111 2300.0 175.0752 26000.0 185.7244 2300.0 187.0752 66000.0 191.5091 2700.0 205.1581 3600.0 205.1955 11000.0 215.1617 2800.0 215.5778 2300.0 END IONS BEGIN IONS SCANS=869 PEPMASS=587.5493 CHARGE=1 COLLISION_ENERGY=0.0 63.0497 2300.0 65.2806 12000.0 65.2833 300000.0 65.4682 2400.0 67.6592 2900.0 67.7063 2400.0 68.1058 2000.0 68.8621 2200.0 69.1624 2300.0 70.6532 2900.0 71.0623 2100.0 71.5238 2500.0 72.625 2300.0 75.1931 2100.0 75.3643 2600.0 76.4018 2200.0 78.2489 2500.0 78.867 2500.0 79.136 2100.0 80.2177 2700.0 80.2401 2600.0 80.8455 2400.0 81.6002 2700.0 84.508 2400.0 84.6906 2600.0 85.1812 2400.0 86.6095 2400.0 88.3556 2100.0 88.5233 2200.0 88.9721 2400.0 89.0592 9100.0 89.1532 2200.0 92.3482 2900.0 97.9363 2500.0 98.1036 2400.0 102.2278 2300.0 104.1858 2600.0 107.085 2500.0 107.7846 2200.0 107.9433 2100.0 109.4618 2400.0 111.1113 2500.0 111.7721 2600.0 111.9851 2400.0 112.2157 2100.0 114.1166 2300.0 119.1166 2200.0 119.1502 2100.0 121.0983 2600.0 121.9562 2500.0 122.0663 3300.0 123.3239 2100.0 124.9643 2200.0 126.3375 2400.0 126.4117 2300.0 127.9355 2400.0 128.5217 2200.0 130.0336 2100.0 130.1643 2400.0 131.5112 3000.0 133.0855 3200.0 133.6817 2400.0 134.1949 2500.0 135.6698 2100.0 140.2132 2700.0 146.881 2600.0 146.8933 5500.0 149.681 7700.0 149.692 9700.0 165.9159 2300.0 168.1443 2400.0 172.8015 2500.0 172.855 2300.0 173.5221 9400.0 173.5337 340000.0 173.5491 2300.0 174.6872 2600.0 175.7675 2400.0 186.4324 2600.0 193.7831 2500.0 198.904 2300.0 199.2808 2200.0 202.9274 2600.0 203.8664 2700.0 204.3425 2300.0 205.1663 2500.0 205.4917 2400.0 232.2119 2800.0 239.507 2600.0 241.5218 2400.0 242.0416 2300.0 248.8316 2500.0 253.3494 2400.0 260.2709 2300.0 277.7798 2200.0 282.0877 2600.0 282.7912 2300.0 286.5987 2800.0 294.5876 2700.0 303.3437 2300.0 307.8511 2400.0 316.397 2400.0 334.5417 2600.0 336.836 2500.0 359.7122 2900.0 361.8897 2500.0 363.7084 3000.0 378.6411 2500.0 382.3721 2300.0 385.1583 2900.0 387.8464 2600.0 397.3838 2400.0 418.2571 2500.0 422.7269 2700.0 429.3858 5800.0 444.3644 2400.0 461.9099 2500.0 472.043 2600.0 478.7024 2400.0 485.8189 2500.0 530.7207 2800.0 547.0746 2700.0 566.3757 2600.0 587.3294 5900.0 587.4391 11000.0 587.5482 7700000.0 587.6588 6300.0 587.7696 3800.0 END IONS BEGIN IONS SCANS=870 PEPMASS=567.4201 CHARGE=1 COLLISION_ENERGY=0.0 65.358 2500.0 67.054 12000.0 69.0331 2900.0 69.0696 14000.0 73.0501 2400.0 73.2995 2200.0 79.0539 14000.0 79.5252 2200.0 81.0695 48000.0 83.0487 6500.0 83.0852 4400.0 85.0644 2700.0 91.0539 17000.0 92.5542 2600.0 93.0649 2100.0 93.0695 54000.0 95.0488 9500.0 95.0852 34000.0 97.0644 5100.0 100.4237 2400.0 105.0627 3600.0 105.0695 87000.0 107.0852 58000.0 109.0641 3000.0 109.1009 42000.0 111.0801 10000.0 117.0697 8600.0 119.0852 89000.0 121.1008 73000.0 123.0801 9200.0 123.1166 10000.0 124.4265 2400.0 125.0957 4300.0 130.077 2800.0 131.0853 24000.0 133.1009 80000.0 135.0799 3400.0 135.1165 33000.0 137.0958 24000.0 142.077 3000.0 143.0851 24000.0 145.1008 72000.0 147.0803 2500.0 147.1165 52000.0 151.1116 8100.0 155.0857 7300.0 156.0934 3600.0 157.101 44000.0 158.1091 2300.0 159.1165 37000.0 161.0957 5200.0 161.1329 6500.0 169.1009 23000.0 171.1164 28000.0 172.1226 2400.0 173.0313 2400.0 173.1324 31000.0 173.5249 16000.0 173.5338 22000.0 173.5449 11000.0 175.148 14000.0 179.0852 2800.0 181.1011 8200.0 182.1084 2800.0 183.1171 24000.0 185.1322 20000.0 187.1476 12000.0 193.1004 6000.0 195.1166 16000.0 196.125 2500.0 197.1323 23000.0 199.1478 17000.0 201.1635 2700.0 206.4726 2300.0 207.1168 9200.0 208.1249 4200.0 209.1326 20000.0 210.138 2700.0 211.1483 21000.0 219.117 2500.0 220.1242 6600.0 221.1326 13000.0 223.1484 15000.0 235.1485 4000.0 261.1661 3000.0 263.1772 6000.0 265.194 2400.0 282.2798 20000.0 283.2832 39000.0 284.2862 22000.0 299.3077 2700.0 300.3095 3100.0 309.3253 3000.0 310.3112 17000.0 311.3143 40000.0 312.3178 24000.0 328.3402 2700.0 337.2479 2800.0 352.3225 2500.0 366.2081 2400.0 454.4991 2400.0 502.4044 2500.0 567.2985 19000.0 END IONS BEGIN IONS SCANS=871 PEPMASS=610.6251 CHARGE=1 COLLISION_ENERGY=0.0 64.0861 2000.0 64.5863 2400.0 68.1971 2100.0 71.0849 2900.0 77.1743 2500.0 77.5749 2400.0 80.2557 2400.0 80.2865 2300.0 82.9121 3100.0 88.8642 2300.0 94.1545 2400.0 95.0854 13000.0 95.5215 2300.0 97.101 2400.0 99.0646 2100.0 100.6518 2400.0 105.1644 2600.0 106.8457 2500.0 107.5819 2000.0 109.1 2400.0 111.6787 2800.0 117.7187 2500.0 118.8408 2600.0 120.5925 2600.0 127.226 2100.0 128.7473 2400.0 131.7032 2200.0 147.2144 2200.0 149.6821 4100.0 149.6924 4400.0 151.6094 2300.0 162.4232 2300.0 170.5081 2300.0 173.5272 110000.0 173.5432 61000.0 174.4068 2400.0 181.2297 2300.0 185.5725 2600.0 195.2516 2400.0 199.1459 2900.0 217.0534 2300.0 242.2804 2400.0 250.7673 2400.0 260.6291 2700.0 262.1229 2800.0 276.4529 2300.0 281.2953 610000.0 281.3313 4400.0 282.2036 3400.0 282.2791 2600000.0 282.3159 16000.0 283.2825 12000.0 285.0103 2400.0 299.2685 5200.0 299.3057 570000.0 299.3447 11000.0 300.3098 2900.0 308.2953 14000.0 309.2902 14000.0 309.3266 600000.0 310.2675 11000.0 310.2795 8200.0 310.3105 2600000.0 313.2728 8000.0 322.6875 2400.0 327.3369 530000.0 337.274 8400.0 346.1705 2700.0 375.6155 2500.0 375.7675 2700.0 376.4943 2700.0 380.9055 2400.0 407.824 2700.0 437.75 3100.0 452.4535 2900.0 452.7443 2700.0 469.9238 2900.0 559.902 2700.0 565.5652 15000.0 END IONS BEGIN IONS SCANS=872 PEPMASS=565.5673 CHARGE=1 COLLISION_ENERGY=0.0 62.0756 2100.0 62.1571 2400.0 64.2286 2800.0 65.114 2200.0 65.2234 2200.0 65.3287 2700.0 67.0538 9600.0 67.1503 2200.0 69.0695 2700.0 69.1232 2600.0 70.5695 55000.0 70.5718 4600.0 71.0419 3000.0 71.0853 54000.0 72.3561 2200.0 72.7064 2900.0 72.9176 2300.0 73.0367 2100.0 73.301 2300.0 73.8513 2400.0 74.2083 2100.0 74.892 2300.0 76.7203 2200.0 77.5772 61000.0 77.5796 3900.0 77.9177 2200.0 79.8068 2300.0 80.772 2100.0 80.8682 2400.0 80.9695 2400.0 81.0696 22000.0 81.207 2300.0 82.7498 2400.0 83.0852 18000.0 83.2243 2500.0 83.9824 2100.0 84.4601 2300.0 85.101 29000.0 89.6567 2500.0 91.0426 2500.0 94.8032 2700.0 95.0853 48000.0 95.4912 2400.0 97.1012 2900.0 97.9207 2500.0 98.0627 4700.0 98.1303 2400.0 101.7919 2200.0 101.9738 2900.0 102.2344 2700.0 102.2563 2400.0 103.1817 2500.0 103.2123 2100.0 103.5204 2400.0 104.5179 2300.0 105.008 2500.0 109.0615 2200.0 109.1009 17000.0 109.6611 2700.0 110.3881 2300.0 111.126 2700.0 111.135 2500.0 111.7693 2100.0 112.3271 2500.0 114.0603 2600.0 114.6999 2300.0 119.0856 3100.0 119.9956 2200.0 122.0616 2400.0 123.1171 3000.0 123.7583 2300.0 124.7133 2400.0 124.7782 2500.0 131.1649 2800.0 134.1829 2200.0 137.1375 2600.0 138.3647 2300.0 138.6177 2600.0 139.4393 2900.0 141.6845 2200.0 141.7229 2400.0 142.5487 2200.0 142.7439 2300.0 145.1004 2700.0 146.8178 2500.0 147.724 2600.0 148.617 2300.0 155.4559 2600.0 156.2449 2700.0 156.8346 3500.0 167.2138 2400.0 168.6876 2600.0 173.5229 98000.0 173.5374 270000.0 187.3704 2400.0 193.088 2500.0 200.6896 2300.0 211.1946 2400.0 211.861 2700.0 218.1495 2200.0 230.8297 2400.0 231.0553 2500.0 239.6391 2300.0 241.0426 2700.0 243.3807 2500.0 245.9245 2500.0 257.2287 2800.0 267.4435 2400.0 276.9807 2800.0 278.5076 2400.0 281.2585 26000.0 281.2954 3400000.0 281.3311 13000.0 282.1856 7900.0 282.2065 120000.0 282.2205 46000.0 282.2426 4600.0 282.2791 19000000.0 282.3163 4300.0 282.3375 42000.0 282.3525 97000.0 298.7331 2800.0 299.2752 2200.0 299.3059 1700000.0 299.3444 5700.0 300.2658 2700.0 301.2866 2700.0 307.6499 2800.0 309.2845 32000.0 309.2966 4300.0 309.3267 3400000.0 309.368 19000.0 310.2261 97000.0 310.2458 70000.0 310.2797 48000.0 310.3106 19000000.0 310.3783 8100.0 310.3943 96000.0 310.418 13000.0 327.2924 20000.0 327.337 1500000.0 327.371 2600.0 331.8257 2300.0 335.0652 2500.0 349.9879 3300.0 361.1826 2400.0 366.6606 2700.0 373.8409 2500.0 390.6766 2900.0 391.502 3000.0 397.1122 2500.0 410.4055 2600.0 413.3027 2600.0 416.1871 3000.0 422.697 2600.0 447.8319 2700.0 465.729 2800.0 482.07 2400.0 493.7944 2600.0 554.4422 2700.0 565.6119 48000.0 END IONS BEGIN IONS SCANS=873 PEPMASS=566.5706 CHARGE=1 COLLISION_ENERGY=0.0 70.0633 2600.0 81.0692 3100.0 82.117 2700.0 85.5091 2300.0 93.0692 3900.0 95.0847 4600.0 97.774 2600.0 109.1004 2600.0 119.0852 4900.0 126.5598 2600.0 131.085 3400.0 133.101 3300.0 143.0846 3600.0 145.1007 4600.0 147.1155 4700.0 157.1006 5400.0 165.6931 2500.0 171.1167 3100.0 173.5228 12000.0 173.5299 27000.0 173.5419 14000.0 177.0547 2500.0 185.1323 4000.0 197.1305 3600.0 248.9904 2900.0 250.5687 2600.0 281.2956 41000.0 282.2794 220000.0 283.2827 240000.0 299.3051 16000.0 300.3092 15000.0 309.3269 40000.0 310.3113 200000.0 311.3139 270000.0 327.3379 17000.0 328.3407 20000.0 349.5651 2900.0 411.5236 2400.0 431.8867 2900.0 END IONS BEGIN IONS SCANS=874 PEPMASS=584.4217 CHARGE=1 COLLISION_ENERGY=0.0 67.0541 26000.0 67.2224 2300.0 68.4316 2200.0 69.0333 5800.0 69.0696 30000.0 71.0487 3000.0 71.0852 3500.0 73.0284 13000.0 75.1384 3000.0 79.0539 40000.0 80.0618 9900.0 81.0696 120000.0 83.049 18000.0 83.0852 19000.0 83.7399 2700.0 85.0649 2600.0 85.2516 2200.0 87.0438 16000.0 89.0594 260000.0 91.0539 42000.0 91.1452 2200.0 91.4817 2500.0 93.0694 160000.0 94.073 2300.0 95.0488 45000.0 95.0852 95000.0 97.0646 31000.0 105.0696 180000.0 106.0733 3400.0 107.0852 140000.0 108.0888 5500.0 109.0645 27000.0 109.1009 98000.0 111.08 16000.0 111.371 2400.0 113.0958 3600.0 114.6765 3200.0 115.2863 2100.0 117.0696 24000.0 119.0766 3700.0 119.0852 260000.0 120.088 3200.0 121.0639 3500.0 121.1008 180000.0 122.1042 17000.0 123.0801 93000.0 123.1168 23000.0 123.874 2400.0 125.0587 13000.0 125.0957 10000.0 126.73 2500.0 129.0699 10000.0 129.315 2700.0 131.0853 100000.0 132.0928 24000.0 133.0857 130000.0 133.1009 180000.0 134.1044 12000.0 135.0803 36000.0 135.1166 68000.0 137.0959 50000.0 138.1037 6400.0 139.1116 27000.0 141.1341 2400.0 142.0782 2800.0 143.0852 100000.0 144.0928 31000.0 145.0889 7200.0 145.1009 320000.0 146.1056 32000.0 147.0801 49000.0 147.1165 99000.0 148.1196 8900.0 149.0962 21000.0 149.1324 6600.0 151.0753 34000.0 151.1112 18000.0 152.1605 2600.0 155.0852 17000.0 156.0198 2600.0 156.0926 19000.0 157.1009 200000.0 158.1081 56000.0 159.0805 19000.0 159.1166 160000.0 160.0881 77000.0 160.123 5800.0 161.0961 41000.0 161.1323 38000.0 163.1114 52000.0 165.0908 170000.0 166.0947 9800.0 167.0853 2400.0 167.1064 35000.0 169.1011 75000.0 170.1073 16000.0 171.1167 140000.0 172.1235 26000.0 173.0958 18000.0 173.1325 96000.0 173.5244 32000.0 173.5361 120000.0 174.1376 15000.0 175.1113 26000.0 175.148 47000.0 176.1203 3000.0 177.0901 2700.0 177.1125 4100.0 177.1276 3200.0 180.1137 7100.0 181.101 33000.0 181.122 40000.0 182.1081 10000.0 182.5432 2900.0 183.1168 82000.0 184.1234 16000.0 185.1323 96000.0 186.1389 19000.0 187.1118 6200.0 187.1481 47000.0 189.1272 26000.0 190.1348 25000.0 191.1064 8800.0 191.143 29000.0 193.1015 15000.0 193.1219 19000.0 194.1083 9900.0 195.1167 68000.0 195.1352 3100.0 196.1233 21000.0 197.1324 110000.0 198.1384 17000.0 199.1117 8400.0 199.1481 37000.0 201.1267 14000.0 201.164 8100.0 203.143 81000.0 204.1479 5000.0 207.1173 24000.0 207.138 29000.0 208.1234 12000.0 208.1446 12000.0 209.1324 84000.0 210.1382 20000.0 211.1481 73000.0 212.1536 5600.0 213.1278 8100.0 213.1631 14000.0 215.1425 3900.0 216.1485 3000.0 217.1576 2500.0 219.139 2800.0 221.1321 33000.0 221.1538 160000.0 222.1388 2900.0 222.1566 5100.0 223.1485 57000.0 224.1535 3400.0 225.1639 38000.0 227.1434 4400.0 227.1785 3100.0 233.1314 3300.0 234.1614 19000.0 235.1479 34000.0 237.1292 3500.0 237.1639 36000.0 238.168 6600.0 239.1805 7100.0 241.1583 2800.0 247.1692 21000.0 248.1561 3100.0 249.164 8300.0 251.1784 19000.0 253.1588 3500.0 253.1922 3200.0 255.1759 2900.0 259.1699 31000.0 260.1769 2600.0 261.1604 3400.0 263.1787 15000.0 265.1939 9700.0 266.2031 21000.0 267.1744 5300.0 271.1691 3500.0 272.1767 2400.0 273.1855 2700.0 273.197 2500.0 274.1091 2700.0 274.1933 8000.0 275.1785 6100.0 281.1904 3000.0 283.2042 3400.0 283.2822 2900.0 286.1165 2700.0 286.1915 18000.0 287.201 55000.0 291.2107 3300.0 297.1847 3200.0 299.2015 18000.0 300.2079 10000.0 311.2004 2600.0 312.2091 2900.0 325.2175 2900.0 327.0812 2400.0 337.2153 20000.0 351.2307 3900.0 352.2393 61000.0 353.2464 31000.0 354.2515 7700.0 356.3028 2800.0 365.2472 50000.0 366.2543 12000.0 403.3059 2500.0 404.4293 2500.0 449.4476 2500.0 491.3511 26000.0 492.3557 69000.0 492.8877 2500.0 504.3598 37000.0 535.6949 2300.0 571.0925 2500.0 575.5451 2300.0 584.4216 3700.0 END IONS BEGIN IONS SCANS=875 PEPMASS=619.2921 CHARGE=1 COLLISION_ENERGY=0.0 65.4838 2400.0 66.3058 2900.0 68.8087 28000.0 68.812 4800.0 72.2267 2500.0 72.8781 2200.0 75.8253 2600.0 79.3595 2800.0 81.0701 2900.0 81.4734 2300.0 88.4358 2200.0 92.2592 2300.0 110.905 2800.0 119.4905 3300.0 157.2281 2800.0 172.8428 2700.0 173.5228 27000.0 173.5393 45000.0 209.841 2400.0 213.2377 2900.0 219.9874 2400.0 230.4471 2300.0 238.8281 2500.0 252.7262 2600.0 277.8203 2300.0 282.5424 2300.0 328.86 2300.0 341.3073 3800.0 360.228 2600.0 399.1661 2300.0 417.6016 2700.0 473.2338 26000.0 485.2331 12000.0 487.2494 40000.0 488.2572 21000.0 503.2441 12000.0 531.2395 25000.0 532.2467 7700.0 559.2702 200000.0 560.2782 31000.0 587.266 35000.0 591.2609 120000.0 591.3522 4000.0 619.2912 810000.0 619.4149 2900.0 END IONS BEGIN IONS SCANS=876 PEPMASS=323.1283 CHARGE=1 COLLISION_ENERGY=0.0 49.0797 2200.0 52.7735 2200.0 53.0383 2400.0 55.0176 12000.0 55.2539 2200.0 65.6078 2400.0 71.8018 2400.0 73.27 2500.0 77.0388 11000.0 79.054 22000.0 91.0539 30000.0 93.0696 8200.0 95.0183 2300.0 95.0489 20000.0 103.0539 78000.0 105.033 3800.0 105.0443 4300.0 105.0696 120000.0 107.0486 55000.0 115.0541 15000.0 117.0696 22000.0 119.0487 17000.0 121.0553 3200.0 121.0645 100000.0 128.0621 3500.0 129.0697 14000.0 131.0489 630000.0 131.0586 3600.0 131.0597 7000.0 132.0566 7000.0 133.0645 850000.0 133.0748 8500.0 135.0438 1700000.0 135.054 16000.0 135.0626 11000.0 137.0595 8900.0 141.0695 2900.0 143.0489 34000.0 143.0852 16000.0 144.0572 4200.0 145.0645 100000.0 148.0515 7000.0 149.046 11000.0 149.0594 270000.0 149.071 2900.0 151.0754 3100.0 157.0646 43000.0 159.044 16000.0 160.0517 33000.0 161.0595 690000.0 161.071 6600.0 161.0914 3000.0 163.0754 27000.0 169.0645 5900.0 171.0447 2600.0 171.0802 33000.0 172.0525 4500.0 173.0597 110000.0 173.5193 4100.0 173.5312 28000.0 174.0672 3900.0 175.0757 25000.0 179.0848 2700.0 185.0597 59000.0 186.0674 67000.0 187.0577 4300.0 187.0752 87000.0 187.0923 3300.0 193.1014 3000.0 194.0729 3000.0 199.0748 4300.0 201.0907 25000.0 207.0796 9200.0 207.1169 8200.0 217.1013 24000.0 220.0881 14000.0 221.0965 6200.0 229.2949 2600.0 233.0944 8300.0 235.0747 2900.0 235.0844 2900.0 235.1119 74000.0 245.0957 40000.0 247.112 3300.0 248.0833 20000.0 263.1067 73000.0 265.1243 2400.0 275.1073 6700.0 278.0944 4200.0 291.1009 3000.0 293.1173 44000.0 308.1048 130000.0 313.0815 2700.0 323.1285 180000.0 326.1156 3300.0 END IONS BEGIN IONS SCANS=877 PEPMASS=663.4545 CHARGE=1 COLLISION_ENERGY=0.0 68.6496 2400.0 72.8977 3100.0 73.6239 2200.0 74.2663 2500.0 74.3327 2400.0 75.3417 2600.0 76.2983 2400.0 78.9626 2100.0 81.1011 2600.0 86.3038 2600.0 86.5016 2500.0 87.0978 2100.0 87.4752 2400.0 88.6855 2500.0 89.588 2400.0 96.9248 2100.0 98.1925 2700.0 100.0521 2300.0 103.8366 2300.0 107.1305 2600.0 110.8743 2400.0 112.2924 2200.0 112.5982 2200.0 119.0838 2600.0 128.2009 2600.0 131.8036 2800.0 144.5446 2500.0 146.6585 2400.0 147.117 3300.0 149.2796 2100.0 149.6721 3300.0 149.6822 4300.0 149.7032 3500.0 153.875 2300.0 154.774 2400.0 157.4822 2600.0 160.091 2400.0 173.5238 90000.0 173.5424 120000.0 176.7992 2700.0 188.0861 2500.0 192.9053 2400.0 211.5136 2700.0 216.2829 2100.0 241.0785 2600.0 251.0467 9400.0 261.5096 2500.0 281.2764 2800.0 295.0612 2400.0 307.1097 15000.0 327.078 170000.0 339.5422 2700.0 363.172 13000.0 382.5083 2500.0 383.1409 640000.0 383.1978 14000.0 439.1022 3500.0 439.2031 2300000.0 481.9989 2700.0 483.0013 2700.0 483.096 2200.0 484.5492 2700.0 495.2005 3400.0 495.2651 4800000.0 496.2666 2900.0 526.2087 2700.0 534.6275 2400.0 551.3283 670000.0 551.4261 3700.0 607.3919 32000.0 621.7942 2700.0 645.3411 2800.0 END IONS BEGIN IONS SCANS=878 PEPMASS=680.481 CHARGE=1 COLLISION_ENERGY=0.0 67.0746 2200.0 68.9794 2300.0 69.7282 2300.0 73.5707 2400.0 73.7532 2500.0 76.2477 4800.0 78.4101 2400.0 79.6241 2200.0 80.1767 2400.0 82.9268 2200.0 84.3911 3000.0 86.3782 2300.0 88.3747 2600.0 90.6299 2400.0 92.2489 2600.0 95.5647 2300.0 96.3066 2600.0 99.3456 2500.0 108.2242 2100.0 109.7869 2400.0 111.2282 2300.0 116.0781 2200.0 124.6824 2500.0 126.6638 2700.0 135.9212 2200.0 138.6075 2100.0 139.5303 2300.0 149.6833 5100.0 149.6934 4300.0 164.6189 2400.0 169.8023 2200.0 173.3165 2600.0 173.5245 89000.0 173.5404 77000.0 182.1122 2300.0 188.2554 2700.0 195.6119 2400.0 209.1566 3000.0 211.9854 2600.0 223.706 2400.0 227.6562 2800.0 227.8689 2900.0 241.5627 2400.0 277.0699 2500.0 282.8149 2900.0 291.6202 2400.0 295.6397 2500.0 327.0777 21000.0 334.8299 2700.0 338.0374 2500.0 347.5876 2500.0 353.9821 2900.0 383.1407 130000.0 395.5779 2500.0 395.6216 2900.0 400.4029 2700.0 439.2031 680000.0 486.0945 2500.0 491.8739 2700.0 495.1451 4000.0 495.2654 2600000.0 531.841 2500.0 535.5344 2600.0 551.2277 2400.0 551.3284 950000.0 551.4253 4600.0 552.4612 3000.0 607.3904 150000.0 617.1117 2600.0 624.2827 2600.0 663.4559 3900.0 680.4286 2400.0 END IONS BEGIN IONS SCANS=879 PEPMASS=621.3069 CHARGE=1 COLLISION_ENERGY=0.0 65.4762 25000.0 65.9208 160000.0 66.776 5900.0 67.6761 34000.0 68.8302 25000.0 69.0337 1900000.0 69.0366 310000.0 77.7709 4100.0 85.2656 33000.0 89.0078 42000.0 101.5093 6100.0 102.7033 32000.0 105.8006 3900.0 126.059 34000.0 133.7634 32000.0 138.7319 33000.0 140.3156 82000.0 140.328 36000.0 147.5434 8600.0 151.4656 31000.0 155.3194 75000.0 155.3338 70000.0 161.0392 27000.0 173.5197 63000.0 173.5376 720000.0 176.2116 7800.0 181.7646 4300.0 193.8562 31000.0 240.6224 30000.0 252.9787 7500.0 264.0071 6600.0 268.9718 7300.0 283.1401 3900.0 315.1678 6700.0 360.783 4600.0 373.5623 9100.0 379.2455 36000.0 381.3627 4000.0 390.3597 7800.0 405.2082 7400.0 417.2071 42000.0 418.2168 9900.0 419.222 18000.0 431.1869 370000.0 432.1935 31000.0 433.2387 840000.0 434.2462 150000.0 445.2025 280000.0 446.2097 330000.0 447.2178 690000.0 449.2341 17000.0 452.9404 40000.0 453.7283 37000.0 459.218 1700000.0 460.1638 20000.0 460.224 4200000.0 461.2335 3800000.0 462.2384 320000.0 472.2244 10000.0 473.2335 1600000.0 473.2944 6700.0 474.2398 290000.0 475.2484 28000.0 476.2594 8800.0 477.2291 29000.0 487.2487 1100000.0 488.216 96000.0 488.2516 100000.0 489.2624 140000.0 491.2096 250000.0 492.2516 650000.0 493.2596 77000.0 499.2524 22000.0 501.2292 77000.0 502.2339 35000.0 503.2463 210000.0 504.2348 7500.0 505.2261 820000.0 506.2573 11000.0 515.2442 890000.0 516.2508 28000.0 517.261 370000.0 518.23 5700.0 518.2443 21000.0 519.2468 400000.0 520.2456 1500000.0 521.2806 7600.0 521.2913 5600.0 531.2427 21000.0 532.246 120000.0 533.2566 3100000.0 534.2619 96000.0 543.2383 51000.0 545.2715 7200.0 546.2617 390000.0 547.2709 920000.0 548.2701 14000.0 548.2831 6200.0 549.2526 4500.0 560.2476 210000.0 561.0209 28000.0 561.0798 240000.0 561.1275 34000.0 561.2865 47000000.0 561.4489 120000.0 561.4902 200000.0 561.55 35000.0 562.2898 2300000.0 563.2531 4600.0 564.2413 23000.0 565.2795 160000.0 572.2742 11000.0 574.2563 22000.0 575.1625 7800.0 575.2659 1500000.0 575.3455 6500.0 577.2468 21000.0 577.2748 7700.0 578.2852 190000.0 579.2958 30000.0 589.1701 10000.0 589.2802 1900000.0 589.3903 6900.0 591.2609 93000.0 592.2686 840000.0 593.2821 4500000.0 593.4856 8800.0 606.2814 550000.0 620.3019 26000.0 621.0658 270000.0 621.1206 88000.0 621.3073 54000000.0 621.4958 120000.0 621.545 250000.0 621.6168 35000.0 622.3063 25000.0 END IONS BEGIN IONS SCANS=880 PEPMASS=620.3005 CHARGE=1 COLLISION_ENERGY=0.0 64.0735 12000.0 64.992 5400.0 65.3633 81000.0 65.3655 12000.0 65.7621 3800.0 67.2506 8700.0 67.2533 30000.0 68.9212 100000.0 68.9244 20000.0 69.3283 11000.0 75.4846 2500.0 78.1664 9400.0 80.5955 5100.0 85.2502 5400.0 85.5787 9200.0 87.747 10000.0 94.1063 3700.0 94.4586 4200.0 104.5269 2400.0 114.8025 15000.0 114.8078 7300.0 119.264 2700.0 129.8049 2500.0 133.9677 4600.0 140.3169 7500.0 140.3269 6700.0 144.2314 3800.0 166.7575 4400.0 173.5263 150000.0 173.5408 120000.0 208.5152 2500.0 241.1063 2500.0 242.6782 5000.0 246.3869 12000.0 270.083 5800.0 277.1349 2400.0 296.1525 2900.0 299.6984 4200.0 325.0976 4100.0 355.1169 2500.0 388.2038 14000.0 400.2034 13000.0 401.2115 56000.0 414.2203 5000.0 416.2334 69000.0 419.2285 6800.0 431.1839 11000.0 432.2311 27000.0 433.2393 170000.0 434.2478 16000.0 444.1951 46000.0 445.1978 43000.0 445.2455 16000.0 446.2055 24000.0 447.2545 110000.0 449.2345 4000.0 459.0689 25000.0 459.1579 59000.0 459.2184 8400000.0 460.2263 940000.0 461.2339 760000.0 461.3031 4700.0 462.279 45000.0 471.2203 7200.0 472.2327 12000.0 473.2336 310000.0 474.2417 64000.0 475.2519 18000.0 476.2215 56000.0 477.2289 12000.0 486.2422 63000.0 487.2168 670000.0 488.2561 320000.0 489.2655 28000.0 491.2443 260000.0 492.2522 220000.0 498.2449 7200.0 500.2198 60000.0 501.2293 270000.0 503.2422 23000.0 505.2295 140000.0 514.236 32000.0 515.2452 130000.0 516.2519 52000.0 517.2561 96000.0 518.2368 29000.0 519.1584 13000.0 519.2409 5500000.0 520.1659 6400.0 520.2702 100000.0 531.2402 53000.0 532.2508 90000.0 533.2581 530000.0 534.2978 21000.0 542.2344 45000.0 544.284 4700.0 545.2556 650000.0 546.263 68000.0 547.2711 130000.0 548.2764 23000.0 549.2814 69000.0 559.2633 66000.0 560.2785 1200000.0 561.0796 30000.0 561.1286 21000.0 561.2103 22000.0 561.2868 8200000.0 561.4903 17000.0 563.254 6900.0 571.2718 94000.0 573.2512 100000.0 575.2382 5500.0 577.2783 370000.0 578.2891 23000.0 579.3021 3200.0 588.157 4500.0 588.1893 29000.0 588.2738 2000000.0 588.3801 25000.0 589.2813 30000.0 590.2532 250000.0 591.266 150000.0 592.2793 170000.0 593.2766 14000.0 602.2922 10000.0 605.1615 23000.0 605.2763 1300000.0 605.3892 23000.0 619.2907 60000.0 620.1321 17000.0 620.2998 2900000.0 621.308 220000.0 END IONS BEGIN IONS SCANS=881 PEPMASS=643.2895 CHARGE=1 COLLISION_ENERGY=0.0 65.9014 2400.0 68.1019 2300.0 68.974 2200.0 70.5754 2100.0 71.4738 5800.0 71.4768 110000.0 71.8092 2800.0 72.3223 2200.0 72.5395 2600.0 72.5576 2500.0 77.4464 2600.0 79.4961 2300.0 81.1161 2300.0 81.6053 3300.0 82.1822 2600.0 85.4327 2300.0 90.6753 2300.0 96.4303 2500.0 98.1846 2400.0 105.6301 3100.0 106.6309 2400.0 108.2921 2100.0 111.6072 2300.0 115.8292 2600.0 121.2638 2800.0 122.5383 2300.0 130.3238 2300.0 130.8413 2200.0 133.501 2400.0 135.9066 2600.0 140.3328 2500.0 146.7957 2200.0 150.0547 2500.0 160.8132 2600.0 163.8056 2700.0 164.7461 2500.0 168.6263 2300.0 169.0122 2400.0 173.5277 160000.0 173.5404 87000.0 175.9397 2400.0 181.2581 2300.0 189.6208 2500.0 194.4278 2300.0 211.3551 3200.0 216.6756 2400.0 223.1416 2500.0 231.6538 2700.0 232.9069 2700.0 257.8361 2400.0 266.2321 2900.0 289.8859 2300.0 304.1057 2500.0 316.0955 2300.0 334.3308 2600.0 342.7552 2700.0 371.1113 2700.0 375.1234 2900.0 390.0533 2500.0 434.8353 2800.0 452.8821 2500.0 467.861 2400.0 469.1967 9300.0 504.8311 2300.0 527.2018 3600.0 539.241 150000.0 541.6743 2700.0 561.8602 2900.0 583.2561 4100.0 583.2706 7400.0 589.2828 2800.0 611.2638 17000.0 643.2888 2900000.0 END IONS BEGIN IONS SCANS=882 PEPMASS=665.2969 CHARGE=1 COLLISION_ENERGY=0.0 70.8095 2400.0 82.9549 2500.0 86.4143 2400.0 91.8163 2400.0 99.1256 2400.0 119.3113 2200.0 149.6872 3600.0 161.4251 2400.0 173.5208 7700.0 173.5341 30000.0 173.5474 7900.0 174.0708 2400.0 190.5164 2500.0 226.1452 2500.0 227.8777 2300.0 261.2164 2500.0 275.1606 2400.0 325.1551 2800.0 351.1358 3200.0 376.6248 2600.0 417.4562 2600.0 458.2435 3900.0 459.2188 27000.0 460.2253 7200.0 472.2247 9000.0 473.2338 63000.0 475.2101 7800.0 476.2208 14000.0 477.2301 21000.0 485.2334 22000.0 487.2503 19000.0 488.2595 7000.0 489.2258 7500.0 496.2697 3300.0 497.2753 2900.0 503.2428 20000.0 513.2266 5700.0 515.2452 2800.0 518.2305 2400.0 519.2422 24000.0 531.2448 27000.0 532.248 2400.0 535.2425 4500.0 536.243 3700.0 545.2547 8100.0 549.276 14000.0 559.2708 380000.0 560.2782 22000.0 561.2865 50000.0 562.2555 3000.0 563.2662 4300.0 576.2725 10000.0 577.2814 230000.0 587.2652 28000.0 588.2731 12000.0 591.2883 69000.0 595.2929 5600.0 605.2766 78000.0 608.2733 3000.0 609.2859 8700.0 609.2982 6900.0 619.2917 98000.0 620.2998 57000.0 621.3059 9900.0 637.3027 160000.0 665.2977 44000.0 END IONS BEGIN IONS SCANS=883 PEPMASS=708.5119 CHARGE=1 COLLISION_ENERGY=0.0 72.6429 2700.0 73.7802 2400.0 74.4942 2400.0 75.8497 2600.0 75.955 2500.0 80.1409 2200.0 80.3507 2700.0 89.4888 2200.0 94.2998 2300.0 105.1873 2300.0 105.7072 2500.0 108.5198 2200.0 118.2974 2500.0 122.0777 2300.0 130.7858 2900.0 135.0125 2500.0 143.358 2500.0 149.657 2500.0 149.6876 4800.0 150.3964 2200.0 154.534 2600.0 157.5875 2400.0 160.4642 2700.0 160.7212 2300.0 166.0502 2400.0 171.8956 2400.0 173.5227 58000.0 173.5377 120000.0 178.1441 2600.0 184.6122 2700.0 189.5213 2700.0 190.1605 2500.0 197.9023 2400.0 205.2786 2700.0 223.3818 2600.0 234.974 2700.0 253.3808 2600.0 257.091 2300.0 270.2212 2500.0 271.6176 2300.0 299.3405 2400.0 310.4879 2600.0 327.078 22000.0 334.8044 2400.0 340.2769 2600.0 354.174 2900.0 383.1411 120000.0 439.2033 640000.0 439.6482 2500.0 466.7266 2800.0 495.2655 2700000.0 496.269 10000.0 497.2725 8200.0 526.6011 2500.0 551.2318 9000.0 551.254 4400.0 551.3285 1100000.0 551.4265 4700.0 552.3359 3500.0 553.3375 4000.0 578.0035 2900.0 607.3909 220000.0 638.7976 2700.0 663.4545 14000.0 END IONS BEGIN IONS SCANS=884 PEPMASS=470.3635 CHARGE=1 COLLISION_ENERGY=0.0 57.0697 8500.0 57.9036 2300.0 67.0539 32000.0 67.7362 3000.0 69.0695 85000.0 70.0748 2500.0 70.6352 2100.0 71.0852 4600.0 73.2845 2200.0 74.2491 2400.0 76.5481 2400.0 79.054 25000.0 79.0697 2300.0 81.0695 420000.0 81.0779 4100.0 83.0852 19000.0 89.0593 3900.0 90.2504 2400.0 90.2677 2300.0 93.0696 36000.0 95.0852 190000.0 97.1011 15000.0 100.4204 2300.0 100.9132 2400.0 105.0693 4900.0 107.0852 41000.0 109.1008 110000.0 111.1165 2500.0 115.0239 3300.0 118.2323 2800.0 119.0852 9500.0 121.1009 78000.0 123.1165 57000.0 133.1007 6500.0 135.1166 52000.0 137.1242 2000.0 137.1322 58000.0 137.9292 2500.0 141.0545 42000.0 147.117 9400.0 149.1323 67000.0 151.0751 20000.0 159.1169 12000.0 161.1316 2600.0 163.1481 17000.0 165.0546 15000.0 165.0909 6000.0 165.1626 2700.0 167.0554 4300.0 167.0703 270000.0 170.154 5500.0 171.0714 2500.0 173.5255 52000.0 173.5405 30000.0 175.0748 2600.0 175.148 4200.0 177.0914 3500.0 177.164 12000.0 179.0701 8500.0 179.1066 2500.0 181.0857 19000.0 187.1118 6200.0 189.1638 5600.0 191.0707 13000.0 191.1072 2900.0 193.0859 17000.0 203.1813 3100.0 205.0864 20000.0 205.1226 8300.0 207.1017 31000.0 215.107 21000.0 219.1018 12000.0 221.1178 12000.0 233.1177 10000.0 241.7877 2300.0 245.1185 3100.0 253.5385 2700.0 257.1526 2500.0 275.1649 3400.0 282.2795 16000.0 411.401 2600.0 419.1956 2700.0 435.8606 2500.0 END IONS BEGIN IONS SCANS=885 PEPMASS=447.2876 CHARGE=1 COLLISION_ENERGY=0.0 56.8179 2700.0 57.0696 2600.0 63.8934 2800.0 65.2935 2200.0 72.7603 2600.0 73.3351 2200.0 73.7617 2100.0 73.9982 2100.0 77.4312 2500.0 83.5177 2300.0 83.9849 2300.0 85.0668 2400.0 95.1618 2300.0 96.5051 2200.0 96.901 2500.0 100.0401 2900.0 119.0848 2200.0 124.6678 2600.0 125.7162 2400.0 127.7635 2300.0 134.4385 2300.0 136.824 2400.0 139.1762 2600.0 142.3381 2400.0 146.272 2300.0 155.5906 2700.0 172.2158 2600.0 173.3271 3000.0 173.5226 8600.0 173.5302 66000.0 173.5425 21000.0 173.5522 2500.0 180.3015 2800.0 187.017 6800.0 187.0365 2500000.0 189.0513 3400.0 205.047 11000.0 212.8032 2700.0 215.7319 2700.0 221.168 2300.0 228.0633 8600.0 251.7472 2600.0 269.8737 2400.0 272.3237 2500.0 296.9544 2700.0 296.9686 3000.0 300.3926 2400.0 307.7408 2400.0 319.3158 2700.0 330.8475 2400.0 343.2168 2700.0 347.7944 2200.0 354.892 2400.0 447.2912 18000.0 447.3944 29000.0 END IONS BEGIN IONS SCANS=886 PEPMASS=425.3056 CHARGE=1 COLLISION_ENERGY=0.0 55.0182 2900.0 55.054 240000.0 56.6663 2500.0 57.0336 2500.0 57.0697 140000.0 57.7544 2200.0 57.8815 2600.0 59.4719 2300.0 60.0342 2100.0 60.9908 2100.0 62.1793 2500.0 64.0953 2300.0 65.0385 18000.0 65.9399 2200.0 67.0178 27000.0 67.05 3700.0 67.0539 630000.0 69.0697 1100000.0 69.0735 3600.0 70.4438 2200.0 71.0491 2500.0 71.0853 50000.0 71.6465 2500.0 73.0328 2400.0 73.5628 2200.0 74.9793 2600.0 76.6236 2200.0 77.0386 7400.0 77.1099 2500.0 79.0539 400000.0 81.0698 5400000.0 81.0782 68000.0 81.0811 7700.0 82.485 2200.0 83.049 47000.0 83.0852 310000.0 85.0287 2500.0 89.0593 81000.0 89.2695 2600.0 90.0628 10000.0 91.054 120000.0 93.0631 5400.0 93.0696 870000.0 93.0767 5200.0 95.0489 73000.0 95.0854 2800000.0 97.1009 230000.0 100.5943 2600.0 105.0449 4700.0 105.0696 190000.0 107.0486 2500.0 107.0772 4500.0 107.0853 860000.0 107.0919 3500.0 109.0647 6400.0 109.0886 3500.0 109.101 1700000.0 109.1136 4100.0 110.3457 2400.0 110.9142 2300.0 111.0438 22000.0 111.0808 2300.0 111.1166 120000.0 111.7587 2400.0 113.0595 26000.0 113.879 2300.0 117.0694 13000.0 119.0491 27000.0 119.0853 250000.0 119.0946 4400.0 121.0647 39000.0 121.091 8900.0 121.101 1000000.0 123.044 8400.0 123.0804 16000.0 123.1069 12000.0 123.1166 750000.0 123.1253 2100.0 125.0597 4400.0 128.1014 2400.0 129.4497 2300.0 131.0855 48000.0 131.5289 2700.0 133.0648 20000.0 133.0866 27000.0 133.1011 190000.0 135.0804 56000.0 135.1056 4200.0 135.1167 680000.0 137.0595 140000.0 137.1204 4600.0 137.1323 480000.0 138.0674 8000.0 138.1797 2400.0 139.039 67000.0 139.0751 110000.0 141.0427 4600.0 141.0545 510000.0 141.0671 4700.0 143.0853 11000.0 143.5344 2500.0 145.1011 80000.0 146.5609 2200.0 147.0802 40000.0 147.1167 240000.0 149.0596 97000.0 149.0957 14000.0 149.1192 13000.0 149.1324 810000.0 149.1462 13000.0 151.0619 4900.0 151.0752 370000.0 151.1483 26000.0 151.9738 2800.0 153.0547 19000.0 155.2007 2300.0 157.1013 33000.0 159.0803 27000.0 159.1168 200000.0 160.0887 2400.0 161.0597 70000.0 161.0962 41000.0 161.1325 130000.0 161.7321 2400.0 163.0753 58000.0 163.1124 12000.0 163.1481 250000.0 165.0547 260000.0 165.0911 140000.0 167.0704 4800000.0 167.1035 6000.0 169.1015 12000.0 169.1699 22000.0 169.5178 2400.0 169.8862 2400.0 170.154 170000.0 171.0797 3800.0 171.1165 9900.0 172.0885 3100.0 173.0962 61000.0 173.1327 36000.0 173.5256 80000.0 173.5414 68000.0 174.1039 2900.0 175.0755 130000.0 175.1119 19000.0 175.1482 120000.0 177.0545 41000.0 177.0912 110000.0 177.1277 6800.0 177.1639 170000.0 178.0622 36000.0 179.0704 140000.0 179.0863 3300.0 179.092 2400.0 179.1069 100000.0 181.086 300000.0 181.1033 4500.0 183.1163 2400.0 185.096 10000.0 187.0756 27000.0 187.1118 110000.0 187.1483 11000.0 187.181 3000.0 188.0853 3000.0 189.0913 160000.0 189.1277 8600.0 189.1638 93000.0 189.478 2400.0 190.0987 2800.0 191.0704 250000.0 191.1067 73000.0 191.1796 51000.0 192.078 32000.0 193.0862 210000.0 193.1213 12000.0 195.101 11000.0 197.0959 5400.0 199.1116 15000.0 201.0915 91000.0 201.1273 6900.0 201.1638 22000.0 203.107 95000.0 203.1798 96000.0 204.0383 2300.0 205.0862 290000.0 205.1226 120000.0 205.1953 34000.0 206.0931 3100.0 207.1019 460000.0 211.1129 2500.0 211.1483 6800.0 213.0919 10000.0 213.1252 3100.0 214.0987 2600.0 215.107 230000.0 215.1791 3800.0 217.0857 17000.0 217.1225 34000.0 217.1956 17000.0 218.0948 3200.0 219.102 150000.0 219.1386 8600.0 221.1176 93000.0 221.6783 2600.0 227.1066 40000.0 229.123 46000.0 229.1591 9600.0 231.1021 42000.0 231.1393 10000.0 233.1176 120000.0 237.1267 2500.0 240.1136 2800.0 241.1234 18000.0 243.1387 13000.0 245.1174 71000.0 245.1416 3100.0 245.2264 29000.0 247.1335 41000.0 253.124 5300.0 254.1309 2700.0 255.1381 16000.0 257.1533 48000.0 259.1334 33000.0 259.242 53000.0 261.148 9700.0 269.1525 7300.0 271.1694 4000.0 273.1494 25000.0 275.1642 31000.0 281.2954 16000.0 282.2803 170000.0 283.1699 7600.0 287.1634 10000.0 301.1797 2700.0 310.8773 3500.0 338.357 3500.0 340.1745 2500.0 343.2319 2600.0 369.9068 2400.0 380.3418 2500.0 393.3571 2400.0 411.4879 2700.0 412.7444 2800.0 415.5596 2700.0 425.3041 28000.0 END IONS BEGIN IONS SCANS=887 PEPMASS=619.2919 CHARGE=1 COLLISION_ENERGY=0.0 68.8083 14000.0 68.8113 3400.0 74.5153 2300.0 74.6786 2300.0 78.8337 2400.0 78.909 2500.0 81.4614 2200.0 82.8791 2400.0 87.8254 2400.0 114.3 2300.0 124.4833 2600.0 129.3679 2300.0 145.6003 2500.0 154.8171 2300.0 168.5631 2400.0 173.5236 58000.0 173.5402 65000.0 204.2141 2300.0 225.2562 2400.0 302.0652 2500.0 302.2236 3000.0 343.2348 2500.0 351.9849 2700.0 376.2426 2600.0 396.894 2800.0 431.2225 12000.0 445.2025 3000.0 457.2026 22000.0 457.5622 2300.0 458.2076 74000.0 459.2186 98000.0 460.2217 6200.0 471.2177 26000.0 472.3056 2400.0 473.2323 13000.0 485.2326 22000.0 490.2287 3000.0 503.21 4700.0 513.2261 14000.0 518.2294 31000.0 519.2427 12000.0 521.8139 2900.0 531.241 43000.0 544.2447 2800.0 545.2569 8500.0 559.2701 700000.0 560.2755 43000.0 561.2844 34000.0 573.248 16000.0 587.2643 40000.0 591.267 53000.0 605.2751 4800.0 619.1743 10000.0 619.2906 490000.0 619.4112 4000.0 619.4407 8200.0 620.292 4700.0 END IONS BEGIN IONS SCANS=888 PEPMASS=643.2893 CHARGE=1 COLLISION_ENERGY=0.0 65.7348 2500.0 65.9516 2400.0 66.3471 2300.0 70.5919 2000.0 71.4757 57000.0 71.4788 12000.0 73.1333 2300.0 75.2584 2200.0 77.5602 2400.0 79.4135 2500.0 81.7168 2200.0 88.6314 2300.0 107.9206 2300.0 107.9725 2500.0 108.8737 2100.0 118.458 2500.0 120.1887 2100.0 122.3129 2300.0 129.3178 2300.0 156.9083 2100.0 157.3515 2600.0 163.814 2300.0 173.533 150000.0 173.5502 4700.0 173.5705 2800.0 183.253 2200.0 186.015 2500.0 190.0609 2600.0 196.4513 2300.0 244.3639 2500.0 292.0366 2600.0 309.0046 2900.0 309.9188 2500.0 317.1909 2500.0 362.566 2400.0 366.139 2500.0 404.4565 2300.0 447.6716 2600.0 469.1992 11000.0 483.2157 3400.0 507.0905 2600.0 514.4669 2900.0 527.2045 12000.0 536.5212 3200.0 537.225 3500.0 538.2271 2600.0 539.2404 86000.0 542.2311 7000.0 543.2354 3000.0 583.2661 25000.0 611.2657 17000.0 617.8308 2500.0 643.2888 1800000.0 END IONS BEGIN IONS SCANS=889 PEPMASS=621.3068 CHARGE=1 COLLISION_ENERGY=0.0 65.721 16000.0 65.9209 15000.0 69.0312 61000.0 69.035 370000.0 71.3075 21000.0 74.2613 14000.0 77.2839 14000.0 77.8764 18000.0 91.0264 17000.0 99.6694 8800.0 110.0459 10000.0 119.6691 8800.0 130.1258 19000.0 140.3165 29000.0 140.3264 57000.0 146.9892 9700.0 164.8265 18000.0 173.5211 63000.0 173.5357 430000.0 175.8194 10000.0 244.8217 20000.0 350.2942 18000.0 431.1855 89000.0 433.2382 410000.0 434.246 58000.0 445.1985 42000.0 446.2086 110000.0 447.2176 160000.0 449.9467 15000.0 459.2175 650000.0 460.2226 1800000.0 461.1585 32000.0 461.2326 1800000.0 462.2367 130000.0 473.2321 570000.0 474.2387 150000.0 475.2456 9900.0 487.248 460000.0 488.2122 57000.0 488.2231 31000.0 488.2535 53000.0 489.2589 64000.0 491.2128 34000.0 491.2239 11000.0 492.2504 200000.0 501.2253 9700.0 502.2323 14000.0 503.2444 77000.0 505.2254 200000.0 515.2426 330000.0 516.2461 13000.0 517.2601 180000.0 518.2351 12000.0 519.2444 130000.0 520.2442 680000.0 532.2485 39000.0 533.2562 1200000.0 534.2607 28000.0 543.2413 15000.0 546.2589 170000.0 547.27 590000.0 560.257 41000.0 561.0208 22000.0 561.0804 110000.0 561.1262 83000.0 561.2856 28000000.0 561.4885 190000.0 561.5485 36000.0 561.9056 12000.0 562.2891 1100000.0 565.2787 39000.0 572.2669 10000.0 575.2652 770000.0 578.2833 86000.0 588.277 22000.0 589.2779 470000.0 592.2695 180000.0 593.2912 1100000.0 606.2791 230000.0 621.3065 11000000.0 END IONS BEGIN IONS SCANS=890 PEPMASS=620.3004 CHARGE=1 COLLISION_ENERGY=0.0 64.1401 2500.0 65.3626 50000.0 65.3656 4900.0 67.2515 21000.0 67.2548 4800.0 68.709 4300.0 68.9209 53000.0 68.9244 8200.0 69.3127 2400.0 80.7185 4600.0 82.4499 4100.0 83.2196 2300.0 84.8509 4700.0 89.06 2700.0 89.6873 2500.0 105.6801 4200.0 108.1907 5000.0 111.0957 2400.0 114.8058 12000.0 114.8079 2700.0 116.4643 4600.0 117.5169 2900.0 128.9741 2500.0 133.0875 2800.0 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SCANS=891 PEPMASS=796.5939 CHARGE=1 COLLISION_ENERGY=0.0 71.0488 50000.0 71.0851 130000.0 71.3874 2700.0 71.998 2100.0 72.862 4300.0 73.0279 9900.0 75.953 2300.0 77.2975 2600.0 79.0538 580000.0 79.4648 2600.0 79.5068 2100.0 80.875 2200.0 81.0694 3000000.0 81.0777 23000.0 82.7949 2800.0 83.0488 67000.0 83.085 1100000.0 85.0279 100000.0 85.0643 120000.0 85.1008 110000.0 87.5771 2400.0 89.6362 2600.0 90.0749 2600.0 90.7958 2300.0 91.0386 39000.0 91.0538 350000.0 93.0694 950000.0 93.5416 2200.0 95.0488 51000.0 95.075 2600.0 95.0851 3000000.0 95.568 2800.0 96.9925 3300.0 97.028 52000.0 97.0643 250000.0 97.1007 860000.0 97.4474 2300.0 98.9511 2800.0 99.08 170000.0 99.99 2500.0 101.0591 20000.0 102.9032 2100.0 102.983 2200.0 104.9241 2700.0 105.0694 420000.0 107.0775 5300.0 107.085 830000.0 107.2744 2300.0 107.4773 2800.0 109.0643 25000.0 109.1007 1800000.0 109.1377 2300.0 110.1134 2300.0 111.08 200000.0 111.1162 240000.0 112.327 2900.0 113.073 2200.0 113.0956 100000.0 115.0743 6200.0 116.543 2200.0 116.7333 2200.0 117.0694 52000.0 118.7096 2900.0 119.0767 9200.0 119.085 520000.0 119.3248 5700.0 121.0918 15000.0 121.1006 1100000.0 121.7474 2700.0 123.0802 69000.0 123.107 32000.0 123.1163 1000000.0 124.7649 2700.0 125.0955 140000.0 125.1322 23000.0 127.0381 3400.0 127.075 5500.0 127.1115 32000.0 130.3658 2700.0 130.8887 2700.0 131.085 200000.0 131.9193 2200.0 132.6467 2500.0 133.0905 25000.0 133.1006 690000.0 135.1056 7900.0 135.1163 820000.0 135.1285 5100.0 137.0956 100000.0 137.1222 8800.0 137.1319 470000.0 139.1113 120000.0 141.1269 8200.0 143.0847 6800.0 143.1181 2600.0 145.049 3200.0 145.1006 180000.0 147.1057 2900.0 147.1163 580000.0 148.1604 2500.0 149.096 11000.0 149.1199 22000.0 149.1319 650000.0 151.1111 89000.0 151.1477 270000.0 151.1894 2400.0 151.6128 3000.0 153.1268 100000.0 153.2122 2800.0 154.1496 2300.0 154.7342 2700.0 155.1423 2800.0 157.1012 11000.0 157.5455 2400.0 159.1163 170000.0 161.1183 4700.0 161.132 610000.0 161.3319 3100.0 163.1128 8900.0 163.1326 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259.2026 2700.0 261.2208 310000.0 261.2518 10000.0 263.2038 18000.0 263.2364 820000.0 265.2528 10000.0 271.2406 3800.0 271.3033 3200.0 273.2559 3100.0 273.3317 2600.0 275.2364 73000.0 277.2171 5300.0 277.2479 5400.0 279.2305 9200.0 281.8064 3100.0 287.2387 2900.0 289.2148 2500.0 289.2529 55000.0 291.2325 2800.0 293.2479 11000.0 294.2795 4500.0 301.2527 11000.0 303.2301 3200.0 303.268 40000.0 305.2478 3100.0 310.5408 6100.0 315.1045 2600.0 317.2474 21000.0 317.2835 8200.0 319.2632 67000.0 321.2781 3200.0 326.6966 2800.0 331.261 6800.0 331.2996 6300.0 335.258 190000.0 337.2265 11000.0 337.2736 9000000.0 337.321 3000.0 337.369 3600.0 337.397 3500.0 339.2891 410000.0 347.2961 3400.0 349.2763 2900.0 359.3315 7900.0 365.264 2600.0 373.3458 14000.0 387.3647 18000.0 401.3772 5500.0 405.3769 2600.0 427.3549 2800.0 441.3667 6000.0 442.0201 5600.0 446.5235 2300.0 459.3871 2600.0 475.8719 2400.0 492.2736 2200.0 507.4565 6800.0 512.4795 3000.0 525.4655 140000.0 526.8559 5200.0 543.478 61000.0 591.5057 2500.0 596.9152 2500.0 599.4077 2100.0 599.5037 800000.0 599.6013 3200.0 617.514 66000.0 621.5573 4600.0 629.657 2800.0 727.3373 5300.0 743.4796 2500.0 748.693 2200.0 785.3446 2600.0 END IONS BEGIN IONS SCANS=892 PEPMASS=801.5494 CHARGE=1 COLLISION_ENERGY=0.0 72.109 2400.0 72.7714 2300.0 73.0278 82000.0 74.7756 2200.0 74.923 2400.0 75.4935 2300.0 75.956 2500.0 79.0537 17000.0 79.541 2400.0 80.6997 2100.0 81.0331 29000.0 81.0692 170000.0 83.085 52000.0 83.5915 2200.0 85.0277 200000.0 85.7257 2300.0 86.3228 2300.0 87.0437 9000.0 89.0571 9200.0 89.0613 140000.0 89.1001 2200.0 90.6385 2300.0 91.0382 170000.0 91.0537 5500.0 93.0694 26000.0 93.8461 2400.0 95.0848 170000.0 97.0277 180000.0 97.1005 34000.0 97.3843 2900.0 99.0434 33000.0 99.0801 2500.0 100.0667 2300.0 101.0225 70000.0 101.242 2100.0 101.3743 2400.0 101.8093 2500.0 103.0384 17000.0 103.7509 2500.0 105.0693 2400.0 106.3043 2400.0 107.0849 34000.0 107.3263 5300.0 107.8568 2400.0 109.0278 25000.0 109.1005 96000.0 109.8892 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203.0522 74000.0 206.287 2300.0 215.7881 2600.0 218.8973 2300.0 220.175 3000.0 221.3977 2400.0 243.083 190000.0 245.2261 41000.0 248.631 2700.0 248.8231 2400.0 263.2361 110000.0 267.5798 2400.0 268.4493 2500.0 269.278 2300.0 277.6866 3100.0 280.4324 2400.0 286.46 3000.0 291.0696 2200.0 292.8412 2800.0 303.2303 3800.0 305.4133 2500.0 306.187 2400.0 306.735 2700.0 308.9026 2700.0 317.8103 2500.0 337.2729 430000.0 343.3186 2500.0 346.9401 2300.0 365.2676 16000.0 377.7772 2800.0 393.8593 2600.0 399.0658 2600.0 421.5227 2800.0 442.5502 2300.0 446.0921 2500.0 451.7335 2600.0 480.2709 2600.0 493.9192 2400.0 499.3267 44000.0 512.9623 2400.0 521.237 7800.0 521.308 5400000.0 521.3955 4700.0 528.5768 2600.0 534.6191 2900.0 542.6381 2600.0 549.1141 2500.0 557.7511 2600.0 577.9202 2500.0 607.1112 2500.0 626.2878 2900.0 639.4945 41000.0 643.6057 2800.0 651.2961 2800.0 701.5363 2500.0 732.0976 3200.0 738.7349 2800.0 763.4907 2800.0 766.5982 2800.0 776.0019 2600.0 801.3745 25000.0 801.5481 3700000.0 801.722 34000.0 808.9143 2500.0 END IONS BEGIN IONS SCANS=893 PEPMASS=635.3225 CHARGE=1 COLLISION_ENERGY=0.0 67.4781 2500.0 70.5885 120000.0 70.5925 280000.0 78.3703 2700.0 99.1407 14000.0 100.9383 15000.0 106.6228 2400.0 109.0046 2400.0 140.2811 8400.0 140.3156 2700.0 140.3261 3100.0 148.6977 15000.0 158.8238 22000.0 158.8373 23000.0 173.5244 210000.0 173.5415 180000.0 187.6907 14000.0 209.2881 7600.0 213.6689 17000.0 261.3384 9500.0 262.3392 17000.0 333.8257 2400.0 419.1833 16000.0 431.1876 49000.0 433.238 120000.0 434.2457 55000.0 435.2552 27000.0 445.1957 3200.0 446.2089 62000.0 447.2178 170000.0 448.2612 3500.0 451.9113 10000.0 459.2179 240000.0 460.2237 570000.0 461.1592 22000.0 461.2332 700000.0 462.2392 95000.0 473.2327 280000.0 474.2397 52000.0 475.2502 18000.0 480.5093 16000.0 487.2488 220000.0 488.2564 34000.0 489.2638 64000.0 491.2426 3400.0 501.2271 6800.0 502.2255 20000.0 505.2259 17000.0 505.2373 24000.0 506.2644 56000.0 507.2721 4700.0 515.2437 140000.0 516.2508 20000.0 517.2605 150000.0 519.2408 70000.0 520.2771 58000.0 529.2161 2600.0 532.2468 26000.0 533.2561 550000.0 534.2593 240000.0 535.2746 220000.0 546.2665 56000.0 547.2691 3600.0 548.2734 26000.0 560.2477 25000.0 561.286 9100000.0 561.4899 35000.0 562.2899 410000.0 563.1966 13000.0 563.3017 2100000.0 575.2652 40000.0 579.2913 3500.0 589.2805 530000.0 591.259 2800.0 593.3142 3100.0 605.273 3000.0 606.2823 97000.0 607.2958 740000.0 620.2991 79000.0 635.3223 9700000.0 635.5631 8100.0 END IONS BEGIN IONS SCANS=894 PEPMASS=567.42 CHARGE=1 COLLISION_ENERGY=0.0 65.0385 26000.0 65.748 3100.0 67.0541 270000.0 67.1603 3400.0 68.0264 2900.0 69.0334 92000.0 69.0698 260000.0 70.4077 5900.0 71.0491 69000.0 75.3013 3500.0 77.0388 27000.0 77.2161 3200.0 79.0542 390000.0 80.0045 3100.0 81.0619 7200.0 81.0698 1100000.0 81.0742 5500.0 82.0986 3600.0 82.1935 5700.0 83.0491 140000.0 83.0855 140000.0 85.0648 34000.0 86.4394 3300.0 91.0542 420000.0 91.059 3700.0 91.0607 6600.0 93.063 13000.0 93.0698 1300000.0 95.0491 200000.0 95.0785 5700.0 95.0855 720000.0 95.0927 7700.0 97.0648 200000.0 97.1013 22000.0 99.0297 3100.0 103.0544 35000.0 105.0444 21000.0 105.0698 1900000.0 105.0782 8700.0 106.0784 8200.0 106.2036 3400.0 107.0491 14000.0 107.0734 8000.0 107.0855 1200000.0 107.0929 15000.0 108.0407 3100.0 109.0647 120000.0 109.1011 930000.0 110.4826 3500.0 111.0803 280000.0 115.0545 34000.0 116.0622 7600.0 117.0698 190000.0 119.0495 3200.0 119.0603 3900.0 119.0651 4300.0 119.0855 2100000.0 120.0929 18000.0 121.0647 56000.0 121.1011 1900000.0 121.1114 6400.0 122.0727 15000.0 123.0803 160000.0 123.1167 260000.0 125.0961 120000.0 128.062 45000.0 129.0699 98000.0 130.0776 47000.0 131.0768 4500.0 131.0855 640000.0 131.0966 11000.0 132.093 35000.0 133.0643 24000.0 133.0771 8800.0 133.0892 20000.0 133.1011 1800000.0 134.1087 5900.0 135.0803 110000.0 135.1167 710000.0 135.1269 2700.0 137.096 550000.0 137.1057 4200.0 137.1325 21000.0 138.1044 5100.0 139.1117 120000.0 141.07 33000.0 142.0777 99000.0 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229.1581 30000.0 231.1166 26000.0 232.1246 23000.0 233.1324 100000.0 234.1405 50000.0 235.1482 200000.0 236.1557 51000.0 237.1259 16000.0 237.1636 160000.0 238.1711 26000.0 239.1431 31000.0 239.1793 88000.0 241.1589 12000.0 241.1947 39000.0 243.1169 11000.0 243.1734 8100.0 245.1322 50000.0 246.1401 52000.0 247.1479 120000.0 248.1302 3800.0 248.1559 42000.0 249.1634 140000.0 250.1714 35000.0 251.15 17000.0 251.1794 88000.0 252.1875 10000.0 253.1613 11000.0 253.1948 53000.0 255.1741 12000.0 257.1319 13000.0 258.1403 16000.0 259.148 69000.0 260.1554 42000.0 261.1636 120000.0 262.171 35000.0 263.1503 7700.0 263.1792 98000.0 264.1865 29000.0 265.1949 85000.0 267.1745 3700.0 267.2113 27000.0 268.1815 4200.0 269.1893 7600.0 271.1488 15000.0 272.1554 16000.0 273.164 49000.0 274.1711 28000.0 275.1799 82000.0 276.1863 22000.0 277.1608 5600.0 277.1953 97000.0 279.1751 7200.0 279.2096 24000.0 281.1895 5100.0 283.2057 12000.0 285.1644 23000.0 286.1688 4100.0 287.1791 49000.0 288.188 7000.0 289.1952 59000.0 290.2044 4900.0 291.1767 5200.0 291.211 49000.0 292.1819 3700.0 293.1909 4600.0 295.2069 14000.0 299.1804 11000.0 301.1965 30000.0 302.202 5500.0 303.2104 15000.0 305.2261 13000.0 313.195 23000.0 315.211 39000.0 317.2259 35000.0 319.2045 4400.0 319.2415 23000.0 320.2522 4200.0 325.1955 4400.0 327.2111 5700.0 329.228 4900.0 330.2335 14000.0 331.2398 22000.0 333.2219 12000.0 335.2375 3500.0 341.2256 22000.0 343.2423 27000.0 348.243 22000.0 350.2577 4000.0 355.2434 5000.0 357.257 4400.0 361.2526 8500.0 369.2543 3800.0 411.3073 7100.0 452.6557 6200.0 464.9594 4200.0 495.7991 5600.0 END IONS BEGIN IONS SCANS=895 PEPMASS=566.4119 CHARGE=1 COLLISION_ENERGY=0.0 64.9202 2500.0 69.0698 2800.0 76.7149 2500.0 78.2498 2400.0 79.054 7400.0 81.0695 22000.0 83.0852 2500.0 84.9773 2400.0 91.0542 7200.0 91.4796 2400.0 92.2965 3000.0 93.0695 27000.0 95.049 10000.0 95.0852 25000.0 96.4002 2700.0 97.0644 19000.0 97.9607 2400.0 100.2876 2100.0 103.6328 2500.0 105.0695 35000.0 107.0852 35000.0 109.0643 2500.0 109.1007 22000.0 112.867 2500.0 113.0958 9600.0 119.0852 53000.0 120.0932 2700.0 121.1009 31000.0 123.0802 18000.0 123.1167 2900.0 131.0852 24000.0 133.1008 41000.0 135.1165 14000.0 137.0957 5000.0 139.1118 8700.0 143.0851 28000.0 144.093 4600.0 145.1008 74000.0 146.1086 2600.0 147.0806 3800.0 147.1164 22000.0 149.6839 4900.0 149.6943 5400.0 155.085 8300.0 155.5004 2600.0 156.0932 3300.0 157.1008 45000.0 158.1081 9000.0 159.1167 35000.0 160.089 4400.0 161.0958 9600.0 163.1114 3200.0 169.1009 24000.0 169.118 2500.0 170.1092 4500.0 171.1167 26000.0 173.1321 21000.0 173.5274 45000.0 173.5432 12000.0 175.148 8300.0 179.1428 9500.0 181.1013 16000.0 181.1217 6300.0 183.1163 25000.0 185.0961 2600.0 185.1324 15000.0 186.9882 2400.0 187.1481 8400.0 195.1168 24000.0 196.1248 5200.0 197.1325 28000.0 199.1123 3500.0 199.1482 14000.0 203.1435 2600.0 205.1598 2600.0 205.5273 2800.0 207.1167 15000.0 209.1323 30000.0 210.1399 3900.0 211.1133 3200.0 211.148 17000.0 219.1159 3100.0 221.1325 12000.0 221.1536 12000.0 223.1478 12000.0 225.1284 3600.0 225.1638 6500.0 227.1432 3000.0 233.1325 3000.0 235.1472 14000.0 237.163 7700.0 241.1583 3300.0 247.1478 5100.0 251.1805 4100.0 263.1795 4000.0 275.1784 3800.0 282.2795 16000.0 283.2828 17000.0 285.1852 2700.0 289.1979 2700.0 299.2031 3900.0 310.31 17000.0 311.3147 21000.0 341.9279 3000.0 504.7094 2400.0 552.4758 2400.0 END IONS BEGIN IONS SCANS=896 PEPMASS=584.4214 CHARGE=1 COLLISION_ENERGY=0.0 65.0776 2200.0 65.7599 2000.0 67.0539 53000.0 68.9518 2600.0 69.0331 15000.0 69.0696 57000.0 70.5442 2100.0 70.8409 2200.0 71.0489 18000.0 73.0281 2500.0 77.0386 2800.0 78.1465 2300.0 79.0539 82000.0 79.8558 2300.0 80.0619 26000.0 81.0695 220000.0 81.6004 2300.0 82.0728 5200.0 83.0488 41000.0 83.0852 49000.0 84.0888 3000.0 85.0645 10000.0 87.0437 10000.0 89.0593 150000.0 90.8272 2300.0 91.054 74000.0 91.8434 2500.0 93.0638 3700.0 93.0695 270000.0 93.4001 2400.0 93.5428 2500.0 94.0726 6800.0 95.0489 79000.0 95.0852 170000.0 96.0886 3100.0 97.0644 97000.0 98.0681 3500.0 100.5944 2500.0 105.0617 3100.0 105.0695 320000.0 106.0728 13000.0 107.0852 260000.0 108.0889 11000.0 109.0645 38000.0 109.1009 190000.0 110.1045 4700.0 111.0801 31000.0 111.1166 3100.0 113.0958 43000.0 114.0591 2300.0 117.0236 2600.0 117.0697 41000.0 119.0761 7400.0 119.0852 440000.0 119.0955 2600.0 120.0901 20000.0 120.0924 2500.0 120.7373 2500.0 121.0646 24000.0 121.0913 3000.0 121.1008 320000.0 122.1043 21000.0 122.4192 2400.0 123.0801 160000.0 123.1165 39000.0 124.4682 2300.0 125.0958 37000.0 127.0657 2700.0 128.0619 10000.0 129.0696 30000.0 130.0774 7800.0 131.0852 200000.0 131.0964 3300.0 132.0926 41000.0 133.0651 2800.0 133.0857 76000.0 133.1009 320000.0 134.1071 18000.0 135.0803 43000.0 135.1166 100000.0 137.0957 74000.0 138.1031 20000.0 139.1115 86000.0 140.1146 8900.0 141.0696 6000.0 142.0775 16000.0 143.0853 190000.0 144.0928 56000.0 145.0648 16000.0 145.089 3700.0 145.1009 520000.0 145.1144 5600.0 146.1066 46000.0 147.0801 41000.0 147.1165 210000.0 148.1199 31000.0 149.0957 43000.0 149.1322 18000.0 149.6775 3200.0 149.6883 6400.0 150.1042 2600.0 151.075 7600.0 151.1114 20000.0 153.1275 6100.0 154.1315 3100.0 155.0851 43000.0 155.1064 30000.0 156.0928 36000.0 156.2641 2700.0 157.0865 2700.0 157.1009 330000.0 158.1079 76000.0 159.0803 35000.0 159.1166 260000.0 160.0739 3800.0 160.088 230000.0 160.1213 13000.0 161.0961 55000.0 161.1322 57000.0 163.1113 38000.0 165.091 55000.0 165.1275 4100.0 166.0937 2600.0 167.0888 4400.0 167.1064 140000.0 168.092 2700.0 169.1011 130000.0 170.1081 40000.0 171.1167 230000.0 172.1228 27000.0 173.096 18000.0 173.1324 150000.0 173.5232 14000.0 173.5358 100000.0 174.1368 15000.0 175.1117 33000.0 175.1481 64000.0 177.112 3700.0 177.1278 10000.0 179.1426 9800.0 181.101 52000.0 181.122 53000.0 181.9293 3100.0 182.1084 23000.0 182.1261 7700.0 183.1167 150000.0 184.1236 31000.0 185.0955 12000.0 185.1324 160000.0 186.1391 27000.0 187.1114 19000.0 187.148 70000.0 188.1179 3100.0 189.1278 27000.0 189.1633 3000.0 190.1338 7400.0 191.1428 39000.0 193.1011 22000.0 193.1224 4900.0 194.1083 17000.0 195.1167 120000.0 195.1367 9900.0 196.1237 40000.0 197.1323 210000.0 198.1387 33000.0 199.1121 11000.0 199.148 100000.0 200.1535 12000.0 201.1276 23000.0 201.1638 26000.0 203.1432 56000.0 205.1593 12000.0 206.1098 3400.0 207.1167 52000.0 207.1382 11000.0 208.1238 27000.0 208.1445 7300.0 209.1324 150000.0 209.1513 3400.0 210.1391 43000.0 211.1483 130000.0 212.1531 21000.0 213.1278 25000.0 213.1638 42000.0 215.1428 18000.0 217.1592 7100.0 219.1165 9300.0 219.1376 3100.0 221.1322 55000.0 221.1541 75000.0 222.1373 12000.0 222.159 4300.0 223.1481 98000.0 224.1549 19000.0 225.1274 10000.0 225.1637 60000.0 226.1707 3000.0 227.1432 14000.0 227.1798 6800.0 228.151 2700.0 229.1581 8100.0 233.1319 18000.0 233.1559 8200.0 234.1393 5400.0 235.1482 56000.0 236.1532 7800.0 236.2048 2600.0 237.1638 56000.0 238.1676 3700.0 239.1424 6900.0 239.1793 24000.0 241.1589 3100.0 241.1944 7500.0 246.1615 20000.0 247.1468 18000.0 247.1707 12000.0 249.1639 40000.0 250.1696 6600.0 251.1789 25000.0 252.1509 2600.0 252.1872 2900.0 253.1601 2600.0 253.1945 14000.0 255.1731 5700.0 255.8519 3000.0 259.1703 9800.0 260.1534 5000.0 261.0308 2600.0 261.1629 25000.0 262.1684 3700.0 263.1787 26000.0 264.1855 2700.0 265.1956 21000.0 266.2025 6600.0 267.1742 6300.0 269.1905 11000.0 271.1704 8700.0 272.176 2700.0 273.1629 3200.0 274.1933 3400.0 275.18 14000.0 277.195 11000.0 278.3087 2900.0 279.176 4400.0 279.2105 4700.0 281.19 6700.0 283.2052 2600.0 285.1852 18000.0 286.1928 21000.0 287.2022 16000.0 289.1958 9400.0 291.2108 3800.0 296.8914 2700.0 297.1862 3500.0 299.201 25000.0 300.2073 5300.0 303.2108 5900.0 311.2014 7400.0 312.2063 3700.0 325.2136 6400.0 337.2172 6100.0 352.2396 20000.0 353.2483 6700.0 354.2545 2500.0 365.2475 29000.0 366.2583 3000.0 469.139 2800.0 492.3564 7400.0 509.9944 2600.0 521.1894 3000.0 528.0188 2500.0 536.2395 2600.0 549.8351 3000.0 END IONS BEGIN IONS SCANS=897 PEPMASS=613.4233 CHARGE=1 COLLISION_ENERGY=0.0 67.0542 4600.0 69.0696 6400.0 79.0539 8900.0 80.0615 2300.0 81.0696 17000.0 83.0853 3100.0 88.3874 2200.0 91.0541 5300.0 93.0696 22000.0 95.0489 4900.0 95.0851 14000.0 97.0645 3500.0 105.0695 30000.0 107.0852 26000.0 109.0646 4300.0 109.1008 18000.0 112.8976 2200.0 119.0851 43000.0 121.1009 32000.0 123.0803 7100.0 123.1164 4500.0 124.0839 3200.0 125.0961 5100.0 129.0695 2500.0 131.0853 17000.0 132.0923 3200.0 133.1009 33000.0 134.1037 4700.0 135.1165 9100.0 137.0957 4900.0 138.1032 2700.0 142.0778 4200.0 143.0851 14000.0 145.1008 43000.0 146.1046 4000.0 147.1165 21000.0 149.0955 3500.0 149.1315 3100.0 151.1112 3700.0 155.0845 3200.0 157.1009 27000.0 158.1058 5200.0 159.1164 24000.0 160.1216 3100.0 161.0953 5800.0 161.132 3300.0 169.1011 9800.0 170.1069 3600.0 171.1163 21000.0 172.121 6100.0 173.1324 21000.0 173.5244 17000.0 173.5432 11000.0 175.111 3000.0 175.148 11000.0 181.1015 4300.0 182.1068 5400.0 183.1164 11000.0 184.1229 5500.0 185.1321 10000.0 187.1475 5500.0 191.1427 3400.0 193.102 6000.0 195.117 11000.0 196.1227 6800.0 197.1322 16000.0 198.1369 5500.0 199.1476 14000.0 207.1167 5500.0 208.122 3200.0 209.1322 15000.0 210.1386 6600.0 211.1484 13000.0 212.1518 5100.0 217.1605 3800.0 221.1324 7300.0 222.1419 3300.0 223.1478 6700.0 224.1548 4200.0 225.1635 4800.0 233.1313 2700.0 235.1484 6300.0 237.1628 7300.0 238.1677 2900.0 247.1479 4900.0 249.1634 3300.0 251.1797 5000.0 261.1625 3700.0 263.1787 2700.0 264.1851 2700.0 295.2061 2900.0 388.3653 2300.0 549.9994 2400.0 END IONS BEGIN IONS SCANS=898 PEPMASS=612.4174 CHARGE=1 COLLISION_ENERGY=0.0 65.804 2400.0 66.3626 2800.0 66.5446 2300.0 67.054 5000.0 71.8813 2400.0 78.9624 2600.0 79.0542 9400.0 81.0695 39000.0 82.0768 2500.0 83.0488 8400.0 83.0854 8000.0 91.0539 17000.0 93.0695 54000.0 95.0489 26000.0 95.0852 29000.0 97.0642 7200.0 97.1492 2500.0 99.0437 17000.0 100.5189 2200.0 104.6006 2500.0 105.0695 62000.0 107.0851 63000.0 109.0645 11000.0 109.1009 29000.0 117.0697 11000.0 117.4156 2600.0 119.0851 100000.0 119.2731 2400.0 120.0929 7200.0 121.0645 2800.0 121.1008 57000.0 123.08 51000.0 125.0955 26000.0 129.0695 3600.0 130.078 2400.0 131.0853 47000.0 132.0929 31000.0 133.1008 92000.0 134.2142 2300.0 135.08 9200.0 135.1166 21000.0 137.0955 18000.0 138.1035 13000.0 143.0852 49000.0 144.093 20000.0 145.1008 150000.0 146.109 11000.0 147.0801 6800.0 147.1164 49000.0 149.0956 18000.0 155.0853 15000.0 156.0927 9400.0 157.1009 96000.0 158.1083 25000.0 159.1165 70000.0 160.1242 3100.0 161.0957 14000.0 161.1322 3300.0 163.1118 3500.0 167.0847 3200.0 169.101 45000.0 170.1088 9500.0 170.2861 2300.0 171.1166 71000.0 172.1242 7500.0 173.0961 11000.0 173.1323 45000.0 173.5288 47000.0 173.5399 38000.0 174.5016 2800.0 175.1112 2900.0 175.1492 4900.0 176.1201 2500.0 177.1278 2700.0 181.1011 20000.0 182.1091 2800.0 183.1166 50000.0 184.1238 12000.0 185.1321 52000.0 186.1412 2600.0 187.1475 6200.0 189.1273 11000.0 191.1426 24000.0 193.1001 4300.0 195.1166 45000.0 196.1247 14000.0 197.1324 65000.0 198.1402 8400.0 198.1652 2400.0 199.1129 6700.0 199.1481 43000.0 199.3868 2800.0 199.4339 2800.0 203.1425 3200.0 207.1165 21000.0 208.1257 7100.0 209.1324 68000.0 210.14 9500.0 211.1481 64000.0 211.1691 3400.0 213.1279 3400.0 213.1636 4000.0 215.1434 7100.0 217.1576 2900.0 220.1243 2500.0 221.1327 18000.0 223.148 36000.0 224.1562 6400.0 225.164 11000.0 233.1313 3400.0 233.1546 7000.0 235.1481 17000.0 236.1536 2700.0 237.1637 46000.0 239.1445 3100.0 239.1771 3000.0 247.1481 8200.0 249.1638 12000.0 250.1703 3300.0 251.178 7500.0 252.1869 9400.0 253.1963 3600.0 261.1628 9400.0 263.1778 9500.0 265.196 2800.0 275.1776 3400.0 276.1871 3700.0 277.1943 3900.0 298.1923 21000.0 302.1332 2400.0 303.2107 3100.0 326.1895 2800.0 329.2253 2700.0 390.2565 12000.0 436.2928 2700.0 442.9029 2600.0 474.308 3000.0 488.3394 2800.0 508.0648 2600.0 528.3597 3700.0 END IONS nf_output/clustering/specs_ms.mgf0000644000000000000000000561106214664572140016311 0ustar rootrootBEGIN IONS FEATURE_ID=1 PEPMASS=235.9524 SCANS=1 RTINSECONDS=51.783 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 6 (0 removed due to low quality, 0 removed due to low cosine). 43.5593 2.3E3 43.9654 2.6E3 44.2560 2.1E3 44.9044 2.2E3 46.5670 2.1E3 48.4572 2.3E3 48.6547 2.7E3 48.8895 2.6E3 50.4860 2.3E3 51.2272 2.2E3 52.0672 2.5E3 52.5885 2.6E3 53.3828 2.1E3 54.4275 2.1E3 54.9100 2.6E3 55.9312 2.2E3 61.1137 2.4E3 61.9921 2.4E3 64.2207 2.1E3 65.9713 3.2E3 70.7143 2.3E3 73.0177 2.6E3 77.0079 2.5E3 77.8837 2.1E3 77.9067 2.5E3 84.9594 6.5E4 85.9632 2.3E3 90.6383 2.3E3 91.2590 2.1E3 95.0480 3.0E3 98.8067 2.3E3 100.0249 2.4E3 102.9234 2.3E3 110.2020 2.7E3 110.4236 2.5E3 120.9262 3.2E3 132.7252 2.5E3 136.0747 2.2E3 138.8332 2.5E3 138.9359 1.0E4 142.7536 2.8E3 147.8078 2.6E3 148.9201 6.7E3 151.7258 2.4E3 156.9460 1.5E5 158.6869 2.6E3 166.9306 7.3E4 167.0200 2.9E3 167.8346 2.5E3 173.5263 4.5E4 173.5395 2.3E4 174.9567 6.4E5 174.9743 4.8E3 176.9606 6.1E3 179.9319 8.1E3 184.9410 1.5E6 185.0304 2.6E3 192.9674 6.0E4 193.9466 3.9E3 194.9247 1.7E4 197.9429 8.5E3 202.9517 9.4E5 207.9557 2.6E3 212.9128 4.7E3 212.9362 4.9E5 216.1402 2.3E3 219.9713 2.7E3 220.9625 1.3E4 225.9664 2.6E3 230.9473 3.0E4 END IONS BEGIN IONS FEATURE_ID=2 PEPMASS=263.9472 SCANS=2 RTINSECONDS=51.82 CHARGE=1+ MSLEVEL=2 MERGED_STATS=10 / 10 (0 removed due to low quality, 0 removed due to low cosine). 47.0957 2.2E3 47.7695 2.4E3 48.6271 2.1E3 50.2298 2.4E3 50.3996 2.4E3 51.5364 2.1E3 52.1325 2.4E3 53.1324 2.1E3 54.9428 2.6E3 54.9734 2.7E3 55.3566 2.6E3 55.3648 2.1E3 56.8451 2.2E3 59.7586 2.1E3 60.0408 2.3E3 60.1979 2.5E3 61.2140 2.6E3 61.3243 2.4E3 61.5577 2.6E3 62.0430 2.4E3 63.0195 2.3E3 63.1772 2.3E3 66.8465 2.4E3 71.1533 2.5E3 72.9670 2.7E3 73.8366 2.2E3 75.7267 2.1E3 79.8220 2.4E3 82.0134 2.1E3 82.5601 2.8E3 86.9925 3.5E4 87.0560 2.3E3 87.6401 2.4E3 88.0130 2.3E3 88.0848 2.8E3 90.4219 2.3E3 92.2658 2.5E3 93.5810 2.3E3 94.4739 2.1E3 101.7689 2.2E3 102.6104 2.2E3 103.5928 2.4E3 105.0031 4.6E4 108.9028 2.3E3 110.9832 2.6E3 114.8830 2.5E3 120.9262 2.3E3 121.5987 2.8E3 122.6222 2.6E3 124.3350 2.7E3 132.9978 1.1E4 134.2612 2.6E3 134.8756 2.9E3 141.6246 2.6E3 144.0744 2.7E3 150.6184 2.2E3 156.9461 6.9E4 163.9585 2.4E3 166.9306 7.5E4 173.5250 1.7E4 173.5363 8.4E4 174.9568 4.4E5 184.9167 6.0E3 184.9411 2.1E6 184.9565 6.0E3 186.9454 2.8E3 192.9674 4.9E4 193.9864 2.6E3 194.9257 8.1E4 194.9838 2.4E4 196.9273 2.2E4 202.1332 2.8E3 202.9301 5.0E3 202.9518 2.0E6 202.9731 1.4E4 203.9728 2.5E3 204.9687 2.0E4 207.9577 1.1E4 208.6189 3.0E3 209.0935 2.4E3 212.9158 2.6E3 212.9362 2.8E6 212.9607 1.4E4 214.9397 1.6E4 218.9840 2.7E3 220.9624 5.5E4 221.9317 6.8E3 221.9840 3.6E3 222.9324 3.4E4 222.9795 6.0E4 223.0883 2.3E3 225.8245 2.5E3 227.2910 2.4E3 228.9897 2.5E3 230.0530 2.3E3 230.9468 3.3E5 235.9504 6.7E3 236.0102 2.5E3 240.9311 9.2E4 250.8875 2.2E3 258.9425 3.1E3 261.9720 2.8E3 END IONS BEGIN IONS FEATURE_ID=3 PEPMASS=249.9260 SCANS=3 RTINSECONDS=51.908 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 44.1372 2.2E3 45.5181 2.1E3 48.8363 2.3E3 49.8966 2.5E3 49.9899 2.0E3 53.2440 2.7E3 53.7629 2.1E3 53.9947 2.3E3 55.3587 2.9E3 55.4572 3.2E3 55.9341 3.4E4 58.6335 2.5E3 62.9880 2.4E3 65.6745 2.2E3 80.9516 2.2E3 84.5500 3.1E3 92.5438 2.8E3 97.4573 2.5E3 99.0327 2.6E3 101.1441 2.5E3 106.5987 2.7E3 107.3250 2.3E3 114.0878 2.3E3 137.5210 2.4E3 146.7141 2.4E3 148.9375 7.0E3 149.6795 3.4E3 149.6900 5.7E3 149.7006 3.7E3 157.6962 2.4E3 159.9303 1.6E4 161.9314 2.2E3 163.9258 4.3E3 164.9332 1.2E4 165.9406 2.8E4 171.5208 2.4E3 173.5217 7.2E3 173.5373 4.1E4 175.9361 5.9E3 176.9331 5.1E4 177.9408 2.8E3 181.9359 2.5E4 182.9436 1.4E4 183.9521 1.8E4 184.1487 2.6E3 185.9274 3.3E3 187.9255 1.9E4 188.9717 6.4E3 190.4268 2.7E3 191.9201 6.6E4 193.9473 7.1E3 194.9435 1.4E4 198.5703 2.6E3 198.9576 3.9E3 203.4747 2.6E3 203.9194 1.2E4 203.9389 2.8E3 204.9279 7.1E4 205.9354 2.5E3 209.9305 3.3E4 219.9144 5.3E3 221.9309 9.2E4 222.9386 1.2E4 224.3337 2.4E3 END IONS BEGIN IONS FEATURE_ID=4 PEPMASS=244.9471 SCANS=4 RTINSECONDS=51.95 CHARGE=1+ MSLEVEL=2 MERGED_STATS=8 / 9 (1 removed due to low quality, 0 removed due to low cosine). 44.4631 2.3E3 46.3288 2.2E3 46.9387 2.2E3 48.7590 4.6E3 48.9989 2.3E3 49.6719 2.2E3 49.9031 2.2E3 51.3132 2.3E3 51.5103 2.3E3 52.2490 2.2E3 52.3312 2.2E3 53.1602 2.2E3 55.2373 2.3E3 55.3285 2.2E3 55.4657 2.3E3 55.9344 2.7E5 56.0811 2.5E3 59.1862 2.4E3 60.0906 2.3E3 60.6917 3.0E3 61.1935 2.3E3 63.8319 2.9E3 64.5645 2.3E3 65.8320 2.3E3 66.9189 2.8E3 67.9957 3.1E3 69.7489 2.1E3 72.9769 2.5E3 75.2225 2.7E3 77.1293 2.6E3 79.2943 2.3E3 82.2237 2.5E3 83.4417 2.9E3 85.9308 2.4E3 86.9928 3.6E3 87.6035 2.4E3 87.7196 2.1E3 88.9163 2.4E3 92.6390 2.9E3 96.5193 3.0E3 98.6941 2.4E3 99.6545 2.3E3 101.9760 4.1E3 102.1469 2.4E3 105.0033 9.1E3 107.3847 2.3E3 109.8813 2.4E3 111.5175 2.6E3 111.9094 4.2E4 118.3182 2.5E3 118.8867 2.5E3 118.9862 1.2E4 119.9866 2.3E4 125.4637 2.4E3 127.9041 1.5E4 128.9706 2.2E3 129.2347 2.4E3 129.9200 3.1E4 129.9710 9.7E3 131.9353 5.4E4 136.0001 5.5E3 136.9965 5.7E4 137.9972 1.2E5 140.1784 2.3E3 141.2366 2.2E3 141.9208 8.4E3 145.9148 8.5E4 145.9844 3.4E3 146.9225 9.1E4 146.9806 1.7E4 147.9302 4.8E4 147.9818 6.6E4 148.9383 1.5E5 149.6826 4.5E3 149.6928 5.5E3 149.9461 6.5E4 155.0072 2.6E3 156.0073 1.2E4 156.6639 2.3E3 156.9658 4.7E3 157.9666 2.5E4 158.4279 2.2E3 159.9304 2.7E5 162.7523 2.3E3 163.6707 2.6E3 163.9253 2.5E5 163.9400 3.8E3 164.9332 2.7E5 164.9915 5.0E4 165.9256 3.5E3 165.9411 5.1E5 165.9925 1.5E5 166.9488 7.9E4 167.2271 2.6E3 173.5280 5.5E4 173.5396 3.5E4 173.9101 8.4E4 173.9793 8.7E3 174.9763 7.2E4 175.9772 2.9E5 177.9412 1.6E5 178.8557 2.7E3 181.9360 4.6E5 182.0459 2.5E3 182.0711 2.4E3 182.9438 3.5E5 183.9516 3.5E5 184.7391 2.4E3 184.9613 3.1E3 185.9099 1.0E4 185.9616 2.4E4 191.9008 5.3E3 191.9203 1.0E6 191.9361 7.2E3 191.9896 1.6E4 192.9866 1.3E5 193.9362 2.0E4 193.9877 5.3E5 202.9713 5.7E4 203.8993 3.9E3 203.9206 3.1E5 203.9724 3.8E5 204.0032 2.8E3 204.7760 2.4E3 209.9076 7.1E3 209.9310 7.4E5 209.9540 9.8E3 212.7159 2.7E3 216.0887 2.2E3 220.7064 2.5E3 220.9818 8.2E4 221.8788 3.9E3 221.9309 3.0E6 221.9571 1.1E4 221.9830 4.7E5 223.9347 1.2E4 227.9418 1.4E4 235.3344 2.4E3 239.9413 4.8E4 241.9969 2.4E3 244.9487 3.0E3 END IONS BEGIN IONS FEATURE_ID=5 PEPMASS=221.9313 SCANS=5 RTINSECONDS=51.96 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 6 (1 removed due to low quality, 0 removed due to low cosine). 43.5360 2.3E3 47.1735 2.5E3 47.6819 2.4E3 52.7669 2.3E3 54.5471 2.3E3 54.6997 2.3E3 55.9342 4.1E4 55.9567 2.3E3 58.0651 6.2E3 59.1568 2.6E3 63.4673 2.3E3 68.1240 2.2E3 69.8471 2.6E3 70.4632 2.8E3 73.3325 2.3E3 74.6466 2.5E3 75.3665 2.4E3 80.5591 2.2E3 84.8107 2.4E3 85.5658 2.4E3 91.0538 1.4E4 119.0487 2.6E3 119.9863 1.7E4 125.4487 2.3E3 129.8425 2.2E3 129.9704 3.2E3 130.8529 2.4E3 131.9357 2.3E3 135.0437 6.1E3 135.9996 6.8E3 136.9964 3.0E4 137.9970 1.0E5 140.1405 2.1E3 145.9140 2.4E3 146.9805 9.2E3 147.9817 4.7E4 148.9378 9.2E3 149.9454 2.8E3 151.2477 2.8E3 154.3143 2.4E3 155.1219 2.4E3 156.0074 1.0E4 157.9657 1.3E4 159.9303 1.6E4 163.9255 2.2E4 163.9947 3.4E3 164.9334 9.1E3 164.9913 1.6E4 165.9409 3.9E4 165.9923 1.1E5 166.9490 3.6E3 173.5239 1.5E4 173.5362 4.4E4 173.9804 2.7E3 174.9767 4.0E3 175.9770 1.2E5 177.9407 1.2E4 181.9357 5.4E4 182.9440 1.5E4 183.9516 1.5E4 191.9201 5.9E4 191.9898 5.8E3 192.9862 1.3E4 193.9874 2.3E5 203.9724 7.2E4 209.9307 3.8E4 219.2902 2.7E3 221.9308 7.8E4 221.9828 9.9E4 END IONS BEGIN IONS FEATURE_ID=6 PEPMASS=272.9423 SCANS=6 RTINSECONDS=52.01 CHARGE=1+ MSLEVEL=2 MERGED_STATS=7 / 7 (0 removed due to low quality, 0 removed due to low cosine). 46.2772 2.3E3 48.8216 2.1E3 49.6768 2.5E3 49.7211 2.2E3 53.7564 2.5E3 54.9395 2.8E3 55.1708 2.4E3 55.3341 2.2E3 55.5395 2.2E3 55.9342 2.5E5 55.9452 3.1E3 56.4961 2.4E3 58.0560 2.5E3 61.5151 2.5E3 62.4029 2.2E3 65.4889 2.0E3 65.6388 2.8E3 65.6815 2.2E3 68.0352 2.4E3 75.7279 2.4E3 79.8329 2.5E3 80.1364 2.6E3 85.4859 2.3E3 86.9924 6.1E3 91.7684 2.3E3 96.3038 2.2E3 99.6888 2.1E3 105.0031 6.7E3 106.6950 2.2E3 110.5040 2.1E3 110.6316 2.3E3 111.3822 2.2E3 111.9094 1.2E4 120.0916 2.7E3 131.9353 2.0E4 136.1769 2.2E3 144.9228 2.6E3 145.0409 2.7E3 145.9144 4.0E4 146.0304 2.6E3 146.9224 5.1E4 147.9301 2.0E4 147.9414 2.6E3 148.4328 2.4E3 148.9380 7.6E4 149.9458 3.8E4 152.8641 2.5E3 155.8027 3.0E3 158.9231 8.2E3 159.9303 1.1E5 162.9920 2.5E3 163.9252 1.1E5 164.9331 1.3E5 165.9408 2.9E5 165.9540 4.9E3 166.9488 7.9E4 167.9532 2.4E3 169.9150 8.9E3 173.5249 4.9E3 173.5338 7.3E4 173.5423 5.3E3 173.6501 2.2E3 173.9096 3.9E4 175.9367 6.4E4 176.9331 3.7E5 176.9506 2.7E3 177.9410 1.3E5 181.5338 2.3E3 181.9358 2.8E5 182.9437 2.5E5 183.9514 2.7E5 186.9178 6.5E4 187.9252 4.2E5 188.1027 2.3E3 191.9201 5.4E5 191.9398 5.1E3 192.9285 1.3E4 193.9340 1.7E4 193.9472 5.1E4 194.9436 2.4E5 199.1201 2.3E3 200.9530 3.2E3 201.9040 1.1E4 203.9208 1.2E5 203.9347 4.6E3 204.9056 4.7E3 204.9279 1.5E6 204.9493 2.4E4 205.9358 2.4E5 209.9075 1.0E4 209.9308 6.6E5 209.9542 9.9E3 210.9393 8.3E3 219.9152 2.0E5 221.9308 2.9E6 221.9567 1.1E4 221.9817 1.3E4 222.9135 1.9E4 222.9385 7.3E5 223.9342 6.3E3 226.7182 3.1E3 227.9420 2.7E4 231.9260 1.5E4 232.9236 8.1E3 234.9645 2.1E4 237.9254 5.3E4 239.9413 1.0E5 243.5209 2.5E3 244.9475 2.5E4 249.9267 4.9E4 250.1465 2.4E3 254.2738 2.4E3 262.9180 2.5E4 262.9593 1.2E4 276.1037 2.7E3 END IONS BEGIN IONS FEATURE_ID=7 PEPMASS=336.9014 SCANS=7 RTINSECONDS=52.382 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 2 (0 removed due to low quality, 0 removed due to low cosine). 52.4581 2.3E3 60.4387 2.1E3 68.3728 2.3E3 76.3385 2.2E3 96.2359 3.1E3 101.1362 2.3E3 159.2096 2.5E3 171.9507 2.4E3 172.9774 2.7E3 173.5271 7.8E3 173.5370 1.2E4 190.9883 1.1E4 200.9729 2.0E4 209.6976 2.3E3 212.9360 4.0E3 218.9837 3.1E4 220.9821 8.2E3 226.2951 2.4E3 230.5443 2.5E3 238.0503 2.2E3 244.9078 6.4E3 246.9183 2.8E3 255.0513 2.4E3 260.9412 3.7E3 262.9193 1.1E4 265.7062 3.4E3 270.9270 9.8E3 272.9036 1.4E4 273.9042 1.4E4 280.9108 4.2E3 290.9165 2.7E3 291.9143 3.4E3 298.9215 3.7E4 316.9303 4.6E3 343.7459 2.8E3 END IONS BEGIN IONS FEATURE_ID=8 PEPMASS=260.0104 SCANS=8 RTINSECONDS=52.486 CHARGE=1+ MSLEVEL=2 MERGED_STATS=1 / 1 (0 removed due to low quality, 0 removed due to low cosine). 79.3252 2.1E3 84.9596 2.0E4 86.9558 2.7E3 124.9869 2.2E3 134.9989 2.0E4 141.3143 2.2E3 144.9834 6.9E3 146.0298 3.9E3 153.0092 3.6E3 162.9938 2.8E4 172.9784 2.9E4 173.5379 1.9E4 180.9305 4.0E3 182.9634 5.5E3 190.9576 2.9E3 190.9685 4.8E3 190.9887 1.5E5 191.0089 2.9E3 198.9406 6.1E3 200.9732 6.8E4 204.0206 1.2E4 212.2670 2.4E3 214.0053 3.8E3 215.0816 1.9E4 218.9464 3.9E3 218.9838 2.8E5 231.9701 7.3E3 232.0155 3.9E4 241.9527 6.0E3 242.0917 2.6E3 247.0127 2.6E3 249.9790 4.4E3 250.0713 2.7E3 259.9653 5.2E3 END IONS BEGIN IONS FEATURE_ID=9 PEPMASS=218.9840 SCANS=9 RTINSECONDS=52.499 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 8 (4 removed due to low quality, 0 removed due to low cosine). 44.4118 2.8E3 47.7459 3.2E3 48.9832 2.3E3 49.2307 2.2E3 50.4040 2.5E3 51.0660 2.6E3 54.5881 2.2E3 56.2209 2.3E3 62.7547 2.3E3 68.9822 1.6E4 70.4684 2.7E3 75.5198 2.6E3 80.9675 9.7E3 82.9827 1.6E4 84.9596 4.1E4 86.9927 5.6E4 87.3321 2.3E3 89.6031 2.3E3 91.3671 2.3E3 92.3268 2.7E3 98.9777 1.7E5 104.2269 2.2E3 104.3814 2.2E3 104.6796 2.5E3 105.0032 6.3E4 108.1228 2.3E3 108.9631 2.3E4 116.9882 4.7E5 118.9925 2.5E3 126.9728 1.3E5 133.2961 2.5E3 134.9988 1.7E6 135.0163 3.6E3 136.1255 2.2E3 137.0030 8.9E3 138.9729 1.3E4 144.9715 6.8E3 144.9832 1.0E6 150.7470 2.3E3 153.0094 2.5E5 153.0231 3.3E3 154.9679 2.4E5 154.9821 3.5E3 156.9719 2.4E3 158.0151 4.0E3 162.9712 3.4E3 162.9938 1.8E6 163.0063 3.7E3 164.9982 1.3E4 172.9435 1.3E4 172.9497 3.8E3 172.9656 1.3E4 172.9783 2.1E6 173.0133 7.9E3 173.5264 8.9E3 173.5371 3.5E4 174.9820 3.3E3 177.9353 2.9E3 180.9701 2.6E3 181.0045 7.2E3 182.9629 1.1E5 186.0104 3.4E3 186.5668 2.4E3 190.9371 3.9E3 190.9484 7.2E3 190.9887 3.1E6 191.0033 1.0E4 191.0202 5.0E3 191.0296 1.0E4 191.6455 2.7E3 191.9909 2.8E3 192.9931 1.8E4 195.9944 4.3E3 200.9732 1.1E6 200.9941 5.1E3 203.1454 2.7E3 212.0156 2.7E3 214.0049 1.5E4 218.9584 7.5E3 218.9839 1.3E6 219.1743 1.4E4 220.1550 2.7E3 223.9882 3.1E3 END IONS BEGIN IONS FEATURE_ID=10 PEPMASS=270.9461 SCANS=10 RTINSECONDS=52.543 CHARGE=1+ MSLEVEL=2 MERGED_STATS=1 / 1 (0 removed due to low quality, 0 removed due to low cosine). 57.1852 2.1E3 65.1515 2.7E3 67.4107 2.4E3 94.5380 3.4E3 94.7701 2.0E3 116.6482 2.2E3 120.2827 2.7E3 149.6798 4.4E3 149.6916 5.4E3 163.9458 3.5E3 173.5282 5.1E3 173.9804 3.5E3 174.9377 4.1E3 185.9300 6.1E3 189.9243 6.9E3 191.9898 4.8E3 201.9249 3.4E3 201.9746 4.1E3 202.9327 2.1E4 207.9360 4.4E3 213.9538 2.3E3 214.9560 5.2E3 219.9357 2.8E4 219.9857 5.4E3 232.9673 1.9E4 242.9523 1.2E4 260.9625 7.1E3 266.2681 2.0E3 END IONS BEGIN IONS FEATURE_ID=11 PEPMASS=385.8763 SCANS=11 RTINSECONDS=52.554 CHARGE=1+ MSLEVEL=2 MERGED_STATS=1 / 1 (0 removed due to low quality, 0 removed due to low cosine). 66.3013 2.0E3 72.5639 2.3E3 89.8834 2.5E3 93.4654 2.5E3 112.7887 2.4E3 116.0387 2.6E3 165.7143 2.5E3 173.5372 1.1E4 226.6456 2.3E3 240.9530 9.4E3 241.9524 3.2E3 243.9513 3.7E3 257.9005 7.9E3 258.9651 7.1E3 275.9044 4.1E3 285.8962 7.4E4 302.8991 6.0E3 303.9072 1.4E4 304.4391 2.9E3 312.8836 7.7E3 313.8909 2.8E4 317.8857 3.5E3 320.9082 4.0E3 330.8935 2.9E4 331.9003 6.3E3 335.8987 5.4E3 340.8797 4.0E3 348.9038 5.7E3 357.8812 3.3E4 358.8883 2.0E4 375.8921 2.9E3 376.9012 3.8E3 END IONS BEGIN IONS FEATURE_ID=12 PEPMASS=201.9743 SCANS=12 RTINSECONDS=52.584 CHARGE=1+ MSLEVEL=2 MERGED_STATS=1 / 1 (0 removed due to low quality, 0 removed due to low cosine). 51.0861 2.2E3 51.7642 2.4E3 55.9344 3.1E3 82.4017 2.3E3 86.9923 2.5E3 95.9308 2.3E3 114.1716 2.1E3 117.9888 3.1E3 133.9585 2.7E3 135.9995 1.3E4 144.9850 2.5E3 145.9840 1.1E4 163.9946 1.6E4 173.5274 1.5E4 173.5452 4.4E3 173.9790 6.9E3 177.6848 3.1E3 191.9898 1.1E4 197.0051 2.3E3 202.0758 2.2E3 END IONS BEGIN IONS FEATURE_ID=13 PEPMASS=220.9816 SCANS=13 RTINSECONDS=52.584 CHARGE=1+ MSLEVEL=2 MERGED_STATS=1 / 1 (0 removed due to low quality, 0 removed due to low cosine). 56.2829 2.5E3 100.9752 8.1E3 105.0030 2.8E3 118.9857 2.0E4 119.0493 3.3E3 123.2931 2.3E3 128.9703 3.7E3 130.0412 4.8E3 134.9987 5.3E3 135.0435 3.0E3 135.9993 3.5E3 136.9962 9.1E4 146.9806 4.1E4 147.0436 8.9E3 149.0609 2.6E3 155.0065 1.9E4 156.9653 8.3E3 160.0524 2.5E3 162.0669 7.6E3 162.9938 4.8E3 163.0389 1.5E4 164.9912 1.1E5 172.9789 2.8E3 173.5315 9.8E3 174.9579 5.3E3 174.9758 7.6E4 175.0397 8.4E3 177.0545 2.5E3 178.0627 9.2E3 184.9601 3.4E3 190.0620 8.9E3 190.9888 4.1E3 191.0340 5.9E3 191.9881 2.9E3 192.9864 2.1E5 193.0852 4.5E3 202.9711 3.6E4 220.9817 9.2E4 END IONS BEGIN IONS FEATURE_ID=14 PEPMASS=243.9975 SCANS=14 RTINSECONDS=52.605 CHARGE=1+ MSLEVEL=2 MERGED_STATS=1 / 1 (0 removed due to low quality, 0 removed due to low cosine). 48.2452 3.3E3 48.2474 4.0E3 50.7436 2.8E3 55.2436 2.9E3 67.6687 2.1E3 84.9800 5.2E3 86.9924 6.3E3 88.0227 2.9E3 88.9523 3.1E3 88.9901 5.4E3 97.4662 2.4E3 99.9782 3.0E3 100.9752 3.6E4 105.0028 4.8E3 107.0009 5.9E3 110.9531 2.1E3 110.9609 8.3E3 111.9683 3.0E3 116.9879 7.1E3 117.9891 5.4E3 118.9858 9.6E4 128.9703 2.8E4 129.3957 2.6E3 134.9987 2.3E4 135.9995 2.5E4 136.9964 4.1E5 139.0006 2.5E3 140.9704 5.8E3 144.9831 1.0E4 145.9838 9.4E3 146.9809 2.3E5 149.7509 2.7E3 153.0087 2.8E3 155.0071 5.6E4 156.9654 1.0E5 157.1405 2.2E3 162.9938 2.0E4 163.9946 1.8E4 164.9916 4.2E5 166.9954 4.9E3 172.9782 2.5E4 173.5353 9.8E3 173.9792 3.0E4 174.9762 9.0E5 175.0117 4.3E3 176.9802 3.3E3 183.9623 2.6E3 184.9609 7.6E4 188.0077 3.1E3 190.9888 3.1E4 191.9898 4.1E4 192.9339 3.7E3 192.9868 1.3E6 193.0538 3.3E3 193.9922 3.0E3 194.9911 1.1E4 197.9912 4.3E3 200.9735 6.9E3 201.9744 2.5E4 202.9714 9.4E5 203.0161 4.1E3 203.8820 2.4E3 204.9764 2.9E3 215.9589 3.0E3 216.0028 5.5E3 218.9839 6.6E3 219.9850 2.6E4 220.9321 4.2E3 220.9418 6.7E3 220.9821 1.0E6 221.9834 3.7E3 222.9862 3.5E3 225.9866 4.2E3 243.9988 5.9E3 END IONS BEGIN IONS FEATURE_ID=15 PEPMASS=265.0159 SCANS=15 RTINSECONDS=52.623 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 7 (2 removed due to low quality, 0 removed due to low cosine). 47.3910 2.1E3 47.7467 3.9E4 47.7483 3.9E3 50.2424 3.1E4 50.2446 7.9E3 54.3586 2.4E3 54.7454 4.7E4 54.7475 8.4E3 58.5121 2.5E3 62.5281 2.4E3 63.5575 2.6E3 68.5156 2.3E3 68.9825 1.8E4 70.4228 2.2E3 74.3953 2.1E3 75.4429 2.3E3 75.6608 2.2E3 77.0840 2.5E3 79.0198 2.2E3 80.9676 4.3E3 82.9830 1.9E4 86.9927 6.7E4 91.0079 2.8E3 94.4168 2.3E3 95.8831 2.4E3 96.7130 2.2E3 98.7404 2.2E3 98.9778 1.9E5 102.4020 2.5E3 102.5301 2.4E3 103.7264 2.2E3 105.0032 7.6E4 105.5531 2.4E3 108.9637 6.5E4 110.5262 2.1E3 114.4533 2.7E3 116.9790 4.9E3 116.9884 5.3E5 125.6883 2.3E3 126.9728 1.6E5 127.9836 2.7E3 134.9898 5.2E3 134.9989 2.0E6 135.0087 4.9E3 137.0035 1.4E4 137.9667 1.7E4 138.9733 4.4E4 144.9833 1.2E6 144.9938 2.8E3 145.0023 3.6E3 149.6697 3.6E3 149.6805 3.6E3 149.6907 6.2E3 153.0095 3.1E5 153.0233 5.8E3 154.9568 3.4E3 154.9678 6.4E5 154.9815 9.0E3 158.0153 5.5E3 162.9939 2.3E6 163.0057 6.6E3 164.9985 9.1E3 165.7555 2.4E3 167.9310 8.8E3 172.9448 3.4E4 172.9512 1.2E4 172.9785 5.5E6 173.0068 8.1E3 173.0136 3.0E4 173.0236 5.6E3 173.5300 4.3E4 173.5412 4.2E3 174.9831 1.4E4 175.9573 3.3E4 181.0039 3.5E3 182.9355 3.1E3 182.9474 4.9E3 182.9631 9.2E5 182.9803 3.4E3 184.9417 4.1E4 185.9420 1.9E5 186.0098 7.1E3 190.9365 7.0E3 190.9498 8.2E4 190.9567 2.4E4 190.9889 9.5E6 191.0214 3.4E4 191.0297 6.6E4 191.0413 1.5E4 191.0645 3.5E3 191.9938 5.3E3 192.9933 5.3E4 194.8437 2.5E3 195.9269 2.4E3 195.9940 2.2E4 200.9294 5.9E4 200.9563 2.8E4 200.9734 1.1E7 201.0076 1.1E4 201.0180 3.7E4 201.0306 1.2E4 201.0539 4.0E3 201.9790 4.7E3 202.9524 2.5E4 202.9777 1.6E4 203.9526 1.1E5 205.0055 7.4E3 208.9997 5.1E3 210.0660 2.9E3 212.9361 3.3E4 213.9372 2.4E5 214.0052 5.3E4 214.9902 5.5E3 218.8915 3.3E3 218.9058 6.3E3 218.9196 2.7E4 218.9338 1.1E5 218.9450 7.5E4 218.9656 1.2E5 218.9840 1.4E7 219.0240 6.7E4 219.0338 9.0E4 219.0489 2.2E4 219.0618 9.0E3 219.9895 1.8E4 220.9883 5.7E4 221.9319 3.1E3 223.9285 9.0E3 223.9897 5.1E4 231.9473 8.7E3 232.8300 3.0E3 232.9994 2.1E4 241.9325 9.1E3 242.0003 6.9E4 END IONS BEGIN IONS FEATURE_ID=16 PEPMASS=200.9733 SCANS=16 RTINSECONDS=52.642 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 10 (7 removed due to low quality, 0 removed due to low cosine). 40.2668 2.1E3 42.0337 6.8E3 42.8274 2.6E3 44.4054 2.6E3 44.5527 2.4E3 46.1446 3.3E3 47.3785 4.2E3 49.3462 2.3E3 51.1805 2.9E3 51.9398 1.3E4 55.9342 5.9E4 56.9369 3.3E4 56.9420 4.2E3 62.8224 3.1E3 67.9349 2.3E3 72.9369 2.9E4 73.6686 2.4E3 74.9526 9.3E3 79.2948 3.6E3 85.6883 2.4E3 85.9453 3.0E3 86.9922 3.5E3 90.9474 7.4E4 96.9373 3.0E4 98.4185 2.4E3 98.9776 6.4E3 100.8765 3.2E3 102.9480 1.2E4 105.0032 5.4E3 106.0318 3.3E3 107.9502 9.5E3 113.6128 3.3E3 113.9634 2.3E4 114.9479 8.5E4 114.9712 2.8E3 115.9790 1.9E4 116.9881 2.8E4 118.9425 3.3E4 121.2772 4.0E3 126.9719 2.9E3 128.9505 1.3E4 129.9524 9.7E3 130.9115 2.7E3 131.9741 8.6E4 132.9585 6.9E4 134.9987 1.4E5 135.9453 9.5E3 136.9537 4.1E3 137.0131 2.5E3 137.9640 4.0E4 141.9592 5.4E3 144.9832 4.4E4 149.9845 7.3E3 153.0094 3.8E4 155.9747 4.6E4 159.9455 7.1E3 162.9783 5.9E3 162.9938 1.9E5 164.3964 3.8E3 165.6960 2.3E3 172.9783 2.5E4 173.5250 1.3E4 173.5383 1.8E4 177.9564 1.5E4 182.6409 2.4E3 190.9889 9.8E4 END IONS BEGIN IONS FEATURE_ID=17 PEPMASS=223.9894 SCANS=17 RTINSECONDS=52.642 CHARGE=1+ MSLEVEL=2 MERGED_STATS=8 / 9 (1 removed due to low quality, 0 removed due to low cosine). 42.0336 7.4E3 42.3178 2.0E3 42.4618 2.0E3 44.9025 9.1E3 46.6222 5.3E3 47.0147 4.0E3 49.2221 4.6E3 49.3655 5.0E3 50.8363 2.9E3 51.3423 8.8E3 51.9397 2.9E3 53.7235 7.3E3 57.4564 3.5E3 58.3933 6.7E3 58.6829 6.0E3 61.3785 2.9E3 63.1007 2.1E3 64.3458 2.5E3 67.6255 8.0E3 68.9825 5.4E3 73.1854 9.3E3 78.6031 4.8E3 78.9521 3.8E3 83.3050 4.1E3 85.9455 6.8E3 86.8608 5.7E3 90.7050 3.2E3 92.7739 7.7E3 92.8701 3.7E3 93.1291 4.4E3 94.2074 6.9E3 95.2317 5.7E3 96.9373 5.6E4 98.9773 9.5E3 100.0053 5.1E3 100.3167 6.5E3 102.2223 5.9E3 102.9480 4.5E4 103.9682 7.0E3 105.0027 3.4E3 113.9634 4.1E4 114.9479 1.9E5 116.9881 2.0E5 117.5337 6.7E3 118.1390 2.5E3 118.9427 3.4E3 119.1787 8.3E3 121.1667 4.6E3 124.5858 4.9E3 126.9723 4.8E3 131.7192 4.8E3 132.9585 1.4E5 134.9877 4.7E3 134.9987 8.3E5 135.2151 7.3E3 137.9638 1.2E5 138.5668 5.0E3 141.9590 4.7E3 143.0904 2.6E3 144.9830 1.5E5 149.0745 8.5E3 153.0092 3.1E5 154.9670 9.3E3 155.9745 3.3E5 156.9825 4.1E3 159.9455 5.2E4 162.9937 1.4E6 171.8854 6.9E3 172.9785 1.9E5 173.5209 1.6E4 173.5302 4.1E4 173.5374 1.2E5 177.9564 1.2E5 181.0043 1.3E4 182.9636 2.6E3 190.9685 4.3E4 190.9886 2.0E6 191.0084 1.8E4 195.1494 6.4E3 200.9729 7.1E4 208.3358 3.4E3 218.3919 3.0E3 218.9309 6.8E3 218.9838 7.0E5 END IONS BEGIN IONS FEATURE_ID=18 PEPMASS=224.9906 SCANS=18 RTINSECONDS=52.642 CHARGE=1+ MSLEVEL=2 MERGED_STATS=1 / 1 (0 removed due to low quality, 0 removed due to low cosine). 55.6341 3.2E3 77.5835 3.3E3 78.4419 3.6E3 79.4074 3.3E3 79.8054 3.2E3 83.6670 3.4E3 88.5534 3.3E3 115.4137 3.4E3 117.9888 1.8E4 133.9588 4.3E3 134.9985 1.8E4 135.9993 7.5E4 145.9840 1.3E4 153.0088 8.7E3 153.4739 3.4E3 154.0099 3.1E4 162.9935 2.3E4 163.9944 1.3E5 170.8000 3.5E3 173.5380 2.1E4 173.9793 2.5E4 190.9885 3.4E4 191.9895 2.2E5 192.0049 3.5E3 192.0103 4.9E3 201.9742 5.6E3 218.9857 6.0E3 219.9845 7.8E4 END IONS BEGIN IONS FEATURE_ID=19 PEPMASS=241.9999 SCANS=19 RTINSECONDS=52.642 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 8 (4 removed due to low quality, 0 removed due to low cosine). 43.2440 2.1E4 43.2454 3.5E3 45.6908 2.6E3 46.8208 2.9E3 47.7464 4.2E4 47.7485 1.1E4 49.7843 3.9E3 49.9951 2.0E3 50.2421 4.1E3 50.2433 2.5E4 51.0659 4.0E3 51.0684 3.4E3 52.6454 2.4E3 54.7458 2.9E4 54.7476 8.9E3 58.0727 2.2E3 59.9744 2.4E3 60.7064 2.8E3 68.9822 3.6E4 70.3340 2.5E3 72.5081 2.4E3 79.7936 2.2E3 80.9677 1.4E4 82.1644 2.6E3 82.9827 3.0E4 84.9596 7.8E4 85.2779 2.7E3 86.9926 9.7E4 87.5040 2.4E3 90.8823 2.4E3 94.8306 2.8E3 95.4531 2.4E3 96.9568 3.4E3 98.9776 3.3E5 102.9703 6.2E3 105.0032 1.1E5 108.3570 2.7E3 108.9633 7.3E4 109.9714 9.8E3 110.9789 2.6E3 116.9883 9.6E5 118.9928 2.6E3 123.0133 3.9E3 126.9727 2.4E5 127.9813 2.9E3 132.5779 3.2E3 134.9988 3.5E6 135.0085 2.6E4 135.0228 8.5E3 136.0042 3.6E3 137.0032 3.0E4 137.9664 1.1E4 138.4567 2.6E3 138.9729 3.7E4 141.8606 3.1E3 144.9832 1.8E6 144.9939 1.6E4 146.9881 9.2E3 153.0093 5.5E5 153.0234 5.8E3 154.9526 1.1E4 154.9676 7.5E5 154.9821 6.2E3 155.0148 3.2E3 158.0148 1.7E4 158.6784 2.8E3 162.9617 1.7E4 162.9938 4.1E6 163.0060 2.1E4 163.0187 8.6E3 163.0263 1.3E4 163.9982 3.8E3 164.9985 3.3E4 167.9982 3.6E3 172.9433 2.4E4 172.9504 9.5E3 172.9782 6.3E6 173.0065 9.2E3 173.0107 6.6E4 173.0232 9.5E3 173.5268 1.5E4 173.5386 2.2E4 173.9823 2.5E3 174.9829 2.2E4 177.0118 3.1E3 180.0883 2.9E3 180.7744 3.2E3 181.0042 5.3E3 182.9444 4.8E3 182.9628 5.9E5 182.9804 5.0E3 186.0098 2.6E4 186.9939 3.8E3 188.9988 2.4E3 190.9362 1.8E4 190.9483 8.3E4 190.9562 3.5E4 190.9888 1.3E7 191.0034 6.0E4 191.0208 6.8E4 191.0295 8.5E4 191.0414 3.1E4 191.0525 9.9E3 191.0756 5.0E3 191.9925 2.1E4 192.9933 7.0E4 194.3332 2.7E3 195.9943 2.4E4 200.9288 1.2E4 200.9732 6.6E6 201.0173 2.6E4 202.9767 4.5E3 205.0055 6.9E3 208.9998 1.0E4 213.9584 3.8E3 214.0051 7.5E4 214.9858 2.7E3 218.9196 1.3E4 218.9336 4.8E4 218.9440 2.2E4 218.9839 9.9E6 219.0237 5.0E4 219.0337 6.4E4 219.0482 1.7E4 219.0620 6.2E3 219.9890 6.7E3 220.9882 3.8E4 223.9892 3.0E4 231.9698 2.1E4 232.9993 1.4E4 241.9552 5.7E3 241.9999 4.8E4 251.8621 2.4E3 END IONS BEGIN IONS FEATURE_ID=20 PEPMASS=268.9483 SCANS=20 RTINSECONDS=52.642 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 6 (4 removed due to low quality, 0 removed due to low cosine). 59.1000 2.2E3 59.4118 2.5E3 68.7811 2.2E3 76.5298 2.7E3 84.6393 2.4E3 102.9723 2.8E3 109.9982 2.2E3 118.3204 2.7E3 120.9837 6.5E3 126.4163 2.4E3 130.1564 2.4E3 130.4922 3.0E3 136.9958 5.9E3 137.9971 6.2E3 138.9937 3.4E4 147.9809 2.6E3 148.9782 2.0E4 157.0040 2.8E3 158.9628 1.5E4 164.9906 8.4E3 165.9930 3.8E3 166.9889 3.4E4 173.5240 1.8E4 173.5418 1.6E4 174.9759 5.4E3 175.9769 1.2E4 176.9333 1.6E4 176.9736 9.8E4 186.9580 1.6E4 190.9891 3.3E3 192.9864 1.4E4 193.9874 2.2E4 194.9460 7.4E3 194.9843 1.5E5 202.9728 4.4E3 203.9723 2.7E4 204.9285 1.1E4 204.9690 2.1E5 205.0005 2.6E3 212.9583 5.5E4 217.8920 2.6E3 217.9371 6.5E3 220.9828 8.4E3 221.9830 3.0E4 222.9411 3.3E3 222.9798 2.5E5 223.0145 2.8E3 230.9687 1.5E5 230.9952 4.9E3 235.9463 2.5E3 240.9262 3.5E3 240.9532 9.5E4 246.9716 2.5E3 248.9789 2.8E4 258.9634 5.2E4 END IONS BEGIN IONS FEATURE_ID=21 PEPMASS=286.9591 SCANS=21 RTINSECONDS=52.664 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 7 (2 removed due to low quality, 0 removed due to low cosine). 51.6660 2.0E3 55.1189 2.5E3 64.5549 2.4E3 79.7548 2.2E3 82.9014 2.5E3 87.5198 2.3E3 94.3006 2.2E3 103.2496 2.3E3 129.4578 2.4E3 135.0441 3.9E3 135.9984 2.5E3 136.0470 4.4E3 142.0597 2.7E3 144.0525 4.2E3 150.1429 2.3E3 155.0739 2.2E3 156.0587 2.6E3 162.8864 2.3E3 172.0482 2.9E3 172.9778 8.0E3 173.5231 1.5E4 173.5322 3.5E4 173.5418 1.4E4 173.9610 3.0E3 174.0631 2.8E3 176.9331 1.1E4 178.4519 2.4E3 178.9512 2.6E3 187.9256 4.5E3 190.9879 2.0E4 192.9855 4.3E3 194.9475 1.4E4 195.0168 3.0E3 197.2017 2.2E3 201.0550 8.5E3 202.0580 2.1E4 202.9724 7.3E3 204.9279 3.1E4 204.9688 1.1E4 205.9363 6.1E3 212.9085 2.8E3 212.9581 1.7E5 217.9363 3.8E4 218.9441 3.0E3 220.9826 7.8E3 221.9307 3.4E3 221.9835 6.8E3 222.8939 4.0E3 222.9415 1.4E4 222.9800 1.4E4 225.7995 2.5E3 230.9405 3.2E3 230.9687 4.9E5 232.9231 2.5E3 235.9467 6.0E4 240.9240 7.6E3 240.9530 9.1E5 240.9816 5.4E3 248.9791 1.1E5 258.9634 5.2E5 258.9949 5.6E3 276.9742 1.4E4 278.1335 2.3E3 281.8661 2.8E3 283.3996 2.6E3 END IONS BEGIN IONS FEATURE_ID=22 PEPMASS=382.9291 SCANS=22 RTINSECONDS=52.664 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 4 (2 removed due to low quality, 0 removed due to low cosine). 59.1292 2.2E3 69.5127 2.5E3 92.9846 2.1E3 94.3095 2.3E3 97.3382 3.1E3 136.5494 2.3E3 149.6820 1.0E4 149.6929 1.0E4 173.5335 1.1E4 180.7524 2.5E3 194.4470 2.6E3 202.9704 3.4E3 212.9569 3.8E3 218.9822 3.1E3 220.9816 8.0E3 221.9830 2.7E3 222.9440 3.1E3 222.9782 5.0E3 230.9690 8.1E3 240.9529 1.5E5 246.2632 2.3E3 250.5887 2.1E3 258.9634 1.1E5 262.9159 2.9E3 272.9036 7.2E3 273.9049 6.5E3 276.9742 3.0E3 286.9193 2.5E3 316.9537 6.0E3 327.9662 2.4E3 344.9468 4.5E3 354.9332 1.2E4 360.0296 3.4E3 372.9440 1.4E4 END IONS BEGIN IONS FEATURE_ID=23 PEPMASS=400.9397 SCANS=23 RTINSECONDS=52.669 CHARGE=1+ MSLEVEL=2 MERGED_STATS=1 / 4 (3 removed due to low quality, 0 removed due to low cosine). 57.8472 2.5E3 70.9126 2.5E3 133.6789 2.3E3 168.0534 2.3E3 173.5296 1.7E4 174.0152 2.4E3 212.9576 6.7E3 222.9440 6.9E3 230.9687 1.5E4 240.9529 4.0E5 244.9489 3.3E3 248.9791 3.8E3 258.9633 2.8E5 276.9736 9.9E3 298.9442 8.8E3 312.1033 2.4E3 316.9535 2.0E4 326.9388 5.3E3 336.9268 6.2E3 344.9500 1.0E4 354.9334 8.9E4 354.9835 3.7E3 372.8896 5.4E3 372.9438 1.3E5 END IONS BEGIN IONS FEATURE_ID=24 PEPMASS=413.8713 SCANS=24 RTINSECONDS=52.689 CHARGE=1+ MSLEVEL=2 MERGED_STATS=1 / 1 (0 removed due to low quality, 0 removed due to low cosine). 62.0161 2.2E3 149.4229 2.1E3 173.5330 1.0E4 200.9722 3.6E3 218.9850 9.8E3 219.9847 2.9E3 240.9534 4.4E3 272.9038 2.8E4 272.9330 2.9E3 273.9128 8.0E3 290.9152 1.1E4 291.9236 3.2E3 302.8613 2.8E3 317.9022 1.5E4 330.8948 8.0E3 358.8885 6.7E3 372.8991 3.4E3 386.8842 8.6E3 415.9439 2.4E3 END IONS BEGIN IONS FEATURE_ID=25 PEPMASS=287.9601 SCANS=25 RTINSECONDS=52.754 CHARGE=1+ MSLEVEL=2 MERGED_STATS=1 / 1 (0 removed due to low quality, 0 removed due to low cosine). 52.0742 2.6E3 63.6090 2.4E3 68.5033 2.1E3 121.3142 2.4E3 135.0439 9.5E3 135.7920 2.2E3 151.4068 2.6E3 173.5247 5.6E3 173.5419 6.1E3 174.2494 2.7E3 208.8828 6.9E3 213.9586 6.8E3 226.8943 4.1E3 231.9697 3.4E4 236.9475 2.9E3 241.9541 4.6E4 248.9785 2.5E3 249.9803 1.8E4 259.9648 5.2E4 277.9751 4.8E3 END IONS BEGIN IONS FEATURE_ID=26 PEPMASS=337.9701 SCANS=26 RTINSECONDS=52.754 CHARGE=1+ MSLEVEL=2 MERGED_STATS=1 / 1 (0 removed due to low quality, 0 removed due to low cosine). 50.6270 2.2E3 56.2916 2.3E3 108.2976 2.5E3 118.6811 2.3E3 157.4897 2.8E3 162.9939 2.8E3 172.9780 7.0E3 173.5321 1.8E4 182.9627 4.0E3 190.9888 1.4E4 200.9731 5.7E4 218.9837 7.4E4 219.9853 3.7E3 248.1794 2.1E3 274.9025 3.2E3 286.1201 2.9E3 292.9140 2.6E3 299.9235 5.6E3 END IONS BEGIN IONS FEATURE_ID=27 PEPMASS=232.9234 SCANS=27 RTINSECONDS=52.766 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 47.6269 2.4E3 65.6772 2.7E3 68.0142 2.1E3 70.3493 2.2E3 72.2663 2.4E3 76.2091 2.3E3 78.1546 2.4E3 84.9596 3.4E3 86.9921 2.4E3 104.7952 2.4E3 105.0034 3.1E3 134.9989 8.5E3 144.9834 3.4E3 148.9378 2.7E3 149.6830 7.5E3 149.6935 3.9E3 149.7042 3.1E3 156.9673 2.4E3 158.9231 1.0E4 162.9937 1.1E4 166.8239 2.5E3 172.9785 1.4E4 173.5346 2.0E4 176.9331 1.5E5 176.9508 4.6E3 177.0078 3.8E3 178.7468 2.3E3 181.9601 2.8E3 189.0096 3.2E3 190.9887 1.9E4 194.9435 4.2E4 200.9730 6.9E3 204.9289 4.0E3 209.9565 3.0E3 215.4590 2.3E3 217.8742 2.9E3 218.9842 9.2E3 232.9981 3.4E3 238.7147 2.6E3 END IONS BEGIN IONS FEATURE_ID=28 PEPMASS=255.9392 SCANS=28 RTINSECONDS=52.784 CHARGE=1+ MSLEVEL=2 MERGED_STATS=9 / 9 (0 removed due to low quality, 0 removed due to low cosine). 44.7156 2.8E3 45.1169 2.2E3 47.2070 2.2E3 47.8319 2.6E3 48.0350 2.3E3 48.3423 2.1E3 49.4703 2.2E3 50.6951 2.8E3 50.7330 2.3E3 50.9395 2.2E3 52.7069 2.3E3 53.7371 2.3E3 54.0024 2.6E3 54.9255 2.5E3 57.0700 1.0E4 57.7954 2.0E3 58.1122 2.4E3 59.5149 2.6E3 61.8092 2.1E3 63.7898 2.4E3 66.4040 2.3E3 68.1173 2.3E3 68.5531 2.3E3 68.9817 2.7E3 71.8638 2.8E3 72.4756 2.8E3 73.0467 2.2E3 74.9252 2.1E3 76.2612 2.4E3 76.7204 2.3E3 77.3214 2.5E3 79.3413 2.4E3 79.3854 2.8E3 81.1577 2.3E3 82.0141 3.0E3 85.5447 2.6E3 86.9926 3.2E4 87.6141 2.4E3 89.4009 2.5E3 89.4417 2.3E3 90.4486 2.2E3 91.1328 2.4E3 91.2955 2.7E3 91.5511 2.4E3 92.0078 2.6E3 94.9053 2.3E3 96.2830 2.6E3 102.5290 2.2E3 105.0029 4.7E4 107.2291 2.5E3 113.4339 2.2E3 113.5570 2.2E3 113.9158 2.5E3 115.6580 2.6E3 127.5197 2.5E3 134.9986 1.3E4 140.9115 4.4E3 144.9828 8.1E3 148.3266 2.6E3 148.5538 2.3E3 148.9380 4.0E4 149.6860 5.3E3 151.3167 2.5E3 156.8517 2.5E3 158.9227 1.3E5 160.0279 2.5E3 162.9936 5.0E4 163.5305 2.8E3 165.9001 2.3E3 166.8751 2.6E3 166.9487 4.3E4 166.9896 7.5E3 167.8295 2.4E3 171.5302 2.5E3 172.9781 1.8E4 173.5222 7.3E3 173.5336 8.4E4 173.5424 5.2E3 176.9197 6.5E3 176.9332 2.2E6 176.9502 8.8E3 177.0095 1.1E4 178.9376 3.5E3 181.9606 5.7E3 183.9510 2.7E3 186.9181 6.3E3 186.9378 5.5E3 186.9933 4.2E3 189.0094 4.2E4 189.4721 2.4E3 190.9885 8.6E4 191.0060 3.0E3 194.9436 1.4E6 194.9603 3.4E3 196.9486 5.4E3 199.9386 7.6E3 200.9733 3.5E4 201.4414 2.4E3 204.9280 2.6E5 204.9485 2.3E4 205.0042 4.4E4 209.9554 3.3E4 214.9335 1.1E4 214.9889 3.1E4 218.3925 2.7E3 218.9837 1.0E5 222.9389 1.3E5 227.5740 2.5E3 232.9231 5.9E4 232.9992 9.6E4 244.5151 2.6E3 250.9342 2.1E4 251.3318 2.5E3 256.2631 1.2E4 END IONS BEGIN IONS FEATURE_ID=29 PEPMASS=320.8668 SCANS=29 RTINSECONDS=55.955 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 50.4709 2.4E3 63.1042 2.6E3 63.1247 3.0E3 69.1382 2.6E3 69.2773 2.4E3 73.0307 2.3E3 74.5823 2.1E3 84.9110 1.4E4 86.0547 2.4E3 89.1685 2.1E3 103.0529 2.4E3 122.9242 6.5E4 123.4929 2.6E3 130.4718 2.8E3 130.7126 2.0E3 143.1808 2.3E3 143.9992 2.5E3 156.1535 2.6E3 163.5064 2.4E3 173.5255 2.7E4 173.5397 3.0E4 183.2463 2.5E3 186.4155 2.4E3 209.3472 2.6E3 216.8613 2.3E3 256.1477 2.6E3 256.1902 2.5E3 271.4027 2.6E3 312.8198 2.6E3 END IONS BEGIN IONS FEATURE_ID=30 PEPMASS=352.8164 SCANS=30 RTINSECONDS=56.25 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 56.3330 2.5E3 62.8915 2.4E3 66.1220 2.5E3 80.7956 2.5E3 89.5988 2.4E3 94.3430 2.3E3 99.8845 2.2E3 103.0372 2.7E3 113.9680 2.4E3 117.3787 2.6E3 121.2038 2.1E3 122.9241 9.0E4 159.6263 2.3E3 165.8527 2.9E3 173.5232 5.4E3 173.5342 4.8E4 181.8199 2.4E3 186.9726 2.5E3 195.1283 2.3E3 230.2904 2.5E3 237.4402 2.4E3 283.8911 2.5E3 337.6373 2.5E3 END IONS BEGIN IONS FEATURE_ID=31 PEPMASS=231.9889 SCANS=31 RTINSECONDS=56.308 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 43.7714 2.4E3 48.1504 2.2E3 55.5470 2.1E3 69.8936 2.1E3 72.2129 2.4E3 72.4896 2.1E3 84.1340 2.3E3 84.7078 2.5E3 86.5177 2.6E3 87.3452 3.1E3 92.2878 2.5E3 96.1014 2.3E3 97.1173 2.4E3 121.0078 2.4E3 169.7758 2.7E3 173.5225 7.9E3 173.5333 3.1E4 173.5418 7.5E3 183.1586 2.3E3 188.9773 2.2E3 196.5381 2.4E3 211.5412 2.1E3 END IONS BEGIN IONS FEATURE_ID=32 PEPMASS=526.7580 SCANS=32 RTINSECONDS=57.061 CHARGE=1+ MSLEVEL=2 MERGED_STATS=1 / 1 (0 removed due to low quality, 0 removed due to low cosine). 65.0164 2.6E3 122.9241 7.5E5 122.9330 1.1E4 122.9403 7.8E3 122.9443 5.3E3 130.3848 2.4E3 173.5227 8.9E3 173.5417 8.6E3 190.9118 4.7E4 196.4842 2.5E3 206.8859 1.6E5 206.9085 5.7E3 274.8734 8.6E3 290.8484 3.0E3 435.5496 2.2E3 END IONS BEGIN IONS FEATURE_ID=33 PEPMASS=206.8862 SCANS=33 RTINSECONDS=57.083 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 2 (0 removed due to low quality, 0 removed due to low cosine). 49.2519 4.0E3 59.2182 3.7E3 60.0804 1.2E4 72.2776 3.0E3 73.2975 5.1E3 74.0599 4.1E3 94.5934 4.4E3 99.0910 3.1E3 103.5103 4.4E3 104.1066 2.8E5 104.1150 8.6E3 107.7283 3.9E3 111.6057 3.0E3 122.9239 8.9E3 173.5261 3.4E4 173.5443 1.3E4 211.6218 3.4E3 END IONS BEGIN IONS FEATURE_ID=34 PEPMASS=290.8478 SCANS=34 RTINSECONDS=57.083 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 2 (0 removed due to low quality, 0 removed due to low cosine). 49.9037 7.3E3 51.3589 6.0E3 52.5731 5.0E3 57.3114 6.1E3 66.3692 6.3E3 70.0648 5.9E3 79.9639 5.6E3 83.2782 5.0E3 110.6243 5.7E3 122.9241 3.3E6 122.9329 5.4E4 122.9450 2.4E4 171.3706 7.0E3 173.5217 2.8E4 173.5392 6.2E4 255.3135 7.6E3 286.2270 6.9E3 END IONS BEGIN IONS FEATURE_ID=35 PEPMASS=292.8459 SCANS=35 RTINSECONDS=57.083 CHARGE=1+ MSLEVEL=2 MERGED_STATS=1 / 1 (0 removed due to low quality, 0 removed due to low cosine). 53.4614 2.5E3 65.8662 2.3E3 70.5944 2.0E3 71.5144 2.2E3 77.9760 2.3E3 86.5126 2.2E3 92.3203 2.2E3 94.5549 2.2E3 95.1218 2.2E3 122.9151 3.6E3 122.9240 5.7E4 124.9125 3.4E3 124.9222 5.2E4 152.0474 2.3E3 163.8323 2.4E3 173.5282 8.3E3 181.1534 2.2E3 190.9615 5.5E3 191.9456 1.3E4 195.2946 2.4E3 208.9722 3.2E4 236.0148 2.7E3 END IONS BEGIN IONS FEATURE_ID=36 PEPMASS=208.8843 SCANS=36 RTINSECONDS=57.115 CHARGE=1+ MSLEVEL=2 MERGED_STATS=1 / 1 (0 removed due to low quality, 0 removed due to low cosine). 48.9552 2.5E3 65.5327 2.3E3 71.8696 2.3E3 94.9295 7.0E3 102.2940 2.5E3 118.2385 2.2E3 127.4034 2.3E3 149.6839 4.8E3 149.6941 4.5E3 173.5344 6.7E3 185.9216 3.8E3 196.2629 2.7E3 END IONS BEGIN IONS FEATURE_ID=37 PEPMASS=381.0800 SCANS=37 RTINSECONDS=58.859 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 9 (5 removed due to low quality, 0 removed due to low cosine). 58.0699 3.1E3 59.6669 2.4E3 60.7059 3.3E3 62.5679 2.4E3 65.5230 2.9E3 69.1319 2.5E3 72.9659 2.3E3 82.0182 2.3E3 98.9379 4.6E3 98.9837 2.8E3 111.3894 2.4E3 115.0550 2.7E3 128.9867 1.5E4 135.0868 2.2E3 141.5070 3.3E3 143.1401 2.3E3 156.7794 2.3E3 160.8656 2.3E3 171.9220 3.6E3 172.9769 4.2E3 173.5292 4.7E4 173.5454 3.2E3 182.9982 3.0E3 192.9166 2.9E3 197.0129 3.1E3 212.6304 3.5E3 214.9880 6.2E3 218.9831 3.9E3 249.9041 3.7E3 251.8901 3.2E3 267.8828 1.0E4 268.8909 3.5E3 272.0125 2.4E3 279.2061 2.3E3 285.8889 3.0E3 291.0396 2.7E3 293.8969 9.8E3 312.0570 2.4E3 355.5080 3.0E3 364.8070 2.3E3 END IONS BEGIN IONS FEATURE_ID=38 PEPMASS=705.1858 SCANS=38 RTINSECONDS=58.95 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 4 (1 removed due to low quality, 0 removed due to low cosine). 68.5479 4.1E3 78.3512 6.2E3 78.3556 9.2E3 80.9041 4.4E3 89.8706 4.2E3 99.7816 4.1E3 102.1244 5.0E3 128.4084 4.4E3 132.2776 4.5E3 134.7683 4.4E3 144.0109 5.4E3 173.5298 4.9E4 173.5405 2.1E4 198.1193 4.5E3 217.8153 5.4E3 238.0772 4.6E3 276.3061 4.7E3 379.0380 4.9E3 437.0384 5.0E3 493.4730 4.5E3 525.1178 2.0E4 543.0364 1.1E4 543.1315 1.6E6 543.3257 5.5E3 701.1425 4.8E3 705.1836 4.7E5 END IONS BEGIN IONS FEATURE_ID=39 PEPMASS=304.1508 SCANS=39 RTINSECONDS=59.347 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 54.1881 2.4E3 56.0494 2.8E5 56.2099 2.6E3 58.0651 2.8E5 68.0494 4.5E4 70.0651 3.9E5 72.0806 3.6E4 74.0235 2.0E4 74.0599 4.3E4 82.0650 4.7E4 84.0443 1.9E4 84.0806 5.8E4 85.0284 1.4E4 85.0760 1.6E5 85.6689 2.2E3 86.0599 3.2E5 86.0960 2.4E3 88.0393 2.6E4 88.0601 2.4E3 94.0651 7.0E3 96.0445 1.2E4 96.0807 2.9E4 97.0760 7.4E3 98.0599 1.3E4 98.0963 7.1E4 99.0915 1.8E4 99.9262 2.3E3 100.0392 6.9E4 100.0756 1.6E4 101.0708 8.3E3 102.0549 3.2E5 110.0600 2.7E3 111.0915 4.8E4 112.0758 7.9E3 113.0710 2.6E4 113.1074 1.8E4 114.0549 2.4E6 114.0629 9.1E3 114.0708 8.2E3 114.0911 2.5E4 124.0656 2.8E3 124.0756 1.8E5 125.0709 5.8E3 127.0866 3.5E4 128.0607 3.3E3 128.0705 1.4E5 129.0658 1.3E5 130.0498 5.5E4 131.0816 7.4E3 139.0866 9.4E4 140.0705 2.4E4 140.1182 7.1E3 141.0661 1.5E4 141.1022 5.7E5 142.0732 4.9E3 142.0862 4.1E5 145.0972 9.7E4 150.0551 1.5E4 151.0866 8.3E4 152.2414 3.5E3 153.1022 2.1E4 157.0610 2.2E4 157.0972 2.9E5 157.1193 3.0E3 158.0445 1.7E4 158.0813 2.6E4 159.1128 6.9E4 168.0656 2.3E4 168.1132 1.7E5 169.0973 7.4E4 170.1288 4.4E4 171.1130 1.4E4 173.5255 3.4E4 173.5411 2.6E4 175.0290 3.9E3 179.0796 3.3E3 179.4686 3.0E3 183.0765 1.5E4 184.0741 3.8E3 184.1082 8.0E3 185.0430 4.2E3 185.0531 2.1E4 185.0626 9.4E3 185.0778 2.9E4 185.0922 4.3E6 185.1306 2.8E4 185.1422 8.4E3 186.0570 3.9E3 186.0762 3.3E5 196.1082 7.5E4 196.1431 1.1E4 197.0922 2.2E4 203.1028 2.3E5 208.8829 3.6E3 214.1188 7.0E4 215.1028 4.8E4 222.1240 1.6E4 233.4840 2.6E3 240.1344 8.9E4 258.1443 1.1E4 259.1286 2.8E3 262.9821 2.5E3 268.1287 1.3E4 286.1404 6.2E4 END IONS BEGIN IONS FEATURE_ID=40 PEPMASS=242.1026 SCANS=40 RTINSECONDS=59.708 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 45.0334 2.5E4 48.7359 2.5E3 49.6066 2.1E3 52.7876 2.6E3 53.0384 4.3E4 53.0409 3.5E3 55.0176 2.4E4 57.0333 4.9E4 59.0489 4.0E3 61.0250 4.0E3 61.0281 1.1E5 63.0357 2.3E3 64.7745 2.2E3 66.4671 2.3E3 69.0332 1.5E5 71.0488 1.8E4 73.0281 4.0E4 80.0434 8.9E3 80.0492 4.5E6 80.0543 2.2E4 80.0583 1.1E5 80.0600 2.0E4 80.0666 4.3E3 81.0332 7.1E4 81.0445 6.2E3 81.5906 2.6E3 83.0124 3.3E3 85.0281 3.9E5 85.0339 2.7E3 87.0437 2.1E4 91.0386 1.4E4 96.0447 2.2E3 97.0281 1.1E5 99.0437 1.8E4 107.4457 2.3E3 109.0282 4.2E4 110.0711 1.0E4 127.0386 3.9E4 134.2751 2.9E3 156.8615 2.6E3 170.9149 9.4E3 173.5317 5.0E4 173.5454 7.5E3 180.0596 2.4E3 187.9191 2.6E3 188.9258 3.8E3 195.6410 2.2E3 205.3279 2.5E3 216.4029 2.7E3 218.6451 2.6E3 END IONS BEGIN IONS FEATURE_ID=41 PEPMASS=203.1505 SCANS=41 RTINSECONDS=59.759 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 41.0386 4.9E3 42.0337 3.8E3 42.5625 2.3E3 43.0289 7.9E3 43.0541 6.7E3 44.0493 7.6E4 46.0651 3.5E6 46.0675 4.3E4 46.0686 3.6E4 46.0698 1.6E4 46.0713 3.7E3 46.0727 4.0E3 47.7927 2.6E3 51.0522 2.2E3 55.0290 6.6E3 55.0541 4.7E3 55.9342 1.4E5 56.0366 3.8E3 56.0493 1.0E5 57.0334 2.6E3 57.0445 6.5E4 58.0647 3.3E3 64.4256 2.6E3 68.0492 2.6E4 70.0597 2.0E4 70.0649 1.2E7 70.0716 8.4E4 70.0737 4.6E4 70.0739 2.0E5 70.0763 1.9E4 70.0788 1.1E4 70.0816 6.8E3 71.0488 3.0E5 71.0603 3.6E6 71.0644 3.2E4 71.0671 2.5E4 71.0692 1.2E4 71.9290 4.0E4 72.0804 6.7E5 72.9368 2.6E4 73.9783 5.0E3 74.0234 3.8E4 74.0597 2.0E4 82.0133 3.7E3 84.0441 1.0E4 85.0471 3.5E3 85.0758 2.0E4 85.1791 4.7E3 86.0598 3.4E4 87.0787 4.2E3 88.0755 1.1E5 88.0867 2.7E6 88.0937 2.8E4 88.0965 1.8E4 88.0991 1.0E4 88.3686 2.5E3 89.9396 6.4E4 90.9475 1.0E4 95.0600 4.2E3 96.9606 4.0E3 97.0757 7.7E4 98.0598 5.1E4 98.3998 2.3E3 98.5365 2.9E3 101.0946 2.4E4 102.0547 6.7E4 107.9502 4.9E4 112.0868 1.2E5 113.0708 2.2E4 113.9634 9.7E3 114.0548 1.4E5 114.1022 4.9E3 114.9713 1.1E4 115.0864 3.3E5 115.1004 3.5E3 116.0704 2.5E6 116.0794 3.9E4 117.7391 2.5E3 120.2574 2.3E3 120.3684 2.1E3 125.9611 1.1E4 126.1025 1.2E5 126.2599 2.2E3 127.0865 4.6E3 128.9505 5.5E4 130.3882 5.5E3 130.9663 4.7E4 133.0970 5.4E4 134.0630 2.3E3 138.9640 7.9E3 141.0655 1.5E4 142.0500 3.4E3 143.0529 6.4E3 144.0658 3.7E3 147.3542 2.6E3 148.9774 2.7E4 150.4143 3.8E3 156.9747 1.2E5 157.0973 7.8E3 158.0925 1.0E5 158.1288 1.6E6 160.0611 2.7E3 161.0638 1.0E4 161.9809 3.6E3 163.4969 5.4E3 172.1082 1.2E5 173.5238 6.3E4 173.5407 7.2E4 173.7237 4.1E3 174.9858 2.5E4 179.9906 5.0E4 186.1239 4.9E3 191.2231 2.5E3 203.0858 9.1E3 203.1507 1.7E5 END IONS BEGIN IONS FEATURE_ID=42 PEPMASS=684.2564 SCANS=42 RTINSECONDS=59.828 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 7 (1 removed due to low quality, 0 removed due to low cosine). 68.7167 2.3E3 69.0331 1.6E5 71.0488 1.5E4 71.0756 2.2E3 73.0281 2.1E5 73.2037 2.5E3 73.4729 2.3E3 76.1077 2.2E3 79.9383 2.5E3 81.0332 3.7E4 82.0885 2.2E3 83.8124 2.2E3 85.0281 3.0E6 85.0336 1.3E4 85.0374 2.2E4 87.0438 2.8E4 87.8495 2.1E3 90.2567 2.3E3 90.9476 2.2E3 91.0387 1.6E6 91.0447 7.5E3 93.4812 2.2E3 95.0638 3.3E3 97.0281 1.3E6 97.0347 6.5E3 98.9289 2.3E3 99.0437 1.5E5 101.0229 3.8E3 101.4097 2.5E3 102.4825 2.4E3 103.0387 1.2E5 104.0680 2.8E3 108.2030 2.4E3 109.0205 3.5E3 109.0280 1.6E5 112.2835 2.3E3 115.0387 1.2E5 117.0544 4.9E4 123.4915 2.2E3 127.0387 2.0E6 127.0475 4.0E4 130.0498 5.5E3 133.1836 2.4E3 138.4641 2.3E3 139.0388 2.5E3 142.0021 2.1E3 145.0493 2.6E6 145.0596 4.0E4 148.0600 6.5E3 149.6902 5.3E3 157.2183 2.7E3 163.0437 7.6E3 163.0601 1.6E6 167.9391 2.3E3 169.0496 4.4E3 173.5191 2.8E3 173.5345 1.1E5 173.5486 2.5E3 174.2350 2.4E3 182.2655 3.3E3 211.0605 2.7E3 229.0708 9.9E3 241.0703 1.9E4 247.1091 2.4E3 248.6729 2.8E3 249.2995 2.4E3 251.7856 3.0E3 256.7496 2.5E3 259.4573 2.3E3 271.0811 2.0E4 289.0938 2.3E3 289.9689 2.6E3 292.9560 2.1E3 296.4577 2.6E3 298.9630 2.4E3 302.7986 2.3E3 325.1133 2.1E4 342.2433 2.5E3 361.3881 2.4E3 402.7353 2.5E3 470.6229 2.4E3 508.5574 2.6E3 510.1204 2.8E3 603.5557 3.5E3 END IONS BEGIN IONS FEATURE_ID=43 PEPMASS=543.1328 SCANS=43 RTINSECONDS=59.85 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 63.6624 2.2E3 66.7671 2.3E3 66.8164 2.0E3 70.2643 2.4E3 78.9006 2.4E3 104.9882 2.6E3 105.1060 2.5E3 111.4681 2.5E3 124.2568 2.1E3 146.7687 2.3E3 149.6686 3.0E3 149.6878 1.1E4 149.6966 3.7E3 162.9424 2.4E3 173.5354 2.5E4 184.0735 3.4E3 196.1144 2.4E3 196.4873 2.6E3 197.9621 2.7E3 210.0505 2.6E3 212.1544 2.3E3 236.8719 2.3E3 259.0003 3.0E3 260.9927 2.4E3 261.9883 3.0E3 272.1903 2.5E3 291.0392 1.3E4 294.0061 3.5E3 334.6439 2.4E3 381.0799 1.0E5 389.4751 2.9E3 474.2448 2.6E3 496.6510 2.7E3 499.1695 3.0E3 543.1325 9.1E4 END IONS BEGIN IONS FEATURE_ID=44 PEPMASS=487.1663 SCANS=44 RTINSECONDS=59.994 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 2 (0 removed due to low quality, 0 removed due to low cosine). 61.0281 6.3E4 62.8221 2.5E3 69.0331 1.3E4 72.8888 2.8E3 73.0281 2.1E4 84.0442 5.4E3 85.0226 3.9E3 85.0279 1.8E5 88.2228 2.4E3 89.0442 2.4E3 91.0386 1.0E5 97.0278 6.7E4 99.0437 4.7E3 101.5377 2.8E3 109.0281 1.2E4 115.0388 3.6E3 116.4145 2.2E3 116.6616 2.4E3 117.3942 2.4E3 127.0386 6.5E4 129.0653 2.4E3 130.0497 4.6E3 138.3640 2.2E3 142.2638 2.4E3 145.0493 5.7E4 150.0538 2.6E3 153.2968 2.2E3 162.0019 2.3E3 163.0601 1.3E4 173.5275 3.1E4 173.9597 2.7E3 182.0268 2.1E4 190.0309 2.4E3 191.0165 9.8E3 201.1930 2.7E3 208.0427 1.6E4 208.9537 2.1E4 215.9717 3.0E3 216.9752 6.7E3 228.9755 3.6E3 250.6823 2.4E3 275.9924 2.1E4 276.9962 4.2E4 279.9542 2.6E3 294.0433 3.4E3 384.1469 3.2E3 END IONS BEGIN IONS FEATURE_ID=45 PEPMASS=505.1767 SCANS=45 RTINSECONDS=60.153 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 60.5755 2.6E3 61.0281 1.2E5 64.9057 2.2E3 66.9880 2.2E3 69.0332 2.3E4 73.0281 3.9E4 76.7513 2.4E3 82.0982 2.9E3 83.5284 2.3E3 85.0280 3.7E5 88.2153 2.7E3 88.2334 2.1E3 90.1782 2.5E3 91.0326 3.9E3 91.0386 2.3E5 94.4126 2.7E3 95.8801 2.3E3 97.0280 1.4E5 99.0439 1.6E4 102.3631 2.6E3 109.0280 1.9E4 111.2539 2.3E3 115.0389 1.2E4 115.7460 2.3E3 117.0548 2.8E3 118.8160 2.9E3 127.0386 1.4E5 130.0497 8.7E3 130.4640 2.4E3 133.0607 6.6E3 134.6072 2.8E3 141.9599 2.5E3 145.0492 1.6E5 145.2476 2.8E3 147.1360 2.4E3 148.0600 3.4E3 149.6783 2.7E3 149.6884 4.8E3 157.0602 5.6E3 163.0597 5.7E4 173.5356 6.1E4 199.0706 3.0E3 203.9034 8.5E3 208.8821 3.2E3 322.0910 2.4E3 325.3924 2.4E3 335.5798 2.5E3 342.9617 2.7E3 349.6082 2.9E3 384.1264 2.3E3 421.7951 2.4E3 END IONS BEGIN IONS FEATURE_ID=46 PEPMASS=258.1102 SCANS=46 RTINSECONDS=60.175 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 5 (0 removed due to low quality, 0 removed due to low cosine). 45.0333 1.7E5 55.7994 2.8E3 56.0494 7.8E3 57.0333 4.0E4 58.0651 7.1E4 59.0730 1.0E4 60.0806 1.4E6 60.0840 1.2E4 62.9021 2.3E3 64.4529 2.9E3 67.7674 2.4E3 70.0651 2.4E3 71.0726 2.2E5 75.0438 1.7E4 77.8912 2.3E3 79.5246 3.4E3 83.7230 2.9E3 85.0283 2.7E3 86.0961 3.1E6 86.1021 1.5E4 86.1054 3.8E4 91.2532 2.7E3 93.1730 2.6E3 97.0280 1.1E4 98.9838 2.6E5 100.9227 2.5E3 104.0975 4.2E4 104.1067 1.4E7 104.1207 7.1E4 104.1209 3.0E5 104.1229 4.1E4 104.1325 3.3E4 124.9995 4.3E6 125.0083 7.6E4 125.0206 2.2E4 130.1949 2.5E3 141.9003 5.9E3 143.0100 3.3E3 158.0322 2.4E3 158.0952 2.4E3 169.0496 3.2E3 173.5243 8.3E4 173.5319 3.2E4 173.5428 6.4E4 181.0263 3.2E4 184.0734 2.4E6 199.0356 2.7E3 221.2243 5.1E3 223.1987 3.1E3 240.0991 1.5E4 243.2221 5.7E3 258.1105 4.4E4 265.1429 6.6E3 END IONS BEGIN IONS FEATURE_ID=47 PEPMASS=558.0887 SCANS=47 RTINSECONDS=60.861 CHARGE=1+ MSLEVEL=2 MERGED_STATS=8 / 8 (0 removed due to low quality, 0 removed due to low cosine). 61.0282 2.8E3 64.6569 2.4E3 65.9038 2.5E3 66.0470 2.0E3 66.6930 2.2E3 67.3241 2.2E3 67.8335 2.7E3 70.6678 2.4E3 71.4911 2.0E3 74.0502 2.2E3 75.9925 2.2E3 77.5982 2.1E3 85.0284 1.2E4 87.2961 2.1E3 91.0387 5.8E3 92.4288 2.3E3 95.1028 2.5E3 96.9852 2.6E3 97.0283 6.7E3 103.3957 2.4E3 103.8177 2.7E3 112.5367 2.4E3 113.1591 2.7E3 113.3861 2.7E3 113.9413 4.4E3 116.3593 2.3E3 117.8623 2.6E3 120.4019 2.4E3 130.4902 2.5E3 131.0637 2.5E3 131.3353 2.4E3 131.9503 6.3E4 143.9506 7.5E3 144.9583 3.0E4 145.9660 2.7E4 149.6766 2.9E3 149.6854 1.7E4 149.6954 1.1E4 149.7073 3.0E3 149.9607 6.2E3 156.9797 2.3E3 157.9661 3.5E4 161.9615 3.0E4 163.9769 9.6E3 169.9668 1.5E4 171.9216 3.1E3 173.5264 7.9E4 173.5399 6.0E4 173.9440 3.5E3 173.9612 3.0E5 174.9689 1.2E5 174.9902 7.5E3 175.9768 8.8E3 181.9664 3.3E4 183.9834 5.6E3 185.9611 3.5E5 186.9689 3.0E5 187.9168 3.6E3 187.9767 1.3E4 192.7504 2.4E3 195.9822 3.8E3 197.9612 7.8E4 198.9690 7.7E4 199.9767 1.9E5 201.9571 3.3E3 203.9489 1.0E4 203.9717 9.5E5 203.9939 8.0E3 204.9796 3.5E4 209.9619 2.3E4 210.9687 2.6E4 211.9171 2.3E4 211.9769 7.5E4 215.9718 4.1E5 216.9796 2.6E5 223.9763 8.2E3 224.9244 2.1E4 226.0029 2.7E3 227.9111 1.5E4 227.9719 3.3E4 227.9959 3.3E3 228.9795 3.5E3 229.9872 4.9E4 233.9822 4.1E5 234.0059 3.9E3 234.9459 2.8E3 234.9901 4.7E4 235.9773 6.6E3 237.9323 4.5E4 239.9711 3.5E4 240.1096 2.3E3 240.9784 2.4E3 241.0034 3.5E3 245.6246 3.0E3 246.8982 4.9E3 246.9905 1.1E4 247.9016 2.9E3 251.9930 9.5E3 253.0013 3.5E3 255.9900 1.8E4 257.9817 2.3E4 258.8979 2.8E3 259.9011 3.5E3 263.9552 4.1E3 267.8836 8.4E3 268.9985 8.2E3 269.9226 1.1E4 269.9813 1.8E4 271.9969 3.2E3 274.0002 8.2E3 275.9576 8.0E3 275.9930 8.8E5 276.0278 1.2E4 276.9638 3.2E3 277.0007 7.5E5 277.0351 3.8E3 277.4905 3.0E3 278.0096 2.5E3 279.0931 1.4E4 280.0968 2.0E4 284.6137 2.6E3 287.9930 3.8E4 289.0010 1.8E5 290.0074 3.5E3 294.0036 5.4E4 295.0108 7.7E3 301.0006 5.5E3 302.0088 5.2E4 306.0034 4.2E4 307.0113 1.3E5 312.2621 2.6E3 319.0111 1.5E4 320.0190 8.3E4 323.0068 4.7E3 325.9925 8.9E3 336.0137 1.6E5 337.0219 2.8E5 338.0300 2.1E4 343.9586 3.5E3 349.0210 1.5E4 366.1698 2.4E3 378.0261 1.2E4 378.9770 8.2E3 379.0324 6.2E5 396.0349 2.5E5 397.0433 9.7E4 427.9508 2.7E3 439.0531 7.7E4 440.9495 2.8E3 486.2583 2.6E3 506.6147 2.4E3 531.4609 2.6E3 END IONS BEGIN IONS FEATURE_ID=48 PEPMASS=527.1586 SCANS=48 RTINSECONDS=61.118 CHARGE=1+ MSLEVEL=2 MERGED_STATS=1 / 1 (0 removed due to low quality, 0 removed due to low cosine). 71.6231 2.5E3 79.5252 2.1E3 86.2059 2.2E3 107.6391 2.3E3 139.0715 2.3E3 141.6462 2.5E3 149.6828 3.9E3 149.6937 5.6E3 173.5263 3.8E3 185.0415 7.0E3 203.0522 1.2E4 210.6463 2.3E3 347.0948 1.2E4 365.1047 4.7E5 527.1572 6.3E4 END IONS BEGIN IONS FEATURE_ID=49 PEPMASS=522.2034 SCANS=49 RTINSECONDS=61.269 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 8 (3 removed due to low quality, 0 removed due to low cosine). 61.0281 5.9E5 62.9801 2.2E3 65.1656 2.4E3 65.5097 2.5E3 69.0332 2.8E5 69.5968 2.5E3 70.3159 2.3E3 71.0489 2.6E4 73.0281 2.5E5 73.3892 2.5E3 81.0332 4.4E4 82.1732 2.4E3 85.0281 3.4E6 85.0342 1.3E4 85.0374 3.0E4 85.0400 1.2E4 87.0437 2.2E4 91.0387 1.4E6 91.0449 4.9E3 92.8474 2.6E3 97.0281 1.3E6 97.0348 6.0E3 98.0074 2.1E3 99.0438 1.5E5 101.0233 1.7E4 103.0387 8.4E4 104.0706 2.8E3 107.6199 2.3E3 109.0206 3.7E3 109.0281 2.1E5 115.0387 1.1E5 117.0544 3.8E4 117.7202 2.6E3 127.0280 5.5E3 127.0387 2.1E6 127.0474 3.9E4 127.0602 4.7E3 130.2876 2.9E3 134.3440 2.5E3 145.0494 2.3E6 145.0596 4.2E4 145.0756 5.1E3 160.8831 2.3E3 163.0601 1.1E6 163.7284 2.3E3 166.1016 2.5E3 173.5253 1.0E5 173.5435 4.1E4 176.2130 2.5E3 179.2782 2.3E3 184.6613 2.2E3 206.8352 2.8E3 211.5701 3.2E3 222.3943 2.4E3 231.4136 2.4E3 232.5923 3.0E3 237.8654 2.3E3 241.0714 1.4E4 246.8499 2.1E3 253.0725 2.4E3 271.0820 2.7E3 278.2887 2.3E3 298.3737 2.7E3 325.1149 2.3E3 457.4796 2.3E3 463.0646 3.1E3 466.6128 2.6E3 470.9329 2.7E3 474.9734 2.6E3 END IONS BEGIN IONS FEATURE_ID=50 PEPMASS=490.1770 SCANS=50 RTINSECONDS=61.355 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 5 (0 removed due to low quality, 0 removed due to low cosine). 58.9969 2.4E3 65.9915 2.7E3 66.1955 2.3E3 68.2927 2.1E3 69.0329 2.3E3 72.0804 2.8E4 72.7995 2.2E3 73.3970 2.2E3 76.0019 2.3E3 76.7716 2.1E3 79.4446 2.3E3 84.0441 1.5E6 84.0527 2.4E4 84.0532 8.2E3 85.0282 4.0E4 88.1339 2.2E3 91.3003 2.1E3 93.4608 2.2E3 95.8387 2.5E3 102.0546 9.2E5 102.0618 4.6E3 102.0906 6.7E3 105.6548 2.7E3 111.7617 2.2E3 112.0343 2.4E3 116.6058 2.5E3 127.0388 3.8E3 130.0336 3.2E3 130.0495 1.9E6 130.0591 2.3E4 130.8713 2.6E3 131.0338 2.2E4 136.2400 2.3E3 137.8505 2.4E3 137.9807 2.3E3 139.5491 2.5E3 148.0601 3.4E6 148.0712 6.2E4 148.0888 7.6E3 148.0946 3.3E4 155.9381 2.5E3 156.1931 2.1E3 169.9293 6.1E3 173.5322 9.6E4 178.2268 2.1E3 183.7029 2.6E3 203.9831 8.0E3 212.9361 1.4E4 230.9466 6.0E3 246.4849 2.5E3 247.9835 1.2E4 271.9844 6.0E3 275.1957 2.5E3 283.9857 2.9E3 305.8323 2.3E3 314.3346 2.6E3 345.8247 3.6E3 377.6254 2.5E3 404.9819 2.3E3 407.4335 2.3E3 417.0670 2.6E3 495.6085 2.7E3 495.9007 2.9E3 END IONS BEGIN IONS FEATURE_ID=51 PEPMASS=261.0371 SCANS=51 RTINSECONDS=61.719 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 3 (1 removed due to low quality, 0 removed due to low cosine). 45.0334 9.6E3 53.0385 1.1E4 55.0177 7.9E3 55.9342 2.3E3 56.7413 2.3E3 57.0333 3.0E4 57.3165 2.3E3 59.5699 2.7E3 60.7272 2.8E3 61.0281 4.4E4 65.7232 2.2E3 67.0085 2.0E3 69.0331 7.8E4 69.4195 2.5E3 71.0489 9.4E3 71.3299 3.1E3 73.0281 1.2E4 75.3670 2.3E3 76.5573 2.3E3 81.0292 2.3E3 81.0331 4.1E4 84.0440 9.2E3 85.0280 3.6E5 85.0342 2.4E3 85.9191 2.9E3 87.0440 9.1E3 91.0390 8.4E3 97.0213 3.5E3 97.0279 1.2E5 98.9839 8.9E5 98.9927 1.4E4 99.0436 1.7E4 105.7278 2.3E3 109.0281 3.9E4 127.0387 4.1E4 134.1994 2.3E3 145.0495 3.6E3 157.0468 1.1E4 165.3580 2.5E3 170.9138 5.1E3 171.9217 4.4E3 173.5307 3.8E4 178.9231 2.4E3 196.9769 1.2E4 200.0464 2.4E3 249.9807 2.1E3 END IONS BEGIN IONS FEATURE_ID=52 PEPMASS=343.1239 SCANS=52 RTINSECONDS=61.856 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 6 (0 removed due to low quality, 0 removed due to low cosine). 50.4143 2.5E3 51.1651 2.1E3 51.4730 2.8E3 51.5205 2.1E3 53.5112 2.1E3 53.7342 2.2E3 53.7943 2.2E3 55.0177 3.1E4 57.0332 3.3E4 61.0281 1.4E5 61.8155 2.4E3 63.0266 2.3E3 67.1742 2.9E3 69.0331 1.4E5 69.9013 2.4E3 70.8352 2.1E3 71.0488 8.2E3 72.0559 2.9E3 73.0281 5.6E4 78.2266 2.2E3 80.0498 2.7E3 81.0332 3.0E4 82.1571 2.4E3 85.0279 5.6E5 86.0315 4.2E3 86.2455 2.4E3 87.0436 2.5E3 89.3726 2.5E3 89.6925 2.1E3 89.7088 2.3E3 91.0386 1.1E5 96.9791 2.2E3 97.0214 3.1E3 97.0281 1.6E5 97.0960 2.3E3 97.8688 2.3E3 98.9126 2.6E3 99.0438 3.8E4 101.0230 1.1E4 102.2965 2.5E3 108.1261 2.7E3 109.0281 5.5E4 115.0388 1.5E4 120.3658 2.3E3 124.9997 2.8E3 127.0386 2.2E5 128.0420 5.6E3 130.4353 2.8E3 140.1935 3.0E3 142.3426 2.5E3 145.0491 5.0E4 149.6720 3.2E3 149.6821 8.0E3 149.6927 1.0E4 149.7039 3.0E3 151.4154 2.3E3 173.5287 7.0E4 173.5432 1.5E4 182.7668 2.5E3 188.5412 2.3E3 190.2748 2.3E3 199.4857 2.7E3 199.4977 2.5E3 303.5098 2.8E3 313.4330 2.4E3 313.7907 2.4E3 326.7228 2.7E3 END IONS BEGIN IONS FEATURE_ID=53 PEPMASS=325.1135 SCANS=53 RTINSECONDS=61.879 CHARGE=1+ MSLEVEL=2 MERGED_STATS=11 / 11 (0 removed due to low quality, 0 removed due to low cosine). 49.6054 2.3E3 50.1282 2.5E3 50.5862 2.3E3 50.5959 2.2E3 53.0384 2.3E4 55.0176 9.4E4 55.9343 1.0E4 57.0333 1.4E5 57.2996 2.2E3 57.8988 2.3E3 58.7266 2.6E3 60.8404 2.7E3 61.0281 7.2E5 65.7981 2.5E3 69.0332 4.0E5 70.9611 2.4E3 71.0126 2.6E3 71.0488 2.1E4 73.0281 2.6E5 77.3991 2.3E3 80.8212 2.4E3 81.0332 7.4E4 83.8827 2.2E3 84.4645 2.4E3 85.0280 1.4E6 85.0360 7.0E3 86.0314 2.5E3 87.0437 2.0E4 90.5097 2.3E3 90.5182 2.5E3 90.9473 1.2E4 91.0386 3.7E5 91.1724 2.2E3 92.4834 2.5E3 93.4094 2.2E3 94.4748 2.2E3 96.2306 2.4E3 97.0215 2.9E3 97.0280 5.1E5 97.3674 2.6E3 97.7035 2.2E3 97.7679 2.3E3 99.0437 1.1E5 101.0230 4.4E4 103.0387 9.1E3 107.1090 2.5E3 107.9505 2.5E3 109.0280 1.1E5 112.4598 2.4E3 115.0387 3.6E4 117.7027 3.3E3 122.9936 2.4E3 124.7723 2.4E3 125.0210 2.8E3 127.0285 8.1E3 127.0386 4.1E5 131.9504 1.3E4 132.9583 1.1E4 138.0543 6.2E3 142.2259 2.3E3 142.7735 2.2E3 143.9510 2.2E3 144.0450 2.5E3 144.9577 2.4E4 145.0072 1.1E4 145.0492 8.1E4 145.9611 7.9E3 147.7819 2.3E3 149.4720 2.5E3 149.6829 4.5E3 149.6931 4.0E3 154.6547 2.4E3 157.9659 1.7E4 158.9688 2.1E4 161.9616 3.3E3 162.9642 6.5E3 166.9625 2.3E3 167.3524 2.3E3 169.6790 2.2E3 171.9226 2.9E3 173.5210 1.7E4 173.5312 1.4E5 173.5414 4.3E4 173.9359 2.3E3 173.9608 1.2E4 174.9643 3.1E3 175.9717 3.5E3 176.1060 2.5E3 176.7000 2.6E3 178.5184 2.3E3 180.5246 2.3E3 181.1691 2.3E3 181.2053 2.4E3 185.9609 1.4E4 186.9660 4.9E4 187.9719 1.2E4 188.6366 2.6E3 188.9780 2.7E3 192.9936 2.9E3 195.2649 2.3E3 198.9638 4.8E3 202.3826 3.0E3 204.5361 2.5E3 204.9734 2.6E3 206.8874 6.8E3 207.6599 2.5E3 211.5447 2.3E3 214.9947 2.5E3 216.9753 8.0E3 220.9355 2.3E3 222.9302 5.7E3 224.8978 2.6E3 233.0760 3.1E3 234.9878 1.4E4 237.4854 3.0E3 244.8742 2.0E4 249.2081 2.4E3 252.9968 5.9E3 260.8547 2.6E3 299.7140 2.5E3 306.7525 2.3E3 316.3850 2.3E3 END IONS BEGIN IONS FEATURE_ID=54 PEPMASS=233.9826 SCANS=54 RTINSECONDS=62.032 CHARGE=1+ MSLEVEL=2 MERGED_STATS=1 / 1 (0 removed due to low quality, 0 removed due to low cosine). 46.1378 2.1E3 55.9342 1.4E4 67.0316 2.3E3 67.5583 2.4E3 71.9293 2.7E3 72.9370 3.6E3 73.0281 1.0E4 73.9452 2.9E3 81.0336 2.2E3 90.9476 8.0E3 101.0094 2.4E3 102.6025 2.4E3 107.9505 3.4E3 131.9502 3.3E4 132.9579 5.2E3 133.9657 4.4E3 144.9578 1.9E4 145.9657 6.8E3 149.9606 7.2E3 152.0703 4.2E3 173.5359 2.1E4 180.9359 2.7E3 192.9377 4.4E3 196.9332 4.8E3 210.9481 3.5E3 END IONS BEGIN IONS FEATURE_ID=55 PEPMASS=204.0870 SCANS=55 RTINSECONDS=62.102 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 2 (0 removed due to low quality, 0 removed due to low cosine). 41.0385 4.6E3 42.0337 1.3E4 43.0177 2.1E4 44.0494 8.5E3 45.0334 7.2E3 46.8886 2.4E3 49.9228 2.1E3 53.0383 4.9E3 55.0177 6.9E3 55.0541 3.9E3 55.9341 8.3E4 56.0493 9.1E3 56.9346 2.3E4 57.0333 1.0E4 59.5970 2.2E3 60.0441 2.2E4 61.0281 3.0E4 68.0492 1.1E5 69.0332 2.2E4 70.0648 2.4E4 71.0489 7.4E3 71.9290 1.8E4 72.0440 1.3E4 72.9297 3.9E3 72.9361 3.0E4 73.0281 9.2E3 73.5913 2.2E3 76.0500 2.2E3 76.5386 2.2E3 80.0492 1.2E4 81.0332 1.3E4 84.0441 1.3E5 85.0281 1.5E4 89.9395 2.0E4 90.9465 2.7E4 94.0646 3.9E3 96.0380 4.1E3 96.0440 1.2E5 97.0279 1.3E5 98.0597 3.2E4 99.0434 3.7E3 100.0388 3.3E3 103.0389 4.1E3 107.9502 2.6E4 108.0442 3.3E3 108.9508 9.5E3 109.0281 1.2E4 110.0598 2.6E4 112.0755 1.2E4 113.9635 1.4E4 114.0476 3.0E3 114.0547 4.7E4 114.9713 6.7E3 122.0599 4.4E3 123.1784 2.3E3 124.0395 5.7E3 124.0752 2.4E4 125.9609 1.0E4 126.0455 3.2E3 126.0544 7.6E4 127.0390 3.9E3 128.9504 1.6E4 129.9526 1.5E4 130.9663 1.0E4 131.9503 1.3E4 131.9672 1.3E4 138.0547 7.4E4 140.0703 2.9E3 144.0653 5.5E4 144.9581 4.8E3 149.9599 3.1E3 149.9790 2.3E3 156.0650 6.0E3 158.0814 1.3E4 168.0654 1.2E4 173.5276 2.6E4 173.5455 3.7E3 175.6997 2.3E3 180.8881 1.3E4 186.0763 2.9E3 204.0878 4.3E3 204.1384 9.9E3 END IONS BEGIN IONS FEATURE_ID=56 PEPMASS=353.9520 SCANS=56 RTINSECONDS=62.167 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 3 (1 removed due to low quality, 0 removed due to low cosine). 55.4746 2.2E3 55.9342 4.9E4 56.8948 2.5E3 56.9420 2.9E3 59.9813 2.2E3 69.9497 3.5E3 71.0125 3.3E3 71.9291 8.1E3 72.9368 2.4E4 73.0284 2.7E3 73.9447 1.7E4 87.9604 7.6E3 89.9396 8.6E3 90.9473 5.6E4 91.9551 1.2E4 93.6787 2.3E3 99.9593 2.2E3 102.9475 1.9E4 105.9345 1.5E4 106.9422 8.0E3 107.9501 2.5E4 108.9581 6.5E3 112.7161 2.2E3 113.9395 1.2E4 115.9553 1.4E4 116.9632 3.7E3 117.9707 3.5E3 118.9423 6.9E3 120.9581 5.8E3 125.9607 1.2E4 126.9475 3.9E3 127.9552 9.2E4 128.9630 2.1E4 129.9709 3.8E3 130.9423 7.3E3 131.9501 1.7E5 132.9579 2.7E4 133.9657 4.2E4 142.9425 5.1E3 143.9501 3.0E4 144.9579 1.3E5 145.9539 3.6E3 145.9658 1.1E5 149.9607 2.8E4 151.9763 2.1E4 155.9503 1.5E4 157.5339 2.5E3 157.9658 6.5E4 159.9450 1.2E4 160.9528 9.5E3 161.9606 4.0E4 162.9684 1.5E4 163.9768 5.8E3 171.9451 5.5E4 172.9532 5.3E3 173.5246 9.2E3 173.5361 1.6E4 173.9609 1.0E5 177.9562 1.3E4 183.9452 5.0E4 187.9401 1.8E4 188.9479 1.8E4 189.9557 1.2E5 190.9637 1.7E4 191.9714 5.8E3 199.9413 4.1E3 201.9560 9.3E3 203.9354 2.3E4 204.9433 2.5E3 217.9510 2.3E4 263.9573 3.2E3 END IONS BEGIN IONS FEATURE_ID=57 PEPMASS=305.9676 SCANS=57 RTINSECONDS=62.251 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 48.2816 2.9E3 50.2798 2.1E3 51.4590 2.2E3 55.0176 1.6E4 55.9342 1.6E5 56.0255 4.3E3 57.0333 2.2E4 60.0443 3.7E3 61.0283 2.7E4 68.0255 1.3E4 68.0912 2.5E3 69.0334 1.6E4 69.9498 1.6E4 70.1212 2.2E3 71.9290 3.6E4 72.9369 6.9E4 73.0281 1.1E4 73.9446 2.8E4 74.9527 4.3E3 81.0331 1.0E4 81.9497 3.0E3 84.0203 3.4E4 84.0442 1.6E4 85.0232 3.8E3 85.0281 1.2E5 87.9604 2.3E4 89.9396 2.5E4 90.9379 3.0E3 90.9474 2.0E5 91.9554 1.8E4 97.0280 6.8E3 98.0598 9.6E3 99.9603 1.3E4 102.0310 3.4E3 102.9474 4.8E4 105.9344 2.6E4 106.0496 2.1E4 107.9502 4.1E4 108.9580 1.8E4 113.9400 1.0E4 115.9552 1.1E4 116.9635 7.3E3 117.9709 6.5E3 118.2689 2.2E3 118.9424 2.5E4 120.9584 1.2E4 123.9451 1.2E4 124.3906 2.2E3 125.9606 1.7E4 126.9476 1.4E4 127.9553 5.7E4 128.9631 5.2E4 129.9707 7.9E3 130.0500 3.8E3 130.9424 3.9E3 131.9391 4.9E3 131.9502 2.0E5 131.9875 2.9E3 132.9580 7.4E4 133.9659 3.8E4 135.9455 6.4E3 136.9530 1.1E4 139.9556 9.2E3 141.9707 1.1E4 142.9425 8.5E3 143.9503 3.2E4 144.0413 1.9E4 144.9449 3.7E3 144.9581 3.2E5 144.9718 5.5E3 145.9659 7.5E4 146.9735 1.1E4 148.9532 1.9E4 149.9609 8.4E4 150.9687 1.9E4 151.9764 2.8E4 155.0808 3.7E3 155.9502 6.2E4 156.9581 4.9E4 157.9659 2.8E5 157.9783 2.5E3 158.9738 9.1E3 159.9452 4.0E4 160.9531 1.8E4 161.9607 7.7E4 162.9688 4.0E4 163.9765 3.0E3 168.9583 2.5E4 169.9661 6.5E4 170.9748 2.3E3 171.9453 3.4E4 172.9532 4.9E3 173.5244 1.9E4 173.5390 2.0E4 173.9610 2.1E5 174.9688 3.4E4 175.9767 9.6E4 177.9559 2.5E4 180.8589 2.6E3 185.9610 1.4E5 186.2222 2.4E3 186.9689 7.6E4 187.9767 4.1E4 191.9716 5.4E4 193.9878 7.6E3 197.9610 3.7E4 203.9718 4.1E4 209.9607 8.6E3 210.9323 9.8E3 211.9772 7.4E3 215.9719 7.5E4 220.0366 2.0E4 220.3303 2.4E3 221.0809 1.3E4 227.9718 1.8E4 233.9823 2.8E4 235.0601 2.7E4 259.8308 2.2E3 275.2459 2.8E3 289.1467 2.5E3 293.3437 2.3E3 301.8680 2.2E3 END IONS BEGIN IONS FEATURE_ID=58 PEPMASS=323.9782 SCANS=58 RTINSECONDS=62.251 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 53.1308 2.1E3 55.0177 3.0E3 55.3832 2.2E3 55.9342 5.7E4 57.0334 2.8E3 59.3204 2.4E3 63.3699 2.5E3 63.6756 2.6E3 63.8586 2.1E3 67.8879 2.3E3 68.0254 1.3E4 69.0333 5.6E3 69.9499 4.8E3 71.9291 1.3E4 72.7821 2.7E3 72.9369 2.5E4 73.9447 6.4E3 75.4104 2.2E3 81.0331 3.5E3 82.2139 2.8E3 84.8820 2.3E3 85.0282 2.3E4 85.1393 2.3E3 87.9603 8.1E3 89.9397 1.3E4 90.9474 5.2E4 91.9555 3.4E3 97.0283 7.1E3 100.8327 2.6E3 102.9475 1.3E4 103.9556 2.8E3 104.9286 2.6E3 105.9343 8.2E3 107.9502 2.3E4 108.9577 3.2E3 113.9405 3.5E3 114.9476 3.2E3 115.9549 5.6E3 116.9639 8.8E3 118.9423 5.3E3 125.9608 5.1E3 126.9480 3.4E3 127.9554 1.7E4 128.9631 1.6E4 129.1199 2.3E3 129.9715 2.2E3 131.9502 1.0E5 131.9862 2.7E3 132.9580 4.9E4 133.9658 1.9E4 135.9438 2.7E3 136.9538 4.8E3 139.9553 1.4E4 141.3861 2.5E3 141.9702 3.6E3 142.9427 3.7E3 143.9505 2.6E4 144.0414 3.4E3 144.9581 1.2E5 145.9659 4.1E4 147.7284 2.5E3 149.9610 3.8E4 150.9685 2.5E3 151.9763 5.2E3 153.0750 2.4E3 155.9501 3.6E4 156.9584 2.0E4 157.9659 2.5E5 159.9449 1.8E4 160.9537 9.2E3 161.9610 5.8E4 162.9689 1.0E4 168.9584 6.9E3 169.9660 4.2E4 171.9453 1.8E4 173.5246 9.7E3 173.5314 2.7E4 173.5431 4.8E3 173.9610 1.1E5 173.9772 4.6E3 174.9690 6.9E4 175.9768 3.6E4 177.9564 5.5E3 181.9655 3.3E3 183.9445 2.5E3 185.9417 4.4E3 185.9611 2.3E5 186.9689 8.3E4 187.9768 5.3E4 191.9718 2.3E4 192.9793 4.0E3 193.9869 3.0E3 197.9611 4.1E4 203.9717 4.2E4 209.9631 3.7E3 211.9769 3.4E3 215.9718 5.9E4 227.9361 6.4E3 227.9715 7.9E3 229.9524 4.0E3 233.9825 4.3E4 241.7750 2.4E3 245.9451 2.6E3 251.9929 2.5E4 256.6271 2.4E3 END IONS BEGIN IONS FEATURE_ID=59 PEPMASS=360.1504 SCANS=59 RTINSECONDS=62.317 CHARGE=1+ MSLEVEL=2 MERGED_STATS=10 / 10 (0 removed due to low quality, 0 removed due to low cosine). 53.0022 5.5E3 53.0385 6.5E4 54.5414 2.4E3 54.7234 2.3E3 55.0176 8.3E5 57.0333 7.6E5 57.0368 2.3E3 57.6014 2.6E3 59.0490 2.4E3 60.0440 2.4E3 60.4560 2.6E3 61.0282 4.6E5 61.5144 2.6E3 63.0712 2.3E3 64.0223 2.2E3 67.2843 2.4E3 68.9776 2.3E3 69.0333 3.4E6 69.0375 1.4E4 69.0399 1.1E4 69.0421 3.7E3 70.9351 2.5E3 71.0125 3.9E4 71.0488 2.0E5 72.0805 9.3E3 73.0280 5.3E5 73.0331 4.2E3 73.7570 2.4E3 74.2837 2.5E3 75.2345 2.3E3 79.6508 2.1E3 80.6186 2.7E3 80.8618 2.3E3 81.0332 3.0E5 81.6274 2.2E3 83.0125 3.1E4 83.0710 2.3E3 85.0217 7.4E3 85.0281 9.9E6 85.0340 1.7E4 85.0378 2.2E5 85.0400 1.8E4 85.0434 7.8E3 85.0473 3.8E3 85.7327 2.5E3 87.0438 1.2E5 88.4446 2.9E3 91.0326 4.3E3 91.0387 2.7E5 94.3549 2.2E3 94.6420 2.4E3 94.7766 2.5E3 96.0072 2.2E3 96.3305 2.5E3 97.0281 3.0E6 97.0352 1.1E4 98.4282 2.4E3 99.0437 1.0E6 99.0507 4.1E3 101.0230 4.0E5 103.0387 6.9E4 103.3252 2.5E3 108.5366 2.3E3 109.0281 6.5E5 109.0371 5.4E3 111.0433 4.9E3 115.0303 1.1E4 115.0386 4.5E5 115.0483 4.1E3 117.0546 3.2E4 119.1571 2.5E3 122.7512 2.3E3 122.8987 2.7E3 123.0433 2.7E3 127.0267 2.0E3 127.0386 8.6E6 127.0478 1.3E5 127.0582 3.5E4 127.0607 1.5E4 130.7706 2.4E3 133.0493 6.7E4 135.0437 3.2E3 136.0744 2.3E3 142.8199 2.7E3 145.0365 8.7E3 145.0493 1.9E6 145.0608 2.0E4 145.0636 3.9E3 149.6832 4.9E3 149.6936 4.5E3 151.0386 2.9E3 154.5882 2.3E3 157.5684 2.5E3 159.1232 2.4E3 162.0750 3.7E3 162.3410 2.3E3 163.0599 1.5E5 168.3094 2.5E3 169.0482 5.5E3 169.5158 2.2E3 169.9258 3.4E3 171.9217 3.6E4 173.5244 6.3E4 173.5408 7.0E4 175.0715 3.1E3 175.3250 2.4E3 180.0863 3.4E4 181.6697 2.5E3 181.7410 2.5E3 185.9011 1.5E4 187.9166 4.7E3 195.9973 2.4E3 199.9536 1.3E4 203.9119 7.0E3 204.4745 2.3E3 208.3769 2.4E3 211.9158 4.7E3 231.3655 2.3E3 238.7022 2.8E3 243.3811 2.4E3 245.1101 2.5E3 246.0314 2.4E3 269.6776 2.4E3 279.8033 2.3E3 291.0742 2.8E3 293.3068 2.7E3 302.4362 2.7E3 315.3656 2.2E3 319.5566 2.3E3 330.2376 2.9E3 338.0280 2.5E3 346.7327 2.5E3 353.3468 3.4E3 END IONS BEGIN IONS FEATURE_ID=60 PEPMASS=396.0357 SCANS=60 RTINSECONDS=62.317 CHARGE=1+ MSLEVEL=2 MERGED_STATS=9 / 9 (0 removed due to low quality, 0 removed due to low cosine). 54.2803 2.3E3 55.0179 6.6E3 55.9343 3.3E4 56.1382 2.2E3 60.3227 2.3E3 61.0284 8.8E3 61.5814 2.2E3 63.5156 2.3E3 65.0286 2.3E3 65.1765 2.3E3 66.4871 2.2E3 67.1389 2.1E3 69.0334 5.0E3 69.0433 2.4E3 69.1826 2.4E3 69.8885 2.3E3 71.6432 2.3E3 71.9293 3.1E3 72.0804 1.5E4 72.9372 7.8E3 73.0282 4.8E3 75.0347 2.6E3 75.7552 2.9E3 76.9872 2.3E3 77.6595 2.4E3 78.1188 2.7E3 79.3071 2.5E3 81.0333 1.4E4 84.4562 2.2E3 85.0282 1.6E4 86.4229 2.6E3 87.2942 2.6E3 90.9477 2.5E4 91.0388 6.8E3 91.1394 2.4E3 92.6698 2.1E3 94.3910 2.5E3 97.0283 4.2E4 97.0854 2.4E3 98.6971 2.4E3 99.0435 6.5E3 99.0708 2.5E3 99.7163 2.3E3 102.5296 2.7E3 102.7065 2.2E3 102.9476 6.3E3 103.3815 2.2E3 105.9345 2.7E3 107.9502 2.6E3 108.6726 2.3E3 109.0283 1.9E4 113.5429 2.4E3 113.9408 1.4E4 115.6151 2.4E3 115.9559 2.6E3 117.1949 2.5E3 121.0235 2.2E3 126.9494 3.3E3 127.0387 2.5E4 127.5956 2.7E3 127.9144 2.3E3 128.9643 2.7E3 131.9502 2.1E5 132.9581 1.9E4 133.9662 1.3E4 138.8849 2.4E3 141.9712 1.2E4 143.9395 2.7E3 143.9504 6.1E4 144.9581 1.5E5 145.9658 3.8E4 149.6687 3.5E3 149.6895 5.6E3 149.9609 6.0E4 151.9768 3.6E3 152.7973 2.4E3 153.9711 1.4E4 156.9584 2.8E4 157.9660 1.1E5 157.9798 2.5E3 158.9739 2.8E4 159.9436 2.4E3 159.9807 3.7E3 161.3920 2.3E3 161.9608 2.1E5 162.9687 1.3E4 163.9767 1.2E4 165.6132 2.5E3 165.9534 2.5E3 166.6507 2.4E3 168.9585 4.5E3 169.9508 3.4E3 169.9660 4.1E5 169.9816 3.6E3 169.9897 2.6E3 170.9737 2.1E4 171.9455 2.2E4 171.9823 1.5E4 173.5222 2.1E4 173.5339 1.1E5 173.5437 6.6E3 173.9436 5.1E3 173.9609 7.6E5 174.9688 5.6E4 175.9767 3.2E4 177.1972 2.6E3 179.9721 8.7E3 181.9660 8.4E4 183.9451 2.0E4 184.3781 2.4E3 185.9610 3.4E5 186.9688 1.4E5 187.9765 1.3E5 189.9555 8.4E3 191.9712 2.2E4 195.9816 1.1E4 197.9610 1.3E5 198.9689 1.1E5 199.0917 2.9E3 199.9766 3.2E5 201.9563 6.9E3 203.9716 1.6E5 204.9905 3.0E3 205.8978 2.6E3 209.8571 2.3E3 209.9612 2.3E5 210.9688 4.7E4 211.9767 1.1E5 213.9557 3.3E3 214.0667 2.5E3 214.9624 3.0E3 215.9717 2.8E5 216.9795 8.3E4 217.9872 6.3E4 218.9576 2.4E3 222.9686 1.2E4 223.9762 1.3E4 227.9716 4.1E5 227.9978 3.4E3 228.9141 2.6E3 228.9791 6.2E3 233.9821 1.0E5 234.9898 1.2E5 235.9979 7.9E3 237.9519 2.6E3 239.6389 2.5E3 239.9716 6.9E4 239.9969 2.5E3 240.9787 5.4E3 245.9822 1.8E4 251.9944 4.1E3 257.9820 9.3E4 269.9829 1.2E4 275.9577 1.1E4 275.9928 1.3E6 276.0278 1.6E4 277.0008 1.0E5 282.0310 3.0E3 283.8485 6.3E3 287.9929 3.6E4 288.3668 2.4E3 288.9996 1.7E4 306.0031 3.8E4 317.3123 2.6E3 322.2912 3.3E3 342.5825 2.6E3 344.6064 2.6E3 391.0150 2.9E3 392.5650 3.0E3 END IONS BEGIN IONS FEATURE_ID=61 PEPMASS=331.8869 SCANS=61 RTINSECONDS=62.435 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 3 (1 removed due to low quality, 0 removed due to low cosine). 49.7363 2.4E3 52.2542 2.2E3 55.9343 1.4E5 57.4261 2.3E3 58.4167 2.6E3 66.7369 2.6E3 67.4251 2.1E3 69.0333 1.1E4 72.0806 2.7E3 78.6509 2.0E3 78.7010 2.6E3 90.9475 3.1E3 104.5142 2.7E3 107.7344 2.5E3 113.9633 8.5E3 117.0545 5.0E3 126.3702 2.9E3 131.9500 7.5E3 135.9009 7.7E3 144.9588 2.9E3 149.6800 3.7E3 149.6904 5.2E3 153.9113 6.2E4 157.9660 4.4E3 163.9150 2.3E3 164.0711 4.1E3 169.9063 8.8E3 170.9143 2.7E4 171.9082 3.0E3 171.9219 7.1E5 172.8619 3.2E3 173.5371 2.7E4 173.9617 3.3E3 180.8885 6.7E3 181.9172 1.1E4 183.9217 4.3E3 184.8476 2.4E3 185.4046 2.5E3 185.9013 3.9E5 185.9608 5.7E3 186.9702 3.1E3 187.9164 9.7E4 188.9249 2.8E4 190.8724 2.5E4 196.8828 3.2E3 203.9115 1.2E5 205.9274 1.8E4 208.8596 4.8E3 208.8833 1.8E5 211.9168 3.1E4 215.9715 4.5E3 218.8686 7.1E3 223.9175 6.6E3 224.9253 1.1E4 225.2711 2.3E3 226.8939 5.6E4 229.9280 1.2E4 231.8993 4.1E4 236.8783 6.8E3 237.9323 2.7E3 240.1646 2.5E3 241.8836 6.6E3 241.9285 2.9E3 242.1564 2.7E3 248.9251 3.1E3 249.9096 6.2E3 259.9021 6.7E3 266.9354 1.1E4 267.8846 6.8E3 268.4376 2.5E3 280.3827 2.4E3 296.0828 2.7E3 339.4205 2.7E3 END IONS BEGIN IONS FEATURE_ID=62 PEPMASS=259.9017 SCANS=62 RTINSECONDS=62.496 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 47.7445 2.4E3 49.4472 2.4E3 50.0970 2.4E3 50.5832 2.3E3 55.9342 8.5E4 59.3440 2.5E3 59.6207 2.1E3 65.7820 2.6E3 70.4470 2.2E3 71.0648 2.1E3 83.9527 2.2E3 86.0535 2.5E3 86.0963 4.2E3 88.2091 2.6E3 101.5310 2.4E3 104.1065 5.4E3 129.9329 2.8E3 131.0496 5.1E3 144.3818 2.5E3 145.0280 1.0E4 149.6712 6.9E3 149.6818 9.7E3 149.6929 1.0E4 153.9112 1.6E4 163.0385 3.6E3 170.9144 3.1E3 171.9217 8.2E4 173.5287 3.8E3 173.5378 1.0E4 175.0390 4.0E4 185.9010 4.3E4 187.9166 2.1E4 188.9242 2.6E3 189.4841 2.6E3 203.9115 1.2E4 236.9409 8.3E3 260.1264 3.0E3 END IONS BEGIN IONS FEATURE_ID=63 PEPMASS=210.9331 SCANS=63 RTINSECONDS=62.533 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 2 (0 removed due to low quality, 0 removed due to low cosine). 43.0175 3.4E3 55.9341 8.0E3 56.9645 9.3E3 64.7324 2.2E3 67.6013 2.2E3 71.5691 2.1E3 71.9290 1.2E4 72.9368 2.5E3 78.3455 2.1E3 89.9396 5.5E3 100.9236 2.4E3 107.9501 1.2E4 124.1645 2.5E3 125.9605 3.5E3 128.5462 2.7E3 130.2889 2.4E3 130.9816 3.1E3 151.0750 4.0E3 162.9269 9.9E3 165.5062 2.4E3 169.9061 2.3E4 170.9136 3.9E3 172.0138 2.9E3 173.5280 1.9E4 173.5424 4.8E3 178.9231 3.4E3 180.9373 2.0E4 187.9166 3.3E5 188.9224 2.8E3 192.9373 7.7E3 196.9325 2.1E4 205.9273 7.5E4 210.9480 2.8E4 END IONS BEGIN IONS FEATURE_ID=64 PEPMASS=365.1057 SCANS=64 RTINSECONDS=62.536 CHARGE=1+ MSLEVEL=2 MERGED_STATS=8 / 9 (1 removed due to low quality, 0 removed due to low cosine). 51.9534 2.6E3 54.2804 2.5E3 55.0061 2.2E3 55.0997 2.5E3 55.7975 2.3E3 57.3258 2.2E3 58.7249 2.8E3 61.2599 2.4E3 61.8519 2.5E3 62.5361 2.5E3 66.0763 2.2E3 66.6093 2.3E3 66.9680 2.5E3 67.0722 2.1E3 69.2571 2.5E3 69.8223 2.6E3 72.9369 2.1E3 73.9954 2.1E3 75.9804 2.3E3 76.2764 2.4E3 76.5379 2.2E3 78.5280 2.3E3 79.8268 2.4E3 80.3636 2.6E3 81.5770 2.5E3 82.3638 2.1E3 89.9630 2.6E3 96.8581 2.6E3 97.2926 2.6E3 99.8430 2.3E3 106.2056 2.3E3 113.3472 2.4E3 121.2627 2.6E3 125.4686 2.4E3 132.9692 5.2E3 133.9764 2.8E3 135.5720 3.1E3 139.1640 2.5E3 143.9765 2.3E3 148.9637 3.3E3 150.6254 3.1E3 150.6463 2.5E3 158.1618 2.6E3 163.2906 2.5E3 173.1577 2.4E3 173.5276 1.1E5 173.5442 2.2E4 183.2253 2.5E3 183.3990 2.8E3 185.0148 3.3E3 185.0420 8.0E5 185.0587 1.0E4 187.3024 2.4E3 194.3857 2.8E3 194.3938 2.8E3 194.9570 2.7E4 196.9330 3.2E3 203.0294 2.7E3 203.0527 2.7E6 203.0973 5.2E3 208.6414 2.7E3 208.8024 3.3E3 210.3048 2.7E3 212.9703 2.7E3 213.9067 2.5E3 236.0307 3.4E3 256.7650 2.5E3 267.8829 8.6E3 272.5621 2.2E3 277.2651 2.4E3 277.9981 2.8E3 281.4192 2.4E3 297.7086 2.4E3 306.0945 2.3E3 323.5245 2.6E3 365.1058 3.5E5 END IONS BEGIN IONS FEATURE_ID=65 PEPMASS=205.1186 SCANS=65 RTINSECONDS=62.603 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 42.0338 1.0E4 42.3089 2.4E3 43.0177 8.5E4 44.0494 1.4E4 46.5122 2.2E3 47.8795 2.2E3 50.7855 2.4E3 51.2862 2.3E3 53.0384 1.0E4 53.3658 2.6E3 53.8095 2.3E3 54.7141 2.4E3 55.0540 6.8E5 55.0572 9.6E3 55.0587 7.2E3 55.9342 4.6E4 56.0492 2.9E5 56.0524 4.0E3 57.0333 8.1E3 57.0556 2.4E3 58.9522 2.7E3 60.0441 1.5E5 60.5654 2.5E3 61.1665 2.2E3 63.3154 2.3E3 63.8468 2.4E3 64.5478 2.4E3 65.0383 1.2E4 67.0414 2.3E4 67.0540 2.4E4 70.0648 6.9E4 70.2633 2.2E3 70.4280 2.2E3 71.9043 2.4E3 71.9612 2.1E3 72.0440 1.9E4 72.0804 7.3E3 72.9370 6.5E3 73.0642 2.8E3 74.0233 7.1E5 74.0280 5.5E3 74.0597 2.3E4 76.5562 2.3E3 80.0492 5.0E4 82.0648 3.6E6 82.0735 2.1E4 82.0744 8.8E4 82.0761 1.6E4 82.0799 4.1E3 83.0488 5.1E4 84.0441 1.6E4 84.0805 7.7E4 85.0473 5.3E3 86.9173 2.9E3 86.9923 3.1E3 89.5014 2.2E3 90.9474 1.1E4 93.2181 2.3E3 95.0120 2.7E3 96.0803 7.2E3 97.0479 2.7E3 98.0598 2.0E4 99.0915 5.4E5 99.0983 4.4E3 100.0393 1.2E4 100.0753 5.6E5 100.0823 3.1E3 101.0592 5.2E3 103.0228 2.8E3 107.0637 2.2E3 107.9502 6.9E3 110.0597 2.3E4 111.0436 3.2E3 113.0789 3.4E3 113.1069 8.1E3 113.9636 1.2E4 114.0911 2.1E4 114.9711 1.0E4 115.0237 2.4E3 116.0704 4.3E4 123.0079 6.4E3 123.0914 4.3E5 123.1002 2.8E3 124.0754 1.8E5 124.0853 2.5E3 127.0864 7.9E3 128.0593 5.5E3 128.0703 1.2E6 128.0795 8.2E3 128.0921 3.8E3 128.9506 1.6E4 135.9446 4.2E3 139.0584 4.2E3 141.0894 4.7E3 141.1020 6.9E5 141.1129 2.6E3 141.1153 3.9E3 142.0733 8.8E3 142.0860 3.9E5 142.0993 4.3E3 145.0970 6.0E4 146.0808 2.5E4 170.0812 2.5E5 173.5284 2.3E4 173.5428 5.1E3 177.8413 2.5E3 187.1078 3.4E4 210.1382 2.4E3 END IONS BEGIN IONS FEATURE_ID=66 PEPMASS=316.1397 SCANS=66 RTINSECONDS=62.672 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 5 (2 removed due to low quality, 0 removed due to low cosine). 49.8645 2.4E3 55.0179 1.6E4 55.3117 2.3E3 57.0334 6.1E4 61.0283 1.1E5 63.3203 2.2E3 67.4811 2.3E3 69.0334 3.1E4 71.3434 2.1E3 72.0806 1.0E4 73.0245 2.3E3 73.0283 4.9E4 75.1735 2.1E3 81.0334 3.0E4 81.6805 2.3E3 82.1708 2.7E3 83.0493 2.7E3 85.0283 2.4E5 91.0388 2.1E4 91.0541 2.1E4 96.0447 3.6E3 97.0283 6.7E4 99.0440 8.3E3 99.0728 2.4E3 103.0388 1.1E5 103.0547 6.8E3 105.0699 2.6E4 106.7849 2.1E3 108.0180 2.2E3 115.0543 2.1E4 117.0700 1.3E4 118.0650 4.3E3 119.0347 3.0E3 119.0491 1.5E4 121.0646 1.4E4 123.0440 3.4E4 127.0388 4.1E4 128.9507 6.1E3 129.0698 2.4E4 130.9668 2.9E3 131.0491 5.4E4 132.0809 4.2E3 133.0647 6.0E4 137.0597 5.5E5 143.0491 7.4E4 144.0660 9.4E3 145.0648 4.4E4 146.0602 2.6E4 147.0442 1.8E4 147.0803 8.8E3 149.0457 5.7E3 149.0597 3.7E5 149.0738 6.5E3 150.0911 5.9E3 151.0753 5.3E5 151.0892 4.8E3 153.0697 5.8E3 154.0863 2.8E4 157.0647 6.8E4 157.0774 3.4E3 160.0524 7.3E3 160.0755 2.6E4 161.0441 7.2E3 161.0597 3.9E5 161.0754 1.0E4 162.0549 1.1E4 163.0394 8.4E3 163.0754 5.6E4 164.0481 2.9E3 164.0706 3.1E5 165.0549 3.2E4 166.0864 5.9E4 167.0506 3.0E3 167.0705 1.7E4 169.0651 1.3E4 171.0803 1.3E4 173.0598 6.1E4 173.5228 1.2E4 173.5346 3.2E4 173.5424 4.8E3 175.0393 3.4E3 175.0596 7.8E3 175.0755 1.7E5 176.0709 2.2E4 177.0548 5.6E4 177.0785 2.7E4 178.0864 7.9E5 179.0441 3.2E3 179.0704 6.1E5 181.0650 3.2E4 184.0755 5.5E3 185.0598 9.5E4 187.0756 3.2E4 187.0929 2.8E3 188.0706 1.8E4 189.0543 2.4E4 189.0914 2.5E4 190.0864 6.4E4 191.0703 1.2E5 192.0655 3.1E3 192.1023 2.3E4 193.0866 1.4E4 194.0815 1.5E4 195.0656 7.3E3 196.0087 2.3E3 196.0969 1.4E5 197.0592 1.2E4 197.9887 5.8E3 198.5319 3.3E3 199.0757 6.5E4 201.0554 8.3E3 202.0865 6.6E4 203.0704 1.4E5 203.0917 3.1E3 203.8830 6.6E3 204.1017 8.3E3 205.0859 1.7E4 207.0659 1.0E4 208.0971 5.3E4 209.0608 7.5E3 209.0809 1.8E4 212.9277 4.5E3 214.0862 1.5E4 215.0705 3.4E4 216.1023 4.1E4 217.0863 5.1E4 218.0814 9.2E4 219.0661 1.4E4 219.0895 3.9E4 220.0971 1.8E5 221.0812 6.5E4 225.0523 2.6E3 226.0864 3.0E3 227.0705 4.6E4 232.0969 3.2E4 233.0811 2.0E4 234.0768 2.2E4 234.1126 4.9E4 243.8786 5.3E3 244.0970 5.6E4 245.0809 5.6E4 250.1074 4.1E4 251.8329 2.3E3 258.8885 1.5E4 262.1075 7.6E4 263.0910 3.6E4 276.8987 6.7E3 280.1184 1.3E5 292.8959 4.9E3 294.8744 2.9E3 298.1291 8.2E4 316.0966 1.0E4 316.1393 3.4E5 322.4838 2.6E3 END IONS BEGIN IONS FEATURE_ID=67 PEPMASS=507.8386 SCANS=67 RTINSECONDS=62.922 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 62.8567 2.2E3 62.9682 2.4E3 64.4990 2.1E3 68.0754 3.0E3 69.9884 2.2E3 90.0503 2.7E3 90.9473 7.0E3 93.1724 2.4E3 94.9614 2.4E3 103.5829 2.6E3 113.9635 1.4E4 118.2782 2.3E3 131.0645 2.9E3 132.8412 2.6E3 143.0314 2.2E4 149.6891 1.9E4 162.8777 1.9E4 168.2090 3.1E3 170.8556 2.7E3 173.5231 5.5E3 173.5354 1.6E4 180.8880 1.7E5 185.0420 3.3E3 185.8936 2.2E4 195.9428 1.6E4 198.8987 5.7E3 203.9042 5.0E5 213.0005 3.0E3 216.9065 2.8E3 218.6366 2.5E3 219.8979 4.1E3 220.4959 2.6E3 221.9158 3.9E3 225.9164 5.0E3 226.9252 4.9E3 231.3550 2.4E3 234.8628 1.7E4 237.9108 6.8E3 249.9187 4.6E3 252.8730 2.9E4 256.8141 2.7E3 257.8502 4.3E3 257.8782 8.4E4 267.9277 2.8E4 275.8895 3.3E4 302.8576 2.7E3 321.6351 2.7E3 324.8954 2.6E3 341.4314 2.3E3 342.7529 2.6E3 377.1262 2.6E3 END IONS BEGIN IONS FEATURE_ID=68 PEPMASS=274.9364 SCANS=68 RTINSECONDS=62.998 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 5 (0 removed due to low quality, 0 removed due to low cosine). 47.2129 2.0E3 47.5967 2.7E3 47.9414 2.5E3 51.5947 2.2E3 53.4577 2.4E3 54.4515 2.2E3 55.9342 4.7E5 56.2256 2.6E3 57.1356 2.2E3 57.1677 2.2E3 66.3510 2.2E3 70.9576 5.8E3 71.9290 3.7E4 72.9369 4.6E4 73.7576 2.5E3 73.9447 6.1E4 84.0287 2.3E3 84.7706 2.4E3 87.3127 2.2E3 88.9682 3.4E4 89.9396 1.2E5 90.9474 4.7E4 91.9553 2.6E4 92.4929 2.4E3 96.9607 5.5E4 100.0753 2.3E3 105.3704 2.3E3 105.9346 3.6E4 107.9501 2.0E5 112.9555 1.3E4 113.9634 9.7E4 114.9712 2.0E5 118.0860 4.1E4 123.9450 6.4E3 125.9607 7.2E4 128.9383 1.2E4 128.9505 5.0E5 128.9619 1.0E4 130.9556 3.5E3 130.9662 5.0E5 130.9776 5.2E3 131.9504 2.4E4 131.9739 1.7E4 138.0547 2.6E4 143.9743 2.5E3 144.9580 2.2E4 145.9659 3.9E3 146.9611 8.9E4 148.9635 4.6E3 148.9767 2.4E5 149.6837 5.4E3 149.6942 4.1E3 154.3228 2.5E3 157.9660 3.3E4 159.5883 2.3E3 159.9455 2.4E3 167.9184 2.3E3 171.1208 2.3E3 173.5210 5.3E3 173.5324 4.4E4 173.5406 1.6E4 182.2921 2.4E3 185.9611 1.4E4 186.9691 7.1E3 192.8134 2.4E3 203.1913 2.5E3 211.6517 2.5E3 212.6013 2.6E3 216.7854 2.3E3 222.4410 2.5E3 223.9964 2.7E3 244.1376 2.8E3 244.2275 2.4E3 253.7108 2.7E3 256.8972 3.1E3 265.2171 2.4E3 END IONS BEGIN IONS FEATURE_ID=69 PEPMASS=240.0717 SCANS=69 RTINSECONDS=63.048 CHARGE=1+ MSLEVEL=2 MERGED_STATS=9 / 9 (0 removed due to low quality, 0 removed due to low cosine). 43.0177 1.4E4 45.0333 5.4E3 45.6393 2.2E3 46.0650 3.7E4 47.4611 2.1E3 47.8486 2.9E3 48.2942 2.4E3 48.8041 2.4E3 49.6114 2.2E3 50.3935 2.5E3 53.4101 2.1E3 54.4782 2.4E3 54.5401 2.4E3 55.9342 8.0E3 55.9431 2.2E3 56.6787 2.7E3 56.8837 2.4E3 56.9843 2.2E3 57.4339 2.1E3 58.8417 2.9E3 60.0442 7.2E3 60.5487 2.3E3 61.7009 2.3E3 62.4537 2.2E3 63.8649 2.2E3 65.1580 2.7E3 65.6776 2.5E3 67.7079 2.4E3 67.7220 2.1E3 69.0332 1.8E4 70.3815 2.3E3 71.0126 1.8E4 71.0242 2.2E3 72.0437 5.5E3 72.2038 2.6E3 72.4978 2.5E3 72.8947 2.3E3 73.0281 2.6E3 73.4209 2.6E3 73.4573 2.3E3 73.6569 2.3E3 74.1850 2.2E3 75.4506 2.2E3 75.9434 2.5E3 80.5211 2.3E3 80.7201 2.3E3 81.0190 2.2E3 81.0444 1.2E4 81.1850 2.6E3 81.3423 2.2E3 82.9554 2.4E3 83.4316 2.2E3 84.6665 2.3E3 85.0281 2.8E4 87.7135 2.6E3 88.0391 9.7E3 89.0231 4.7E3 90.9473 2.7E3 93.0453 2.3E3 94.7061 2.2E3 95.0125 1.5E5 97.0282 1.4E4 99.0072 1.6E4 104.9805 8.8E3 106.7515 2.7E3 107.3012 2.5E3 109.5129 2.5E3 113.0140 8.2E3 113.0230 9.1E5 113.0323 2.0E3 113.7525 2.2E3 113.8758 2.5E3 114.9950 2.3E3 115.0023 1.2E5 116.9658 1.1E4 119.8739 2.3E3 121.6358 2.5E3 122.8652 2.6E3 122.9987 2.7E3 123.0074 4.3E5 124.9043 2.2E3 125.6126 2.5E3 129.3778 2.9E3 130.9817 1.4E4 131.0337 4.8E4 132.0661 5.5E3 134.9201 7.0E3 140.9659 1.1E4 141.0035 6.1E3 141.0181 4.6E5 141.0294 3.7E3 144.9968 2.5E3 145.9324 2.5E3 149.6816 3.1E3 149.6921 5.7E3 151.0614 3.4E4 151.0735 2.4E3 151.1813 2.7E3 164.0918 2.5E3 164.3670 2.2E3 168.9965 7.3E3 169.0132 1.5E6 169.0301 2.8E4 170.9144 3.2E4 171.9215 3.0E3 173.5316 7.6E4 173.5380 9.1E3 173.5462 2.6E3 177.0402 3.1E4 182.4298 2.3E3 184.6277 2.5E3 186.6575 2.4E3 187.9169 8.6E3 188.9241 2.2E4 193.9303 2.8E3 194.0675 7.8E4 194.4558 2.6E3 194.4796 2.9E3 195.0511 2.7E3 196.2924 2.6E3 197.4452 2.3E3 202.6908 2.4E3 220.6354 2.7E3 236.7540 2.1E3 238.3508 2.5E3 246.7675 2.3E3 END IONS BEGIN IONS FEATURE_ID=70 PEPMASS=202.9515 SCANS=70 RTINSECONDS=63.247 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 8 (2 removed due to low quality, 0 removed due to low cosine). 41.6382 2.1E3 43.0177 3.5E3 43.3103 2.3E3 45.1655 2.1E3 46.0650 5.1E4 49.5124 2.5E3 49.5335 2.5E3 49.7554 2.3E3 50.6031 2.7E3 50.9942 2.1E3 52.3806 2.3E3 52.7286 2.3E3 54.1008 2.2E3 55.9343 3.2E6 55.9373 1.8E4 55.9390 1.4E4 55.9406 7.4E3 56.0493 4.8E3 57.8231 2.9E3 66.8123 2.5E3 67.0747 2.5E3 70.0648 2.4E5 70.3930 2.4E3 70.9575 4.0E4 71.0489 1.1E4 71.0601 7.4E4 71.7860 2.3E3 71.9194 3.4E3 71.9290 8.3E5 72.0802 8.7E3 72.9368 5.3E5 73.1637 2.2E3 73.9447 7.9E4 74.0233 6.4E3 74.0601 3.4E3 74.5250 2.5E3 78.6584 2.6E3 82.0136 3.1E3 82.7963 2.1E3 83.5659 2.5E3 84.0441 2.8E3 88.0866 4.3E4 88.9681 7.8E4 89.9303 3.2E3 89.9396 1.0E6 89.9478 1.1E4 90.3894 2.4E3 90.7394 2.3E3 90.9474 3.5E5 91.0779 2.3E3 91.9551 2.9E4 96.9606 1.3E5 98.0598 4.3E4 100.0240 1.1E4 102.0548 2.9E3 105.9345 4.0E4 107.9502 1.5E6 107.9603 1.4E4 108.9581 2.3E4 109.1865 2.2E3 111.2256 2.5E3 112.9555 7.1E4 113.9634 2.5E5 114.0544 3.3E3 114.9630 1.3E4 114.9712 4.6E5 114.9807 2.8E3 115.9539 4.0E3 116.0702 4.3E4 119.0852 2.5E3 121.0767 2.4E3 124.9670 4.1E3 125.9501 2.7E3 125.9606 5.5E5 125.9715 3.7E3 128.9396 2.9E3 128.9504 1.2E6 128.9600 3.5E3 128.9614 3.2E4 130.9661 1.2E6 130.9804 1.8E4 131.9740 3.2E4 133.9641 3.2E3 135.0143 2.1E3 140.0712 6.6E3 142.0498 2.7E3 143.0529 4.2E3 144.0648 1.1E4 145.7249 2.5E3 146.9611 2.0E5 148.9635 4.7E3 148.9767 6.0E5 150.0623 2.6E3 152.7845 2.3E3 156.9743 4.2E4 158.1286 2.4E4 171.9914 3.1E3 173.5227 6.4E3 173.5323 6.1E4 173.5423 1.5E4 174.9855 7.0E3 175.8926 2.4E3 179.9907 1.2E4 202.0769 3.3E3 203.0857 4.0E4 END IONS BEGIN IONS FEATURE_ID=71 PEPMASS=238.0924 SCANS=71 RTINSECONDS=63.26 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 43.0177 6.5E4 44.0494 2.2E4 55.0176 5.8E4 55.9344 2.9E3 56.0493 9.7E3 57.0333 3.7E4 57.2571 2.6E3 58.0285 1.3E4 58.9948 3.7E4 59.0489 2.8E3 60.0441 3.5E5 61.0281 1.8E4 68.0458 3.0E3 68.0492 9.8E4 69.0332 7.0E4 70.0285 2.1E4 70.0647 5.5E3 71.0127 5.9E3 72.0441 2.5E5 73.0281 1.1E5 74.0056 2.9E4 74.0233 1.3E5 74.9897 1.2E4 76.0214 3.7E3 80.0493 1.7E4 81.0331 7.2E3 84.0440 6.0E4 85.0103 1.9E4 85.0281 1.1E5 86.0055 2.0E4 86.0597 4.3E4 86.9896 3.8E4 87.0437 1.2E4 88.0390 2.8E4 94.4431 2.3E3 95.0126 1.5E4 96.0441 1.5E5 96.0513 4.2E3 97.0281 9.1E4 98.0597 4.5E4 99.0074 1.9E4 100.0216 3.1E3 100.0530 2.2E3 102.0547 3.2E3 102.9845 2.0E5 104.0341 1.2E4 105.0001 2.5E4 107.8243 2.4E3 112.0390 7.8E4 113.0230 6.4E4 113.4630 2.6E3 114.0005 5.1E4 114.0547 3.8E5 114.0634 9.1E3 115.0318 2.4E3 115.0387 6.2E4 116.0703 1.2E4 120.9951 1.6E5 124.0390 6.0E4 125.0231 3.8E4 126.0551 7.5E3 128.0161 2.0E4 131.0154 5.7E3 132.0110 6.2E4 132.0653 5.8E5 132.0786 6.7E3 132.9949 2.4E4 133.0493 4.4E4 135.9891 2.9E3 138.0006 3.5E4 138.0552 2.9E3 140.4556 3.0E3 142.0497 8.8E4 143.0330 6.7E3 148.9901 3.5E4 150.0759 7.3E4 156.0111 4.7E4 156.0658 4.2E3 160.0604 3.8E4 173.5349 3.1E4 174.0219 5.1E4 178.0711 4.7E4 184.0063 7.7E4 196.0816 1.1E5 196.9304 4.1E3 199.7475 2.7E3 202.0174 1.6E4 END IONS BEGIN IONS FEATURE_ID=72 PEPMASS=206.1026 SCANS=72 RTINSECONDS=65 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 2 (0 removed due to low quality, 0 removed due to low cosine). 41.0386 4.8E3 45.0333 1.3E4 45.9334 2.6E3 53.0902 2.2E3 54.4564 2.3E3 55.0541 8.1E3 55.9342 3.1E3 56.0469 2.2E3 56.0493 4.9E4 57.5261 2.9E3 58.0649 8.3E4 59.0489 6.1E3 59.9578 2.2E3 60.0440 2.5E3 68.0492 2.9E4 68.3053 2.9E3 69.0696 1.4E4 70.0648 1.0E4 71.0682 2.6E3 73.0279 9.7E4 74.0232 8.8E3 75.0268 3.5E3 76.0755 6.9E3 78.5796 2.4E3 81.0695 2.7E3 82.0648 2.6E4 83.0625 3.0E3 83.0681 3.7E4 84.0165 2.4E3 84.0440 2.7E5 85.0234 2.2E3 85.0281 4.5E4 88.0755 1.2E4 94.0649 2.5E3 96.0805 3.8E5 96.0875 4.2E3 102.0546 1.0E4 114.0914 6.6E3 124.0753 1.9E5 124.0922 2.8E3 125.0789 3.7E3 129.0740 4.2E3 131.9507 2.8E3 142.0859 1.2E5 142.1050 5.3E3 160.0964 5.2E4 170.0812 2.4E4 173.5329 2.9E4 187.9174 3.1E3 198.1349 2.4E3 END IONS BEGIN IONS FEATURE_ID=73 PEPMASS=337.0942 SCANS=73 RTINSECONDS=65.419 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 5 (0 removed due to low quality, 0 removed due to low cosine). 69.3936 2.4E3 70.0284 1.3E4 71.2045 2.2E3 73.3890 2.4E3 74.0055 2.5E4 76.0211 5.8E4 76.2526 2.3E3 84.0440 9.0E5 84.0509 1.1E4 84.0527 4.3E3 85.0476 7.5E3 88.0389 7.4E4 88.4823 2.3E3 88.8594 2.4E3 92.0163 2.2E4 96.0446 3.1E3 98.0597 1.5E4 102.0547 2.2E4 103.3134 2.2E3 106.0419 4.7E3 106.0494 4.1E5 107.9930 1.8E4 109.0517 2.9E3 109.0761 3.1E3 112.0214 6.0E3 114.0552 2.9E3 114.1284 2.5E3 116.0338 3.5E4 126.0546 3.3E4 129.0654 1.6E4 130.0387 4.4E3 130.0495 4.7E5 131.0535 2.2E3 131.5446 2.2E3 131.9932 3.1E4 135.0439 6.1E3 136.0398 6.5E3 140.0161 4.5E4 142.0315 4.3E3 142.0495 6.1E4 143.0447 5.0E3 145.1256 2.4E3 146.0268 1.0E4 153.0658 2.0E4 154.0487 2.7E3 155.0808 3.3E4 157.0605 6.6E4 160.0602 4.5E4 161.0392 4.8E3 161.0550 1.6E4 172.0602 8.6E3 173.5212 5.9E3 173.5339 5.3E4 174.0220 1.4E4 175.0718 2.4E3 177.9988 8.5E3 181.0606 2.4E4 185.0378 6.5E4 185.0561 6.8E3 187.0551 2.7E3 189.0330 1.2E4 190.0166 2.7E4 191.0481 2.1E4 192.0321 5.2E4 193.0374 3.0E3 199.0713 6.3E4 203.2344 2.6E3 207.0435 1.1E5 209.0592 1.4E5 212.9624 2.4E3 213.8690 2.4E3 219.0256 1.3E4 223.0714 3.5E4 231.0435 5.4E5 231.0706 4.1E3 232.0476 1.9E4 233.0591 8.5E4 239.0189 3.5E3 241.0310 2.2E4 241.0812 8.8E3 247.0206 4.0E4 255.0439 3.2E3 256.9089 6.7E3 257.0584 3.6E4 264.0198 2.6E3 265.0311 1.7E5 267.0658 3.5E3 267.8838 3.5E4 268.0923 1.0E4 273.0550 2.0E4 274.2019 2.6E3 275.0699 4.0E3 277.1391 2.8E3 285.8928 6.4E3 287.0874 4.1E4 289.0869 6.9E3 318.0770 6.1E3 320.0886 3.0E3 321.0753 2.1E4 328.0637 1.1E4 338.1027 5.9E4 353.0477 2.4E3 582.3258 3.1E3 664.4089 2.5E3 666.3480 2.9E3 END IONS BEGIN IONS FEATURE_ID=74 PEPMASS=300.1448 SCANS=74 RTINSECONDS=66.988 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 5 (0 removed due to low quality, 0 removed due to low cosine). 51.1375 2.2E3 54.3237 2.0E3 55.0177 3.0E3 57.0333 1.0E5 57.0363 3.5E3 60.1055 2.4E3 61.0281 5.6E4 61.0428 2.2E3 64.4522 2.3E3 66.2416 2.1E3 66.6463 2.1E3 67.6425 2.4E3 69.0331 4.2E4 71.0125 7.0E3 71.0489 9.8E3 71.6794 2.7E3 73.0280 2.2E4 75.0437 3.8E4 76.0288 2.3E3 77.0385 2.6E3 81.0332 3.8E3 82.1958 2.5E3 85.0281 1.5E5 85.5938 3.0E3 87.0437 1.8E4 88.0964 2.2E3 91.0386 2.4E4 91.0540 3.5E4 93.0543 2.3E4 93.0695 1.0E5 94.0240 2.1E3 95.0491 9.8E3 96.0439 3.1E3 97.0281 6.9E4 99.0074 7.6E3 99.0439 1.6E4 103.0385 7.4E4 103.0539 4.3E4 103.3822 2.4E3 106.2869 2.7E3 108.6910 2.6E3 113.0230 9.7E3 116.3120 2.4E3 117.2483 2.2E3 120.9336 2.6E3 121.0645 3.1E6 121.0732 4.9E4 121.0814 1.9E4 121.0845 8.9E3 121.9757 2.5E3 124.8792 2.2E3 127.0386 2.1E4 131.0342 3.2E3 137.0594 3.0E4 138.0909 3.0E4 141.7133 2.4E3 141.7592 2.4E3 148.1389 2.3E3 149.0594 2.5E4 151.0749 3.0E4 161.0594 2.5E4 163.0754 9.4E3 164.0704 9.5E3 169.0485 2.7E3 171.4586 2.4E3 171.9218 3.0E3 173.0607 5.6E3 173.5247 3.6E3 173.5329 4.4E4 173.5418 5.5E3 175.0753 5.1E3 177.0554 6.4E3 178.0864 3.2E4 179.0701 2.3E4 185.0601 3.0E3 187.9165 8.1E3 188.9255 2.9E3 191.0702 2.9E3 192.5296 2.4E3 196.9322 1.7E4 199.0744 2.3E3 199.7322 2.5E3 201.0530 2.4E3 201.0924 2.3E3 204.9055 2.4E3 205.9268 2.8E3 209.8248 2.4E3 218.0811 6.4E3 219.0655 7.8E3 220.0968 7.7E3 222.8015 2.2E3 229.9275 5.1E3 239.9116 1.1E4 257.9211 5.3E3 258.8879 2.6E4 276.8974 3.4E3 300.1031 2.2E3 300.1451 6.9E3 END IONS BEGIN IONS FEATURE_ID=75 PEPMASS=303.1346 SCANS=75 RTINSECONDS=67.855 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 3 (1 removed due to low quality, 0 removed due to low cosine). 48.4663 2.4E3 48.9170 2.1E3 71.5782 2.6E3 90.9477 2.5E3 91.0540 2.9E3 93.0065 2.6E3 99.0328 2.4E3 106.9829 2.5E3 109.4212 2.4E3 110.0598 3.3E4 119.0497 3.1E3 123.0441 3.6E3 130.8545 2.6E3 134.0599 1.4E4 135.0440 3.1E3 136.0762 3.0E3 137.0596 2.6E4 140.0704 1.0E6 149.0711 1.6E4 150.0549 3.5E4 152.0575 3.3E3 152.0705 9.2E4 161.0720 3.3E3 162.0789 1.0E4 163.0636 4.0E3 163.0869 7.3E3 164.0706 5.8E5 173.5307 3.0E4 173.5448 2.3E3 186.9244 4.3E3 196.6083 2.4E3 210.0919 3.9E3 213.0784 2.7E3 219.7345 2.2E3 238.0869 3.3E3 240.1016 4.4E3 242.0809 1.0E4 256.0974 8.5E4 257.0807 5.1E3 267.1131 7.8E3 268.0970 2.8E4 285.1245 3.5E4 286.1085 5.2E4 303.1353 2.4E4 END IONS BEGIN IONS FEATURE_ID=76 PEPMASS=316.1397 SCANS=76 RTINSECONDS=69.122 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 3 (1 removed due to low quality, 0 removed due to low cosine). 49.7642 2.8E3 53.0385 7.7E3 55.0540 2.5E4 55.4827 2.5E3 57.0335 9.0E3 59.0490 8.6E3 59.2969 2.3E3 61.0252 4.3E3 61.0280 1.2E5 61.0822 2.2E3 62.8942 2.1E3 64.4356 2.2E3 65.0387 2.5E3 65.9079 2.4E3 69.0332 2.1E4 71.0489 3.0E4 71.4920 2.7E3 72.9128 2.6E3 73.0282 3.3E4 81.0333 3.8E3 83.0488 5.5E4 85.0233 3.1E3 85.0281 1.1E5 87.0435 2.3E3 87.5242 2.2E3 87.6829 3.0E3 90.8527 2.4E3 91.0387 6.2E4 91.0538 1.3E5 97.0225 2.3E3 97.0281 5.2E4 99.0437 5.9E3 100.6050 2.4E3 101.0594 2.4E5 106.7491 2.5E3 109.0282 3.8E3 109.0645 1.2E4 114.8267 2.3E3 115.0385 3.3E3 119.0404 4.1E3 119.0489 1.0E5 123.1123 2.4E3 127.0387 2.3E4 137.0594 2.2E6 137.0695 3.3E4 137.0837 1.8E4 145.0490 7.1E3 154.0861 5.3E4 160.7230 2.6E3 166.0862 1.6E4 167.0897 1.7E4 173.5226 5.3E3 173.5400 1.5E4 203.8833 2.6E4 205.8986 1.2E4 221.8942 7.5E3 231.8778 6.1E3 233.8943 3.2E3 243.8775 1.7E4 249.8892 8.4E3 257.0021 3.2E3 289.5569 3.0E3 313.3922 2.5E3 END IONS BEGIN IONS FEATURE_ID=77 PEPMASS=277.9362 SCANS=77 RTINSECONDS=69.18 CHARGE=1+ MSLEVEL=2 MERGED_STATS=8 / 8 (0 removed due to low quality, 0 removed due to low cosine). 49.0450 2.1E3 50.6048 2.1E3 51.4400 4.5E3 53.7089 2.4E3 55.9341 2.9E5 59.4542 2.1E3 59.7045 2.2E3 60.7851 2.4E3 61.0437 2.2E3 61.5503 2.6E3 63.6088 2.5E3 64.3625 2.5E3 68.0091 2.5E3 68.2967 2.3E3 68.5317 2.6E3 69.2747 2.2E3 69.9497 6.3E4 70.0649 3.3E3 71.9290 5.4E4 72.0491 2.2E3 72.0772 6.3E3 72.9369 1.2E5 73.9447 6.8E4 74.0105 2.2E3 74.9525 1.2E4 77.7121 2.2E3 81.4947 2.5E3 81.8025 2.3E3 83.0757 2.7E3 84.1305 2.4E3 85.0282 1.1E4 87.9602 1.2E5 89.9396 1.8E5 90.6391 2.8E3 90.9474 3.9E5 91.1059 2.7E3 91.9552 4.4E4 95.6782 2.6E3 98.0597 4.3E4 99.9604 3.5E3 101.0987 2.2E3 102.8187 2.6E3 102.9473 1.5E4 105.9346 4.5E4 105.9707 9.6E3 107.9423 4.7E3 107.9501 8.8E5 108.9581 2.9E4 110.7230 2.6E3 112.9298 2.4E3 115.9552 2.2E5 115.9637 4.7E3 116.0702 1.3E5 116.9632 3.7E4 117.9712 5.3E3 118.5384 2.3E3 118.9422 1.4E4 120.1721 2.9E3 120.7993 2.6E3 121.1254 2.4E3 125.7070 2.2E3 125.9514 4.0E3 125.9606 4.0E5 128.9847 2.4E3 129.7433 2.5E3 131.9504 2.1E4 131.9867 8.3E3 133.9658 8.2E5 133.9758 5.9E3 134.9733 3.0E3 135.9451 1.3E4 136.9532 2.8E3 141.9345 2.7E3 143.9502 6.6E4 144.8935 2.5E3 144.9581 2.5E4 146.2170 2.3E3 147.9452 2.8E3 151.6139 2.6E3 151.9763 6.1E5 153.3494 2.3E3 156.8022 2.2E3 159.9451 7.0E5 159.9582 2.4E3 159.9677 3.4E3 160.9531 3.5E4 161.9609 1.1E5 162.9682 1.2E4 164.0703 8.1E3 167.3544 2.4E3 173.5254 3.9E4 173.5399 4.2E4 175.0387 4.0E3 175.1203 2.9E3 175.9401 2.3E4 177.1412 2.4E3 177.4502 2.4E3 177.9559 2.8E6 179.0717 3.1E3 180.8860 2.8E3 187.9765 1.5E4 190.0264 2.0E4 192.4793 2.6E3 195.9666 1.7E4 200.9731 1.1E4 203.9718 3.2E4 204.0087 2.3E3 205.0499 3.8E4 205.9499 3.0E3 208.8838 1.2E4 226.8929 5.7E3 251.8793 2.5E3 253.8641 2.5E3 263.7711 2.8E3 271.7873 2.4E3 277.8486 2.5E3 END IONS BEGIN IONS FEATURE_ID=78 PEPMASS=205.9512 SCANS=78 RTINSECONDS=69.195 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 5 (0 removed due to low quality, 0 removed due to low cosine). 41.2572 2.3E3 41.6607 2.3E3 45.0333 1.9E4 45.7113 2.3E3 45.7640 2.4E3 47.0983 2.9E3 52.9190 2.0E3 53.6139 2.3E3 55.2604 2.5E3 55.9341 1.4E5 56.1094 2.5E3 56.3679 2.2E3 61.8503 2.6E3 64.6278 2.6E3 65.5218 2.2E3 66.1034 2.2E3 69.9498 2.8E4 70.0664 7.8E3 71.9290 2.8E4 72.9368 6.8E4 73.0281 1.5E5 73.9447 3.9E4 74.0185 2.5E3 75.1173 2.6E3 77.3932 2.4E3 78.5967 3.0E3 80.5046 2.4E3 87.5312 2.2E3 87.8617 2.1E3 87.9602 4.8E4 88.0754 1.7E4 89.9395 5.1E4 90.9473 1.3E5 91.9553 2.2E4 96.7857 2.4E3 103.2347 2.4E3 105.9344 2.8E4 105.9711 2.2E3 106.6772 2.3E3 107.9425 3.9E3 107.9501 2.0E5 108.9581 3.7E3 112.8424 2.2E3 114.0370 3.5E3 114.0904 2.5E3 114.6381 2.2E3 115.9552 2.3E4 115.9638 2.6E3 125.9606 7.4E4 126.5752 2.5E3 128.9866 2.2E3 133.9658 6.5E4 136.8154 2.2E3 146.7609 2.5E3 148.0103 2.7E3 151.9764 3.9E4 159.9450 5.1E4 160.0954 2.8E3 173.5236 1.1E4 173.5350 5.2E4 173.6291 2.4E3 177.9558 1.1E5 177.9709 3.0E3 189.5422 2.4E3 189.7609 2.3E3 END IONS BEGIN IONS FEATURE_ID=79 PEPMASS=222.0612 SCANS=79 RTINSECONDS=72.436 CHARGE=1+ MSLEVEL=2 MERGED_STATS=9 / 9 (0 removed due to low quality, 0 removed due to low cosine). 42.5716 2.6E3 43.8096 4.2E3 43.8558 4.6E3 44.5721 3.0E3 44.6944 3.8E3 44.8427 2.8E3 44.9321 6.2E3 47.0292 3.7E3 47.7754 3.3E3 48.3051 3.7E3 48.7414 3.7E3 51.9394 2.6E3 52.0877 4.3E3 52.1411 3.1E3 52.6626 6.9E3 53.2483 3.4E3 53.2717 3.6E3 54.0906 3.6E3 54.2601 5.3E3 55.0177 1.7E4 56.0494 3.2E3 56.6377 6.6E3 57.0333 7.4E4 58.0059 4.7E3 58.0649 1.0E5 58.4841 2.7E3 59.3088 2.6E3 59.3884 4.1E3 63.9294 6.2E3 65.2311 4.0E3 65.6340 4.8E3 66.1461 2.7E3 68.6636 4.9E3 69.0295 5.8E3 69.0331 4.6E5 70.0649 8.8E3 73.2255 5.4E3 75.3585 3.4E3 76.0971 4.3E3 83.1289 2.8E3 83.1390 3.6E3 83.5692 6.1E3 85.0281 3.4E5 87.3825 5.2E3 89.5096 4.4E3 91.0539 9.3E4 95.0124 6.9E5 95.1723 6.9E3 97.0281 1.6E6 97.0349 4.2E3 99.0075 7.0E3 101.2660 4.4E3 103.3914 4.3E3 103.5198 4.3E3 104.4799 6.0E3 107.0487 4.7E3 108.1999 7.2E3 111.7108 5.2E3 113.0048 3.1E3 113.0230 7.5E5 113.1269 3.2E3 118.0414 7.0E3 119.0488 8.4E4 122.9972 1.3E4 123.0073 1.4E6 123.0160 4.4E3 123.0182 2.3E4 125.0230 2.7E5 131.4856 4.9E3 131.8929 4.1E3 135.0439 1.0E5 141.0179 1.1E6 141.0303 1.6E4 141.7221 3.0E3 143.0217 3.8E3 143.0336 2.2E5 144.0653 1.3E4 144.2459 2.7E3 149.9802 3.8E3 153.5885 6.5E3 156.7622 3.2E3 159.0285 7.3E3 163.0380 8.8E3 168.9982 7.7E3 169.0130 5.3E5 173.5248 1.9E4 173.5373 1.3E5 176.3185 3.7E3 179.5215 6.2E3 187.0235 9.3E4 188.8426 5.7E3 195.0504 1.6E4 196.3829 3.0E3 200.9212 4.6E3 205.0688 1.0E4 229.4987 5.0E3 END IONS BEGIN IONS FEATURE_ID=80 PEPMASS=227.0166 SCANS=80 RTINSECONDS=72.436 CHARGE=1+ MSLEVEL=2 MERGED_STATS=9 / 9 (0 removed due to low quality, 0 removed due to low cosine). 47.4478 2.6E3 47.7035 2.2E3 48.2739 2.5E3 48.5883 2.2E3 53.6793 2.5E3 54.0181 2.2E3 54.8091 2.4E3 55.9343 2.9E3 56.7126 2.5E3 59.3088 2.1E3 59.4921 2.2E3 60.4458 2.2E3 61.3487 2.0E3 61.6544 2.6E3 62.3732 2.1E3 63.2787 2.4E3 64.6907 4.6E3 64.7721 2.5E3 65.6102 2.3E3 66.3747 2.3E3 70.0520 2.3E3 72.9368 1.1E5 74.0898 2.1E3 74.3079 2.3E3 78.1563 2.4E3 80.7704 2.6E3 82.7183 2.6E3 83.7449 2.1E3 85.7166 2.3E3 90.9474 6.8E4 93.2516 2.5E3 101.5617 2.4E3 102.0317 2.4E3 103.4525 2.3E3 103.8515 2.3E3 109.3915 2.2E3 109.9056 2.4E3 112.5057 2.2E3 113.0080 2.5E3 113.9634 1.8E5 115.2744 2.3E3 123.9433 2.7E3 125.7509 2.3E3 126.0536 3.3E3 128.1130 2.3E3 131.6383 2.2E3 131.9734 5.9E3 135.8453 2.5E3 137.2073 2.6E3 139.4766 2.4E3 148.1718 2.6E3 154.6762 2.4E3 157.9923 2.6E3 167.0703 1.2E4 168.5906 2.5E3 173.5284 8.7E4 173.5414 1.1E4 174.3059 2.7E3 185.9278 2.9E4 191.7124 2.2E3 198.0076 2.6E3 199.6400 2.3E3 200.1390 2.4E3 203.9380 5.3E3 212.2258 2.8E3 227.0180 2.8E3 227.1175 2.6E3 233.5006 3.1E3 END IONS BEGIN IONS FEATURE_ID=81 PEPMASS=316.1396 SCANS=81 RTINSECONDS=73.194 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 4 (1 removed due to low quality, 0 removed due to low cosine). 50.5909 2.6E3 50.8515 2.4E3 51.0875 2.2E3 55.0543 3.4E3 55.5225 2.5E3 57.6540 2.3E3 59.0489 2.3E3 59.8715 2.5E3 60.9703 2.3E3 61.0282 3.3E3 62.3320 2.2E3 65.1656 2.3E3 67.5065 2.3E3 69.0332 1.4E4 71.0489 4.6E3 73.0278 5.0E3 81.8502 2.5E3 83.0488 9.8E3 84.1005 2.4E3 85.0280 4.9E4 87.9690 2.2E3 91.0539 4.0E4 96.0441 1.0E4 97.0282 2.0E4 98.6343 2.6E3 99.0443 2.3E3 101.0593 3.9E4 103.9340 2.3E3 119.0489 3.2E4 127.0387 1.3E4 131.0482 2.9E3 133.1609 2.3E3 133.6475 2.3E3 135.0441 2.6E3 136.0614 3.7E3 137.0594 6.5E5 137.0698 5.9E3 140.0714 3.0E3 143.9694 2.3E3 144.0653 2.3E4 149.0593 1.2E4 151.0745 2.9E3 152.3910 2.7E3 153.0537 3.7E3 154.0860 1.3E4 161.0587 3.1E3 162.0750 2.1E4 164.0705 2.0E4 164.9998 9.4E3 166.0862 4.1E4 167.0895 2.1E4 168.2882 2.4E3 173.5243 1.0E4 173.5339 2.6E4 173.5428 4.8E3 176.9999 2.7E3 177.0549 6.7E3 178.0861 4.6E4 179.0155 8.6E3 179.0705 5.8E3 188.0834 2.4E3 194.0025 5.0E3 197.0268 4.4E3 202.0877 3.2E3 203.0707 3.6E3 203.8834 8.4E3 205.8987 4.4E3 208.0961 3.0E3 209.0267 9.8E4 209.0491 2.8E3 218.0817 4.4E3 220.0969 1.5E4 232.0980 4.3E3 243.8782 2.9E3 253.0670 2.8E3 262.9922 2.3E3 280.1184 2.1E4 281.0654 2.9E3 298.1290 3.6E4 302.0815 2.5E3 316.1400 5.1E3 END IONS BEGIN IONS FEATURE_ID=82 PEPMASS=358.1135 SCANS=82 RTINSECONDS=73.511 CHARGE=1+ MSLEVEL=2 MERGED_STATS=7 / 8 (1 removed due to low quality, 0 removed due to low cosine). 52.6621 2.2E3 53.4544 2.3E3 54.7126 2.9E3 58.7192 2.8E3 59.3171 2.1E3 59.6779 3.0E3 61.5689 2.4E3 64.7850 2.6E3 65.0385 7.2E4 66.0238 2.5E3 71.2000 2.8E3 72.0406 2.2E3 74.0623 2.7E3 74.0914 3.1E3 75.3361 2.2E3 78.8112 2.1E3 81.0697 2.9E4 84.9156 2.3E3 85.2142 2.6E3 85.8614 2.4E3 91.0541 1.8E6 91.0614 1.1E4 92.2812 2.2E3 93.1714 2.9E3 93.7509 2.3E3 93.8149 2.2E3 97.8172 2.4E3 100.2304 2.4E3 109.0646 1.1E5 109.2520 2.8E3 113.0237 5.4E3 119.0391 1.9E4 119.0490 1.0E6 119.0584 8.9E3 128.2177 2.1E3 132.8016 3.7E3 136.9996 3.9E3 137.0205 4.1E3 137.0596 2.8E7 137.0692 8.1E4 137.0791 3.8E4 137.0844 2.9E5 137.0943 3.3E4 137.1004 1.4E4 154.0653 3.3E3 154.0862 2.3E6 161.0602 8.8E3 169.0125 2.8E3 169.8739 2.4E3 173.5316 1.1E5 173.5453 4.0E3 178.0864 3.8E4 182.0275 2.6E3 192.9780 2.5E4 196.0997 2.3E3 201.0783 2.4E3 203.0716 3.4E3 205.9861 2.8E3 206.9948 2.9E4 208.0421 5.6E3 208.0613 1.6E4 208.7292 3.3E3 219.0897 9.7E3 222.9927 6.2E3 224.0934 3.1E3 225.0032 3.0E3 236.0922 4.6E4 236.9724 1.1E4 258.0778 2.6E3 266.1022 1.6E4 294.0981 3.7E4 300.2876 3.2E3 308.8163 2.6E3 311.0216 2.4E5 312.0088 1.3E4 312.1086 3.3E5 312.1496 4.1E3 324.0291 9.2E4 328.0476 2.2E4 339.0376 3.0E3 340.1080 2.6E3 341.0353 2.2E4 358.1131 1.3E4 366.7817 2.4E3 END IONS BEGIN IONS FEATURE_ID=83 PEPMASS=248.0245 SCANS=83 RTINSECONDS=73.898 CHARGE=1+ MSLEVEL=2 MERGED_STATS=7 / 8 (1 removed due to low quality, 0 removed due to low cosine). 44.0494 7.3E3 44.4877 2.4E3 47.6760 2.3E3 48.9885 2.5E3 49.1804 2.5E3 49.7524 2.1E3 52.3590 2.3E3 53.2407 2.1E3 55.9342 6.4E4 58.3446 2.4E3 58.6538 2.3E3 60.0932 2.3E3 61.7984 2.9E3 62.0599 1.9E4 68.0263 2.2E3 70.0094 2.2E3 70.0649 2.5E3 70.7270 2.2E3 71.1049 2.5E3 72.9369 2.7E3 73.0281 8.5E4 73.0380 2.1E3 74.3856 2.3E3 84.0440 1.1E4 85.0281 5.5E3 86.0964 6.6E3 86.5997 2.9E3 87.0551 1.2E4 87.0993 6.6E3 90.9473 6.1E3 91.7931 2.3E3 92.1756 2.1E3 96.5194 2.4E3 97.6849 2.4E3 104.7894 2.6E3 106.3894 2.4E3 108.5487 2.3E3 111.3559 2.4E3 113.0701 8.4E3 123.4077 2.3E3 123.5555 2.7E3 128.9518 2.4E3 128.9632 5.4E3 130.0493 3.3E3 133.2921 2.9E3 138.0546 1.2E4 138.9837 1.5E4 139.9270 2.1E3 149.9769 2.4E3 151.5276 2.4E3 153.9711 2.2E4 155.6058 2.2E3 157.2041 2.2E3 166.9792 3.4E3 167.9870 1.4E4 171.2622 2.8E3 173.5252 6.2E4 173.5392 3.9E4 175.0394 4.4E3 176.9639 1.0E5 177.9714 5.6E4 179.9874 8.8E3 181.3136 2.6E3 181.9664 3.4E3 194.9326 3.6E3 194.9738 4.2E6 194.9893 1.3E4 195.9621 9.3E3 195.9817 3.3E5 203.9815 2.7E3 204.9694 3.7E4 205.9899 1.6E5 206.9973 1.7E4 208.9532 2.7E3 209.9613 5.4E4 212.9846 5.2E5 213.0082 4.6E3 213.8195 2.6E3 213.9921 6.3E4 215.9921 2.6E3 216.7696 2.5E3 216.9976 3.0E4 217.9900 3.4E5 224.9270 2.5E3 228.9019 2.8E3 231.0131 6.4E3 234.7720 2.6E3 236.0003 3.4E3 241.9579 2.3E3 248.0909 6.8E3 253.5217 2.7E3 258.0361 2.7E3 END IONS BEGIN IONS FEATURE_ID=84 PEPMASS=303.1345 SCANS=84 RTINSECONDS=74.162 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 2 (0 removed due to low quality, 0 removed due to low cosine). 50.9957 2.2E3 63.1976 2.2E3 64.2545 2.7E3 75.8193 2.4E3 76.3880 2.3E3 86.0596 9.5E3 91.0538 1.5E4 91.1779 2.3E3 94.0647 8.5E3 119.0488 9.8E3 121.0645 3.2E4 122.0598 3.7E4 124.7588 2.3E3 137.0595 1.0E5 138.0547 2.5E4 140.0704 6.1E4 146.0596 7.2E3 149.6843 5.6E3 149.6958 4.6E3 150.0548 1.9E5 152.0708 6.9E3 152.5040 3.1E3 152.6157 2.4E3 154.0860 2.7E3 164.0706 5.1E4 166.0496 1.8E4 173.5291 2.1E4 173.5386 5.3E3 185.5884 2.3E3 221.9658 2.9E3 230.0812 4.4E3 256.0978 3.1E3 263.2882 2.8E3 267.0771 1.8E4 274.1078 3.8E3 285.0883 3.8E3 298.8957 2.3E3 303.0984 3.6E3 END IONS BEGIN IONS FEATURE_ID=85 PEPMASS=245.0864 SCANS=85 RTINSECONDS=75.161 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 44.0495 6.0E3 55.0178 6.6E3 56.0494 1.1E4 58.0650 1.1E4 60.0442 3.7E5 66.6221 2.4E3 68.0493 1.0E4 69.0333 3.5E3 70.0286 3.5E4 70.0650 5.6E4 71.0487 3.3E3 71.4140 2.5E3 72.0447 2.6E3 73.0734 2.6E3 74.0058 1.9E4 74.0234 8.1E4 76.0214 9.5E3 77.1229 2.4E3 79.0543 3.1E3 80.0493 1.5E4 81.0332 2.7E3 82.0652 2.6E3 83.0602 3.0E4 83.5522 5.6E3 83.8748 2.6E3 83.9643 2.9E3 84.0442 1.6E6 84.0507 1.3E4 84.0531 3.1E3 84.0805 6.3E3 85.0282 2.4E4 85.0474 1.0E4 86.0965 3.8E3 87.2940 2.5E3 88.0390 1.1E5 88.0754 9.6E4 90.9473 5.7E3 92.0163 2.3E3 96.0442 2.6E4 97.5496 3.2E4 98.0599 4.6E4 99.0437 6.9E3 99.0550 2.8E3 100.0392 2.6E3 102.0547 6.9E4 105.1285 2.5E3 106.0496 1.2E5 106.5550 2.3E4 107.0489 2.7E4 107.0604 1.6E4 108.0442 4.7E4 109.0522 4.8E3 109.0756 6.6E3 110.0599 2.6E4 111.0552 1.6E4 112.0391 1.9E4 112.8666 2.1E3 113.0341 1.9E4 113.5362 2.8E3 114.0547 6.9E4 115.0085 2.6E3 115.0856 2.9E3 116.0339 1.8E4 116.0703 3.0E5 118.8548 2.1E3 120.5523 1.9E4 121.0105 2.4E3 122.0182 4.1E3 122.5408 3.2E4 123.0261 9.0E4 123.0431 3.7E3 123.3368 2.5E3 123.9938 2.1E3 124.0393 3.6E3 124.0753 2.5E4 124.5402 1.6E4 125.0708 2.0E4 126.0547 4.5E4 129.0656 7.9E4 130.0496 5.1E5 130.0588 4.3E3 131.0493 1.0E4 132.0655 5.9E3 135.0438 4.0E4 135.0547 1.1E4 136.0391 1.2E5 136.0517 1.3E5 136.0758 1.2E4 136.5383 1.2E4 137.0593 1.2E4 137.8487 2.6E3 138.0456 2.7E3 138.5379 5.5E4 139.0205 8.8E3 142.0497 9.2E4 146.0451 5.9E3 147.0260 6.6E4 147.0510 3.1E4 147.0629 2.8E3 148.0515 2.7E3 149.0053 3.0E4 149.0594 3.0E3 149.0710 2.1E4 149.6923 4.3E3 149.9615 2.7E3 150.0130 9.4E3 151.0210 2.7E5 151.0351 5.4E3 151.0624 6.3E3 153.0656 7.1E4 154.0495 4.0E4 154.0861 1.9E4 155.0158 6.0E4 155.0815 1.5E4 156.0656 1.8E4 157.0607 3.7E4 158.0444 2.0E4 160.0603 7.9E4 161.0489 5.8E3 163.0206 1.2E4 165.0372 7.2E3 167.0161 9.3E4 167.0815 6.7E3 168.0239 2.1E5 168.0556 6.3E3 169.0316 5.1E5 169.0448 4.5E3 170.0346 2.8E3 171.0764 2.4E4 172.0599 1.1E4 173.0925 8.0E3 173.5279 1.9E4 173.5360 1.5E4 173.5440 3.6E3 174.3162 2.8E3 175.0213 1.2E5 175.0716 7.1E3 177.0658 4.0E4 178.0628 7.3E3 178.9096 2.6E3 179.1138 2.9E3 181.0318 2.8E4 181.0605 3.3E4 182.0532 1.3E4 182.0811 1.4E5 190.0168 1.8E4 192.0476 1.1E4 193.0318 5.3E5 193.0520 5.3E3 194.0348 1.9E4 195.0764 5.7E4 199.0711 3.9E4 203.0158 2.9E3 205.7985 2.5E3 210.0580 6.1E4 210.0768 3.9E4 216.9795 2.8E3 216.9975 8.1E4 218.0594 2.4E3 220.0431 4.2E3 221.0266 1.1E4 222.0881 7.4E3 223.0713 8.2E4 228.0867 3.5E4 235.0082 1.2E4 239.0371 1.5E4 241.0818 2.0E4 245.1124 3.2E3 246.0602 3.1E3 268.0926 1.8E4 276.0691 2.6E4 280.0615 2.5E3 303.0816 2.8E3 326.0690 2.1E4 364.6182 2.2E3 417.9692 2.5E3 439.8545 2.6E3 465.1558 2.4E3 END IONS BEGIN IONS FEATURE_ID=86 PEPMASS=215.0167 SCANS=86 RTINSECONDS=75.318 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 7 (3 removed due to low quality, 0 removed due to low cosine). 44.0492 2.1E3 47.0316 2.0E3 51.3939 2.4E3 53.5638 2.1E3 55.9342 7.2E3 56.0494 2.7E3 57.4785 2.2E3 58.0647 2.3E3 59.6762 2.1E3 61.5765 2.5E3 63.3770 2.9E3 66.3082 2.5E3 67.3769 2.2E3 69.1618 2.2E3 70.0649 1.2E4 72.0221 2.2E3 72.0805 6.9E5 90.9475 1.9E4 96.8205 2.3E3 106.8511 2.4E3 111.2464 2.7E3 115.1003 2.2E3 118.3394 2.4E3 127.4809 2.3E3 132.9586 2.7E3 142.3640 2.3E3 173.5212 7.1E3 173.5295 2.3E4 173.5399 1.8E4 185.6008 2.7E3 195.5532 2.3E3 201.3015 2.6E3 215.1396 1.2E4 END IONS BEGIN IONS FEATURE_ID=87 PEPMASS=438.9798 SCANS=87 RTINSECONDS=75.338 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 2 (0 removed due to low quality, 0 removed due to low cosine). 55.9345 2.7E4 56.9350 2.6E3 66.4708 2.4E3 69.9500 7.6E3 70.9580 2.3E4 71.9293 1.5E4 72.9373 5.3E4 73.9375 3.8E3 73.9452 1.0E4 79.4240 2.8E3 87.9606 1.5E4 88.9630 2.2E3 88.9685 1.9E4 89.9400 2.8E4 90.9412 4.6E3 90.9477 1.7E5 90.9544 3.4E3 91.9483 6.1E3 91.9538 1.4E4 95.8642 2.3E3 98.2336 2.3E3 101.9763 9.6E3 102.9477 2.0E4 105.9347 1.7E4 106.9427 3.6E3 107.9505 3.3E4 108.9575 2.1E4 112.9689 3.6E3 114.4248 2.4E3 114.9487 1.2E4 114.9839 7.2E3 115.9554 9.9E3 116.9633 2.5E4 117.9347 3.1E3 123.9451 6.6E3 125.9610 1.0E4 126.9477 2.2E3 126.9846 3.5E3 127.9555 1.3E4 128.9637 1.6E4 128.9999 7.6E4 129.9714 4.1E3 130.9791 3.7E5 130.9922 8.3E3 131.9505 5.4E4 132.9583 1.9E5 133.9659 1.2E4 137.0595 1.2E4 140.9640 1.3E4 143.9504 3.3E4 143.9868 2.9E4 144.9529 1.4E4 144.9893 1.9E4 145.9662 1.5E5 146.9683 6.4E4 147.9449 3.9E3 147.9819 4.5E4 148.9890 6.2E4 149.9611 7.4E4 150.9683 6.6E4 151.9775 3.4E3 154.9788 8.3E3 156.9583 3.4E4 156.9950 3.0E4 157.9649 8.9E3 158.9581 9.2E3 158.9740 5.0E5 158.9893 4.7E3 160.9533 1.2E5 161.9612 6.7E4 161.9970 2.3E3 162.9634 2.8E4 163.9377 2.5E3 163.9769 1.8E4 164.9787 8.4E3 165.9927 2.4E4 166.9948 1.5E4 167.9717 7.6E3 170.0024 4.8E3 171.0077 5.3E3 171.9454 3.0E3 172.4899 2.4E3 172.9898 9.6E4 173.5285 2.2E4 173.5449 4.2E3 173.9613 5.8E4 174.9681 1.1E5 176.9847 6.2E4 178.9640 2.3E4 182.9741 1.9E4 183.0106 3.2E3 184.9533 8.3E4 184.9893 9.1E3 186.9323 7.9E3 187.0017 3.1E3 187.9406 5.3E4 188.9431 4.0E4 189.0210 3.0E4 189.9559 2.9E3 190.9588 3.5E3 191.0006 1.7E4 191.9718 6.3E4 192.9769 6.7E4 196.9888 1.1E4 198.9695 1.6E4 199.0054 2.4E5 200.9848 8.9E4 201.9562 8.7E4 202.9625 2.3E5 204.9432 3.5E3 205.9514 2.5E4 206.9533 1.9E4 213.9929 7.8E3 214.5464 3.0E3 214.9993 6.9E4 216.9785 8.7E3 217.0160 2.0E4 218.9951 1.0E4 219.9668 1.6E5 220.9701 1.7E5 224.9847 5.6E4 226.9642 4.9E4 227.0004 7.6E4 228.9431 1.6E4 228.9795 2.3E4 230.9586 7.4E3 240.9785 7.6E3 242.9946 3.1E4 244.9741 2.6E4 245.0083 4.8E3 246.9536 1.1E5 252.9793 5.4E4 254.9588 1.6E4 263.9565 2.7E3 264.9641 8.7E4 268.9740 1.5E4 270.9542 3.4E3 270.9893 1.2E4 279.4735 2.9E3 286.9839 3.6E3 334.9722 3.7E3 404.0551 2.5E3 END IONS BEGIN IONS FEATURE_ID=88 PEPMASS=282.0978 SCANS=88 RTINSECONDS=75.425 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 6 (0 removed due to low quality, 0 removed due to low cosine). 48.2292 2.2E3 54.5216 2.4E3 55.0538 2.5E3 55.9345 3.2E3 57.0698 7.6E3 59.0212 2.4E3 60.1997 2.3E3 60.6639 2.5E3 62.3817 2.4E3 62.7028 2.4E3 63.5489 2.9E3 64.4875 2.7E3 67.1773 2.2E3 68.6118 2.3E3 69.0697 1.0E4 73.0281 6.5E3 73.3337 2.2E3 74.4920 2.6E3 75.4466 2.6E3 76.8384 2.3E3 80.6672 2.6E3 81.0691 3.0E3 83.0852 9.5E3 84.1391 2.7E3 85.0281 1.8E4 86.2987 2.4E3 91.0540 9.1E4 91.2994 2.5E3 95.5960 2.6E3 102.7231 2.6E3 104.0074 2.7E3 109.0649 6.7E3 115.9439 2.3E3 117.4694 2.3E3 119.0489 7.1E4 121.0645 1.0E4 122.0607 3.9E3 134.0963 4.7E4 134.8005 2.3E3 136.0624 1.3E4 137.0595 1.3E6 137.0694 1.0E4 144.9101 2.4E3 146.0443 8.8E3 146.6448 2.3E3 150.0547 4.6E4 151.0750 1.1E4 157.0649 2.7E3 161.0456 2.5E3 161.0597 3.4E4 162.0549 2.6E4 163.0628 2.9E3 164.0706 3.9E4 168.2791 2.2E3 170.0719 2.8E3 172.0756 3.2E3 172.8346 2.6E3 173.0598 7.8E4 173.5231 2.2E4 173.5372 4.7E4 175.0753 1.8E4 176.0705 5.2E4 183.8555 2.5E3 184.3159 2.5E3 189.0545 6.5E4 190.0863 8.6E4 191.0706 4.0E4 192.0656 6.1E4 193.0318 8.0E3 196.4578 2.6E3 200.0707 2.4E4 201.0549 5.5E4 201.0740 3.0E3 202.0849 3.2E3 203.0691 3.0E3 206.0814 3.4E3 209.3841 2.7E3 211.1355 1.4E4 218.0318 4.7E3 218.0812 3.7E6 219.0296 1.2E4 219.0653 1.4E5 219.0887 3.9E3 220.0969 3.3E4 222.0759 4.0E4 223.0796 2.6E3 226.5713 2.4E3 236.0364 3.5E3 236.0918 3.2E6 236.1490 5.0E3 237.0757 1.6E4 246.0757 1.3E4 251.3270 2.5E3 255.7474 2.7E3 264.0866 2.1E5 264.1165 3.0E3 266.5247 2.5E3 268.6202 2.5E3 273.7513 3.1E3 276.6951 2.8E3 281.7846 2.4E3 282.0975 1.2E5 282.2219 1.3E5 291.4858 2.3E3 END IONS BEGIN IONS FEATURE_ID=89 PEPMASS=287.9808 SCANS=89 RTINSECONDS=75.453 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 49.0490 2.4E3 55.9340 2.7E3 58.9047 2.3E3 58.9132 2.4E3 64.0712 2.2E3 70.9576 5.4E4 72.9369 1.1E5 86.0964 7.2E3 88.9681 4.5E4 90.0069 2.3E3 90.9411 3.6E3 90.9473 2.7E5 97.4168 2.7E3 102.9475 3.8E3 107.8185 2.4E3 108.9580 2.8E4 109.9685 2.5E4 110.4356 2.4E3 111.9841 5.6E4 112.9682 3.6E4 113.9549 3.9E3 113.9634 8.4E5 113.9715 8.1E3 114.9474 9.7E3 116.9633 7.1E3 121.0645 1.7E4 122.0594 3.4E3 122.0681 6.5E3 123.0634 3.4E3 128.9631 3.8E3 130.9788 1.4E5 131.9739 8.9E4 132.4171 2.4E3 132.9580 3.3E5 132.9685 2.7E3 135.0439 2.0E4 140.9638 3.8E3 142.9421 3.0E3 148.9894 1.9E4 149.6878 1.2E4 149.6985 4.0E3 150.0547 1.9E4 150.9687 1.2E5 151.0581 2.0E4 155.9742 3.3E4 156.9582 6.6E4 158.9737 2.0E5 160.3156 2.5E3 160.9531 5.9E4 167.0340 3.3E3 172.0056 2.4E4 173.5309 2.2E4 173.5426 4.9E3 174.9689 7.0E4 176.9844 2.4E4 178.9648 6.3E3 181.9901 3.0E4 183.9691 1.1E4 184.9533 1.8E4 186.9326 7.2E3 189.9821 2.6E3 191.0696 6.4E3 192.9794 1.9E4 197.9850 3.9E4 202.9636 2.2E4 203.0602 2.8E3 204.9440 6.9E3 208.8829 1.7E4 226.8942 2.5E3 266.9602 2.3E3 END IONS BEGIN IONS FEATURE_ID=90 PEPMASS=312.1083 SCANS=90 RTINSECONDS=75.49 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 2 (0 removed due to low quality, 0 removed due to low cosine). 48.3874 2.0E3 49.5658 2.9E3 53.0384 9.0E3 55.0176 8.5E3 57.0333 1.6E4 59.0490 2.4E3 61.0251 2.7E3 61.0281 5.2E4 62.9044 2.7E3 65.2710 2.3E3 69.0332 6.4E4 70.8145 2.2E3 71.0489 8.6E3 72.1964 2.5E3 73.0281 1.8E4 73.6469 2.3E3 75.2388 2.1E3 81.0331 2.9E4 82.8148 2.4E3 84.6730 2.7E3 85.0281 1.8E5 87.0437 1.7E4 91.0387 1.1E4 94.0652 5.6E3 97.0282 6.2E4 99.0438 9.1E3 103.0388 1.2E4 104.0492 3.2E3 109.0282 2.3E4 122.0598 7.9E4 123.0434 2.7E3 126.5524 2.4E3 127.0388 2.9E4 132.0442 6.0E4 136.0754 6.3E3 137.0597 4.7E3 139.6684 2.9E3 145.0498 3.8E3 150.0268 8.4E3 150.0548 1.3E6 150.0912 3.5E4 161.0599 3.9E3 163.0624 3.3E3 164.0706 9.9E4 167.0341 8.0E3 173.5251 1.0E4 173.5382 2.1E4 177.0783 9.3E3 178.0863 1.0E5 180.9801 4.2E3 190.0321 1.5E4 190.0860 1.9E4 201.0781 9.0E3 202.0859 1.2E4 203.0711 3.8E3 204.0657 3.8E3 204.1021 6.8E3 206.0814 3.7E4 208.0426 1.7E4 214.0844 2.7E3 218.0809 1.0E4 219.0894 2.4E4 220.0967 9.1E3 222.0763 8.7E3 224.7175 2.5E3 230.0806 8.7E3 232.0979 4.6E3 236.0647 5.3E3 236.0919 1.1E5 248.0918 7.9E3 250.1074 1.3E4 257.0885 2.8E3 258.0766 5.5E3 266.1024 3.6E4 267.9897 2.9E3 294.0976 2.9E4 294.4809 2.6E3 294.9759 1.1E4 295.4422 2.7E3 312.1082 1.3E5 312.1489 3.5E3 END IONS BEGIN IONS FEATURE_ID=91 PEPMASS=229.1550 SCANS=91 RTINSECONDS=75.504 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 6 (0 removed due to low quality, 0 removed due to low cosine). 43.9377 2.2E3 44.0493 2.9E4 44.4252 2.4E3 49.6355 2.2E3 52.7414 2.2E3 53.2750 2.1E3 55.0177 3.5E4 57.0333 1.8E4 57.8181 2.1E3 58.0648 6.9E5 58.0699 4.5E3 59.0726 1.5E5 60.0805 9.6E5 60.0840 8.7E3 62.0833 2.2E3 65.0281 2.2E3 66.4169 2.6E3 68.0491 7.2E4 69.0581 3.1E3 70.0649 3.7E6 70.0706 4.2E4 70.0715 2.4E4 70.0737 9.4E3 70.0766 3.8E3 71.6704 2.5E3 72.0805 2.6E4 73.0282 8.5E3 77.8232 2.5E3 79.1737 2.3E3 79.9768 2.5E3 80.9448 5.2E3 83.3419 2.4E3 84.0806 9.3E3 85.0841 3.0E3 87.8738 2.7E3 96.0804 7.6E4 98.0596 7.0E4 98.9554 2.5E3 101.3250 2.3E3 107.6665 2.5E3 108.2066 2.3E3 108.2835 2.2E3 111.0204 2.5E3 114.0545 4.5E5 114.0639 5.4E3 114.0909 1.4E5 115.8305 2.3E3 115.9637 1.5E4 116.0702 8.8E4 116.9658 6.7E4 124.0655 4.8E3 124.0753 4.6E5 124.2049 2.4E3 125.1157 5.2E3 126.0909 9.0E4 129.4479 2.4E3 132.1014 5.1E3 142.0735 5.6E3 142.0859 3.8E6 142.0967 5.7E4 143.4738 2.3E3 143.5369 2.6E3 149.6762 2.9E3 149.6869 6.2E3 149.7079 4.2E3 150.9163 2.8E3 156.9976 2.1E4 157.6922 2.6E3 170.0812 1.2E5 173.5235 1.2E4 173.5372 5.2E4 182.9773 1.1E4 187.9159 6.1E3 229.1012 6.4E3 229.1546 2.9E6 229.1809 4.6E3 229.2084 6.9E3 END IONS BEGIN IONS FEATURE_ID=92 PEPMASS=331.0931 SCANS=92 RTINSECONDS=75.533 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 2 (0 removed due to low quality, 0 removed due to low cosine). 52.2543 2.2E3 53.5698 2.2E3 55.6356 2.5E3 57.0699 2.5E3 63.0444 2.5E3 96.7498 2.6E3 123.0441 1.1E4 144.3038 2.1E3 163.2307 2.3E3 173.5217 4.2E3 173.5375 2.0E4 178.2903 2.4E3 212.0707 7.4E4 213.0547 2.8E4 214.8889 2.7E3 222.0555 1.6E4 225.0532 5.4E3 230.0815 1.8E4 240.0655 1.9E5 241.0498 4.4E4 243.0645 3.4E3 250.0498 1.1E5 258.0759 1.4E5 266.0451 3.8E3 267.0774 8.0E3 268.0273 4.7E3 268.0604 1.9E5 277.0626 1.1E4 278.0450 7.2E4 284.0572 4.9E3 285.0875 8.4E3 286.0713 7.4E4 295.0715 3.9E4 296.0556 1.3E5 313.0823 2.7E4 314.0659 2.8E4 END IONS BEGIN IONS FEATURE_ID=93 PEPMASS=437.9734 SCANS=93 RTINSECONDS=75.552 CHARGE=1+ MSLEVEL=2 MERGED_STATS=1 / 1 (0 removed due to low quality, 0 removed due to low cosine). 55.9344 7.4E4 56.9423 4.4E3 69.9500 2.5E4 71.9292 5.5E4 72.9324 3.8E3 72.9371 1.1E5 73.9450 4.4E4 74.6489 2.2E3 74.9527 7.4E3 77.5614 2.2E3 85.9452 5.3E3 87.9548 4.3E3 87.9606 5.8E4 88.9324 2.6E3 89.9332 2.9E3 89.9398 1.0E5 89.9463 4.9E3 90.9411 5.6E3 90.9476 1.8E5 90.9528 3.6E3 91.9554 4.2E4 99.9607 5.5E3 101.9762 2.9E4 102.9476 2.6E4 103.9555 8.3E3 105.9347 6.3E4 105.9427 3.5E3 105.9711 1.0E4 106.9426 2.1E4 107.9504 9.2E4 108.9582 2.0E4 111.9605 8.1E3 113.9398 4.3E3 113.9635 3.4E3 113.9770 2.4E3 114.9484 5.6E3 115.9555 3.8E4 116.9274 2.3E3 116.9633 1.4E4 117.9348 1.4E4 117.9709 8.3E3 118.9425 1.5E4 120.9581 3.3E3 121.0646 3.5E3 121.5089 2.6E3 123.9453 2.1E4 124.9527 5.7E3 125.9610 3.7E4 127.9556 4.5E4 127.9914 3.8E3 128.9631 2.7E3 129.9712 3.1E4 130.9792 2.2E4 131.9504 1.6E5 131.9868 1.7E4 132.9583 1.2E5 133.9660 5.2E4 134.9733 3.2E3 135.9452 6.4E3 136.9529 5.6E3 137.0598 1.1E4 140.0467 3.1E3 142.0071 6.1E3 142.9426 3.6E3 143.9504 1.4E5 143.9634 5.1E3 143.9868 1.5E5 144.9582 3.3E3 145.9661 6.1E5 146.0015 4.0E3 146.9378 5.3E3 147.9453 1.6E4 147.9817 1.5E5 147.9955 3.9E3 148.9893 6.7E3 149.9466 3.9E3 149.9610 2.9E5 150.9688 5.1E4 151.9646 3.7E3 151.9767 3.2E4 153.0404 5.1E3 154.0055 2.8E3 154.0876 3.5E3 154.9786 3.2E3 155.9504 1.2E4 157.9660 3.3E4 157.9784 4.2E3 158.0025 7.7E3 158.9380 3.8E3 158.9740 9.3E3 159.9455 2.2E4 160.0186 3.3E3 160.9533 6.2E3 161.9610 3.2E5 161.9973 2.0E4 163.9413 4.6E3 163.9610 5.2E3 163.9767 1.0E5 164.9479 7.3E3 165.9568 5.7E3 165.9924 1.5E5 167.9717 4.2E4 169.9661 8.6E3 170.0025 5.0E4 171.9455 1.8E4 171.9820 8.7E3 173.5326 2.5E4 173.9611 2.1E5 175.9770 2.5E4 177.9560 1.4E4 179.9716 1.0E4 183.9819 3.3E3 185.9976 2.3E4 187.9404 2.5E5 187.9603 4.7E3 187.9706 4.3E3 187.9790 3.3E3 188.0127 4.5E3 189.9560 3.6E4 189.9930 4.0E3 191.9716 3.5E5 195.9821 1.0E4 197.9977 8.2E3 200.9854 7.0E3 201.9562 1.6E5 201.9903 4.6E3 202.9626 3.0E3 204.0084 5.4E3 205.9510 1.6E5 206.0235 2.0E4 207.9661 3.8E3 209.9823 1.9E4 213.9926 7.8E4 215.9357 6.8E3 215.9717 5.5E3 216.0087 4.8E3 217.9508 4.9E3 217.9878 4.0E3 219.9666 9.4E5 221.9702 3.2E3 223.9779 7.3E3 229.9866 4.8E3 232.0028 7.0E3 233.9816 4.4E3 235.9610 3.1E3 237.9402 3.1E3 239.9719 1.1E4 241.9876 7.2E3 242.9833 8.0E3 243.9661 3.9E3 245.9459 1.5E4 257.9819 1.4E4 263.9568 8.5E3 264.9654 3.4E3 267.9662 9.0E3 269.9448 2.8E3 283.9589 3.0E3 285.9768 5.1E3 301.9716 6.0E3 303.9890 3.8E3 329.9680 1.2E4 352.1554 2.7E3 END IONS BEGIN IONS FEATURE_ID=94 PEPMASS=462.2128 SCANS=94 RTINSECONDS=75.667 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 58.0650 9.2E5 58.0683 9.2E3 58.0699 6.7E3 72.0805 8.3E3 73.0287 2.3E3 82.9064 2.2E3 85.0281 2.4E4 87.5083 2.3E3 91.8152 2.6E3 93.8284 2.3E3 97.0277 5.3E3 99.0441 2.6E3 107.0489 8.8E4 116.0636 2.0E3 116.3218 2.6E3 116.6603 2.2E3 119.0493 2.6E3 121.0645 5.1E4 123.0438 1.9E4 127.0389 5.9E3 131.0652 2.4E3 135.0442 2.5E3 137.0594 3.5E4 143.0484 3.4E3 145.0645 1.9E4 147.0804 1.1E4 149.4366 2.4E3 152.8922 2.3E3 154.0860 6.1E3 161.0595 4.1E4 161.8863 2.3E3 163.0753 6.9E3 173.5228 1.4E4 173.5383 3.6E4 209.0965 2.5E3 237.0907 3.8E3 239.1058 6.2E3 250.4778 2.4E3 255.1013 2.3E5 255.1327 4.0E3 257.1171 8.4E4 278.1894 2.6E3 300.1024 3.8E3 300.1596 4.5E5 300.1915 2.2E3 306.8652 2.6E3 309.2583 2.9E3 406.1834 2.3E3 462.2119 8.3E5 END IONS BEGIN IONS FEATURE_ID=95 PEPMASS=254.1614 SCANS=95 RTINSECONDS=75.693 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 4 (1 removed due to low quality, 0 removed due to low cosine). 48.7765 7.4E3 48.7785 3.8E4 49.6994 2.3E3 56.6969 2.5E3 58.3817 2.4E3 60.0554 3.2E4 61.4624 2.3E3 64.6683 2.4E3 65.1380 2.7E3 69.0335 1.0E4 69.2378 2.5E3 70.0650 7.7E5 70.0689 3.0E3 70.0714 3.7E3 70.7498 2.5E3 71.0492 1.6E4 75.7881 2.9E3 82.0650 1.7E4 82.5500 2.6E3 87.0440 1.7E4 87.0635 3.2E3 88.0756 2.2E4 91.0542 1.0E4 92.0768 2.7E3 97.0759 8.8E4 98.0599 6.3E5 98.0706 4.5E3 99.0677 2.8E3 100.0757 3.1E3 105.8544 3.0E3 112.0868 6.9E4 115.0867 7.2E3 116.0704 6.6E3 122.0963 6.5E4 125.0708 1.0E6 125.0796 5.2E3 125.9648 2.7E3 130.1480 2.8E3 137.0597 3.6E4 140.0815 1.2E4 149.1074 6.4E3 150.0911 1.3E4 153.0657 2.2E4 154.0734 2.8E4 156.4306 3.2E3 157.5716 2.7E3 164.1189 6.9E3 166.1340 1.7E5 166.9792 1.4E4 167.1179 1.9E6 173.5330 3.5E4 177.1027 1.3E4 178.9791 9.2E3 185.1036 3.1E4 192.1139 2.8E3 193.0971 2.3E4 194.1289 7.7E5 194.9738 2.8E4 195.0583 8.0E3 195.0704 7.5E4 195.0801 5.1E4 195.1128 1.1E7 195.1463 4.5E4 195.1548 7.3E4 195.1675 2.1E4 195.1782 1.1E4 196.9894 1.3E4 205.9894 6.9E3 206.0809 4.1E3 208.0974 2.8E3 208.9897 6.9E4 209.1198 2.8E3 209.1402 3.2E4 212.1394 3.4E4 212.9835 3.5E3 217.5218 2.6E3 220.1083 5.5E4 224.0009 2.5E4 226.0161 8.1E4 226.9999 1.7E4 237.1348 1.1E5 247.1410 2.7E3 254.1164 4.0E3 254.1612 5.2E5 END IONS BEGIN IONS FEATURE_ID=96 PEPMASS=241.1549 SCANS=96 RTINSECONDS=75.755 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 43.0177 6.3E3 43.5438 2.1E3 45.2480 2.3E3 47.0687 2.1E3 48.3308 2.4E3 49.2312 2.5E3 49.8285 2.5E3 50.1119 2.2E3 50.2211 2.2E3 53.9387 2.7E4 55.9342 5.3E3 56.2748 2.2E3 58.0648 2.0E5 58.8158 2.3E3 62.1238 2.2E3 62.4405 2.2E3 67.9544 5.4E3 69.9336 1.2E4 70.0648 2.2E4 70.9413 2.7E4 71.9492 3.5E3 72.8355 2.2E3 73.8687 2.4E3 76.4263 2.6E3 78.8010 2.6E3 78.9362 2.4E3 81.0332 2.6E3 81.0445 2.5E3 84.0803 8.8E4 85.9647 8.2E3 87.9441 1.4E4 88.9128 2.7E3 88.9519 4.1E4 89.9597 2.6E3 98.0959 1.2E4 100.1111 3.0E3 103.9393 8.7E3 105.9546 1.5E4 110.0710 2.7E3 116.9474 2.5E3 123.6785 2.4E3 123.9658 3.0E3 126.0911 2.5E3 126.9233 2.3E3 128.1066 6.7E4 128.8087 2.2E3 129.9547 2.0E4 130.9628 9.2E3 136.0744 2.6E3 143.9701 1.8E4 144.1019 1.8E4 145.0778 2.7E3 145.9868 6.6E3 147.9652 3.2E4 148.9747 2.7E3 149.0953 2.8E3 149.6871 1.6E4 149.7080 3.2E3 156.1729 2.6E3 161.0702 6.2E3 165.9767 3.0E3 166.9109 2.3E3 168.1008 6.7E3 171.9660 8.1E3 173.5296 1.7E4 173.5381 3.8E3 189.9762 1.1E4 194.9429 1.3E4 196.0965 9.3E4 197.9973 1.3E4 200.5061 2.2E3 203.4803 2.6E3 203.8833 6.8E3 205.4919 2.4E3 239.1345 2.3E3 241.1545 7.2E5 243.8376 2.7E3 END IONS BEGIN IONS FEATURE_ID=97 PEPMASS=210.0612 SCANS=97 RTINSECONDS=75.768 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 43.0177 2.5E4 44.5128 2.4E3 52.5352 2.5E3 55.1620 2.3E3 56.6300 2.2E3 57.9780 2.1E3 58.1545 2.3E3 58.7639 2.5E3 59.6194 2.6E3 66.0408 2.7E3 68.9968 2.3E4 79.1730 2.5E3 83.8544 2.2E3 84.1977 2.3E3 87.0072 4.3E3 91.0535 3.0E3 96.0670 2.2E3 103.3024 2.2E3 111.0072 2.7E4 115.6297 2.0E3 116.9660 6.0E3 117.9664 2.6E3 129.0179 7.5E4 137.0594 1.8E4 139.0023 5.5E4 139.0126 2.5E3 149.6714 6.5E3 149.6866 1.7E4 149.6932 4.5E3 157.0127 4.1E3 173.5247 3.0E3 173.5337 1.4E4 174.0549 2.9E3 184.6501 2.5E3 192.0656 2.3E4 END IONS BEGIN IONS FEATURE_ID=98 PEPMASS=393.9837 SCANS=98 RTINSECONDS=75.768 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 55.9342 4.7E4 62.3632 2.0E3 69.9499 1.4E4 71.9290 2.9E4 72.5520 2.2E3 72.9368 5.2E4 73.9446 2.0E4 74.3905 2.2E3 85.0281 1.1E4 85.3851 2.4E3 85.6291 3.1E3 87.9603 2.8E4 89.9395 4.9E4 90.9474 9.1E4 91.9554 1.5E4 101.9760 2.4E4 103.9550 2.6E3 105.9344 3.6E4 107.9501 6.1E4 108.9582 2.5E3 109.3602 2.9E3 115.9553 2.0E4 116.5575 2.5E3 116.9628 3.6E3 117.9345 9.8E3 118.9421 6.9E3 119.0487 1.8E4 121.0645 8.0E3 123.9454 2.6E3 125.9610 2.0E4 127.9549 7.2E3 129.9707 1.9E4 130.9789 1.0E4 131.9501 9.0E4 132.9580 6.4E4 133.9658 2.9E4 137.0481 3.6E3 137.0594 1.4E5 141.0005 6.3E3 142.0053 3.5E3 142.9959 1.2E4 143.9502 4.2E4 143.9865 7.3E4 145.9537 4.6E3 145.9658 2.9E5 145.9793 8.5E3 147.0314 2.5E3 147.0437 8.9E4 147.9813 9.9E4 149.6648 3.4E3 149.6855 6.4E3 149.6964 3.8E3 149.9607 1.7E5 150.9687 2.4E4 151.9763 1.8E4 155.9507 9.6E3 157.9662 1.3E4 159.9458 3.2E3 161.9609 7.8E4 161.9969 5.8E3 163.9765 4.0E4 165.9921 6.1E4 167.9715 1.3E4 170.0024 2.3E4 171.9468 3.6E3 173.5313 4.1E4 173.9610 1.3E5 175.9761 2.9E3 176.1505 2.4E3 179.0702 4.7E4 185.9971 3.6E3 187.9401 7.0E4 189.9560 6.6E3 191.9714 1.4E5 201.9559 1.4E5 205.9508 3.6E4 213.9926 1.8E4 219.9422 3.2E3 219.9666 2.1E5 223.9783 2.5E3 262.1714 2.8E3 320.6375 2.3E3 394.3459 9.9E3 END IONS BEGIN IONS FEATURE_ID=99 PEPMASS=236.0921 SCANS=99 RTINSECONDS=75.964 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 6 (0 removed due to low quality, 0 removed due to low cosine). 43.4275 2.1E3 43.9024 2.8E3 47.8070 2.3E3 48.0619 2.5E3 48.0945 2.1E3 48.3284 2.4E3 48.4554 2.3E3 50.9638 2.2E3 51.3509 2.2E3 54.5200 2.9E4 54.5216 4.9E3 55.0179 9.6E3 55.9342 2.5E3 60.1418 2.1E3 60.2839 2.6E3 61.7243 2.1E3 62.2495 2.7E3 66.1159 2.6E3 66.3361 2.0E3 69.0698 2.4E3 71.0492 2.3E3 73.0454 2.1E3 74.1914 2.1E3 75.8620 2.5E3 76.0731 2.5E3 76.5983 2.1E3 78.1114 2.2E3 83.3433 2.6E3 84.3505 2.4E3 86.0966 2.6E3 88.5016 2.6E3 89.0386 3.1E3 91.0542 1.2E4 91.7544 2.2E3 93.2829 2.2E3 96.2139 2.7E3 98.0598 3.3E3 99.8790 2.2E3 106.0647 1.0E4 106.8391 2.4E3 109.8932 2.1E3 115.0541 7.7E3 116.0495 2.6E4 117.0699 6.1E3 117.1149 2.4E3 119.0487 6.7E3 129.0696 2.0E4 131.0493 1.5E4 132.6688 2.3E3 134.0600 8.2E4 135.0441 6.0E4 137.0596 1.3E5 137.4177 2.8E3 141.2733 2.5E3 143.0493 6.6E3 144.0807 9.1E4 145.0648 2.9E4 146.0594 5.9E3 147.0439 2.8E4 149.0598 2.7E4 149.6818 5.4E3 149.6928 4.0E3 149.7034 3.2E3 151.9046 2.6E3 157.0652 7.4E3 161.0600 8.9E3 162.0550 7.7E5 162.0912 4.1E4 163.0628 9.6E4 164.0706 6.7E3 172.0758 1.2E5 173.0604 1.8E4 173.5282 5.1E4 173.5429 2.1E4 175.0620 1.7E4 175.0764 1.6E4 176.0712 1.5E4 177.0547 1.3E4 189.0775 5.5E3 190.0679 5.0E3 190.0864 1.1E6 194.9737 3.0E3 200.0705 5.6E4 201.0792 1.5E4 203.0582 9.7E3 216.0649 2.2E3 218.0038 8.2E3 218.0178 1.8E4 218.0316 7.1E4 218.0416 4.9E4 218.0812 1.2E7 218.1208 4.8E4 218.1312 7.0E4 218.1454 2.0E4 218.9935 7.7E3 219.0151 6.2E3 223.7893 2.8E3 236.0649 3.4E3 236.0918 1.5E6 236.1213 5.8E3 243.9864 2.5E3 END IONS BEGIN IONS FEATURE_ID=100 PEPMASS=267.0979 SCANS=100 RTINSECONDS=75.982 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 55.1962 2.1E3 64.8927 2.3E3 66.4617 2.4E3 67.0540 1.1E4 83.2674 2.2E3 94.0585 3.2E3 94.0649 6.6E4 100.0390 1.8E4 101.0232 2.7E3 103.1215 2.7E3 106.0648 2.6E4 122.0598 7.7E4 140.2413 2.5E3 149.6700 3.7E3 149.6824 9.5E3 149.6918 1.5E4 149.7028 6.5E3 150.0267 5.1E3 150.0548 1.3E6 162.0550 2.3E4 162.3920 2.5E3 168.0655 4.4E4 173.5317 1.7E4 178.6542 2.4E3 180.0652 2.9E3 192.3783 2.3E3 195.9773 2.6E3 208.0606 2.3E4 END IONS BEGIN IONS FEATURE_ID=101 PEPMASS=300.1447 SCANS=101 RTINSECONDS=76.071 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 2 (0 removed due to low quality, 0 removed due to low cosine). 50.8989 2.4E3 57.0333 1.3E5 65.0385 2.9E3 66.6101 2.2E3 71.0489 4.9E3 73.0280 8.1E4 75.0438 6.3E5 75.0487 4.4E3 75.0513 5.7E3 83.0490 9.0E3 83.6183 2.6E3 85.0281 5.4E4 86.5131 2.5E3 90.9479 6.8E3 91.0483 4.2E3 91.0539 1.3E5 98.4725 2.3E3 100.3406 2.2E3 104.7990 2.8E3 109.0646 1.5E4 111.0440 5.3E3 119.0405 3.3E3 119.0488 9.6E4 121.0648 8.7E3 124.9678 2.5E3 137.0594 1.9E6 137.0695 2.7E4 137.0837 1.6E4 144.9578 2.5E3 148.8250 2.5E3 153.7004 2.3E3 154.0860 3.2E4 156.2834 2.4E3 158.7841 2.5E3 167.2670 2.7E3 168.9579 2.4E3 173.5214 1.3E4 173.5397 2.9E4 180.8420 2.9E3 187.7868 2.4E3 193.0325 4.3E3 197.8891 2.7E3 200.0654 2.5E3 END IONS BEGIN IONS FEATURE_ID=102 PEPMASS=242.9828 SCANS=102 RTINSECONDS=76.225 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 5 (1 removed due to low quality, 0 removed due to low cosine). 44.4431 2.1E3 46.4163 2.2E3 48.7240 2.7E3 51.0463 2.1E3 51.4622 2.2E3 51.6609 2.4E3 52.9244 2.3E3 55.0177 2.8E4 55.4904 2.2E3 55.9342 8.2E5 55.9371 2.4E3 56.9420 4.1E4 57.7797 2.5E3 59.0736 2.1E3 59.5853 3.2E3 60.0931 2.2E3 62.4588 2.3E3 62.4817 2.5E3 66.9674 2.1E3 68.8185 2.3E3 69.9497 2.8E5 70.9577 1.1E4 71.9290 3.8E5 71.9336 2.4E3 72.9369 8.7E5 72.9411 3.3E3 73.2138 2.4E3 73.9404 3.2E3 73.9447 1.8E5 74.9526 1.9E4 76.7853 2.5E3 78.3255 2.5E3 81.9500 5.0E3 81.9762 2.4E3 83.9655 4.4E4 85.9448 2.0E4 87.9603 4.2E5 87.9668 5.6E3 88.9685 2.6E3 89.9396 4.6E5 89.9455 2.8E3 90.9475 1.1E6 90.9533 3.7E3 90.9545 5.1E3 91.9443 2.4E3 91.9552 1.2E5 95.0318 2.6E3 99.9604 4.2E4 100.1219 2.2E3 100.9315 3.0E3 101.9759 1.2E5 102.9474 2.2E4 102.9552 2.2E3 103.9553 5.0E4 105.9343 2.5E5 105.9709 2.4E4 107.9501 4.6E5 107.9583 7.4E3 108.9579 7.5E4 111.9603 1.1E5 113.9397 7.2E3 113.9635 7.8E3 114.8711 2.4E3 114.9479 1.0E4 115.9552 1.0E5 116.9636 3.0E4 117.9344 6.1E4 117.9709 4.5E4 118.9425 4.4E4 121.9660 2.6E3 123.9451 7.5E4 125.9607 1.5E5 128.9505 2.7E4 129.0178 1.6E4 129.9710 8.8E4 130.9811 1.5E4 131.9502 6.1E5 131.9604 2.8E3 132.1223 2.7E3 132.9580 3.5E5 133.9549 3.3E3 133.9659 1.5E5 135.9451 2.3E4 136.9530 7.5E3 141.7192 2.4E3 143.9502 1.7E4 145.9520 3.5E3 145.9658 5.4E5 145.9808 9.9E3 147.9679 3.2E3 147.9814 2.5E5 147.9943 2.4E3 149.6856 5.1E3 149.6957 3.4E3 149.9467 5.2E3 149.9608 1.1E6 149.9708 2.5E3 149.9748 4.9E3 150.9686 1.3E5 151.9764 8.7E4 154.4850 2.1E3 155.9501 5.4E4 156.1101 3.0E3 157.9661 1.3E4 160.8403 2.7E3 161.9605 3.3E4 163.9765 7.0E4 165.9921 1.8E5 167.9715 1.2E5 173.5331 4.2E4 173.9437 5.1E3 173.9609 3.1E5 173.9754 2.1E3 178.6438 2.5E3 178.9217 1.4E4 180.8870 2.4E3 187.9406 1.8E4 191.9714 3.8E5 191.9911 4.9E3 196.9326 2.9E4 197.8915 1.2E4 201.9560 3.7E4 202.0077 2.4E3 205.9520 3.1E3 209.9817 5.6E3 212.2846 2.7E3 218.0975 2.3E3 219.9664 5.7E4 230.4050 2.3E3 237.3806 2.5E3 243.1599 4.7E3 250.9589 2.6E3 END IONS BEGIN IONS FEATURE_ID=103 PEPMASS=322.0776 SCANS=103 RTINSECONDS=76.356 CHARGE=1+ MSLEVEL=2 MERGED_STATS=7 / 7 (0 removed due to low quality, 0 removed due to low cosine). 49.4322 2.1E3 50.3921 2.3E3 52.6012 2.2E3 53.4733 2.5E3 54.5212 2.7E3 55.3666 2.7E3 55.8387 2.1E3 56.0492 1.2E5 57.0452 2.6E3 61.4665 2.3E3 62.0910 2.5E3 62.8946 2.2E3 63.2738 2.2E3 64.2634 2.3E3 65.7157 2.2E3 70.8952 2.2E3 72.0806 1.2E4 72.7155 2.2E3 73.0440 2.2E3 77.9611 2.8E3 78.6619 2.3E3 78.9927 2.0E3 79.1694 2.3E3 79.4507 2.6E3 80.9179 2.3E3 83.5200 2.2E3 84.0441 7.6E5 85.0280 1.3E5 87.7521 2.6E3 88.3165 2.5E3 93.3249 2.8E3 96.0350 2.5E3 97.6726 2.3E3 98.3347 2.2E3 101.0227 2.6E3 102.0546 2.2E5 106.0720 2.5E3 111.0073 7.5E3 115.8113 2.0E3 128.0339 4.8E4 129.0180 8.8E4 130.0496 3.3E5 136.4759 2.3E3 136.9599 2.9E3 138.0183 8.1E4 139.0023 1.9E4 145.0285 7.5E3 148.0601 7.0E3 149.6924 2.8E3 150.0546 3.0E3 152.0340 6.7E4 152.0747 2.7E3 156.0288 8.6E4 158.8372 2.2E3 161.5686 2.3E3 166.0497 2.2E5 170.5309 2.8E3 170.9204 2.8E3 173.5202 4.9E3 173.5288 5.8E4 173.5389 3.9E4 174.0396 1.1E5 174.6813 2.5E3 175.0268 5.5E3 176.0344 1.0E5 177.0547 3.9E4 180.0292 4.2E4 183.2516 2.5E3 183.4448 2.4E3 184.0603 6.8E4 193.6653 2.5E3 194.0147 3.2E3 194.0243 1.0E4 194.0448 6.9E5 194.0604 2.3E3 194.0663 2.3E3 196.6492 2.4E3 198.0394 2.8E3 204.0289 3.1E3 212.0554 5.5E5 212.0727 2.3E3 216.9955 2.5E3 222.0400 7.1E4 234.1117 1.1E4 240.0506 4.4E4 258.0596 3.0E3 266.7544 2.6E3 271.9769 2.7E3 272.0714 3.0E3 END IONS BEGIN IONS FEATURE_ID=104 PEPMASS=335.9418 SCANS=104 RTINSECONDS=76.463 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 5 (0 removed due to low quality, 0 removed due to low cosine). 50.7611 2.5E3 51.5173 2.1E3 51.7829 2.4E3 53.9778 2.4E3 55.9341 1.2E5 56.0706 2.4E3 58.2478 2.4E3 59.9827 3.2E3 65.2891 2.4E3 69.9497 2.7E4 71.5915 2.6E3 71.9290 5.9E4 72.8747 2.2E3 72.9368 1.5E5 73.9447 4.7E4 74.9125 2.4E3 79.4275 2.5E3 81.1788 2.2E3 81.9497 2.2E3 84.1278 2.5E3 85.4755 2.5E3 87.5721 2.8E3 87.9601 5.2E4 89.9395 1.1E5 90.9412 2.5E3 90.9473 2.0E5 91.9552 3.3E4 99.9602 1.6E4 101.9760 2.9E4 103.9554 8.4E3 105.9344 6.8E4 107.9501 1.4E5 108.1287 2.4E3 108.9582 6.3E3 110.6313 2.2E3 111.9603 5.8E4 114.3733 2.5E3 115.6618 2.3E3 115.9552 2.6E4 116.9637 3.8E3 117.9344 1.7E4 118.9421 3.7E3 123.9446 2.3E4 125.9607 6.1E4 129.9708 7.4E4 131.9502 6.0E4 132.9578 3.5E4 133.9658 5.3E4 137.0592 3.5E3 145.9657 5.7E4 147.9699 9.8E3 147.9814 2.4E5 147.9953 3.5E3 148.4460 2.7E3 149.6825 5.7E3 149.6931 4.1E3 149.9608 9.7E4 150.9687 9.2E3 151.9764 3.3E4 155.9503 2.8E4 157.9659 6.4E4 159.9447 6.4E3 161.9605 8.2E3 163.9763 2.9E3 164.7773 2.3E3 165.9922 1.8E5 167.9718 8.5E3 173.5348 6.0E4 173.9609 2.3E5 175.9775 5.3E3 177.9560 2.8E3 183.9456 2.9E4 185.9250 6.2E3 188.5371 2.7E3 191.9714 6.2E5 199.9401 4.3E4 201.9558 3.1E4 203.9352 1.7E5 205.8995 4.1E3 210.8537 2.9E3 213.0181 2.8E3 217.9510 2.5E5 219.9663 2.9E4 221.9450 4.0E3 222.9927 6.1E3 227.9354 5.8E4 235.9618 3.9E4 245.9458 1.4E5 251.8321 2.5E3 259.9705 2.4E3 261.1246 2.3E3 263.9556 1.0E4 285.9280 2.3E3 END IONS BEGIN IONS FEATURE_ID=105 PEPMASS=254.1615 SCANS=105 RTINSECONDS=96.382 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 7 (2 removed due to low quality, 0 removed due to low cosine). 44.6134 2.2E3 45.8878 2.1E3 45.8969 2.6E3 46.3508 2.3E3 47.0146 2.3E3 48.6111 2.1E3 48.7777 2.9E4 48.7793 5.4E3 49.5702 2.2E3 49.6558 2.2E3 51.3546 2.7E3 53.8371 2.6E3 54.4726 2.3E3 55.0191 2.9E3 55.5660 2.2E3 57.7130 2.5E3 60.0555 2.3E4 61.2521 2.2E3 67.0777 2.3E3 68.0495 2.8E3 70.0650 5.9E5 70.0687 2.6E3 71.0489 8.9E3 74.3700 2.1E3 80.3625 2.6E3 80.4100 2.4E3 82.0651 1.3E4 88.0754 1.4E4 89.7237 2.4E3 97.0760 5.8E4 98.0599 4.9E5 98.0674 5.8E3 100.0755 4.3E3 100.4560 2.1E3 103.9294 2.5E3 107.0946 2.1E3 112.0868 5.2E4 120.5247 2.5E3 122.0964 4.8E4 124.2998 2.4E3 125.0708 8.0E5 125.0796 2.6E3 140.0818 3.6E3 143.0823 6.0E3 149.1071 3.8E3 150.0910 8.1E3 153.0656 2.1E4 154.0738 1.7E4 164.1185 6.3E3 166.1338 1.2E5 167.1178 1.6E6 173.5208 4.8E3 173.5300 4.7E4 173.5392 8.9E3 177.1028 1.4E4 185.1034 1.6E4 191.0468 2.8E3 193.0973 1.8E4 194.1288 6.4E5 194.1452 2.4E3 195.0704 5.0E4 195.0804 2.6E4 195.1128 9.1E6 195.1548 6.2E4 195.1661 6.2E3 195.1781 4.3E3 204.8599 2.7E3 209.1402 1.8E4 212.1396 2.0E4 214.3137 2.4E3 220.1080 4.5E4 225.8973 2.6E3 237.1347 9.7E4 252.7655 2.6E3 254.1612 4.4E5 254.2077 2.7E3 END IONS BEGIN IONS FEATURE_ID=106 PEPMASS=236.0922 SCANS=106 RTINSECONDS=99.378 CHARGE=1+ MSLEVEL=2 MERGED_STATS=17 / 19 (2 removed due to low quality, 0 removed due to low cosine). 44.4686 2.7E3 45.8229 2.5E3 46.2312 2.3E3 46.2538 2.3E3 46.7292 2.4E3 47.5159 2.2E3 48.4268 2.2E3 48.6533 2.2E3 49.1258 2.5E3 49.2641 2.3E3 49.5505 2.5E3 50.0547 2.2E3 50.1755 2.2E3 50.3392 2.2E3 50.5563 2.4E3 50.6834 2.2E3 51.2559 2.2E3 51.4990 2.1E3 51.5666 2.4E3 51.5863 2.3E3 51.9651 2.3E3 52.1052 2.3E3 52.9581 2.6E3 54.2603 2.5E3 54.7672 2.5E3 55.9342 1.2E4 56.6135 2.0E3 57.2419 2.3E3 58.1489 2.3E3 62.8777 2.2E3 63.0197 2.3E3 64.4555 2.5E3 64.9477 2.2E3 65.0620 2.7E3 65.5454 2.6E3 65.6232 2.1E3 66.2954 2.1E3 67.1146 2.3E3 70.0433 2.1E3 70.4476 2.2E3 70.8106 2.6E3 70.9619 2.3E3 71.0864 2.6E3 71.3718 2.3E3 71.5819 2.6E3 72.7842 2.6E3 73.1312 2.6E3 74.9437 2.5E3 75.0338 2.2E3 76.2535 2.4E3 77.4503 2.2E3 78.0990 2.7E3 78.2361 2.5E3 79.0467 2.8E3 80.1444 2.4E3 81.3244 2.5E3 82.3071 2.5E3 84.2717 2.6E3 86.3787 2.2E3 86.6861 2.0E3 89.0099 2.5E3 91.1087 2.1E3 93.8861 2.4E3 95.1676 2.2E3 96.0596 2.4E3 96.4917 2.3E3 98.5591 2.6E3 99.6687 2.9E3 103.6728 2.3E3 104.2693 2.4E3 105.8849 2.5E3 106.0643 3.3E3 106.8476 2.3E3 107.3581 2.4E3 108.3716 2.5E3 109.8878 2.6E3 112.6172 2.3E3 116.1279 2.9E3 118.7166 2.4E3 120.6768 2.1E3 125.2968 2.4E3 127.6820 2.3E3 127.8999 2.3E3 128.1659 2.4E3 132.7713 2.5E3 134.0597 1.8E4 135.0436 5.3E3 137.0594 3.0E4 140.3918 2.3E3 141.5704 2.3E3 142.4760 2.7E3 142.9509 2.5E3 143.9078 2.5E3 144.0809 1.7E4 145.0643 2.6E3 147.0443 3.3E3 147.9089 2.3E3 148.5612 2.7E3 148.9478 2.4E3 149.0593 3.0E3 151.9261 2.3E3 152.8678 2.7E3 153.9522 2.1E3 154.9212 2.5E3 156.2955 2.5E3 157.3939 2.3E3 159.8256 2.8E3 162.0548 2.7E5 162.0909 2.9E3 162.5342 2.3E3 163.0624 1.2E4 169.2432 2.6E3 171.6146 2.6E3 172.0756 2.9E4 173.5253 1.1E5 173.5398 8.1E4 174.9569 2.6E3 178.1599 2.6E3 182.7554 2.7E3 184.9414 1.9E4 185.4211 2.6E3 185.7648 2.5E3 187.8861 2.5E3 190.0862 3.7E5 190.1059 3.7E3 194.4625 2.2E3 194.9437 2.2E4 196.7000 2.3E3 198.7287 2.5E3 200.0696 4.9E3 202.9521 1.8E4 204.1858 2.2E3 213.8390 2.3E3 217.9600 1.3E4 218.0568 3.6E4 218.0814 3.8E6 218.1064 1.9E4 219.0134 2.1E4 219.8723 2.7E3 228.7002 2.5E3 236.0648 4.4E3 236.0919 5.3E5 236.1174 4.5E3 END IONS BEGIN IONS FEATURE_ID=107 PEPMASS=321.0852 SCANS=107 RTINSECONDS=99.932 CHARGE=1+ MSLEVEL=2 MERGED_STATS=9 / 12 (3 removed due to low quality, 0 removed due to low cosine). 49.0644 2.5E3 49.9864 2.3E3 51.2895 2.4E3 52.5062 2.3E3 53.3951 2.4E3 55.9033 2.2E3 60.5483 2.6E3 60.6307 2.4E3 61.0915 2.5E3 61.7466 2.2E3 62.9141 2.6E3 64.1945 2.6E3 64.4949 2.3E3 64.8327 2.3E3 66.1259 2.3E3 66.6945 2.2E3 67.1070 2.0E3 70.8383 2.3E3 72.6841 2.3E3 72.8408 2.0E3 82.5688 2.5E3 93.7182 2.5E3 95.6617 2.3E3 97.4101 2.1E3 98.9638 2.6E3 104.7906 2.5E3 105.3221 2.1E3 107.4070 2.4E3 107.8674 2.5E3 108.7716 2.8E3 110.6615 2.4E3 115.7491 2.6E3 116.9825 2.5E3 126.1059 2.3E3 131.0490 5.8E3 133.5513 2.4E3 135.0435 3.0E3 140.9063 2.9E3 146.6924 2.3E3 147.6235 2.3E3 148.3833 2.4E3 149.0598 3.0E4 150.3327 2.3E3 161.0596 2.2E4 164.6600 2.5E3 165.4880 2.1E3 168.1406 3.0E3 172.0022 1.0E4 172.0195 6.2E3 172.0368 5.8E6 172.0542 1.2E4 172.0645 7.4E3 172.0716 3.3E4 173.0582 2.7E3 173.5246 3.8E4 173.5394 7.0E4 173.6947 2.4E3 173.9748 2.0E3 175.2106 2.3E3 194.0474 2.5E3 195.0466 2.4E3 196.0092 2.8E3 198.3139 2.4E3 198.4237 2.6E3 203.2641 2.7E3 212.0553 4.8E3 212.8361 2.3E3 218.5860 2.4E3 279.7158 2.7E3 284.5151 2.2E3 316.1362 2.7E3 320.2665 2.8E3 329.5608 2.7E3 END IONS BEGIN IONS FEATURE_ID=108 PEPMASS=462.2130 SCANS=108 RTINSECONDS=100.224 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 3 (1 removed due to low quality, 0 removed due to low cosine). 58.0648 2.7E5 58.0683 3.8E3 80.8918 2.7E3 83.4750 2.2E3 85.0278 3.1E3 91.8101 2.2E3 100.2082 2.6E3 107.0487 2.1E4 121.0642 7.2E3 123.0438 5.0E3 131.0469 2.3E3 137.0589 6.5E3 145.0627 2.6E3 147.0796 3.1E3 148.8835 2.2E3 161.0591 1.2E4 173.5343 3.1E4 177.7283 2.7E3 224.7393 2.6E3 234.9684 6.6E3 243.0571 2.5E3 251.9705 3.1E3 255.1010 7.1E4 257.1167 2.3E4 275.9705 8.7E3 300.1593 1.3E5 452.7038 2.6E3 462.2120 2.3E5 466.1926 2.6E3 END IONS BEGIN IONS FEATURE_ID=109 PEPMASS=284.1498 SCANS=109 RTINSECONDS=102.67 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 47.9821 2.3E3 50.1538 2.3E3 54.5484 2.2E3 55.3030 2.4E3 55.6070 2.2E3 57.0332 3.6E4 57.3363 2.8E3 63.3368 2.6E3 64.3273 2.2E3 73.0281 1.9E4 73.0547 2.1E3 75.0437 1.6E5 80.5652 2.2E3 85.0282 5.9E3 85.2184 2.5E3 91.0539 2.5E4 93.0695 5.9E4 95.0489 1.7E4 103.0538 2.8E4 107.4551 2.5E3 121.0644 1.5E6 121.0733 3.2E4 151.4367 2.2E3 173.5285 2.5E4 173.5373 1.3E4 198.6369 3.0E3 200.5549 2.3E3 231.1898 3.3E3 284.2950 1.5E4 END IONS BEGIN IONS FEATURE_ID=110 PEPMASS=300.1449 SCANS=110 RTINSECONDS=107.129 CHARGE=1+ MSLEVEL=2 MERGED_STATS=7 / 7 (0 removed due to low quality, 0 removed due to low cosine). 47.5700 2.3E3 47.8905 2.4E3 51.1296 2.5E3 52.8392 2.6E3 54.1116 2.3E3 57.0332 2.1E5 57.1592 2.4E3 58.3910 2.1E3 64.8114 2.2E3 66.3690 2.2E3 67.1147 2.2E3 67.2187 2.2E3 69.9804 2.7E3 72.0806 3.2E3 73.0281 1.3E5 74.8762 2.4E3 75.0438 1.0E6 75.0486 3.3E3 79.1534 2.5E3 83.0490 5.6E3 85.0281 7.1E4 85.1082 2.4E3 87.1500 2.4E3 91.0483 3.0E3 91.0539 2.1E5 92.5038 2.9E3 92.5836 2.2E3 98.0599 7.3E3 98.4377 2.2E3 106.4505 2.5E3 109.0644 2.1E4 111.0442 5.4E3 117.1105 2.5E3 119.0488 1.6E5 121.8851 2.2E3 127.6615 2.4E3 129.2100 2.2E3 131.0488 2.5E3 135.0438 2.5E4 136.1827 3.0E3 137.0594 3.1E6 137.0696 4.1E4 138.0629 3.0E3 143.8880 2.5E3 145.3701 2.6E3 148.2090 2.7E3 151.4252 2.2E3 152.7405 2.6E3 154.0860 5.1E4 154.7116 2.5E3 158.2307 2.4E3 173.5283 7.5E4 173.5405 2.5E4 173.9238 2.5E3 174.8284 2.5E3 181.4727 2.5E3 182.4376 2.8E3 196.9346 2.6E3 197.8903 2.2E4 201.7589 2.6E3 204.8919 2.4E3 206.7183 2.4E3 208.8863 3.1E3 226.8992 2.5E3 242.1752 2.4E3 248.8819 3.1E3 263.6756 2.8E3 298.4416 2.3E3 304.4622 2.5E3 END IONS BEGIN IONS FEATURE_ID=111 PEPMASS=476.2286 SCANS=111 RTINSECONDS=147.776 CHARGE=1+ MSLEVEL=2 MERGED_STATS=14 / 14 (0 removed due to low quality, 0 removed due to low cosine). 57.0611 2.2E3 57.1469 2.4E3 58.0650 1.9E6 58.0682 6.1E3 60.0632 2.0E3 62.1288 2.4E3 62.2391 2.4E3 63.7863 2.8E3 65.1219 2.6E3 65.2901 2.5E3 66.1994 2.4E3 66.3614 2.4E3 67.2298 2.6E3 69.0334 9.4E3 70.2423 2.1E3 70.9510 2.0E3 71.4147 2.2E3 73.7031 2.3E3 75.6312 2.1E3 79.6327 2.2E3 80.3783 2.4E3 81.3204 2.2E3 82.1988 2.1E3 84.5571 2.1E3 84.8006 2.2E3 85.0282 3.1E4 87.6228 2.1E3 87.8283 2.5E3 89.8753 2.2E3 91.1024 2.4E3 91.5647 2.7E3 91.6498 2.1E3 93.2016 2.1E3 94.3710 2.6E3 95.6208 2.4E3 96.6212 2.1E3 98.1822 2.1E3 98.2809 2.5E3 102.6806 2.3E3 104.7349 2.5E3 105.3834 2.6E3 105.7384 2.3E3 106.0568 2.4E3 106.8082 2.6E3 107.0488 2.1E5 107.3943 2.8E3 109.0737 2.5E3 109.6560 2.5E3 121.0645 7.3E4 123.4296 2.4E3 125.6312 2.7E3 125.9122 2.4E3 127.0384 2.5E3 128.2295 2.2E3 128.3814 2.1E3 134.7520 2.5E3 137.0597 3.7E4 142.3803 2.3E3 145.0648 4.4E4 147.0800 2.1E4 151.0750 2.6E4 153.7722 2.3E3 157.5156 2.3E3 159.2332 2.3E3 162.0883 2.4E3 173.5228 1.1E4 173.5329 2.2E5 173.5426 9.9E3 175.0751 9.1E4 177.0913 1.4E4 182.7444 2.6E3 183.0342 2.2E3 190.2927 2.3E3 194.8149 2.3E3 198.3690 2.9E3 199.3685 2.4E3 199.6036 2.3E3 207.4219 2.3E3 209.0956 5.3E3 211.0736 2.7E3 212.5123 2.5E3 214.2957 2.3E3 232.0537 2.5E3 234.2265 2.4E3 237.0908 7.1E4 239.1067 1.9E4 248.3815 2.7E3 249.2491 2.4E3 266.9042 2.3E3 269.0850 5.2E3 269.1170 7.6E5 269.9685 2.8E3 270.1053 2.7E3 270.5510 2.7E3 271.1329 1.5E5 282.7407 2.4E3 301.9409 2.9E3 303.4472 2.3E3 311.8617 2.3E3 314.1333 7.6E3 314.1751 7.7E5 320.7054 2.4E3 327.7605 2.6E3 328.1054 2.5E3 336.3939 2.7E3 350.1326 2.3E3 353.5902 2.4E3 358.1818 2.5E3 369.7838 2.4E3 379.5793 2.3E3 382.4526 2.3E3 388.0038 2.4E3 393.7761 2.3E3 405.7729 2.6E3 425.1706 3.3E3 456.6952 2.4E3 469.6065 2.4E3 476.2276 1.4E6 476.3406 3.2E3 484.7595 2.8E3 END IONS BEGIN IONS FEATURE_ID=112 PEPMASS=514.1385 SCANS=112 RTINSECONDS=154.789 CHARGE=1+ MSLEVEL=2 MERGED_STATS=10 / 10 (0 removed due to low quality, 0 removed due to low cosine). 59.4041 2.5E3 63.9756 2.4E3 64.1328 2.2E3 65.7265 2.2E3 66.3855 2.3E3 68.6680 2.2E3 68.8571 2.3E3 69.0332 7.8E3 70.8251 2.5E3 72.3793 2.8E3 75.8677 2.4E3 78.9846 3.0E3 80.3275 2.3E3 83.4437 2.5E3 84.1407 2.5E3 84.2268 2.6E3 84.6291 2.3E3 85.0282 6.3E4 86.3059 2.5E3 86.3514 2.5E3 87.0436 6.1E3 88.6844 2.4E3 90.7024 2.4E3 90.7172 2.7E3 90.9195 2.2E3 92.5160 2.4E3 93.1064 2.4E3 94.3591 2.7E3 97.0281 1.4E4 98.5343 2.2E3 98.6813 2.2E3 102.6397 2.5E3 104.1835 2.6E3 106.7225 2.5E3 107.0489 3.1E5 107.0574 2.6E3 107.3665 2.2E3 108.3515 2.6E3 109.5305 2.2E3 114.7291 2.2E3 116.2461 2.3E3 118.2193 2.6E3 120.2727 2.4E3 120.8011 2.3E3 123.0439 6.0E4 127.0385 1.7E4 128.4145 2.5E3 135.5871 2.3E3 137.2753 2.2E3 141.1191 2.6E3 143.0490 1.7E4 145.0499 3.5E3 145.0645 4.3E4 147.0443 2.9E3 149.0586 2.7E3 150.2321 2.4E3 161.0594 1.6E5 164.0705 7.7E4 170.7755 2.8E3 170.8949 2.8E3 173.5265 1.2E5 173.5402 6.8E4 175.1635 2.3E3 180.9707 2.2E3 183.8235 2.4E3 185.0636 2.3E3 190.0253 2.3E3 190.4391 2.5E3 204.8162 2.5E3 205.9256 2.2E3 208.1477 2.6E3 209.0962 2.9E3 220.7204 2.9E3 231.2102 2.7E3 237.0909 9.4E3 242.4989 2.7E3 242.5405 2.4E3 246.7422 2.3E3 247.0078 2.2E3 250.4190 2.2E3 255.0699 1.0E4 255.0786 4.3E3 255.1013 1.1E6 255.1320 1.4E4 256.5428 3.1E3 268.9097 2.5E3 270.8559 2.4E3 272.1281 1.2E6 275.1496 2.5E3 280.5091 2.5E3 293.0682 2.3E3 298.1156 2.4E3 299.3896 2.4E3 302.6125 2.6E3 307.4678 2.4E3 320.7115 2.4E3 340.2664 2.6E3 353.1187 2.4E3 354.1335 2.3E3 377.6311 2.6E3 385.7667 2.5E3 408.1603 2.8E3 417.1604 2.9E3 430.7695 2.3E3 431.5673 2.3E3 434.1115 4.6E3 434.1807 1.7E6 434.2510 4.1E3 454.7706 2.4E3 466.8594 2.8E3 470.5595 2.5E3 483.2468 2.9E3 513.9010 2.4E3 END IONS BEGIN IONS FEATURE_ID=113 PEPMASS=379.0642 SCANS=113 RTINSECONDS=155.638 CHARGE=1+ MSLEVEL=2 MERGED_STATS=8 / 8 (0 removed due to low quality, 0 removed due to low cosine). 52.8068 2.2E3 54.0381 2.1E3 54.5907 2.1E3 55.4361 2.3E3 55.5977 2.2E3 58.4361 2.3E3 60.3292 2.3E3 61.1467 2.7E3 61.2807 2.6E3 62.3638 2.3E3 66.3836 2.3E3 68.0780 2.3E3 68.7474 2.2E3 68.9245 2.6E3 71.2128 2.3E3 73.7011 2.2E3 74.5390 2.2E3 75.3483 2.2E3 75.6097 2.3E3 82.7795 2.3E3 87.2338 2.3E3 89.0616 2.7E3 90.7077 2.6E3 91.0539 3.1E3 92.0495 2.6E3 93.2767 2.5E3 98.8562 2.5E3 98.9206 2.2E3 100.2854 2.3E3 101.0304 2.3E3 101.9649 2.4E3 103.3486 2.3E3 103.8037 2.4E3 104.4729 2.4E3 105.2743 2.4E3 110.6540 2.6E3 113.2696 2.5E3 119.0488 6.0E4 127.1200 2.2E3 147.0437 8.1E5 147.0549 2.3E3 158.0568 2.6E3 164.4783 2.3E3 165.9894 2.6E3 169.0258 1.7E5 172.7929 2.8E3 173.5326 1.4E5 173.5447 5.6E3 176.0829 2.3E3 188.3801 2.7E3 190.7406 2.7E3 196.3984 2.3E3 201.6423 2.4E3 201.9554 2.3E3 212.3073 2.5E3 215.0146 7.2E3 233.0267 5.8E5 233.0516 4.5E3 240.7657 2.3E3 243.9960 2.9E3 265.6335 2.6E3 269.4393 2.5E3 277.6136 2.3E3 280.9063 2.6E3 287.3417 3.2E3 294.0080 2.4E3 328.1130 2.4E3 372.0388 2.6E3 385.3260 2.8E3 END IONS BEGIN IONS FEATURE_ID=114 PEPMASS=455.9992 SCANS=114 RTINSECONDS=155.702 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 6 (0 removed due to low quality, 0 removed due to low cosine). 59.2929 2.5E3 61.7288 2.3E3 65.5049 2.5E3 66.6363 2.2E3 66.9306 2.0E3 71.2395 2.4E3 73.6842 2.3E3 74.0951 2.4E3 82.8514 2.1E3 84.0031 2.2E3 91.0539 6.0E4 95.0737 2.6E3 97.2366 2.5E3 98.1085 2.5E3 99.4948 2.5E3 99.7540 2.8E3 101.2168 2.2E3 102.3462 2.6E3 107.3143 2.4E3 111.5436 2.2E3 113.6893 3.2E3 114.2993 2.6E3 119.0488 1.8E5 131.9496 2.9E3 144.9578 1.2E4 145.7516 2.5E3 147.0437 1.9E6 147.0549 2.6E4 152.9509 2.7E3 157.9656 4.5E4 158.1081 2.8E3 163.7219 2.1E3 167.9060 2.7E3 173.5203 5.0E3 173.5336 1.1E5 173.5449 3.7E3 173.8401 2.6E3 173.9624 2.6E3 175.8048 2.1E3 181.7727 2.7E3 188.9397 2.4E3 191.9865 2.5E4 201.9725 3.3E3 211.6345 2.8E3 217.9659 2.0E4 218.9741 5.7E4 219.9816 7.9E4 233.9609 2.7E4 234.9682 6.8E3 235.9766 3.6E4 241.2513 2.4E3 245.9970 4.2E4 253.9865 3.4E3 259.9770 8.1E4 271.6462 2.5E3 272.9844 3.3E4 275.9722 5.8E4 277.9881 2.6E3 285.9925 4.8E4 309.8249 2.5E3 317.9177 2.5E3 389.2852 2.7E3 401.6758 2.7E3 426.2650 2.6E3 END IONS BEGIN IONS FEATURE_ID=115 PEPMASS=220.1184 SCANS=115 RTINSECONDS=156.598 CHARGE=1+ MSLEVEL=2 MERGED_STATS=15 / 15 (0 removed due to low quality, 0 removed due to low cosine). 42.6139 2.2E3 42.7965 2.5E3 43.0177 4.5E5 43.0261 2.4E3 43.0687 2.2E3 45.0333 1.3E5 45.5663 2.1E3 46.2977 2.2E3 46.7814 2.4E3 48.3415 2.5E3 49.1896 2.2E3 50.8689 2.4E3 51.4459 2.3E3 52.2773 2.4E3 52.3577 2.4E3 52.7825 2.3E3 53.1982 2.2E3 54.3848 2.8E3 54.4416 2.3E3 55.0177 4.1E4 55.0540 2.5E4 55.3762 2.0E3 55.7403 2.5E3 55.9342 2.2E4 56.0130 3.2E3 56.0782 2.4E3 56.1428 2.4E3 56.4542 2.3E3 56.5513 2.9E3 57.0696 3.5E5 57.6857 2.5E3 58.1396 2.7E3 58.2801 2.6E3 58.4781 2.1E3 59.0489 2.4E5 60.2851 2.4E3 61.0283 2.6E3 61.9385 2.9E3 62.0960 2.3E3 65.2799 2.1E3 65.8072 2.5E3 66.0051 2.6E3 66.3929 2.0E3 66.6575 2.2E3 67.0539 2.6E5 68.0800 2.4E3 69.0696 1.7E5 69.3282 2.6E3 70.0284 3.3E5 71.6823 2.4E3 72.0041 3.0E3 72.0440 3.7E5 72.9369 3.2E3 73.0281 1.5E5 74.0234 5.5E4 75.6128 2.4E3 76.0309 2.2E3 79.0538 2.5E3 79.6710 2.4E3 79.9346 2.5E3 80.7651 2.2E3 81.0691 2.3E3 83.0488 4.0E4 84.3369 2.4E3 85.0645 3.9E5 86.0961 5.8E4 87.0801 1.1E4 89.3533 2.5E3 90.0546 1.9E6 91.2067 2.2E3 91.4662 2.1E3 91.9832 2.5E3 92.2462 2.4E3 92.9905 2.3E3 94.5696 2.3E3 95.0488 2.4E5 95.7613 2.3E3 96.0804 7.3E4 96.3525 2.2E3 97.6722 2.7E3 98.0233 4.6E5 98.0306 3.3E3 99.8830 2.4E3 100.0210 3.3E3 100.0390 3.4E4 100.1293 2.2E3 103.0751 1.1E5 108.8239 2.7E3 112.0745 4.7E3 112.5418 2.4E3 113.0593 6.0E4 113.4349 2.5E3 116.0339 2.6E5 122.3342 2.4E3 124.0659 1.2E4 124.0753 7.0E5 125.3129 2.5E3 126.2550 2.4E3 129.2084 2.4E3 130.0853 3.5E3 130.9326 2.3E3 131.0081 2.8E3 131.0704 8.6E3 133.8045 2.7E3 138.3274 2.5E3 138.9535 2.5E3 139.3533 2.6E3 142.0860 2.0E5 143.0831 2.3E3 144.5236 2.4E3 146.4959 2.4E3 152.7723 2.3E3 154.7325 2.2E3 160.0968 1.9E4 161.3271 2.3E3 166.0857 1.5E4 167.9486 2.5E3 170.1884 3.0E3 173.5254 6.3E4 173.5371 1.3E5 174.3849 2.6E3 176.9770 2.3E3 178.9283 2.6E3 179.2630 2.2E3 184.0968 1.1E5 189.0088 2.5E3 196.9042 4.0E4 196.9365 1.7E5 198.5285 2.6E3 202.1074 9.0E4 207.0372 2.3E3 END IONS BEGIN IONS FEATURE_ID=116 PEPMASS=318.1553 SCANS=116 RTINSECONDS=163.796 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 6 (0 removed due to low quality, 0 removed due to low cosine). 49.7607 2.5E3 50.3415 2.2E3 50.6190 2.5E3 52.1038 2.6E3 52.7783 2.4E3 53.0384 3.5E4 53.2283 2.4E3 53.3443 3.8E3 54.5538 2.4E3 54.9369 2.4E3 55.0176 5.5E4 57.0332 8.6E4 58.9700 2.4E3 60.9849 2.2E3 61.0281 2.1E5 67.8083 2.5E3 69.0331 2.9E5 69.4635 2.5E3 71.0488 5.4E4 72.0650 2.2E3 73.0280 7.0E4 78.8692 2.2E3 78.9656 2.2E3 81.0332 1.2E5 83.0123 6.3E3 85.0281 1.9E6 85.0352 1.0E4 87.0437 5.0E4 88.6712 2.3E3 90.7238 2.6E3 91.0386 9.5E4 91.0536 9.4E3 93.0697 2.1E4 97.0213 3.2E3 97.0280 4.7E5 98.0596 2.9E3 99.0437 9.7E4 102.5949 2.4E3 103.0382 6.1E3 103.0538 7.0E3 109.0280 1.5E5 110.5374 2.5E3 110.6428 2.5E3 115.0387 1.8E4 121.0645 9.4E5 121.0735 1.5E4 126.4669 2.2E3 127.0386 3.2E5 133.0632 2.4E3 137.3173 2.5E3 144.0651 3.3E3 145.0492 1.5E5 145.0631 2.8E4 151.0755 6.2E3 152.1154 2.5E3 157.0644 9.4E3 159.0802 5.4E4 162.0670 2.2E4 163.0384 2.5E3 163.0761 2.5E3 169.0639 6.5E3 171.0803 2.6E3 173.5241 7.9E3 173.5334 8.4E4 173.8421 2.4E3 174.0098 2.7E3 175.0372 2.4E3 175.0753 1.3E4 177.6588 2.6E3 178.0623 1.3E4 179.0706 2.9E3 183.0814 3.4E3 184.1635 2.5E3 187.0753 1.1E5 189.0561 2.4E3 190.0623 1.2E5 191.0342 2.6E4 191.0709 3.3E3 193.0859 8.5E4 205.0860 2.6E4 206.0572 3.8E4 215.4327 2.6E3 217.0862 2.9E3 221.0568 3.0E3 221.0809 2.7E5 228.5034 3.0E3 232.5453 2.4E3 249.4901 2.3E3 252.2563 2.8E3 293.3369 2.9E3 298.0812 2.5E3 314.7082 2.6E3 END IONS BEGIN IONS FEATURE_ID=117 PEPMASS=332.1347 SCANS=117 RTINSECONDS=171.315 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 5 (0 removed due to low quality, 0 removed due to low cosine). 53.0386 3.7E3 53.2987 2.6E3 55.0177 9.9E3 56.9611 2.6E3 57.0333 2.2E4 58.0650 3.6E3 61.0282 4.9E4 62.1347 2.6E3 67.5939 3.1E3 69.0332 6.8E4 71.0489 1.1E4 72.2208 2.3E3 73.0282 1.4E4 81.0332 2.7E4 85.0226 4.2E3 85.0280 4.6E5 85.0373 3.4E3 87.0437 1.3E4 87.1937 2.3E3 91.0386 2.2E4 96.8356 2.2E3 97.0280 1.2E5 99.0438 3.0E4 99.3575 2.4E3 100.8398 2.5E3 107.0487 1.4E5 109.0281 3.5E4 113.6302 2.2E3 127.0387 8.9E4 134.7345 3.1E3 142.9828 2.6E3 145.0493 4.0E4 153.0550 7.9E3 173.0602 6.3E3 173.5228 1.2E4 173.5362 5.5E4 187.5746 2.5E3 191.7807 2.3E3 204.8888 3.0E3 204.9828 7.4E3 205.9846 1.2E4 207.7166 2.4E3 208.8814 3.2E3 214.8735 2.8E3 218.8691 3.5E3 222.9921 3.4E3 226.8936 2.7E3 257.4684 2.6E3 285.8530 5.6E3 308.9003 2.3E4 END IONS BEGIN IONS FEATURE_ID=118 PEPMASS=289.9990 SCANS=118 RTINSECONDS=173.418 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 5 (0 removed due to low quality, 0 removed due to low cosine). 47.2764 2.3E3 51.2268 2.3E3 54.6686 4.3E3 55.5013 2.1E3 55.9342 1.6E4 56.4266 4.7E3 56.7709 2.4E3 65.4772 2.8E3 70.5472 2.3E3 73.3170 2.4E3 77.6606 2.4E3 79.9382 2.8E3 85.1678 2.6E3 85.5865 2.4E3 86.7885 2.5E3 107.8252 2.2E3 113.9735 3.1E3 117.0968 2.3E3 125.5887 2.4E3 137.3151 2.2E3 138.6090 2.3E3 138.9319 2.2E3 143.6419 2.1E3 147.5096 2.3E3 156.7626 2.4E3 164.9867 3.0E3 168.0778 3.1E3 173.5241 2.6E4 173.5412 3.0E4 176.9866 3.7E3 183.7310 2.7E3 197.5738 2.6E3 204.9819 1.0E5 214.5766 2.4E3 221.9848 3.9E4 222.9926 2.4E4 230.5450 2.5E3 232.0084 3.4E3 253.0202 2.4E3 254.1427 2.4E3 257.9881 2.4E3 END IONS BEGIN IONS FEATURE_ID=119 PEPMASS=388.0882 SCANS=119 RTINSECONDS=178.012 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 6 (0 removed due to low quality, 0 removed due to low cosine). 53.7739 2.3E3 55.0176 8.4E3 59.5773 2.3E3 61.9399 2.2E3 67.7890 2.5E3 69.0332 3.2E4 70.9946 2.8E3 73.0281 9.0E4 76.0108 2.9E3 77.0385 2.4E4 77.4187 2.5E3 79.0543 2.6E3 82.8957 2.5E3 83.0124 5.0E4 84.5270 2.5E3 85.0282 2.6E4 85.1164 2.5E3 85.4682 2.6E3 86.0959 2.4E3 92.1037 2.1E3 93.9881 2.3E3 95.0124 5.8E3 95.0488 2.6E4 95.9213 2.3E3 99.4660 2.3E3 101.0174 2.6E3 101.0230 1.7E5 104.7981 2.6E3 105.0332 1.0E5 106.8192 2.8E3 106.8376 2.7E3 107.0488 1.0E5 111.0074 6.3E4 111.0446 2.4E3 113.0231 2.1E4 115.5873 2.3E3 117.9883 2.6E3 119.0337 2.5E3 121.5265 2.7E3 123.0337 2.4E4 123.0438 8.7E5 123.0525 2.5E3 123.0540 9.4E3 129.0180 6.2E4 133.0166 3.0E3 133.0282 8.7E5 133.0397 1.2E4 133.1313 2.4E3 135.0440 5.0E4 135.6367 2.9E3 144.6921 2.5E3 147.0278 3.3E3 149.0612 3.3E3 150.0550 9.1E3 151.0388 1.5E5 153.0524 3.6E3 155.0336 3.1E3 157.0133 2.8E3 161.0232 2.9E5 163.0389 2.7E4 165.0547 3.4E3 173.0603 2.7E3 173.5289 6.7E4 173.5389 2.8E4 175.0391 3.0E3 179.0079 3.6E3 179.0340 1.1E6 183.2426 2.5E3 184.0031 2.3E3 187.0388 9.2E3 189.0545 2.7E4 199.0388 2.8E3 203.4542 2.8E3 205.0488 2.8E3 208.4712 2.5E3 215.0338 3.2E3 222.8016 2.3E3 233.0444 6.6E3 244.8303 2.4E3 270.7755 2.6E3 279.0511 2.8E3 280.3824 2.3E3 367.9058 2.4E3 375.7970 2.5E3 END IONS BEGIN IONS FEATURE_ID=120 PEPMASS=432.9889 SCANS=120 RTINSECONDS=178.204 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 57.6082 2.3E3 63.0544 2.2E3 72.2661 2.6E3 73.6137 2.7E3 75.7783 2.1E3 77.0384 1.7E4 78.2393 2.4E3 80.5310 2.2E3 86.5720 2.6E3 90.9476 2.2E3 94.9811 2.6E3 100.3523 2.3E3 105.0332 4.1E4 116.9658 6.3E4 120.8310 2.4E3 123.0438 1.5E4 126.6104 2.6E3 132.5314 2.4E3 133.0281 3.2E5 134.7337 2.6E3 152.9657 2.4E4 154.9818 1.2E4 163.0391 1.7E4 164.0425 5.3E3 164.9662 2.6E3 173.5289 7.2E4 173.5443 5.2E3 177.1738 2.6E3 180.9602 8.5E3 182.9767 3.1E4 208.9559 1.6E4 211.2744 2.4E3 214.9819 9.2E4 220.0873 2.6E3 226.9821 2.4E4 228.9978 1.5E4 230.9774 2.7E3 234.9685 1.3E4 235.9732 3.1E4 236.9790 1.0E4 238.9821 5.3E4 240.9974 2.1E4 242.9767 7.8E4 244.9921 7.4E3 247.6881 2.4E3 248.9876 3.2E4 252.9752 7.3E3 253.9832 3.6E3 254.9771 6.3E3 256.2274 2.8E3 256.9925 9.3E4 258.9719 2.5E3 260.9859 2.5E4 266.9771 1.0E5 268.9929 3.9E4 272.6606 2.9E3 272.9873 6.4E4 275.0032 5.1E3 275.9724 4.0E3 276.9772 1.1E4 278.9775 2.9E3 282.9722 4.8E3 284.9880 9.8E4 287.0036 3.7E4 296.9874 3.4E4 299.0030 2.9E3 300.9828 1.0E5 312.9825 2.3E4 314.9979 2.1E4 318.2919 2.5E3 318.9931 3.5E3 324.8443 2.5E3 328.9781 8.0E3 340.1812 2.6E3 END IONS BEGIN IONS FEATURE_ID=121 PEPMASS=474.1739 SCANS=121 RTINSECONDS=178.205 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 6 (0 removed due to low quality, 0 removed due to low cosine). 57.7930 2.2E3 58.2833 2.1E3 59.3530 2.3E3 60.9748 2.2E3 63.2140 2.3E3 63.2442 2.2E3 64.2753 2.3E3 68.1266 2.4E3 73.3182 2.6E3 76.0154 2.1E3 77.0382 3.0E3 79.8332 2.5E3 79.8827 2.3E3 88.3338 2.3E3 89.7207 2.3E3 91.9650 2.2E3 93.4423 2.4E3 99.0919 2.2E3 103.2436 2.1E3 105.0331 2.0E4 108.9374 2.3E3 116.7961 2.4E3 116.9658 4.2E4 124.7476 2.7E3 129.5165 2.5E3 132.0439 7.9E4 133.0180 7.6E3 133.0279 2.8E5 134.0597 3.4E3 136.1497 2.3E3 145.0860 2.5E3 146.9638 2.4E3 152.9657 1.1E4 158.3633 2.3E3 160.0496 2.5E3 163.0380 2.6E3 164.9662 3.2E3 173.5232 9.9E3 173.5289 8.7E4 173.5423 1.7E4 174.4346 2.3E3 181.9939 2.4E3 182.9763 3.8E4 187.0103 2.8E3 189.1806 2.7E3 190.9471 2.6E3 193.0218 2.5E3 193.2861 2.5E3 194.0673 3.5E3 196.2442 2.6E3 199.8794 2.4E3 203.9166 2.2E3 208.9554 1.5E4 210.5106 2.6E3 214.9815 7.7E4 224.5572 2.8E3 226.9830 2.7E3 228.9985 7.6E3 230.9766 2.5E3 236.5009 2.3E3 238.9816 4.4E4 240.9972 1.2E4 242.0921 2.3E4 242.9764 7.5E4 248.9856 2.2E4 251.3060 2.3E3 252.9962 3.1E3 254.9751 3.6E3 256.9918 8.5E4 259.0090 2.5E3 259.1182 1.2E5 260.9869 2.1E4 266.9761 9.2E4 268.9921 4.8E4 272.9869 4.8E4 275.0021 2.8E3 275.7156 2.4E3 278.9758 2.8E3 279.0004 3.7E3 280.9919 3.5E3 282.9725 4.8E3 284.1142 8.9E4 284.9873 1.3E5 286.9680 2.7E3 287.0027 2.9E4 296.9870 5.0E4 299.0033 1.8E4 300.9823 2.2E5 302.1248 1.1E5 302.9976 4.3E3 304.8932 2.6E3 310.9661 2.8E3 312.9822 2.7E4 314.9984 4.2E4 318.9934 1.9E4 320.2482 2.7E3 320.7362 2.6E3 324.9829 3.0E3 327.1205 1.7E5 328.9760 1.0E4 330.0650 2.6E3 340.9775 8.4E3 342.9934 9.2E3 345.1302 3.0E6 358.9891 1.1E4 386.9874 2.4E3 END IONS BEGIN IONS FEATURE_ID=122 PEPMASS=371.0614 SCANS=122 RTINSECONDS=178.396 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 5 (0 removed due to low quality, 0 removed due to low cosine). 54.3800 2.1E3 54.5570 2.4E3 55.0177 1.7E4 55.0543 2.3E3 56.0647 2.3E3 56.8438 2.2E3 57.0334 2.7E3 57.0696 3.0E3 58.4002 2.5E3 59.2818 2.1E3 61.0282 2.7E3 65.6817 2.5E3 68.3454 2.3E3 68.9967 2.1E3 69.0332 5.7E4 71.0121 4.5E3 71.0851 3.5E3 73.0281 3.9E4 75.3824 2.3E3 77.4692 2.4E3 81.8450 2.2E3 83.0124 4.6E4 85.0281 2.4E4 85.2584 2.3E3 89.1625 2.4E3 92.2870 2.2E3 92.4858 2.3E3 92.6813 2.5E3 95.0125 1.8E4 95.0489 1.8E4 101.0230 6.0E4 101.0594 3.7E4 105.0331 7.1E3 107.0487 4.0E4 111.0074 3.9E4 111.0437 3.8E4 113.0230 2.9E4 118.9356 2.4E3 122.1020 2.4E3 122.3186 2.3E3 123.0336 4.3E3 123.0437 3.6E5 124.1198 2.3E3 129.0179 2.4E4 129.0543 1.8E4 133.0281 1.5E5 135.0438 6.4E4 137.6404 2.4E3 138.6000 2.4E3 143.0486 3.0E3 147.0437 1.8E4 149.0231 1.9E4 149.0599 5.9E3 149.2999 2.3E3 150.0311 2.6E4 151.0387 1.3E5 153.0543 1.3E4 159.0436 2.5E3 159.3945 2.6E3 161.0231 3.0E5 161.0596 3.3E4 162.0298 3.1E3 162.4431 2.4E3 163.0388 3.3E4 173.0599 1.6E4 173.5226 2.2E4 173.5356 7.4E4 173.5426 8.1E3 175.0385 1.5E4 177.0184 2.4E4 177.0548 1.9E4 179.0078 4.1E3 179.0339 1.0E6 183.7551 2.6E3 187.0389 2.6E4 189.0184 3.4E3 189.0548 5.7E4 191.0345 3.8E3 193.0489 7.4E3 194.2065 2.2E3 197.0441 2.6E3 199.0392 1.1E4 205.0499 1.4E4 205.9101 2.2E3 207.0286 4.0E3 215.0341 2.2E4 217.0493 1.3E4 219.0291 4.0E3 221.0449 1.8E4 233.0443 3.0E4 245.0446 2.1E4 261.0394 1.1E4 273.9449 2.5E3 279.0497 3.1E3 297.1110 2.6E3 318.5153 2.5E3 325.3133 2.9E3 333.7463 2.3E3 347.7396 2.4E3 371.1681 3.5E3 END IONS BEGIN IONS FEATURE_ID=123 PEPMASS=300.1600 SCANS=123 RTINSECONDS=186.564 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 10 (5 removed due to low quality, 0 removed due to low cosine). 47.2133 2.2E4 47.5508 2.2E4 47.8080 2.3E4 50.0161 2.2E4 50.7396 2.4E4 55.0179 2.4E4 56.0494 4.2E5 56.3750 2.4E4 57.0572 1.5E5 58.0582 2.1E5 58.0652 1.3E8 58.0704 3.4E5 58.0718 2.7E5 58.0739 1.1E5 58.0740 9.9E5 58.0757 6.0E4 71.0027 2.4E4 71.0728 8.6E5 72.0807 1.0E6 74.9082 1.4E4 79.0543 4.0E4 86.0602 1.9E4 86.1535 1.2E4 91.0541 3.4E5 93.0697 1.8E5 95.0491 2.8E5 103.0542 9.0E4 104.5431 2.3E4 105.0449 1.8E4 105.0697 4.3E4 107.0319 3.3E4 107.0491 3.3E7 107.0661 1.8E5 108.3089 1.3E4 115.0542 5.3E5 116.8881 1.4E4 117.0698 3.7E5 119.0489 1.1E6 119.0857 8.1E4 121.0647 5.2E6 121.0733 2.6E4 123.0337 4.8E4 123.0439 3.9E6 124.6929 1.4E4 131.0492 2.2E5 133.0646 4.9E5 135.0440 6.3E5 135.0806 6.8E4 137.0596 2.6E6 138.2385 1.2E4 143.0362 2.0E4 143.0491 3.0E6 145.0515 2.1E4 145.0647 4.2E6 145.0746 2.3E4 145.0769 4.5E4 146.0730 1.6E4 146.2313 2.5E4 147.0445 1.4E4 147.0803 1.9E6 148.0518 1.6E5 149.0596 1.0E6 150.3153 1.3E4 151.0753 1.2E5 155.0598 5.7E4 157.0645 4.1E4 161.0439 5.8E4 161.0596 1.1E7 161.0755 1.3E5 162.0674 1.6E4 163.0753 1.8E6 163.0910 2.0E4 173.0598 1.3E4 173.5224 2.1E5 173.5385 3.4E5 175.0755 5.6E4 178.0862 3.6E5 179.0940 7.1E5 179.7273 1.3E4 180.1020 7.0E5 181.0641 6.8E4 181.1019 1.3E5 183.0797 4.7E4 186.7968 1.2E4 191.0857 1.5E5 191.5103 2.6E4 192.1015 5.1E4 193.1094 6.0E5 194.0726 6.0E4 201.3298 1.4E4 206.1175 6.8E4 209.0962 1.1E6 210.0666 1.7E4 211.0762 6.3E4 211.1120 8.7E5 219.0809 2.4E5 221.0957 1.4E5 222.0675 1.3E4 226.0620 3.2E5 227.0449 1.3E4 227.0704 1.3E5 227.1074 4.1E4 227.5192 1.5E4 228.0780 1.9E5 229.1238 4.0E4 237.0910 2.1E6 239.1067 8.5E5 240.0779 2.2E5 255.0698 1.0E5 255.1015 9.0E6 255.1323 2.9E4 257.1170 3.0E6 257.1481 2.4E4 274.5282 2.3E4 282.1491 1.2E5 285.1392 5.0E4 300.1595 2.2E7 300.1898 9.2E4 END IONS BEGIN IONS FEATURE_ID=124 PEPMASS=301.1628 SCANS=124 RTINSECONDS=186.827 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 55.0178 8.1E3 56.0494 4.8E4 57.0574 8.0E3 58.0333 5.4E3 58.0651 1.7E7 58.0696 1.6E5 58.0703 6.9E4 58.0718 5.4E4 58.0737 2.2E4 59.0592 9.9E3 59.0621 1.2E5 59.0681 3.7E6 59.0714 4.9E4 67.6929 3.8E3 71.0728 1.2E5 72.0765 1.0E4 72.0801 1.5E5 73.0840 4.1E4 83.0342 5.6E3 91.0541 3.7E4 92.0574 2.0E4 93.0698 5.5E3 93.7173 3.8E3 94.3194 3.6E3 95.0490 3.1E4 104.2979 3.3E3 107.0490 3.3E6 108.0524 2.0E6 108.3199 6.8E3 115.0543 4.6E4 116.0576 3.2E4 117.0698 3.2E4 118.0553 5.2E3 118.0731 3.3E4 119.0490 9.7E4 120.0524 7.5E4 120.0874 6.5E3 121.0552 1.3E4 121.0646 5.0E5 122.0680 3.8E5 123.0338 5.8E3 123.0439 4.1E5 124.0473 2.5E5 125.8130 4.7E3 126.4077 4.1E3 132.0526 1.6E4 133.0647 3.9E4 134.0680 3.9E4 135.0439 4.7E4 135.0804 6.4E3 136.0474 3.3E4 137.0596 2.7E5 138.0630 1.8E5 141.2455 5.9E3 143.0490 2.2E5 144.0524 2.7E5 145.0646 3.1E5 146.0546 5.5E3 146.0681 3.9E5 147.0801 1.4E5 148.0514 7.5E3 148.0837 1.8E5 149.0593 9.4E4 149.4054 6.4E3 150.0628 7.6E4 151.0744 6.0E3 158.0660 6.5E3 160.4071 6.2E3 161.0440 1.0E4 161.0596 8.2E5 161.0751 7.5E3 161.8606 5.8E3 162.0469 6.7E3 162.0631 1.0E6 162.0789 1.5E4 163.0751 1.4E5 164.0788 1.7E5 165.4117 3.8E3 173.5211 1.2E4 173.5323 6.9E4 173.5397 2.9E4 176.0786 9.2E3 176.1063 7.0E3 178.0869 1.9E4 179.0926 6.6E4 180.0996 8.9E4 181.1052 6.8E4 191.0863 6.8E3 192.0884 1.1E4 193.1092 4.6E4 194.1130 6.2E4 195.0772 1.1E4 207.0844 6.0E3 209.0963 3.8E4 210.0997 1.4E5 211.0714 9.2E3 211.1116 1.4E4 212.0790 1.4E4 212.1154 1.2E5 220.0839 4.1E4 221.0926 6.8E3 222.1001 9.0E3 226.0625 6.3E3 227.0668 4.4E4 228.0750 2.7E4 229.0814 3.2E4 237.0910 4.6E4 238.0944 3.0E5 239.1070 7.7E3 240.0839 7.7E3 240.1101 1.1E5 241.0812 3.6E4 243.0995 7.5E3 255.1014 1.8E5 256.0738 2.3E4 256.1048 1.3E6 256.1273 4.7E3 256.1370 2.6E4 257.1173 6.5E4 258.1205 4.3E5 270.1214 9.4E3 270.7256 4.6E3 280.1153 4.2E3 282.5012 6.6E3 283.1553 1.3E4 301.1628 3.4E6 END IONS BEGIN IONS FEATURE_ID=125 PEPMASS=298.1446 SCANS=125 RTINSECONDS=187.029 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 6 (0 removed due to low quality, 0 removed due to low cosine). 48.2608 2.7E3 48.2820 2.2E3 50.0408 2.5E3 52.0995 2.4E3 55.2390 3.2E3 56.5080 2.2E3 56.9469 2.4E3 58.0652 2.7E6 58.0683 1.3E4 58.0700 1.2E4 58.9005 2.1E3 58.9388 2.3E3 61.0104 8.1E3 61.3529 2.6E3 62.8808 2.1E3 63.7570 2.6E3 65.9844 2.7E3 67.2448 2.6E3 71.1364 2.4E3 72.0442 2.9E4 72.0808 2.5E3 72.4379 2.6E3 72.6113 3.0E3 72.9583 2.1E3 73.1977 2.3E3 75.0260 5.4E3 76.2543 2.6E3 77.6819 2.5E3 83.4556 2.4E3 83.9648 2.4E3 90.0970 2.2E3 90.6216 2.0E3 97.4576 2.9E3 99.8238 2.4E3 103.0213 2.4E3 107.0488 1.6E5 108.9110 2.3E3 110.8113 2.2E3 111.3669 2.3E3 117.3148 2.5E3 120.0801 2.1E3 121.0639 2.9E3 122.0956 3.3E3 128.4593 2.8E3 131.0484 2.8E3 136.0615 1.8E5 136.0714 2.3E3 136.0741 3.8E3 146.0955 3.1E3 148.0757 2.6E4 149.0594 2.4E4 149.3642 2.5E3 150.0912 3.3E3 151.1598 2.3E3 152.8129 2.2E3 153.9549 2.2E3 162.0917 9.8E3 163.0990 3.4E4 164.1067 3.6E4 166.0496 4.5E3 170.6225 2.3E3 172.2174 2.6E3 173.5312 5.3E4 173.5391 2.1E4 174.6423 2.2E3 176.0715 2.8E3 177.0783 1.4E5 178.0859 2.5E3 181.0647 6.5E3 190.8975 2.6E3 191.0940 7.4E4 192.1017 7.3E4 194.2608 2.5E3 197.0954 7.1E3 202.8964 6.9E3 203.0052 2.6E3 207.0795 6.2E3 208.9053 2.9E3 218.8892 1.7E4 225.0906 7.8E3 233.6290 2.6E3 238.2515 2.2E3 246.8847 1.3E4 270.1492 4.4E4 271.7130 2.5E3 280.5306 3.3E3 282.3848 2.4E3 283.1207 2.5E4 298.1438 4.4E4 300.5406 2.8E3 END IONS BEGIN IONS FEATURE_ID=126 PEPMASS=330.1705 SCANS=126 RTINSECONDS=188.914 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 5 (0 removed due to low quality, 0 removed due to low cosine). 49.8453 2.1E3 49.9345 2.3E3 52.2671 2.6E3 53.4833 2.3E3 54.3826 2.4E3 54.4477 2.1E3 56.7281 2.5E3 58.0612 2.4E3 58.0651 1.5E6 58.0683 9.4E3 58.0699 7.0E3 58.1775 2.2E3 62.0020 2.3E3 62.6134 2.4E3 65.5732 2.3E3 65.7285 2.3E3 77.1816 2.4E3 77.5294 2.2E3 78.1929 3.1E3 79.5152 2.1E3 80.1913 2.6E3 81.0860 2.7E3 84.1419 2.5E3 91.0541 2.7E3 91.4948 2.6E3 105.1628 2.6E3 106.5564 2.6E3 107.0489 3.5E4 115.0539 3.9E3 121.0646 2.7E3 123.0437 1.8E5 137.0594 1.0E5 138.3257 2.6E3 143.0488 7.7E4 145.0645 2.7E3 151.0750 2.0E4 157.3334 2.6E3 161.0593 2.5E4 163.0754 2.6E4 164.0542 2.9E3 173.5293 6.2E4 173.5418 6.3E3 175.0753 1.2E5 177.0908 9.5E3 191.0702 7.3E3 192.1015 9.1E3 193.1096 1.7E4 194.1164 3.3E3 205.1095 3.3E4 206.1169 2.7E3 207.0809 6.1E3 209.0958 2.5E3 218.9568 2.4E3 221.1965 2.3E3 225.0910 1.7E4 233.0886 2.8E3 233.2538 2.6E3 235.0753 2.4E4 253.0853 4.1E4 255.1023 3.5E3 257.1177 3.3E3 267.1018 1.8E4 269.1161 2.7E3 285.1124 1.3E5 285.1443 3.6E3 287.1286 2.0E4 298.1454 3.3E3 320.0464 2.5E3 330.1703 2.1E5 END IONS BEGIN IONS FEATURE_ID=127 PEPMASS=298.0978 SCANS=127 RTINSECONDS=189.492 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 6 (3 removed due to low quality, 0 removed due to low cosine). 54.3891 2.1E3 56.2246 2.5E3 58.0649 1.5E5 60.1044 2.3E3 60.2785 2.2E3 61.0104 8.0E4 69.0332 2.5E3 75.0260 3.2E4 76.2648 2.4E3 81.2564 2.3E3 88.7948 2.4E3 89.1903 2.2E3 95.9871 2.2E3 97.0282 2.4E4 100.0146 2.5E3 100.6127 2.2E3 107.0488 7.2E3 117.1221 2.4E3 118.4566 2.2E3 125.7218 2.4E3 128.5045 2.4E3 131.6581 2.3E3 136.0615 1.3E6 136.0713 2.1E4 145.0318 8.4E3 149.0590 3.3E3 167.6104 2.3E3 171.9438 2.5E3 173.5337 3.6E4 177.0785 5.5E3 190.8973 5.3E3 203.9050 2.5E3 218.8896 8.2E3 224.9014 6.6E3 246.8855 9.3E3 280.7253 2.2E3 END IONS BEGIN IONS FEATURE_ID=128 PEPMASS=374.1087 SCANS=128 RTINSECONDS=193.483 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 5 (0 removed due to low quality, 0 removed due to low cosine). 52.9719 2.4E3 55.6992 2.1E3 55.8772 2.3E3 57.0491 2.1E3 58.1135 2.4E3 58.2171 2.4E3 58.8506 2.2E3 61.0735 2.3E3 61.1510 2.5E3 65.0385 7.7E3 65.7879 2.8E3 67.2398 2.5E3 67.2748 2.3E3 68.0884 2.3E3 74.9998 2.4E3 87.0438 2.8E3 89.8725 2.4E3 91.0539 1.1E5 106.5331 2.1E3 108.5842 2.3E3 109.5944 2.1E3 115.2151 2.6E3 119.0396 1.0E4 119.0488 3.8E5 121.1280 2.3E3 128.0582 2.9E3 140.6000 2.7E3 147.0437 4.2E6 147.0548 5.6E4 147.0709 2.5E4 150.4952 2.2E3 167.6767 2.7E3 173.5290 5.7E4 173.5408 1.4E4 189.4784 2.4E3 200.7619 2.4E3 227.0948 7.8E3 229.6645 2.2E3 241.2841 2.2E3 251.7835 2.8E3 292.2429 2.7E3 347.8947 2.4E3 357.5909 2.6E3 END IONS BEGIN IONS FEATURE_ID=129 PEPMASS=446.2180 SCANS=129 RTINSECONDS=194.591 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 56.4549 2.3E3 58.0648 3.3E5 58.0683 5.2E3 67.5211 2.8E3 72.3408 2.6E3 75.0436 1.1E4 87.2454 2.4E3 91.8197 2.3E3 92.4206 2.3E3 107.0487 2.5E4 116.6708 2.5E3 121.0640 6.7E3 123.0441 3.7E3 123.2575 2.6E3 125.5892 2.3E3 142.5015 2.4E3 161.0597 6.1E3 165.8627 2.7E3 173.5254 6.6E3 173.5351 4.0E4 193.0182 2.5E3 206.6638 3.6E3 251.4383 2.4E3 255.1014 7.1E4 257.1173 2.2E4 286.9715 2.8E3 300.1596 4.9E5 314.1737 8.9E3 323.2130 2.9E3 388.9652 2.6E3 411.0041 2.7E3 428.5437 2.5E3 446.2179 1.3E5 END IONS BEGIN IONS FEATURE_ID=130 PEPMASS=272.1285 SCANS=130 RTINSECONDS=198.379 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 52.5676 2.4E3 53.0387 2.2E3 53.5439 2.2E3 54.4205 2.2E3 54.9866 2.4E3 55.0178 1.2E4 61.3444 2.3E3 62.8792 2.6E3 64.3096 2.3E3 64.8024 2.2E3 65.4120 2.5E3 76.4942 2.5E3 79.0540 1.4E4 91.0541 3.7E4 94.6357 2.7E3 95.0490 2.6E4 96.5633 2.1E3 98.1319 2.4E3 103.0542 3.1E3 105.0332 3.2E3 105.0450 2.9E3 105.0700 1.0E4 107.0318 8.4E3 107.0490 4.7E6 107.0557 3.1E4 107.0622 1.4E4 107.0660 5.3E4 107.0703 4.1E3 115.0541 1.4E5 117.0697 3.5E4 119.0492 1.5E4 121.0646 7.5E4 123.0337 8.0E3 123.0439 4.0E5 126.4756 3.0E3 131.0491 3.5E4 131.8128 2.7E3 133.0646 6.6E4 135.0444 3.3E3 136.0755 1.6E4 137.0597 4.9E4 143.0362 4.9E3 143.0490 4.9E5 143.0587 2.5E3 144.0565 2.6E3 145.0515 8.4E3 145.0647 4.0E5 145.0748 2.7E3 146.0727 1.1E4 146.5916 2.2E3 147.0436 3.0E3 149.0596 8.1E4 155.0605 1.3E4 161.0596 1.1E6 161.0726 1.4E4 162.0679 8.5E3 164.0707 5.4E4 173.5254 1.3E4 173.5340 2.6E4 173.5427 4.9E3 181.0645 1.9E4 181.1011 2.0E4 191.0854 4.4E4 194.0728 3.8E4 195.0810 1.0E4 195.8375 2.8E3 203.7991 2.5E3 203.8833 4.9E4 205.8991 7.3E3 209.0962 1.7E5 216.8916 6.8E3 219.0804 4.5E4 221.8947 6.8E3 222.0674 8.0E3 225.0895 3.0E3 226.0628 4.3E4 227.0697 1.4E4 227.1057 4.3E3 229.3236 2.8E3 237.0493 3.6E3 237.0910 2.6E5 240.0779 4.3E4 255.1015 3.7E5 255.1327 4.3E3 272.0967 7.0E3 272.1280 4.0E4 END IONS BEGIN IONS FEATURE_ID=131 PEPMASS=318.1553 SCANS=131 RTINSECONDS=198.799 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 53.0385 1.5E4 53.2748 2.3E3 55.0176 2.6E4 57.0332 4.0E4 61.0281 9.1E4 69.0332 1.2E5 71.0488 1.8E4 71.0808 2.4E3 73.0281 3.4E4 76.6648 2.4E3 80.0175 2.1E3 81.0331 4.9E4 85.0281 8.5E5 85.0338 4.9E3 87.0438 2.7E4 91.0386 4.0E4 91.0541 1.3E4 93.0695 1.4E4 95.0492 2.7E3 96.0974 2.6E3 97.0281 2.0E5 99.0437 3.7E4 99.1149 2.5E3 103.0387 6.8E3 103.0541 1.0E4 109.0280 7.6E4 113.3654 2.4E3 115.0387 3.3E3 121.0645 5.0E5 121.0736 5.5E3 127.0386 1.4E5 131.0853 7.4E3 142.9237 2.4E3 145.0493 6.0E4 145.0642 1.9E4 147.0428 3.0E3 151.0751 8.0E3 155.0857 2.4E3 157.0647 1.4E4 159.0801 4.5E4 162.0671 9.3E3 163.0378 3.3E3 163.0750 4.5E3 169.0652 7.0E3 169.2370 2.6E3 171.0806 5.3E3 173.5213 1.1E4 173.5391 3.2E4 175.0752 2.0E4 178.0625 5.8E3 179.0703 2.9E3 183.0805 2.9E3 185.0598 4.0E3 187.0753 9.2E4 190.0622 4.4E4 191.0338 1.1E4 191.0701 2.7E3 193.0855 3.7E4 201.0922 6.2E3 205.0860 1.8E4 206.0568 1.7E4 210.7606 2.8E3 217.0870 1.0E4 221.0808 1.2E5 229.0856 5.6E3 296.0244 2.7E3 END IONS BEGIN IONS FEATURE_ID=132 PEPMASS=205.0975 SCANS=132 RTINSECONDS=200.425 CHARGE=1+ MSLEVEL=2 MERGED_STATS=7 / 11 (4 removed due to low quality, 0 removed due to low cosine). 42.8472 2.4E3 43.0179 1.1E4 44.3326 2.1E3 46.2430 2.1E3 46.7507 2.2E3 51.0235 2.6E3 51.1528 2.4E3 51.4106 2.8E3 53.0022 2.3E3 53.2800 2.2E3 54.2785 2.4E3 54.3391 2.4E3 55.0031 2.2E3 55.0177 8.9E3 55.1412 2.7E3 55.9343 1.8E5 58.5695 2.4E3 60.7027 2.3E3 60.7537 2.3E3 61.0120 2.0E3 62.0974 2.5E3 64.8414 2.6E3 65.0388 3.7E3 69.2637 2.3E3 70.0849 2.5E3 70.4781 2.4E3 71.6282 2.4E3 72.8557 2.7E3 72.9369 1.8E4 73.9448 2.6E3 74.0235 4.4E5 74.9526 2.9E3 75.5549 2.2E3 89.0393 9.7E3 90.9476 5.1E4 91.0541 2.3E5 95.0477 2.5E3 103.0543 2.5E4 105.0701 1.9E4 105.9347 3.9E3 105.9886 2.2E3 107.9502 4.1E3 109.0775 2.4E3 113.9639 9.2E3 114.9710 2.3E4 115.0452 4.7E3 115.0541 4.6E5 116.0493 1.3E4 116.0624 6.2E3 116.7927 2.5E3 116.9659 1.9E4 117.0573 2.4E5 117.0697 6.7E5 117.9658 3.1E3 118.0456 1.7E4 118.0486 2.2E4 118.0650 1.1E7 118.0735 6.5E4 118.0817 1.2E5 118.0843 2.3E4 118.0922 1.3E4 118.9424 2.3E4 119.1152 2.4E3 127.0538 1.3E4 128.0495 1.7E4 128.0616 1.2E4 128.9506 6.6E4 130.0650 7.7E5 130.0755 6.3E3 131.0729 3.0E4 132.0439 1.5E4 132.0806 2.5E6 132.0902 1.7E4 135.9450 2.6E4 142.0539 8.0E3 142.0650 1.1E6 142.0759 2.3E3 143.0600 9.8E3 143.0728 1.4E6 143.0837 3.8E3 143.0853 1.8E4 143.2509 2.9E3 144.0446 1.7E5 144.0806 5.1E6 144.0917 3.1E4 144.1069 1.1E4 145.0526 3.5E3 145.0647 1.4E5 146.0100 3.9E3 146.0247 1.1E4 146.0329 9.2E4 146.0404 4.8E4 146.0598 1.9E7 146.0705 1.9E5 146.0847 2.2E5 146.0869 3.6E4 146.0948 1.4E4 146.0988 3.8E4 146.9614 2.9E3 147.5636 2.9E3 155.0602 1.3E5 158.9771 5.9E3 159.0765 9.3E3 159.0916 1.7E6 159.1038 4.6E3 159.1056 9.1E3 160.0611 4.7E3 160.0756 4.1E5 160.0906 5.0E3 170.0433 9.7E3 170.0600 1.9E6 170.0730 2.0E4 173.5232 4.6E3 173.5311 4.7E4 173.5415 1.8E4 188.0510 7.0E3 188.0706 1.7E6 188.0903 3.4E3 194.9444 9.7E3 205.7604 2.9E3 END IONS BEGIN IONS FEATURE_ID=133 PEPMASS=286.1444 SCANS=133 RTINSECONDS=203.035 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 48.9276 2.4E3 53.3122 2.3E3 57.4892 2.3E3 58.0649 6.5E3 61.7438 2.7E3 62.1258 2.6E3 84.1629 2.2E3 91.0539 1.1E4 97.5042 2.7E3 104.9792 2.9E3 105.0698 5.5E3 107.0489 8.2E5 107.0566 4.8E3 107.0762 3.0E3 114.8333 2.2E3 115.0541 1.7E4 117.0688 2.6E3 119.0490 2.6E4 121.0646 5.8E4 121.6981 2.4E3 123.0438 1.1E5 131.0495 8.0E3 133.0646 2.7E4 135.0439 1.1E4 137.0596 1.9E4 143.0490 8.7E4 145.0646 8.3E4 147.0808 2.7E3 148.0682 2.6E3 149.0595 3.2E4 161.0444 2.3E3 161.0597 2.4E5 163.0752 6.2E3 166.0865 6.3E3 173.5295 1.1E4 173.5393 1.8E4 175.0767 2.3E3 178.0867 2.1E4 181.1023 3.4E3 184.8441 2.6E3 197.0964 2.5E4 201.0541 7.9E3 203.8842 3.1E3 209.0967 2.8E4 216.8914 3.1E3 219.0819 3.6E3 225.0916 1.0E4 226.0638 3.1E3 227.0711 3.5E3 237.0916 4.9E4 239.0728 3.3E3 243.1019 3.0E4 255.1020 1.5E5 257.1178 4.0E3 280.6430 2.8E3 286.1447 1.1E5 END IONS BEGIN IONS FEATURE_ID=134 PEPMASS=330.1706 SCANS=134 RTINSECONDS=204.506 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 8 (3 removed due to low quality, 0 removed due to low cosine). 51.1767 2.5E3 56.0494 7.4E4 57.0782 8.1E3 58.0353 3.1E3 58.0540 1.5E4 58.0652 2.7E7 58.0705 9.0E4 58.0719 8.9E4 58.0741 3.8E4 58.0741 1.9E5 58.0757 2.5E4 66.8059 2.5E3 70.0650 9.3E3 71.0728 4.6E4 71.3091 5.7E3 72.0808 4.6E4 72.9875 2.9E3 76.8170 5.4E3 84.3129 8.1E3 84.4385 5.9E3 85.3945 5.5E3 86.0598 1.5E4 87.0286 2.6E3 87.2591 5.8E3 88.3992 5.9E3 88.4773 2.4E3 91.0542 8.0E4 93.5271 3.1E3 95.0488 2.5E4 100.3957 5.9E3 101.7052 2.4E3 107.0491 3.6E4 109.0646 3.0E4 111.0439 2.3E4 115.0542 1.9E5 115.9383 3.0E3 116.9204 2.6E3 117.0700 6.9E4 119.0491 8.9E4 121.0647 2.0E4 121.5705 3.4E3 123.0440 6.0E6 123.0547 3.5E3 123.4464 6.4E3 125.0599 3.4E4 125.4760 2.2E3 131.0492 1.3E5 133.0648 3.8E4 133.5042 2.9E3 135.0440 1.8E5 137.0424 8.6E3 137.0596 2.4E6 143.0490 2.5E6 143.0588 1.3E4 144.0569 9.1E3 144.4030 3.1E3 145.0646 2.5E5 147.0438 3.0E4 147.0805 5.1E4 149.0596 2.4E5 149.0959 4.7E3 150.0676 3.2E4 151.0752 8.9E5 153.0911 3.9E3 157.0658 1.2E4 160.0518 1.6E5 160.0757 9.4E3 161.0596 7.4E5 161.0828 3.7E4 162.0678 5.0E4 162.0909 1.5E4 162.8171 2.9E3 163.0754 6.3E5 165.0912 6.9E4 173.5257 3.3E4 173.5374 8.8E4 174.0917 4.8E4 175.0396 5.0E3 175.0576 4.3E3 175.0754 4.4E6 175.1010 4.6E4 175.1030 1.9E4 176.0831 1.8E5 176.1071 1.7E5 177.0911 2.3E5 178.0849 3.4E3 179.0857 5.7E4 181.0648 1.2E4 181.1022 2.8E4 183.0816 3.6E3 188.1061 4.0E3 192.0817 6.7E3 192.1019 6.5E5 193.1097 6.2E5 194.1176 3.1E5 195.0796 3.4E3 197.0941 3.1E3 199.0745 8.8E3 201.2339 2.8E3 205.1094 3.9E3 206.1178 7.5E4 207.0807 3.0E5 207.1257 1.1E5 208.1333 6.8E3 209.0598 3.0E4 209.0962 1.5E5 211.0745 7.9E3 213.0547 3.6E3 213.0913 1.3E4 219.0809 6.9E3 225.0911 5.5E5 226.0620 1.7E4 227.0702 8.9E4 227.1069 3.2E5 235.0753 2.7E5 237.0911 2.1E5 237.7826 2.7E3 239.1069 6.5E4 240.0789 3.3E3 241.0858 1.9E4 241.1225 1.2E5 251.1062 2.6E4 252.0726 7.8E3 253.0561 1.7E4 253.0857 9.3E5 254.0937 4.3E4 255.1015 4.0E5 256.0734 3.2E4 257.0840 4.2E3 257.1156 2.8E4 258.0887 6.0E4 259.1311 1.1E4 267.1019 6.7E4 269.1170 1.5E5 270.0884 1.8E5 270.1489 2.6E4 272.1047 1.1E4 285.0741 6.3E3 285.0849 1.5E4 285.1122 2.6E6 287.1280 8.4E5 287.1646 1.7E4 291.0028 6.5E3 298.1439 3.1E5 299.1501 1.3E4 315.1471 9.7E4 330.1700 5.1E6 END IONS BEGIN IONS FEATURE_ID=135 PEPMASS=328.1552 SCANS=135 RTINSECONDS=205.14 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 4 (1 removed due to low quality, 0 removed due to low cosine). 50.5020 2.9E3 56.4347 2.3E3 57.0300 2.3E3 57.7432 2.3E3 58.0650 1.5E6 58.0682 2.1E4 58.0700 1.5E4 58.0716 1.0E4 62.1567 2.7E3 62.8700 2.5E3 64.1830 2.1E3 64.4472 2.3E3 67.7519 2.2E3 74.6924 2.3E3 92.9117 2.5E3 93.0994 2.7E3 99.2369 2.4E3 103.1457 2.2E3 121.8644 2.9E3 122.1440 2.4E3 124.1363 2.3E3 127.6635 2.4E3 130.3235 2.1E3 131.0491 3.9E3 145.3741 2.3E3 146.0963 2.0E4 155.4042 2.3E3 161.0597 3.0E3 163.0752 6.0E4 173.5242 8.5E3 173.5380 3.2E4 174.0914 5.4E4 175.0993 2.5E4 184.6503 2.8E3 190.0866 3.7E3 191.0941 2.7E4 192.1023 8.6E3 204.1016 6.4E3 206.1176 1.2E5 223.0757 6.4E3 225.0924 4.5E3 233.0602 4.5E3 249.4511 2.4E3 251.0705 6.4E4 255.1008 3.8E3 274.8135 2.4E3 276.2813 2.4E3 283.0969 4.0E4 300.1604 4.9E3 328.1551 8.0E3 END IONS BEGIN IONS FEATURE_ID=136 PEPMASS=247.0604 SCANS=136 RTINSECONDS=208.104 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 45.0329 2.5E3 47.3639 2.3E3 54.1060 2.3E3 55.0177 8.4E3 61.8512 2.6E3 64.2838 2.5E3 65.0384 5.4E3 65.9296 2.2E3 67.0176 1.2E4 69.0334 5.4E3 71.0127 6.0E3 76.7266 2.5E3 88.2459 2.5E3 92.9818 3.0E3 93.1829 2.5E3 95.8409 2.4E3 104.0116 2.6E3 111.0439 6.0E3 117.0182 2.3E3 117.4246 2.9E3 121.0181 1.2E4 121.0282 4.5E5 121.0386 2.3E4 129.0182 3.2E3 140.4652 2.2E3 152.9971 3.4E3 153.0181 8.0E5 171.0289 3.4E3 173.5280 2.3E4 173.5407 4.3E3 209.7004 2.9E3 216.9195 2.2E3 219.6589 2.7E3 225.0783 2.4E3 END IONS BEGIN IONS FEATURE_ID=137 PEPMASS=350.0696 SCANS=137 RTINSECONDS=208.197 CHARGE=1+ MSLEVEL=2 MERGED_STATS=7 / 7 (0 removed due to low quality, 0 removed due to low cosine). 52.2576 2.2E3 54.1941 2.3E3 56.8027 2.4E3 57.8327 2.5E3 59.6511 2.3E3 61.5609 2.6E3 67.0584 2.3E3 70.0645 2.3E3 70.8683 2.3E3 71.6915 2.4E3 74.0421 2.7E3 74.5263 2.4E3 74.7578 2.1E3 77.2691 2.4E3 78.5898 2.5E3 81.9539 2.4E3 87.7533 2.3E3 97.8177 2.3E3 98.5643 2.7E3 99.7236 2.5E3 103.0541 2.5E3 104.0436 2.5E3 105.0697 2.9E3 105.7177 2.3E3 107.0488 1.4E6 107.0572 2.8E4 119.0489 2.4E4 120.0801 2.5E3 120.2718 2.9E3 121.0294 2.5E3 121.0640 1.2E4 122.0598 5.3E4 126.8781 2.5E3 127.4651 2.4E3 130.0651 3.2E4 131.0491 1.6E4 132.0442 2.8E3 134.0597 5.1E4 135.0337 3.6E3 135.0437 2.9E4 135.0678 4.2E4 136.0757 3.9E4 143.7270 2.4E3 146.0598 1.2E5 147.0440 1.5E4 148.0757 3.0E4 157.0647 5.8E3 158.0598 3.5E4 162.0549 3.1E4 163.0497 2.4E3 163.0627 1.1E5 164.0548 8.7E3 164.0705 1.9E6 164.0935 3.2E3 167.0857 7.6E3 168.2476 3.0E3 173.5222 3.4E3 173.5357 7.3E4 173.5406 7.4E3 176.0703 2.7E3 179.0853 3.2E4 181.0649 6.0E3 182.0727 2.4E3 185.0959 5.4E3 187.0060 1.5E5 187.3931 2.3E3 188.0323 6.7E3 188.4687 2.4E3 193.9340 2.4E3 194.0738 2.4E3 195.0809 2.6E4 197.0964 7.4E4 199.0763 2.7E3 199.1118 2.6E3 200.1077 1.1E4 207.0807 4.1E4 209.0963 3.8E3 213.0915 6.2E4 214.1227 3.0E3 221.5927 2.6E3 223.0771 2.5E3 224.1075 3.5E4 225.0913 4.7E4 234.0911 3.0E3 235.0759 5.9E3 235.1213 2.9E3 241.0863 8.4E3 242.1180 9.1E4 244.0033 2.8E3 244.0285 2.1E4 252.1023 8.2E4 253.0872 6.9E3 267.3625 2.6E3 270.1131 8.0E4 275.9124 2.6E3 END IONS BEGIN IONS FEATURE_ID=138 PEPMASS=298.1444 SCANS=138 RTINSECONDS=210.619 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 7 (2 removed due to low quality, 0 removed due to low cosine). 50.8187 2.3E3 52.8336 2.2E3 53.6397 3.1E3 57.4550 2.1E3 58.0648 6.7E4 60.1614 3.2E3 65.5489 2.5E3 89.4847 2.6E3 91.0927 3.0E3 93.0697 4.1E3 107.0488 1.3E5 110.7834 2.4E3 121.0645 1.3E5 121.3872 2.2E3 123.4372 2.4E3 130.5219 2.2E3 145.0888 3.1E3 146.0360 8.3E3 146.0961 1.7E4 148.0518 2.9E3 149.0611 2.9E3 153.7390 2.8E3 160.0753 3.3E3 161.0600 1.3E4 173.0834 1.4E4 173.5253 3.1E4 173.5403 3.7E4 174.0762 2.1E3 174.0914 8.1E4 176.0707 1.4E5 176.6713 2.1E3 177.0785 1.0E5 178.0863 5.8E4 184.2398 2.7E3 189.0785 1.1E4 190.0864 5.6E4 191.0533 7.8E3 191.0739 6.6E3 191.0941 2.7E6 192.1020 1.9E5 202.0881 2.5E3 204.1022 1.1E4 206.8910 3.1E3 207.0802 1.2E4 217.5037 2.6E3 218.8901 9.7E3 224.9026 3.0E3 235.0761 1.0E4 246.8856 6.9E3 253.0842 4.4E3 262.0250 2.6E3 263.0873 2.5E3 270.0934 3.7E3 296.1287 4.7E3 296.6620 2.7E3 298.1439 2.7E4 301.3236 2.9E3 END IONS BEGIN IONS FEATURE_ID=139 PEPMASS=460.2335 SCANS=139 RTINSECONDS=212.103 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 58.0650 6.0E5 58.0683 5.9E3 58.2563 2.4E3 58.3131 2.6E3 59.1586 2.3E3 62.6259 2.5E3 75.0439 2.2E4 82.3494 2.4E3 83.3245 2.3E3 91.0540 3.2E3 92.7165 2.3E3 93.6953 2.3E3 107.0488 6.1E4 109.0702 2.4E3 119.0488 1.8E4 121.0644 2.3E4 127.4205 2.2E3 134.7741 2.5E3 137.0595 1.7E4 139.5308 2.5E3 143.0490 7.5E3 145.0643 6.8E3 147.0437 3.3E5 148.0478 7.1E3 173.5284 5.9E4 173.5449 5.2E3 175.0754 2.5E4 175.6354 2.5E3 177.0919 3.1E3 191.1406 2.4E3 237.0915 1.9E4 239.1071 1.4E4 244.9930 6.7E3 247.1284 2.5E3 265.0092 2.5E3 268.9923 7.0E3 269.1171 2.4E5 269.1496 4.9E3 271.1328 5.1E4 286.4923 2.6E3 287.0031 2.4E4 290.4689 2.3E3 295.0073 2.9E3 314.1751 9.8E5 320.9091 2.4E3 327.0429 3.0E3 344.4362 2.4E3 346.2252 2.7E3 388.8398 2.5E3 415.1795 3.1E3 460.2329 2.5E5 END IONS BEGIN IONS FEATURE_ID=140 PEPMASS=247.0604 SCANS=140 RTINSECONDS=212.627 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 8 (5 removed due to low quality, 0 removed due to low cosine). 49.9011 2.1E3 49.9553 2.0E3 50.2612 2.2E3 52.1954 2.6E3 52.9391 2.4E3 55.0177 1.1E4 58.4649 2.3E3 58.8902 2.4E3 63.9749 2.7E3 65.0357 2.3E3 65.0383 7.4E4 67.0175 8.8E4 68.9969 4.4E4 69.0332 4.3E4 71.9196 2.5E3 72.5500 3.0E3 73.0282 8.1E3 81.0335 2.8E3 83.0126 1.2E4 93.0333 1.3E4 97.0281 3.5E4 97.0633 2.6E3 111.0072 6.7E3 111.0438 1.0E5 121.0077 2.4E4 121.0282 4.5E6 121.0389 2.5E5 121.0450 9.5E3 121.0490 3.9E4 122.5356 2.7E3 125.0239 4.4E3 135.1947 2.8E3 149.9378 2.4E3 152.9889 5.0E4 153.0181 8.1E6 153.0406 1.2E4 153.0458 8.2E4 153.0559 1.6E4 171.0290 5.2E4 173.0596 2.6E3 173.5275 3.8E4 173.5421 1.3E4 205.0501 7.7E3 212.6734 2.6E3 218.5984 3.2E3 229.0500 2.4E4 240.3851 2.5E3 247.0337 3.3E3 247.0607 6.8E4 END IONS BEGIN IONS FEATURE_ID=141 PEPMASS=409.1136 SCANS=141 RTINSECONDS=212.812 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 2 (0 removed due to low quality, 0 removed due to low cosine). 58.6885 2.1E3 60.1030 2.6E3 61.0285 2.1E3 64.4554 2.7E3 66.5476 2.1E3 69.0336 7.1E3 85.0283 4.1E4 97.0282 1.4E4 99.2551 2.1E3 121.0283 1.6E5 127.0383 6.1E3 147.0440 1.4E4 150.8861 2.4E3 153.0181 2.4E5 165.0180 1.4E4 168.2879 2.1E3 171.0288 5.7E3 173.5301 2.3E4 177.0181 9.3E3 177.0545 7.5E3 183.0291 8.1E3 191.0340 7.9E3 195.0287 5.2E4 201.7989 2.6E3 218.9709 2.7E3 219.0289 2.6E4 231.0289 3.2E4 233.0246 3.8E3 247.0599 2.4E5 249.0384 3.0E3 259.0594 4.3E3 261.0395 9.7E3 271.0605 7.2E3 303.8534 2.5E3 313.0708 8.6E3 325.0741 3.7E3 329.8231 2.9E3 END IONS BEGIN IONS FEATURE_ID=142 PEPMASS=409.9937 SCANS=142 RTINSECONDS=213.036 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 54.2007 2.3E3 54.9968 2.3E3 55.3130 2.2E3 55.6421 2.1E3 55.9342 1.7E4 61.1968 2.4E3 66.9844 2.3E3 68.7011 2.2E3 70.4178 2.1E3 83.8696 2.1E3 85.7303 2.6E3 87.3365 2.2E3 91.0543 5.2E3 102.5850 2.7E3 112.7082 2.7E3 119.0489 2.3E4 121.0283 3.7E3 139.9025 2.7E3 142.7917 2.4E3 144.9578 1.4E4 145.7456 2.4E3 147.0311 3.7E3 147.0438 2.0E5 153.0180 1.0E4 154.0208 2.8E3 157.9658 1.8E4 173.5285 4.7E4 173.5370 1.5E4 173.5455 7.9E3 183.2450 2.7E3 191.9865 3.3E4 195.0294 3.1E3 205.9662 3.2E3 217.9660 2.5E4 218.9740 9.9E4 219.9819 8.5E4 233.9611 3.1E4 233.9948 2.3E3 235.9767 2.1E4 236.9845 7.6E3 238.3704 2.5E3 245.9967 6.8E3 248.0632 1.1E4 253.9875 8.1E3 259.9774 3.4E3 260.4922 2.4E3 272.9838 9.5E3 275.3158 2.2E3 275.9712 5.9E3 277.4247 2.4E3 280.3449 2.8E3 300.4684 2.8E3 387.9157 2.6E3 END IONS BEGIN IONS FEATURE_ID=143 PEPMASS=419.0095 SCANS=143 RTINSECONDS=213.036 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 57.0697 7.4E3 59.3210 2.4E3 65.0383 1.0E4 66.8657 2.3E3 69.0580 2.6E3 71.0852 2.1E4 79.8206 2.5E3 80.2780 2.2E3 85.1008 8.2E3 91.0539 6.2E4 92.4205 2.4E3 97.8815 2.4E3 116.9658 1.4E4 117.4883 2.2E3 119.0392 3.3E3 119.0488 2.1E5 120.7906 2.4E3 138.2088 2.2E3 140.9920 2.2E3 147.0437 2.2E6 147.0547 3.0E4 147.0709 1.0E4 148.0471 2.4E4 149.0230 3.7E4 173.5279 2.9E4 173.5404 2.0E4 219.0127 1.7E4 244.9923 6.0E4 263.0027 7.0E3 268.9927 6.3E4 276.9979 3.0E3 280.9929 2.5E3 287.0034 1.0E5 295.0086 2.7E4 301.0217 7.0E3 310.3882 2.3E3 363.0409 2.6E3 365.7575 2.8E3 END IONS BEGIN IONS FEATURE_ID=144 PEPMASS=455.9990 SCANS=144 RTINSECONDS=213.036 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 57.0023 2.2E3 58.4594 2.2E3 59.5752 2.7E3 65.0385 6.4E3 70.8279 2.4E3 71.7365 2.8E3 79.0255 2.5E3 88.9674 2.1E3 91.0539 5.5E4 92.9269 2.1E3 107.2258 2.4E3 113.0487 2.2E3 116.3643 2.4E3 118.4306 2.3E3 119.0488 1.8E5 121.6823 3.2E3 123.2154 2.4E3 125.7540 2.4E3 126.5184 2.5E3 131.9499 3.3E3 138.2978 2.3E3 144.9580 1.7E4 146.0345 2.5E3 147.0437 1.8E6 147.0549 2.6E4 147.0710 3.5E3 157.9659 4.8E4 165.9696 2.8E3 166.8077 2.5E3 173.5225 4.7E3 173.5291 4.8E4 173.5436 1.5E4 173.9605 6.3E3 190.0522 2.7E3 191.9866 3.4E4 196.9908 8.7E3 197.1947 2.4E3 205.9672 5.5E3 209.9972 2.8E3 217.9660 3.5E4 218.9741 6.6E4 219.9818 8.0E4 223.0050 2.8E3 223.9781 7.7E3 233.9609 3.4E4 234.9680 1.2E4 235.9767 4.3E4 236.9842 3.0E3 245.9968 2.5E4 253.9872 9.9E3 256.1036 2.6E3 259.9766 7.7E4 263.0544 1.5E4 272.9845 3.5E4 275.9715 6.5E4 277.9872 5.3E3 285.9925 5.4E4 300.0637 2.5E3 320.5389 2.8E3 362.7065 2.6E3 379.3559 2.2E3 454.9697 2.2E3 456.1576 1.6E4 END IONS BEGIN IONS FEATURE_ID=145 PEPMASS=757.0732 SCANS=145 RTINSECONDS=213.036 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 76.4324 2.5E3 76.9254 2.3E3 81.5516 2.2E3 81.5862 2.3E3 89.6715 2.4E3 91.0539 2.9E4 92.6670 2.2E3 93.7016 2.3E3 108.9948 2.3E3 118.9713 1.4E4 119.0488 7.1E4 123.6739 2.3E3 125.0155 2.2E3 141.1255 2.4E3 147.0437 9.1E5 147.0550 1.4E4 147.0635 3.9E3 148.0471 1.3E4 166.9838 2.3E3 173.5243 1.1E4 173.5348 6.0E4 173.5431 4.7E3 176.0181 2.9E3 193.3879 3.1E3 194.7110 3.0E3 202.1222 2.3E3 209.0187 1.2E4 221.6067 2.2E3 224.9895 3.3E3 231.1089 2.5E3 234.9720 3.7E3 236.7049 2.5E3 244.9930 3.0E3 259.8249 2.7E3 263.0020 3.4E3 268.9767 1.5E4 287.0030 3.6E4 291.0224 2.8E3 296.9727 9.8E3 307.4218 2.4E3 311.0044 6.5E3 314.9809 5.9E3 328.8299 2.5E3 329.0129 3.4E3 336.3464 3.0E3 373.0042 9.6E3 397.0037 6.4E3 415.0159 4.6E3 425.0004 2.8E3 443.0093 1.5E4 444.9500 2.4E3 465.9662 2.4E3 544.9235 2.6E3 624.1885 3.4E3 708.6534 2.6E3 758.9238 3.0E3 END IONS BEGIN IONS FEATURE_ID=146 PEPMASS=339.0714 SCANS=146 RTINSECONDS=213.218 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 51.7273 2.6E3 54.9461 2.5E3 58.7030 2.5E3 58.7851 2.5E3 60.4448 2.6E3 64.3486 2.3E3 65.0384 7.8E3 67.8790 2.3E3 68.6594 2.2E3 70.1907 2.2E3 71.9698 2.3E3 77.0277 2.2E3 77.1608 2.5E3 83.0125 5.5E3 90.2458 2.1E3 91.0539 1.1E5 111.0067 2.4E3 119.0393 1.4E4 119.0488 4.2E5 119.0572 2.3E3 119.0591 5.6E3 127.0919 2.3E3 131.6525 2.6E3 138.9929 2.3E3 145.2647 2.6E3 147.0437 2.6E6 147.0547 3.9E4 147.0708 2.0E4 149.6880 6.0E3 162.4716 2.4E3 165.5731 2.5E3 168.9438 2.3E3 173.5204 2.6E3 173.5287 4.7E4 173.5464 7.2E3 175.4473 2.2E3 190.0921 2.6E3 256.2758 2.4E3 260.6013 2.6E3 266.6696 2.6E3 278.8934 2.5E3 303.3950 2.6E3 344.8270 2.3E3 END IONS BEGIN IONS FEATURE_ID=147 PEPMASS=379.0640 SCANS=147 RTINSECONDS=213.218 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 2 (0 removed due to low quality, 0 removed due to low cosine). 63.6985 2.5E3 66.2890 2.8E3 72.2081 2.3E3 82.9731 2.5E3 91.0542 1.2E4 99.3719 2.5E3 119.0489 6.9E4 136.3909 2.3E3 147.0439 1.1E6 149.2044 2.5E3 164.4899 2.8E3 169.0116 3.0E3 169.0260 1.8E5 169.0424 4.4E3 173.5296 1.7E4 173.5397 1.0E4 175.6143 2.5E3 178.5082 2.2E3 179.5828 2.4E3 187.0208 8.6E3 190.4418 2.1E3 215.0161 1.6E4 222.3203 2.3E3 224.9386 2.7E3 233.0267 7.9E5 233.6636 2.8E3 247.6314 2.7E3 336.4727 2.4E3 END IONS BEGIN IONS FEATURE_ID=148 PEPMASS=735.1381 SCANS=148 RTINSECONDS=213.218 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 70.9072 2.6E3 101.9177 2.1E3 107.1544 2.3E3 108.7593 2.3E3 114.3647 2.4E3 116.0261 2.2E3 119.0489 4.2E3 119.8148 2.3E3 141.0531 2.2E3 147.0310 8.8E3 147.0437 2.2E5 149.6807 4.1E3 149.6909 4.0E3 169.0104 7.6E3 169.0258 1.7E5 173.5254 4.6E4 173.5419 2.7E4 215.0164 2.6E4 227.2467 2.4E3 233.0267 7.4E5 233.0544 9.1E3 247.0460 6.4E3 259.0466 2.5E3 265.0558 1.1E4 280.5700 2.5E3 304.6193 2.9E3 351.0688 6.7E3 361.0500 1.2E4 379.0641 1.5E5 396.0260 2.6E3 461.1630 2.7E3 487.7682 2.8E3 519.9175 2.4E3 END IONS BEGIN IONS FEATURE_ID=149 PEPMASS=766.0680 SCANS=149 RTINSECONDS=213.218 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 74.1167 2.6E3 78.8428 2.1E3 90.9472 2.6E3 91.0539 2.2E4 95.0244 2.4E3 95.9446 2.6E3 98.0821 2.5E3 108.3395 2.4E3 109.9575 2.6E3 111.4339 2.2E3 119.0488 5.2E4 127.9549 4.7E3 131.9504 1.6E4 138.5656 2.7E3 139.9569 2.4E3 144.9581 2.1E4 145.9658 4.5E3 147.0437 8.9E5 147.0549 7.7E3 149.6817 3.5E3 149.6920 5.4E3 157.9532 2.4E3 157.9658 3.9E4 172.5994 2.7E3 173.5286 4.9E4 173.5367 7.3E3 173.5459 4.3E3 173.9611 1.9E4 174.9692 3.0E3 175.5166 2.7E3 179.3316 2.8E3 187.9393 3.0E3 189.9558 2.3E4 191.9867 2.3E4 197.9616 5.7E3 201.9550 8.6E3 217.9504 8.6E3 218.9741 3.5E4 219.9818 4.1E4 222.9292 2.6E3 233.9610 1.8E4 234.9686 1.9E4 235.9761 1.5E4 245.9970 3.6E4 253.9875 9.3E3 259.9764 1.5E5 260.9845 4.4E4 261.9934 5.8E3 263.9559 7.5E3 272.9845 1.1E5 273.9929 3.4E3 275.9717 8.9E4 277.9870 4.5E4 278.9951 1.7E4 285.9926 1.3E5 287.4592 2.4E3 287.8995 2.4E3 288.9788 7.0E3 290.9967 3.2E3 295.9964 3.9E3 300.0316 2.4E3 301.9851 3.2E3 305.9691 1.6E4 320.0021 2.5E3 323.9794 2.6E3 327.5147 2.7E3 339.9642 2.3E3 346.7404 2.4E3 364.0036 3.9E3 365.0104 1.0E4 372.6197 2.5E3 374.9796 1.7E4 382.0119 9.3E3 392.9902 1.5E4 411.0014 1.4E4 452.9138 2.5E3 529.9904 2.4E3 573.0873 2.5E3 769.1277 2.7E3 END IONS BEGIN IONS FEATURE_ID=150 PEPMASS=357.0819 SCANS=150 RTINSECONDS=213.409 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 53.8413 2.5E3 54.0694 2.3E3 54.2185 2.3E3 57.7908 2.6E3 65.0382 2.4E4 71.5396 2.6E3 73.5526 2.3E3 73.8249 2.3E3 76.8088 2.5E3 79.5113 2.1E3 81.4052 2.5E3 91.0539 2.0E5 98.0710 2.3E3 98.4463 2.3E3 119.0392 3.6E3 119.0488 3.5E5 119.0591 5.8E3 131.4403 2.7E3 134.5612 2.4E3 147.0437 1.5E6 147.0548 2.0E4 148.0471 5.9E3 149.2217 2.2E3 158.5787 2.7E3 158.9215 2.5E3 173.5280 3.7E4 173.5424 5.6E3 175.0169 2.2E3 185.0201 2.2E3 185.0337 2.3E3 208.3489 2.3E3 224.6458 2.8E3 231.8760 2.5E3 268.0177 2.5E3 284.8706 2.6E3 307.5044 2.5E3 331.7935 2.6E3 END IONS BEGIN IONS FEATURE_ID=151 PEPMASS=450.1978 SCANS=151 RTINSECONDS=213.811 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 5 (0 removed due to low quality, 0 removed due to low cosine). 57.0333 4.8E4 59.0491 1.3E4 60.0441 8.0E3 61.0282 6.7E3 61.3166 2.3E3 68.0204 2.2E3 69.0332 3.4E5 72.0662 2.3E3 73.0276 2.9E3 74.5459 2.5E3 75.0437 3.0E3 81.0333 1.2E4 85.0225 3.4E3 85.0280 3.2E5 87.0437 4.1E5 91.0389 8.3E3 97.0281 4.8E5 99.0437 1.5E4 101.2126 2.4E3 103.0385 3.3E3 107.0487 3.4E3 109.0282 1.4E4 111.0446 3.0E3 112.5754 2.6E3 114.8633 2.3E3 115.0306 3.2E3 115.0386 5.4E5 115.0495 1.3E4 115.0529 3.6E3 117.0696 7.2E3 117.3617 2.3E3 121.0645 1.5E5 122.0665 2.3E3 124.5725 2.2E3 125.2111 3.0E3 127.0385 6.0E4 132.0596 2.3E3 133.0492 2.4E5 135.0806 7.0E3 139.0388 3.3E3 141.2839 2.4E3 145.0494 6.7E4 145.0645 1.8E5 145.8905 2.8E3 147.0440 1.4E4 149.6808 3.3E3 149.6912 4.3E3 150.0758 5.5E4 153.8347 2.8E3 156.7647 2.7E3 159.0800 1.8E4 163.0752 1.2E5 169.0496 8.2E3 171.0823 2.7E3 173.5260 5.3E4 173.5362 5.1E3 173.5443 1.0E4 175.0604 2.9E3 175.0753 1.0E5 177.0545 3.7E3 182.8376 2.2E3 187.0753 6.5E4 187.5555 3.1E3 200.1380 2.7E3 201.0922 2.9E3 205.0863 3.1E4 205.7985 3.1E3 217.0862 1.3E5 222.1994 2.3E3 229.0854 3.1E3 229.2977 2.6E3 235.0963 3.3E3 237.9204 2.5E3 246.3482 2.5E3 258.9294 2.4E3 258.9884 5.7E3 271.0973 1.7E4 277.0886 5.5E3 288.1234 2.0E4 361.7150 2.5E3 386.8173 2.3E3 421.9012 3.0E3 433.2141 2.6E3 END IONS BEGIN IONS FEATURE_ID=152 PEPMASS=265.1549 SCANS=152 RTINSECONDS=215.116 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 14 (10 removed due to low quality, 0 removed due to low cosine). 48.7784 4.2E3 49.1123 2.5E3 49.6232 5.2E3 51.4317 3.8E3 53.8498 3.3E3 55.0541 4.4E4 55.0871 4.3E3 55.1018 2.7E3 60.1038 3.6E3 60.1913 4.6E3 60.8120 2.1E3 62.0159 4.3E3 63.0235 3.5E4 63.5681 4.4E3 68.5801 3.1E3 69.3965 2.4E3 70.0653 5.2E3 72.0806 1.8E6 72.0851 1.3E4 72.0873 7.5E3 73.8397 2.4E3 78.0463 1.4E4 78.7731 5.2E3 78.7939 5.3E3 87.1961 3.6E3 89.0326 9.9E3 89.0384 3.9E5 89.1070 4.2E5 91.0542 1.5E4 95.0490 3.8E3 98.0598 1.7E5 100.4994 5.3E3 101.3165 5.0E3 103.0546 7.0E3 103.5708 4.8E3 106.0408 1.8E4 114.0913 2.7E4 115.0864 6.2E4 117.0238 4.5E3 117.0333 2.0E6 117.0417 7.0E3 117.0426 1.7E4 119.0491 2.1E4 120.1591 4.9E3 124.0522 5.5E3 129.0446 1.2E4 134.0363 9.6E4 135.0439 1.2E5 145.0282 1.8E7 145.0389 2.4E5 145.0551 1.4E5 145.0630 4.8E4 147.0439 3.3E4 149.0460 2.3E4 149.0596 1.0E6 149.0706 6.3E3 149.0739 1.6E4 152.0703 2.0E4 154.4987 6.4E3 162.0312 3.5E4 163.0390 1.6E5 173.5251 2.8E4 173.5374 4.5E4 177.0075 1.6E4 177.0180 1.5E5 177.0263 9.9E4 177.0547 2.5E7 177.0836 5.3E4 177.0910 2.2E5 177.1018 6.4E4 177.1109 9.3E3 186.0550 1.1E5 206.1173 3.0E4 214.2516 6.0E3 248.1287 2.5E5 END IONS BEGIN IONS FEATURE_ID=153 PEPMASS=300.1599 SCANS=153 RTINSECONDS=217.217 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 5 (2 removed due to low quality, 0 removed due to low cosine). 55.0179 1.8E4 56.0495 2.8E4 57.0573 1.3E4 57.1189 4.2E3 58.0652 7.2E6 58.0679 5.2E4 58.0718 2.7E4 58.0739 7.1E3 65.2691 2.5E3 68.3006 5.4E3 70.0654 9.2E3 70.7689 5.8E3 71.0728 1.6E5 72.0807 1.4E5 75.0374 9.4E3 75.0417 5.1E3 77.0386 1.1E4 79.0541 2.5E4 80.5819 4.8E3 82.1859 4.5E3 85.4854 3.9E3 89.0595 1.4E4 91.0541 5.8E4 93.0697 2.9E4 95.0491 7.2E4 103.0542 7.1E3 105.0439 2.9E3 105.0698 2.4E4 107.0319 5.5E4 107.0490 8.6E6 107.0576 1.1E5 107.0626 2.7E4 107.0660 8.3E4 115.0542 3.3E5 117.0698 7.0E4 119.0490 2.0E5 121.0283 3.1E4 121.0647 8.6E5 121.0757 8.8E3 123.0439 1.1E6 123.0533 1.7E4 123.0806 5.2E3 131.0489 6.8E4 131.8578 2.6E3 133.0647 1.4E5 135.0440 1.7E5 135.0808 1.3E4 136.0515 2.4E4 137.0596 3.5E5 138.9093 2.5E3 140.5527 5.4E3 143.0490 1.8E6 145.0647 1.1E6 145.0744 8.1E3 145.0784 2.0E4 146.0725 3.3E4 147.0439 3.9E4 147.0803 2.2E5 148.0515 2.9E4 149.0595 1.6E5 149.0834 4.7E4 151.0754 4.6E4 155.0604 5.0E3 157.0646 3.7E4 161.0596 1.8E6 162.0674 1.5E4 163.0753 3.6E5 166.0784 5.1E3 171.0808 5.8E3 173.5259 4.0E4 173.5409 2.4E4 175.0753 2.5E4 176.1069 3.8E4 178.0861 1.1E5 179.0941 1.6E5 180.1019 2.1E5 181.0646 2.5E4 181.1015 3.7E4 182.3112 2.7E3 183.0806 1.9E4 191.0858 5.4E4 192.1016 1.0E4 193.1096 1.9E5 194.0728 4.8E4 194.1179 5.2E3 195.0804 2.4E4 199.0755 7.7E3 199.1128 6.1E3 202.9053 5.8E3 206.1177 5.3E4 209.0600 3.5E4 209.0962 3.4E5 210.0679 1.1E4 211.0756 2.3E4 211.1119 1.3E5 219.0802 7.5E4 221.0951 1.9E4 226.0624 8.6E4 227.0704 3.0E4 227.1068 5.6E4 228.0779 1.5E4 229.1223 6.1E3 237.0695 4.3E3 237.0909 5.9E5 239.1066 1.1E5 240.0780 7.4E4 251.1051 1.2E4 253.0840 9.6E3 253.1223 6.1E3 255.1014 3.2E6 257.1170 5.1E5 257.1477 1.0E4 267.4334 4.4E3 269.1166 3.7E4 271.1328 1.5E4 282.1500 2.8E4 285.1362 1.8E4 300.1594 5.3E6 300.2380 2.3E4 END IONS BEGIN IONS FEATURE_ID=154 PEPMASS=298.1444 SCANS=154 RTINSECONDS=217.409 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 48.4474 2.7E3 51.9305 2.4E3 56.0495 2.8E3 58.0611 4.8E3 58.0650 2.2E6 58.0683 2.4E4 58.0700 1.9E4 58.0716 1.0E4 62.6779 2.5E3 65.2786 2.5E3 80.3027 2.2E3 88.8632 2.3E3 92.5283 2.2E3 99.5976 2.3E3 101.3016 2.7E3 107.0488 2.0E4 110.3571 2.3E3 121.2076 2.7E3 132.0998 2.3E3 160.8352 3.2E3 166.8000 2.4E3 173.5305 3.7E4 174.9025 3.1E3 191.0937 2.5E4 192.1028 3.2E3 218.8908 2.6E3 229.3101 3.0E3 241.9635 3.0E3 243.0233 2.6E3 246.7669 2.4E3 246.8861 3.6E3 253.0867 2.6E3 260.0946 2.4E3 271.9649 2.6E3 282.4151 2.4E3 298.1443 2.9E3 END IONS BEGIN IONS FEATURE_ID=155 PEPMASS=290.1028 SCANS=155 RTINSECONDS=218.739 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 47.0323 2.6E3 52.2380 2.5E3 55.1975 2.2E3 56.4300 2.2E3 60.2955 2.8E3 61.1839 2.2E3 67.4965 2.2E3 68.0821 2.5E3 73.3916 2.7E3 74.2333 2.4E3 81.0333 2.2E4 91.0539 9.3E4 109.0285 9.7E3 109.0645 8.8E3 116.4243 2.7E3 119.0420 2.4E3 119.0488 6.8E4 127.0386 2.0E4 131.7611 3.1E3 134.8543 2.4E3 137.0231 1.1E6 137.0335 1.9E4 137.0594 1.1E6 137.0696 1.6E4 138.0259 2.4E3 149.1252 2.3E3 154.0497 1.6E4 154.0859 5.5E4 173.5247 8.8E3 173.5384 2.5E4 184.1827 2.5E3 190.0264 3.8E3 193.2626 2.3E3 197.0521 2.5E3 205.0500 5.1E3 215.9494 2.2E3 219.5845 2.1E3 229.0266 2.4E3 230.5338 2.4E3 281.6719 2.3E3 294.1178 2.7E3 END IONS BEGIN IONS FEATURE_ID=156 PEPMASS=355.1024 SCANS=156 RTINSECONDS=219.07 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 58.7283 2.2E3 58.7640 2.6E3 67.0539 4.6E3 67.3909 2.5E3 78.3452 2.5E3 79.0539 1.6E4 80.7630 2.4E3 81.3480 2.3E3 83.0489 1.9E4 85.0281 2.6E3 89.0382 1.2E5 93.0334 2.9E3 95.0489 1.2E4 98.6424 2.6E3 104.7165 2.3E3 107.0488 3.7E4 111.0437 2.1E4 115.8552 2.9E3 116.2621 2.3E3 117.0332 1.2E5 117.8352 2.3E3 129.0432 3.1E3 131.8802 2.5E3 134.0350 2.8E3 135.0439 3.5E5 135.0558 6.9E3 145.0282 4.8E5 145.0388 3.0E3 150.5358 2.8E3 163.0071 3.0E4 163.0388 4.6E6 163.0634 7.4E3 163.0696 4.4E4 173.5233 8.2E3 173.5333 3.1E4 173.5417 9.5E3 175.9650 2.7E3 181.0500 9.3E3 219.6584 2.3E3 258.8632 3.2E3 308.9009 1.5E4 336.3250 3.1E3 351.9253 2.7E3 362.1186 2.6E3 END IONS BEGIN IONS FEATURE_ID=157 PEPMASS=613.1765 SCANS=157 RTINSECONDS=219.174 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 6 (0 removed due to low quality, 0 removed due to low cosine). 70.1609 2.1E3 76.5092 2.6E3 79.0791 2.3E3 79.3535 2.2E3 81.5201 2.7E3 82.3366 2.1E3 83.3419 2.6E3 85.0280 7.3E3 85.5958 2.4E3 86.1233 2.2E3 86.3580 2.3E3 86.9135 2.7E3 87.0220 2.3E3 88.5295 2.2E3 90.7855 2.3E3 90.9606 2.4E3 91.1450 2.2E3 91.7711 2.1E3 101.6179 2.2E3 101.9209 2.2E3 114.8699 2.3E3 121.0187 7.0E3 121.0280 3.6E5 121.0377 2.5E3 124.3878 2.4E3 128.2175 2.3E3 129.2276 2.4E3 131.5656 2.5E3 134.3294 2.8E3 136.2231 2.3E3 137.7190 2.4E3 138.2733 2.8E3 147.0444 3.1E3 155.2007 2.3E3 163.0387 1.0E5 169.7392 2.2E3 173.5273 7.4E4 173.5420 1.2E4 175.0387 6.9E3 177.0188 2.9E3 181.0492 3.6E3 181.2068 2.4E3 193.0487 7.1E3 195.0285 5.7E3 205.0495 3.1E4 207.0284 2.1E4 217.0492 4.6E4 217.4559 2.3E3 219.0285 3.8E4 224.2575 2.6E3 229.0494 1.3E4 231.0288 3.9E4 233.0441 3.1E3 235.0600 1.3E4 237.0397 1.1E4 241.0492 8.5E3 243.0285 1.6E4 245.0425 3.7E3 247.0606 3.7E4 249.0386 1.7E4 255.0639 2.6E3 255.1827 2.5E3 259.0297 2.6E3 259.0595 5.1E4 261.0389 9.4E4 261.2297 2.3E3 265.0708 4.4E3 269.0879 2.6E3 271.0604 3.7E4 273.0397 4.6E4 273.0708 2.6E3 274.2708 2.4E3 277.0701 6.8E3 279.0502 9.3E3 283.0608 1.3E4 285.0399 6.1E4 285.0717 5.8E3 291.0502 6.7E4 295.0600 3.0E4 297.0379 4.1E3 301.0705 3.1E4 303.0500 4.7E4 307.0603 2.2E4 309.0615 1.3E4 313.0712 4.1E4 315.0505 3.0E4 319.0804 2.7E3 321.0608 3.5E4 325.0706 6.7E4 327.0504 6.1E4 331.0814 1.1E4 337.0706 6.4E4 339.0697 4.6E4 343.0811 9.8E3 345.0606 6.1E4 349.0720 4.0E4 355.0814 2.9E4 357.0613 1.9E4 361.0706 1.4E4 363.0728 3.0E4 367.0803 1.0E4 369.0617 6.9E3 375.0734 3.6E4 379.0822 6.6E4 385.5396 2.6E3 387.0714 1.7E4 391.0821 4.4E4 393.0827 2.7E4 403.0821 2.1E4 405.0832 3.5E4 409.0916 3.8E4 421.0928 1.7E4 423.0918 2.3E4 427.1014 9.3E3 433.0918 8.8E3 437.8033 2.4E3 439.1016 1.2E4 441.1034 3.9E3 445.0936 8.2E3 457.1072 1.7E4 460.6629 2.6E3 463.1004 7.4E3 481.1116 3.2E3 493.3654 2.6E3 512.2781 2.4E3 517.6235 2.5E3 541.7327 2.8E3 END IONS BEGIN IONS FEATURE_ID=158 PEPMASS=326.1396 SCANS=158 RTINSECONDS=220.326 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 5 (0 removed due to low quality, 0 removed due to low cosine). 51.9850 2.5E3 53.0657 2.7E3 56.0493 3.0E4 57.4488 2.6E3 58.0611 2.0E4 58.0652 1.2E7 58.0701 7.2E4 58.0717 3.5E4 58.0736 1.3E5 58.0737 1.9E4 58.0757 8.1E3 58.0816 4.0E3 58.5126 2.6E3 63.5846 2.3E3 70.1742 2.2E3 75.1392 2.6E3 75.5070 2.5E3 78.9271 2.6E3 81.5284 2.4E3 89.2209 2.8E3 90.8023 2.3E3 101.2247 2.5E3 106.0740 2.6E3 109.3327 2.3E3 110.9441 2.5E3 139.7337 2.4E3 141.9400 2.4E3 147.7599 3.4E3 156.0029 2.1E3 173.5277 6.0E4 173.5424 1.1E4 174.6651 2.4E3 176.1559 2.4E3 179.6946 2.5E3 183.0811 3.2E3 195.0805 3.3E3 209.0730 2.1E3 216.9817 2.6E3 223.0760 1.9E4 224.0818 2.6E3 224.5067 2.1E3 225.0910 1.4E4 226.0636 1.2E4 227.1068 1.8E4 240.0790 9.3E3 253.0860 6.5E4 255.1015 2.6E5 255.1299 6.8E3 266.1171 3.2E3 274.8801 5.2E3 283.0968 7.4E4 298.1053 1.0E4 298.1441 3.8E5 311.1160 3.0E4 311.9157 2.5E3 326.1389 2.2E5 326.1762 3.0E3 END IONS BEGIN IONS FEATURE_ID=159 PEPMASS=327.1434 SCANS=159 RTINSECONDS=220.326 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 5 (0 removed due to low quality, 0 removed due to low cosine). 49.8031 2.4E3 54.3538 2.4E3 56.0494 2.6E3 58.0650 2.6E6 58.0683 2.2E4 58.0701 1.7E4 58.0718 7.2E3 59.0619 1.5E4 59.0680 4.6E5 59.0716 4.4E3 62.1013 2.5E3 63.9267 2.3E3 64.4848 2.2E3 66.7707 2.3E3 67.2163 2.1E3 67.2387 2.3E3 76.2363 2.3E3 78.0897 2.5E3 85.9901 2.7E3 89.5487 2.3E3 94.6932 2.2E3 97.0286 2.8E3 99.8364 2.4E3 105.5844 2.5E3 108.9413 2.5E3 133.8522 3.1E3 134.5565 2.9E3 137.6632 2.6E3 141.7628 2.5E3 156.8802 2.7E3 164.0332 4.6E3 168.5974 2.4E3 172.2004 2.2E3 173.5238 7.9E3 173.5354 5.6E4 175.8678 2.4E3 176.9032 2.4E3 190.2055 2.3E3 211.7594 2.6E3 219.8968 2.8E3 221.6019 2.7E3 223.0750 3.0E3 231.8956 2.4E3 233.3861 2.6E3 239.0702 2.0E4 250.0622 2.7E3 251.0702 3.2E4 253.0604 5.5E3 254.0921 2.6E4 255.1007 6.6E3 256.1053 5.3E4 265.4041 2.6E3 281.0561 7.6E3 282.0864 2.8E3 283.0969 1.5E4 284.1009 1.1E4 299.0635 3.1E3 299.1474 7.7E4 312.1185 5.9E3 322.1544 2.7E3 327.1426 5.1E4 END IONS BEGIN IONS FEATURE_ID=160 PEPMASS=328.1549 SCANS=160 RTINSECONDS=220.326 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 51.0831 9.9E3 56.0496 4.5E3 57.6337 4.4E3 58.0651 4.6E6 58.0681 3.3E4 58.0719 1.4E4 58.4600 7.7E3 59.0684 3.9E4 62.7661 1.2E5 62.7694 2.8E4 63.8544 9.6E3 64.1672 3.7E3 68.1292 9.8E3 70.6242 1.1E4 70.7717 1.9E4 70.7752 8.3E4 72.0805 6.2E4 80.1993 3.9E3 83.5799 8.5E3 89.0218 5.5E3 126.3834 3.9E3 129.1060 1.1E4 136.5359 4.2E3 146.3607 1.0E4 154.2297 8.2E3 157.5332 1.0E4 167.0854 6.7E4 168.4172 4.9E3 173.5260 4.2E4 173.5358 6.9E4 176.0637 5.4E4 177.0702 8.8E4 181.0651 4.3E4 191.0849 1.4E4 195.0807 1.3E5 197.0599 1.7E4 205.0650 1.1E6 205.0857 1.8E4 207.0804 2.3E4 209.0605 3.8E4 209.0959 3.7E4 212.0834 2.5E4 219.0810 4.3E4 222.0681 4.0E3 223.0497 2.4E4 223.0756 3.3E6 225.0562 6.4E3 225.0917 4.8E4 226.0628 2.6E5 227.0704 1.9E5 227.1066 6.1E3 232.0127 1.0E4 233.0598 2.4E6 233.0983 1.6E4 235.0750 6.2E4 237.0912 1.5E5 239.0682 1.7E4 240.0781 1.3E5 250.0629 3.6E4 250.9905 3.7E4 251.0084 2.3E5 251.0223 1.7E5 251.0702 3.8E7 251.1189 1.4E5 251.1320 2.6E5 251.1484 5.0E4 252.0776 2.3E4 253.0858 4.0E5 255.1017 2.2E5 261.0650 3.6E4 265.0858 1.4E5 267.1024 2.2E4 268.0731 1.7E6 270.0887 1.6E4 282.0885 1.9E4 283.0016 3.6E4 283.0232 1.6E5 283.0389 1.3E5 283.0968 2.3E7 283.1555 1.2E5 283.1705 1.7E5 283.1903 3.6E4 285.1125 1.6E5 326.5881 1.0E4 328.1546 7.6E5 328.2000 6.8E3 END IONS BEGIN IONS FEATURE_ID=161 PEPMASS=314.1757 SCANS=161 RTINSECONDS=220.98 CHARGE=1+ MSLEVEL=2 MERGED_STATS=8 / 10 (2 removed due to low quality, 0 removed due to low cosine). 49.5032 9.0E4 51.0490 6.2E4 51.8247 3.7E4 52.7599 2.1E4 56.0495 1.4E6 56.6914 9.8E3 58.0430 2.7E4 58.0565 3.3E4 58.0653 5.1E8 58.0704 1.6E6 58.0718 1.1E6 58.0737 4.0E5 58.0745 3.5E6 58.0757 2.3E5 59.9036 5.9E4 61.1504 1.0E5 62.1570 3.6E4 66.7051 4.0E4 67.8759 6.4E4 68.1447 6.1E4 68.5942 2.4E4 68.8578 8.8E3 69.2896 3.8E4 71.0727 1.7E5 72.0808 7.5E5 73.9382 4.0E4 74.3865 9.0E4 74.7939 1.0E5 75.5190 5.9E4 75.9009 1.0E4 78.5415 2.5E4 86.4878 1.0E5 91.0542 9.2E5 93.0699 6.0E5 94.4521 3.6E4 95.0320 4.8E4 95.0491 1.2E6 95.8317 7.6E4 98.9748 2.9E4 99.6189 1.1E4 100.1562 3.7E4 101.6562 8.7E4 103.0544 2.7E5 104.8052 2.5E4 105.0452 3.0E4 107.0491 1.3E8 107.0551 6.6E5 107.0658 3.7E5 109.0646 1.2E5 114.7328 8.7E3 115.0542 2.9E6 117.0698 1.9E6 119.0491 2.1E6 119.0857 4.1E5 121.0647 2.5E7 121.0730 7.8E4 124.1619 4.1E4 125.0593 3.8E5 125.9157 1.2E5 131.0491 2.6E6 133.0647 1.2E6 135.0445 3.9E4 135.0806 4.6E4 137.0480 1.4E5 137.0596 1.9E7 142.9211 8.0E4 143.0363 1.5E5 143.0491 1.4E7 143.0593 5.1E4 144.0570 3.3E5 145.0515 4.4E5 145.0647 2.1E7 145.0751 9.5E4 145.0783 3.8E5 147.0437 1.4E5 147.0804 7.0E6 147.2738 9.4E3 149.0596 1.3E6 151.0753 9.1E6 151.0890 3.1E4 157.0647 5.2E5 160.0519 2.4E6 161.0598 5.0E5 161.0968 4.4E4 162.0676 1.9E6 163.0754 5.6E6 165.0701 4.4E4 165.0911 9.1E5 167.0868 8.4E4 172.1818 1.1E5 172.6217 1.0E4 173.5219 7.6E4 173.5324 1.9E6 173.5388 4.7E5 175.0574 3.9E5 175.0755 3.5E7 176.0834 8.4E5 176.1070 7.8E5 177.0739 2.9E4 177.0911 7.7E6 178.0867 7.6E5 181.0652 4.8E5 181.1011 8.6E5 182.0732 4.0E4 183.0808 8.1E5 189.0909 5.1E5 191.0859 1.3E6 192.1021 5.2E6 193.1095 3.3E6 194.0731 1.0E6 194.1175 3.2E6 195.0804 5.9E5 196.0886 7.4E4 197.0620 5.1E4 197.0961 3.3E5 199.7913 1.1E4 206.1182 1.1E4 207.1257 2.2E6 209.0618 2.4E5 209.0963 1.2E7 210.0675 7.6E4 211.0757 1.0E6 211.1120 6.4E6 219.0806 2.1E6 220.1325 1.2E5 221.0965 7.2E5 223.1119 2.4E5 225.1278 6.6E5 235.1113 7.4E4 236.0832 7.9E4 237.0911 3.6E7 237.1311 1.1E5 238.0990 1.1E6 239.0661 2.5E4 239.1067 6.6E6 240.0779 9.7E5 241.0852 6.7E5 242.0935 4.6E5 251.1066 1.4E6 253.1218 9.9E5 254.0936 2.4E6 256.1089 7.5E4 267.1018 3.2E4 269.1171 5.2E7 271.1329 1.0E7 282.1488 1.2E6 282.2046 2.7E4 283.1328 8.9E5 285.1496 9.9E3 298.1108 4.2E4 299.1518 6.6E5 314.1751 9.1E7 314.2070 4.4E5 314.2186 1.6E5 END IONS BEGIN IONS FEATURE_ID=162 PEPMASS=317.1841 SCANS=162 RTINSECONDS=221.092 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 58.0649 9.4E5 58.0683 7.1E3 58.0700 6.1E3 59.0619 1.1E4 59.0679 3.7E5 59.0714 4.1E3 60.0653 3.6E3 60.0710 4.0E4 71.2032 2.3E3 80.5403 2.3E3 82.8749 2.2E3 84.5855 2.2E3 85.2886 2.5E3 91.5895 2.3E3 107.0488 1.2E5 108.0521 1.2E5 109.0543 5.4E4 110.0571 1.8E4 119.0496 2.6E3 121.0647 2.3E4 122.0680 2.1E4 123.0702 5.6E3 126.8266 2.2E3 134.8084 2.5E3 137.0597 7.0E3 138.0631 1.6E4 139.0647 1.8E4 140.0685 2.9E3 143.0492 2.9E3 144.0526 9.6E3 145.0545 3.0E3 145.0653 1.1E4 146.0683 1.7E4 147.0704 1.0E4 152.0791 2.6E3 154.6682 2.3E3 157.1781 2.9E3 170.3198 2.8E3 172.0077 2.8E3 173.5212 5.3E3 173.5338 7.0E4 175.0758 5.6E3 176.0789 1.9E4 176.9381 2.6E3 177.0809 3.2E4 178.0836 2.1E4 179.0963 6.3E3 179.1752 2.3E3 194.1068 3.5E3 210.1003 5.6E3 212.1063 2.4E3 214.1211 3.5E3 224.8991 1.5E4 226.5516 2.5E3 237.0632 2.3E3 238.0950 8.6E3 239.0970 1.9E4 240.1010 4.9E4 241.1140 2.8E3 242.1172 5.5E3 265.5967 2.9E3 271.1236 2.6E4 272.1260 1.1E5 273.1399 3.0E3 274.1414 2.0E4 281.8608 9.4E3 293.3658 2.4E3 317.1844 2.2E5 317.2252 4.3E3 END IONS BEGIN IONS FEATURE_ID=163 PEPMASS=330.1704 SCANS=163 RTINSECONDS=222.96 CHARGE=1+ MSLEVEL=2 MERGED_STATS=10 / 11 (1 removed due to low quality, 0 removed due to low cosine). 49.4243 2.2E3 49.6569 2.3E3 49.7778 2.6E3 50.2309 2.2E3 51.2373 2.4E3 51.5075 2.3E3 51.6207 2.4E3 52.7177 2.4E3 52.8776 2.2E3 53.1196 2.1E3 53.4007 2.2E3 53.5527 2.3E3 54.5182 2.4E3 55.0177 3.8E3 57.1018 2.4E3 58.0611 5.1E3 58.0651 4.0E6 58.0690 2.4E4 58.0699 1.6E4 59.0683 1.9E4 66.2423 2.8E3 68.8229 2.1E3 70.5213 2.2E3 74.8382 2.2E3 75.5004 2.5E3 77.4392 2.2E3 78.7965 2.3E3 79.7486 2.3E3 79.8518 2.5E3 80.0675 2.5E3 80.6628 2.4E3 82.9793 2.1E3 85.5360 2.5E3 94.2144 2.5E3 97.5598 2.3E3 98.9752 2.5E3 100.5305 2.8E3 101.9517 2.4E3 102.4020 2.5E3 105.0923 2.6E3 107.0487 1.0E6 107.0575 1.5E4 109.0728 2.3E3 112.2979 2.6E3 113.8382 2.3E3 115.4843 2.2E3 115.5765 2.4E3 115.8223 2.5E3 116.1738 2.3E3 120.1278 2.2E3 120.8967 2.4E3 121.0644 2.6E5 123.0437 7.4E4 124.2776 2.4E3 131.0485 4.0E4 133.0647 5.7E3 136.1786 2.2E3 136.8936 3.0E3 137.0595 1.3E4 139.1839 2.6E3 139.2862 2.1E3 140.4529 2.6E3 141.6768 2.3E3 143.0489 2.2E4 145.0643 1.3E5 147.0440 3.6E4 147.0804 2.1E4 148.7617 2.5E3 148.8370 2.7E3 150.3800 2.3E3 151.6714 2.4E3 152.0284 2.6E3 153.0420 3.3E3 153.0541 1.6E5 159.0437 2.6E5 160.2892 2.2E3 161.0596 1.9E4 163.0755 2.7E3 163.0991 2.8E4 164.0352 2.6E3 167.0699 5.4E4 171.2661 2.5E3 172.9448 2.4E3 173.0592 1.4E4 173.5226 2.2E4 173.5380 1.1E5 175.0601 3.0E3 175.0754 4.2E4 179.0701 5.4E4 181.0857 1.4E4 183.0806 3.0E3 184.1826 2.6E3 190.5871 2.4E3 191.0701 1.7E5 192.0778 2.2E3 192.1011 1.0E4 193.0857 1.0E5 194.0799 2.7E3 197.0613 2.5E3 205.0851 6.2E3 207.0801 1.7E4 208.0965 1.5E5 209.1044 1.3E4 210.1126 8.7E4 223.0764 6.1E3 223.1178 2.7E3 224.0786 1.1E4 225.0907 1.0E5 225.2125 2.6E3 227.1066 1.3E4 233.0616 4.5E3 234.0636 1.0E4 235.0694 2.4E4 235.0761 3.1E3 237.0911 5.7E3 242.9948 2.4E3 250.9891 2.6E3 251.0707 5.4E4 251.1945 2.5E3 252.0440 5.8E3 252.0739 1.4E5 253.0853 6.7E5 254.0944 6.0E3 255.1011 1.7E4 263.8626 2.5E3 266.0649 2.7E3 267.1014 3.4E4 269.0779 4.8E3 270.0878 3.9E4 284.1009 5.1E4 285.1121 6.2E5 287.1279 1.3E5 290.9858 2.4E3 293.3386 2.6E3 298.1428 9.0E3 299.1281 2.5E4 300.8491 3.2E3 315.1467 2.7E4 320.3501 2.7E3 330.1700 1.0E6 END IONS BEGIN IONS FEATURE_ID=164 PEPMASS=399.1656 SCANS=164 RTINSECONDS=224.85 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 53.0385 3.0E3 55.3501 2.4E3 57.0333 2.9E4 61.0281 1.2E4 69.0331 4.7E4 71.0855 3.0E3 73.0280 2.3E3 75.8154 2.6E3 78.1792 2.3E3 78.5051 2.7E3 78.7987 2.6E3 81.0332 2.4E4 82.7931 2.1E3 84.4969 2.7E3 85.0280 1.4E5 86.9310 2.8E3 87.0437 7.0E3 91.0384 4.6E3 97.0281 3.6E4 99.0439 1.3E4 102.9278 2.4E3 103.0386 5.7E3 103.0539 8.0E4 109.0281 2.4E4 109.7573 2.5E3 114.9335 2.4E3 117.0541 2.7E3 117.1664 2.6E3 120.0244 2.6E3 127.0387 2.9E4 129.0555 2.5E3 131.0377 4.0E3 131.0488 6.8E5 131.0586 3.3E3 131.0593 7.9E3 133.0633 2.6E3 148.0516 8.6E4 161.0595 2.4E4 162.0666 3.3E3 163.0752 1.4E5 173.5314 5.0E4 173.5462 5.5E3 188.9108 2.4E3 201.0899 2.4E3 202.8297 2.7E3 206.1194 4.8E3 220.3445 2.3E3 253.2318 2.5E3 269.9477 2.5E3 289.9211 5.5E3 301.9229 1.5E4 303.9381 5.9E3 317.9177 7.0E3 319.9321 2.0E4 329.9171 2.2E4 333.9092 2.6E3 347.9288 2.8E4 376.0162 1.2E4 END IONS BEGIN IONS FEATURE_ID=165 PEPMASS=439.1581 SCANS=165 RTINSECONDS=225.511 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 3 (1 removed due to low quality, 0 removed due to low cosine). 76.5821 2.5E3 80.7098 2.3E3 84.0174 3.6E3 95.0099 9.4E3 96.0170 3.2E3 103.0662 2.3E3 104.8521 2.4E3 109.5514 2.3E3 110.2338 2.4E3 112.0127 3.0E3 113.0203 1.6E4 113.1920 2.5E3 117.7126 2.6E3 126.0280 2.8E3 139.3145 2.6E3 157.0464 3.0E3 166.0497 3.8E3 173.5237 2.2E4 173.5428 1.7E4 181.3581 2.8E3 185.0415 2.8E4 201.0361 1.1E4 202.0422 2.5E3 202.0596 3.3E4 203.0517 5.7E3 220.8099 2.5E3 259.0782 1.8E4 273.9823 2.4E4 277.1040 9.9E3 291.9957 3.3E3 315.2928 2.6E3 343.8292 2.9E3 356.9949 2.7E3 375.0088 2.5E4 393.0202 2.7E4 411.0859 3.9E3 439.0869 1.1E4 439.1569 2.7E5 END IONS BEGIN IONS FEATURE_ID=166 PEPMASS=210.0401 SCANS=166 RTINSECONDS=225.995 CHARGE=1+ MSLEVEL=2 MERGED_STATS=7 / 7 (0 removed due to low quality, 0 removed due to low cosine). 41.6801 2.2E3 44.2200 2.4E3 45.2849 2.3E3 52.5790 2.0E3 52.6199 2.2E3 52.9265 2.3E3 53.0384 6.4E4 54.7187 2.4E3 55.0540 1.3E4 57.2327 2.1E3 57.3792 2.3E3 58.7652 2.5E3 60.3057 2.4E3 60.4402 2.0E3 60.6704 2.4E3 62.5672 2.4E3 65.0384 3.0E3 65.4314 2.4E3 66.1391 2.4E3 67.0176 8.2E4 68.0128 2.2E5 70.0648 2.8E4 70.3164 3.3E3 70.9864 2.3E3 73.5344 2.4E3 73.6703 2.3E3 76.1171 2.1E3 77.3605 2.3E3 78.0115 2.7E3 80.0491 2.6E5 81.0331 2.6E5 83.3133 2.4E3 84.0441 4.8E3 86.0838 2.1E3 87.6836 2.3E3 90.2385 2.5E3 93.0337 2.2E3 95.0124 8.3E4 96.0440 1.2E4 97.0520 2.2E4 97.8431 2.6E3 98.0533 3.1E3 98.0597 1.6E5 106.8606 2.3E3 108.0316 3.3E3 108.0441 9.0E5 108.0527 5.3E3 109.0281 1.4E5 116.9660 1.4E4 117.3317 2.5E3 120.0433 2.4E3 120.3148 2.3E3 121.0280 3.0E3 122.0234 1.0E4 122.2470 2.5E3 124.0391 7.3E4 125.0468 5.9E4 126.0442 1.6E4 126.0546 1.2E6 126.0648 2.5E4 127.0383 3.8E3 136.0216 3.5E3 136.0391 2.1E6 136.0491 3.3E4 137.0238 2.9E3 137.4308 2.4E3 145.9247 2.5E3 147.2382 3.1E3 148.0388 2.9E3 153.0417 6.8E4 154.0496 4.1E5 154.0644 4.1E3 155.6231 2.8E3 158.9900 1.0E4 164.0342 1.3E6 164.0500 2.1E4 168.9776 2.9E3 170.4162 2.6E3 173.5240 7.2E3 173.5348 7.2E4 176.2814 2.3E3 182.0446 2.2E4 183.0281 2.7E3 192.0289 3.0E4 193.3210 2.3E3 206.4986 2.4E3 209.8192 2.6E3 210.0395 2.6E3 211.0711 2.5E3 END IONS BEGIN IONS FEATURE_ID=167 PEPMASS=243.9932 SCANS=167 RTINSECONDS=226.084 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 6 (1 removed due to low quality, 0 removed due to low cosine). 44.7527 2.1E3 45.7706 2.2E3 46.5050 2.0E3 48.4698 2.3E3 48.6141 2.3E3 49.4854 2.2E3 50.7485 2.2E3 52.7155 2.3E3 55.4373 2.7E3 55.9342 4.7E5 56.4252 2.3E3 62.5816 2.1E3 63.1999 2.3E3 63.4341 2.3E3 63.6837 2.5E3 64.9522 2.3E3 65.5679 2.4E3 66.7686 2.4E3 67.0415 3.8E4 69.9475 2.1E3 70.9446 2.2E3 71.9291 1.3E4 72.9369 3.0E3 72.9560 2.5E3 73.6824 2.7E3 73.9450 2.8E3 76.0167 2.4E3 83.6613 2.8E3 85.6754 2.5E3 89.9400 2.6E3 90.9479 3.2E3 91.9905 3.1E3 92.2023 2.3E3 94.0286 2.1E4 94.1191 2.4E3 99.8747 2.5E3 99.9482 2.9E3 107.2196 2.4E3 111.9814 2.2E3 113.6099 2.7E3 113.9634 4.0E3 119.0367 9.5E3 126.2976 2.9E3 126.3085 2.4E3 128.9503 2.6E3 132.9617 2.8E3 138.9719 2.9E3 139.5139 2.3E3 140.9873 2.0E4 146.9765 9.1E4 147.1390 2.4E3 148.9758 3.0E3 149.9636 1.0E4 156.9805 2.5E3 164.9870 2.9E5 167.9742 9.6E4 173.5296 6.3E4 175.9727 7.4E3 180.8536 2.4E3 182.4002 2.6E3 182.9976 7.7E4 183.3483 2.5E3 185.9850 7.7E3 191.5700 2.5E3 192.9820 4.7E4 202.9673 3.2E4 220.9584 7.4E3 220.9771 1.5E6 224.9080 2.3E3 230.9722 3.8E3 234.9285 7.1E3 234.9563 4.5E5 234.9833 8.5E3 238.9875 4.5E5 239.0305 2.6E3 241.1121 2.6E3 243.9701 4.0E3 243.9935 2.3E4 END IONS BEGIN IONS FEATURE_ID=168 PEPMASS=267.0767 SCANS=168 RTINSECONDS=226.093 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 2 (0 removed due to low quality, 0 removed due to low cosine). 47.0570 2.0E3 47.2496 2.5E3 49.6003 2.1E3 50.7872 2.1E3 53.8435 2.1E3 54.6040 2.3E3 58.0049 2.3E3 59.8647 2.2E3 62.2592 2.3E3 62.4616 2.3E3 65.7653 2.4E3 79.9110 2.7E3 86.0964 9.4E3 104.1736 2.4E3 110.6914 2.6E3 113.8588 2.5E3 129.3498 2.5E3 142.1858 2.4E3 151.7939 2.7E3 152.4113 2.5E3 156.0798 3.4E3 173.5225 1.3E4 173.5409 1.8E4 183.0914 1.6E4 184.0756 1.3E4 193.0762 5.7E4 194.0597 5.7E3 210.0788 3.1E3 211.0868 6.0E4 215.8958 1.1E4 220.9764 2.8E3 221.0713 3.1E4 222.0554 4.5E3 222.0792 1.1E4 224.0582 3.7E3 225.0656 8.7E3 226.0297 1.2E4 228.9857 2.2E4 237.0666 6.9E3 238.0742 3.5E4 239.0816 1.5E5 244.0152 2.5E3 244.0403 3.0E4 249.0657 1.8E4 252.0531 7.2E3 254.4692 2.4E3 267.0766 5.7E4 END IONS BEGIN IONS FEATURE_ID=169 PEPMASS=329.0774 SCANS=169 RTINSECONDS=226.093 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 53.2835 2.3E3 54.6014 2.6E3 55.7614 2.4E3 57.5344 2.4E3 61.1340 2.1E3 63.5822 2.3E3 72.8346 2.5E3 91.2609 2.6E3 95.0492 2.3E3 95.2324 2.6E3 96.0620 2.2E3 105.6637 2.2E3 120.0448 2.3E3 124.0396 3.1E3 125.0469 1.3E4 138.0548 1.1E4 139.0407 2.7E3 148.0391 3.6E4 149.0475 9.6E3 149.0698 3.4E3 149.6813 4.7E3 149.6919 4.7E3 150.0545 3.1E3 154.0861 2.7E3 161.0715 8.3E3 162.0782 7.5E3 163.0877 3.3E3 164.0343 3.1E5 165.0419 3.4E4 166.0499 9.6E4 170.1191 2.5E3 172.8621 1.3E4 173.5301 3.9E4 173.5441 4.9E3 174.0553 5.9E3 176.0344 4.8E3 176.0947 3.4E3 176.7175 2.7E3 180.8882 1.7E4 181.0488 2.3E3 190.8726 7.5E4 197.8909 4.3E3 200.0521 2.6E3 201.8649 4.1E3 202.8710 2.6E3 208.8601 4.3E3 208.8831 5.0E5 209.0697 5.4E3 210.0558 2.9E3 212.0711 2.9E3 218.8675 3.6E4 226.8939 1.7E5 227.0824 1.1E4 228.0653 8.0E3 231.8989 2.8E3 234.6297 2.1E3 236.7122 2.7E3 236.8782 1.6E5 237.0662 6.9E4 238.0496 1.3E4 238.0742 9.3E3 240.0656 1.4E4 245.7179 2.3E3 246.8625 2.2E4 254.0688 3.1E3 254.8887 4.3E4 255.0764 6.1E4 255.1083 3.5E3 256.0604 1.3E5 256.0888 3.8E3 264.8728 5.4E4 265.0608 8.5E4 265.0926 3.0E3 266.0449 1.2E4 267.0784 3.0E3 267.1100 2.5E3 268.0610 1.4E4 282.0648 5.7E3 282.8842 8.9E3 283.0718 7.7E4 283.1084 8.2E3 284.0552 3.4E4 293.0558 6.3E4 301.0807 6.7E3 311.0663 3.5E4 312.1470 1.5E4 317.7556 2.6E3 329.0784 4.6E3 329.1498 1.6E5 END IONS BEGIN IONS FEATURE_ID=170 PEPMASS=589.1359 SCANS=170 RTINSECONDS=226.113 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 4 (2 removed due to low quality, 0 removed due to low cosine). 63.4570 2.2E4 63.4601 1.1E4 63.5656 6.7E3 63.6779 6.5E3 63.6809 4.4E3 65.4579 2.4E4 65.4615 1.3E4 65.8502 2.3E3 75.3094 2.3E3 82.1021 2.4E3 85.3258 2.7E3 140.7519 2.5E3 147.8905 2.6E3 162.0542 4.3E3 173.2854 3.6E3 173.5229 2.1E4 173.5384 4.0E4 232.6655 4.2E3 282.5862 2.7E3 283.0690 4.0E3 293.0549 1.3E4 295.0705 5.4E3 307.0706 1.3E4 354.4048 2.4E3 394.0832 6.0E3 396.0962 5.1E3 412.0922 2.9E4 413.0787 1.1E4 422.0825 7.2E3 423.0878 4.3E3 424.0974 5.6E3 428.0840 6.9E3 436.0928 2.9E4 439.0787 7.1E3 440.0150 7.2E3 440.0872 4.5E5 440.1579 3.7E3 441.0952 6.8E4 446.0729 4.5E3 452.0887 1.8E4 454.1048 4.7E3 454.9034 4.6E3 464.0871 1.0E6 465.0945 1.8E4 467.1100 7.4E3 470.1117 9.9E3 478.1022 4.7E3 488.1243 6.5E3 491.1094 1.2E4 492.1138 7.9E3 497.1220 1.5E4 498.1085 4.0E4 502.0967 4.9E3 503.1085 4.2E3 506.0969 1.1E4 515.1212 2.2E4 516.1170 3.1E4 517.1175 8.3E3 518.1042 9.0E3 519.1260 6.0E3 525.1158 5.4E4 526.1044 9.6E4 527.1109 1.6E4 530.0984 1.1E4 533.1430 2.7E4 535.1055 6.6E3 542.1183 5.5E3 543.1289 6.1E5 544.1142 1.2E5 545.1331 5.2E3 546.1141 5.5E3 553.1137 7.8E4 554.1060 1.4E5 555.1070 2.1E4 559.1240 9.5E4 560.1150 1.3E4 561.1383 7.3E4 570.1149 8.9E3 571.1244 7.9E5 572.1184 3.5E5 573.1165 3.0E5 588.1275 1.6E4 589.1345 1.1E6 END IONS BEGIN IONS FEATURE_ID=171 PEPMASS=442.1040 SCANS=171 RTINSECONDS=226.256 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 4 (1 removed due to low quality, 0 removed due to low cosine). 57.4803 2.3E3 59.0163 2.1E3 70.7642 2.5E3 70.7685 2.4E3 73.2618 2.6E3 73.2656 4.1E3 74.3466 2.1E3 75.1951 2.4E3 76.7562 2.3E3 82.0822 2.2E3 105.8015 2.1E3 112.0199 2.4E3 123.1492 2.4E3 132.0442 1.2E4 135.9131 2.5E3 148.0387 8.3E3 149.0470 5.5E3 149.6710 3.1E3 149.6917 4.5E3 150.0547 2.9E4 173.5245 1.5E4 173.5414 1.3E4 229.3094 2.1E3 233.8645 2.3E3 237.0656 3.4E4 238.0752 3.7E3 247.0497 2.4E3 265.0605 1.8E5 266.0683 1.1E4 267.0791 3.1E3 268.0616 5.0E3 275.0442 8.6E3 288.9393 2.3E3 292.9784 1.0E4 293.0555 2.4E6 293.1172 5.5E3 293.1330 9.9E3 294.0625 1.1E4 295.0720 2.7E4 299.8250 2.3E3 307.0705 4.3E3 323.0624 2.4E3 335.0649 8.5E3 340.1075 6.4E3 350.0899 3.1E3 358.1182 7.9E3 368.1021 3.7E4 369.0876 1.1E4 378.0852 7.3E3 385.1011 4.7E3 386.1133 7.5E4 395.0901 4.0E3 396.0368 4.2E3 396.0976 1.6E5 397.0850 3.5E4 398.0914 1.3E4 399.0787 2.8E3 406.0821 1.4E4 407.0902 1.6E4 408.0966 2.7E3 413.0984 8.8E3 414.1081 3.1E5 415.0871 2.7E3 424.0926 1.4E5 425.0067 3.5E3 425.0261 3.3E3 425.0991 2.2E5 426.0842 6.5E4 427.0818 3.4E3 441.0949 9.6E3 442.1029 7.9E5 442.1770 3.2E3 END IONS BEGIN IONS FEATURE_ID=172 PEPMASS=297.0875 SCANS=172 RTINSECONDS=226.311 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 4 (2 removed due to low quality, 0 removed due to low cosine). 53.2907 2.4E3 54.8760 2.5E3 65.0385 4.4E3 74.2690 2.4E3 79.0539 2.3E3 92.0492 9.8E3 105.0331 1.3E4 120.0441 3.7E5 132.0440 2.5E4 134.0601 4.7E3 136.0393 5.6E3 147.9958 3.2E3 148.0113 1.3E4 148.0389 3.5E6 148.0504 1.7E4 148.0606 1.1E4 148.0646 3.7E4 148.0749 8.0E3 149.0468 6.0E5 149.0581 3.5E3 150.0546 8.6E4 162.0544 1.1E4 164.0340 2.1E4 173.5346 3.9E4 187.0501 1.4E4 194.9440 2.9E3 195.0915 8.9E3 196.0755 3.2E3 199.0628 8.0E3 202.0510 2.5E3 205.0763 8.4E3 206.0596 4.5E3 217.8917 6.9E3 220.9773 2.9E3 222.0762 3.2E3 223.0862 3.4E4 224.0704 2.1E4 227.9504 1.3E4 232.9895 3.3E3 233.0708 3.2E4 234.0557 5.2E3 237.9347 3.6E3 240.0856 6.5E3 241.0954 2.0E4 250.0727 3.2E3 251.0811 9.0E5 252.0652 4.7E4 255.9469 7.9E3 261.0656 4.5E4 262.0740 1.8E4 267.0750 5.2E3 268.0797 9.9E3 269.0854 5.7E4 270.0760 2.9E5 273.9563 2.1E4 279.0763 8.3E5 280.0528 4.0E3 280.0844 9.3E4 281.0685 3.7E4 296.0789 7.6E4 297.0078 3.7E3 297.0864 1.1E6 END IONS BEGIN IONS FEATURE_ID=173 PEPMASS=313.0825 SCANS=173 RTINSECONDS=226.311 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 5 (1 removed due to low quality, 0 removed due to low cosine). 51.0369 2.3E3 53.8954 2.7E3 54.5850 2.2E3 57.0463 2.2E3 80.0494 1.1E4 80.0700 2.2E3 80.0899 2.1E3 82.8822 2.3E3 86.3019 2.7E3 89.9692 2.5E3 90.7609 2.8E3 96.0446 2.3E3 104.0494 1.9E4 108.0441 8.9E3 111.0914 2.2E3 112.4247 2.8E3 120.0443 3.4E4 122.0236 3.0E4 124.0391 1.0E4 128.8527 2.2E3 132.0443 1.7E5 136.0392 1.2E5 138.0548 7.6E3 148.0392 2.1E5 149.0471 1.0E5 150.0386 8.2E3 150.0548 5.0E5 156.5001 2.9E3 162.0552 3.3E4 164.0017 1.1E4 164.0085 7.3E3 164.0224 9.6E3 164.0342 3.8E6 164.0601 7.8E3 164.0666 1.9E4 164.0752 4.4E3 165.0419 7.0E4 166.0497 1.0E4 172.9620 2.5E3 173.5249 1.6E4 173.5314 4.7E4 173.5439 1.0E4 174.0554 3.1E3 176.0342 5.3E3 179.2009 2.4E3 184.0760 9.3E3 186.0543 2.6E3 193.0762 6.4E3 194.0602 1.3E4 196.0754 1.8E4 200.0691 3.1E3 202.0501 1.8E4 211.0867 5.4E4 212.0708 5.0E4 221.0709 5.8E4 222.0553 6.3E4 222.0782 1.3E4 223.0631 3.2E4 223.0859 1.2E4 224.0707 6.9E4 225.0662 3.0E3 229.0970 2.7E4 231.8763 2.5E3 237.0673 3.7E3 238.0734 4.7E4 239.0600 3.6E3 239.0815 3.2E5 239.1094 4.4E3 239.1895 2.2E3 240.0653 1.3E5 240.0897 2.9E4 241.0974 3.2E4 243.8757 2.3E3 249.0659 2.0E5 250.0498 6.9E4 250.0734 2.5E3 251.0569 1.2E4 251.0828 7.7E3 252.0654 5.5E4 253.0604 3.1E3 257.0918 5.6E4 262.0038 8.6E3 266.0682 3.2E4 267.0763 7.4E5 268.0603 2.6E5 268.0854 3.2E3 269.0679 5.1E4 270.0635 2.4E3 271.9867 1.9E4 274.2060 2.5E3 275.8904 2.7E3 277.0610 3.2E5 278.0400 8.7E3 278.0691 6.3E4 280.8533 2.5E3 283.0713 8.4E3 284.0785 1.6E4 285.0871 5.5E5 293.0569 2.7E3 294.0630 1.2E4 295.0715 3.3E5 296.0538 1.1E4 313.0811 1.1E5 END IONS BEGIN IONS FEATURE_ID=174 PEPMASS=259.9880 SCANS=174 RTINSECONDS=226.636 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 6 (1 removed due to low quality, 0 removed due to low cosine). 45.2152 2.3E3 47.6315 2.2E3 48.6712 2.0E3 50.8257 3.2E3 53.5839 2.0E3 53.8192 2.0E3 55.5576 2.0E3 55.9341 2.7E4 56.4222 2.5E3 56.7825 2.3E3 57.0578 2.1E3 58.1221 2.4E3 58.3336 2.1E3 60.2289 2.8E3 62.0749 2.3E3 62.2261 3.0E3 66.4587 2.5E3 69.0698 2.7E3 79.3958 2.2E3 81.5981 2.2E3 81.6495 2.1E3 85.4647 2.3E3 92.3983 2.8E3 95.6680 2.1E3 103.3598 2.1E3 109.8869 2.4E3 110.1050 2.6E3 110.8915 2.5E3 112.0752 2.6E3 119.8712 2.4E3 124.6400 2.4E3 125.5530 2.4E3 129.7665 2.7E3 131.0493 3.0E3 135.6140 2.2E3 138.1881 2.8E3 144.1554 2.7E3 145.0284 1.9E4 148.0391 3.0E3 153.8250 2.3E3 161.9070 2.3E3 162.9715 3.4E3 163.0387 8.6E3 173.5310 5.0E4 173.5394 7.6E3 175.0392 5.7E4 180.9818 1.1E4 187.6966 2.3E3 190.8732 2.8E3 190.9652 3.1E3 196.9680 3.0E3 207.9695 3.1E4 208.8842 8.0E3 208.9771 1.4E5 218.9602 2.6E3 218.9814 3.7E3 222.9565 8.4E4 222.9771 3.2E3 226.9874 1.6E4 229.4780 2.5E3 231.9894 2.6E3 235.9638 1.3E4 236.9716 4.0E5 236.9996 3.5E3 244.9804 4.1E3 250.9512 1.7E5 254.9820 9.3E4 255.0087 3.5E3 260.1284 3.7E3 END IONS BEGIN IONS FEATURE_ID=175 PEPMASS=311.0669 SCANS=175 RTINSECONDS=226.756 CHARGE=1+ MSLEVEL=2 MERGED_STATS=7 / 7 (0 removed due to low quality, 0 removed due to low cosine). 49.4745 2.4E3 50.6025 2.1E3 54.4188 2.3E3 56.6849 2.3E3 58.1245 2.3E3 60.1313 2.5E3 60.9590 2.1E3 64.3304 2.5E3 65.5853 3.0E3 71.6217 2.3E3 73.3059 2.7E3 74.1540 2.2E3 74.8484 2.6E3 75.6579 2.3E3 75.8553 2.7E3 76.2613 2.3E3 79.5012 2.6E3 82.0535 2.9E3 86.1777 2.6E3 91.0538 2.0E4 91.1160 2.4E3 91.2359 2.7E3 93.7194 2.4E3 96.0441 8.1E3 98.8470 2.6E3 100.2042 2.1E3 102.8224 2.4E3 110.8191 2.6E3 114.0214 2.3E3 114.7684 2.3E3 117.0831 2.8E3 121.2278 2.9E3 121.4258 2.6E3 125.2859 2.4E3 131.8370 2.5E3 136.8033 2.3E3 146.0267 1.1E4 147.0291 4.0E3 148.0390 4.1E4 149.0471 6.2E3 149.6646 5.8E3 149.6862 1.3E4 149.6935 3.9E3 155.7438 2.5E3 156.3903 2.6E3 156.8220 2.6E3 164.5408 2.3E3 170.7159 2.3E3 171.3499 2.2E3 173.5218 1.7E4 173.5349 8.4E4 175.6819 2.5E3 176.9773 2.6E3 179.9891 2.4E3 182.3404 2.6E3 199.0872 3.8E3 209.0710 5.2E4 210.0551 3.0E4 212.0695 6.1E3 213.0669 3.0E3 227.0814 7.6E4 231.1770 2.2E3 237.0659 2.9E5 238.0496 9.2E4 238.0735 8.4E3 239.0564 3.3E3 240.0647 1.3E4 241.0604 2.0E4 243.3523 2.4E3 247.0497 1.7E4 254.0683 1.6E4 255.0761 1.8E5 265.0605 5.0E5 265.0860 2.5E3 266.0449 3.8E4 266.0728 2.6E3 267.0525 5.2E4 267.9745 2.6E3 268.0605 1.9E4 269.0561 1.8E4 273.6149 2.8E3 275.0445 1.4E4 276.0536 3.0E3 282.0643 2.7E4 283.0379 4.6E3 283.0714 2.7E5 284.0567 3.1E3 288.7283 2.6E3 293.0557 1.7E5 294.0657 6.4E3 311.0662 4.7E5 312.2047 2.6E3 END IONS BEGIN IONS FEATURE_ID=176 PEPMASS=260.9958 SCANS=176 RTINSECONDS=226.774 CHARGE=1+ MSLEVEL=2 MERGED_STATS=1 / 1 (0 removed due to low quality, 0 removed due to low cosine). 56.1382 2.4E3 72.9372 5.3E3 90.9475 3.3E3 103.1401 2.5E3 132.0442 1.4E4 136.0391 1.9E4 148.0392 5.6E3 148.0626 7.1E3 149.6686 2.7E3 149.6896 5.2E3 151.9793 2.9E3 152.9638 3.3E3 155.9748 4.1E3 163.9791 2.3E4 164.0334 2.6E3 166.9783 3.3E3 168.9582 3.7E3 170.0596 2.7E3 171.0548 5.8E3 173.5313 7.1E3 173.9638 4.3E3 176.0285 5.4E3 179.9743 9.5E3 181.9897 9.3E3 182.9739 4.5E4 183.9693 1.1E4 187.0866 2.2E4 191.9742 6.8E4 192.0238 9.8E3 194.0391 3.1E4 195.9689 5.1E3 200.9843 6.8E3 207.9692 2.0E4 208.9530 1.5E4 208.9741 3.8E3 209.9848 2.1E5 210.0341 3.0E4 215.0814 7.5E4 219.9692 4.6E4 220.0185 7.5E3 220.8620 2.8E3 220.9783 3.2E3 223.9633 7.9E3 225.9793 5.7E3 227.9943 4.5E3 236.9706 3.3E3 237.9794 2.2E5 238.0279 9.7E3 247.9735 2.6E3 251.9582 2.8E4 255.9881 1.1E4 END IONS BEGIN IONS FEATURE_ID=177 PEPMASS=295.0719 SCANS=177 RTINSECONDS=226.774 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 5 (1 removed due to low quality, 0 removed due to low cosine). 49.4126 2.5E3 52.2099 2.6E3 60.7256 2.5E3 65.4934 2.7E3 66.7671 2.9E3 66.7695 9.9E3 73.7699 2.4E3 75.2093 2.3E3 77.5564 2.6E3 80.9108 2.4E3 98.3531 2.4E3 101.7468 3.0E3 105.2208 2.2E3 105.5145 2.4E3 106.0495 2.4E3 121.2927 2.4E3 148.0392 1.5E4 149.0466 8.0E3 159.0097 2.5E3 166.0647 2.8E3 167.3279 2.4E3 173.5347 6.3E4 175.0382 3.7E3 183.0914 2.2E4 184.0754 1.1E4 185.4618 2.5E3 187.9002 2.3E3 193.0760 1.0E5 194.0598 9.1E3 197.0697 2.7E3 198.0560 6.1E3 199.0625 1.3E4 207.0660 3.8E3 211.0864 1.2E5 212.0708 2.0E4 215.8953 1.8E4 216.7008 2.1E3 221.0708 1.5E5 222.0550 2.5E4 222.0781 1.7E4 223.0855 4.3E3 225.0660 2.4E4 226.0495 1.1E4 227.0565 5.7E3 229.9927 1.7E4 230.9948 3.5E4 238.0736 7.5E4 239.0541 7.6E3 239.0814 5.0E5 240.0652 2.6E4 244.9735 1.6E4 249.0657 2.2E5 250.0489 1.1E4 250.0751 1.6E4 253.0610 7.6E3 253.9305 1.1E4 254.0242 4.3E3 266.0687 1.3E4 267.0083 8.9E3 267.0243 6.6E3 267.0763 3.3E6 267.1428 1.5E4 268.0598 1.1E4 271.5656 2.4E3 272.0359 2.3E3 272.0650 2.3E3 277.0610 1.0E5 278.0686 1.1E5 294.0643 1.2E4 295.0307 3.6E3 295.0409 6.2E3 295.0716 1.8E6 END IONS BEGIN IONS FEATURE_ID=178 PEPMASS=258.9802 SCANS=178 RTINSECONDS=227.037 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 50.6535 2.1E3 52.2459 2.6E3 52.4044 2.6E3 55.6725 2.5E3 55.9343 2.9E3 59.2729 2.1E3 60.4539 2.3E3 63.8690 2.3E3 72.9367 3.6E3 73.0602 2.3E3 74.0331 2.6E3 89.0181 2.2E3 90.9473 3.0E3 94.9003 2.4E3 98.4902 2.1E3 132.8560 2.7E3 136.9678 7.7E3 151.9788 4.9E4 154.9792 2.8E3 164.0058 2.2E3 170.5992 2.8E3 173.5270 1.0E4 173.5329 2.6E4 179.9736 1.0E4 183.5189 2.3E3 193.5318 2.8E3 207.8754 4.6E3 207.9691 2.1E4 207.9894 2.3E4 225.9793 5.4E3 228.7260 2.6E3 235.9636 3.4E5 235.9860 8.4E3 245.7090 2.8E3 253.9744 8.1E4 END IONS BEGIN IONS FEATURE_ID=179 PEPMASS=307.0018 SCANS=179 RTINSECONDS=227.037 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 5 (1 removed due to low quality, 0 removed due to low cosine). 48.9343 2.4E3 50.2707 2.2E3 55.9343 1.3E4 56.9422 5.0E3 60.1329 2.6E3 67.0175 2.7E3 72.9372 1.3E4 76.5002 2.8E3 80.2201 2.3E3 90.0107 2.3E3 90.9476 1.6E4 94.8822 2.4E3 99.8131 3.0E3 100.0838 2.3E3 105.8619 2.6E3 107.4852 2.5E3 112.0546 2.7E3 113.9634 6.1E3 114.1784 2.1E3 120.0076 4.0E3 125.2953 2.2E3 128.9629 3.3E3 132.0426 2.3E3 137.6860 2.5E3 138.0547 3.7E4 140.0336 1.4E4 148.0390 1.0E5 149.6886 4.3E3 150.0546 3.1E3 151.9791 2.1E4 163.9791 6.6E3 164.0340 5.1E4 165.0419 3.3E4 166.0493 2.0E4 167.9734 8.0E3 173.5265 1.9E4 173.5404 1.4E4 175.9791 4.0E4 177.9586 4.7E3 179.9742 6.5E4 181.9897 5.9E3 182.0150 2.4E3 182.9742 4.7E3 184.2664 3.0E3 191.9743 5.4E4 193.9895 1.2E4 195.9691 6.8E4 197.3075 2.4E3 197.9847 3.5E4 203.9741 3.0E4 207.9691 1.2E5 208.8845 6.6E3 209.9501 4.4E3 209.9849 3.6E5 212.0009 5.2E3 213.9799 2.2E4 219.9692 3.8E5 220.9773 1.9E4 221.9848 1.4E6 223.9641 5.7E4 225.9794 4.8E4 227.8952 3.2E3 227.9954 1.7E4 234.0405 3.0E3 235.9637 8.7E4 236.9697 2.7E3 237.9395 3.4E3 237.9797 9.7E5 238.9866 3.6E3 239.9952 1.2E6 241.9744 2.9E4 251.9587 1.5E5 253.9742 4.3E4 255.9901 5.9E5 258.0013 2.9E3 260.9472 2.8E3 260.9960 3.3E3 263.0111 1.8E4 265.9748 3.4E4 269.9697 3.0E4 273.9994 8.1E3 279.0064 7.7E3 283.9855 4.1E4 301.5184 2.8E3 305.7437 2.7E3 END IONS BEGIN IONS FEATURE_ID=180 PEPMASS=265.9749 SCANS=180 RTINSECONDS=227.084 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 4 (1 removed due to low quality, 0 removed due to low cosine). 46.8109 2.5E3 47.3872 2.3E3 55.9342 3.3E3 58.1402 2.2E3 60.4310 2.4E3 65.1848 2.1E3 68.7114 2.5E3 73.5588 2.4E3 79.0454 2.1E3 84.4574 2.9E3 85.8264 2.6E3 110.3119 2.6E3 113.5017 2.4E3 113.7665 2.5E3 122.9355 2.6E3 141.9475 2.5E3 148.6243 2.5E3 149.6873 5.8E3 161.7122 2.1E3 163.1416 2.7E3 173.5222 3.4E3 173.5357 2.6E4 175.9798 6.6E3 177.0547 2.2E4 178.0580 4.5E4 184.6347 3.0E3 186.9011 1.4E4 197.3179 2.7E3 209.9845 4.0E3 214.8956 4.4E4 219.9687 8.0E3 221.9812 1.4E4 237.9787 1.2E4 244.2488 2.7E3 247.2920 2.3E3 264.0710 2.4E3 269.5096 2.6E3 END IONS BEGIN IONS FEATURE_ID=181 PEPMASS=314.1393 SCANS=181 RTINSECONDS=227.153 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 48.0593 2.6E3 48.7916 2.4E3 48.9361 2.2E3 52.7648 2.2E3 53.2806 2.4E3 53.5809 2.3E3 55.5376 2.4E3 58.0652 6.6E3 63.6761 2.4E3 64.3517 2.4E3 74.5244 2.8E3 74.7766 4.3E3 74.7808 7.0E3 76.1561 2.6E3 77.7027 2.2E3 78.5323 4.9E3 78.5354 1.3E4 90.5078 2.1E3 91.0541 2.9E3 93.9821 2.4E3 95.0491 6.5E3 102.1065 2.5E3 105.0699 1.4E4 107.0489 3.2E3 109.0647 1.1E4 118.4219 2.4E3 131.0494 9.3E3 133.0647 8.9E3 136.0521 7.7E3 137.0596 7.5E4 138.0549 2.6E4 139.3475 2.3E3 140.0707 2.8E3 143.0491 4.1E3 145.0647 3.1E3 146.0603 6.6E3 150.0545 9.0E3 150.0674 1.4E4 151.0753 7.1E5 151.0881 9.3E3 152.0705 2.1E5 160.0525 2.4E3 162.0551 6.0E4 163.0624 3.0E4 163.0759 1.1E4 164.0342 5.7E4 164.0706 2.8E4 165.0377 5.5E4 165.0910 1.5E5 168.8068 2.5E3 173.5274 9.1E3 173.5354 2.3E4 175.0753 3.3E4 176.0706 5.5E4 178.0864 3.1E3 190.0858 7.3E3 195.0811 2.5E3 223.4086 2.7E3 236.1073 2.3E4 238.0870 3.2E3 243.1256 2.6E3 244.9908 2.6E3 253.0736 7.1E3 254.1178 1.4E4 256.0960 8.1E3 263.0020 3.8E3 264.1022 3.4E4 267.0869 2.6E3 268.0799 1.5E4 268.1331 7.6E4 269.0636 3.0E3 270.0764 2.0E4 270.6395 2.5E3 271.0860 3.8E3 272.9874 1.1E4 273.1117 1.3E4 280.0958 4.5E3 281.1046 2.0E4 282.1127 5.4E4 283.0849 1.3E4 283.1195 6.3E3 284.0918 1.1E5 285.0994 1.0E5 286.0885 7.7E3 286.1076 3.5E3 296.0746 3.9E3 296.0929 4.0E3 296.1284 1.1E5 298.0793 6.6E3 298.1076 1.9E6 298.1864 6.4E3 298.2095 3.3E3 299.0355 1.1E4 299.0508 7.2E3 299.1152 3.5E6 299.1784 7.6E3 299.1947 2.3E4 299.2172 4.1E3 314.0515 9.2E3 314.1386 4.1E6 314.2050 1.1E4 314.2251 2.4E4 END IONS BEGIN IONS FEATURE_ID=182 PEPMASS=342.1762 SCANS=182 RTINSECONDS=229.349 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 50.5844 2.3E3 57.0332 5.7E4 59.0490 1.0E4 61.0281 1.6E4 64.2098 2.6E3 67.2370 2.3E3 68.5091 2.6E3 69.0332 2.0E4 69.2644 2.3E3 71.0489 1.3E4 71.0852 6.1E4 73.0281 6.6E3 78.5426 2.7E3 79.0540 1.2E4 81.0333 3.1E3 81.0695 8.0E4 83.0488 2.8E3 85.0280 1.2E5 85.0646 1.6E4 88.5544 2.3E3 91.0387 2.9E3 97.0281 3.2E4 97.0341 2.7E3 99.0442 2.7E3 99.0733 4.3E3 99.0801 3.1E5 107.1106 2.7E3 108.5030 2.5E3 109.0280 2.9E3 109.0644 1.9E5 117.0811 5.3E3 117.0906 7.6E5 117.0991 1.7E4 119.0486 8.3E3 120.2056 2.3E3 121.4191 2.3E3 127.0387 2.1E4 127.0750 5.1E5 127.0873 8.4E3 138.0569 2.2E3 145.0492 2.4E3 147.0437 6.9E4 173.5208 5.4E3 173.5370 3.9E4 195.0875 2.7E3 195.1104 2.4E3 195.5970 2.4E3 196.0968 1.6E4 226.6119 2.4E3 227.2518 2.8E3 231.1171 2.8E3 256.5139 2.9E3 271.8047 2.4E3 END IONS BEGIN IONS FEATURE_ID=183 PEPMASS=476.2283 SCANS=183 RTINSECONDS=229.614 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 58.0649 1.4E5 69.0335 3.8E3 71.5452 2.4E3 72.4267 2.3E3 73.1909 2.2E3 81.6172 2.3E3 81.7027 2.2E3 85.0280 8.7E3 89.4805 2.4E3 89.5442 2.2E3 107.0487 1.4E5 114.4211 2.3E3 121.0645 2.7E4 127.0386 3.8E3 137.0594 3.9E4 140.9826 2.2E3 143.0488 4.3E4 145.0283 2.9E3 145.0644 2.4E4 147.0802 1.0E4 151.0751 3.3E3 157.5090 2.5E3 163.0745 2.9E3 167.0180 2.2E3 173.5242 9.0E3 173.5335 3.1E4 173.5427 3.9E3 175.0752 2.5E4 179.9290 2.5E3 194.1189 2.5E3 211.1114 6.3E3 219.2159 2.4E3 237.0909 2.6E4 239.1056 1.1E4 269.1170 1.8E5 271.1325 5.3E4 314.1749 4.2E5 314.2069 2.5E3 414.6381 2.8E3 454.7393 2.3E3 476.2270 5.6E5 476.3406 3.5E3 END IONS BEGIN IONS FEATURE_ID=184 PEPMASS=227.0918 SCANS=184 RTINSECONDS=231.278 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 43.0176 3.0E4 45.0333 9.2E4 45.0567 2.4E3 46.8447 2.5E3 49.4304 2.2E3 49.8644 2.3E3 51.6401 2.1E3 52.5592 2.6E3 54.4516 2.2E3 55.0176 3.7E4 56.4880 2.4E3 60.9114 2.2E3 65.0383 2.3E4 67.0540 1.2E4 67.2086 2.4E3 69.0697 2.4E3 70.8165 2.1E3 72.9369 2.2E3 73.0243 3.9E3 73.0279 1.3E5 73.0419 2.6E3 75.5859 2.1E3 79.0539 6.5E3 81.1363 2.3E3 81.1842 2.2E3 82.0412 4.2E3 85.0281 1.2E4 90.9473 3.5E3 91.0539 4.2E3 92.0528 3.3E3 95.0488 3.5E4 97.0646 8.5E3 100.1113 6.3E3 100.7244 2.6E3 107.0491 2.4E3 110.0360 1.3E4 111.0439 6.9E3 113.9634 8.1E3 121.0645 1.4E4 123.0438 2.7E4 125.0230 7.9E3 125.0593 8.6E3 126.5868 2.7E3 127.8661 2.6E3 138.0305 3.4E3 139.9820 6.4E3 140.0341 4.0E3 140.0465 2.4E5 142.0264 3.0E3 149.0592 2.5E3 153.0542 2.5E4 155.0696 2.4E4 157.9927 2.1E4 165.0541 4.2E3 167.0700 4.2E3 167.9774 3.1E3 171.0653 6.7E4 173.5262 3.1E4 173.5426 1.2E4 179.0702 1.7E4 180.8807 3.5E3 181.0495 4.9E5 181.0663 2.5E3 181.0856 9.9E3 185.9280 3.4E3 203.9397 4.0E3 209.0793 2.5E3 230.7062 2.7E3 END IONS BEGIN IONS FEATURE_ID=185 PEPMASS=286.1442 SCANS=185 RTINSECONDS=232.635 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 49.3771 2.1E3 54.3126 2.3E3 56.6200 2.6E3 57.7286 2.5E3 58.0650 2.7E3 60.3168 2.4E3 67.1082 2.4E3 67.3846 2.2E3 76.8553 2.6E3 82.4014 2.6E3 85.5691 2.3E3 86.7131 2.4E3 91.0540 8.5E3 95.0490 6.3E3 104.2238 2.2E3 105.0695 2.3E3 107.0320 3.7E3 107.0406 3.9E3 107.0487 1.2E6 107.0573 1.3E4 108.0302 2.5E3 108.1302 2.2E3 115.0538 6.0E4 117.0695 8.4E3 119.0488 1.7E4 121.0644 9.0E4 123.0436 1.4E5 131.0486 5.3E3 133.0646 2.2E4 135.0439 2.0E4 137.0595 1.9E4 140.8038 2.8E3 143.0363 3.7E3 143.0488 2.4E5 145.0644 1.4E5 147.0438 5.2E3 147.0802 2.4E3 149.0593 1.9E4 151.0750 8.2E3 154.6457 2.3E3 157.0642 2.6E3 161.0593 2.3E5 163.0751 1.5E4 166.0863 1.1E4 173.5227 2.3E4 173.5322 1.5E4 173.5397 4.5E4 175.0761 5.8E3 177.6405 2.7E3 178.0860 1.6E5 179.5853 2.5E3 183.0796 2.5E3 191.0856 6.8E3 192.1019 8.3E3 194.0725 3.9E3 201.0547 3.1E3 203.8827 2.8E3 204.8822 2.7E3 209.0963 5.9E4 216.8907 2.8E3 219.0801 8.5E3 226.0615 1.3E4 227.0687 3.8E3 227.1065 9.5E3 235.1362 2.5E3 237.0905 8.4E4 237.4840 2.6E3 240.0779 1.5E4 241.1515 2.2E3 255.0697 3.4E3 255.1014 3.4E5 255.1319 3.6E3 257.1182 6.3E3 257.6361 2.5E3 269.1169 3.2E3 277.5266 2.4E3 286.1098 8.5E3 286.1440 2.4E5 286.1802 5.1E3 END IONS BEGIN IONS FEATURE_ID=186 PEPMASS=314.1755 SCANS=186 RTINSECONDS=233.619 CHARGE=1+ MSLEVEL=2 MERGED_STATS=7 / 13 (6 removed due to low quality, 0 removed due to low cosine). 49.2080 2.2E4 51.6509 6.2E3 52.6881 5.5E3 53.1287 6.0E3 55.0177 9.1E3 56.0494 2.2E5 58.0652 7.9E7 58.0710 2.3E5 58.0719 2.0E5 58.0744 5.3E5 58.0757 4.0E4 58.7007 1.8E4 60.7810 3.7E3 61.1798 5.2E3 63.5112 1.8E4 63.7723 8.0E3 65.3444 7.5E3 65.6133 7.3E3 67.6784 5.1E3 68.4974 1.2E4 69.9181 1.9E4 71.0728 4.7E4 72.0807 1.3E5 72.8228 9.2E3 73.4580 1.2E4 73.8288 6.5E3 78.6842 8.0E3 79.0543 8.3E3 84.9787 3.9E3 86.4787 1.6E4 91.0542 2.2E5 93.0698 6.7E4 95.0490 2.9E5 95.3983 1.1E4 99.1743 1.2E4 99.5485 5.1E3 103.0545 1.9E4 105.1202 7.2E3 106.9072 7.0E3 107.0319 6.9E4 107.0491 2.6E7 107.0660 1.6E5 109.0647 5.8E4 109.8283 1.9E4 114.2881 7.7E3 115.0542 4.4E5 117.0698 2.9E5 119.0490 5.2E5 119.0855 7.6E4 121.0646 3.1E6 121.0738 2.0E4 124.1503 1.3E4 125.0596 1.2E5 128.6977 9.0E3 129.0703 7.7E3 131.0491 4.3E5 133.0646 1.9E5 133.1078 4.2E3 135.0807 1.6E4 137.0596 3.4E6 137.0695 3.8E4 143.0361 5.4E4 143.0490 2.7E6 143.0613 3.2E4 144.0572 7.6E4 145.0514 4.9E4 145.0646 3.5E6 145.0748 4.3E4 147.0444 4.2E4 147.0676 2.0E4 147.0802 1.7E6 148.0561 6.0E3 149.0595 4.7E5 149.0961 1.1E5 149.3551 5.0E3 151.0617 7.8E3 151.0752 2.2E6 151.0891 2.4E4 152.0159 2.1E4 153.0908 3.2E4 155.0600 4.1E4 157.0647 5.9E4 160.0517 4.4E5 160.0751 1.9E4 161.0600 7.3E4 162.0675 2.5E5 163.0611 2.0E4 163.0753 1.2E6 165.0698 3.9E4 165.0912 1.2E5 173.5102 2.2E4 173.5243 2.4E5 173.5394 3.9E5 175.0576 4.4E4 175.0753 7.4E6 175.1011 4.2E4 176.0838 1.3E5 176.1070 1.4E5 176.7823 8.1E3 177.0910 6.0E5 178.0861 1.0E4 181.0647 1.7E5 181.1013 2.1E5 183.0804 1.9E5 188.4375 5.8E3 189.8318 6.7E3 191.0856 2.7E5 191.7231 4.2E3 192.0836 1.3E4 192.1018 1.4E6 193.1094 7.4E5 194.0727 2.4E5 194.1175 5.4E5 195.0805 1.2E5 196.0871 9.7E3 197.0605 6.3E4 197.0962 7.2E4 200.0739 8.1E3 207.1252 2.7E5 208.1340 1.2E4 209.0619 5.0E4 209.0960 3.0E6 210.0680 8.1E4 211.0752 3.3E5 211.1117 1.5E6 211.1347 9.0E3 212.0837 9.4E4 213.0909 8.4E4 219.0806 4.5E5 220.0882 1.5E4 221.0963 2.0E5 223.0748 1.6E4 224.0826 8.2E3 225.1271 5.8E4 237.0908 5.2E6 237.1131 2.4E4 238.0987 1.6E5 239.1065 1.6E6 240.0783 1.6E5 241.0855 1.2E5 241.1217 9.1E4 242.0940 2.0E5 246.9994 8.1E3 247.3427 7.7E3 249.4624 9.1E3 251.1067 6.8E4 253.1221 1.2E5 254.0935 6.3E5 256.1090 1.1E5 262.8536 8.6E3 267.1007 1.8E4 269.1169 9.1E6 269.1441 1.3E4 271.1326 2.7E6 282.1488 4.2E5 295.7681 2.0E4 299.1158 4.5E4 299.1516 1.7E5 314.0900 1.8E4 314.1748 1.2E7 314.2074 1.2E5 END IONS BEGIN IONS FEATURE_ID=187 PEPMASS=463.0843 SCANS=187 RTINSECONDS=233.87 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 58.2436 2.6E3 58.3518 2.5E3 61.9142 2.3E3 63.1569 2.4E3 71.7370 2.2E3 76.5545 2.0E3 77.4715 2.4E3 79.7907 2.1E3 82.8970 3.0E3 84.5570 2.4E3 86.0220 2.7E3 97.4950 2.3E3 101.0198 2.4E3 102.1988 2.1E3 105.5533 2.7E3 107.0489 1.6E5 115.3991 2.5E3 135.6958 2.9E3 137.0595 3.6E4 139.1784 2.5E3 143.0490 1.1E4 145.0645 2.4E4 151.0618 4.1E3 151.0752 1.3E5 163.0752 1.1E4 173.5215 8.4E3 173.5359 4.7E4 175.0752 6.6E4 177.0544 1.4E4 178.0860 2.9E3 187.0061 2.6E4 199.4230 2.2E3 209.0963 1.3E4 237.0909 7.1E4 249.7388 2.6E3 269.1171 9.9E5 286.1439 6.0E5 292.0454 2.8E3 317.0490 1.9E4 337.0768 3.4E3 349.0739 3.7E5 354.6861 2.4E3 365.6221 2.4E3 366.1004 7.6E5 END IONS BEGIN IONS FEATURE_ID=188 PEPMASS=579.1504 SCANS=188 RTINSECONDS=234.799 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 9 (4 removed due to low quality, 0 removed due to low cosine). 64.0690 2.2E3 67.9748 3.4E3 68.9972 3.6E4 74.5896 4.4E3 77.7600 4.7E3 80.4093 3.2E3 81.0334 3.8E4 91.8649 3.1E3 93.0326 2.9E3 94.7594 3.4E3 95.0490 2.0E4 95.0661 3.6E3 97.5877 3.3E3 99.0433 5.0E3 104.5003 3.4E3 107.0490 1.4E4 109.0282 3.9E4 110.9796 3.0E3 111.0075 6.5E4 111.0440 4.4E4 112.9825 3.9E3 119.0491 1.2E4 119.1970 4.3E3 119.7994 4.7E3 123.0439 2.0E6 123.0525 1.8E4 127.0388 6.2E6 127.0470 6.3E4 131.0486 3.6E3 135.0439 7.5E5 135.0559 3.1E4 137.0231 5.8E4 138.4362 2.3E3 139.0388 3.6E6 141.8822 2.3E3 147.0439 2.4E5 147.3388 3.7E3 149.0232 8.5E4 149.0597 4.9E3 151.0388 4.9E5 155.0342 4.2E3 159.0439 6.6E4 161.0596 1.4E5 163.0388 2.5E6 163.0520 2.2E4 163.0718 3.7E3 165.0545 4.3E5 167.0338 4.1E5 167.0500 5.6E3 169.0493 4.7E4 173.0598 3.4E4 173.2678 2.5E3 173.5293 1.4E5 173.5346 3.3E4 173.5450 2.1E4 175.0390 3.1E4 176.3088 3.3E3 177.0546 8.6E4 179.0337 1.9E5 179.0702 2.8E3 179.8385 5.2E3 181.0495 5.5E4 185.0598 7.7E3 187.0389 2.8E5 189.0548 3.4E4 191.0338 2.9E5 193.0496 4.1E4 197.0591 4.2E4 201.0546 1.7E5 203.0339 1.8E5 203.0701 1.3E5 205.0495 2.4E5 205.0852 2.8E3 207.0652 1.2E5 213.0549 9.7E3 215.0337 1.7E4 215.0702 9.0E4 217.0492 3.2E4 219.0649 8.5E3 221.0445 6.8E3 225.0546 5.9E4 227.0683 4.9E3 229.0244 4.4E3 229.0495 3.2E5 231.0651 6.8E4 233.0443 7.5E5 241.0493 5.6E4 243.0648 4.6E5 245.0442 3.9E5 247.0302 5.1E3 247.0597 1.2E6 247.0819 4.1E3 247.0902 1.5E4 249.0754 3.0E4 251.0546 2.3E5 253.0492 7.0E4 255.0650 8.8E4 257.0440 7.6E5 257.0761 6.9E3 258.0515 1.3E4 259.0283 1.1E4 259.0596 7.7E5 259.0846 7.4E3 261.0747 7.0E4 265.0488 7.1E3 269.0444 2.7E5 271.0250 1.6E4 271.0345 4.5E3 271.0600 1.6E6 273.0756 1.6E5 274.8860 2.5E3 275.0201 3.9E4 275.0299 4.6E3 275.0549 1.4E6 275.0898 3.4E4 283.0240 1.7E4 283.0600 8.0E5 283.0964 9.4E3 285.0421 6.8E3 285.0759 4.9E4 287.0265 8.3E3 287.0550 3.0E6 289.0707 1.5E5 291.0863 1.8E5 295.0587 1.3E4 297.0750 2.4E4 299.0550 5.2E5 299.0936 6.5E3 299.2197 2.5E3 301.0705 3.5E5 303.0864 7.5E4 311.0549 8.0E4 325.0700 5.3E4 341.1029 9.7E3 343.0807 3.1E3 367.0810 4.3E4 379.0800 3.8E4 391.0801 8.1E4 409.0912 9.5E5 411.1068 1.3E5 421.0940 2.5E4 427.1003 7.8E3 433.1005 2.6E3 435.1052 3.1E4 490.9424 5.2E3 520.2340 3.3E3 END IONS BEGIN IONS FEATURE_ID=189 PEPMASS=298.1442 SCANS=189 RTINSECONDS=234.973 CHARGE=1+ MSLEVEL=2 MERGED_STATS=8 / 8 (0 removed due to low quality, 0 removed due to low cosine). 47.4435 2.6E3 47.7730 7.8E4 47.7747 8.6E3 47.9493 3.4E3 48.0251 2.1E4 48.0264 4.6E3 48.0803 2.3E3 51.4611 2.5E3 51.5625 3.7E3 52.2511 2.1E3 53.7113 4.1E3 56.0495 1.5E4 58.0651 2.1E6 61.1351 2.2E3 62.8938 2.7E3 63.5368 2.3E3 63.6242 2.4E3 70.8794 2.7E3 71.0728 2.3E4 74.4666 3.6E3 77.1997 4.5E3 77.5542 2.4E3 77.7269 3.5E3 79.0543 2.0E4 79.3579 2.0E3 84.0439 2.4E3 86.9749 2.4E3 90.7011 2.2E3 91.0542 3.1E4 93.0697 9.4E4 95.0325 2.4E3 95.0490 3.6E4 95.6126 2.3E3 102.0464 7.2E3 103.0541 4.5E4 103.1627 2.8E3 105.0450 4.1E3 107.0362 7.6E3 107.0490 5.5E6 107.0576 3.1E3 107.0641 5.5E4 115.0541 4.9E4 117.0698 5.6E3 118.0414 2.8E4 119.0487 5.0E3 120.0809 4.7E3 121.0279 4.2E3 121.0646 1.1E6 121.0739 8.2E3 123.0439 1.5E5 125.3087 2.2E3 131.0490 2.3E4 132.0805 2.1E4 133.0646 4.8E3 135.0448 2.1E4 135.1032 3.8E3 140.3013 4.5E3 141.8761 2.5E3 143.0490 2.3E5 145.0646 1.0E5 145.0885 9.1E4 146.0222 4.1E3 146.0361 1.2E6 146.0494 3.8E3 146.0963 5.0E5 146.1083 4.0E3 147.0440 9.3E4 148.0520 4.2E4 148.0759 9.0E3 149.0596 9.8E4 150.0913 9.7E4 151.0748 2.1E4 154.5531 3.3E3 158.0964 6.2E4 158.9786 3.9E3 159.0440 4.0E3 159.0672 4.7E3 159.3471 2.8E3 159.8066 2.5E3 160.0756 6.3E4 161.0596 1.8E5 162.0914 3.1E4 163.0754 5.6E4 163.0990 3.5E4 164.1071 5.8E4 170.5391 2.5E3 170.8956 2.4E3 173.0594 2.9E4 173.0837 1.5E5 173.5232 5.8E4 173.5356 1.1E5 173.5432 3.0E4 174.0775 2.9E3 174.0914 8.7E5 174.1051 3.4E3 175.0992 2.4E4 176.0708 1.2E6 176.0845 5.3E3 176.1069 9.5E3 177.0608 3.8E3 177.0785 1.5E6 177.0919 5.7E3 178.0862 3.8E5 179.0859 2.8E4 181.0653 4.9E3 182.4985 3.1E3 182.7744 2.3E3 183.3216 2.7E3 185.0709 6.5E3 186.0436 2.8E3 186.0912 7.6E4 188.0704 1.7E4 189.0782 1.2E5 189.9556 4.1E3 190.0863 5.0E5 190.8955 3.3E3 191.0188 6.5E3 191.0416 1.6E4 191.0532 1.5E5 191.0616 7.0E4 191.0941 2.3E7 191.1265 1.3E5 191.1345 1.7E5 191.1461 4.9E4 191.1576 3.0E4 192.0606 2.4E4 192.1019 7.7E6 192.1224 8.5E3 192.1424 1.4E4 194.9701 3.6E3 195.9587 3.5E3 197.0963 2.0E4 199.0760 2.2E4 202.0862 3.9E4 204.1020 2.1E5 207.0576 9.6E3 207.0807 6.1E5 208.2188 2.6E3 209.0607 4.0E3 209.0965 9.7E3 210.0676 4.0E3 213.0663 1.1E4 218.8884 2.3E4 221.0960 1.0E4 225.0269 4.3E3 225.0909 7.6E4 227.0703 4.6E3 234.4553 2.6E3 235.0484 2.1E4 235.0754 6.8E5 235.1004 4.5E3 236.0832 4.1E3 236.9021 3.0E3 237.0910 1.5E4 243.3736 3.7E3 246.8859 1.0E4 251.0813 3.3E3 251.8541 3.9E3 252.1386 2.7E4 253.0859 4.1E5 255.1017 8.4E4 265.1097 1.4E4 280.1333 8.7E4 282.1120 1.7E4 283.1201 5.4E4 296.1284 1.1E5 296.9865 2.3E3 298.1441 4.7E5 END IONS BEGIN IONS FEATURE_ID=190 PEPMASS=272.1283 SCANS=190 RTINSECONDS=235.047 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 51.6276 2.2E3 52.1304 2.1E3 53.1370 2.1E3 55.0178 5.4E3 59.1029 2.2E3 63.6707 2.5E3 77.0385 3.0E3 79.0542 1.4E4 86.7522 2.9E3 91.0542 2.1E4 95.0490 2.0E4 97.3170 2.3E3 103.0545 6.8E3 104.7614 2.1E3 105.0444 3.1E3 105.0698 1.8E4 107.0319 6.0E3 107.0490 2.8E6 107.0658 1.2E4 115.0451 3.7E3 115.0541 1.7E5 115.9801 2.3E3 117.0697 1.6E4 119.0490 3.5E4 121.0283 2.0E4 121.0646 8.7E4 123.0335 4.5E3 123.0439 2.6E5 127.0538 3.1E3 130.4469 2.4E3 131.0491 2.8E4 133.0647 4.9E4 133.8714 2.4E3 134.2493 2.4E3 135.0440 5.2E4 136.0752 4.7E3 137.0594 2.4E4 143.0361 4.2E3 143.0490 4.9E5 143.0606 4.4E3 144.2052 2.3E3 145.0518 2.9E3 145.0646 2.7E5 147.0441 8.7E3 148.6515 2.3E3 149.0595 2.9E4 155.0602 2.4E3 161.0440 8.5E3 161.0596 4.6E5 161.0754 1.3E4 162.0672 7.1E3 164.0706 1.6E5 166.0790 2.6E3 171.0820 2.9E3 173.5186 8.4E3 173.5340 7.8E4 178.0860 9.3E3 181.0643 1.4E4 181.1012 2.5E4 191.0853 3.9E4 194.0724 3.3E4 195.0808 7.3E3 199.0747 6.0E3 203.8830 2.6E4 205.8987 3.3E3 209.0607 7.9E3 209.0961 1.6E5 216.8911 3.5E3 219.0804 3.3E4 220.0887 2.6E3 222.0671 2.6E3 226.0623 3.4E4 227.0700 2.7E3 227.1070 1.6E4 237.0909 1.7E5 240.0779 3.5E4 255.0700 5.6E3 255.1013 4.9E5 255.1324 1.0E4 272.1278 5.5E4 END IONS BEGIN IONS FEATURE_ID=191 PEPMASS=344.1861 SCANS=191 RTINSECONDS=236.677 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 5 (2 removed due to low quality, 0 removed due to low cosine). 50.4313 2.4E3 50.9239 2.3E3 54.2824 2.4E3 58.0651 9.6E5 58.0680 6.4E3 58.1151 2.3E3 59.7034 2.5E3 85.8804 2.4E3 86.4003 2.4E3 88.6502 2.2E3 89.0593 1.7E5 91.0535 2.8E3 123.0336 4.5E3 123.0437 2.5E5 125.0795 2.7E3 133.0857 4.1E4 136.0518 2.6E3 136.9394 2.6E3 137.0594 5.8E4 140.4634 2.3E3 143.0490 1.5E4 149.0585 3.0E3 151.0752 5.4E4 158.0728 1.1E4 161.0596 4.0E4 163.0751 3.3E4 164.0832 2.7E3 165.0907 2.9E4 173.5298 4.8E4 173.5422 6.3E3 174.0673 2.7E4 174.6175 2.4E3 175.0759 6.8E3 177.0910 1.5E4 189.0909 2.0E5 190.0988 4.2E3 190.1230 4.8E3 191.1062 2.7E3 206.1174 2.7E4 207.1253 2.1E4 208.1336 5.8E3 241.1185 2.5E3 251.1058 2.5E3 268.1091 2.9E4 281.1165 2.7E3 284.1047 2.8E4 286.1205 3.8E3 289.1201 2.6E3 299.1280 1.2E5 301.1435 2.4E4 329.1635 3.3E3 344.1855 1.8E5 END IONS BEGIN IONS FEATURE_ID=192 PEPMASS=279.1708 SCANS=192 RTINSECONDS=236.946 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 3 (1 removed due to low quality, 0 removed due to low cosine). 49.7305 2.6E3 64.9107 2.2E3 72.6184 2.5E3 74.7688 2.3E3 86.0963 3.4E4 89.0384 1.1E4 94.2644 2.3E3 103.1233 8.3E3 117.0334 6.2E4 118.3118 2.3E3 120.9509 2.3E3 134.0369 2.5E3 145.0282 6.0E5 149.0231 9.0E3 149.0594 3.4E4 163.0389 4.4E3 172.6423 2.6E3 173.0508 5.2E3 173.5335 2.4E4 177.0546 1.0E6 186.0551 2.8E3 201.0465 3.1E4 219.0570 2.2E5 219.0817 3.5E3 279.0932 1.6E5 END IONS BEGIN IONS FEATURE_ID=193 PEPMASS=285.1239 SCANS=193 RTINSECONDS=237.373 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 3 (1 removed due to low quality, 0 removed due to low cosine). 49.8395 2.4E3 50.7039 2.3E3 52.1777 2.1E3 67.6796 2.4E3 91.0542 5.1E4 95.0493 4.3E3 99.9891 2.6E3 107.0492 4.3E3 111.3175 2.4E3 118.0651 1.7E4 119.0491 6.8E4 120.0445 2.5E3 123.0440 1.1E6 123.0527 3.2E3 123.0547 6.2E3 123.0652 6.8E3 129.5985 2.7E3 130.0653 5.5E3 133.0519 3.7E3 136.9816 2.8E3 137.0596 1.4E4 146.0600 9.7E5 146.0738 3.3E3 148.0392 5.4E4 149.0471 7.5E4 158.0601 8.8E3 159.0675 2.3E3 170.3810 2.3E3 173.5329 2.3E4 180.0805 2.5E3 185.6814 2.7E3 194.0965 3.2E4 195.0820 3.3E3 198.0914 2.5E4 201.3662 2.5E3 203.8832 1.7E4 204.0809 6.6E3 205.8986 4.1E3 206.8524 2.6E3 207.0683 1.5E4 212.1071 1.2E4 220.9784 2.9E3 221.0825 4.5E3 221.8950 2.9E3 222.0655 3.5E3 222.0917 2.0E5 222.1170 4.8E3 224.2107 2.7E3 225.0790 1.6E4 226.2140 2.4E3 232.0745 3.9E3 233.0834 2.2E4 235.0618 4.4E3 236.0694 3.3E3 238.0878 3.4E3 240.1021 1.3E5 249.0782 5.7E3 250.0863 4.6E5 250.1158 4.4E3 251.0942 4.7E3 252.0663 3.3E3 253.0732 1.0E4 256.0958 5.6E3 267.0883 6.7E3 268.0969 5.5E5 285.0884 4.8E3 END IONS BEGIN IONS FEATURE_ID=194 PEPMASS=328.1548 SCANS=194 RTINSECONDS=240.905 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 49.7222 2.2E3 50.7822 2.4E3 53.4818 2.4E3 55.2758 1.4E4 55.2772 3.7E3 56.4647 2.7E3 57.7077 2.4E3 58.0649 6.2E4 61.4037 2.5E3 62.1018 2.3E3 63.5819 2.3E3 68.2005 2.6E3 68.6325 2.5E3 72.0443 2.5E3 77.6448 2.4E3 81.3436 2.3E3 85.9045 3.0E3 86.1764 2.4E3 93.0695 5.6E3 98.2820 2.3E3 102.9273 2.4E3 107.0489 3.2E5 107.0575 4.1E3 111.4440 2.2E3 114.5152 2.4E3 115.6307 2.4E3 119.7623 2.8E3 121.0645 1.0E5 131.0488 1.4E4 136.0755 9.1E3 140.5822 2.6E3 141.3195 2.4E3 147.0439 2.9E4 148.0517 5.2E4 150.0908 5.2E3 153.0544 6.8E3 156.5313 2.3E3 159.0441 1.6E4 161.0596 6.3E3 162.0912 4.4E4 163.0390 4.7E3 166.1225 4.6E4 173.5286 3.0E4 173.5413 1.5E4 175.0987 2.6E3 176.0468 8.8E4 176.7163 2.3E3 177.0545 4.1E4 178.0622 3.3E4 178.0865 6.1E3 179.0699 2.5E4 183.2207 2.8E3 189.0550 5.6E3 189.0776 3.1E3 190.0862 1.2E5 191.0703 4.5E4 191.0940 3.7E4 192.0651 6.9E3 192.1039 3.4E3 194.1172 4.2E3 195.0805 3.2E4 196.8240 2.4E3 203.0940 5.1E4 206.0811 8.0E5 206.0988 3.3E3 207.0889 2.1E5 208.0965 1.7E4 220.0967 3.2E4 221.1046 4.0E6 221.1555 2.6E4 222.1124 9.1E5 222.1378 5.8E3 223.0755 8.0E4 229.5221 2.8E3 233.0589 3.3E3 251.0699 8.5E4 253.0868 1.0E4 255.1016 4.4E4 273.4193 2.6E3 283.0972 2.7E4 302.0762 2.5E3 304.4926 2.4E3 309.7039 2.2E3 311.8787 2.5E3 313.1290 2.5E3 328.1540 3.6E4 END IONS BEGIN IONS FEATURE_ID=195 PEPMASS=716.2221 SCANS=195 RTINSECONDS=242.636 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 68.9969 3.6E3 74.2791 2.2E3 75.0441 1.2E4 85.0283 8.2E3 89.0593 7.8E3 91.0540 3.0E4 93.0332 7.8E4 93.0697 1.3E4 95.0490 1.2E4 95.0668 2.5E3 95.0743 2.3E3 97.0645 2.6E3 98.8162 2.3E3 103.0542 6.6E3 106.0411 4.8E4 107.0490 1.1E4 111.0434 2.8E3 120.1080 2.7E3 121.0284 5.2E3 121.0556 2.2E3 121.0645 1.0E5 125.0595 5.6E4 126.9521 2.6E3 127.2786 2.4E3 131.0485 1.2E4 134.0359 9.7E3 135.0438 7.6E3 137.0596 2.8E3 139.0754 8.3E3 145.0278 1.2E4 145.0642 4.4E3 147.0436 2.5E3 149.0459 3.3E3 149.0595 2.9E5 151.0754 1.8E4 153.0541 1.2E4 153.0908 1.0E5 155.0679 2.6E3 156.6028 2.4E3 160.0518 2.5E3 163.0388 4.8E4 163.0754 9.0E3 167.0701 5.3E4 173.0597 1.4E4 173.5283 1.5E4 173.5377 3.0E4 177.0546 2.7E5 177.4534 2.9E3 179.0703 3.2E4 180.0421 1.6E4 181.0488 9.9E3 181.0677 3.7E3 181.0859 2.1E5 182.0940 1.9E4 191.0703 5.2E4 192.0781 3.0E4 195.0651 4.1E4 205.0858 7.0E3 207.0652 2.7E4 207.0872 6.2E3 209.0810 3.1E5 210.0886 2.4E4 217.0495 5.8E3 217.0855 2.6E4 223.0603 8.6E5 223.0865 4.7E3 242.4029 2.6E3 261.0754 2.5E3 300.4503 2.3E3 301.6497 2.3E3 334.9418 2.3E3 355.9355 2.5E3 383.1138 1.7E4 595.9135 2.6E3 630.4851 2.4E3 646.2646 2.9E3 720.3608 2.9E3 END IONS BEGIN IONS FEATURE_ID=196 PEPMASS=300.1599 SCANS=196 RTINSECONDS=242.946 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 48.4550 6.5E3 53.0387 8.5E3 55.0178 3.3E4 58.0651 1.3E5 60.3291 6.6E3 60.7633 7.0E3 64.4360 7.1E3 64.8503 8.1E3 67.7597 5.3E3 77.0388 2.7E4 79.0542 4.5E4 81.0335 9.4E3 88.4188 5.3E3 91.0541 1.4E5 93.0700 7.6E4 94.4816 6.4E3 95.0490 1.5E5 103.0542 6.3E4 105.0697 7.6E4 107.0320 1.3E5 107.0490 1.8E7 107.0557 1.3E5 107.0620 5.9E4 107.0665 2.2E5 107.0708 2.7E4 107.0812 1.4E4 107.1617 8.5E3 109.0647 8.4E4 111.0435 4.2E4 115.0542 4.6E5 117.0698 1.7E5 119.0490 4.5E5 119.0846 9.0E3 120.5591 6.4E3 121.0278 2.3E4 121.0647 1.6E6 121.0792 1.0E4 123.0439 4.2E4 125.0595 3.8E4 127.3353 7.3E3 129.0700 1.2E4 130.2343 8.7E3 131.0490 4.7E5 133.0289 1.7E4 133.0540 1.7E4 133.0647 5.3E5 135.0432 7.9E3 135.0805 6.3E4 137.0596 2.3E6 137.0694 1.2E4 137.0771 2.4E4 139.0751 4.7E4 143.0490 2.0E6 143.0587 1.1E4 143.0627 9.0E3 144.0569 1.1E5 145.0647 2.3E6 145.0748 1.5E4 145.0783 3.3E4 147.0437 3.9E4 147.0804 3.0E5 149.0596 1.7E5 149.9697 7.7E3 151.0753 4.4E5 155.0602 5.4E4 155.0845 1.0E4 157.0648 9.0E4 160.0519 3.7E5 161.0594 7.5E4 162.0675 1.3E5 162.0913 8.7E4 163.0638 5.6E3 163.0754 8.3E5 163.0911 8.9E3 164.0707 8.4E3 165.0692 1.2E4 165.0912 2.0E4 166.0779 4.1E4 167.0853 4.0E4 169.0651 9.0E3 169.1017 2.3E4 173.5260 1.1E5 173.5425 5.9E4 174.0916 4.1E4 175.0755 4.2E6 176.0834 8.6E4 177.0911 2.3E5 178.0861 1.3E5 179.0861 1.7E5 180.1019 3.4E5 181.0648 1.3E5 181.1013 1.5E5 182.0726 1.3E5 183.0804 7.5E4 189.0909 4.3E4 191.0860 2.1E5 192.1019 3.2E5 193.1091 5.2E4 194.0727 1.8E5 194.1180 1.5E4 195.0803 1.1E5 196.0890 7.0E3 197.0621 5.1E4 197.0750 8.1E3 197.0962 2.2E6 197.1172 2.1E4 206.1178 4.8E4 207.0807 1.4E5 208.0890 9.1E3 209.0601 2.7E4 209.0962 1.7E6 209.1148 7.2E3 210.0678 9.7E4 211.0755 6.6E4 211.1119 2.4E5 219.0806 3.1E5 220.0875 8.7E3 221.0965 7.4E4 222.0673 4.5E4 223.1112 5.3E4 225.0652 8.1E3 225.0911 1.4E6 225.1096 9.6E3 225.1173 2.9E4 226.0991 3.4E4 227.1079 6.3E3 235.0750 1.0E4 236.0838 3.7E4 237.0910 4.8E6 238.0988 1.6E5 239.0707 1.3E4 239.0721 4.9E4 239.1067 2.4E5 240.0780 1.5E5 241.0863 6.5E4 241.1229 1.2E4 242.0940 5.5E4 243.1015 4.9E4 251.1065 1.7E5 254.0936 3.6E5 257.1171 1.1E6 257.1433 7.4E3 261.2114 7.3E3 267.1022 9.4E3 268.1331 4.9E4 269.1172 4.6E6 271.1328 1.8E5 283.1325 6.0E4 292.8751 8.4E3 293.1692 6.9E3 300.1596 2.4E6 300.1898 1.0E4 END IONS BEGIN IONS FEATURE_ID=197 PEPMASS=434.1815 SCANS=197 RTINSECONDS=244.424 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 6 (3 removed due to low quality, 0 removed due to low cosine). 55.0178 1.8E4 56.0744 4.1E3 57.0334 4.5E4 60.7733 2.3E3 61.0283 9.2E4 63.7746 2.9E4 63.7766 4.6E3 63.9190 3.0E3 67.0544 2.6E3 68.0314 3.1E4 68.0340 7.4E3 69.0334 2.8E5 71.0490 3.8E4 73.0283 6.3E4 74.7757 3.3E3 78.3886 3.4E3 79.0542 4.0E3 81.0334 8.7E4 82.6762 3.6E3 85.0283 7.8E5 85.0330 3.8E3 85.7832 3.3E3 87.0439 1.5E5 87.3215 3.2E3 91.0389 6.5E4 93.9614 3.0E3 95.0491 2.3E4 97.0283 2.8E5 98.7216 3.6E3 99.0440 7.9E4 101.0230 1.5E4 103.0385 9.7E3 107.0320 8.8E3 107.0490 4.4E6 107.0661 3.7E4 109.0283 1.1E5 115.0389 2.3E4 115.0543 9.4E4 117.0703 8.5E3 119.0492 2.8E4 121.0286 9.8E3 121.0647 1.8E5 122.1854 3.9E3 123.0440 8.4E5 127.0389 2.6E5 127.0499 2.3E3 131.0491 1.2E4 133.0648 5.0E4 135.0439 2.1E4 135.0679 3.1E4 136.0757 2.5E4 137.0596 8.3E4 143.0491 1.1E6 145.0498 9.2E4 145.0647 6.2E5 146.0724 1.1E4 147.0442 2.8E4 147.5950 3.1E3 148.0755 9.1E3 149.0596 8.5E4 152.0709 1.4E4 161.0597 1.2E6 164.0707 7.2E5 164.0938 9.0E3 165.0780 1.8E4 173.0602 1.3E4 173.5245 2.6E4 173.5406 3.1E4 174.7803 3.3E3 175.0748 4.4E3 176.0711 1.7E4 177.9647 3.9E3 178.0865 6.8E4 185.0611 3.8E3 191.0857 5.0E3 194.0731 5.9E3 209.0608 4.0E3 209.0963 1.1E5 219.0805 2.9E4 226.0631 3.3E4 227.0701 2.9E4 227.1069 5.5E4 237.0912 2.9E5 237.1178 5.3E3 239.1067 7.0E3 240.0780 1.9E4 243.1017 1.0E4 253.0861 2.8E4 254.0918 1.0E4 255.0202 6.9E3 255.0385 5.3E4 255.0516 3.5E4 255.1016 7.3E6 255.1519 2.6E4 255.1640 4.7E4 255.1820 6.6E3 257.1173 1.1E4 267.1018 8.3E4 270.1127 9.6E4 271.1208 4.2E4 272.0582 6.4E4 272.1282 1.0E7 272.2782 4.5E3 279.1016 1.6E4 296.1287 8.3E3 297.1135 1.2E4 314.1385 3.5E4 326.1249 8.5E3 334.3707 2.8E3 398.1612 7.4E3 416.1717 2.0E4 434.1809 1.5E6 END IONS BEGIN IONS FEATURE_ID=198 PEPMASS=274.1078 SCANS=198 RTINSECONDS=245.006 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 48.7781 2.2E3 49.3094 2.3E3 53.1359 2.2E3 54.2743 2.2E3 55.4401 2.5E3 57.3588 2.3E3 58.5965 2.7E3 61.4115 2.8E3 66.5356 2.4E3 67.7422 2.4E3 77.0383 2.8E3 80.4639 2.4E3 81.0333 1.9E4 81.6762 2.6E3 91.0539 4.2E4 93.0638 2.7E3 93.0696 1.0E5 95.0489 2.0E4 99.4969 2.5E3 103.0539 5.6E4 105.0449 3.1E3 109.0282 7.4E3 109.6413 2.4E3 115.8174 2.5E3 117.7123 2.4E3 121.0645 1.6E6 121.0734 2.5E4 127.0387 1.4E4 130.2968 2.4E3 131.0490 6.2E3 137.0231 9.6E5 137.0334 1.8E4 138.0910 3.5E4 154.0496 3.4E4 173.5314 7.0E4 174.2057 2.7E3 180.0647 4.0E3 214.9274 2.3E3 222.9050 6.9E3 246.6720 2.7E3 254.2483 2.4E3 279.7553 2.7E3 281.6310 2.5E3 END IONS BEGIN IONS FEATURE_ID=199 PEPMASS=595.1662 SCANS=199 RTINSECONDS=245.081 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 5 (1 removed due to low quality, 0 removed due to low cosine). 68.1561 2.4E3 68.2891 2.6E3 78.5007 2.5E3 83.3368 2.9E3 85.0281 1.6E4 90.3078 2.5E3 102.4310 2.5E3 103.0386 1.1E4 103.3645 2.1E3 105.4384 2.5E3 108.3999 2.3E3 111.3319 2.9E3 120.7525 2.5E3 121.0281 1.1E4 152.5840 2.3E3 157.1058 2.7E3 163.5297 2.5E3 172.4120 2.5E3 173.5197 5.1E3 173.5298 5.7E4 173.5386 2.1E4 223.4535 2.5E3 225.7215 2.3E3 256.1513 2.4E3 281.0765 2.8E3 283.0592 1.5E4 283.2873 2.7E3 287.0192 2.5E3 294.0522 2.0E4 295.0601 2.8E5 301.1614 3.4E3 307.0598 2.4E5 308.0675 1.4E4 309.0761 1.5E4 313.0700 3.7E4 315.5274 2.7E3 319.0602 6.9E3 321.0749 2.6E4 322.0848 6.7E3 323.0547 2.7E4 325.0704 7.8E5 327.0509 2.4E3 333.0762 1.7E4 335.0915 3.8E4 336.0630 5.3E3 337.0702 4.8E5 347.0911 4.5E4 349.0702 3.0E5 349.1202 7.1E3 351.0502 7.1E3 351.0862 7.3E4 353.0646 4.9E3 355.0807 2.4E5 355.1288 4.8E3 357.0746 3.8E3 361.0212 4.6E3 361.0701 1.4E5 361.1152 4.5E3 363.0858 4.6E4 365.0605 3.3E3 365.1018 9.2E4 367.0805 4.0E4 373.0701 3.6E4 375.0865 7.8E4 375.5627 2.8E3 377.0626 8.3E3 379.0808 6.5E5 379.1399 3.1E3 385.0708 3.1E4 389.1038 2.6E4 391.0810 3.4E5 393.0972 3.6E4 397.0915 9.0E3 401.1027 9.3E3 403.0814 3.4E5 405.0975 2.7E3 409.0294 4.3E3 409.0916 3.8E5 409.1573 3.0E3 413.0988 7.4E3 415.0842 3.6E4 417.0975 3.1E4 421.0916 2.9E5 421.1525 4.4E3 427.1004 2.1E5 429.0981 1.6E4 431.1136 2.1E4 433.0924 4.6E4 435.1082 1.1E4 439.1022 2.1E5 441.0982 1.5E4 445.0917 8.0E4 449.1236 1.6E4 451.1003 8.8E3 457.1084 1.6E5 459.1043 8.1E3 463.1018 1.1E5 469.0951 2.9E4 475.1031 5.4E4 477.1138 4.0E3 481.1127 1.1E5 487.1023 5.6E4 493.1129 2.8E4 499.1226 1.4E4 505.1129 5.6E4 511.1224 1.2E4 523.1220 6.8E4 541.1334 4.1E4 559.1455 4.3E3 589.3495 2.3E3 597.1478 2.4E3 END IONS BEGIN IONS FEATURE_ID=200 PEPMASS=366.1007 SCANS=200 RTINSECONDS=245.17 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 52.1582 2.7E3 56.1261 2.2E3 60.0442 3.8E3 60.6836 2.4E3 64.2324 2.3E3 73.4578 2.3E3 84.5430 2.8E3 88.6851 2.7E3 96.2281 2.7E3 107.0406 4.8E3 107.0487 7.9E5 107.0568 1.1E4 110.9392 2.4E3 112.4905 2.4E3 115.0543 1.1E4 115.7301 2.6E3 119.0488 3.4E3 121.0643 1.4E4 131.0487 8.3E3 137.0480 3.5E3 137.0593 1.1E5 143.0488 7.4E4 145.0643 1.1E5 151.0749 4.3E4 156.5767 2.5E3 160.0516 5.4E3 161.0601 3.0E3 162.0676 8.1E3 163.0751 3.2E4 165.2919 2.4E3 165.3075 2.7E3 172.6300 2.4E3 173.5337 7.8E4 173.5447 4.4E3 175.0577 3.7E3 175.0750 2.5E5 175.0931 2.7E3 178.0861 1.1E4 178.7078 2.3E3 181.1008 2.6E3 187.0058 3.4E4 189.0412 2.7E3 194.0740 3.8E3 209.0959 7.9E4 219.0803 1.3E4 237.0908 3.1E5 238.7372 3.0E3 254.0931 1.7E4 258.1452 2.9E3 269.1170 8.9E5 269.1437 4.7E3 286.1440 8.9E4 317.0457 2.9E3 349.0737 2.8E4 356.5420 2.4E3 366.0999 1.0E4 END IONS BEGIN IONS FEATURE_ID=201 PEPMASS=269.1174 SCANS=201 RTINSECONDS=246.235 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 2 (0 removed due to low quality, 0 removed due to low cosine). 46.0173 2.1E3 48.7115 2.5E3 53.7501 2.3E3 54.0128 2.5E3 55.7762 2.2E3 55.8205 2.3E3 57.3779 2.1E3 62.5745 2.4E3 62.8376 2.3E3 62.8808 2.4E3 62.9607 2.4E3 63.6892 2.2E3 77.0376 2.6E3 79.0540 6.5E3 86.3018 2.6E3 86.9051 2.3E3 89.0910 2.2E3 91.0538 5.3E3 95.0488 5.1E3 107.0487 8.5E5 107.0571 6.8E3 115.0538 5.3E4 117.0694 1.3E4 125.5347 2.3E3 131.0484 2.1E4 137.0593 6.5E4 143.0488 9.6E4 144.0567 1.1E4 145.0644 7.8E4 147.0800 2.9E3 149.8514 2.5E3 155.0604 5.0E3 157.5365 2.3E3 160.0514 3.2E4 162.0677 3.0E3 163.0750 1.3E4 166.0778 4.0E3 169.1316 2.9E3 173.5210 6.9E3 173.5296 1.3E4 173.5396 1.2E4 175.0751 9.8E4 175.1015 2.4E3 176.0827 3.5E3 181.0642 5.1E3 181.1012 7.4E3 183.5016 2.9E3 191.0850 3.2E4 194.0724 2.4E4 195.0806 3.4E3 197.0560 2.8E3 209.0960 8.6E4 217.2418 2.3E3 219.0805 2.3E4 222.0678 3.5E3 237.0907 1.2E5 238.0989 3.8E3 239.0702 7.0E3 254.0931 2.0E4 266.9699 2.4E3 269.1173 2.3E4 END IONS BEGIN IONS FEATURE_ID=202 PEPMASS=286.1443 SCANS=202 RTINSECONDS=246.569 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 9 (7 removed due to low quality, 0 removed due to low cosine). 53.5936 1.9E4 55.0178 1.0E5 58.5336 1.7E4 72.1167 1.6E4 76.4468 1.6E4 77.0385 7.5E4 79.0541 1.6E5 82.2612 2.2E4 91.0541 2.9E5 93.0699 6.8E4 95.0490 3.7E5 103.0542 9.8E4 105.0447 7.1E4 107.0126 2.8E4 107.0318 2.7E5 107.0490 5.2E7 107.0568 7.7E5 107.0624 2.2E5 107.0667 5.0E5 107.0720 1.4E5 107.0775 7.4E4 109.0646 1.1E5 115.0541 1.9E6 116.2974 1.6E4 117.0697 4.9E5 119.0490 3.3E5 121.0281 4.6E4 121.0647 9.9E5 125.0590 3.9E4 129.0694 7.0E4 131.0490 1.2E6 133.0642 9.1E4 137.0595 4.5E6 137.0693 2.4E4 143.0490 6.1E6 143.0597 1.5E5 144.0568 3.5E5 145.0646 4.7E6 145.0765 6.4E4 147.0434 2.4E4 147.0800 1.9E5 148.0755 8.1E4 149.0600 3.7E4 151.0752 1.0E6 155.0601 2.1E5 160.0517 1.3E6 160.0750 7.7E4 161.0598 1.6E5 162.0675 2.9E5 163.0594 1.8E4 163.0753 1.3E6 165.0694 7.4E4 166.0779 1.4E5 167.0846 6.0E4 173.5244 1.2E5 173.5425 8.6E4 175.0753 8.8E6 176.0832 2.5E5 178.0862 4.4E5 179.0841 3.1E4 181.0645 4.3E5 181.1011 5.3E5 190.0783 6.3E4 191.0854 1.1E6 194.0725 8.0E5 195.0803 2.2E5 197.0595 8.9E4 197.0960 1.6E5 204.3862 1.7E4 207.0797 8.9E4 208.0888 3.2E4 209.0596 4.6E4 209.0961 4.9E6 209.1139 2.6E4 211.0753 2.9E4 211.6944 2.5E4 212.0832 7.6E4 218.0723 2.8E4 219.0804 1.1E6 220.0878 7.9E4 222.0678 1.8E5 223.0757 2.0E4 225.0913 4.1E4 226.1009 2.0E4 226.5099 1.7E4 229.0749 5.4E4 235.0745 8.0E4 236.0827 8.4E4 237.0908 1.1E7 237.1131 5.9E4 238.0986 4.5E5 239.0703 2.5E5 240.0778 3.9E5 241.0859 1.5E5 254.0933 1.2E6 254.1155 1.0E4 267.1009 5.9E4 269.1169 5.9E6 286.1437 3.7E5 END IONS BEGIN IONS FEATURE_ID=203 PEPMASS=239.0918 SCANS=203 RTINSECONDS=248.389 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 45.0333 2.0E4 46.7545 2.1E3 49.3816 2.3E3 55.2685 2.1E3 55.9343 6.5E3 65.8606 2.3E3 66.4161 2.7E3 73.7033 2.1E3 76.1465 2.6E3 76.1813 2.7E3 78.1351 2.2E3 79.6533 2.7E3 83.6646 2.5E3 89.0590 1.2E4 91.0544 3.8E3 95.7985 2.2E3 109.0650 3.3E3 121.0646 8.0E3 123.0437 3.9E3 125.0587 2.6E3 125.7148 3.0E3 138.0673 1.6E5 139.0389 2.6E3 139.0753 2.5E4 149.0594 2.0E4 154.0622 1.3E5 162.0661 3.0E3 163.0392 9.7E3 164.0831 2.0E4 165.0553 4.5E3 169.0693 7.4E3 169.0859 3.0E5 173.5345 3.6E4 178.0622 5.0E3 179.0704 1.4E4 180.0773 4.1E3 182.9088 2.6E3 189.1554 2.4E3 190.0622 9.9E3 191.0342 1.1E4 193.0861 1.3E4 197.0808 1.7E4 204.5563 2.1E3 240.7866 2.5E3 END IONS BEGIN IONS FEATURE_ID=204 PEPMASS=300.1600 SCANS=204 RTINSECONDS=251.745 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 5 (0 removed due to low quality, 0 removed due to low cosine). 51.3136 2.5E3 51.7415 2.4E3 55.0009 2.4E3 57.2105 2.5E3 58.0649 1.4E5 59.8523 2.4E3 64.6631 2.5E3 70.2385 2.3E3 72.0439 2.2E3 75.4605 2.2E3 75.6734 2.4E3 78.1739 2.4E3 79.4854 2.3E3 81.9497 2.5E3 85.1561 2.2E3 91.0540 1.4E4 93.5369 2.6E3 94.6220 2.3E3 95.0491 8.5E3 96.4099 2.6E3 107.0406 4.7E3 107.0489 1.8E6 107.0575 5.0E3 107.0656 3.3E3 109.0643 2.8E3 115.0539 3.6E4 117.0698 1.2E4 118.0123 2.3E3 118.2423 2.7E3 119.0488 3.3E4 121.0645 1.2E5 125.8203 2.8E3 131.0490 4.1E4 133.0644 3.2E4 136.3253 2.3E3 137.0480 4.4E3 137.0593 2.0E5 138.1542 2.6E3 143.0488 1.9E5 145.0644 2.1E5 145.9738 2.5E3 147.0803 3.0E4 149.0599 1.2E4 151.0751 5.1E4 159.8517 3.1E3 160.0516 3.3E4 160.7250 2.6E3 161.0592 1.5E4 162.0677 8.0E3 163.0752 6.9E4 167.1274 2.3E3 173.5285 6.7E4 173.5423 2.4E4 174.0910 2.6E3 175.0575 3.3E3 175.0752 4.4E5 175.0933 9.9E3 176.0837 3.5E3 177.0764 2.7E3 177.0910 3.4E3 177.3412 2.2E3 177.8664 2.6E3 178.0863 2.0E4 179.0928 2.3E3 180.1016 2.7E4 180.8885 2.9E3 181.0643 1.2E4 181.1009 1.6E4 182.0058 2.8E3 183.0800 5.0E3 185.9177 2.5E3 191.0853 3.0E4 192.1019 4.6E4 193.1090 2.9E3 193.3759 2.4E3 194.0722 2.4E4 195.0804 7.2E3 195.8750 3.1E3 197.0617 2.4E3 197.0960 1.2E5 197.1148 4.1E3 197.8907 2.0E4 198.0833 2.3E3 209.0962 2.1E5 210.0671 3.0E3 211.0754 9.7E3 211.1115 2.3E4 217.4424 2.8E3 219.0809 3.0E4 225.0907 7.8E4 227.3590 2.8E3 237.0909 3.2E5 238.0987 8.1E3 239.0718 3.3E3 239.1065 2.2E4 240.0788 4.4E3 241.0853 4.0E3 243.1010 7.2E3 246.9629 2.2E3 253.8802 8.7E3 254.0935 5.1E4 255.1012 7.0E3 257.1169 5.0E4 268.1338 1.3E4 269.1171 3.9E5 271.1327 1.8E4 282.7471 2.4E3 300.1211 8.3E3 300.1596 2.2E5 300.1966 4.6E3 308.4383 2.4E3 END IONS BEGIN IONS FEATURE_ID=205 PEPMASS=426.0515 SCANS=205 RTINSECONDS=253.121 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 6 (0 removed due to low quality, 0 removed due to low cosine). 56.8888 2.3E3 57.4982 2.4E3 63.0556 2.3E3 63.2300 2.4E3 71.5476 2.3E3 71.9180 2.2E3 73.1507 2.2E3 79.9587 2.2E3 80.4619 2.3E3 84.8456 2.2E3 87.0706 2.1E3 87.6863 2.6E3 91.2345 2.5E3 93.6229 2.6E3 94.1228 2.8E3 98.5128 2.7E3 101.2826 2.5E3 101.4207 2.2E3 104.3014 2.1E3 132.4156 2.5E3 135.3777 2.5E3 137.5507 2.4E3 149.6855 9.4E3 151.0389 1.7E4 151.9654 2.7E3 173.5258 3.7E4 173.5391 3.8E4 173.8673 2.2E3 176.9653 3.5E3 185.3577 2.7E3 194.9739 1.0E5 195.9814 6.2E3 197.5782 2.5E3 205.9675 4.3E4 207.9815 4.2E3 209.9612 2.9E3 210.9684 1.0E4 211.9768 1.2E4 212.9846 1.0E4 217.9678 3.2E3 217.9898 7.9E4 221.9614 4.8E4 222.0540 2.2E3 222.9692 2.7E4 223.9767 9.2E5 224.0133 6.5E3 230.7996 2.8E3 235.9764 3.2E3 236.9839 2.9E3 237.9291 4.3E3 237.9559 3.3E5 237.9824 5.2E3 239.9717 1.7E4 241.9871 1.7E5 242.0122 2.5E3 245.9847 2.5E4 246.9925 1.5E6 260.0119 6.6E3 265.0031 7.5E4 269.9970 6.5E3 273.9914 8.0E3 285.9901 2.4E3 287.9734 1.0E4 288.0089 2.3E4 297.9920 4.5E4 301.9877 3.7E4 314.9951 2.8E5 315.0352 4.7E3 316.0032 1.8E5 318.9317 2.5E3 325.9874 2.8E4 334.0134 6.4E4 342.9929 2.4E3 343.9976 1.3E6 353.0127 3.0E3 362.0068 1.4E4 381.3143 2.6E3 427.5162 2.4E3 END IONS BEGIN IONS FEATURE_ID=206 PEPMASS=291.0868 SCANS=206 RTINSECONDS=253.23 CHARGE=1+ MSLEVEL=2 MERGED_STATS=7 / 9 (2 removed due to low quality, 0 removed due to low cosine). 47.5347 2.5E3 50.2892 3.1E3 50.3610 2.6E3 50.6609 2.2E3 51.0233 1.5E4 51.2154 2.0E3 53.0386 2.4E4 54.0335 3.0E3 55.0178 2.2E5 55.0542 1.7E4 58.6885 2.2E3 59.0484 2.4E3 59.1180 2.5E3 59.6644 2.3E3 61.2477 2.3E3 61.7242 2.2E3 61.7602 2.1E3 63.0949 2.3E3 65.0386 9.3E4 66.7214 2.4E3 67.0179 6.2E3 67.0541 2.1E5 68.2214 2.5E3 68.9970 2.3E5 69.0336 1.7E4 70.5023 2.1E3 71.0127 2.6E3 71.0485 2.5E3 71.6693 2.5E3 77.0387 3.4E4 78.1814 2.5E3 79.0546 6.1E3 81.0333 3.9E4 83.0491 1.9E5 85.0283 6.2E4 91.0542 1.2E5 92.7875 2.4E3 93.0334 1.2E5 95.0490 6.4E5 97.0282 5.5E4 99.0439 4.3E4 101.9428 2.6E3 104.2666 2.9E3 104.5693 2.6E3 105.0335 3.4E4 105.0444 2.5E3 105.0697 1.7E4 107.0491 6.8E4 109.0282 2.7E4 109.6215 2.4E3 111.0076 7.3E4 111.0439 3.0E5 115.0542 7.0E4 117.0701 2.8E3 118.9399 2.5E3 119.0392 1.6E4 119.0491 9.3E5 119.0592 1.1E4 120.4250 2.6E3 121.0283 4.2E4 121.0387 2.5E3 122.0732 2.2E3 123.0231 3.0E4 123.0439 9.7E6 123.0617 1.5E5 123.0665 1.8E4 123.0770 3.4E3 124.0478 8.5E3 125.0492 3.5E3 126.6608 2.8E3 127.0389 2.3E5 131.0492 1.8E4 133.0273 5.4E3 133.0647 1.1E5 135.0337 3.0E3 135.0440 1.6E5 137.0232 1.4E5 137.0597 1.8E5 138.9989 3.7E3 139.0144 9.9E4 139.0188 7.7E3 139.0389 1.7E7 139.0494 4.3E4 139.0644 2.1E5 139.0784 2.5E4 140.0423 4.2E4 143.0491 4.5E5 145.0647 2.9E4 145.7135 2.5E3 147.0296 3.6E3 147.0440 4.3E6 147.0550 1.6E4 147.0711 4.3E3 147.0802 3.0E3 147.2643 2.6E3 149.0596 4.9E4 151.0260 4.1E3 151.0389 3.5E5 151.0753 1.2E5 152.1774 2.5E3 153.0545 1.7E5 159.0440 8.0E4 161.0596 2.1E6 161.0736 8.1E3 163.0389 2.6E5 163.0754 5.2E4 165.0546 1.0E6 167.1873 2.6E3 169.0496 1.0E5 169.0634 2.8E3 171.0437 2.2E4 171.4445 2.7E3 173.5255 6.8E4 173.5425 3.6E4 175.0756 1.7E4 177.0547 2.8E5 179.0338 3.2E4 179.0703 1.0E6 179.3562 2.4E3 181.0494 1.1E5 181.0653 3.2E3 182.7948 2.7E3 185.0598 3.9E4 187.0749 1.1E4 189.0348 2.7E3 189.0546 5.1E5 189.0747 3.1E3 196.6310 2.8E3 199.0749 1.2E4 203.0705 7.5E4 205.0861 6.2E4 207.0443 9.7E3 207.0653 1.5E6 213.0549 2.2E4 217.0087 2.3E3 226.8349 2.8E3 227.0698 1.9E4 231.0656 2.9E4 245.0794 3.0E3 249.0749 1.8E4 255.0653 4.6E3 262.9138 2.7E3 270.5971 2.5E3 273.0759 1.6E4 END IONS BEGIN IONS FEATURE_ID=207 PEPMASS=385.0250 SCANS=207 RTINSECONDS=253.239 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 6 (0 removed due to low quality, 0 removed due to low cosine). 53.6614 2.6E3 56.7729 2.2E3 58.3914 2.7E3 62.5662 2.5E3 63.6533 2.3E3 63.7132 2.5E3 71.6229 2.4E3 71.7026 2.5E3 73.4078 2.5E3 81.5348 2.3E3 82.7345 2.6E3 84.3869 2.4E3 90.5079 2.4E3 92.6161 2.2E3 103.6471 2.2E3 107.1021 2.9E3 113.9875 2.5E3 117.2198 2.3E3 118.8524 2.4E3 120.4868 2.9E3 123.0437 9.2E4 127.2261 2.6E3 138.8567 2.3E3 139.0393 2.6E3 149.0704 2.4E3 153.3175 2.9E3 157.6213 2.4E3 160.3694 2.7E3 163.3241 2.5E3 173.5268 5.8E4 173.5397 4.7E4 176.3317 2.3E3 189.9380 2.4E3 194.9737 7.6E3 201.6320 2.6E3 202.5726 2.4E3 202.9814 3.6E3 218.2424 2.3E3 223.9766 6.9E4 228.8432 2.4E3 233.5033 2.2E3 235.4508 2.4E3 237.9555 2.6E4 238.4175 2.3E3 241.9873 6.4E3 246.9927 3.1E4 252.3996 2.5E3 263.0041 5.5E3 292.4665 2.4E3 306.1412 2.2E3 308.4171 2.8E3 312.9257 2.6E3 314.9946 2.5E4 316.0020 5.2E3 335.0028 4.8E4 343.9970 2.7E4 353.0134 4.5E4 358.8004 2.4E3 362.0284 2.2E4 385.7621 2.6E3 387.5173 2.5E3 END IONS BEGIN IONS FEATURE_ID=208 PEPMASS=388.2548 SCANS=208 RTINSECONDS=253.253 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 58.8960 2.5E3 59.6866 2.3E3 62.7935 2.5E3 65.7602 2.6E3 68.7174 2.4E3 70.2270 2.4E3 70.9440 2.1E3 71.4924 2.3E3 73.0648 4.9E3 76.6731 2.5E3 87.0437 2.3E4 89.0593 5.4E5 89.0652 3.5E3 92.5778 2.3E3 93.3622 2.2E3 107.0702 2.8E3 107.7068 2.4E3 109.9695 2.2E3 120.4007 2.6E3 130.9768 2.2E3 131.0699 2.3E3 133.0740 3.1E3 133.0856 1.7E5 140.8167 2.5E3 163.1346 2.6E3 173.5222 1.2E4 173.5395 3.4E4 177.1121 1.9E4 191.4129 2.8E3 247.0368 2.4E3 255.3690 2.4E3 266.1881 2.4E3 296.8708 2.6E3 329.0723 2.5E3 END IONS BEGIN IONS FEATURE_ID=209 PEPMASS=289.0712 SCANS=209 RTINSECONDS=253.568 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 6 (0 removed due to low quality, 0 removed due to low cosine). 48.4517 2.2E3 51.0228 1.9E4 51.4438 2.2E3 51.6792 2.2E3 53.0384 3.1E3 54.9987 2.5E3 55.0177 3.1E4 59.0053 2.2E3 62.4310 2.2E3 63.2420 2.1E3 64.6097 2.2E3 64.9921 2.1E3 65.0383 3.4E3 66.0721 2.5E3 67.0539 6.2E4 67.1827 2.3E3 68.2388 2.3E3 68.9968 4.4E4 69.5692 2.3E3 70.7449 3.1E3 71.0487 2.6E3 75.2385 2.3E3 76.0694 2.6E3 77.0383 3.7E4 79.0540 5.3E3 79.5418 2.1E3 81.9822 2.2E3 83.0123 3.7E4 83.0489 7.9E3 86.1646 2.2E3 89.0384 1.5E4 95.0489 1.5E5 96.4482 2.2E3 97.0278 2.5E3 101.5114 2.1E3 105.0333 4.7E4 105.0447 5.5E3 107.0488 4.3E4 109.3923 2.7E3 111.0075 2.2E4 111.0440 3.1E4 114.3825 2.5E3 114.9271 2.4E3 117.0332 4.2E4 119.0494 4.7E3 121.0282 3.2E3 123.0230 3.2E3 123.0438 2.8E6 123.0523 4.9E4 123.1823 3.0E3 127.0379 2.4E3 129.0178 6.0E3 131.0491 3.5E4 135.0439 1.7E5 137.0595 5.3E3 139.0388 6.9E5 139.0512 1.0E4 141.0699 3.5E3 143.0488 2.8E3 145.0282 1.4E5 147.9010 2.4E3 149.0234 1.4E4 149.0595 2.2E4 151.0388 9.5E4 153.0180 3.1E3 153.0699 3.5E3 159.0440 7.2E4 161.0596 3.1E3 163.0214 1.2E4 163.0389 6.9E5 163.0519 2.8E3 169.0646 2.5E4 173.0600 1.3E4 173.5209 1.4E4 173.5370 6.8E4 177.0547 2.2E4 178.9791 6.4E4 185.0604 2.1E4 187.0391 1.4E5 197.0597 7.2E4 199.0396 3.5E3 201.0551 2.9E3 205.0498 1.1E5 206.9739 1.6E4 215.0706 3.1E4 217.0494 1.1E4 224.8986 7.5E3 224.9850 3.7E4 225.0550 4.7E4 225.6077 3.5E3 229.0500 1.1E4 243.0651 3.1E4 245.0446 2.3E4 253.0503 9.5E3 271.0612 2.0E4 278.4674 3.0E3 278.5203 2.7E3 287.4371 2.3E3 END IONS BEGIN IONS FEATURE_ID=210 PEPMASS=311.0532 SCANS=210 RTINSECONDS=253.617 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 50.1099 2.3E3 52.5368 2.1E3 54.5560 2.3E3 55.9042 2.5E3 57.2256 2.5E3 61.1374 2.5E3 63.8011 2.9E3 65.9653 2.8E3 70.2551 2.3E3 80.0501 2.5E3 102.6415 2.3E3 103.6712 2.4E3 132.4076 2.4E3 147.1877 2.2E3 149.6831 4.9E3 149.6933 4.5E3 173.5206 4.8E3 173.5339 3.2E4 182.3035 2.4E3 193.1017 2.4E3 212.2459 2.4E3 237.0657 7.0E3 265.0607 1.2E4 265.5989 2.5E3 272.8821 2.3E3 309.9309 2.7E3 311.1001 4.5E3 314.0717 2.6E3 END IONS BEGIN IONS FEATURE_ID=211 PEPMASS=326.1393 SCANS=211 RTINSECONDS=256.511 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 6 (0 removed due to low quality, 0 removed due to low cosine). 49.2450 2.4E3 51.1202 2.2E3 55.4603 2.3E3 57.0697 3.1E3 57.5429 2.3E3 58.0648 6.3E4 58.9014 2.5E3 58.9541 2.3E3 65.0216 2.5E3 66.9198 2.2E3 70.1403 2.4E3 71.2751 2.4E3 72.0259 2.7E3 73.0831 2.5E3 76.8513 2.6E3 77.5046 2.2E3 77.7792 1.1E4 78.3624 2.5E3 79.4045 2.4E3 94.5952 2.2E3 96.1022 2.4E3 96.4095 2.2E3 97.7013 2.4E3 111.1677 2.3E3 111.9570 2.5E3 112.3459 2.4E3 115.2151 2.5E3 121.5505 2.8E3 126.2612 2.4E3 143.1908 2.6E3 147.5810 2.5E3 155.5812 2.3E3 173.5225 4.4E4 173.5397 5.9E4 173.5417 1.3E4 203.0932 2.6E3 213.4578 2.5E3 219.1523 2.8E3 221.0208 2.4E3 268.0965 2.8E3 278.0952 2.6E3 280.2112 2.2E3 281.0685 9.4E3 289.0244 2.5E3 289.5090 2.5E3 292.8447 2.6E3 295.8972 2.6E3 296.0917 2.6E5 307.5641 2.9E3 310.1059 3.2E3 311.0303 1.7E4 311.0477 6.4E3 311.1153 4.2E6 311.1992 1.9E4 326.1387 4.9E5 END IONS BEGIN IONS FEATURE_ID=212 PEPMASS=867.2131 SCANS=212 RTINSECONDS=257.397 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 5 (1 removed due to low quality, 0 removed due to low cosine). 78.5866 2.2E3 92.2319 2.4E3 92.4491 2.6E3 94.7561 2.5E3 95.4359 2.7E3 96.7271 2.4E3 110.4608 2.5E3 111.0076 7.2E3 111.0437 1.7E4 123.0335 5.2E3 123.0437 2.6E5 127.0280 9.3E3 127.0386 6.1E5 127.0499 5.9E3 135.0438 1.6E5 137.0237 2.6E3 139.0387 3.6E5 139.2665 2.1E3 147.0439 1.5E4 149.0232 9.8E3 151.0387 7.9E4 161.0599 9.0E3 163.0389 3.4E5 165.0547 4.3E4 167.0339 3.7E4 169.0492 2.0E4 173.5286 6.8E4 173.5375 9.4E3 177.0546 9.1E3 177.2917 2.8E3 179.0338 3.5E4 186.5614 2.5E3 187.0387 2.1E4 191.0337 1.6E4 201.0546 1.4E4 203.0338 2.0E4 203.0697 4.4E3 203.4857 2.4E3 205.0498 2.0E4 207.0639 3.1E3 215.0711 4.3E3 219.0635 6.0E3 225.0548 3.2E3 229.0494 3.0E4 231.0286 2.9E3 231.0655 6.8E3 233.0447 3.1E4 241.0497 2.6E3 243.0651 4.1E4 245.0444 3.6E5 247.0316 8.4E3 247.0599 3.3E5 251.0549 8.2E3 253.0493 5.6E3 255.0645 6.8E3 257.0441 6.5E4 258.0448 2.7E3 259.0597 9.8E4 261.0442 5.9E3 261.0758 2.4E4 263.0545 1.3E4 269.0445 1.4E4 271.0348 2.6E3 271.0602 2.2E5 273.0754 1.8E4 274.0470 2.6E4 275.0552 2.7E5 283.0604 9.8E4 285.0404 7.9E3 285.0746 4.5E3 287.0553 2.6E5 288.0612 2.8E3 289.0705 6.0E4 291.0866 4.7E4 295.0614 4.0E3 299.0554 6.4E4 301.0711 6.2E4 303.0488 5.5E3 303.0856 5.5E3 307.8041 2.5E3 311.0553 5.8E3 313.0702 8.5E3 315.0489 3.0E3 323.0561 1.6E4 325.0704 2.9E3 327.0492 2.8E3 338.4818 2.6E3 342.5019 2.4E3 349.0697 3.4E3 361.0707 2.8E3 363.0864 4.5E3 365.0656 2.0E4 377.0690 5.9E3 379.0814 2.6E4 381.0959 4.2E3 383.0775 5.0E3 389.0660 2.6E4 391.0810 2.4E4 393.0606 6.7E4 395.0754 2.5E4 397.0910 3.0E3 405.0599 3.3E4 407.0769 1.1E5 407.1324 4.3E3 409.0924 1.5E5 409.1447 2.2E3 411.1067 2.2E4 417.0613 4.0E3 419.0764 5.5E4 421.0899 1.6E4 427.0964 4.2E3 431.0754 7.1E3 433.0911 5.4E3 437.0886 3.2E3 449.0848 2.9E3 450.6503 2.7E3 451.1012 5.2E3 517.1148 7.4E3 527.0967 5.3E4 537.1182 2.9E3 545.1055 1.7E4 557.1078 8.3E3 END IONS BEGIN IONS FEATURE_ID=213 PEPMASS=373.1839 SCANS=213 RTINSECONDS=257.497 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 57.9779 2.4E3 62.8743 2.3E3 62.9692 2.6E3 74.7334 2.4E3 113.0154 2.1E3 132.7736 2.5E3 137.0591 9.3E3 173.5254 1.2E4 173.5341 3.5E4 183.2970 2.7E3 183.4170 2.8E3 201.0543 2.1E4 211.1301 2.9E4 256.2083 2.3E3 340.8226 2.5E3 357.8689 3.3E3 373.0733 6.4E3 373.1832 2.0E6 END IONS BEGIN IONS FEATURE_ID=214 PEPMASS=328.1549 SCANS=214 RTINSECONDS=259.283 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 6 (0 removed due to low quality, 0 removed due to low cosine). 49.6561 2.6E3 49.6677 2.5E3 53.3833 2.4E3 53.8384 2.2E3 56.7885 2.2E3 57.3758 2.9E3 58.0649 1.1E5 62.3342 2.7E3 63.9887 2.2E3 66.2730 2.7E3 66.6989 2.1E3 73.0282 7.4E3 74.2758 2.4E3 77.0423 2.2E3 79.5038 2.8E3 81.5713 2.1E3 89.0595 8.9E3 112.2057 2.6E3 117.3248 2.3E3 126.6386 2.4E3 152.7191 2.7E3 154.3344 3.0E3 165.0710 5.8E3 166.0778 3.8E3 167.5988 2.3E3 172.7303 2.5E3 173.5288 5.1E4 173.5382 2.0E4 173.5472 4.3E3 179.0853 2.0E4 181.1015 2.7E4 189.0712 3.4E3 191.0856 1.8E5 193.0652 8.1E3 194.0727 2.4E4 195.0804 1.2E4 202.8700 2.3E3 203.0865 4.6E3 205.0651 6.1E4 207.0805 1.3E5 208.0883 1.4E4 209.0618 3.4E3 209.0962 1.7E5 209.4716 2.8E3 217.0652 9.8E3 217.3307 2.3E3 218.0736 7.5E3 219.0805 2.8E5 220.0870 5.6E3 221.0599 7.6E4 221.0965 5.2E3 222.0677 2.0E5 223.0755 6.2E4 223.1116 5.7E3 225.0912 5.7E4 233.0599 1.4E5 235.0755 6.9E4 236.0833 4.5E4 236.3084 2.7E3 237.0911 7.7E5 239.0698 1.3E4 247.0754 1.3E5 248.0832 1.2E4 250.0624 7.5E4 251.0702 3.7E5 251.1061 2.8E4 252.0779 5.1E3 253.0858 9.6E4 254.0938 6.3E3 255.1016 9.7E4 263.0708 4.1E3 263.9054 2.6E3 264.0780 2.4E4 265.0192 8.3E3 265.0527 1.6E4 265.0859 2.5E6 265.1193 5.0E3 265.1516 4.1E3 266.0937 5.6E4 267.0653 5.1E4 267.1012 2.6E4 268.0735 1.2E4 268.1338 3.5E3 269.1175 1.0E4 279.1018 8.7E4 282.0889 9.5E5 282.1234 3.7E3 283.0969 2.6E5 283.1327 3.3E3 284.1045 5.1E3 285.1126 2.2E4 296.1286 3.7E3 297.1125 1.5E6 298.1044 4.2E3 299.1286 9.3E3 311.1293 7.5E3 312.1203 4.6E3 313.1228 5.9E4 320.5806 3.0E3 322.9946 2.7E3 326.7262 2.6E3 328.1539 8.7E4 END IONS BEGIN IONS FEATURE_ID=215 PEPMASS=460.2183 SCANS=215 RTINSECONDS=260.08 CHARGE=1+ MSLEVEL=2 MERGED_STATS=7 / 7 (0 removed due to low quality, 0 removed due to low cosine). 57.4055 2.3E3 58.3144 2.3E3 61.0281 3.6E4 62.3457 2.3E3 66.7362 2.3E3 67.0542 7.7E3 67.8761 2.2E3 69.0333 5.5E4 70.5760 2.0E3 71.0489 1.2E4 73.0283 3.8E3 73.9026 2.1E3 74.0193 2.1E3 76.4151 2.3E3 77.5579 2.4E3 79.0551 3.6E3 81.0333 1.7E4 81.0696 2.9E3 83.0489 9.4E3 85.0281 3.4E5 87.6939 2.8E3 91.0388 2.2E4 91.7948 2.2E3 94.1534 2.5E3 94.8036 3.2E3 95.0489 2.5E4 95.0854 5.2E4 96.0700 2.4E3 96.1758 2.5E3 97.0282 1.0E5 97.0582 3.8E3 97.0645 2.0E5 99.0439 5.5E4 102.1811 2.4E3 103.5498 2.3E3 105.0703 5.6E3 107.0853 5.1E3 108.0811 2.8E3 109.0283 2.6E4 109.0648 9.7E3 111.0439 3.6E4 119.0850 1.8E4 120.0122 2.3E3 120.9903 2.2E3 121.0650 1.2E4 121.1016 2.8E3 123.0443 5.4E3 123.0802 2.5E6 123.0889 4.1E3 123.0900 2.1E4 125.0597 6.8E3 127.0388 7.9E4 131.0854 7.3E3 133.1009 6.9E3 135.0803 2.4E4 137.0597 3.5E4 137.0960 1.1E4 139.0753 6.4E4 145.0496 7.0E4 145.0623 4.8E3 147.0802 6.3E4 147.1176 3.1E3 149.0596 8.7E3 150.0205 2.5E3 151.0774 2.6E3 153.8847 2.3E3 156.0953 2.6E3 157.1014 2.1E4 159.0805 3.5E4 159.1172 2.0E4 161.0960 4.7E4 161.1308 2.7E3 163.0755 5.3E4 165.0581 2.3E4 165.0909 1.1E7 165.1241 4.7E4 165.1328 9.0E3 165.8526 2.7E3 166.0785 2.6E3 167.0702 8.8E4 168.0934 2.3E3 171.1171 3.1E4 173.0964 3.5E4 173.1329 2.3E4 173.5295 1.0E5 173.5420 5.4E3 174.7885 2.5E3 175.0740 3.1E3 175.1118 7.7E4 177.0912 3.8E4 179.0692 2.9E3 183.1162 3.0E3 185.0961 5.3E4 185.3349 2.5E3 187.0754 2.0E4 187.1118 7.1E4 189.1272 4.2E4 199.1118 2.3E5 201.1269 1.7E4 203.1068 1.6E5 205.0862 1.5E5 205.1219 8.0E3 212.0834 2.5E4 215.1068 1.5E5 215.8089 2.4E3 217.1226 7.5E4 221.1175 2.0E4 227.1069 1.6E5 233.1175 4.3E5 233.3111 2.5E3 234.9672 2.8E3 235.1334 2.5E4 245.1175 2.1E5 263.1281 4.4E5 263.1515 2.8E3 263.1785 2.6E3 266.2491 2.4E3 295.5838 2.4E3 347.5094 2.7E3 367.8394 2.4E3 392.3002 2.5E3 403.3942 2.1E3 416.4888 2.4E3 END IONS BEGIN IONS FEATURE_ID=216 PEPMASS=263.1280 SCANS=216 RTINSECONDS=260.111 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 46.0558 2.2E3 46.2576 2.4E3 46.9884 2.1E3 50.4986 2.1E3 51.3033 2.2E3 55.0541 5.9E3 56.3084 2.2E3 56.6018 2.6E3 67.0541 8.4E3 68.9110 2.2E3 69.0333 6.5E3 72.7042 2.2E3 72.9726 2.7E3 77.5530 2.6E3 81.0697 6.8E3 91.0540 7.2E3 91.4202 2.7E3 93.0695 4.1E3 95.0488 2.4E4 95.0852 4.8E4 97.0646 3.0E4 98.0595 1.2E4 99.8236 2.4E3 105.0697 7.1E3 114.8900 2.4E3 118.2688 2.2E3 119.0853 1.8E4 121.0276 3.2E3 121.0647 1.9E4 123.0439 1.3E4 123.0702 4.6E3 123.0800 4.2E5 128.0634 2.8E3 131.0850 8.9E3 133.1006 6.7E3 135.0804 1.6E4 137.0595 8.1E3 139.0751 6.9E3 143.0851 6.6E3 147.0800 6.3E3 154.6294 2.3E3 156.0930 2.9E3 157.1010 1.3E4 159.0800 1.4E4 159.1166 1.7E4 160.0886 3.3E3 161.0954 1.1E4 162.3208 2.2E3 163.0756 2.8E3 165.0908 3.7E4 167.9414 2.3E3 171.1168 8.8E3 173.0960 8.9E3 173.5288 5.4E4 173.5424 1.1E4 175.1111 9.8E3 184.0895 2.9E3 186.1021 2.4E3 187.1116 1.6E4 199.0724 2.5E3 199.1117 1.7E4 205.0876 3.4E3 212.0837 5.3E3 215.1071 3.4E3 242.4541 2.4E3 265.6884 2.8E3 END IONS BEGIN IONS FEATURE_ID=217 PEPMASS=465.1736 SCANS=217 RTINSECONDS=260.124 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 6 (0 removed due to low quality, 0 removed due to low cosine). 57.0400 2.6E3 58.7099 4.7E3 61.6592 2.6E3 62.5263 2.3E3 62.6176 2.3E3 65.2957 2.4E3 67.5061 2.3E3 73.9429 2.4E3 74.0314 2.6E3 75.7776 3.4E3 75.7816 3.4E3 78.1472 2.4E3 80.8142 2.3E3 92.4472 2.4E3 94.4208 2.4E3 99.9155 2.2E3 103.6511 2.4E3 106.0810 2.3E3 115.4181 2.4E3 117.7114 2.5E3 128.0217 2.5E3 133.1926 2.5E3 135.5626 2.7E3 145.4061 2.4E3 162.5240 2.6E3 173.5197 1.5E4 173.5278 2.8E4 173.5353 7.1E4 173.5469 5.3E3 177.4581 2.5E3 185.0418 1.5E5 249.7749 2.3E3 250.2183 2.6E3 285.1093 2.8E4 303.0387 9.7E3 303.0577 4.8E3 303.0797 6.5E3 303.1204 4.2E6 303.2013 1.7E4 339.8971 2.3E3 340.0121 2.6E3 442.0187 3.4E3 450.5223 2.5E3 465.0973 1.1E4 465.1728 5.1E5 465.2428 4.5E3 END IONS BEGIN IONS FEATURE_ID=218 PEPMASS=234.1491 SCANS=218 RTINSECONDS=260.311 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 45.0334 3.1E3 51.8579 2.3E3 53.0385 2.6E3 55.0177 1.1E4 55.0541 1.2E5 57.0698 2.9E4 58.0650 4.2E4 62.5756 2.2E3 67.0540 9.3E3 69.0697 2.5E5 69.6192 2.2E3 72.0806 3.3E4 73.0282 6.2E4 73.5091 2.5E3 79.0542 1.7E4 79.5662 2.1E3 81.0697 3.9E4 91.0541 4.2E4 93.0698 4.9E3 98.0961 7.9E3 103.0541 3.1E4 105.0697 3.2E4 107.0489 8.0E3 107.0854 7.9E3 108.1546 2.6E3 109.2052 2.3E3 115.0540 5.9E4 116.0619 8.4E3 117.0696 2.7E4 118.0649 1.4E4 119.0490 1.0E4 119.0854 9.6E3 121.0635 2.3E3 122.4484 2.6E3 123.0438 1.5E5 128.0620 2.4E4 129.0590 4.6E3 129.0697 2.0E5 130.0408 1.5E4 131.0377 4.8E3 131.0490 1.6E5 131.0857 2.5E3 133.0646 3.1E4 134.4973 2.5E3 135.1587 2.6E3 137.0595 7.1E4 141.0696 2.6E3 142.0775 1.2E4 143.0490 9.8E4 143.0854 8.7E4 144.0567 2.1E4 145.0647 5.5E4 146.0598 3.3E4 147.0310 3.9E3 147.0438 1.7E5 147.0803 3.7E4 147.6503 2.4E3 148.0517 1.2E5 149.0459 5.4E3 149.0595 3.6E5 149.0738 2.9E3 151.0753 2.4E4 156.0932 1.5E4 157.0521 2.0E3 157.0646 2.2E5 157.1006 2.2E3 158.0725 1.0E4 159.0802 3.2E3 160.0518 5.7E4 161.0595 6.4E5 161.0756 5.7E3 162.0538 6.6E3 162.0674 1.5E5 163.0753 3.1E4 164.0705 7.2E5 165.0698 2.8E3 166.0769 2.7E3 170.0728 3.8E4 171.0804 8.5E4 171.1168 1.1E5 173.0598 2.5E4 173.5208 3.8E3 173.5347 6.0E4 174.0676 2.8E4 175.0575 3.4E3 175.0754 8.6E5 176.0833 1.6E4 177.0576 2.4E3 181.1012 1.3E4 184.0882 3.2E4 188.0832 7.6E4 189.0911 4.5E4 197.9157 2.8E3 199.1118 6.7E4 202.0993 3.9E3 217.1225 1.2E5 221.5599 2.6E3 234.1492 1.4E4 244.4298 2.6E3 END IONS BEGIN IONS FEATURE_ID=219 PEPMASS=344.1859 SCANS=219 RTINSECONDS=262.199 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 5 (2 removed due to low quality, 0 removed due to low cosine). 50.4445 4.0E3 55.8147 4.2E3 56.0494 4.5E4 58.0652 1.4E7 58.0692 1.6E5 58.0703 1.2E5 58.0718 7.4E4 58.0739 2.5E4 58.0757 2.2E4 58.0898 8.0E3 59.0684 4.9E4 62.0078 3.7E3 62.1155 3.9E3 62.9675 3.3E3 65.4269 3.8E3 69.2089 4.3E3 70.2809 3.8E3 70.5270 6.9E3 71.0727 2.5E4 72.0807 3.2E4 83.2993 6.9E3 83.3045 8.5E3 86.0598 1.2E4 89.0447 3.9E3 91.0541 5.2E4 94.1668 4.0E3 95.0490 4.0E4 101.7929 7.0E3 107.0489 1.5E4 109.0648 3.7E4 115.0542 1.2E5 117.0697 4.6E4 119.0491 8.7E4 121.0649 2.5E4 122.0360 1.8E4 123.0438 4.0E4 125.0596 7.0E4 131.0492 7.0E3 137.0596 4.4E6 137.0693 4.7E4 143.0491 2.0E6 143.0589 9.0E3 143.0625 9.3E3 144.0568 1.4E4 145.0648 1.7E5 147.0801 2.4E4 149.0596 1.7E5 151.0753 1.6E6 154.8030 2.5E3 157.0645 3.8E3 157.8574 4.2E3 160.0519 1.2E5 160.0761 9.0E3 160.8177 3.7E3 161.0596 4.3E4 162.0675 3.8E4 163.0753 6.2E4 165.0908 2.3E4 173.5335 1.2E5 174.0674 5.0E3 174.0917 6.7E4 175.0755 4.1E6 175.0951 1.9E4 175.1031 5.0E4 175.1114 1.3E4 176.0836 3.4E4 176.1075 2.7E4 177.0912 3.3E5 179.0859 3.0E4 179.1078 1.9E4 181.0648 7.4E3 181.1015 2.7E4 187.0752 5.4E3 188.0461 2.6E3 188.1067 2.1E4 189.0915 8.3E3 192.0816 4.2E3 192.1021 3.8E5 193.0666 8.2E3 193.0906 7.5E3 193.1099 3.2E5 194.1176 1.0E5 195.0810 8.3E3 206.1177 8.5E4 207.0808 2.2E5 207.1021 4.3E3 207.1258 1.1E5 208.0873 3.5E3 209.0604 2.3E4 209.0962 1.1E5 211.0755 5.2E3 213.0919 1.2E4 219.0807 2.6E4 220.1341 1.7E4 221.0876 2.9E3 223.1116 8.5E3 224.0824 1.0E4 235.0755 2.5E5 236.0834 1.4E4 237.0911 1.4E5 238.0949 8.8E3 239.0713 2.5E4 239.1065 3.6E5 240.0779 4.5E3 241.0864 8.2E4 241.1224 3.0E5 241.1497 1.4E4 249.0908 2.1E4 251.1061 3.7E4 252.0778 2.6E4 253.1247 7.8E3 254.0930 5.4E3 255.1374 8.1E3 265.0861 1.0E4 266.0893 4.6E4 267.1006 6.7E5 268.1094 3.3E4 269.1175 3.9E5 270.0893 2.4E4 271.0983 1.8E4 271.1318 4.3E3 272.1047 3.6E4 281.1141 4.1E3 283.0969 8.6E3 283.1327 2.6E4 284.1027 1.1E5 286.1179 2.5E4 298.1155 2.4E4 299.0742 3.0E3 299.1276 1.5E6 301.1437 4.3E5 312.1596 2.1E5 313.1697 1.8E4 314.6460 4.9E3 329.1619 7.4E4 344.1858 3.1E6 END IONS BEGIN IONS FEATURE_ID=220 PEPMASS=202.0503 SCANS=220 RTINSECONDS=262.755 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 46.7408 2.1E3 49.6340 2.1E3 50.0107 2.4E3 50.2845 2.3E3 50.8429 2.2E3 51.4333 2.4E3 52.5522 2.7E3 54.0199 2.4E3 55.9342 1.5E4 65.6533 2.4E3 66.4800 2.3E3 70.1186 2.7E3 72.6935 2.2E3 77.4783 2.5E3 78.9493 3.4E3 99.7978 2.1E3 105.3170 2.8E3 110.2066 2.5E3 114.4768 2.6E3 114.9709 1.0E4 116.9750 5.8E3 118.0649 2.6E4 119.1459 2.6E3 128.0495 9.7E3 130.8556 2.4E3 130.9491 2.7E3 131.0489 8.2E3 131.9742 2.9E3 132.9693 2.0E4 140.0993 2.3E3 146.0598 5.4E4 147.0440 2.8E3 148.0112 2.5E3 156.0442 9.2E4 173.5253 1.9E4 173.5418 9.9E3 174.0551 5.8E4 184.0394 2.3E5 184.0584 4.0E3 202.0501 1.0E5 204.9049 2.3E3 END IONS BEGIN IONS FEATURE_ID=221 PEPMASS=342.0824 SCANS=221 RTINSECONDS=263.179 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 51.2230 2.3E3 56.9972 2.3E3 57.0334 4.8E3 57.3532 2.4E3 58.0649 5.8E4 59.3584 2.5E3 61.3742 2.4E3 62.6344 2.0E3 64.5056 2.1E3 67.1136 2.2E3 69.0331 4.3E4 69.2228 2.4E3 75.1058 2.3E3 75.2716 2.7E3 85.0280 3.4E4 95.0124 5.8E4 95.0426 2.7E3 95.0488 1.5E5 97.0215 4.1E3 97.0280 2.6E5 101.1556 2.4E3 110.7792 2.3E3 111.9872 2.5E3 113.0230 1.6E5 121.0281 1.1E5 122.9984 3.8E3 123.0073 1.5E5 125.0230 5.2E4 139.0387 6.2E5 141.0069 4.0E3 141.0179 2.2E5 143.0336 9.9E4 148.8771 2.5E3 157.0643 2.3E3 169.0130 1.8E5 169.4090 2.3E3 173.5246 9.1E3 173.5364 3.5E4 177.4884 2.2E3 187.0236 3.8E4 189.1143 2.6E3 207.2635 2.6E3 225.9769 3.0E3 237.0901 3.2E3 250.2778 2.4E3 265.0861 2.7E4 266.0859 2.4E3 277.1837 3.0E3 284.0533 2.5E3 289.6482 2.6E3 297.1121 2.1E4 306.4920 2.5E3 340.7537 2.3E3 END IONS BEGIN IONS FEATURE_ID=222 PEPMASS=207.1383 SCANS=222 RTINSECONDS=263.45 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 9 (7 removed due to low quality, 0 removed due to low cosine). 41.0385 1.7E4 43.0177 3.8E5 43.0542 5.9E3 45.0333 1.7E4 51.9949 2.5E3 53.0384 1.2E4 54.6433 2.4E3 55.0176 1.7E4 55.0540 1.4E5 55.5163 2.1E3 57.0333 9.6E3 57.0696 1.0E5 58.4369 2.5E3 59.0489 2.1E4 63.6897 2.2E3 64.1489 2.2E3 65.0383 2.2E4 67.0539 5.6E5 67.0582 5.8E3 69.0332 4.4E4 69.0695 4.0E4 71.0458 2.1E3 71.0488 2.9E4 75.8965 2.4E3 77.0386 2.5E3 79.0539 7.1E4 80.0618 3.7E3 80.9117 2.8E3 81.0333 6.5E3 81.0696 8.1E4 83.0446 2.2E3 83.0488 3.7E4 83.0852 5.1E3 85.0645 5.6E4 87.9068 2.2E3 89.9767 2.3E3 91.0539 1.1E5 93.0631 4.0E3 93.0696 2.2E5 95.0488 6.1E4 95.0852 1.6E6 95.0919 1.6E4 95.0960 1.3E4 95.0993 1.1E4 97.0643 1.1E4 103.0539 6.2E3 105.0447 2.8E3 105.0615 3.5E3 105.0695 2.0E5 105.0782 3.7E3 106.0781 3.1E3 107.0488 1.1E4 107.0773 5.1E3 107.0852 2.1E5 108.0569 4.6E3 109.0645 5.7E4 109.0935 2.9E3 109.1009 3.1E4 111.0803 1.4E4 112.7459 2.2E3 113.0598 1.1E4 114.9711 5.6E3 115.0538 2.7E3 115.9639 2.2E4 116.0619 1.1E4 116.9725 3.1E3 117.0695 1.6E4 119.0489 4.2E3 119.0852 2.6E5 119.0938 2.9E3 119.0955 5.2E3 120.0931 1.6E4 121.0644 4.6E4 121.0911 4.2E3 121.1009 1.8E5 123.0801 2.5E5 123.1165 5.7E4 125.0958 9.1E3 129.0698 9.7E3 130.0778 8.0E3 131.0853 5.3E4 132.6166 2.5E3 133.0645 1.6E4 133.0749 2.5E3 133.0903 3.5E3 133.1009 6.5E4 135.0801 1.6E4 135.1165 1.9E4 137.0957 2.6E4 137.1322 9.6E3 139.0750 1.1E4 141.0681 2.6E3 143.0854 1.3E4 145.0643 3.2E3 145.1011 2.2E4 146.1088 6.5E3 147.0801 3.8E4 147.1165 7.5E4 149.0958 4.0E5 149.1072 3.6E3 151.0748 1.1E4 155.9972 1.1E4 156.0931 3.1E4 157.0861 3.6E3 159.0803 2.5E4 159.1172 7.9E3 160.0882 1.3E4 161.0961 1.0E4 161.1322 5.6E4 162.6920 2.6E3 163.1123 9.9E3 165.0915 3.3E3 165.1272 4.7E4 171.1167 1.9E4 173.5228 6.1E3 173.5325 1.6E4 173.5407 1.1E4 174.1039 5.0E4 189.1274 3.6E4 207.1380 1.3E4 END IONS BEGIN IONS FEATURE_ID=223 PEPMASS=409.1839 SCANS=223 RTINSECONDS=263.506 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 3 (1 removed due to low quality, 0 removed due to low cosine). 55.7479 2.2E3 58.7915 2.1E3 63.3881 2.4E3 66.4310 2.5E3 68.6395 2.4E3 71.1403 2.5E3 75.4346 2.1E3 88.7205 2.3E3 100.4245 2.4E3 107.5457 2.2E3 165.6822 2.4E3 173.5262 2.6E4 173.5440 9.0E3 200.2019 2.3E3 203.0522 4.0E3 208.9636 2.7E3 221.4194 2.5E3 228.5702 2.5E3 259.7844 2.7E3 297.3979 2.6E3 369.1518 2.5E3 372.7850 2.6E3 384.8168 2.4E3 409.1831 4.3E5 409.2462 3.3E3 END IONS BEGIN IONS FEATURE_ID=224 PEPMASS=285.1239 SCANS=224 RTINSECONDS=264.249 CHARGE=1+ MSLEVEL=2 MERGED_STATS=1 / 3 (2 removed due to low quality, 0 removed due to low cosine). 52.8727 2.2E3 56.3385 2.4E3 60.3490 2.1E3 67.0222 3.6E3 67.0256 2.6E3 91.0542 2.3E4 95.3482 2.4E3 101.7537 2.7E3 107.0490 2.8E3 119.0493 9.2E3 120.0443 1.7E4 123.0439 6.7E4 124.0394 5.4E3 127.1979 2.4E3 130.0650 1.0E4 131.0734 5.3E3 135.4700 2.3E3 137.0594 6.2E3 146.0598 6.6E4 148.0391 2.1E5 149.0470 4.4E5 158.0601 1.7E4 159.0676 6.7E3 162.0549 1.5E4 164.0342 4.2E3 167.0854 1.5E4 173.5221 4.1E3 173.5404 9.7E3 174.0556 4.1E3 175.0630 9.2E3 180.0813 3.3E3 181.0651 3.5E3 184.0761 2.9E3 184.1129 2.7E3 193.0888 5.1E3 194.0964 2.0E5 195.0804 2.7E4 197.0836 3.2E3 198.0911 6.3E3 199.0623 1.1E4 203.8827 4.3E3 204.0809 1.0E4 205.0651 6.0E3 207.0682 1.2E4 208.0759 7.6E3 211.0995 5.9E3 212.0704 1.1E4 212.1073 1.7E4 213.0909 5.8E3 220.0754 5.4E3 221.0827 6.1E3 222.0914 4.4E5 223.0751 2.0E4 223.0985 4.1E3 224.0710 4.7E3 225.0784 1.6E5 226.0868 7.5E3 232.0756 6.8E3 233.0846 6.3E3 235.0615 7.2E3 236.0700 5.6E3 238.0861 9.8E3 239.0932 7.6E3 240.1018 9.4E5 241.0843 1.2E4 241.1102 2.6E3 249.0786 5.5E3 250.0861 3.5E5 251.0935 2.2E4 252.0656 7.9E3 253.0732 2.0E4 256.0930 8.2E3 267.0561 2.5E3 267.0887 7.9E4 268.0965 1.1E6 268.1631 5.8E3 END IONS BEGIN IONS FEATURE_ID=225 PEPMASS=342.1706 SCANS=225 RTINSECONDS=264.668 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 54.0950 1.3E4 56.0495 1.0E5 56.7445 1.2E4 58.0652 3.4E7 58.0690 3.0E5 58.0705 1.3E5 58.0720 1.0E5 58.0740 5.7E4 58.0799 2.3E4 59.2742 1.1E4 60.9135 1.7E4 61.7315 7.1E3 65.3543 1.0E4 66.2708 9.6E4 66.2733 3.3E4 66.9050 1.6E4 72.0807 9.9E4 72.7036 1.8E4 74.2758 6.7E4 74.2799 2.9E4 77.9631 1.4E4 94.9409 1.7E4 118.7675 6.1E3 152.0650 1.1E4 156.6744 1.6E4 161.2009 1.1E4 165.0719 6.3E4 166.0788 3.1E4 169.4895 6.1E3 173.5208 1.3E4 173.5352 1.9E5 178.0793 7.3E3 179.0859 1.1E5 181.0650 1.5E4 181.1009 1.2E5 181.7488 1.1E4 182.2738 1.7E4 189.0704 3.6E4 190.0782 3.4E4 191.0858 8.3E5 194.0727 1.1E5 195.0808 1.0E5 201.0719 2.3E4 202.8713 2.0E4 203.0853 1.3E4 205.0652 2.6E5 205.1015 3.8E4 205.1407 7.0E3 206.0725 3.4E4 207.0807 6.4E5 208.0874 8.0E4 209.0964 8.8E5 217.0643 1.7E4 218.0721 3.2E4 218.2931 2.0E4 219.0808 1.6E6 219.1058 3.1E4 219.4655 1.9E4 220.0879 6.1E4 221.0605 7.4E4 221.0968 9.5E4 222.0679 8.9E5 223.0757 1.6E5 223.1112 3.0E4 224.0834 2.5E4 225.0923 3.2E4 233.0341 1.0E4 233.0600 7.4E5 233.0880 2.7E4 233.0976 3.9E4 234.0679 5.0E4 235.0488 1.5E4 235.0756 8.8E5 236.0834 3.0E5 237.0913 5.4E6 239.0703 9.3E4 239.1067 1.7E5 240.0768 7.6E3 241.0835 1.4E4 247.0756 9.2E5 248.0828 7.9E4 249.0912 8.7E4 250.0627 4.1E5 251.0745 7.1E4 251.1068 4.1E5 252.0780 7.4E4 253.0859 2.1E5 253.1187 2.4E4 254.0936 9.8E4 255.1017 4.9E5 261.0907 9.3E3 263.0711 4.5E4 264.0781 1.8E5 265.0193 1.9E5 265.0340 1.3E5 265.0861 2.6E7 265.1389 2.4E4 265.1521 1.7E5 266.0938 4.8E5 267.0655 2.3E5 267.1017 6.9E5 269.1175 6.7E5 270.0897 2.6E4 271.0968 9.6E4 271.2453 2.1E4 279.1020 1.3E6 279.1361 2.5E4 281.0857 9.3E3 281.1178 2.3E5 282.0891 7.0E6 283.0973 1.1E5 284.1046 1.0E6 285.1123 8.1E4 296.1046 4.0E4 297.0344 9.2E4 297.1126 2.2E7 298.1224 2.1E4 299.0979 1.6E4 299.1282 3.0E6 310.1441 1.2E5 311.1283 4.5E5 313.1434 1.5E5 324.1161 1.2E4 327.1475 1.0E5 342.1702 4.4E6 344.1417 1.3E4 END IONS BEGIN IONS FEATURE_ID=226 PEPMASS=347.1451 SCANS=226 RTINSECONDS=267.767 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 2 (0 removed due to low quality, 0 removed due to low cosine). 52.2093 2.1E3 55.0176 3.4E3 57.0332 1.2E4 61.0281 3.4E4 69.0331 4.5E4 69.9263 2.2E3 71.0488 8.0E3 73.0281 1.2E4 80.2609 2.3E3 81.0331 1.5E4 85.0198 3.2E3 85.0280 3.0E5 85.0372 3.8E3 87.0437 8.4E3 91.0385 1.9E4 97.0214 3.5E3 97.0281 8.1E4 99.0438 1.7E4 109.0280 1.9E4 127.0386 5.7E4 128.8468 2.4E3 133.2368 2.2E3 145.0492 3.2E4 163.3025 2.5E3 173.5217 1.1E4 173.5397 2.3E4 220.5695 2.3E3 221.3443 2.4E3 239.3727 2.6E3 249.8888 2.4E3 251.4438 2.4E3 257.1306 2.9E3 291.9836 2.7E3 296.3102 3.1E3 296.6739 2.9E3 END IONS BEGIN IONS FEATURE_ID=227 PEPMASS=328.1913 SCANS=227 RTINSECONDS=268.154 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 11 (8 removed due to low quality, 0 removed due to low cosine). 49.2916 2.0E4 56.0495 3.2E5 56.2070 1.9E4 58.0582 2.1E5 58.0653 1.0E8 58.0704 3.4E5 58.0719 3.3E5 58.0739 8.6E5 58.0740 1.2E5 58.0758 6.3E4 66.8265 3.1E4 69.4244 2.9E4 69.6123 3.6E4 71.0727 3.4E4 72.0808 1.4E5 75.9669 3.1E4 79.0541 3.6E4 85.5270 3.6E4 87.0901 2.4E4 91.0544 1.7E5 93.0699 1.2E5 95.0492 1.9E5 103.0542 8.1E4 105.0698 2.4E4 107.0319 1.6E5 107.0491 3.9E7 107.0661 3.7E5 113.7746 3.0E4 117.0699 3.5E5 118.1883 3.9E4 119.0491 3.0E5 119.0856 1.3E5 121.0647 5.3E6 121.0732 4.0E4 124.0521 1.2E5 125.0600 9.7E4 128.4906 2.8E4 129.0701 9.4E4 131.0490 1.6E5 133.0649 4.9E5 135.0803 3.0E5 136.0518 3.4E5 137.0596 2.2E5 139.0753 4.4E5 145.0493 1.2E5 145.0647 6.8E6 145.0784 5.7E4 146.0720 8.9E4 147.0804 1.8E6 149.0962 1.0E5 150.0675 1.3E5 151.0753 6.2E6 155.0601 9.1E4 158.0727 9.4E5 159.0452 4.1E4 159.0806 4.4E5 160.0881 9.2E4 161.0596 1.3E5 161.0962 2.9E5 162.0670 3.2E4 163.0616 2.4E4 163.0755 2.6E6 164.0831 4.6E4 164.2250 2.2E4 165.0911 2.4E6 173.0972 7.2E4 173.5303 6.2E5 173.5448 4.8E4 174.0519 6.0E4 174.0677 2.3E6 174.0840 5.4E4 175.0754 1.8E5 176.0834 1.1E6 177.0911 2.5E6 179.1067 2.7E5 183.0800 4.3E4 189.0911 1.3E7 190.0992 3.4E5 190.1226 5.0E5 191.1068 8.5E5 192.1020 2.5E5 193.8979 4.0E4 195.0806 3.8E4 196.0890 4.4E4 197.0961 2.0E5 203.1068 1.4E5 206.1177 2.0E6 207.1255 1.1E6 208.1335 6.7E5 209.0971 6.2E4 211.0770 3.4E4 221.0970 7.4E4 221.1409 3.5E5 222.1498 4.4E4 223.1115 1.1E5 224.0828 1.4E5 225.0912 2.1E5 225.1276 6.1E5 226.1002 4.9E4 236.0836 4.7E4 237.0908 3.3E5 238.0993 2.4E5 251.1064 5.5E5 252.0831 4.1E4 252.1146 6.0E6 252.1449 2.0E5 253.0892 9.0E4 253.1222 6.6E5 254.0938 3.3E5 254.1296 3.6E5 255.1021 2.7E5 256.1091 7.0E5 257.1186 4.3E4 266.1304 1.6E5 267.1368 4.0E4 268.1095 3.8E6 268.1416 1.6E5 270.1251 1.0E6 277.7158 2.1E4 281.1169 7.0E4 283.0955 7.2E4 283.1331 1.8E7 285.1109 2.9E4 285.1488 3.7E6 285.1848 6.2E4 296.1641 2.4E4 297.1738 2.8E5 313.1675 4.8E5 328.1908 1.7E7 END IONS BEGIN IONS FEATURE_ID=228 PEPMASS=432.2809 SCANS=228 RTINSECONDS=268.424 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 6 (0 removed due to low quality, 0 removed due to low cosine). 58.8652 2.5E3 60.0002 2.6E3 60.9089 2.2E3 61.3197 2.4E3 62.0799 2.3E3 62.7728 2.2E3 66.0665 2.2E3 67.9330 2.4E3 73.0646 6.2E3 75.1113 2.4E3 84.4744 2.3E3 87.0435 4.4E4 87.4063 2.3E3 89.0593 8.6E5 89.0653 4.8E3 97.5125 2.4E3 99.2004 2.6E3 102.9092 2.3E3 110.4718 2.4E3 123.6005 2.4E3 126.9491 2.5E3 131.0699 2.3E3 133.0754 4.2E3 133.0855 3.2E5 148.0595 2.9E3 148.1998 2.7E3 151.6281 2.8E3 153.5000 2.5E3 155.9037 2.3E3 166.1580 2.7E3 173.5182 4.9E3 173.5289 9.2E4 173.5443 2.5E4 173.7885 2.5E3 173.8409 2.8E3 177.1119 3.1E4 188.6293 3.1E3 189.2424 2.4E3 190.1240 2.3E3 197.8543 2.3E3 200.8270 2.2E3 200.9310 2.4E3 205.1424 2.6E3 211.0938 2.5E3 211.3869 2.1E3 230.5586 3.4E3 241.6428 2.3E3 284.0428 2.6E3 317.6653 2.6E3 330.5451 2.5E3 382.7034 3.3E3 400.6490 2.6E3 421.4684 2.4E3 END IONS BEGIN IONS FEATURE_ID=229 PEPMASS=342.1703 SCANS=229 RTINSECONDS=270.618 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 4 (1 removed due to low quality, 0 removed due to low cosine). 55.9851 2.2E3 56.0494 7.1E3 58.0650 2.0E6 58.0678 1.7E4 58.0704 1.1E4 58.0718 1.0E4 58.0800 2.7E3 59.0626 2.2E3 62.9726 2.2E3 79.7196 2.2E3 80.2353 3.0E3 80.5062 2.4E3 82.5646 2.3E3 83.3129 2.5E3 86.0599 1.5E4 95.7343 2.2E3 97.0283 7.5E3 101.9623 2.6E3 104.2201 2.2E3 104.8790 2.3E3 113.0231 5.3E3 121.0276 2.6E3 123.0066 2.4E3 123.0436 2.5E3 135.0439 4.1E3 137.2683 2.4E3 137.4394 2.3E3 139.0388 2.5E4 141.0184 4.9E3 143.0335 2.5E3 164.0831 2.8E4 169.0125 3.7E3 173.5280 2.7E4 173.5386 1.2E4 174.0911 1.6E4 175.1003 2.5E3 188.1071 1.5E5 189.0978 3.2E3 189.1148 4.0E5 190.1017 2.9E3 190.1224 7.3E3 203.0939 4.2E3 204.1020 5.8E4 205.1097 6.3E4 206.1176 5.6E4 206.1385 4.1E3 208.1341 3.9E3 218.1179 2.3E4 220.1334 3.5E5 243.1027 3.6E3 265.0854 3.1E3 266.0927 9.3E3 269.1190 2.8E3 271.0972 9.0E3 285.1138 3.0E3 297.1120 1.2E4 306.2882 3.1E3 310.4841 2.4E3 342.1717 2.7E3 END IONS BEGIN IONS FEATURE_ID=230 PEPMASS=330.0976 SCANS=230 RTINSECONDS=271.241 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 58.0651 1.6E6 58.0683 1.0E4 58.0699 9.5E3 59.0618 1.0E4 59.0683 5.0E5 59.0715 5.3E3 59.2711 2.4E3 60.0653 3.5E3 60.0717 3.2E4 60.7485 2.2E3 61.9738 2.1E3 65.0386 1.6E4 68.9941 2.1E3 69.1113 2.2E3 72.0803 3.0E3 86.0960 2.5E3 87.6017 2.3E3 88.0354 2.7E3 91.0540 4.5E4 93.0695 2.7E3 107.0490 3.7E5 107.0577 3.9E3 108.0524 2.9E5 109.0547 9.2E4 109.5948 2.9E3 111.9159 2.7E3 114.4717 2.7E3 119.0392 3.4E3 119.0489 1.8E5 121.0282 1.0E5 121.0646 9.7E4 121.0736 4.8E3 122.0594 9.6E3 122.0680 4.5E4 123.0703 1.2E4 123.2599 2.8E3 126.6379 2.5E3 134.0685 3.0E3 138.0546 7.5E3 145.0646 4.7E4 146.0680 5.7E4 147.0439 1.3E6 147.0708 2.8E4 147.0809 7.9E3 148.0838 1.2E4 149.0856 5.9E3 149.6859 5.0E3 149.6964 3.8E3 151.0753 4.1E4 152.0786 5.5E4 152.4736 2.5E3 153.0809 3.3E4 159.0766 6.5E3 160.0807 3.1E3 163.0753 1.4E4 164.0706 2.5E5 165.0795 3.0E3 165.0919 3.6E3 166.0941 1.8E4 166.5828 2.4E3 167.0168 3.5E3 167.0339 9.0E5 167.0963 1.7E4 173.5291 2.2E4 173.5398 9.1E3 174.0679 8.8E3 175.0715 2.0E4 176.0716 2.0E4 177.0894 1.2E4 178.0932 1.7E4 179.0972 5.7E3 182.2370 2.4E3 189.0910 4.8E4 190.0945 1.0E5 191.0971 9.7E4 192.1091 8.4E3 193.1113 5.6E3 206.1180 7.3E3 207.1216 1.6E4 208.1259 2.1E4 209.1326 1.2E4 225.3615 2.3E3 227.1335 3.4E3 252.1132 1.0E4 253.1170 3.1E4 254.1209 8.4E4 255.1277 1.1E4 256.1020 6.9E3 256.1372 2.9E3 257.1099 5.4E3 258.1150 9.8E3 269.1121 1.7E4 270.1157 5.7E4 272.1311 1.9E4 284.1359 6.2E4 285.1393 3.0E5 286.1521 1.4E4 287.1549 5.4E4 330.1971 3.0E5 330.2398 4.4E3 END IONS BEGIN IONS FEATURE_ID=231 PEPMASS=743.2035 SCANS=231 RTINSECONDS=271.768 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 2 (0 removed due to low quality, 0 removed due to low cosine). 69.0331 2.9E4 71.0488 6.1E4 73.4958 2.2E3 75.0438 2.4E3 75.7649 2.5E3 81.0329 2.8E3 83.0486 1.1E4 85.0280 1.2E5 87.0436 2.1E4 87.7363 2.6E3 90.0216 2.4E3 97.0279 4.5E4 99.0437 8.5E3 99.2796 2.3E3 111.0438 1.0E4 115.0384 2.4E4 115.3123 2.7E3 127.0385 1.1E4 129.0541 2.3E4 133.0495 4.4E3 139.0394 2.6E3 145.0493 1.1E4 147.8224 2.3E3 151.0262 2.5E3 169.2172 2.3E3 171.0645 3.2E3 173.5212 7.1E3 173.5398 2.8E4 183.4869 2.3E3 242.7465 2.4E3 243.9078 2.4E3 258.1874 2.3E3 261.0963 4.0E3 302.9688 3.7E3 303.0498 1.4E6 308.7199 2.9E3 345.0597 9.5E3 474.8039 2.5E3 553.6123 3.2E3 585.7518 3.0E3 641.3464 2.5E3 END IONS BEGIN IONS FEATURE_ID=232 PEPMASS=316.1913 SCANS=232 RTINSECONDS=272.202 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 5 (0 removed due to low quality, 0 removed due to low cosine). 48.4184 2.6E3 52.5586 2.3E3 53.6888 2.3E3 54.1576 2.5E3 57.0699 2.1E3 58.0648 7.2E3 58.5018 2.3E3 58.5863 2.3E3 59.2105 2.4E3 60.0805 6.4E5 60.0839 3.4E3 61.5990 2.2E3 62.5327 2.5E3 62.7882 2.3E3 63.4850 2.2E3 66.4934 2.2E3 69.4311 2.2E3 74.0761 2.2E3 77.8506 2.2E3 81.3380 2.5E3 81.3558 2.3E3 83.1553 2.6E3 87.1542 2.3E3 87.1833 2.3E3 89.3242 2.5E3 89.9045 2.4E3 91.0539 5.6E4 93.0695 2.7E4 93.1154 2.2E3 95.0489 2.6E4 101.8471 2.4E3 103.0537 2.8E3 107.0488 1.3E5 109.0645 8.3E3 112.4294 2.5E3 117.0695 6.3E4 117.0777 2.7E3 118.6135 2.5E3 119.0402 4.0E3 119.0488 2.0E5 119.0854 2.6E4 120.0431 2.6E3 121.0645 8.7E5 121.0733 1.5E4 123.0437 6.5E4 123.7171 2.5E3 133.0645 1.6E4 135.0438 1.1E5 135.0804 2.5E4 137.0480 4.7E3 137.0594 4.7E5 137.0715 5.3E3 139.5712 2.7E3 145.0556 2.3E3 145.0644 1.4E5 147.0698 2.1E3 147.0801 3.6E5 149.0400 2.7E3 149.0595 3.2E4 151.0750 3.0E3 163.0751 3.7E5 163.0910 2.7E3 173.5295 4.4E4 173.5402 2.1E4 176.0805 2.3E3 178.0809 2.2E3 180.2360 2.3E3 182.0727 6.3E3 182.0893 2.6E3 183.0803 3.2E4 193.1009 8.3E3 210.0670 1.9E4 211.0755 2.7E4 211.1118 1.6E5 218.3007 2.3E3 221.0961 2.9E4 223.9055 3.4E3 228.0776 4.7E4 229.1227 7.1E3 239.1066 1.2E5 250.1542 2.5E3 257.0880 4.0E3 257.1171 3.0E5 257.1471 6.3E3 271.5126 3.1E3 272.7830 2.8E3 308.7747 2.2E3 311.2586 2.3E3 316.1901 3.3E4 318.8927 2.8E3 END IONS BEGIN IONS FEATURE_ID=233 PEPMASS=330.1707 SCANS=233 RTINSECONDS=275.42 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 58.0652 3.6E3 76.4742 2.6E3 85.6230 2.2E3 87.5945 2.6E3 91.0541 1.7E4 95.2170 2.3E3 95.8377 2.5E3 95.9193 2.2E3 96.7901 2.7E3 97.6303 2.3E3 102.6280 3.0E3 104.9453 2.5E3 105.0339 2.4E3 109.0647 3.4E3 115.0543 3.5E4 118.8269 2.6E3 119.0492 1.7E4 122.0363 5.5E3 125.0597 3.6E3 133.1439 2.4E3 135.0436 3.6E3 137.0597 1.0E6 140.8288 2.4E3 143.0360 3.1E3 143.0491 5.0E5 143.0626 3.4E3 145.0646 1.3E4 147.0441 2.5E3 147.0806 5.4E3 149.0597 2.0E4 151.0620 5.1E3 151.0754 1.6E5 157.0647 3.1E3 160.0519 2.4E4 160.0768 6.8E3 161.0597 5.5E3 163.0756 3.3E4 165.0903 5.7E3 173.5330 3.7E4 174.0918 2.9E3 175.0575 4.4E3 175.0756 7.3E5 175.0934 5.5E3 176.0837 3.5E3 177.0787 6.9E4 177.0926 1.0E4 178.0864 3.0E4 179.0878 9.7E3 180.1025 1.1E4 192.0607 1.7E4 192.0872 1.7E4 192.1020 3.0E6 192.1426 1.4E4 192.1544 3.2E3 192.7312 2.9E3 193.1080 6.0E3 195.0808 1.2E4 207.0807 6.1E4 209.0959 2.8E3 223.0759 1.2E4 227.1069 5.4E4 235.0753 6.0E4 237.0907 8.6E3 239.0674 3.3E3 239.1068 8.0E4 241.0872 6.8E3 241.1224 1.3E4 252.0781 3.0E3 255.1016 4.8E4 267.1016 1.5E5 268.1100 9.5E3 269.1166 1.4E4 284.1044 2.7E4 287.1278 2.5E4 289.8487 2.3E3 298.1438 1.2E4 299.1282 1.5E5 301.1447 1.2E4 327.7255 2.9E3 330.1702 1.1E5 END IONS BEGIN IONS FEATURE_ID=234 PEPMASS=360.2172 SCANS=234 RTINSECONDS=275.654 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 51.1381 2.2E3 51.2454 2.3E3 55.0177 3.8E3 57.3563 2.7E3 58.0651 3.7E3 69.2409 2.2E3 69.2450 2.8E3 71.3543 2.7E3 81.0696 1.4E4 91.0541 2.5E4 91.5570 2.8E3 93.1679 2.4E3 102.6752 2.8E3 103.0543 2.9E3 105.0699 8.7E3 106.0280 2.9E3 107.0488 3.3E4 109.0282 6.2E3 109.0646 2.4E4 114.2605 2.2E3 115.0547 3.2E3 117.0696 2.5E4 119.0488 3.4E3 121.0646 4.5E4 123.0441 3.5E3 126.9182 2.2E3 131.0854 1.7E4 135.0333 3.3E3 135.0439 9.8E4 135.0803 3.2E4 137.0594 3.1E5 137.0715 5.2E3 139.0746 1.3E4 144.0570 2.8E3 145.0644 1.7E4 146.0724 5.8E4 146.0848 3.5E3 147.0801 2.3E4 149.0594 2.2E4 149.0960 2.6E4 150.0672 1.3E4 151.0753 2.7E4 152.0828 5.1E4 152.0955 2.2E3 159.0801 2.5E4 160.0881 1.3E5 161.0599 1.4E4 161.0960 2.7E4 162.0674 1.7E5 163.0751 1.8E5 163.1118 8.8E3 164.0830 7.0E3 165.0910 6.8E4 166.0985 1.0E4 167.1065 5.4E4 173.5245 1.5E4 173.5391 2.2E4 174.1628 3.3E3 175.0752 1.2E4 176.0832 4.6E5 177.0548 2.5E4 177.0909 4.3E6 177.1047 2.4E4 177.1191 1.6E4 177.1275 2.2E4 178.0987 5.4E4 179.1068 4.7E4 189.0918 2.7E3 190.0989 6.7E4 191.1065 1.4E6 192.1143 7.9E5 193.1223 2.9E4 195.1015 2.2E4 208.5788 2.7E3 212.0853 2.5E3 213.0919 2.8E3 215.1070 1.8E4 223.1114 7.1E3 224.1190 7.8E3 227.1066 4.2E3 234.1020 4.8E3 236.1650 8.4E3 237.0910 1.6E4 240.5099 2.5E3 241.0873 2.5E3 241.1224 3.3E4 242.0918 2.5E3 250.1804 1.6E4 251.1062 1.3E4 252.1144 7.8E4 253.0852 3.4E3 254.0927 3.1E3 255.1369 1.2E4 259.9880 2.5E3 265.1213 1.1E4 268.1096 3.7E4 269.1177 2.1E4 272.1049 1.1E4 283.1332 4.2E4 286.1202 4.1E4 301.1439 6.9E4 328.3864 2.5E3 350.9016 2.6E3 357.2488 2.6E3 360.2170 5.3E4 END IONS BEGIN IONS FEATURE_ID=235 PEPMASS=344.1860 SCANS=235 RTINSECONDS=277.865 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 52.9421 2.3E3 56.0494 2.9E3 56.7491 2.2E3 58.0651 1.1E6 70.1704 2.1E3 72.0807 8.7E3 74.6322 2.0E3 77.8242 2.5E3 79.9677 2.0E3 81.3662 2.3E3 89.0599 3.3E3 91.0540 1.0E4 93.7484 2.2E3 95.0493 2.4E3 97.5624 2.7E3 100.4459 2.6E3 107.0492 5.4E3 115.0542 1.6E4 121.0646 9.5E3 123.0230 7.3E3 123.0439 1.9E6 123.0651 7.0E3 124.3757 2.5E3 129.0703 7.1E3 131.0493 3.7E3 131.0853 2.9E3 133.0649 3.9E3 136.0517 1.6E4 137.0597 6.0E4 139.0756 9.8E3 143.0377 3.8E3 143.0491 1.1E5 144.0562 3.4E3 145.0650 8.7E3 146.0728 8.2E3 147.0439 3.6E3 149.0598 2.8E3 151.0645 2.1E3 151.0753 3.2E5 151.0892 5.4E3 155.3005 2.4E3 158.0726 1.3E5 159.0805 2.9E4 161.0441 6.4E3 161.0597 2.6E5 162.0674 1.3E4 163.0753 5.4E4 165.0912 3.3E4 173.5298 3.9E4 174.0676 2.3E5 174.0849 5.1E3 175.0754 1.6E4 176.0834 1.8E4 177.0911 9.0E4 189.0910 1.4E6 190.0987 9.5E4 190.1218 1.7E4 191.1069 6.3E3 192.1018 6.7E3 206.1175 4.5E4 207.1255 3.5E4 208.1332 1.5E4 223.0756 2.5E3 249.0914 1.3E4 250.0985 6.8E3 253.0858 1.5E4 253.1210 1.3E4 267.1012 2.2E4 268.1094 2.8E5 269.0807 6.7E3 270.0882 1.9E4 271.0975 3.7E3 279.4023 2.7E3 281.1167 2.3E4 284.0685 4.8E3 284.1044 2.3E5 299.1279 6.5E5 299.1848 3.3E3 301.1426 2.2E4 313.1680 1.0E4 329.1634 2.8E3 344.1372 4.1E3 344.1852 2.5E5 END IONS BEGIN IONS FEATURE_ID=236 PEPMASS=252.0869 SCANS=236 RTINSECONDS=281.085 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 6 (0 removed due to low quality, 0 removed due to low cosine). 44.0131 1.7E4 44.4867 2.3E3 44.5504 2.0E3 46.0525 2.2E3 49.0109 2.5E3 49.3123 2.5E3 49.8301 2.3E3 50.4483 2.4E3 50.4583 2.4E3 53.3737 2.5E3 55.0194 2.3E3 55.7488 2.2E3 60.4968 2.6E3 60.8188 2.6E3 62.9504 2.2E3 63.5755 2.3E3 68.6368 2.2E3 69.4786 2.4E3 71.7405 2.6E3 74.3369 2.2E3 74.8027 2.2E3 74.8876 2.2E3 75.9144 2.4E3 77.0385 4.8E3 77.2589 2.2E3 79.0539 1.1E6 79.0592 5.5E3 81.2372 2.4E3 82.4025 2.3E3 86.0233 8.2E4 87.0073 1.0E5 87.8894 2.2E3 90.6419 2.6E3 95.0488 2.0E4 95.1051 2.2E3 97.9137 2.4E3 103.0539 2.1E5 104.0339 1.2E6 104.0417 1.1E4 104.1068 6.4E3 105.0695 5.2E4 106.0532 3.0E3 106.0648 1.9E6 106.0729 1.6E4 107.0395 5.0E3 107.0489 5.0E6 107.0617 1.5E4 107.0632 6.1E4 107.0656 1.2E4 111.0154 2.5E3 113.0675 2.3E3 121.0161 2.4E3 131.0379 1.1E4 131.0488 1.2E6 131.0588 4.0E3 131.0603 1.9E4 132.0441 1.5E5 135.8890 2.4E3 139.2933 2.6E3 145.6924 2.5E3 148.8895 2.3E3 149.0598 1.0E4 161.7452 2.2E3 164.0703 1.9E4 164.9499 2.2E3 173.5238 1.5E4 173.5363 5.7E4 174.0545 2.5E3 182.2902 2.4E3 191.3963 2.3E3 192.0654 2.8E5 192.0851 3.4E3 215.6228 2.5E3 243.8957 2.4E3 END IONS BEGIN IONS FEATURE_ID=237 PEPMASS=476.3069 SCANS=237 RTINSECONDS=281.46 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 58.2395 2.4E3 68.2345 2.2E3 73.0647 3.8E3 74.8131 2.4E3 87.0436 2.9E4 89.0593 4.2E5 89.0654 2.5E3 97.9959 2.3E3 104.6811 3.0E3 108.9618 2.3E3 110.5698 2.4E3 119.0388 2.3E3 119.0487 2.5E3 125.3477 2.3E3 133.0855 1.6E5 136.8069 2.2E3 167.0894 2.6E3 173.5338 6.6E4 177.1122 1.4E4 198.6416 2.7E3 274.9514 2.7E3 317.7368 2.3E3 320.6321 2.5E3 348.1523 2.2E3 467.2920 2.9E3 END IONS BEGIN IONS FEATURE_ID=238 PEPMASS=482.1850 SCANS=238 RTINSECONDS=283.935 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 61.2158 2.5E3 86.5857 2.4E3 88.0391 8.3E3 88.3002 2.3E3 95.4444 2.3E3 96.2184 2.6E3 98.3930 2.6E3 111.3580 2.0E3 113.8062 2.7E3 131.0488 9.3E3 132.7540 2.3E3 136.0254 2.2E3 137.0594 3.4E5 137.0693 2.4E3 145.0651 2.5E3 145.6681 2.6E3 151.0202 2.6E3 151.0751 3.3E4 157.0649 3.5E3 161.0595 6.1E4 162.0676 5.9E3 163.0213 1.7E4 163.0753 4.2E4 165.0367 2.0E4 167.7229 2.5E3 169.0150 4.2E3 169.0316 1.9E5 171.0812 2.6E3 173.5172 4.5E3 173.5358 5.3E4 175.0753 3.4E4 177.0347 2.6E3 177.0913 5.4E3 177.7684 2.5E3 181.0319 4.2E3 183.0473 1.1E4 183.6334 2.5E3 185.0267 1.8E4 187.0754 5.7E4 188.0830 2.6E4 189.0370 2.9E4 189.0907 2.5E4 190.0985 2.6E3 190.3204 2.4E3 193.0318 5.5E4 195.0472 5.7E4 201.0363 3.6E3 201.0909 1.4E4 203.1066 1.7E4 207.0476 1.4E4 207.1019 7.3E3 209.0267 2.9E3 209.0623 3.9E3 213.0914 1.4E4 215.0520 3.3E3 215.1065 2.6E3 219.0477 6.1E3 221.0631 4.1E4 224.0380 2.1E4 229.0325 5.6E3 233.0631 1.3E4 239.0740 5.4E3 251.0732 2.5E4 257.0631 4.3E3 259.0431 3.7E3 264.1108 3.3E3 265.0677 4.3E3 267.0488 3.5E3 270.0882 3.1E3 271.0449 3.5E3 277.0874 3.3E3 281.0655 3.0E3 283.0774 5.1E3 292.1080 3.2E3 293.0621 8.9E3 297.0587 3.1E3 297.0948 1.2E4 299.3226 2.4E3 309.1134 5.0E3 310.0652 5.1E3 311.0742 5.2E4 315.1061 1.2E4 319.0794 3.3E3 324.1355 2.8E4 325.0905 2.6E4 329.0823 3.0E3 342.1469 4.2E4 343.1004 3.4E4 350.1517 3.4E4 351.1056 1.3E4 357.1136 1.4E4 360.1546 1.1E4 361.1105 3.6E3 375.1268 1.8E4 383.1322 3.7E4 393.1329 3.4E3 401.1410 9.4E3 452.7366 2.5E3 478.4809 2.9E3 END IONS BEGIN IONS FEATURE_ID=239 PEPMASS=360.1081 SCANS=239 RTINSECONDS=286.103 CHARGE=1+ MSLEVEL=2 MERGED_STATS=11 / 11 (0 removed due to low quality, 0 removed due to low cosine). 51.4773 2.5E3 51.9747 2.4E3 52.4845 2.1E3 55.0540 2.5E3 55.5334 2.7E3 56.1436 2.4E3 59.4120 2.5E3 59.6768 2.2E3 60.6241 4.4E3 61.7212 2.3E3 63.0234 7.4E3 64.5071 2.5E3 65.0384 1.3E5 67.0540 2.3E4 68.4157 2.5E3 70.6715 2.2E3 71.5403 2.5E3 72.0805 1.5E4 72.5010 2.2E3 73.7022 3.2E3 75.2232 2.1E3 82.0981 2.4E3 82.4671 2.6E3 82.9461 2.3E3 84.1796 2.4E3 84.7610 2.3E3 86.0598 9.6E3 87.7609 2.2E3 89.0385 1.8E5 89.2541 2.7E3 89.8175 2.2E3 90.5512 2.3E3 91.0540 6.3E4 91.4773 2.3E3 92.1150 2.6E3 92.8882 2.2E3 93.0332 4.1E4 94.4247 2.2E3 94.5082 2.2E3 95.0491 2.2E3 95.3042 2.4E3 95.3904 2.6E3 98.5013 2.5E3 101.2002 2.4E3 101.7833 2.3E3 106.0410 2.9E3 110.0716 2.9E3 110.1702 2.3E3 110.7587 2.4E3 111.9303 2.4E3 113.1558 2.8E3 114.0174 2.2E3 115.7528 2.2E3 117.0241 7.9E3 117.0333 7.7E5 119.0489 1.3E5 120.0447 8.3E3 121.0182 1.5E4 121.0281 9.6E5 121.0367 2.4E3 121.0386 1.3E4 121.0633 2.2E3 123.0437 4.4E3 124.4312 2.3E3 127.9919 2.4E3 130.9684 2.5E3 134.0361 3.5E4 135.0439 5.5E4 136.0407 2.7E3 136.0518 7.4E4 137.0599 8.6E3 137.1297 2.6E3 138.0546 8.1E4 138.0655 5.4E3 140.3155 2.7E3 142.0276 2.2E3 144.9481 2.6E3 145.0282 8.4E6 145.0392 7.5E4 145.0548 5.0E4 147.0437 3.4E3 149.0595 3.9E5 151.0752 3.1E5 152.0705 1.2E5 156.0301 2.4E3 162.0305 2.5E4 162.6054 2.3E3 163.0387 1.4E5 164.0341 6.2E4 164.9258 3.0E3 167.0338 1.2E7 167.0472 5.7E4 167.0668 7.1E4 167.0762 1.1E4 170.1844 3.0E3 173.5231 1.8E4 173.5318 1.2E5 173.5412 2.5E4 177.0073 5.5E3 177.0179 3.2E4 177.0265 6.3E3 177.0546 1.6E7 177.0691 3.6E4 177.0907 1.5E5 177.1021 8.2E3 178.0565 2.8E3 182.0454 1.2E4 186.0550 5.6E4 188.8434 2.9E3 194.0812 1.3E6 194.1004 6.3E3 200.5937 3.3E3 210.0399 1.4E5 229.5228 2.7E3 245.4935 2.6E3 255.8139 2.8E3 267.1973 2.7E3 274.5637 2.7E3 295.0061 2.3E3 301.7283 2.9E3 313.6378 3.0E3 318.4731 2.3E3 338.7488 2.4E3 341.4839 2.6E3 353.3285 2.5E3 363.5977 2.3E3 368.7456 2.8E3 END IONS BEGIN IONS FEATURE_ID=240 PEPMASS=328.1550 SCANS=240 RTINSECONDS=286.309 CHARGE=1+ MSLEVEL=2 MERGED_STATS=7 / 7 (0 removed due to low quality, 0 removed due to low cosine). 49.3004 2.3E3 49.6912 2.2E3 52.6112 2.3E3 55.8750 2.2E3 58.0648 3.6E5 60.1157 2.3E3 62.0236 2.4E3 62.4164 2.4E3 63.9256 2.4E3 64.8860 2.3E3 65.8452 2.5E3 72.4967 2.5E3 74.3368 2.2E3 76.8394 2.3E3 79.2131 2.3E3 80.8880 2.6E3 86.0599 3.1E3 86.0961 2.6E3 90.1133 2.3E3 95.1599 2.5E3 121.0648 3.2E3 123.0432 5.7E3 123.7098 2.5E3 125.7634 2.4E3 127.8970 2.2E3 128.2487 2.1E3 130.2247 2.3E3 136.2888 2.3E3 137.0229 6.0E4 138.7250 2.5E3 141.6196 2.3E3 143.4147 2.3E3 143.7984 2.5E3 146.0962 7.6E3 147.7881 2.5E3 154.0487 4.8E3 158.1472 2.5E3 160.2884 2.7E3 160.9246 2.6E3 173.2574 2.7E3 173.5283 5.3E4 173.5388 2.5E4 174.0912 3.8E4 175.0985 9.0E3 183.1990 2.3E3 184.9250 2.5E3 189.1988 2.5E3 190.0855 8.2E3 191.0942 1.3E4 192.1014 4.9E3 195.0790 2.9E3 200.8878 2.7E3 205.0647 5.0E4 206.1173 6.6E4 208.6325 2.5E3 218.9716 2.5E3 219.0807 4.7E3 222.0671 5.4E3 223.0761 7.0E3 232.9291 2.4E3 233.0597 1.5E5 234.0677 2.8E3 237.0908 1.8E5 247.0759 2.9E3 250.0625 3.1E4 251.0701 1.7E5 252.0779 1.1E4 253.0491 2.6E3 254.0941 3.3E3 255.1015 5.1E4 265.0857 1.1E6 266.0927 5.0E3 267.5219 2.8E3 268.0727 2.3E4 269.1173 2.3E3 282.0892 4.5E4 283.0966 4.6E5 283.1323 4.7E3 285.1122 6.5E3 297.1122 3.0E5 302.6020 2.3E3 310.2665 2.7E3 313.0823 2.2E3 END IONS BEGIN IONS FEATURE_ID=241 PEPMASS=554.1695 SCANS=241 RTINSECONDS=287.021 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 62.1669 2.4E3 63.7969 2.1E3 65.0384 2.3E4 66.8968 2.2E3 67.0541 3.8E3 68.9969 2.8E4 69.5997 2.2E3 70.9555 2.4E3 71.0489 2.4E3 72.3952 2.3E3 75.0438 4.9E4 75.6447 2.5E3 77.0388 6.2E3 78.0463 1.8E4 79.0541 1.8E4 83.8825 2.3E3 85.0281 3.6E4 87.6551 2.3E3 89.0385 2.7E3 89.0595 3.2E4 91.0540 1.2E5 93.0333 3.7E5 93.0402 6.3E3 93.0696 5.5E4 95.0490 5.2E4 97.0645 1.7E4 97.3264 2.1E3 100.6409 2.2E3 103.0540 4.6E4 105.0447 2.9E3 105.0698 1.8E4 106.0411 1.9E5 107.0490 3.1E4 109.0644 5.1E3 111.0438 4.6E3 117.0333 1.6E4 117.6729 2.4E3 118.0416 5.3E3 119.0491 2.7E4 121.0285 1.5E4 121.0646 3.9E5 121.0763 8.5E3 121.4287 2.6E3 122.0370 2.4E3 122.0725 5.7E3 123.0438 1.5E4 123.0802 9.8E3 123.7527 2.3E3 125.0595 2.3E5 131.0490 5.8E4 132.0568 1.7E4 133.0646 1.8E4 134.0361 3.0E4 135.0440 3.6E4 135.0802 6.4E3 137.0596 3.3E4 139.0753 4.8E4 144.1401 2.3E3 145.0285 3.5E4 147.0435 1.4E4 148.0518 2.8E4 149.0596 1.2E6 151.0753 7.0E4 152.7847 2.6E3 153.0544 3.6E4 153.0910 4.6E5 154.0624 1.4E4 156.0316 2.6E3 156.4267 2.5E3 159.0439 1.2E4 160.0517 2.2E4 161.0600 3.2E3 162.1851 2.5E3 163.0250 3.9E3 163.0390 1.7E5 163.0755 5.6E4 165.0543 4.2E3 166.0624 1.5E4 167.0705 1.5E5 167.0854 4.7E3 173.0603 3.0E3 173.5264 1.1E4 173.5397 1.2E4 176.0452 2.8E3 177.0408 2.2E4 177.0549 1.3E6 179.0161 6.9E3 179.0706 5.5E4 180.0420 4.7E4 180.0783 5.4E4 181.0497 2.0E4 181.0560 4.7E3 181.0710 1.4E4 181.0861 9.8E5 181.7618 2.6E3 182.0940 9.3E4 191.0705 2.8E5 191.0890 4.2E3 192.0581 5.6E3 192.0783 2.7E5 194.0569 4.0E3 195.0655 1.1E5 205.0498 3.2E3 207.0659 1.0E4 207.0897 1.2E4 207.1775 2.5E3 208.0377 6.2E3 209.0646 1.8E4 209.0813 1.5E6 210.0891 1.2E5 222.0524 2.7E3 223.0427 2.3E4 223.0608 1.3E6 267.0857 2.6E3 270.6929 2.5E3 299.3516 2.4E3 307.0560 2.8E3 344.9570 2.6E3 383.1141 4.9E4 417.8080 2.7E3 END IONS BEGIN IONS FEATURE_ID=242 PEPMASS=344.1860 SCANS=242 RTINSECONDS=289.475 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 51.5295 2.4E3 55.6610 2.2E3 57.1490 2.4E3 58.0648 6.2E5 58.0698 8.8E3 59.2803 2.9E3 60.9789 2.2E3 61.0330 2.5E3 64.8418 2.4E3 70.0716 2.6E3 70.8595 2.2E3 81.0520 2.5E3 82.0171 2.5E3 86.3970 2.1E3 91.8743 2.1E3 101.9308 2.6E3 102.4038 2.6E3 104.5404 2.5E3 107.0487 2.5E5 114.5087 2.6E3 121.0644 5.2E4 135.0796 2.3E3 141.7962 2.4E3 145.0644 5.0E4 147.0796 5.8E3 161.0604 5.5E3 167.0701 4.1E4 173.0597 5.1E4 173.5222 4.0E3 173.5365 3.8E4 175.0753 3.5E3 179.0708 2.9E3 181.0860 1.1E4 181.6573 2.4E3 192.0776 2.4E3 193.0859 1.7E4 205.0861 3.4E4 207.0800 9.6E3 207.1021 1.3E4 222.1121 2.1E4 224.1276 1.2E4 235.0754 4.1E3 237.0896 3.2E3 238.3025 2.5E3 239.1062 1.9E4 241.1218 6.8E3 246.4326 2.6E3 251.0660 3.0E3 252.0772 3.4E3 267.1012 5.8E4 268.1088 1.6E4 269.1174 6.6E3 276.5505 2.4E3 284.1039 2.1E4 297.9016 2.8E3 299.1280 9.7E4 301.1435 4.0E4 312.1607 4.9E3 344.1856 1.8E5 346.1644 2.6E3 352.3719 2.6E3 END IONS BEGIN IONS FEATURE_ID=243 PEPMASS=314.1756 SCANS=243 RTINSECONDS=289.691 CHARGE=1+ MSLEVEL=2 MERGED_STATS=9 / 9 (0 removed due to low quality, 0 removed due to low cosine). 48.1994 3.4E4 48.3033 1.3E4 50.6164 2.5E4 51.0235 3.8E4 51.1871 2.0E4 53.3547 8.8E3 53.9245 1.6E4 54.4964 1.3E4 55.0180 1.0E5 56.0495 2.5E5 56.0688 8.7E3 58.0653 9.3E7 58.0683 3.3E5 58.0718 1.7E5 58.1650 1.2E4 61.2284 8.8E3 62.4006 2.2E4 62.7492 1.4E4 66.3001 1.3E4 67.9928 4.5E4 70.4673 3.1E4 71.0241 9.0E3 71.0730 2.9E5 72.0807 7.8E5 73.3575 3.2E4 73.8685 3.3E4 77.0389 1.6E5 78.5433 2.6E5 79.0542 3.6E5 79.4201 2.0E4 81.2700 1.9E4 81.7447 8.2E3 84.4480 3.0E4 86.3590 1.0E4 89.3691 1.2E4 91.0542 7.2E5 93.0698 5.7E5 95.0491 1.0E6 96.0044 9.5E3 96.7538 1.5E4 103.0543 3.7E5 104.9871 1.4E4 105.0335 4.3E4 105.0696 4.1E4 105.1533 4.1E4 106.8357 3.3E4 107.0320 7.8E5 107.0491 1.4E8 107.0656 1.8E6 107.0728 1.4E5 107.2389 1.6E4 109.0648 2.9E5 113.3785 3.7E4 115.0451 5.2E4 115.0543 5.0E6 116.1865 1.1E4 117.0698 1.4E6 119.0491 1.8E6 119.0855 1.6E5 121.0283 9.8E5 121.0647 1.5E7 121.0746 6.1E4 121.4859 1.4E4 123.0445 4.8E4 123.0813 2.1E4 124.3878 1.8E4 125.0593 2.8E5 125.1942 3.6E4 129.0698 1.9E5 131.0491 1.5E6 133.0648 7.8E5 135.0807 5.6E4 137.0499 1.6E4 137.0597 1.8E7 137.0747 1.2E5 140.2761 1.5E4 143.0491 3.2E7 143.0589 8.6E4 143.0624 7.7E4 144.0566 2.3E5 145.0516 7.6E4 145.0648 1.9E7 145.0782 2.8E5 146.0722 7.7E4 147.0437 5.1E4 147.0804 4.1E6 149.0596 1.1E6 149.0835 8.2E5 149.0957 1.2E5 150.0673 2.0E5 151.0621 2.5E4 151.0753 5.3E6 151.0891 1.6E4 153.0911 1.0E5 155.0603 1.2E5 157.0648 9.4E5 159.0812 9.9E4 160.0518 7.2E5 160.1124 4.5E4 161.0598 7.7E5 162.0676 9.2E5 162.0921 2.5E4 163.0754 3.3E6 163.0994 3.9E5 164.1068 1.1E5 165.0703 7.5E4 165.0912 7.9E5 166.0775 5.6E4 167.0852 3.7E4 173.5223 3.9E5 173.5370 1.2E6 173.5481 1.5E4 174.0662 3.4E4 174.0919 1.1E5 175.0574 2.1E5 175.0756 1.8E7 175.1002 3.2E5 176.0834 4.1E5 176.1073 1.6E6 177.0912 5.5E6 178.0861 3.4E5 179.0942 2.0E5 181.0648 6.7E5 181.1013 8.0E5 182.0724 6.6E4 183.0807 6.0E5 186.8506 1.4E4 188.1067 5.2E4 189.0911 6.1E5 189.1139 2.4E5 190.1231 1.7E5 191.0858 1.1E6 191.1057 6.9E4 192.0834 4.3E4 192.1021 5.4E6 192.1218 1.4E4 193.0645 1.6E4 193.1097 2.7E6 194.0729 1.1E6 194.1176 4.5E6 194.1364 4.2E4 195.0808 5.6E5 195.7192 1.5E4 196.0880 7.1E4 197.0592 4.3E4 197.0954 6.3E4 201.0523 1.8E4 205.1094 2.6E5 205.3603 1.2E4 206.1179 3.9E5 207.1257 1.8E6 208.1341 5.2E4 209.0601 5.4E5 209.0725 5.0E4 209.0963 1.0E7 209.1149 3.6E4 210.0678 2.7E5 211.0754 7.1E5 211.1120 4.4E6 216.4681 2.9E4 219.0807 1.8E6 220.0879 1.9E5 220.1333 7.6E5 221.0960 5.8E5 222.0675 2.5E5 222.6659 1.2E4 223.0755 2.0E4 223.1119 4.2E5 224.0825 1.2E5 224.8177 1.3E4 225.0536 3.9E4 225.0913 1.2E5 225.1273 4.4E5 235.0751 1.2E5 236.0836 4.5E5 237.0520 5.9E4 237.0911 2.0E7 237.1127 3.1E4 237.1204 3.3E4 237.1303 1.3E4 238.0991 6.8E5 239.0733 3.7E5 239.1068 4.5E6 240.0783 1.0E6 241.0856 5.4E5 241.1222 2.9E5 242.0938 2.7E5 243.1018 1.5E4 251.1065 2.1E6 253.1221 7.4E5 254.0938 2.0E6 254.1540 5.3E5 256.1092 8.8E4 258.0324 4.4E4 267.1012 1.4E5 268.1091 4.4E4 269.1172 5.1E7 269.1842 1.9E4 271.1330 1.2E7 271.1817 3.9E4 282.1491 2.0E6 283.1329 8.4E5 285.1488 5.2E5 290.0032 1.4E4 299.1520 1.1E6 307.1376 1.1E4 314.0657 6.0E4 314.0902 4.3E5 314.1752 8.9E7 314.2071 2.4E5 314.2410 2.1E5 314.2613 3.1E5 324.6004 8.8E3 END IONS BEGIN IONS FEATURE_ID=244 PEPMASS=355.1541 SCANS=244 RTINSECONDS=289.698 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 7 (3 removed due to low quality, 0 removed due to low cosine). 60.6565 2.8E3 68.7762 2.4E3 69.0440 2.1E3 69.5848 2.4E3 79.0538 2.4E3 81.4060 2.6E3 88.4693 2.7E3 91.0540 3.2E3 94.0414 2.5E3 103.0536 2.2E3 107.0490 9.4E3 107.7296 2.2E3 109.0647 1.7E4 113.5482 2.4E3 113.8902 2.4E3 118.7399 2.2E3 121.0647 7.1E3 121.7250 2.4E3 122.0360 8.2E3 122.8961 2.5E3 125.0593 5.3E3 129.0696 2.0E4 131.0492 5.9E3 135.0438 5.7E3 135.0818 2.7E3 136.0515 5.3E4 137.0482 8.6E3 137.0594 5.3E5 139.0757 7.7E3 143.0855 6.3E3 145.0647 2.6E3 146.0731 2.6E3 149.0598 7.9E3 151.0380 6.2E3 151.0621 4.2E3 151.0751 3.9E5 153.8284 2.9E3 157.0645 3.8E4 158.0724 1.2E4 160.0524 2.6E3 161.0591 8.9E3 163.0758 1.4E4 165.0545 9.3E3 165.0914 1.5E4 168.8054 2.5E3 171.0805 1.6E4 172.0522 5.9E3 172.0883 4.0E4 173.0601 7.0E3 173.5219 1.6E4 173.5377 5.7E4 174.0677 5.6E4 174.9793 2.1E3 175.0752 4.4E4 177.0914 1.2E4 179.0702 1.1E4 180.6158 2.3E3 181.9237 2.9E3 184.8799 2.4E3 186.0679 2.6E3 187.0753 1.6E5 188.0831 1.1E5 189.0909 1.2E5 191.0720 3.4E3 199.0757 2.6E4 201.0910 2.2E5 202.0987 9.2E3 203.1068 1.1E5 205.1040 2.5E3 212.3800 2.5E3 213.0915 3.0E4 214.8728 5.6E3 217.0859 6.2E4 218.8700 2.5E3 225.0905 1.3E4 230.9030 2.8E3 231.0794 1.1E4 231.1018 1.0E5 233.0960 3.2E4 234.1044 4.3E3 235.0747 3.6E3 239.1075 4.0E3 241.0065 2.4E3 241.0861 2.5E4 244.0890 2.4E3 245.0958 2.2E4 245.1537 2.9E3 246.1038 3.5E4 247.0752 1.7E4 248.0837 2.4E3 250.0997 6.0E3 251.1065 8.4E3 253.0864 1.4E4 254.0936 3.7E4 255.0653 2.8E3 255.1022 6.5E3 258.4962 2.6E3 259.0759 4.9E3 261.0908 8.5E4 262.0988 7.3E4 263.0716 7.1E3 263.1065 2.0E4 265.1227 2.8E4 267.1012 7.6E3 269.0814 6.5E4 270.0889 3.3E4 273.0916 2.2E4 274.0993 6.4E4 275.0713 1.3E4 275.1068 4.9E4 276.1142 3.9E3 277.0892 1.2E4 277.1226 8.5E4 278.0942 3.6E4 279.1019 7.3E4 280.1096 7.8E3 282.0904 2.6E3 284.0694 6.6E3 284.1046 2.0E5 285.1124 2.8E4 287.1048 3.1E3 289.0881 7.0E3 289.1240 2.7E3 290.0940 7.0E4 290.8876 2.8E3 291.1019 1.6E5 293.1178 9.0E4 294.1253 8.4E4 295.0965 5.0E4 297.1131 3.5E4 304.1100 3.3E3 305.1175 1.8E5 306.1254 1.7E5 307.0968 1.0E5 308.1062 2.6E3 308.9008 3.3E4 309.1136 1.2E4 310.0793 3.7E3 310.1203 2.0E5 310.1583 3.8E3 311.1275 1.2E4 321.1127 9.5E3 322.1207 7.0E4 323.1271 3.7E3 324.1367 5.4E3 325.1433 4.0E4 334.4759 2.6E3 337.1438 8.6E4 355.1582 5.1E3 END IONS BEGIN IONS FEATURE_ID=245 PEPMASS=570.2547 SCANS=245 RTINSECONDS=289.883 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 3 (1 removed due to low quality, 0 removed due to low cosine). 63.7152 2.5E3 74.6185 2.2E3 75.8908 2.2E3 76.9755 2.1E3 80.7013 2.4E3 82.3573 2.3E3 82.3929 2.1E3 82.9319 2.6E3 83.0490 9.2E3 95.0491 3.7E3 103.0541 3.7E3 109.0651 2.9E3 111.5792 2.2E3 117.5548 2.8E3 121.0646 2.8E3 124.0522 3.5E3 125.0595 4.3E3 128.0624 2.6E3 129.0695 2.1E4 131.0490 2.7E4 136.0514 2.1E4 137.0595 3.7E5 137.0693 4.5E3 139.0751 1.9E4 143.0493 3.2E3 145.0644 3.2E3 146.0725 3.7E3 147.0801 2.7E3 149.0591 4.0E3 151.0383 6.8E3 151.0751 3.0E5 151.0891 4.0E3 153.0542 1.6E4 157.0646 7.6E4 160.0517 4.0E3 161.0595 1.9E4 163.0752 4.4E4 165.0541 3.3E3 167.0703 3.4E4 171.0807 2.4E3 172.0881 3.0E4 173.0598 7.2E3 173.5219 1.2E4 173.5390 2.8E4 174.0674 2.5E4 175.0753 1.1E5 177.0909 1.1E5 179.0700 1.5E4 185.0594 5.6E3 187.0752 7.4E4 188.0830 6.0E4 189.0908 2.8E5 189.1053 6.4E3 191.1067 9.0E3 199.0740 3.0E3 201.0689 3.7E3 201.0908 1.9E5 201.1103 4.0E3 202.8730 2.6E3 203.1066 2.4E5 205.0849 6.3E3 207.1015 4.0E3 213.0916 6.5E3 217.0858 3.6E4 219.1016 9.0E3 221.1172 6.4E3 231.1014 6.5E4 233.0944 4.8E3 253.0856 4.2E3 261.0902 1.4E4 262.0977 7.8E3 273.0883 3.3E3 274.0999 7.0E3 275.1052 3.2E3 277.0902 2.7E3 277.1225 2.0E4 278.0949 3.9E3 279.1013 3.0E3 279.3701 2.7E3 284.1042 4.4E4 285.1122 2.1E4 286.2793 2.7E3 286.3068 2.8E3 290.0928 6.8E3 291.0991 6.6E3 293.1169 3.2E4 294.1241 1.8E4 297.1126 1.9E4 302.5180 2.3E3 305.1170 6.8E4 306.1250 4.7E4 307.0963 3.3E3 310.1200 3.2E4 311.1277 7.5E3 322.1197 2.3E4 325.1429 1.3E5 325.1882 4.2E3 327.1588 2.6E3 337.1431 1.2E5 343.1552 3.5E3 355.1530 3.5E4 362.8528 2.5E3 578.8154 2.6E3 END IONS BEGIN IONS FEATURE_ID=246 PEPMASS=373.1647 SCANS=246 RTINSECONDS=289.897 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 55.6569 2.3E3 63.9695 2.0E3 66.0062 2.4E3 67.3674 2.2E3 73.7411 2.3E3 79.0175 2.2E3 82.2403 2.2E3 91.0544 2.6E3 105.0335 3.6E3 109.0644 6.4E3 111.0436 2.6E3 115.6396 2.6E3 121.6692 2.1E3 122.0362 3.0E3 125.0592 3.9E3 129.0696 4.0E3 131.0485 1.4E4 136.0518 8.2E3 137.0480 4.6E3 137.0594 2.6E5 147.0441 5.3E3 149.0590 6.3E3 151.0384 1.1E4 151.0751 1.0E5 153.0537 5.8E3 154.7753 3.2E3 155.3067 2.5E3 157.0650 1.5E4 158.0724 3.1E3 163.0758 2.8E3 165.0915 2.8E3 167.2104 2.7E3 172.0882 1.4E4 173.5234 2.1E4 173.5351 3.6E4 173.5444 1.4E4 174.0674 3.4E4 175.0752 3.0E4 177.0909 1.7E4 179.0705 3.6E3 187.0752 2.9E4 188.0830 4.5E4 189.0909 1.5E5 191.1071 2.5E3 201.0910 2.5E5 201.1134 4.6E3 203.1066 7.3E4 205.3626 2.6E3 213.0914 1.0E4 217.0863 3.2E3 224.4708 2.3E3 231.1018 4.6E4 233.0966 6.7E3 241.0840 2.5E3 245.0950 2.8E3 246.1035 4.6E3 247.0750 2.5E3 251.1070 3.6E3 253.0870 3.2E3 254.0945 4.5E3 261.0907 2.8E4 262.0989 2.4E4 265.1209 4.5E3 268.1442 2.5E3 269.0809 1.4E4 270.0882 5.2E3 273.0903 2.5E3 274.0992 2.3E4 275.1045 3.8E3 277.0912 3.6E3 277.1226 2.6E4 278.0938 1.3E4 279.1020 1.4E4 284.1047 4.5E4 285.1142 3.9E3 287.9091 2.5E3 290.0951 1.5E4 291.1021 2.7E4 293.1172 3.3E4 294.1252 3.1E4 295.0969 5.4E3 297.1140 1.8E4 305.1175 5.8E4 306.1258 3.9E4 307.0974 1.8E4 309.1124 5.1E3 310.1204 5.7E4 322.1205 2.2E4 325.1443 2.8E4 337.1442 3.4E4 END IONS BEGIN IONS FEATURE_ID=247 PEPMASS=575.2100 SCANS=247 RTINSECONDS=289.991 CHARGE=1+ MSLEVEL=2 MERGED_STATS=1 / 1 (0 removed due to low quality, 0 removed due to low cosine). 74.5231 2.4E3 79.9507 2.3E3 97.7391 2.5E3 137.0594 2.0E4 151.0751 1.7E4 173.5399 1.1E4 175.0749 4.7E3 177.0902 3.5E3 187.0742 2.9E3 189.0906 9.8E3 190.6507 2.5E3 203.0526 6.6E4 203.1065 1.0E4 234.9821 2.4E3 325.1442 4.2E3 337.1430 2.4E3 377.1359 3.8E3 395.1468 1.5E4 575.2087 2.7E4 END IONS BEGIN IONS FEATURE_ID=248 PEPMASS=540.1898 SCANS=248 RTINSECONDS=290.13 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 65.0384 2.0E4 65.7198 2.1E3 74.1560 2.6E3 74.2014 2.5E3 75.0439 5.6E4 77.0386 5.2E3 78.0464 2.0E4 78.1648 2.2E3 79.0539 1.0E4 85.0282 3.9E4 87.2583 2.3E3 89.0389 2.9E3 89.0595 3.4E4 91.0540 6.0E4 93.0333 3.8E5 93.0397 3.0E3 93.0697 5.5E4 95.0489 3.5E4 97.0648 1.9E4 103.0541 3.6E4 105.0443 5.8E3 105.0697 2.1E4 106.0335 4.0E3 106.0411 1.9E5 106.0493 3.4E3 107.0488 2.0E4 109.0651 5.8E3 115.7435 2.2E3 116.4240 2.3E3 117.0337 5.8E3 118.0414 5.8E3 119.0491 9.2E3 121.0646 3.9E5 121.0794 3.0E3 122.0722 2.5E3 123.0440 1.3E4 123.0798 6.4E3 125.0492 3.0E3 125.0595 2.3E5 131.0489 1.7E4 132.9416 2.5E3 133.0648 1.5E4 134.0362 3.0E4 135.0436 9.1E3 135.0799 6.1E3 137.0594 2.4E4 138.0675 3.3E3 139.0751 3.8E4 145.0282 3.6E4 148.0518 2.2E4 149.0595 1.3E6 149.0699 1.4E4 149.0736 6.7E3 149.0878 3.5E3 150.0664 7.6E3 151.0752 7.6E4 153.0544 2.1E4 153.0908 4.9E5 153.1021 2.4E3 159.0455 2.5E3 161.0595 1.7E4 163.0390 3.5E4 163.0752 4.0E4 165.0548 5.6E3 166.0624 1.6E4 167.0702 6.8E4 173.5252 2.2E4 173.5367 6.0E4 173.5442 1.0E4 177.0546 1.2E6 177.0908 3.2E3 179.0162 7.2E3 179.0697 2.7E3 181.0859 1.0E6 182.0935 6.0E3 184.4561 2.3E3 190.7348 2.7E3 191.0702 9.5E4 192.0780 1.7E4 193.0858 7.0E3 195.0655 1.2E4 207.0888 1.3E4 209.0808 1.6E6 210.0898 5.5E3 219.1015 2.0E4 223.0423 2.2E5 369.1328 2.1E4 460.1999 2.4E3 472.5041 3.0E3 537.8434 2.5E3 END IONS BEGIN IONS FEATURE_ID=249 PEPMASS=727.2078 SCANS=249 RTINSECONDS=290.144 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 3 (1 removed due to low quality, 0 removed due to low cosine). 69.0330 7.3E4 71.0487 1.4E5 71.7616 2.8E3 71.7643 1.1E4 73.0280 1.2E4 75.0438 7.0E3 76.4757 2.5E3 81.0332 1.1E4 83.0486 3.3E4 85.0279 3.1E5 85.0338 3.8E3 87.0435 4.9E4 91.0388 3.8E3 95.0489 5.7E3 95.1052 2.3E3 97.0279 1.3E5 99.0435 1.9E4 101.0230 3.2E3 109.0279 1.2E4 111.0435 2.2E4 113.0590 4.5E3 115.0384 6.5E4 117.0541 7.3E3 123.0440 2.8E3 123.8962 2.3E3 127.0384 3.2E4 129.0541 6.1E4 133.0491 2.2E4 137.0594 3.1E3 139.0379 2.4E3 145.0491 2.7E4 145.0615 3.2E3 149.0441 4.5E3 149.0578 2.9E3 151.0402 2.7E3 151.0756 3.4E3 153.0182 6.0E3 153.0539 8.8E3 171.0645 1.5E4 173.5216 2.4E4 173.5408 4.1E4 179.0691 2.9E3 225.0753 8.0E3 245.2788 2.5E3 248.2799 2.4E3 258.0529 2.5E3 261.0962 9.6E3 286.9793 2.2E4 286.9970 1.3E4 287.0549 3.3E6 287.1296 2.4E4 287.1505 5.2E3 299.0550 8.7E3 329.0663 1.6E4 353.0620 4.2E3 529.0477 2.8E3 612.7719 2.5E3 END IONS BEGIN IONS FEATURE_ID=250 PEPMASS=595.1658 SCANS=250 RTINSECONDS=290.341 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 69.3858 2.1E3 71.0487 3.1E4 77.3926 2.6E3 78.1976 2.1E3 80.4254 2.5E3 82.0217 2.2E3 85.0280 4.6E4 92.3404 2.7E3 95.2094 2.4E3 97.0281 4.0E3 129.0541 2.5E3 145.1802 2.4E3 153.5209 2.2E3 157.6064 2.5E3 165.3761 2.2E3 173.5236 8.2E3 173.5323 3.9E4 173.5435 3.2E3 174.1590 2.8E3 194.0182 2.4E3 223.0726 2.3E3 241.9687 2.4E3 287.0164 3.6E3 287.0551 4.0E5 287.0914 5.8E3 291.8618 2.4E3 312.9709 2.6E3 371.6186 2.5E3 409.0896 2.3E3 428.5607 2.3E3 481.5931 2.5E3 END IONS BEGIN IONS FEATURE_ID=251 PEPMASS=311.0669 SCANS=251 RTINSECONDS=290.468 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 51.3582 2.2E3 51.9028 2.3E3 55.0079 2.4E3 57.5655 2.3E3 57.6156 2.2E3 60.9288 2.6E3 64.0592 2.2E3 67.7854 2.3E3 70.8391 2.5E3 73.9189 2.3E3 78.4112 2.3E3 89.2111 2.0E3 94.9361 2.4E3 96.0440 1.7E4 105.0329 9.9E3 113.5761 3.0E3 120.0446 2.3E3 121.5870 2.1E3 122.0234 4.9E3 122.7671 2.4E3 137.8557 2.1E3 148.0389 5.1E4 170.0591 2.7E3 172.7013 2.3E3 173.5225 2.3E4 173.5408 3.7E4 174.8948 2.5E3 184.0758 3.7E3 185.0709 6.9E3 186.0557 4.1E3 194.0605 4.4E3 199.0865 1.7E4 209.0710 4.1E4 210.0552 5.6E4 211.0862 9.6E3 212.0702 6.4E3 213.0661 1.1E4 221.0717 7.5E3 222.0545 3.8E3 226.0486 2.5E3 227.0816 5.1E4 237.0659 9.2E4 238.0498 8.2E4 238.0740 8.4E3 239.0819 1.1E4 240.0668 3.5E3 241.0606 2.3E4 247.0501 8.9E3 247.6087 2.4E3 249.0658 4.5E3 250.0500 3.0E3 252.0287 2.8E3 254.0691 5.0E3 255.0763 5.0E4 264.0526 2.7E3 265.0607 1.0E5 266.0448 4.2E4 269.0559 5.9E4 282.0630 2.8E3 283.0715 6.4E4 293.0561 1.1E5 293.0937 3.2E3 294.0643 2.6E3 311.0055 2.7E3 311.0662 2.4E5 END IONS BEGIN IONS FEATURE_ID=252 PEPMASS=304.1912 SCANS=252 RTINSECONDS=292.33 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 5 (0 removed due to low quality, 0 removed due to low cosine). 49.1090 2.5E3 55.5680 2.5E3 66.9008 2.4E3 67.6467 2.1E3 68.0495 3.2E3 70.7195 2.2E3 75.3349 2.3E3 75.8285 2.3E3 82.8563 2.2E3 83.1621 2.6E3 86.9027 2.3E3 86.9531 2.1E3 107.0849 5.8E3 107.6262 2.1E3 110.0962 2.7E4 119.0490 3.6E3 124.3232 2.6E3 125.0959 3.8E3 126.3388 2.5E3 128.8492 2.8E3 137.0595 1.2E5 145.8230 2.5E3 147.0445 3.2E3 148.0620 2.5E3 152.9186 2.7E3 153.6396 2.5E3 164.0705 2.2E5 173.5248 7.5E3 173.5350 6.4E4 175.0388 4.4E3 180.8878 1.4E4 185.8264 2.6E3 190.8723 3.6E3 191.4848 2.5E3 202.0867 2.8E4 203.0940 1.0E4 204.1020 1.1E5 206.8910 2.5E3 207.0649 3.0E3 208.8831 5.8E4 223.1222 3.2E3 226.2115 3.4E3 226.7482 2.6E3 226.8936 2.8E4 227.1302 2.4E3 229.1223 4.4E3 230.1245 2.4E3 244.1342 1.4E4 246.1487 2.0E6 251.9019 2.5E3 252.2504 2.6E3 265.9460 2.7E3 304.1330 3.0E3 304.1514 5.3E3 304.1909 5.4E5 304.2293 5.4E3 END IONS BEGIN IONS FEATURE_ID=253 PEPMASS=382.7086 SCANS=253 RTINSECONDS=293.769 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 5 (0 removed due to low quality, 0 removed due to low cosine). 70.0284 1.3E4 70.0648 2.9E5 72.4092 2.2E3 74.8780 2.3E3 75.5402 2.1E3 77.5289 2.4E3 84.0805 3.0E3 86.0962 1.9E6 86.1010 8.2E3 87.0550 2.7E4 87.0788 1.8E4 87.0994 3.1E4 88.0391 2.4E4 91.0539 1.9E4 93.1626 2.6E3 97.0764 3.2E3 98.0598 3.0E4 99.0550 3.3E3 100.0872 2.5E3 100.8187 2.4E3 105.5171 2.2E3 106.2725 2.6E3 112.0865 1.5E5 113.0951 2.9E3 113.5868 2.4E4 114.6698 2.4E3 115.0498 9.3E4 115.0863 2.2E4 118.0647 6.1E4 119.0487 3.8E4 119.0721 4.3E3 120.0804 1.1E5 121.3742 2.1E3 123.0436 5.1E4 124.0869 5.1E3 125.0707 1.6E4 126.0551 8.1E3 129.1132 1.7E4 131.0493 5.7E3 132.0803 5.2E3 135.0675 7.1E4 136.0753 2.8E5 136.0875 3.4E3 138.1026 3.0E3 140.0817 3.4E4 144.0805 6.5E3 146.0465 5.3E3 146.0596 5.5E5 146.0959 3.0E4 147.0437 4.3E4 147.0629 1.3E4 151.1232 2.5E3 157.0944 3.4E3 157.1082 1.6E5 157.1331 3.7E4 161.1070 4.3E3 165.0544 2.8E5 165.1003 2.4E3 166.1335 3.5E3 167.1172 2.1E4 169.1010 2.1E4 171.4464 2.4E3 173.5236 3.4E4 173.5369 5.4E4 177.1054 2.8E4 178.1149 4.2E4 178.4772 2.4E3 182.0634 3.0E3 182.0810 1.8E5 183.0852 2.5E3 183.1122 4.1E4 183.1260 3.9E3 186.1137 3.2E3 189.1021 5.5E4 191.1054 2.9E4 192.1134 1.2E4 193.1443 3.1E3 194.1285 9.6E4 195.1126 3.4E5 195.1331 5.2E3 195.7613 2.3E3 196.1150 1.3E4 197.0962 3.6E3 200.1103 8.1E4 204.1384 5.9E4 209.1395 4.1E4 210.1489 4.6E3 217.0972 8.3E4 217.1337 4.4E4 220.1052 2.5E3 224.1072 1.7E4 226.1662 2.0E4 227.1742 2.4E4 228.1013 1.9E4 234.1241 4.0E4 236.0754 2.0E3 236.1072 6.9E3 236.1504 1.9E4 237.1345 1.6E5 238.1398 3.2E3 243.1129 2.4E4 250.1435 1.4E5 251.1473 2.6E3 253.1763 2.4E4 254.1608 8.7E5 254.1849 3.0E3 255.1632 2.8E4 263.1520 3.2E3 267.6459 9.5E3 270.1126 2.0E5 271.1154 1.1E4 271.1875 2.0E4 272.6440 2.3E3 276.1450 1.5E4 279.1779 2.7E3 280.1401 2.7E4 282.1131 2.5E4 286.1613 2.8E3 290.4149 2.3E3 293.1723 2.7E4 294.1581 3.5E3 296.1760 3.8E4 299.1391 5.2E3 306.1582 2.9E3 308.9036 2.9E3 311.1830 3.5E4 312.1825 2.7E3 314.1861 1.8E4 321.1703 3.3E3 322.1545 5.2E4 322.1917 3.3E3 324.6788 5.1E3 336.2146 3.6E4 337.1972 1.3E4 338.1965 1.6E4 339.1841 3.2E3 340.1648 1.6E4 340.6590 2.5E3 346.4861 2.6E3 352.2083 2.7E3 354.2244 1.3E5 355.2240 8.4E4 356.2085 1.2E5 360.0291 2.6E4 364.2098 3.7E4 365.2072 1.0E4 368.7119 2.6E3 372.2247 4.7E3 373.2348 4.0E5 373.2875 2.8E3 374.2374 3.5E4 381.2036 9.1E4 382.1797 6.7E3 382.2213 4.1E4 383.2145 4.0E3 390.2503 6.6E3 396.1913 8.3E3 398.2300 1.4E4 399.2143 3.0E5 399.2664 4.2E3 400.2173 2.4E4 407.2251 3.0E3 411.2040 2.6E3 420.6791 2.8E3 424.2464 5.0E4 425.2312 4.5E4 426.2625 2.8E3 442.2561 1.7E5 443.2616 2.0E4 448.6555 2.9E3 449.2996 3.8E4 452.2416 2.5E3 467.2336 2.6E3 469.2697 3.2E3 470.2519 7.2E4 471.2539 4.6E3 487.2775 7.6E3 513.1528 2.7E3 521.2392 1.3E4 529.4775 2.6E3 534.2804 1.1E4 535.2660 1.6E4 555.3393 9.6E3 561.2832 4.0E3 562.2755 3.5E3 562.2938 2.8E3 563.2618 6.9E3 577.3236 1.2E4 578.3096 5.2E4 579.3113 2.6E4 579.3307 3.3E3 580.2881 8.4E4 605.3172 2.0E4 606.3039 7.0E4 607.3149 3.2E3 623.2127 8.8E3 623.3295 4.6E5 623.4186 2.0E3 624.3324 6.0E4 651.3256 4.5E4 END IONS BEGIN IONS FEATURE_ID=254 PEPMASS=300.1599 SCANS=254 RTINSECONDS=294.82 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 2 (0 removed due to low quality, 0 removed due to low cosine). 50.0160 3.8E3 51.0233 6.3E3 53.7117 4.0E3 54.6930 4.1E3 58.0650 1.5E4 77.0388 2.6E4 79.0541 4.2E4 91.0540 2.3E4 92.2929 5.2E3 93.0700 1.7E4 95.0490 6.7E4 103.0543 1.7E4 105.0446 2.1E4 105.0696 2.7E4 105.1679 5.3E3 107.0318 7.1E4 107.0354 2.5E4 107.0490 1.3E7 107.0641 1.9E5 107.0661 5.8E4 107.0712 2.2E4 107.0756 1.3E4 115.0542 2.3E4 117.0697 1.6E5 119.0489 1.8E4 121.0647 2.7E5 124.0516 3.7E4 125.1052 5.0E3 128.0617 1.5E4 129.0697 6.4E4 130.0764 4.7E3 131.0490 4.3E4 131.0856 1.3E4 133.0646 4.1E4 135.0805 7.6E3 136.0518 1.3E5 137.0594 2.7E4 139.0751 3.8E4 143.0493 2.1E4 144.0568 4.5E4 145.0646 1.7E6 145.0751 1.2E4 145.0913 8.5E3 146.0726 5.8E4 147.0804 2.8E4 150.0674 7.6E4 151.0752 1.3E6 151.0867 9.4E3 155.0601 7.0E4 157.0643 1.7E4 158.0725 5.1E5 158.0874 9.6E3 159.0440 5.3E4 159.0805 9.8E4 160.0517 6.2E3 161.0597 5.5E4 161.0956 8.1E3 161.2738 5.3E3 162.0677 2.8E4 163.0753 2.1E4 164.0824 6.5E3 165.0910 3.9E5 173.0604 5.9E3 173.5310 3.1E4 173.5391 1.6E4 174.0675 1.0E6 174.0932 1.5E4 175.0755 5.5E4 175.0988 1.1E4 176.0660 8.2E3 176.0832 2.6E5 177.0733 9.5E3 177.0910 5.0E5 177.1049 3.2E3 178.0868 1.8E4 180.1020 1.5E4 189.0508 1.2E4 189.0909 3.0E6 190.0817 5.5E3 190.0987 9.6E4 192.1018 1.2E5 195.0789 4.6E3 207.0801 1.7E4 208.0876 5.1E3 209.0956 2.2E4 219.0806 2.8E4 220.0879 2.2E4 221.0959 5.2E4 223.1122 2.4E4 224.0836 3.1E4 224.1201 5.3E3 225.0914 2.4E4 226.0978 9.5E3 235.0735 7.5E3 235.1125 6.0E3 236.0830 4.0E4 237.0908 2.1E5 239.0702 2.4E4 239.1059 2.8E4 240.1148 1.5E4 246.7426 5.0E3 251.1065 1.1E5 252.1143 2.0E6 252.1758 1.4E4 253.0854 1.1E5 254.0933 1.1E5 255.1015 4.4E4 255.1337 5.2E3 268.1092 1.3E6 271.1332 4.9E3 281.1175 2.3E4 283.1329 1.5E6 300.1589 5.2E4 END IONS BEGIN IONS FEATURE_ID=255 PEPMASS=376.2123 SCANS=255 RTINSECONDS=295.33 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 55.5355 2.2E3 58.0651 1.5E5 59.0730 1.0E4 59.6842 2.1E3 62.9386 2.1E3 65.3128 2.2E3 69.0828 2.3E3 71.3375 2.2E3 71.5228 2.3E3 81.2259 2.9E3 96.7174 2.6E3 98.8909 2.7E3 103.8979 2.2E3 107.0493 2.8E3 109.3048 2.6E3 118.0849 2.5E3 131.1086 2.1E3 135.0810 4.1E3 142.6030 2.1E3 147.0805 1.4E4 148.8088 2.3E3 163.0755 8.3E4 164.0833 6.3E5 164.0994 4.7E3 173.5230 6.1E3 173.5389 3.5E4 176.0840 4.4E3 177.0912 1.4E5 178.0840 1.1E4 178.0990 1.2E6 191.1068 3.6E4 191.8434 2.2E3 192.1146 2.7E5 197.0675 2.4E3 209.1413 5.9E4 222.1300 7.0E3 222.1491 1.1E6 229.9272 3.0E3 236.1643 2.5E4 237.1434 9.3E3 237.1515 8.4E3 237.1725 8.5E5 272.4490 2.7E3 284.1412 1.3E4 298.6677 2.4E3 306.5042 2.3E3 318.2376 2.9E3 321.5779 2.4E3 329.4851 3.2E3 343.2145 2.4E4 348.1642 2.7E3 END IONS BEGIN IONS FEATURE_ID=256 PEPMASS=492.2597 SCANS=256 RTINSECONDS=296.387 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 58.0620 4.2E3 58.0648 1.6E5 60.2525 2.2E3 60.6283 2.3E3 61.0283 7.3E3 61.4871 2.1E3 69.0332 3.7E4 71.0489 5.4E3 72.6657 2.3E3 74.9794 2.4E3 79.0463 2.7E3 81.0334 4.0E3 85.0281 1.2E5 87.0439 1.6E4 89.4731 2.1E3 91.0389 3.3E3 91.0539 3.2E3 91.5527 2.2E3 93.0699 3.2E3 95.0482 3.7E3 97.0282 3.0E4 99.0436 1.2E4 101.0230 3.2E3 103.0383 2.6E3 107.0488 4.7E4 108.8763 2.3E3 109.0280 1.6E4 117.6350 2.4E3 119.0488 1.6E4 119.0851 3.2E3 121.0645 3.6E5 121.0743 7.7E3 123.0804 4.1E3 124.0516 3.5E3 125.0595 1.2E4 127.0385 3.3E4 128.5908 2.3E3 129.0699 2.6E3 133.0646 2.7E4 135.0802 2.8E4 137.0593 1.6E4 139.0750 2.8E4 141.0906 7.1E3 145.0504 1.3E4 145.0644 4.6E4 147.0801 2.2E5 149.0590 9.1E3 149.0954 1.1E4 150.0674 3.0E3 150.8086 2.3E3 151.0751 1.2E5 152.0833 6.3E3 159.0802 2.1E4 161.0958 3.5E4 163.0752 1.6E5 165.0908 2.7E5 167.1067 1.1E4 171.0802 2.4E3 173.0954 1.2E4 173.5189 5.6E3 173.5284 2.0E4 173.5369 5.1E4 176.0831 2.6E3 177.0908 4.4E4 179.0137 2.5E3 179.1065 1.6E4 183.0809 6.8E3 189.0905 2.8E3 191.1064 8.3E4 197.0961 2.2E4 225.0916 1.9E4 225.1272 9.6E4 235.1112 3.0E3 238.0997 7.8E3 253.1219 1.3E5 254.1295 1.8E4 256.1091 3.6E4 257.1178 6.9E3 257.1523 1.6E4 267.1376 1.6E4 270.1248 1.3E5 271.1334 2.5E3 283.1326 1.1E4 285.1109 4.5E3 285.1485 1.2E6 309.1484 2.0E4 327.1590 3.5E4 330.2062 6.7E4 330.2427 3.1E3 378.9906 2.4E3 492.2596 1.9E5 END IONS BEGIN IONS FEATURE_ID=257 PEPMASS=506.2754 SCANS=257 RTINSECONDS=297.762 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 61.0284 2.9E3 67.1473 2.2E3 69.0334 4.1E4 73.0285 3.0E3 75.0439 3.3E3 77.9230 2.3E3 81.0333 1.3E4 85.0282 1.2E5 87.0438 1.4E4 89.7382 2.4E3 91.0539 3.9E3 95.0488 3.9E3 95.8373 2.6E3 97.0282 3.3E4 99.0440 1.0E4 101.0602 3.2E3 104.7293 2.2E3 107.0491 5.2E4 108.2462 2.1E3 109.0283 2.0E4 109.3770 2.7E3 111.0437 2.4E3 117.0343 2.5E3 119.0488 2.6E4 119.0856 7.7E3 121.0554 3.3E3 121.0646 4.6E5 121.0729 2.0E3 123.0806 5.6E3 125.0596 1.5E4 127.0388 3.6E4 131.0480 3.0E3 133.0646 4.6E4 135.0439 2.7E3 135.0803 3.3E4 137.0598 1.2E4 139.0753 3.8E4 141.0910 6.3E3 145.0514 9.8E3 145.0646 5.1E4 147.0802 2.7E5 149.0598 1.4E4 149.0961 7.8E3 151.0752 1.5E5 152.0831 7.7E3 159.0803 2.4E4 160.0880 3.0E3 161.0959 4.6E4 163.0609 3.8E3 163.0753 1.7E5 164.0853 2.9E3 165.0770 2.0E3 165.0909 3.1E5 167.1066 1.2E4 171.0800 3.2E3 173.0960 1.1E4 173.5245 2.5E4 173.5408 4.4E4 177.0745 3.9E3 177.0910 5.0E4 179.1066 1.3E4 182.4962 2.4E3 183.0798 8.3E3 189.0906 1.0E4 190.8822 2.5E3 191.1065 1.0E5 196.0877 2.7E3 197.0957 1.8E4 206.4604 2.5E3 207.6468 2.2E3 210.7933 2.5E3 211.1134 3.0E3 219.5987 2.2E3 224.0823 3.8E3 225.0905 1.4E4 225.1273 1.2E5 235.1121 8.1E3 238.0985 1.2E4 240.8580 2.6E3 243.1366 2.5E3 244.7525 2.5E3 253.1218 1.6E5 254.1301 1.8E4 256.1092 4.0E4 257.1176 5.6E3 257.1528 1.2E4 267.1375 2.0E4 270.1251 1.7E5 271.1338 2.6E3 277.1213 2.4E3 283.1334 1.6E4 285.1209 6.9E3 285.1486 1.7E6 292.9128 2.5E3 309.1488 2.4E4 310.7870 2.7E3 327.1587 4.3E4 342.4223 2.4E3 344.2180 2.8E3 398.8828 2.7E3 433.1512 2.6E3 437.9278 2.9E3 449.5094 2.6E3 506.2740 1.7E5 511.6328 2.2E3 END IONS BEGIN IONS FEATURE_ID=258 PEPMASS=757.2191 SCANS=258 RTINSECONDS=298.319 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 71.0487 5.2E4 74.6841 2.5E3 80.4236 2.4E3 81.0333 6.2E3 83.0487 1.7E4 84.4645 2.2E3 85.0279 1.2E5 85.0340 2.5E3 85.2947 2.3E3 87.0435 1.7E4 90.2781 2.3E3 96.0698 2.2E3 97.0279 4.5E4 99.0439 3.2E3 102.8118 2.5E3 103.1862 2.4E3 107.8844 2.3E3 111.0437 1.3E4 115.0385 2.6E4 115.0473 2.3E3 126.7485 2.4E3 127.0387 1.1E4 129.0542 2.0E4 133.0491 3.7E3 134.6731 2.4E3 145.0491 2.8E3 151.0377 2.3E3 152.1196 2.3E3 173.5238 2.4E4 173.5330 2.4E4 173.5428 1.3E4 218.5570 2.5E3 221.7879 2.8E3 227.5480 2.7E3 230.0829 2.5E3 245.3090 2.3E3 280.7780 2.7E3 285.0399 2.8E3 287.0553 3.2E4 302.0432 1.7E4 317.0654 1.6E6 359.0744 1.3E4 538.5103 2.5E3 650.4453 2.8E3 END IONS BEGIN IONS FEATURE_ID=259 PEPMASS=579.1508 SCANS=259 RTINSECONDS=299.139 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 6 (1 removed due to low quality, 0 removed due to low cosine). 64.5334 2.3E3 64.7230 2.2E3 68.9270 2.5E3 69.4317 2.1E3 71.4262 2.5E3 72.5012 2.6E3 73.9860 2.3E3 76.7417 2.5E3 78.4298 2.3E3 81.7393 2.9E3 84.9374 2.5E3 88.2515 2.5E3 88.9675 2.5E3 89.1601 2.7E3 90.4430 2.4E3 90.5051 2.5E3 92.1054 2.5E3 109.3130 2.3E3 117.3584 2.4E3 119.0481 3.0E3 119.2661 2.2E3 123.0337 1.5E4 123.0435 6.1E5 123.0547 3.4E3 127.0282 7.6E3 127.0385 5.1E5 127.0498 6.5E3 128.1241 2.1E3 128.6396 2.4E3 135.0436 9.1E4 139.0273 4.2E3 139.0385 2.7E5 139.0510 3.1E3 142.8467 2.1E3 146.8519 2.6E3 147.0436 7.0E4 151.0385 3.9E4 154.9769 2.3E3 160.7628 2.2E3 161.0594 1.6E4 161.4562 2.8E3 162.2250 3.9E3 163.0386 2.7E5 163.3798 2.6E3 165.0542 9.3E4 167.0337 3.6E4 169.0494 2.5E3 169.5035 2.5E3 169.8833 2.5E3 173.5208 7.2E3 173.5291 6.1E4 173.5406 3.3E4 177.0540 1.4E4 179.0335 2.2E4 180.5844 2.2E3 181.0196 2.5E3 181.0495 1.7E4 187.0386 2.7E4 191.0336 3.1E4 193.0491 1.1E4 195.2999 3.1E3 197.1178 2.4E3 201.0540 1.1E4 203.0333 3.1E4 203.0702 7.5E3 205.0493 1.9E4 207.0650 2.2E4 215.0691 2.5E3 217.0492 2.7E3 229.0492 3.2E4 229.1847 3.0E3 231.0663 2.6E3 232.0892 2.8E3 233.0443 2.7E4 243.0651 4.3E4 245.0442 1.1E5 247.0597 1.5E5 255.0648 2.0E4 257.0441 1.0E5 259.0598 4.1E4 261.0759 3.1E3 267.9466 2.4E3 269.0444 2.1E4 271.0600 1.6E5 273.0767 1.2E4 275.0551 1.5E5 283.0602 9.6E4 285.0758 2.5E4 287.0551 5.3E5 291.0857 1.8E4 295.0614 2.7E3 299.0552 1.3E5 301.0717 4.0E4 303.0867 6.4E3 311.0542 2.7E3 363.2834 2.9E3 391.0811 7.2E3 391.3152 2.8E3 400.7737 2.9E3 409.0921 2.6E5 411.1061 7.8E3 421.0937 7.2E3 433.0919 2.8E3 435.1074 1.3E4 451.3876 2.4E3 END IONS BEGIN IONS FEATURE_ID=260 PEPMASS=346.2017 SCANS=260 RTINSECONDS=299.299 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 50.6910 2.4E3 52.0444 2.7E3 52.0546 2.3E3 54.3073 2.0E3 56.0349 2.3E3 57.8345 2.5E3 60.0808 2.1E4 64.4422 2.2E3 69.7594 2.3E3 80.9905 2.4E3 81.0699 2.5E3 81.2363 2.3E3 91.0483 3.2E3 91.0542 1.2E5 95.0491 3.9E4 101.0146 2.5E3 101.2231 2.5E3 107.0491 5.0E4 107.2053 2.3E3 109.0648 2.2E4 111.0440 2.5E4 116.0313 2.3E3 117.0698 1.5E5 119.0491 1.2E5 119.0863 2.9E3 121.0648 3.8E4 123.0350 4.3E3 123.0439 1.8E5 124.1290 2.4E3 125.0597 3.2E4 126.1409 2.1E3 131.0491 3.9E4 133.0648 5.1E4 135.0440 2.0E5 135.0559 3.4E3 135.0807 1.9E4 136.0513 3.7E3 137.0596 2.5E6 137.0840 5.6E3 138.0684 5.8E3 139.0749 2.5E3 143.0492 1.6E4 145.0514 9.1E3 145.0647 4.3E5 145.0747 2.6E3 146.0728 6.1E3 147.0442 1.2E4 147.0802 1.6E4 149.0231 1.1E4 149.0596 2.8E5 149.0738 3.1E3 149.0965 8.2E3 150.0675 4.8E4 151.0629 1.0E4 151.0753 1.1E6 151.0957 2.9E3 152.0831 1.6E4 153.0552 1.2E4 153.0910 7.1E3 157.0638 3.8E3 159.0798 3.7E3 160.4205 2.6E3 161.0596 5.1E4 162.0675 1.3E4 163.0590 3.4E3 163.0754 6.2E5 163.0910 6.4E3 164.0813 6.6E3 165.0911 9.5E4 173.0607 2.8E3 173.5289 5.1E4 173.5408 2.1E4 175.0753 1.4E4 177.0734 4.9E3 177.0911 7.7E5 178.0993 1.9E4 181.0649 2.1E4 181.1012 5.8E4 187.0742 5.5E3 190.1088 2.5E3 191.0859 2.2E4 194.0727 7.1E3 195.0806 2.6E4 198.0675 9.7E3 199.0749 2.2E4 199.1129 3.1E3 209.0607 1.5E4 209.0962 2.7E5 209.1180 5.1E3 211.0708 2.4E3 212.0847 4.1E3 213.0910 1.6E4 219.0804 3.8E4 222.0687 2.9E3 223.1120 2.4E4 226.0623 4.0E4 226.0983 3.0E3 226.7343 2.6E3 227.0692 3.5E4 227.1068 5.0E5 230.3000 2.5E3 237.0910 3.1E5 240.0781 3.5E4 241.0905 3.6E3 241.1223 1.8E5 251.1065 2.8E4 254.0940 3.2E3 255.0701 2.8E3 255.1015 5.2E5 255.1325 1.1E4 258.0884 1.0E5 259.0999 3.1E3 259.1328 2.2E4 269.1172 1.7E5 287.0896 3.4E3 287.1279 7.5E5 302.7144 3.1E3 346.2008 6.7E4 END IONS BEGIN IONS FEATURE_ID=261 PEPMASS=404.1558 SCANS=261 RTINSECONDS=303.599 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 6 (0 removed due to low quality, 0 removed due to low cosine). 57.0332 5.9E4 59.5287 2.4E3 60.7301 2.2E3 61.8211 2.6E3 63.5819 2.1E3 64.1598 2.5E3 64.9778 2.3E3 66.1941 2.3E3 67.0247 2.7E3 67.4449 2.5E3 71.9586 2.4E3 73.0280 9.1E3 73.4315 2.4E3 75.0437 7.2E4 75.4233 2.5E3 76.7274 2.4E3 85.0280 6.6E4 87.9058 2.3E3 88.3413 2.5E3 91.0539 2.3E6 91.0619 1.6E4 91.0639 8.2E3 94.7177 2.3E3 95.0125 1.7E4 96.5839 2.7E3 101.0688 2.6E3 103.0391 2.8E3 113.0231 3.1E4 118.0864 3.7E3 119.0488 2.5E4 121.9829 2.5E3 122.5374 2.5E3 122.9603 2.4E3 129.1658 2.3E3 131.0334 2.9E4 137.0481 3.5E3 137.0594 2.7E5 137.0714 4.1E3 141.0179 1.9E5 144.9818 2.7E3 145.0211 2.2E3 159.0288 1.2E4 162.5924 2.5E3 165.0707 2.3E3 169.6627 2.3E3 173.5235 1.5E4 173.5331 1.0E5 173.5429 2.2E4 174.8128 2.6E3 181.0115 2.7E3 188.6071 2.7E3 193.0654 1.4E4 193.0859 1.3E6 193.1066 1.6E4 193.4340 2.3E3 202.5440 2.8E3 211.0970 9.8E3 252.1297 2.4E3 255.4798 2.5E3 261.5240 2.3E3 331.1441 2.8E3 347.6565 2.4E3 359.9490 2.3E3 380.4065 2.4E3 386.5981 2.5E3 409.9354 2.3E3 END IONS BEGIN IONS FEATURE_ID=262 PEPMASS=684.2505 SCANS=262 RTINSECONDS=303.674 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 2 (0 removed due to low quality, 0 removed due to low cosine). 67.3394 2.5E3 69.0331 3.7E4 71.0254 2.6E3 78.8587 2.4E3 79.2661 2.2E3 83.0484 2.2E3 85.0281 3.0E4 87.0386 2.9E3 87.0436 4.6E4 97.0225 3.4E3 97.0280 5.2E4 114.4094 2.5E3 115.0385 5.8E4 119.7259 2.5E3 127.0389 2.6E3 131.2959 3.1E3 133.0490 2.6E4 137.0479 4.9E3 137.0593 2.2E5 146.8815 2.4E3 150.0758 7.7E3 161.0602 3.8E3 173.5273 5.0E4 173.5447 9.3E3 175.0755 8.3E3 189.0541 2.6E3 194.7145 2.9E3 201.0546 1.6E4 203.0712 3.4E3 207.0651 2.6E4 219.0647 1.3E4 228.3723 2.4E3 231.0639 9.4E3 237.0896 3.7E3 265.0856 2.5E4 277.0855 4.8E3 279.1017 3.0E3 283.0961 5.7E3 293.0809 4.0E4 293.8405 2.4E3 297.1123 2.3E4 305.0795 1.3E4 307.0968 6.0E4 309.1122 8.7E3 311.0887 4.7E3 323.0908 5.6E3 325.1073 1.5E5 337.1066 2.6E4 343.1176 3.6E4 355.1169 5.3E3 363.5962 2.6E3 END IONS BEGIN IONS FEATURE_ID=263 PEPMASS=621.1796 SCANS=263 RTINSECONDS=304.936 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 65.2057 2.5E3 67.0423 2.4E3 68.6571 2.2E3 71.1145 2.4E3 71.3085 2.3E3 76.2461 2.3E3 84.5222 2.3E3 84.7049 2.2E3 92.7811 2.2E3 93.1090 2.3E3 97.6644 2.1E3 100.4420 2.4E3 115.3398 3.1E3 115.6548 2.3E3 122.6011 2.5E3 126.4182 2.4E3 131.5866 2.4E3 141.1395 2.3E3 143.0307 6.0E3 149.6896 5.2E3 173.5267 6.0E4 173.5422 2.2E4 181.6407 2.7E3 217.2791 2.5E3 221.0806 7.5E3 253.7471 2.5E3 275.5473 2.5E3 293.2797 2.3E3 361.0246 5.4E4 375.0780 2.8E3 381.0954 1.6E4 404.0193 3.0E3 411.1065 1.7E4 435.1054 9.9E3 441.1170 2.7E4 446.6597 2.6E3 453.1154 1.6E4 459.1241 6.1E3 465.1172 2.1E4 471.1251 5.5E3 477.1138 4.1E3 483.1266 9.1E4 495.1273 3.0E4 501.1363 9.5E4 507.1269 8.0E3 513.1369 1.2E5 519.1260 3.4E3 525.1372 1.2E4 531.1469 5.7E4 549.1383 2.9E4 567.1479 7.1E4 585.1584 1.3E5 603.1687 1.6E5 621.1791 6.0E4 END IONS BEGIN IONS FEATURE_ID=264 PEPMASS=599.1978 SCANS=264 RTINSECONDS=305.044 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 9 (3 removed due to low quality, 0 removed due to low cosine). 68.1481 2.3E3 69.0334 5.8E3 70.4862 5.9E3 75.8130 5.7E3 77.0385 6.0E3 78.0627 6.2E3 81.0333 3.2E4 81.4632 6.5E3 85.0282 2.7E5 86.4127 7.9E3 92.3029 2.3E3 95.0490 2.4E4 97.0283 5.7E4 98.4621 2.4E3 99.4506 2.7E3 99.8086 2.2E3 101.2828 3.4E3 103.0386 5.8E4 103.3931 6.2E3 107.0490 6.1E6 107.0552 3.2E4 107.0660 1.8E4 109.0281 3.8E4 111.1629 2.7E3 111.3515 3.2E3 113.3262 3.2E3 114.0319 3.3E3 121.0281 3.3E4 121.0647 4.8E4 122.2125 5.8E3 127.0393 6.9E3 129.0539 2.4E3 131.0492 4.7E4 131.3712 3.8E3 134.8061 3.8E3 135.1676 2.1E3 136.2624 3.3E3 139.0385 4.5E4 147.0436 2.7E4 148.9082 5.5E3 149.0595 9.5E4 151.0078 5.7E3 151.0388 8.3E4 152.4178 2.7E3 157.1159 2.6E3 163.0388 1.6E5 173.0593 4.9E4 173.5212 7.7E3 173.5348 2.2E5 175.0389 1.6E5 177.0553 3.7E3 179.0320 7.5E3 181.0494 1.3E5 181.3842 5.8E3 183.7405 3.1E3 187.0385 2.2E4 189.0548 3.9E4 189.8228 2.3E3 191.0337 9.8E4 193.0495 2.2E5 199.0390 2.7E3 200.8620 2.9E3 201.0545 1.9E4 201.2798 6.0E3 203.0334 2.2E4 205.0495 4.6E5 205.0712 4.5E3 207.0654 1.8E4 211.0602 5.8E4 213.0548 1.8E4 215.0343 3.3E3 215.0691 3.5E3 217.0496 6.4E5 219.0289 9.0E4 219.0653 6.8E4 221.0446 1.7E5 223.0602 2.1E5 229.0495 1.2E5 231.0284 2.7E4 231.0654 1.3E5 233.0444 9.0E4 235.0330 3.8E3 235.0600 8.1E5 235.0880 4.7E3 241.0497 8.7E4 243.0656 7.6E4 245.0452 5.0E4 245.0804 4.5E4 247.0303 4.8E3 247.0599 7.2E5 249.0404 1.8E4 249.0745 2.4E4 253.0467 7.6E3 255.0651 6.8E4 257.0444 5.9E4 259.0284 1.8E4 259.0598 1.1E6 261.0404 1.5E4 261.0759 4.2E4 263.0549 4.6E3 264.1731 3.0E3 265.0708 5.2E4 267.0651 7.0E3 269.0443 3.9E4 269.0806 1.3E4 271.0601 4.3E5 273.0430 1.6E4 273.0756 2.3E5 275.0561 5.1E4 275.0887 2.7E4 277.0708 6.7E5 279.0649 4.2E3 281.0814 1.2E4 283.0601 2.6E5 285.0762 1.2E5 287.0551 1.0E5 287.0916 3.3E5 289.0707 5.7E5 293.0806 3.2E4 295.0580 2.6E4 295.6570 6.3E3 297.0753 1.1E5 299.0551 6.4E4 299.0917 3.8E5 301.0400 2.0E3 301.0708 1.1E6 301.1034 2.4E3 305.0721 3.2E4 307.0127 2.4E3 307.0819 9.8E4 309.0762 2.5E4 311.0551 5.1E4 311.0916 4.1E5 313.0707 5.6E5 313.1101 3.0E3 315.0866 8.2E4 317.1025 1.1E5 319.0816 2.2E5 323.0911 1.7E5 325.0707 4.2E5 325.1079 2.7E4 327.0864 3.2E5 329.0602 1.8E4 329.0684 5.4E3 329.1020 8.1E5 329.1466 9.8E3 329.2567 2.5E3 331.0813 7.1E4 335.0890 7.5E4 337.0695 5.4E4 337.1058 2.1E4 339.0864 6.2E4 341.0597 2.6E4 341.1017 5.7E5 341.1494 3.9E3 343.0813 3.5E5 347.0897 8.5E4 349.1080 7.5E3 353.0514 1.8E4 353.1016 1.7E6 353.1378 3.8E3 353.1525 3.0E4 355.0809 2.5E5 357.1011 8.2E3 359.0905 4.0E4 361.0939 1.2E5 363.0874 9.3E3 365.0481 1.6E4 365.1015 1.2E6 365.1554 1.6E4 367.0805 1.1E5 367.1247 9.1E3 371.0917 1.7E4 371.1018 6.9E3 373.0933 7.3E4 376.1688 3.7E3 377.0510 4.7E3 377.1020 5.1E5 379.1181 7.6E4 381.0966 5.4E4 383.1125 7.6E5 383.1563 2.5E3 385.0932 8.9E4 389.1018 3.5E5 391.1167 6.1E4 393.0968 1.1E5 393.1494 3.0E3 395.1125 1.7E6 401.1037 8.6E4 403.1133 8.8E4 407.0497 7.8E3 407.1126 9.8E5 407.1752 1.3E4 407.2050 4.0E3 411.1074 4.9E4 413.1217 3.7E5 415.1170 1.4E4 417.1353 3.5E3 419.1125 1.4E6 419.1627 2.4E3 421.1270 2.6E4 425.1224 1.5E5 429.1179 7.7E4 431.1166 9.8E5 433.1287 5.0E4 437.1212 2.9E4 443.1149 1.7E5 443.1994 2.5E3 445.1279 4.0E4 449.1225 3.3E5 451.1466 7.8E3 455.1147 2.3E4 461.0519 4.2E3 461.1225 6.6E5 467.1336 6.4E4 473.1221 2.3E5 479.1329 5.0E5 491.1323 1.7E5 497.1433 1.7E5 509.1437 5.7E4 604.9941 6.8E3 END IONS BEGIN IONS FEATURE_ID=265 PEPMASS=581.1872 SCANS=265 RTINSECONDS=305.053 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 6 (0 removed due to low quality, 0 removed due to low cosine). 71.7801 2.6E3 72.0451 2.4E3 73.2672 2.3E3 73.8738 2.3E3 74.0476 2.4E3 81.7473 2.6E3 83.7268 2.4E3 85.0281 2.0E4 87.3452 2.2E3 92.7359 2.3E3 96.7407 2.2E3 102.2610 2.2E3 103.0605 2.1E3 103.5769 2.3E3 104.1714 2.4E3 107.0406 5.7E3 107.0488 4.3E5 107.0575 3.1E3 123.0447 2.2E3 124.6011 2.4E3 124.6993 2.5E3 124.8311 2.2E3 133.3443 2.1E3 143.2304 2.3E3 143.6573 2.6E3 147.5483 2.5E3 149.0584 2.6E3 163.0385 7.4E3 173.5216 3.1E4 173.5379 1.1E5 180.5816 2.5E3 181.0510 2.7E3 182.7401 2.9E3 193.0496 8.9E3 205.0495 3.2E4 217.0496 3.5E4 217.0943 2.2E3 221.0457 4.2E3 229.4624 2.3E3 231.0297 2.3E3 231.0652 5.4E3 235.0602 3.7E4 238.3455 2.5E3 240.3257 2.2E3 243.0665 5.2E3 247.0601 5.9E4 259.0598 8.3E4 267.3020 2.6E3 271.0603 3.0E4 273.0765 7.4E3 277.0720 3.3E4 283.0593 2.1E4 285.0772 3.1E3 287.0551 3.7E4 287.0909 2.9E4 289.0707 4.1E4 299.0568 2.7E3 299.0913 3.5E4 301.0710 9.0E4 311.0919 1.9E4 313.0713 4.5E4 313.6718 2.6E3 319.0798 6.7E3 323.0916 3.8E3 325.0708 3.8E4 327.0860 2.1E4 329.1024 5.5E4 331.0854 2.5E3 341.1022 1.5E4 343.0815 2.6E4 351.9348 2.5E3 353.1020 1.9E5 353.1517 2.9E3 355.0807 1.9E4 355.8544 2.7E3 361.0920 6.5E3 365.1024 1.1E5 367.0804 4.5E3 377.1014 4.2E4 378.0494 2.4E3 383.1131 5.4E4 389.1024 1.6E4 393.0987 4.0E3 395.1130 1.5E5 403.1172 3.5E3 407.1134 8.5E4 413.1228 3.7E4 419.1131 1.4E5 425.1252 9.7E3 426.4299 2.9E3 429.1169 3.0E3 431.1180 9.6E4 434.1702 2.9E3 443.1172 6.6E3 449.1229 3.0E4 451.1375 2.6E3 455.1845 2.7E3 461.1231 7.1E4 467.1344 6.5E3 473.1227 1.2E4 479.1344 4.7E4 491.1343 2.5E4 492.4137 2.9E3 497.1477 4.4E3 END IONS BEGIN IONS FEATURE_ID=266 PEPMASS=300.1599 SCANS=266 RTINSECONDS=305.828 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 12 (8 removed due to low quality, 0 removed due to low cosine). 48.2553 2.9E3 48.8147 6.9E3 49.0589 2.8E3 50.0221 2.3E3 50.2226 2.4E3 50.7781 2.7E3 55.0179 1.1E4 55.7830 2.7E3 58.0651 3.8E4 58.9642 2.2E3 65.7005 2.3E3 67.2773 3.2E3 69.1087 2.5E3 70.9332 2.2E3 77.0389 8.3E3 79.0541 2.2E4 82.6469 2.3E3 91.0541 5.8E4 93.0698 4.3E4 95.0490 6.1E4 103.0541 2.5E4 104.7223 2.2E3 107.0319 4.3E4 107.0490 9.0E6 107.0575 8.8E4 107.0659 2.4E4 107.0661 8.6E4 107.0723 1.5E4 109.0648 1.7E4 109.7845 2.4E3 113.9178 4.1E3 115.0452 3.0E3 115.0541 3.9E5 117.0698 7.3E4 119.0489 7.9E4 121.0282 8.6E4 121.0646 8.2E5 121.0735 1.1E4 125.0593 1.3E4 129.0699 1.7E4 130.9489 2.7E3 131.0490 1.1E5 133.0647 4.0E4 135.0792 2.6E3 137.0595 1.0E6 137.0696 2.8E3 137.1509 2.4E3 143.0490 1.8E6 143.0604 1.9E4 144.0567 2.4E4 145.0646 1.0E6 145.0745 6.0E3 145.0783 1.9E4 146.0964 2.6E4 147.0803 8.2E4 148.0750 3.8E3 149.0597 6.2E4 149.0836 3.0E3 151.0752 1.6E5 153.0703 3.7E3 155.0602 1.9E4 157.0646 4.5E4 160.0518 5.3E4 161.0596 5.1E4 161.0832 2.8E3 162.0676 3.4E4 162.0912 8.4E4 163.0752 1.6E5 166.0775 1.2E4 167.0851 7.8E3 168.9931 4.2E3 173.5252 3.5E4 173.5426 3.8E4 174.0915 3.4E4 175.0575 1.6E4 175.0753 1.0E6 175.0990 1.4E4 176.0834 2.4E4 177.0768 1.2E4 177.0911 9.5E4 178.0862 1.2E5 179.0937 3.2E4 180.0839 3.8E3 180.1019 2.6E5 180.9287 2.4E3 181.0645 4.9E4 181.1011 6.4E4 182.0738 2.6E3 183.0801 1.2E4 189.0907 2.2E4 191.0862 9.3E4 192.0812 1.7E4 192.1018 9.8E5 192.1221 3.8E3 193.1091 2.4E4 194.0726 8.5E4 194.1178 1.4E4 195.0805 4.4E4 197.0611 9.5E3 197.0960 1.0E5 197.8907 1.1E4 206.1175 1.0E5 207.0806 1.2E4 208.0898 3.9E3 209.0596 3.5E4 209.0961 7.7E5 210.0669 1.1E4 211.0759 2.5E4 211.1118 1.0E5 213.0922 3.5E3 213.8856 3.7E3 219.0805 1.4E5 220.0880 1.9E4 221.0961 9.7E3 222.0677 1.9E4 223.1111 2.7E4 223.7331 3.1E3 225.0544 6.4E3 225.0911 6.6E4 226.0980 5.1E3 227.1061 9.5E3 235.0742 1.1E4 236.0827 3.3E4 237.0908 1.2E6 237.1130 1.2E4 238.0985 4.4E4 239.0702 3.0E4 239.1066 7.8E4 239.6737 2.6E3 240.0780 6.8E4 240.1382 1.8E4 241.0861 2.4E4 241.1216 2.2E4 242.0927 7.9E3 251.1062 1.1E5 252.1140 4.8E3 254.0659 3.5E3 254.0936 1.4E5 257.1171 3.6E4 267.1018 1.6E4 268.1329 5.5E4 269.1169 2.5E6 271.1327 1.1E5 283.1315 2.2E4 285.1366 5.4E3 290.6642 2.5E3 300.1594 1.6E6 300.1899 1.1E4 300.2015 5.9E3 END IONS BEGIN IONS FEATURE_ID=267 PEPMASS=354.8521 SCANS=267 RTINSECONDS=305.893 CHARGE=1+ MSLEVEL=2 MERGED_STATS=7 / 7 (0 removed due to low quality, 0 removed due to low cosine). 83.0606 5.3E3 84.0816 1.5E5 86.0972 4.8E4 89.3659 2.2E3 91.0549 2.5E4 92.0239 2.3E3 92.4592 2.6E3 92.7013 2.3E3 93.0455 3.4E3 98.0609 7.0E3 107.0501 1.7E4 108.7351 2.4E3 109.6145 2.5E3 110.0725 4.3E5 110.9281 2.5E3 112.1869 2.6E3 118.0664 1.0E5 119.0741 5.0E4 120.0821 8.4E4 121.5738 2.7E3 122.3823 2.4E3 125.0721 1.1E4 129.1037 1.9E5 132.8498 2.2E3 134.0605 3.3E3 136.0521 1.1E4 136.0666 2.7E3 136.0770 5.6E4 137.0611 6.7E3 145.0080 2.5E3 146.0479 6.4E3 146.0618 3.3E5 147.0653 7.8E3 148.5741 2.5E3 155.0937 4.5E3 161.0617 4.3E3 161.3838 2.4E3 162.0569 8.9E3 164.0472 1.2E4 165.0565 1.1E4 167.8907 2.6E3 169.1350 5.8E3 172.1142 1.6E5 173.5217 6.6E3 173.5313 8.6E4 173.5396 2.4E4 180.3970 2.4E3 181.0740 3.9E4 187.1244 5.8E3 190.3290 2.3E3 192.9479 2.5E3 197.0165 2.5E3 203.0549 4.6E4 205.1365 8.4E3 205.5963 5.6E3 215.1546 2.5E3 216.1278 2.3E4 217.1348 1.8E4 221.3595 2.6E3 230.1204 1.2E4 231.1265 3.1E4 231.1518 4.3E4 237.9483 2.3E3 243.1154 7.2E3 244.1114 2.5E4 245.1318 2.5E3 247.1465 2.5E3 248.1531 2.9E4 249.1598 2.6E3 258.1159 3.0E3 258.8658 3.1E3 259.1476 2.2E4 262.7838 2.9E3 263.1110 2.5E3 266.1649 1.1E5 271.1228 4.2E4 272.1060 9.5E3 275.1429 3.3E4 276.1415 8.3E3 276.8823 2.3E3 277.0891 4.7E3 286.1138 2.5E3 289.8583 2.5E3 290.5486 2.6E3 290.8925 1.7E4 291.1382 2.8E3 292.1451 3.0E5 293.1265 2.8E3 293.1510 2.1E4 299.1185 3.8E4 305.0850 8.0E3 308.1774 2.8E3 308.9046 1.3E5 310.1812 3.9E4 314.1241 2.5E3 319.3119 2.6E3 323.0939 4.4E3 337.1099 2.5E3 340.6679 2.8E3 343.6016 2.5E3 355.1777 3.3E5 359.7530 2.6E3 361.1688 5.1E3 370.1985 2.7E3 381.7554 2.6E3 389.1683 3.3E3 391.9299 2.3E3 394.1915 3.4E3 410.1904 3.6E3 412.2038 6.4E3 414.2069 4.3E4 420.1971 8.2E3 427.2115 1.0E4 428.1981 3.1E3 434.9053 2.3E3 447.2405 4.2E4 455.2098 1.5E4 473.2179 2.9E4 482.5792 2.9E3 488.4392 2.6E3 498.0946 2.3E3 529.2574 4.2E3 551.2654 3.1E3 642.0324 2.8E3 749.0381 2.7E3 825.7965 2.7E3 856.5671 2.9E3 882.0062 2.6E3 994.0111 2.5E3 1004.3564 2.8E3 END IONS BEGIN IONS FEATURE_ID=268 PEPMASS=526.1921 SCANS=268 RTINSECONDS=305.934 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 64.8810 2.3E3 66.2488 2.6E3 66.4775 2.5E3 70.2348 2.3E3 70.5786 2.2E3 70.6696 2.2E3 75.8256 2.2E3 80.3341 2.5E3 85.0280 2.7E4 101.3765 2.2E3 121.0642 6.8E3 123.4637 2.5E3 127.0382 2.4E3 131.3552 2.1E3 135.0427 2.3E3 137.0593 5.6E5 137.0696 5.6E3 147.2427 2.5E3 148.3400 2.7E3 150.0680 2.4E3 161.0230 8.9E3 161.0590 1.7E4 162.0670 1.1E4 170.2244 2.9E3 173.5165 2.2E3 173.5302 7.5E4 173.5420 1.3E4 175.0367 3.0E3 179.0339 2.8E3 181.0492 2.5E4 191.0341 1.3E4 193.0494 7.4E4 195.6002 2.8E3 202.7431 2.4E3 205.0493 2.9E4 225.0892 2.5E3 237.0550 7.0E3 238.0628 5.8E3 241.1671 2.5E3 253.0488 8.0E3 257.0802 5.7E3 265.0492 7.8E4 266.8317 2.9E3 267.0653 8.4E3 269.0809 2.3E4 285.0374 6.3E3 285.0758 7.1E5 285.1122 5.7E3 297.0368 4.0E3 297.0757 4.4E5 302.0803 1.2E4 303.0880 3.2E3 315.0862 1.9E5 317.1018 2.0E5 317.1447 3.0E3 329.1022 6.8E4 347.1123 5.6E4 355.8003 2.8E3 456.9537 2.8E3 474.9786 2.9E3 END IONS BEGIN IONS FEATURE_ID=269 PEPMASS=347.1127 SCANS=269 RTINSECONDS=306.038 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 2 (0 removed due to low quality, 0 removed due to low cosine). 57.0195 2.3E3 62.1486 2.1E3 62.6821 2.9E3 64.2671 2.2E3 65.2381 2.5E3 66.4982 2.7E3 73.3279 2.4E3 78.1848 2.3E3 80.6331 2.7E3 97.8602 2.9E3 107.0491 6.0E3 117.2782 2.1E3 121.0648 1.2E4 137.0594 1.4E5 149.0233 4.7E3 149.6695 3.6E3 149.6901 4.9E3 161.0235 7.6E3 161.0596 6.8E3 162.0665 3.5E3 163.0385 1.0E4 167.0859 3.2E3 173.5344 2.4E4 177.6734 2.6E3 179.1477 3.1E3 181.0489 9.0E3 181.0649 1.0E4 193.0500 5.1E3 195.4730 2.5E3 197.0603 6.6E3 201.2701 2.1E3 205.0492 2.8E3 209.0591 4.9E3 211.0749 1.1E4 214.6672 2.4E3 225.0542 7.8E3 229.0854 3.1E3 237.0544 2.7E4 238.0625 1.0E4 239.0698 5.8E3 241.0844 2.6E3 242.0567 2.8E3 242.4033 2.6E3 253.0503 1.1E4 257.0811 6.8E3 265.0495 5.4E4 267.0645 1.2E4 269.0809 1.7E4 285.0761 1.1E5 297.0760 4.0E4 312.8184 2.9E3 322.3340 2.5E3 END IONS BEGIN IONS FEATURE_ID=270 PEPMASS=286.1442 SCANS=270 RTINSECONDS=306.426 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 11 (8 removed due to low quality, 0 removed due to low cosine). 48.1749 5.3E3 48.2257 9.2E3 51.0235 5.3E3 53.0385 2.8E4 54.5428 1.2E4 55.0179 5.8E4 69.5170 8.5E3 71.1717 7.7E3 72.2604 5.3E3 74.7889 8.0E3 77.0387 5.4E4 79.0542 1.2E5 81.0694 1.3E4 82.8637 5.6E3 91.0543 2.1E5 93.0698 1.0E5 95.0491 2.6E5 103.0544 1.1E5 105.0449 5.1E4 107.0128 1.5E4 107.0326 3.1E5 107.0355 6.2E4 107.0491 3.2E7 107.0628 8.8E4 107.0658 4.1E5 107.0710 3.5E4 107.0778 3.2E4 109.0649 6.0E4 112.5575 8.8E3 115.0543 1.9E6 115.0613 1.5E4 117.0699 2.6E5 119.0491 2.6E5 121.0284 4.4E5 121.0648 1.2E6 121.0747 1.9E4 124.3652 5.7E3 125.0590 1.8E4 127.0541 8.8E3 131.0491 5.0E5 132.0580 2.5E4 132.0806 6.3E4 133.0650 7.8E4 137.0450 2.4E4 137.0597 3.1E6 139.0754 7.8E3 141.9855 1.2E4 143.0491 6.2E6 144.0569 1.1E5 145.0648 3.0E6 147.0805 1.3E5 148.0757 1.3E5 149.0598 1.8E5 151.0754 3.2E5 155.0604 1.0E5 157.0656 9.3E3 160.0520 2.2E5 160.0758 9.0E4 161.0598 1.4E5 161.2429 5.2E3 162.0678 9.3E4 163.0625 5.6E4 163.0756 3.8E5 164.0709 1.5E4 165.0697 6.4E4 166.0778 9.7E4 166.0882 1.9E4 167.0856 3.1E4 169.0655 6.0E3 173.5237 3.5E4 173.5328 1.6E5 173.5429 3.9E4 175.0586 5.1E4 175.0756 3.1E6 176.0837 6.9E4 177.0782 1.1E4 178.0865 1.7E6 181.0649 2.7E5 181.0846 1.8E4 181.1015 3.0E5 182.0730 2.2E4 183.0802 7.0E4 183.3592 6.2E3 189.0704 2.1E4 190.0780 4.6E4 191.0858 5.7E5 191.1043 1.3E4 192.1019 1.5E5 193.0657 1.4E4 194.0728 4.8E5 195.0807 1.9E5 196.0886 6.8E3 197.0602 5.2E4 197.0953 1.2E4 202.0796 6.9E3 207.0806 4.5E4 208.0883 2.9E4 209.0597 1.4E5 209.0964 3.2E6 210.0676 6.2E4 211.0759 5.6E4 211.1120 2.6E5 212.0839 2.6E4 213.0910 3.3E4 218.0716 4.4E4 219.0808 6.5E5 219.1028 1.5E4 220.0887 1.1E5 221.0964 2.2E4 222.0678 1.4E5 223.0751 4.0E4 223.1124 5.4E4 225.0550 6.6E4 225.0912 1.6E4 226.0984 5.4E4 235.0758 6.4E4 236.0833 1.5E5 237.0913 3.9E6 238.0990 1.9E5 239.0706 2.1E5 239.1063 1.0E5 240.0783 2.7E5 241.0866 7.6E4 241.1223 5.9E4 250.0326 1.2E4 251.1070 3.9E5 254.0660 8.5E3 254.0939 5.7E5 254.1210 2.1E4 267.1024 2.9E4 269.0912 1.3E4 269.1174 6.9E6 286.1441 6.0E5 END IONS BEGIN IONS FEATURE_ID=271 PEPMASS=511.2552 SCANS=271 RTINSECONDS=306.745 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 61.2503 2.2E3 69.0697 7.6E3 75.3532 2.3E3 79.1338 2.2E3 86.0911 3.7E3 86.0961 1.9E5 89.6123 2.2E3 90.1389 2.4E3 91.0542 1.5E4 91.9574 2.2E3 93.8338 2.4E3 102.5327 2.3E3 103.0535 2.6E3 107.5661 2.2E3 108.1579 2.4E3 115.0498 9.1E3 115.6568 2.5E3 118.0648 7.9E4 120.0718 2.4E3 120.0803 4.7E4 129.5984 2.4E3 131.0488 3.8E3 136.0755 6.4E4 146.0466 4.5E3 146.0597 7.9E5 146.0703 9.1E3 146.0958 2.1E4 155.9448 2.6E3 157.1334 6.5E4 165.0543 6.0E4 173.5253 4.7E4 173.5424 2.4E4 182.0809 8.6E4 183.1127 3.9E4 185.1285 1.1E4 187.7365 2.7E3 189.1020 8.4E4 217.0972 1.9E5 236.1065 7.3E3 239.6937 2.8E3 246.4436 2.4E3 265.0888 2.8E3 270.1119 8.3E3 282.1130 3.3E4 282.4192 2.6E3 299.1395 2.1E4 321.9867 2.8E3 333.4979 2.5E3 345.5506 2.3E3 383.1931 2.8E3 383.2002 7.2E3 387.3828 2.9E3 END IONS BEGIN IONS FEATURE_ID=272 PEPMASS=764.4088 SCANS=272 RTINSECONDS=307.766 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 5 (0 removed due to low quality, 0 removed due to low cosine). 70.0650 1.1E6 70.0691 6.0E3 70.0716 3.5E3 78.4773 2.9E3 80.5676 2.3E3 81.4423 2.3E3 82.9309 6.5E3 83.0415 5.6E4 83.0457 6.8E3 84.1986 2.5E3 84.9330 6.2E4 84.9378 7.2E3 86.0961 2.3E5 86.2841 2.4E3 90.1768 2.4E3 94.7248 2.3E3 96.4247 2.5E3 97.0758 3.7E4 98.0598 1.6E5 105.0177 3.0E3 110.9696 2.4E3 111.0626 2.5E3 112.0867 7.4E5 112.0943 3.2E3 113.0945 1.9E4 115.0863 9.8E4 117.6509 2.3E3 118.0648 9.8E3 120.0807 2.6E4 122.7934 2.2E3 124.0867 7.0E3 125.0354 2.4E3 125.0707 7.6E4 126.0547 7.0E4 129.1132 1.8E4 136.0754 5.3E4 140.0816 1.7E5 141.1132 9.1E3 143.0535 2.6E3 146.0598 2.2E5 150.0915 6.2E3 151.1229 2.1E4 155.6482 2.4E3 157.1082 5.5E5 157.1331 1.4E5 158.0920 3.2E4 163.0676 2.6E3 165.0545 3.2E4 165.1022 1.0E4 166.1336 5.0E4 167.1178 9.8E4 172.1121 3.3E3 173.5239 3.1E4 173.5352 1.1E5 173.5451 4.3E3 175.1191 1.2E4 177.1021 3.8E4 177.3962 2.6E3 178.1103 6.1E3 182.0811 1.8E5 182.0992 3.8E3 183.1126 3.4E4 185.1284 7.7E4 189.1021 3.7E4 192.1130 9.8E4 193.0975 2.6E3 193.1224 2.8E3 193.1445 1.9E4 194.1288 8.4E4 195.1128 1.8E5 209.1397 3.0E5 209.1628 3.2E3 210.1477 1.7E4 211.1555 4.8E3 211.6513 2.6E3 212.1396 2.4E4 215.1177 2.7E3 216.1255 9.0E3 217.0972 3.0E5 217.1338 1.3E5 220.1081 4.8E4 220.1298 2.6E3 222.6646 2.9E3 227.0819 8.4E3 227.1180 7.0E3 229.4501 2.4E3 234.1238 2.8E4 236.1073 4.0E3 236.1510 4.5E3 237.0950 3.4E3 237.1119 2.4E3 237.1346 1.1E6 237.1561 3.0E3 243.1128 1.3E5 245.0919 4.3E4 245.1646 1.8E4 248.6519 2.8E3 254.1610 1.9E5 259.2785 2.7E3 265.9244 2.5E3 270.1133 1.5E4 273.1593 2.9E3 276.1453 8.6E3 277.1298 5.7E3 282.1135 5.3E4 293.1710 2.6E3 294.1594 3.4E4 295.1657 6.1E4 296.1767 2.8E4 299.1392 2.5E4 312.0739 2.9E3 312.1719 1.1E4 314.1501 1.2E5 314.1869 1.5E4 321.1721 3.1E4 322.1550 1.7E5 326.1971 5.2E3 330.1809 3.9E4 336.1823 4.1E4 338.1976 4.2E3 339.1820 2.1E4 340.1659 5.9E4 347.1837 3.6E3 347.1970 2.9E3 354.1920 3.6E4 355.2234 9.9E3 356.2082 1.9E5 358.1761 4.1E4 364.1764 6.4E4 365.1597 4.6E4 365.2037 1.3E4 373.2349 1.4E5 374.1740 2.5E3 381.2037 6.5E4 382.1880 2.1E5 383.2012 1.8E4 390.1957 2.7E3 392.1818 5.8E3 393.1928 1.2E4 395.1963 1.4E4 396.1940 1.7E4 398.1708 1.3E4 399.2159 5.6E4 407.2198 1.9E4 410.2206 2.7E3 410.8350 2.8E3 411.2030 3.8E4 424.1860 1.9E4 425.2301 5.0E4 427.2350 1.7E4 435.2145 4.3E4 436.2016 3.8E3 442.2554 1.2E4 449.2919 2.8E3 449.9312 2.8E3 452.2396 4.3E3 453.2250 4.9E4 454.2448 3.2E3 466.2349 6.1E3 470.2504 1.9E4 471.2341 8.5E3 490.0880 2.7E3 493.2360 2.5E3 495.2243 4.0E4 495.3028 2.4E4 496.2900 3.7E3 500.2226 2.7E3 511.2553 4.7E4 517.2526 3.6E3 520.3045 6.6E3 521.2396 2.8E4 524.2821 8.1E3 535.2662 2.7E3 537.3304 2.1E4 538.3126 6.7E4 539.2495 4.1E4 545.2581 2.9E3 555.3405 1.9E4 563.2619 2.4E4 565.3262 2.0E4 566.3087 3.0E4 580.3092 2.0E4 583.3347 9.7E4 584.3187 9.3E4 590.3015 7.2E3 592.2750 7.2E3 599.3182 2.7E3 601.3465 4.4E4 606.3035 7.6E4 608.3081 6.9E4 618.2910 2.3E4 623.3324 3.0E4 634.2992 4.6E4 648.3422 6.1E3 651.3275 2.3E4 658.3659 4.8E4 674.3671 3.3E3 676.3401 3.4E3 677.3616 1.3E4 687.3495 5.4E4 698.2489 2.8E3 701.3847 5.9E3 703.3932 3.5E3 704.3832 1.2E4 705.3600 1.2E5 716.2426 2.8E3 718.4066 1.5E4 719.3868 2.3E5 722.3882 3.7E3 728.3966 3.2E3 729.3707 6.0E4 730.3607 3.3E3 736.4134 1.4E5 746.3978 3.9E5 746.5123 2.3E3 746.5367 4.2E3 746.5543 3.4E3 747.2255 5.2E3 747.3813 1.4E6 747.5011 7.5E3 764.2844 4.5E3 764.4085 1.4E6 764.5691 3.7E3 END IONS BEGIN IONS FEATURE_ID=273 PEPMASS=382.7086 SCANS=273 RTINSECONDS=307.856 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 10 (6 removed due to low quality, 0 removed due to low cosine). 70.0286 1.6E5 70.0650 2.4E6 71.0600 1.0E5 76.3880 9.0E3 79.2824 1.1E4 81.1805 1.0E4 86.0963 1.3E7 86.1031 9.7E4 87.0551 2.8E5 87.0789 1.5E5 87.0997 2.0E5 88.0391 2.9E5 88.0866 1.2E4 89.0706 4.7E4 91.0541 2.8E5 94.0641 1.7E4 95.0492 2.7E4 97.0759 7.3E4 98.0599 2.7E5 99.0552 1.5E5 102.7110 8.9E3 103.0542 7.2E4 107.0493 1.9E4 109.8558 6.4E3 111.4099 6.0E3 112.0868 1.2E6 112.3787 8.3E3 113.0945 3.0E4 113.5867 1.8E5 114.0917 1.8E4 115.0501 1.2E6 115.0866 1.9E5 117.4346 1.0E4 118.0650 9.1E5 118.5793 1.1E4 119.0490 4.3E5 120.0707 2.4E4 120.0806 1.4E6 121.0647 5.5E4 123.0439 6.9E5 123.0533 9.6E3 124.0870 5.1E4 125.0707 1.4E5 126.0548 1.2E5 129.1133 1.3E5 130.1201 2.0E4 132.0811 2.5E4 135.0566 1.1E4 135.0678 7.6E5 136.0633 4.9E4 136.0756 3.5E6 136.0879 4.7E4 137.0795 6.6E4 140.0818 2.9E5 141.1022 3.2E4 141.1132 4.4E4 142.0861 6.0E4 143.0936 1.2E4 144.0808 1.2E5 146.0599 7.8E6 146.0708 7.2E4 146.0961 3.7E5 147.0438 4.8E5 147.0633 1.8E5 148.0756 7.0E4 149.1078 6.5E3 151.1226 5.6E4 157.0948 3.7E4 157.1083 1.3E6 157.1334 4.5E5 158.6806 6.4E3 161.1075 1.2E5 163.0870 7.2E3 165.0547 3.5E6 165.1010 2.2E4 166.0582 1.1E5 166.1337 9.3E4 167.1180 2.9E5 169.1011 1.4E5 172.0760 9.2E4 173.5270 3.6E5 173.5361 3.3E4 173.5450 1.3E5 175.1196 2.2E4 177.1063 2.4E5 178.1154 4.1E5 179.0849 1.5E4 182.0657 8.4E3 182.0813 2.2E6 183.0851 1.0E5 183.1129 7.0E5 183.3617 6.7E3 186.1136 1.2E5 187.1227 1.8E4 189.1024 8.2E5 190.1069 2.1E4 191.1055 2.9E5 191.6071 7.1E3 192.1134 1.5E5 193.1444 7.4E4 194.1288 1.1E6 195.0971 1.8E4 195.1128 4.6E6 196.1154 2.1E5 197.0960 7.8E4 198.6304 8.0E3 200.1107 6.9E5 200.6124 1.7E4 204.1385 5.1E5 206.1294 5.1E4 209.1399 3.2E5 210.1479 3.9E4 212.1397 1.6E5 212.6266 1.2E4 217.0974 1.0E6 217.1339 5.0E5 220.1083 6.4E4 223.0764 1.4E4 224.1074 9.8E4 225.1347 1.2E4 226.1663 1.9E5 227.1740 2.0E5 228.1022 1.0E5 233.1396 9.7E4 234.1239 4.8E5 236.1076 1.1E5 236.1504 1.5E5 237.1347 1.6E6 237.1609 5.3E4 238.1383 5.6E4 238.1657 1.9E4 243.1130 2.3E5 245.1637 1.3E4 250.1139 9.7E3 250.1438 1.2E6 250.1712 4.3E4 251.1488 1.1E5 253.1770 2.5E5 253.6479 7.3E4 254.0995 2.2E4 254.1366 3.8E4 254.1612 1.2E7 254.2225 1.6E4 255.1639 5.0E5 260.1428 1.2E4 265.0856 1.5E4 267.6445 1.1E5 270.1127 1.0E6 271.1157 7.8E4 271.1876 1.8E5 275.1601 8.9E3 276.1459 2.3E5 277.1700 7.4E4 280.1411 1.6E5 282.1129 1.6E5 286.1554 6.9E4 289.1296 9.5E3 293.1727 3.9E5 294.1577 2.0E4 296.1763 2.4E5 299.1398 6.0E4 302.1649 1.5E4 306.1583 7.3E4 310.1995 1.3E4 310.6808 2.0E4 311.1835 1.9E5 312.1756 6.9E3 314.1507 2.1E4 314.1871 1.9E5 319.1886 2.0E4 321.1715 1.0E5 322.1550 4.1E5 322.1885 1.0E5 324.6795 7.9E3 329.7200 1.0E4 336.2146 4.5E5 337.2002 6.2E4 338.1974 1.7E5 339.1828 7.8E4 340.1655 1.8E5 346.2008 2.8E4 347.1835 7.5E4 348.1832 2.5E4 352.2101 4.0E4 354.1866 1.1E4 354.2246 7.3E5 355.2245 6.2E5 356.2084 9.6E5 357.2073 8.7E4 360.0273 8.0E3 363.2298 1.5E4 364.2093 5.2E5 365.1598 3.7E4 365.2076 1.8E5 368.7073 1.5E4 368.7167 6.8E3 371.2170 2.3E4 372.2273 5.5E4 373.1929 1.6E4 373.2349 3.4E6 374.2379 2.7E5 380.2169 1.6E4 381.2038 5.6E5 382.1857 2.6E5 382.2251 2.2E5 383.2126 1.2E5 390.2497 1.4E5 391.2213 2.3E4 396.1923 9.4E3 398.2307 1.7E5 399.2145 2.0E6 399.2648 2.0E4 400.2182 1.8E5 407.2172 5.6E4 408.2524 1.5E4 411.2051 8.6E3 424.1898 4.6E4 424.2461 4.1E5 425.2316 3.1E5 426.2556 1.1E4 428.2531 7.5E3 432.2744 7.3E4 442.2563 1.2E6 443.2606 1.8E5 449.2989 6.7E5 450.2976 5.3E4 452.2409 7.8E4 453.2244 2.3E4 469.2653 8.2E4 470.2514 5.7E5 471.2537 6.1E4 478.2294 1.3E4 487.2787 1.1E5 504.8635 1.3E4 521.2387 5.3E4 534.2836 8.8E4 535.2677 1.3E5 537.3292 8.5E4 538.3196 4.0E4 552.2927 8.0E4 555.3397 2.6E5 561.2850 2.8E4 562.2827 1.1E4 562.3079 5.3E4 563.2631 7.0E4 564.2808 3.1E4 577.3247 7.8E4 578.3087 4.1E5 579.3188 2.2E5 580.2886 5.1E5 581.2880 1.5E4 605.3214 9.4E4 606.3039 4.5E5 607.3044 1.5E4 622.3372 1.2E4 623.3294 3.1E6 623.4207 2.7E4 624.3321 4.0E5 650.3318 1.2E4 651.3265 2.5E5 END IONS BEGIN IONS FEATURE_ID=274 PEPMASS=316.1911 SCANS=274 RTINSECONDS=309.603 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 55.0179 1.1E4 58.0620 4.3E3 58.0650 1.7E5 58.1760 2.3E3 65.6284 2.4E3 68.2582 2.2E3 69.5120 2.2E3 72.0807 6.3E3 78.1908 2.7E3 78.4981 2.5E3 79.0539 3.0E3 83.1276 2.4E3 91.0541 5.7E4 93.0697 3.3E4 94.3293 2.4E3 95.0490 6.5E4 97.0644 3.8E3 103.0541 1.3E4 107.0490 2.3E5 107.1995 2.7E3 109.0648 5.5E3 117.0697 7.0E4 119.0490 1.5E5 119.0853 3.6E4 121.0646 7.8E5 121.0729 4.5E3 123.0443 2.6E3 123.0798 7.5E3 125.0593 1.7E4 129.0696 6.2E3 131.0490 2.7E4 133.0647 4.3E4 135.0803 1.9E4 137.0480 3.7E3 137.0596 1.7E5 142.6035 2.5E3 145.0515 3.3E3 145.0646 2.2E5 145.3498 2.2E3 146.0730 2.9E3 147.0802 3.9E5 149.0595 1.7E5 149.0960 5.1E4 150.0677 8.9E3 151.0646 4.0E3 151.0752 5.0E5 153.0910 8.3E3 157.0647 1.7E4 160.3739 2.4E3 161.0964 2.7E3 163.0752 4.4E4 165.0691 6.2E3 165.0908 3.0E4 167.0857 3.5E3 169.0647 8.8E3 173.5247 3.8E4 173.5423 3.1E4 173.5666 2.6E3 173.6651 2.3E3 177.0910 1.5E5 181.0652 7.6E3 181.1017 2.5E3 182.0728 3.5E4 183.0804 8.5E4 183.1161 3.1E3 193.1012 3.9E4 195.0800 1.5E4 196.0884 2.4E4 197.0609 2.7E3 197.0957 2.4E4 203.0853 6.8E3 209.0959 6.5E3 210.0675 4.6E4 211.0753 7.2E4 211.1118 5.0E5 211.1464 3.1E3 212.0835 2.3E4 213.0912 3.1E4 221.0961 5.8E4 221.5981 3.3E3 224.0838 1.6E4 225.0895 3.8E3 225.1278 2.0E4 229.1227 2.5E3 235.1109 1.2E4 237.0908 1.8E4 238.9827 2.3E3 239.1065 3.5E5 241.1228 5.9E3 242.0935 8.2E4 246.7801 2.3E3 253.1218 2.0E4 254.5493 2.4E3 256.1093 1.8E4 271.1326 2.3E5 271.1660 4.5E3 316.1893 8.5E3 END IONS BEGIN IONS FEATURE_ID=275 PEPMASS=330.2069 SCANS=275 RTINSECONDS=311.1 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 7 (1 removed due to low quality, 0 removed due to low cosine). 50.2686 2.7E3 51.1675 2.4E3 51.6459 2.4E3 53.2951 3.2E3 59.1167 2.3E3 60.0807 2.2E5 60.2381 2.4E3 61.9454 2.4E3 62.1846 2.4E3 62.6098 2.0E3 64.0955 2.2E3 67.4466 2.3E3 68.5760 2.1E3 75.6209 4.6E3 75.6294 2.3E3 77.4040 2.2E3 82.6340 2.1E3 82.7332 2.5E3 83.6498 2.3E3 89.3516 2.4E3 91.0541 6.4E4 93.0699 2.7E4 94.2661 2.3E3 95.0490 8.7E4 98.6907 2.3E3 103.0543 1.2E4 107.0490 2.7E5 109.0647 2.7E3 116.3353 2.4E3 117.0698 7.4E4 119.0490 2.1E5 119.0854 4.3E4 121.0647 1.1E6 121.0793 3.6E3 123.0435 2.7E3 123.0804 8.1E3 123.6452 2.7E3 125.0597 2.3E4 131.0491 2.6E4 133.0648 6.5E4 135.0446 2.7E3 135.0801 2.5E4 136.0521 2.7E3 137.0481 3.1E3 137.0597 2.0E5 138.4524 2.6E3 145.0646 3.1E5 147.0672 5.1E3 147.0803 6.6E5 149.0596 2.3E5 149.0960 7.3E4 151.0753 7.5E5 151.0890 7.2E3 151.6311 2.7E3 153.0909 1.7E4 157.0648 2.3E4 159.0798 3.0E3 161.0960 7.3E3 163.0754 6.3E4 163.1344 2.5E3 165.0912 3.6E4 173.5335 9.9E4 175.1108 8.2E3 177.0911 2.3E5 181.0651 5.9E3 181.1017 6.1E3 182.0727 2.4E4 183.0805 1.0E5 187.8096 2.4E3 188.1196 2.3E3 193.1012 5.1E4 193.6933 2.4E3 195.0817 5.7E3 196.0879 3.2E4 197.0621 2.7E3 197.0963 3.1E4 203.0853 5.7E3 203.9004 2.5E3 207.4441 2.6E3 209.0956 2.6E3 210.0676 6.1E4 211.0755 9.6E4 211.1119 7.0E5 211.1351 1.4E4 212.0834 2.7E4 213.0911 4.5E4 216.5950 2.4E3 221.0962 7.9E4 223.6743 2.9E3 224.0829 1.5E4 225.0906 4.7E3 225.1276 3.0E4 235.1115 9.2E3 237.0916 2.2E4 238.0973 2.3E3 239.0792 5.4E3 239.1067 6.0E5 240.1128 2.7E3 241.1219 1.3E4 241.3721 2.4E3 242.0938 9.5E4 243.1379 3.4E3 253.1221 4.1E4 256.1100 2.2E4 271.1328 5.2E5 271.1659 8.8E3 299.4850 2.5E3 330.2059 2.9E3 339.2608 2.6E3 END IONS BEGIN IONS FEATURE_ID=276 PEPMASS=577.1350 SCANS=276 RTINSECONDS=312.176 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 6 (0 removed due to low quality, 0 removed due to low cosine). 62.3694 2.2E3 63.4845 2.7E3 66.6210 2.0E3 67.6146 2.2E3 69.5293 2.9E3 71.7611 2.6E3 71.7651 2.4E3 72.6324 2.1E3 73.7462 2.3E3 74.7284 2.4E3 75.9663 2.4E3 76.2186 2.5E3 77.7546 2.5E3 78.2006 2.3E3 83.0734 2.4E3 86.8097 2.3E3 88.9989 2.3E3 91.4317 2.3E3 101.1666 2.3E3 104.0444 2.3E3 105.8609 2.3E3 113.0126 2.4E3 117.7307 2.7E3 120.3480 2.7E3 123.0351 2.9E3 123.0435 1.6E5 127.0384 2.5E4 135.2378 2.8E3 137.0237 7.0E3 139.0383 3.9E4 147.6132 2.6E3 147.7454 2.7E3 149.0233 1.3E4 151.0387 2.1E4 154.1019 2.7E3 155.0354 2.9E3 159.1384 2.5E3 165.0544 3.0E3 173.5313 1.0E5 173.5454 4.2E3 203.0333 6.8E3 211.5318 2.4E3 227.2312 2.8E3 231.0646 2.3E4 232.1991 2.7E3 245.0439 4.2E4 247.0599 2.6E4 257.0457 3.5E3 259.0601 5.6E4 269.0441 2.4E4 271.0602 6.1E4 280.0690 2.7E3 283.0601 2.6E4 287.0170 6.4E3 287.0550 3.9E6 287.1292 1.6E4 295.6332 2.3E3 299.0552 1.4E5 311.0572 1.5E4 337.2232 2.5E3 358.4574 2.4E3 377.3345 2.7E3 391.0900 2.4E3 396.4076 2.3E3 397.0095 2.4E3 407.0761 2.3E4 419.0214 2.7E3 419.0763 1.2E5 425.0885 1.9E4 429.2146 2.9E3 437.0868 1.9E4 525.1920 2.6E3 536.3975 3.3E3 562.4755 2.6E3 575.8272 2.8E3 END IONS BEGIN IONS FEATURE_ID=277 PEPMASS=368.8595 SCANS=277 RTINSECONDS=317.426 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 6 (0 removed due to low quality, 0 removed due to low cosine). 82.8966 2.6E3 86.0909 1.1E4 86.0971 9.1E5 87.1005 1.8E4 87.5295 2.3E3 89.9571 2.6E3 91.0551 2.5E4 95.7774 2.3E3 97.0768 1.1E4 97.2543 2.4E3 98.0605 8.2E3 101.7711 2.4E3 106.0658 3.8E3 110.0726 1.9E5 112.0794 2.1E3 112.0877 2.8E4 115.0876 1.1E4 118.0665 1.0E5 119.0741 4.3E4 120.0821 7.0E4 122.0608 8.2E3 125.0719 2.3E4 134.0627 2.3E3 136.0772 3.6E4 140.0830 7.7E3 144.1794 2.5E3 146.0456 8.9E3 146.0618 3.5E5 147.0650 5.3E3 152.8333 2.7E3 155.0930 2.3E3 157.1093 2.6E3 158.4409 2.6E3 162.0568 9.5E3 172.1144 1.7E5 173.1162 3.7E3 173.5310 9.7E4 173.5440 1.7E4 173.5995 2.5E3 174.0569 6.7E3 175.1210 1.8E4 180.0898 9.1E3 181.0744 3.2E4 187.1253 2.0E4 188.1456 1.7E4 198.0929 3.3E3 199.2330 2.5E3 202.8212 2.3E3 207.0651 2.5E3 207.7465 2.4E3 208.6071 2.5E3 215.1209 6.4E3 216.1283 4.0E4 217.1363 1.3E4 218.5690 2.4E3 228.1136 1.6E4 230.1213 3.3E4 231.1525 4.7E4 235.1208 5.5E3 238.1264 6.2E3 241.8976 2.7E3 243.1152 2.2E4 245.1317 2.5E3 251.1168 3.9E4 252.1477 7.8E3 257.4619 2.9E3 258.1173 6.3E3 259.1485 1.4E4 271.1216 2.7E4 275.1423 2.2E4 277.1453 6.7E4 278.1291 1.0E5 278.4387 2.8E3 279.1125 4.3E4 290.1390 6.5E3 293.4615 2.5E3 294.1712 3.3E4 295.1546 6.1E3 299.1176 3.0E4 300.2434 2.8E3 301.1208 7.5E3 303.1236 4.1E4 304.1321 5.0E3 312.1813 2.7E4 315.6384 2.6E3 320.1508 6.1E3 321.1613 3.1E4 321.3162 2.8E3 323.1633 2.5E4 338.1568 8.6E3 338.1903 2.4E4 362.6685 3.1E3 369.1681 4.7E3 396.1694 3.0E3 412.2038 3.1E3 420.1971 3.3E3 438.1915 1.7E4 439.1799 3.8E3 441.1931 2.5E4 442.1826 1.2E4 458.2224 6.8E4 473.2340 2.9E3 475.2491 8.0E4 476.2481 3.9E3 484.2007 2.8E4 501.2258 2.7E4 540.3132 9.1E3 562.2494 3.0E3 583.7516 2.8E3 586.3156 2.1E4 593.2702 2.7E3 598.8314 3.5E3 614.7429 2.7E3 619.2706 2.5E3 636.2991 7.2E4 637.2927 6.3E3 662.2782 1.1E4 731.3603 2.6E3 732.3625 3.6E3 736.3358 2.6E3 749.3824 9.4E4 750.3879 2.2E4 753.3555 1.0E4 775.3667 7.1E3 866.4410 2.6E4 867.4352 2.9E3 877.4128 8.8E3 894.4386 8.1E4 895.4388 3.1E4 922.4383 3.2E4 END IONS BEGIN IONS FEATURE_ID=278 PEPMASS=251.1070 SCANS=278 RTINSECONDS=319.214 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 59.0490 6.0E3 59.2560 2.6E3 62.4649 2.5E3 63.4825 2.3E3 64.8819 2.5E3 65.0528 2.4E3 95.1656 2.5E3 99.6923 2.6E3 105.9946 2.3E3 114.3723 2.3E3 121.1591 2.8E3 137.3916 2.6E3 139.5992 2.6E3 165.0707 1.0E4 173.5205 2.3E3 173.5383 2.6E4 179.0859 1.4E4 180.0932 2.7E4 189.0410 2.6E3 189.0700 2.0E4 190.0778 7.9E4 191.0650 4.4E3 191.0855 6.5E5 191.1056 5.1E3 195.3061 3.0E3 203.0855 5.6E3 205.0672 2.9E3 205.1012 2.2E4 207.0802 6.2E3 208.0885 6.7E4 218.0729 2.1E4 219.0807 9.7E4 220.0883 5.5E4 230.5781 2.7E3 235.9663 2.3E3 236.0835 9.2E4 251.1069 2.3E4 252.6321 2.3E3 END IONS BEGIN IONS FEATURE_ID=279 PEPMASS=268.1335 SCANS=279 RTINSECONDS=319.376 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 8 (3 removed due to low quality, 0 removed due to low cosine). 45.7533 2.5E3 46.8314 2.2E3 47.6496 2.4E3 47.7701 4.8E3 47.7714 1.7E4 49.5121 2.9E3 50.0929 2.1E3 51.6283 2.1E3 52.2992 2.3E3 52.3308 2.4E3 52.5009 2.5E3 53.3841 2.2E3 54.7694 9.5E3 55.5164 2.3E3 55.6021 2.1E3 55.6662 2.6E3 59.0229 2.3E3 60.0236 2.6E3 62.7783 2.7E3 63.5261 2.7E3 64.9776 2.3E3 70.5595 2.7E3 74.3066 2.2E3 80.7409 2.6E3 82.6956 2.4E3 83.7809 2.4E3 87.9443 2.7E3 91.4118 2.4E3 92.3325 2.3E3 94.0015 2.3E3 105.2071 2.8E3 108.8299 2.3E3 115.6245 2.4E3 118.7246 2.4E3 128.3779 2.6E3 132.0806 2.5E3 136.4158 2.3E3 139.5635 2.4E3 150.0089 2.5E3 153.1085 2.4E3 155.7847 2.5E3 158.6247 2.2E3 162.8953 2.7E3 163.0543 2.4E3 165.0704 4.0E4 167.0853 2.4E3 170.3027 2.2E3 173.5298 4.8E4 173.5422 5.4E3 177.0689 3.8E3 178.0785 2.9E3 179.0859 2.5E4 180.0934 6.4E4 180.1106 2.9E3 181.0648 5.7E3 188.8967 1.6E4 189.0706 6.8E4 190.0779 2.0E5 191.0331 1.0E4 191.0449 1.6E4 191.0534 1.3E4 191.0857 6.2E6 191.1262 4.0E4 191.1379 4.8E3 191.1492 3.4E3 192.0937 1.2E4 193.1006 4.3E3 194.0724 1.2E4 195.0810 1.4E4 195.1171 2.8E3 201.0703 2.3E4 201.2925 2.6E3 203.0867 1.2E4 205.0673 6.0E3 205.1014 1.9E5 207.0806 2.8E4 208.0887 2.4E5 209.0966 5.5E3 215.0858 5.3E3 216.8914 5.7E4 218.0728 9.2E4 219.0308 9.3E3 219.0806 3.8E6 219.0984 5.4E3 219.1307 7.4E3 220.0886 6.7E5 220.1080 2.4E3 221.0978 6.7E3 222.0685 1.8E4 223.0764 5.1E3 223.1119 3.4E4 229.0773 3.3E3 231.2330 2.5E3 233.0964 5.6E4 234.9011 1.2E4 235.0752 1.7E4 235.1008 2.3E3 236.0834 1.1E6 251.0468 4.3E3 251.0766 4.0E3 251.1066 2.0E6 251.1336 7.0E3 END IONS BEGIN IONS FEATURE_ID=280 PEPMASS=670.2714 SCANS=280 RTINSECONDS=322.112 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 67.9206 2.6E3 69.0295 2.6E3 69.0331 1.4E5 74.2216 2.4E3 76.1128 2.3E3 81.0332 1.0E4 82.3239 2.4E3 82.7284 2.6E3 83.0494 2.5E3 85.0233 2.4E3 85.0280 1.0E5 87.0386 3.8E3 87.0437 1.6E5 89.7280 2.7E3 90.8658 2.3E3 97.0214 3.2E3 97.0280 2.1E5 101.5654 2.4E3 102.9754 2.6E3 105.6998 2.3E3 112.5907 2.3E3 115.0305 3.3E3 115.0386 2.1E5 115.0535 7.1E3 122.9967 2.3E3 127.0388 1.6E4 129.0701 7.1E3 131.0490 6.6E3 133.0492 9.7E4 137.0594 5.1E5 137.0696 2.1E3 143.0489 7.0E4 145.0493 1.8E4 145.0639 2.4E3 150.0759 3.6E4 151.0388 3.2E3 153.0543 2.4E4 157.0644 2.2E4 160.0516 3.3E4 161.0594 1.2E4 162.0757 3.6E3 163.0754 2.5E4 173.5256 4.0E4 173.5426 1.9E4 175.0574 1.3E4 175.0754 9.1E5 175.0934 3.7E3 179.0711 5.7E3 180.0870 3.6E3 185.0596 3.2E3 187.0754 2.4E5 187.8977 2.2E3 189.0910 8.1E4 204.6225 2.3E3 205.0861 4.9E4 206.2587 2.9E3 217.0863 3.7E4 235.0965 2.6E4 239.0703 1.4E4 241.0713 2.4E3 241.6585 2.5E3 253.1200 2.3E3 259.0754 8.2E3 263.1072 2.3E4 264.7001 2.5E3 270.0900 9.8E3 271.0969 3.2E4 279.1028 1.8E4 291.1026 7.6E4 311.1286 2.7E4 323.1290 4.1E4 323.3754 2.6E3 341.1399 5.0E3 401.5325 2.8E3 440.3930 2.5E3 478.9891 2.8E3 556.1188 2.4E3 559.7120 2.8E3 618.0468 2.4E3 END IONS BEGIN IONS FEATURE_ID=281 PEPMASS=415.2108 SCANS=281 RTINSECONDS=322.645 CHARGE=1+ MSLEVEL=2 MERGED_STATS=7 / 7 (0 removed due to low quality, 0 removed due to low cosine). 78.9988 2.4E3 86.0961 1.5E6 86.1023 4.1E3 87.0996 2.4E4 88.8284 2.5E3 91.0541 3.1E4 91.2027 2.5E3 91.2102 2.2E3 95.0489 2.1E4 95.2735 2.1E3 96.1470 2.4E3 97.0758 2.4E4 98.0596 6.5E4 100.7073 2.1E3 103.0546 2.5E3 105.6080 2.2E3 106.0649 2.8E4 107.0489 6.3E3 107.2842 2.4E3 109.4435 2.7E3 114.5445 2.7E3 115.0863 5.3E4 115.7632 2.5E3 118.0649 7.0E4 119.0488 1.5E5 119.0728 3.0E3 120.0804 7.8E4 121.0648 6.0E3 123.0338 5.8E3 123.0437 3.3E5 123.8771 2.9E3 123.9837 2.4E3 124.0475 5.7E3 125.0706 1.2E5 126.0549 1.5E4 127.5361 2.2E3 130.0640 2.2E3 131.0486 4.8E3 132.3110 2.4E3 134.0597 1.1E5 135.0675 4.3E4 136.0754 2.7E5 137.5170 2.3E3 141.1023 4.0E3 146.0466 8.8E3 146.0597 8.0E5 146.0704 2.9E3 147.0437 2.0E5 147.0632 2.4E4 148.0466 2.9E3 148.0754 2.1E4 154.9991 2.3E3 155.6521 2.2E3 162.0549 2.7E4 164.7121 2.5E3 165.0545 5.3E5 166.0578 9.3E3 172.1119 1.1E5 173.5224 1.7E4 173.5307 4.1E4 173.5393 4.4E4 174.0554 8.5E3 174.1275 1.2E4 180.0648 2.5E3 182.0647 2.5E3 182.0810 5.1E4 182.5668 2.6E3 183.1491 8.3E4 187.1230 5.3E4 188.1440 1.0E4 203.0233 2.8E3 203.1546 3.2E3 204.1380 3.0E4 204.2529 2.7E3 211.1445 5.5E4 213.0880 2.7E3 214.1212 2.1E3 215.1177 5.7E4 216.1257 1.1E5 217.1336 3.1E5 218.1367 6.5E3 224.1074 7.8E3 230.1176 7.7E4 231.1493 1.7E5 236.1072 3.8E4 240.1017 4.1E4 243.1129 8.4E4 245.1285 1.4E4 247.1441 6.8E4 249.1603 6.2E4 253.0676 2.6E3 253.1334 2.2E4 258.1118 2.6E4 259.1440 2.7E5 260.1463 6.7E3 268.0939 3.2E3 273.1227 1.1E4 275.1395 1.9E5 281.1295 1.3E4 286.1080 7.0E4 287.1402 1.8E4 292.7982 2.9E3 293.1500 7.1E4 297.1232 1.5E4 301.1191 9.1E4 313.0395 2.7E3 319.1291 2.0E4 321.6693 2.0E4 330.2166 1.5E4 331.6454 3.0E3 335.6661 1.2E5 336.1650 4.1E3 336.5200 2.3E3 337.1919 5.0E4 349.1917 2.6E4 356.1964 2.3E4 366.2181 4.7E4 386.5891 2.4E3 393.1846 6.5E3 399.4518 2.7E3 410.2083 3.4E4 420.3491 2.3E3 422.2077 2.8E4 436.6751 2.5E3 438.2066 9.3E3 463.2692 2.9E3 466.1956 2.0E4 526.3287 3.2E3 551.8563 2.9E3 584.8535 2.7E3 622.6456 2.8E3 622.8093 3.0E3 END IONS BEGIN IONS FEATURE_ID=282 PEPMASS=219.1020 SCANS=282 RTINSECONDS=327.8 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 42.1203 2.5E3 42.1403 2.2E3 43.0178 1.1E4 43.4445 2.3E3 43.9227 2.3E3 45.0333 2.4E3 49.7784 2.6E3 51.3306 2.8E3 52.0476 2.9E3 53.9318 2.4E3 54.9422 2.3E3 55.9343 9.0E3 56.2739 2.2E3 57.0334 1.2E4 67.0541 6.3E3 69.7909 2.3E3 72.2122 2.1E3 73.0287 2.5E3 73.7407 2.5E3 83.9399 2.6E3 87.3450 2.5E3 91.0540 7.1E4 91.0602 3.4E3 98.6116 2.2E3 103.0541 2.0E4 107.4670 2.4E3 115.0542 5.7E4 116.0618 2.3E4 117.0697 2.1E4 128.0620 6.1E4 129.0589 4.3E3 129.0697 3.5E5 130.0775 2.1E4 131.0489 5.7E4 131.0854 3.1E5 131.0967 5.0E3 131.2455 2.3E3 133.0643 3.4E3 133.1011 3.5E3 137.0597 2.9E4 140.5814 2.2E3 141.0571 1.1E4 141.0697 3.3E5 141.0830 3.5E3 142.0779 4.1E3 142.3540 2.7E3 143.0492 1.7E4 143.0855 2.2E4 144.0568 4.7E4 145.0646 5.0E4 146.0725 4.6E4 148.0519 9.0E3 151.0760 3.1E3 155.0601 4.5E3 156.0366 2.5E3 156.0566 6.0E3 157.0647 1.6E5 158.0584 4.0E3 158.0726 1.9E5 159.0439 1.6E4 159.0804 1.2E5 160.0518 4.5E4 161.0596 1.1E4 161.0960 3.3E4 162.0675 2.9E3 163.0756 1.5E4 168.0571 1.2E4 169.0647 9.9E4 170.0727 6.3E4 171.0803 1.0E4 173.0598 3.7E4 173.0965 1.1E4 173.5192 4.1E3 173.5351 5.5E4 174.0676 7.1E5 174.0851 6.3E3 174.7310 2.5E3 175.0754 5.9E4 183.0793 2.4E3 185.0590 1.0E4 186.0676 1.7E5 187.0760 8.4E3 188.0834 4.5E4 189.0711 5.3E3 189.0910 3.2E5 189.1109 8.3E3 191.1065 7.4E3 195.3443 2.8E3 195.9433 9.6E3 201.0715 3.7E3 201.0912 1.5E5 203.1433 7.9E3 219.1014 2.3E4 219.1748 1.1E4 END IONS BEGIN IONS FEATURE_ID=283 PEPMASS=316.1912 SCANS=283 RTINSECONDS=328.872 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 6 (1 removed due to low quality, 0 removed due to low cosine). 49.4812 2.3E3 53.0388 5.3E3 55.0178 5.6E4 55.1210 4.1E3 56.0499 4.7E3 57.0334 4.3E3 58.0651 3.6E6 58.0680 1.8E4 58.0703 1.6E4 59.8851 2.4E3 61.7118 4.7E3 63.5107 2.5E3 64.3147 2.3E3 67.0542 2.3E4 72.0807 6.4E4 73.5831 2.3E3 77.0389 5.6E3 78.0657 2.5E3 79.0541 2.3E4 79.4075 2.4E3 81.0333 6.8E3 81.0698 1.7E4 83.0492 7.1E3 89.3480 4.5E3 91.0541 4.7E5 91.0593 3.0E3 91.0607 4.7E3 93.0637 7.7E3 93.0696 3.3E5 95.0425 8.7E3 95.0490 3.7E5 97.0647 3.2E4 99.1756 5.4E3 103.0541 1.2E5 103.9797 4.4E3 105.0450 1.1E4 105.0698 4.2E4 107.0404 1.1E4 107.0490 1.0E6 107.0551 5.0E3 107.0576 2.4E4 108.7790 2.5E3 109.0646 3.9E4 115.0542 4.1E4 117.0607 4.3E3 117.0697 7.3E5 117.0778 2.4E3 119.0392 1.5E4 119.0489 9.4E5 119.0580 1.4E4 119.0854 2.5E5 121.0646 9.8E6 121.0729 7.9E4 121.0850 7.1E4 121.0970 7.4E3 123.0440 3.8E4 123.0802 4.9E4 125.0594 9.4E4 129.0698 4.1E4 131.0490 1.6E5 132.0569 1.8E4 133.0282 2.7E4 133.0541 4.1E3 133.0646 3.3E5 134.0361 3.0E3 135.0439 1.1E4 135.0802 1.1E5 136.0515 2.6E4 137.0595 9.9E5 137.0694 4.5E3 137.8884 4.2E3 138.0672 3.2E4 145.0646 1.7E6 145.0748 8.4E3 145.0767 2.2E4 146.0724 6.0E4 147.0446 2.2E4 147.0802 2.5E6 147.0910 1.6E4 149.0460 1.1E4 149.0595 5.3E5 149.0959 9.6E4 150.0677 2.6E4 151.0752 3.0E6 153.0693 8.2E3 153.0911 6.3E4 155.0601 2.2E4 155.0852 1.2E4 157.0646 1.0E5 157.2565 5.1E3 158.0726 2.9E3 159.0802 3.2E4 161.0600 4.2E4 161.0961 3.9E4 162.0673 6.2E4 163.0752 3.5E5 164.0833 2.4E4 165.0698 4.5E4 165.0909 1.6E5 167.0853 1.3E4 167.3284 4.7E3 167.9103 6.0E3 169.0645 4.7E4 169.1027 3.2E3 171.0803 1.1E4 173.0964 2.4E4 173.5233 7.0E3 173.5327 9.1E4 173.5443 1.4E4 175.0754 8.6E3 175.1117 3.6E4 177.0909 3.3E6 177.1048 2.3E4 178.0779 2.8E4 179.0848 6.6E3 181.0648 4.8E4 181.1010 3.6E4 182.0726 1.5E5 183.0622 2.9E3 183.0803 4.9E5 183.1166 3.4E4 185.0964 7.9E3 193.0665 1.4E4 193.1012 2.4E5 194.0724 4.5E3 195.0805 5.9E4 196.0881 1.3E5 197.0599 3.9E4 197.0961 1.3E5 199.0760 2.9E3 201.0912 7.5E3 202.0762 4.6E3 203.0855 6.0E4 206.0724 3.5E4 208.4000 2.3E3 209.0646 4.8E3 209.0962 5.1E4 210.0676 2.4E5 211.0753 3.4E5 211.1117 2.6E6 213.0911 1.2E4 215.1066 8.2E3 217.1014 4.7E3 219.0814 1.5E4 221.0712 6.9E3 221.0961 3.6E5 224.0835 9.1E4 225.0912 3.4E4 225.1273 8.5E4 227.0705 1.6E4 227.1065 1.2E4 229.1226 6.5E3 231.0938 2.2E3 235.1117 2.9E4 237.0909 1.1E5 238.0993 2.0E4 239.1065 2.1E6 239.1284 1.1E4 240.1142 1.8E4 241.0835 9.3E3 242.0936 4.6E5 243.1015 3.9E4 243.1382 4.7E4 247.6753 2.4E3 251.4592 2.7E3 253.1217 1.3E5 256.1092 5.3E4 271.1326 1.6E6 286.5316 5.0E3 316.1905 1.4E5 END IONS BEGIN IONS FEATURE_ID=284 PEPMASS=346.2015 SCANS=284 RTINSECONDS=329.091 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 51.9436 2.6E3 53.2266 2.4E3 54.5931 2.8E3 55.7587 2.1E3 56.9000 2.2E3 58.0649 2.3E5 63.1965 2.6E3 72.1200 2.1E3 82.2531 2.3E3 87.7533 2.5E3 91.0539 3.5E4 103.0540 2.7E3 105.0695 6.4E3 107.0488 1.9E4 109.0647 1.2E4 117.0696 2.8E4 117.2645 2.2E3 119.0489 2.8E4 119.0849 5.4E3 119.6267 2.4E3 121.0645 2.7E4 123.0349 3.9E3 123.0437 1.1E5 123.0537 5.3E3 123.0801 3.0E3 125.0594 5.6E3 131.0490 2.2E4 131.0853 3.5E3 133.0646 9.3E3 134.6060 2.6E3 135.0437 5.5E4 135.0802 2.7E4 136.0520 3.8E3 137.0594 6.9E5 137.0697 6.8E3 139.0749 1.8E4 139.2561 2.3E3 140.7567 2.6E3 145.0645 8.4E4 147.0433 2.5E3 147.0802 8.9E3 149.0594 6.2E4 150.0671 4.0E4 151.0751 2.6E5 151.0892 4.8E3 152.0833 1.1E4 153.0906 2.9E3 157.3542 2.3E3 159.0803 2.7E4 160.0880 3.3E4 161.0597 1.3E4 163.0425 2.9E3 163.0591 3.3E3 163.0752 7.1E5 163.0915 5.1E3 163.0980 3.9E3 164.0829 6.6E4 165.0908 4.7E5 166.0982 1.6E4 167.1076 3.0E3 173.5232 6.8E3 173.5324 2.7E4 173.5409 9.3E3 175.0760 7.8E3 176.0831 1.8E4 177.0911 5.4E4 178.0983 7.0E3 179.1065 4.2E4 189.0902 1.3E4 190.1015 2.6E3 191.1065 1.3E5 192.1141 6.9E3 195.0810 9.7E3 195.1165 1.8E4 199.0747 2.5E3 208.0897 2.5E3 209.0966 6.6E3 212.0833 3.2E3 213.0917 2.7E3 214.3467 2.5E3 223.0752 4.2E3 223.1120 5.3E4 224.3880 2.2E3 226.0983 3.8E3 227.1059 3.9E3 237.0914 7.0E3 240.0779 1.2E4 240.1154 3.2E3 241.0856 3.1E3 241.1224 5.8E4 243.6799 2.4E3 251.1068 4.1E4 252.1143 1.7E4 254.0936 3.2E4 255.1062 1.2E4 255.1379 5.4E4 257.0817 7.5E3 258.0896 6.2E3 269.1174 5.6E4 270.1253 5.8E4 272.1045 1.4E5 273.1124 2.8E3 283.1333 5.9E4 286.1202 7.9E4 294.6582 2.5E3 301.1440 1.7E5 341.8767 2.5E3 346.1998 6.1E3 END IONS BEGIN IONS FEATURE_ID=285 PEPMASS=330.2068 SCANS=285 RTINSECONDS=331.293 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 6 (0 removed due to low quality, 0 removed due to low cosine). 49.0782 3.4E3 49.4218 4.6E3 50.7393 5.0E3 53.0386 1.1E4 53.3624 4.8E3 53.5301 8.4E3 54.8592 2.7E3 55.0179 1.4E5 55.2412 5.6E3 56.5673 2.9E3 57.0335 1.7E4 57.6435 8.6E3 57.9240 4.8E3 58.0448 4.8E3 59.6762 4.9E3 60.0807 2.0E5 61.0828 4.9E3 62.5594 6.1E3 63.6312 5.6E3 64.0734 7.7E3 64.2443 8.2E3 64.3973 9.7E3 67.0542 7.9E4 67.7813 7.0E3 69.0334 2.3E4 71.0801 5.3E3 75.5647 7.6E3 77.0391 5.3E4 79.0542 7.6E4 81.0335 3.4E4 81.0699 6.8E4 83.0492 3.2E4 83.7944 5.7E3 83.8186 7.8E3 87.4388 8.8E3 88.0396 7.7E3 91.0543 1.1E6 93.0637 1.4E4 93.0698 7.5E5 95.0491 1.1E6 95.4283 2.9E3 96.7132 3.1E3 97.0285 2.1E4 97.0648 1.1E5 103.0542 3.3E5 105.0699 1.2E5 107.0405 1.7E4 107.0492 2.7E6 107.0576 6.9E4 109.0648 1.2E5 110.9841 7.3E3 111.0438 5.1E4 115.0546 1.1E5 117.0699 1.9E6 119.0392 6.5E4 119.0493 3.0E6 119.0591 3.6E4 119.0856 7.0E5 119.0953 8.4E3 121.0442 1.4E5 121.0569 8.7E4 121.0648 3.1E7 121.0854 1.7E5 121.0973 1.3E4 123.0441 1.3E5 123.0804 1.4E5 124.1721 7.6E3 125.0597 3.9E5 127.0747 7.1E3 129.0700 9.5E4 131.0492 3.9E5 131.0853 5.1E3 132.0572 5.0E4 133.0285 9.4E4 133.0539 1.6E4 133.0649 9.9E5 134.0363 2.9E4 135.0440 8.4E4 135.0804 3.6E5 136.0521 7.6E4 137.0502 1.2E4 137.0598 3.0E6 137.0696 4.9E3 137.0951 5.8E3 138.0677 8.1E4 141.0701 2.0E4 143.0500 3.6E3 145.0553 1.9E4 145.0649 5.2E6 145.0784 3.8E4 146.0727 1.3E5 147.0450 5.8E4 147.0695 4.6E4 147.0805 9.1E6 147.0910 1.4E4 148.0518 9.0E3 149.0459 6.4E3 149.0598 1.7E6 149.0962 3.2E5 150.0678 8.9E4 151.0606 2.4E4 151.0634 5.3E4 151.0755 1.1E7 151.1035 1.3E4 153.0911 3.3E5 155.0609 3.8E4 155.0851 3.5E4 157.0649 3.0E5 158.0726 9.9E3 158.4466 8.5E3 159.0805 1.4E5 161.0601 1.4E5 161.0962 1.6E5 162.0678 1.7E5 163.0617 1.2E4 163.0756 1.1E6 163.0909 1.8E4 164.0835 6.3E4 165.0696 7.4E4 165.0913 4.7E5 167.0859 6.1E3 169.0647 1.4E5 169.1023 8.7E3 170.0143 4.7E3 171.0802 4.9E4 171.8180 7.7E3 172.0890 8.1E3 173.0964 9.2E4 173.5279 1.4E5 173.5365 7.9E4 173.5451 3.7E4 175.0760 3.3E4 175.1121 1.7E5 176.0830 2.9E4 177.0553 6.7E4 177.0762 7.3E4 177.0913 1.1E7 178.0781 6.6E4 179.0864 3.4E4 181.0650 1.1E5 181.1017 9.7E4 182.0731 3.7E5 183.0628 1.5E4 183.0654 5.2E3 183.0808 1.3E6 183.0996 7.6E3 183.1177 8.5E4 185.0964 7.1E4 185.9556 3.3E3 187.0752 2.0E4 189.0912 7.3E4 190.3433 3.1E3 191.4700 4.9E3 193.0650 7.3E4 193.1015 6.4E5 194.7447 5.5E3 195.0807 1.8E5 196.0886 3.1E5 197.0603 1.3E5 197.0964 4.1E5 200.4731 5.0E3 201.0911 9.4E3 201.1274 1.0E4 203.0859 1.5E5 206.0727 7.1E4 207.0827 5.3E3 207.1174 1.2E4 209.0965 1.4E5 210.0679 6.9E5 211.0758 1.1E6 211.1122 8.6E6 211.1588 1.1E4 213.0917 6.1E4 215.1070 3.8E4 219.0808 5.6E4 220.0889 2.3E4 221.0713 8.6E3 221.0967 1.4E6 222.1038 5.1E4 223.1110 7.0E3 224.0839 2.7E5 225.0910 9.0E4 225.1280 3.3E5 227.0703 3.6E4 227.1070 6.8E4 229.1227 9.4E4 233.4401 1.0E4 235.1122 1.3E5 237.0916 3.6E5 238.0990 7.0E4 239.0501 8.4E3 239.0834 4.6E4 239.1071 8.3E6 239.1283 6.8E3 240.1146 8.6E4 241.0862 5.9E3 241.1175 6.8E3 241.8309 9.5E3 242.0673 4.3E3 242.0942 1.2E6 243.1019 1.7E5 243.1384 1.8E5 253.1228 6.1E5 253.1502 1.5E4 256.1096 1.7E5 257.1786 5.6E3 263.8003 5.3E3 271.1045 3.9E4 271.1335 9.1E6 279.2717 7.3E3 279.3065 8.7E3 284.0741 6.3E3 289.4716 5.1E3 291.4087 5.3E3 330.2071 5.6E5 339.9043 8.3E3 END IONS BEGIN IONS FEATURE_ID=286 PEPMASS=360.2173 SCANS=286 RTINSECONDS=331.996 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 5 (0 removed due to low quality, 0 removed due to low cosine). 52.5957 3.4E3 54.1666 4.1E3 55.0180 2.8E4 57.0335 2.6E4 59.6003 4.7E3 59.6243 4.1E3 60.5372 1.5E4 63.0240 1.4E4 65.0391 1.1E4 65.9969 4.3E3 67.0543 1.6E4 68.6118 3.7E3 69.0335 2.5E4 70.2998 4.7E3 71.0492 7.2E4 73.0648 1.0E5 73.1072 1.4E4 74.5298 1.3E4 75.0440 2.0E5 75.2883 1.4E4 77.0155 1.6E4 77.0394 2.3E4 77.1744 1.6E4 79.0543 1.2E5 79.3055 1.6E4 81.0330 4.2E3 81.0698 1.9E5 82.0854 1.8E4 83.0490 2.5E4 84.2888 1.4E4 85.0645 5.2E3 85.1954 5.2E3 86.7524 1.8E4 90.6566 1.8E4 91.0542 1.5E6 93.0699 7.8E4 95.0490 2.4E5 95.0856 4.9E3 97.0648 6.2E4 100.0380 5.2E3 101.0596 1.1E5 103.0543 2.9E5 105.0699 3.6E5 105.9570 1.6E4 107.0491 8.1E5 107.0857 5.5E4 109.0647 5.7E5 110.1021 1.3E4 111.0441 1.3E5 111.0803 1.0E5 113.0598 1.4E5 115.0544 1.0E5 115.5003 4.5E3 117.0698 1.2E6 119.0403 3.6E4 119.0491 1.2E6 119.0854 3.7E5 121.0647 1.1E6 123.0336 6.4E3 123.0440 4.9E6 123.0535 6.4E4 123.0804 4.1E5 124.0518 2.3E5 125.0507 1.7E4 125.0596 4.1E5 125.0959 4.1E4 131.0491 1.1E6 131.0856 3.5E5 133.0647 4.6E5 133.1017 3.7E4 134.0364 2.5E4 134.0724 2.7E4 135.0440 2.9E6 135.0557 6.3E4 135.0804 1.3E6 136.0521 3.4E5 137.0217 1.5E4 137.0271 5.6E4 137.0354 1.3E4 137.0596 3.5E7 137.0692 5.7E4 137.0843 2.3E5 137.0927 1.3E5 138.0673 1.6E5 139.0752 1.3E6 139.0877 4.7E3 141.0905 9.7E4 141.5199 4.9E3 143.0491 2.7E5 143.0856 4.8E3 144.0574 8.2E4 145.0513 8.4E4 145.0647 4.1E6 145.0783 1.2E4 145.0844 5.2E3 146.0731 6.1E4 147.0440 3.3E5 147.0805 5.2E5 148.0518 8.3E4 149.0233 6.3E3 149.0458 9.7E4 149.0596 3.4E6 149.0739 5.1E4 149.0960 3.0E5 149.1084 2.2E4 150.0675 1.8E6 150.0816 2.5E4 151.0753 1.3E7 151.1119 3.4E5 152.0831 5.9E5 153.0551 3.5E4 153.0704 2.4E4 153.0910 2.0E5 157.0639 6.8E3 159.0805 1.3E6 160.0882 1.2E6 160.5154 1.6E4 161.0598 8.2E5 161.0959 1.8E5 161.1700 1.6E4 162.0676 1.7E5 163.0426 3.1E5 163.0504 4.9E4 163.0753 3.5E7 163.1011 4.9E4 163.1069 3.8E5 164.0670 9.2E3 164.0832 3.4E6 164.0996 4.4E4 165.0576 6.4E4 165.0735 3.0E4 165.0910 2.6E7 165.1240 1.7E4 166.0769 1.7E4 166.0803 1.6E4 166.0989 9.4E5 167.0712 1.2E5 167.0859 1.9E5 167.1067 4.4E5 171.0804 2.4E5 172.9572 1.5E4 173.0600 2.0E5 173.5242 1.3E5 173.5391 1.9E5 174.0676 9.1E4 175.0756 6.0E5 176.0833 9.2E5 177.0544 1.3E5 177.0735 9.9E3 177.0911 3.0E6 177.1047 1.5E4 178.0984 4.5E5 179.0703 8.6E4 179.0893 2.0E4 179.1067 1.9E6 180.0940 3.6E4 181.0651 1.4E5 181.1014 1.7E4 183.0818 6.0E3 185.0963 4.0E4 187.0761 5.5E4 188.0832 5.2E4 189.0911 5.3E5 190.0987 1.8E5 191.0675 2.5E4 191.0906 7.6E4 191.1067 6.6E6 191.1226 8.2E3 191.1353 5.1E4 192.1144 4.1E5 194.0729 1.4E5 195.0806 6.4E5 195.1169 8.9E5 197.0610 8.2E3 197.0950 2.6E4 198.0681 2.8E4 199.0756 3.5E5 199.1132 1.7E4 201.0911 2.0E5 202.0981 2.0E4 203.1072 1.1E5 205.0835 2.3E4 205.1017 8.0E4 208.0883 2.3E5 209.0962 3.3E5 209.1316 2.3E4 211.0757 1.3E5 212.0835 3.3E5 213.0550 5.4E3 213.0912 4.6E5 213.1274 1.2E5 215.1070 2.0E5 216.1159 1.5E4 217.0845 1.7E4 218.0731 4.8E4 219.0808 1.4E5 220.0890 5.4E4 221.0953 5.4E4 222.0671 1.1E5 223.0743 2.1E5 223.1119 3.1E6 223.1370 3.9E4 224.0833 5.3E4 224.1196 2.8E5 225.0919 1.3E5 225.1289 2.8E4 226.0988 3.0E5 227.0696 9.5E4 227.1069 4.2E5 229.0857 1.5E4 229.1213 7.7E3 231.1401 2.7E4 233.0961 1.9E5 234.1039 8.7E4 236.0831 3.2E5 237.0911 3.6E5 237.1278 7.7E4 238.0987 6.5E4 239.0699 1.3E5 239.1069 1.5E5 240.0782 6.4E5 240.1144 2.4E5 241.0865 4.7E5 241.1223 3.4E6 241.1505 3.4E4 242.0941 1.4E5 243.1016 3.5E4 245.1174 3.5E4 245.1522 2.4E4 250.0981 2.4E4 251.0764 3.0E4 251.1065 2.4E6 251.1291 4.9E3 251.1370 6.2E3 252.1144 9.4E5 253.0869 9.7E4 253.1229 1.3E5 254.0937 1.8E6 254.1248 8.0E3 255.1022 6.5E5 255.1378 3.5E6 257.0807 3.7E5 257.1109 8.8E3 258.0885 2.9E5 259.0982 1.6E4 259.1332 5.7E4 265.1224 2.8E5 267.1021 1.5E4 268.1096 5.4E5 269.1171 3.4E6 269.1440 1.2E4 270.1250 2.8E6 270.1514 3.6E3 271.0962 3.8E5 271.1276 3.7E4 272.1043 6.0E6 272.1318 8.3E3 273.1121 3.9E5 273.1485 3.9E5 283.1330 3.9E6 286.1200 5.4E6 286.1587 5.9E3 301.0636 2.3E4 301.1435 1.5E7 301.2227 2.8E4 360.2163 5.3E5 END IONS BEGIN IONS FEATURE_ID=287 PEPMASS=358.2018 SCANS=287 RTINSECONDS=332.282 CHARGE=1+ MSLEVEL=2 MERGED_STATS=9 / 9 (0 removed due to low quality, 0 removed due to low cosine). 53.2053 2.3E3 53.2745 2.2E3 54.3296 2.2E3 55.0178 2.2E4 63.0243 2.3E3 64.7733 2.3E3 65.0690 2.7E3 65.2348 2.6E3 66.0332 2.2E3 66.5202 2.7E3 67.8678 2.4E3 69.0333 3.1E4 72.9375 2.7E3 77.6556 2.2E3 78.1121 2.5E3 79.8587 2.8E3 80.1455 2.3E3 81.0333 3.6E3 83.0488 1.9E4 85.7991 2.5E3 86.0963 7.4E3 91.0542 3.6E4 91.9367 2.4E3 95.0488 3.6E3 95.4944 2.3E3 95.5795 2.1E3 98.4981 2.9E3 100.3276 2.5E3 103.0097 2.4E3 103.0550 3.0E3 105.0697 1.3E4 107.0488 1.1E4 115.0542 1.6E4 115.6635 2.6E3 117.0697 8.6E4 119.0853 7.3E3 120.5290 2.3E3 121.0645 1.4E5 122.9545 2.9E3 126.5052 2.6E3 131.0493 9.8E3 133.0647 1.0E4 134.0723 1.7E4 134.3362 2.5E3 135.0441 1.7E4 135.0803 1.4E4 136.8904 2.6E3 137.6474 2.6E3 139.2632 2.3E3 139.9684 2.7E3 142.6139 2.3E3 145.0644 5.0E4 146.0724 3.7E5 147.0450 3.6E3 147.0803 6.6E4 149.0595 4.5E4 149.0960 4.9E4 150.0669 2.7E3 151.0386 7.2E3 151.0751 1.2E5 161.0597 3.4E4 161.3965 2.6E3 162.0675 2.1E5 163.0608 7.5E3 163.0753 5.7E5 163.0913 3.7E3 164.0827 3.2E4 165.0909 2.6E5 165.1772 2.3E3 167.5145 2.5E3 173.5218 1.4E4 173.5340 1.1E5 173.5415 9.3E3 174.0672 5.3E3 175.0753 4.2E4 177.0345 3.9E3 177.0548 7.1E4 177.0910 1.5E7 177.1048 4.0E4 177.1191 5.0E4 177.1276 6.8E4 177.1378 7.9E3 177.2350 2.5E3 177.5266 2.4E3 178.0797 2.4E3 178.0986 4.2E4 179.0697 2.7E3 179.0869 9.7E3 179.1068 2.3E4 181.6611 3.0E3 187.0760 2.6E3 188.0831 3.6E4 189.0912 9.4E4 190.0988 1.5E5 193.0857 1.7E4 195.0813 3.5E3 196.0878 6.8E3 197.0962 2.7E4 198.1038 1.6E4 199.1117 2.9E3 200.0829 1.2E4 201.0912 1.1E5 202.0990 2.3E4 203.1067 2.4E4 205.0856 3.0E3 207.0799 8.0E3 208.3153 2.5E3 209.0964 1.4E4 211.0756 2.2E4 211.1128 3.4E4 212.0841 9.6E3 212.1199 1.5E5 213.0912 2.9E4 214.0991 4.0E4 214.6382 3.1E3 215.1071 5.3E4 221.0968 2.3E4 222.1043 6.2E4 222.1488 2.7E4 223.0757 1.4E4 224.0829 2.5E4 225.0911 6.2E4 226.0989 3.2E3 227.0701 2.6E3 227.1066 4.4E4 228.1147 9.0E4 228.8248 2.5E3 229.1224 9.1E4 234.5801 2.6E3 235.0745 1.5E4 238.0993 7.9E4 239.1067 1.1E5 240.1145 1.1E5 241.0862 1.2E5 241.1168 8.2E3 242.0934 5.5E4 243.1039 1.7E4 243.1382 4.8E5 249.0908 2.3E4 250.0991 7.0E4 251.0697 1.4E4 252.0793 7.9E3 253.0861 1.0E5 253.1224 1.3E5 255.1018 3.1E4 256.0782 1.0E4 256.1095 5.9E5 256.1389 6.6E3 266.0937 3.4E4 267.1015 6.9E4 268.1093 1.1E5 269.0809 7.3E4 270.0895 9.8E3 271.1333 5.2E5 281.1179 6.0E4 284.1049 2.7E5 299.1288 2.8E5 330.2069 1.8E5 335.9919 2.4E3 338.9789 2.7E3 349.7947 2.5E3 355.5294 3.0E3 358.2016 9.9E4 END IONS BEGIN IONS FEATURE_ID=288 PEPMASS=359.2057 SCANS=288 RTINSECONDS=332.618 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 5 (0 removed due to low quality, 0 removed due to low cosine). 51.7463 2.2E3 53.6800 2.3E3 54.5964 2.2E3 58.7645 2.3E3 59.8168 2.7E3 60.0563 2.3E3 66.1762 2.1E3 69.9528 2.3E3 78.4305 2.2E3 83.8429 2.5E3 90.2414 2.8E3 103.5202 2.2E3 107.0490 2.7E3 108.7204 2.3E3 117.0696 6.4E3 117.3530 2.6E3 117.5241 2.4E3 118.4787 2.8E3 121.0645 1.4E4 121.5842 2.3E3 123.0433 2.7E3 126.7945 2.4E3 133.5957 2.8E3 135.0804 2.5E3 136.8670 2.1E3 137.0595 3.8E4 146.0721 3.3E4 147.0767 2.4E4 149.6860 5.1E3 151.0748 2.3E4 152.0785 3.4E3 154.2136 2.3E3 154.9753 2.7E3 155.6477 2.3E3 162.0669 1.7E4 163.0749 1.2E5 164.0811 7.4E4 165.0909 5.3E4 166.0947 2.0E4 173.5311 5.5E4 173.5413 1.1E4 177.0735 5.0E3 177.0910 1.3E6 178.0947 1.4E6 179.1043 4.9E3 189.0895 6.1E3 190.0985 1.2E4 191.1047 1.3E4 200.8581 2.7E3 201.0905 9.2E3 202.0954 1.1E4 212.1197 3.4E3 213.1238 1.7E4 214.2810 3.0E3 215.1031 3.0E3 216.1098 5.1E3 221.7300 2.6E3 222.1492 1.0E5 223.1112 2.9E3 225.0904 5.8E3 226.0974 2.3E3 229.1203 1.3E4 230.1256 5.8E3 239.1039 1.1E4 240.1109 1.7E4 241.1186 1.3E4 242.0904 1.8E4 243.1382 1.8E4 244.1416 5.5E4 251.1039 1.3E4 253.9310 2.3E3 254.0906 9.6E3 254.1251 1.1E4 256.1095 1.8E4 257.1128 6.9E4 267.0988 2.8E3 268.1062 7.8E3 269.0787 2.9E3 269.1134 1.9E4 269.3647 2.5E3 270.0869 3.2E3 271.0937 3.6E3 271.1327 1.7E4 272.1050 7.3E3 272.1369 7.0E4 282.1220 3.4E3 284.1042 7.3E3 285.1095 3.9E4 300.1316 4.7E4 301.1442 1.3E4 327.6346 2.3E3 331.2104 2.2E4 359.2055 1.6E4 END IONS BEGIN IONS FEATURE_ID=289 PEPMASS=303.0746 SCANS=289 RTINSECONDS=334.418 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 5 (0 removed due to low quality, 0 removed due to low cosine). 53.9307 2.1E3 54.7840 2.6E3 55.0763 2.2E3 55.3180 2.1E3 56.2132 2.9E3 57.4545 2.2E3 60.6842 2.6E3 60.8891 2.6E3 63.1142 2.1E3 66.6551 2.5E3 67.2028 2.2E3 68.7786 2.2E3 72.6801 2.2E3 80.9999 2.7E3 83.3410 2.3E3 83.8232 2.5E3 86.6664 2.4E3 88.6826 2.5E3 89.1582 2.6E3 96.0994 2.3E3 102.1078 2.3E3 125.0607 2.2E3 150.1905 2.4E3 151.8699 2.2E3 165.7023 2.7E3 173.5227 1.9E4 173.5328 1.3E4 173.5407 3.1E4 180.9240 2.6E3 210.1628 3.0E3 266.5216 2.4E3 278.5314 2.5E3 294.2906 2.7E3 303.0742 2.0E5 303.1116 4.2E3 307.4630 2.2E3 312.0676 2.3E3 END IONS BEGIN IONS FEATURE_ID=290 PEPMASS=281.0925 SCANS=290 RTINSECONDS=334.467 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 8 (2 removed due to low quality, 0 removed due to low cosine). 49.3715 2.3E3 51.2417 2.0E3 54.4645 2.3E3 55.0150 3.3E3 55.0178 2.2E5 55.7283 2.1E3 56.8594 2.4E3 57.7968 2.2E3 58.0134 2.4E3 59.5280 2.5E3 63.2727 2.6E3 63.2742 1.3E4 66.4625 2.4E3 66.6341 2.7E3 67.0542 1.7E4 67.3609 2.2E3 69.1340 2.2E3 70.2726 3.0E4 70.2749 4.7E3 70.8760 2.2E3 71.3171 2.6E3 72.1629 2.2E3 74.3562 2.4E3 78.7379 2.6E3 79.0542 2.8E3 80.0494 4.0E4 81.0334 1.5E4 83.2220 2.5E3 85.2666 2.6E3 87.2006 2.3E3 94.0289 1.0E4 94.0651 2.8E3 94.4701 2.5E3 95.0425 3.3E3 95.0490 2.5E5 96.0444 1.3E4 96.8866 2.0E3 100.9975 2.6E3 103.1777 2.9E3 104.0494 5.0E4 104.0560 2.7E3 106.5320 2.4E3 107.0490 6.2E4 108.9638 2.3E3 117.6101 2.6E3 118.0625 2.3E3 119.0603 2.6E4 120.0444 4.7E4 121.0519 2.3E3 122.0600 3.7E4 123.0440 3.4E4 124.0120 2.6E3 130.0652 5.2E3 132.0444 4.1E5 132.0557 4.3E3 133.0522 4.7E4 134.0602 1.1E4 136.0020 3.0E3 142.8289 2.5E3 143.0607 1.5E4 146.0026 2.3E3 146.0600 5.1E4 147.0552 1.1E5 147.2693 3.0E3 148.0392 5.1E4 148.0624 3.5E3 149.0475 6.5E3 150.0550 5.0E4 156.0682 3.6E4 156.0811 1.5E4 157.0762 1.3E4 158.0600 3.8E4 159.0553 4.1E5 159.0691 3.8E3 168.0810 6.4E3 169.8691 2.6E3 170.0594 1.4E4 171.0379 3.6E3 171.0554 5.3E5 171.0723 8.6E3 172.0631 1.7E5 173.5261 2.7E4 173.5359 4.5E4 174.0556 2.5E3 175.0519 2.9E3 180.0809 6.4E4 182.0838 4.9E4 183.0734 4.2E3 183.0918 1.7E5 184.0762 4.3E4 185.0709 3.0E4 186.0554 4.6E4 186.1410 2.5E3 193.0755 3.7E3 194.0590 5.8E3 195.0921 6.2E3 196.0621 2.7E3 197.0712 3.2E4 197.1073 1.5E5 198.0764 1.2E4 198.0932 8.7E3 199.0502 3.5E3 199.0865 7.5E4 206.0835 9.9E3 207.0721 2.6E3 207.0918 1.2E5 208.0760 2.8E5 208.0984 1.1E4 209.0712 1.3E5 210.0607 6.8E3 210.0790 6.4E5 210.1016 1.0E4 211.0868 2.3E6 213.0664 1.4E4 221.0674 2.9E3 222.0778 6.9E3 223.0867 5.0E4 224.0723 2.2E4 224.0944 7.5E4 225.0645 4.2E4 225.0735 3.8E3 225.1025 1.5E6 225.1285 9.1E3 226.0866 2.3E4 235.0595 9.3E3 235.0867 5.4E5 235.1122 4.7E3 236.0707 2.4E5 236.0940 3.5E4 238.0737 3.1E5 239.0815 3.8E4 246.0787 4.3E3 251.0816 3.3E4 252.0645 2.0E4 252.0907 3.2E4 253.0343 1.7E4 253.0746 2.9E4 253.0972 5.9E6 253.1473 4.4E3 253.1588 4.1E4 254.0772 2.8E3 263.0815 1.8E5 264.0625 7.2E3 264.0903 1.5E4 266.0684 6.2E3 280.9985 4.2E3 281.0199 4.0E4 281.0339 1.0E4 281.0923 7.9E6 281.1504 6.4E3 281.1643 3.1E4 281.1858 7.2E3 END IONS BEGIN IONS FEATURE_ID=291 PEPMASS=313.0824 SCANS=291 RTINSECONDS=334.601 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 48.6851 2.3E3 51.0819 2.2E3 53.9695 2.1E3 54.4947 2.1E3 54.7005 2.3E3 56.6812 2.2E3 57.3295 2.6E3 63.2579 2.9E3 64.4254 2.2E3 66.0521 2.5E3 69.4306 2.5E3 77.5741 2.3E3 80.0493 8.4E3 84.4237 2.2E3 89.3877 2.3E3 92.9952 2.5E3 104.0322 2.6E3 114.6580 2.5E3 116.5589 2.1E3 120.0439 2.7E4 122.4889 2.4E3 132.0442 6.8E3 136.0393 1.6E4 138.0547 1.3E5 138.9747 2.4E3 140.8524 2.4E3 141.6575 2.2E3 144.6192 2.6E3 144.8528 2.4E3 148.0389 2.8E5 148.0530 2.4E3 148.8247 2.2E3 149.0467 1.1E4 150.0548 4.4E4 151.0388 5.2E3 160.8630 2.6E3 163.9288 2.3E3 164.0341 2.2E5 165.0420 5.1E4 165.0559 2.9E3 166.0500 8.3E3 173.5280 3.2E4 173.5388 1.9E4 186.4388 2.4E3 190.0507 3.4E3 198.0186 2.5E3 203.8834 1.3E4 205.7709 2.7E3 205.8996 6.2E3 211.0865 1.8E4 212.0707 1.1E4 219.8402 2.3E3 221.0706 5.4E3 222.0547 1.6E4 223.8292 2.5E3 224.0710 1.2E4 239.0815 1.8E5 240.0650 3.3E4 249.0660 4.2E4 250.0491 1.2E4 252.0658 2.4E4 257.0914 4.6E3 263.2530 2.4E3 267.0763 2.6E5 268.0604 8.0E4 268.1491 2.7E3 268.2787 3.1E3 277.0612 7.6E4 278.0444 2.2E4 285.0871 2.5E5 285.1228 3.7E3 295.0716 1.7E5 313.0818 5.4E4 END IONS BEGIN IONS FEATURE_ID=292 PEPMASS=640.2620 SCANS=292 RTINSECONDS=335.814 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 5 (0 removed due to low quality, 0 removed due to low cosine). 68.1493 3.0E3 69.4616 2.1E3 70.0649 7.0E5 70.0689 4.1E3 70.7526 2.4E3 72.5076 2.4E3 74.0090 2.4E3 74.4105 2.2E3 78.4245 2.3E3 80.0798 2.2E3 82.3174 2.1E3 84.0442 5.4E4 88.4650 2.4E3 91.0540 1.7E4 92.3472 2.8E3 97.0759 2.8E3 97.4677 2.3E3 99.0718 2.3E3 102.0548 1.3E4 111.9903 2.5E3 115.0862 3.2E4 118.0649 8.0E4 119.0729 7.8E3 120.0807 7.2E4 125.0707 2.2E4 130.0655 2.5E3 133.0289 2.3E3 134.0450 2.6E3 136.0757 2.2E4 137.0707 6.8E4 139.0863 2.0E4 146.0469 2.9E3 146.0598 6.6E5 153.0894 1.0E5 155.0819 5.7E3 157.0969 6.3E5 157.1081 3.9E3 157.1123 9.9E3 163.2595 2.4E3 164.0702 1.5E4 164.0836 4.1E3 165.0542 4.3E3 165.0889 3.0E3 165.1924 2.9E3 166.0972 2.4E3 167.0820 4.8E3 168.0892 2.0E4 172.1122 3.3E4 173.5257 4.3E4 173.5370 4.8E4 180.8919 2.4E3 181.7355 2.6E3 182.0812 4.5E4 183.1000 8.0E3 184.1082 1.0E4 185.0922 1.2E5 187.1229 3.0E3 199.1245 4.4E3 204.1026 9.1E3 210.4073 2.5E3 215.1178 1.1E4 216.1258 5.4E4 217.1337 6.0E4 224.1039 1.9E4 225.1015 4.4E3 229.0971 9.2E3 236.1071 3.8E4 243.1127 4.7E4 245.0940 2.7E3 245.8321 2.7E3 247.1078 1.0E5 254.1280 1.1E4 256.1440 9.5E3 258.1236 8.9E3 264.1018 1.2E4 265.0857 2.4E4 266.1281 1.2E4 268.1448 1.6E4 270.1128 2.2E4 273.0873 1.1E5 275.1028 1.3E5 282.1148 8.3E4 284.1399 4.1E4 286.1556 2.2E5 291.0975 1.4E4 293.1135 1.0E5 294.1240 4.8E4 300.1348 1.2E5 301.0825 1.3E4 302.1155 6.7E3 303.0990 2.9E3 312.1348 1.4E5 319.0919 1.2E4 330.1454 4.8E5 331.1526 2.1E4 347.1391 4.7E4 356.5707 2.5E3 357.1223 1.6E4 381.1449 4.6E4 393.0888 2.6E3 393.1443 4.4E4 399.1554 2.1E4 410.1704 7.6E3 424.3916 2.8E3 435.2497 2.9E3 438.1656 1.5E4 456.1763 3.0E4 484.1705 2.7E4 507.2225 1.8E4 511.2180 1.3E4 525.2303 6.2E3 535.2188 4.5E3 553.2280 2.0E4 577.5272 3.0E3 579.2559 2.5E3 622.2517 7.6E4 END IONS BEGIN IONS FEATURE_ID=293 PEPMASS=489.2237 SCANS=293 RTINSECONDS=340.042 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 4 (1 removed due to low quality, 0 removed due to low cosine). 58.9348 2.4E3 62.2615 2.4E3 64.0988 2.1E3 64.4226 2.4E3 71.6751 2.4E3 73.9159 2.4E3 76.9449 2.2E3 79.5489 2.3E3 89.2628 2.3E3 90.1172 2.1E3 91.0543 4.3E3 97.1915 2.4E3 104.8800 2.2E3 111.5135 2.3E3 116.0702 2.8E3 119.0486 2.7E3 129.7286 2.1E3 137.0480 4.5E3 137.0595 1.6E5 137.0715 5.4E3 143.6977 2.5E3 147.0443 3.3E3 147.2504 2.8E3 158.1307 2.2E3 159.0761 8.7E3 162.0675 2.5E4 163.0388 4.8E3 163.0743 3.1E3 173.5216 1.5E4 173.5381 4.1E4 175.0382 3.1E3 177.0553 2.7E3 178.0626 2.0E4 180.1024 5.5E3 189.0549 1.7E4 189.9072 2.4E3 190.0624 1.9E5 191.0337 3.4E4 191.0698 1.3E4 192.0811 3.3E3 192.1018 5.1E5 192.1222 4.2E3 193.0859 1.7E5 206.0573 6.7E4 221.0303 1.4E4 221.0808 3.7E6 221.1204 1.2E4 221.1320 1.2E4 222.0847 8.2E3 223.0867 4.0E3 251.1390 1.9E4 252.1228 3.0E4 269.1494 2.5E4 290.1395 2.6E3 295.1293 1.6E4 297.3160 2.2E3 336.1440 4.5E5 336.1798 2.3E3 353.1710 3.5E3 370.0054 2.6E3 387.2316 2.5E3 403.3070 2.2E3 404.2116 2.3E3 413.1259 2.6E3 472.1961 1.2E4 489.2233 3.7E4 END IONS BEGIN IONS FEATURE_ID=294 PEPMASS=490.2803 SCANS=294 RTINSECONDS=340.458 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 59.0490 2.3E3 59.6247 2.3E3 59.6644 2.4E3 60.9198 2.4E3 61.8592 2.3E3 70.4001 2.3E3 71.0126 2.6E3 71.0491 1.9E4 73.0283 6.7E4 74.7387 2.5E3 75.0438 2.6E5 83.0491 1.9E4 85.0282 7.6E4 87.0441 1.4E4 87.2511 2.4E3 95.0494 5.9E3 99.0438 4.0E3 101.0595 1.3E4 103.2380 2.6E3 105.0696 2.2E3 105.9946 2.6E3 107.0490 4.9E4 111.0440 2.2E4 113.0599 3.1E3 116.4025 2.2E3 119.0492 1.7E4 119.0853 8.7E3 121.0646 3.7E5 123.0801 6.9E3 125.0596 1.5E4 126.2751 2.2E3 129.0543 2.1E4 131.0499 2.6E3 133.0646 3.0E4 135.0803 3.2E4 135.5839 2.4E3 136.8827 2.3E3 137.0597 3.1E4 138.0634 4.5E3 139.0752 4.3E4 139.8260 2.9E3 140.9075 2.5E3 141.0908 8.2E3 145.0646 3.3E4 147.0803 2.3E5 149.0597 9.0E3 149.0962 8.5E3 150.0681 7.7E3 151.0752 1.2E5 152.0832 2.8E3 159.0804 1.7E4 161.0960 4.4E4 163.0753 1.4E5 163.0892 4.6E3 165.0910 2.6E5 167.1064 8.5E3 173.0958 9.7E3 173.5209 1.7E4 173.5384 6.2E4 177.0912 5.0E4 179.1062 1.2E4 180.3907 3.0E3 183.0810 8.4E3 184.3380 2.3E3 190.0624 1.8E4 191.0665 9.3E3 191.1067 7.2E4 192.1019 6.3E4 193.0859 1.7E4 193.1053 4.1E4 194.0898 9.0E3 196.0884 2.9E3 197.0965 1.3E4 206.0576 6.4E3 207.0608 3.6E3 208.7045 2.9E3 221.0808 3.9E5 222.0844 3.7E5 222.1065 3.5E3 224.0830 9.8E3 225.0907 9.1E3 225.1028 3.1E3 225.1274 1.0E5 238.0996 1.1E4 239.1064 3.0E3 251.1389 2.3E3 253.1221 1.5E5 254.1303 1.3E4 256.1093 3.2E4 257.1176 7.9E3 257.1532 8.9E3 267.1383 1.7E4 269.1472 2.7E3 270.1251 1.5E5 270.1572 4.6E3 283.1327 1.4E4 285.1487 1.5E6 309.1481 1.3E4 313.1426 9.5E3 327.1598 1.1E4 336.1439 2.6E4 337.1474 6.4E4 342.0614 3.0E3 344.2219 1.2E5 365.6527 2.4E3 369.1689 6.6E3 377.1728 3.4E3 402.2407 2.4E3 431.2062 3.8E3 490.2788 7.6E4 END IONS BEGIN IONS FEATURE_ID=295 PEPMASS=449.1713 SCANS=295 RTINSECONDS=343.374 CHARGE=1+ MSLEVEL=2 MERGED_STATS=10 / 10 (0 removed due to low quality, 0 removed due to low cosine). 56.8865 2.2E3 61.5913 2.2E3 63.0213 2.3E3 63.1722 2.4E3 63.2375 2.4E3 63.7944 2.7E3 64.0086 2.7E3 64.3667 2.7E3 64.8398 2.4E3 65.9281 2.9E3 67.7377 2.6E3 68.3698 2.4E3 68.8276 2.3E3 69.0293 2.1E3 71.5907 2.3E3 72.8398 3.1E3 75.6297 2.1E3 76.4784 2.1E3 76.9358 2.7E3 77.5969 2.2E3 79.0628 2.5E3 82.1275 2.4E3 84.6071 2.2E3 85.7695 2.3E3 87.5895 2.3E3 89.6842 2.5E3 91.4467 2.2E3 94.2329 2.1E3 96.3736 2.6E3 97.6466 2.4E3 97.9765 2.4E3 102.1087 2.8E3 107.0488 6.6E5 108.0442 1.7E4 108.5198 2.3E3 115.0543 2.3E3 118.7922 2.4E3 121.0649 1.7E4 123.1134 2.3E3 124.0252 2.6E3 125.5591 2.5E3 126.0547 4.8E4 129.4279 2.3E3 130.7923 2.4E3 135.0020 2.3E3 135.1574 2.5E3 136.5994 2.3E3 137.0594 1.1E5 141.0617 2.6E3 142.0237 2.3E3 142.4675 2.2E3 142.5887 2.3E3 143.0490 6.5E4 145.0646 1.1E5 146.4007 2.5E3 151.0752 6.0E4 152.0340 2.4E4 154.0352 1.8E4 154.0495 1.0E6 154.0621 7.4E3 161.5772 2.5E3 163.0752 3.8E4 164.0340 3.4E5 165.0420 2.4E4 167.0126 2.7E3 173.4472 2.4E3 173.5256 7.0E4 173.5374 1.0E5 175.0596 3.6E3 175.0752 2.5E5 177.0902 2.8E3 178.0861 8.8E5 178.1029 6.7E3 179.8894 2.7E3 180.9076 2.6E3 181.0610 5.3E4 184.3201 2.6E3 187.6048 2.3E3 188.7827 2.5E3 189.6194 2.7E3 190.0861 5.3E4 191.0951 2.2E3 195.0510 2.6E3 196.8514 2.4E3 197.1020 2.7E3 209.0961 5.3E4 215.4249 2.2E3 219.0814 2.5E3 222.9476 2.4E3 226.3041 2.5E3 237.0909 2.2E5 241.0857 2.9E3 250.5495 2.6E3 256.8345 2.4E3 269.0849 5.0E3 269.1171 7.0E5 277.6017 3.4E3 286.1438 2.4E5 294.7574 3.0E3 297.2988 2.2E3 298.1441 9.8E4 299.1522 2.6E3 303.3109 2.6E3 307.0809 2.4E3 321.8969 2.6E3 324.4569 2.4E3 337.0715 2.4E3 338.8180 2.6E3 346.9269 2.4E3 374.2140 2.5E3 376.6181 2.4E3 379.4111 2.2E3 386.7341 2.6E3 426.4266 2.5E3 431.1503 2.7E3 449.1707 5.9E5 449.2794 8.4E3 END IONS BEGIN IONS FEATURE_ID=296 PEPMASS=303.1080 SCANS=296 RTINSECONDS=343.714 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 52.4894 2.2E3 55.0178 2.9E3 55.0539 6.6E3 57.0334 3.7E3 58.6019 2.4E3 60.9212 2.4E3 64.9449 2.2E3 66.3989 2.6E3 67.0540 8.2E3 67.5835 2.4E3 78.3871 2.1E3 79.0539 4.1E4 81.0696 1.3E4 82.1676 2.2E3 83.9950 2.3E3 89.9544 2.7E3 91.0541 1.7E4 91.9983 2.3E3 93.0696 3.0E4 94.3439 2.5E3 97.1009 6.1E3 100.8975 2.2E3 107.0490 1.5E4 107.0851 5.5E4 111.0801 1.5E4 117.0695 3.1E4 119.2360 2.5E3 119.5576 2.5E3 121.0642 4.1E3 123.5020 2.1E3 125.0958 3.0E4 127.4313 2.2E3 135.0802 1.3E5 141.8241 2.5E3 145.0647 6.4E3 153.0907 1.1E5 155.2177 2.5E3 163.0751 2.6E4 173.5221 4.2E3 173.5361 3.5E4 181.0859 1.1E5 182.7056 2.6E3 190.0052 2.5E3 252.5941 2.5E3 265.1013 2.4E3 END IONS BEGIN IONS FEATURE_ID=297 PEPMASS=427.1802 SCANS=297 RTINSECONDS=346.262 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 6 (0 removed due to low quality, 0 removed due to low cosine). 81.0445 9.8E3 82.0525 3.7E3 83.0600 5.2E4 85.0394 3.9E3 86.0961 1.3E6 86.1022 6.5E3 86.1053 8.6E3 87.0994 2.2E4 88.0390 8.2E4 91.0538 2.7E4 93.0444 1.7E4 93.1521 2.3E3 95.0601 3.0E4 96.8882 2.7E3 97.7586 2.5E3 98.7541 2.2E3 101.0596 5.2E3 105.8668 2.2E3 106.0647 3.5E3 107.0487 2.4E4 110.0709 8.3E5 110.0793 5.1E3 110.0838 4.7E3 111.0439 1.9E4 111.0746 1.4E4 115.3928 2.5E3 118.0649 2.0E4 119.0163 2.4E3 119.0489 3.0E4 119.0728 6.6E3 119.1306 2.5E3 120.0546 3.3E3 120.0805 3.7E4 121.2741 2.5E3 122.0600 2.7E3 122.0703 4.7E3 123.0440 1.3E4 125.1066 3.1E3 129.0540 5.3E3 130.0647 1.4E4 131.0487 5.4E4 134.0499 2.9E3 134.0597 1.0E5 135.0437 5.9E3 135.0674 2.9E4 135.0781 2.9E3 136.0501 7.6E4 136.0754 2.6E5 136.9750 2.6E3 137.0785 2.4E3 138.0658 1.3E4 138.9815 2.3E3 141.1008 6.7E3 146.0595 6.7E4 150.0651 6.2E3 155.0926 4.1E4 160.0385 4.2E3 162.0400 3.8E3 162.0547 2.3E5 162.4612 2.4E3 163.0582 5.2E3 164.0452 1.5E5 164.0688 3.1E3 165.0547 4.0E4 165.0770 2.9E4 166.0610 1.6E4 166.5758 2.5E3 167.0926 2.5E4 172.0757 3.7E3 173.0714 4.0E3 173.5214 9.2E3 173.5289 8.2E4 173.5404 2.9E4 174.0544 1.1E4 174.0710 2.5E3 174.1277 1.0E4 174.3013 2.5E3 178.0607 6.1E4 178.1352 2.6E3 178.3630 2.5E3 179.0824 2.6E3 181.0717 2.2E4 182.0569 2.8E3 182.0808 1.9E4 183.0795 2.6E3 184.6073 3.1E4 184.6231 2.3E3 186.1273 9.1E3 186.5827 2.4E3 188.0697 3.8E3 188.1430 3.3E4 190.1226 1.7E4 193.0718 4.6E4 193.1685 2.3E3 195.0875 1.3E5 198.0550 1.6E4 198.1025 3.6E4 201.6745 2.5E3 202.2653 2.4E3 205.0723 5.3E3 205.0963 3.1E3 206.0786 2.3E3 210.1032 2.0E4 211.0756 6.5E3 212.1180 8.7E4 213.7658 3.2E3 214.0990 2.0E4 214.1226 3.9E4 216.0661 2.4E4 216.9616 2.7E3 217.0613 2.2E4 219.0749 2.6E3 221.0670 4.0E4 222.0962 3.3E3 223.0773 2.9E3 224.1072 9.3E3 226.0967 5.5E3 228.1130 7.0E4 231.1485 9.5E3 232.1567 9.7E3 235.0822 4.3E3 236.6199 8.5E3 237.1128 2.7E3 238.0970 6.6E4 240.0583 2.4E3 240.1020 2.0E5 241.1075 7.3E3 242.1178 3.0E3 243.1212 3.3E3 244.0996 2.6E3 248.8680 2.5E3 249.0871 2.6E4 250.0867 8.8E3 250.6183 5.4E3 252.1025 2.6E3 254.0912 1.0E4 255.1237 2.3E5 256.1070 2.3E4 259.0710 9.4E4 259.1439 7.8E4 264.1086 2.7E4 265.1063 7.3E3 266.0930 1.4E4 267.0991 6.3E3 268.0980 1.2E4 269.0922 8.4E3 271.1182 2.9E4 273.1352 4.6E4 275.0678 4.4E3 277.0823 1.1E5 278.7834 2.9E3 279.0763 5.0E3 279.1133 3.5E4 280.0840 5.8E3 282.0875 1.6E4 283.1191 2.2E5 284.1234 1.4E4 286.1075 8.3E4 288.0998 1.3E4 289.1055 3.0E3 291.1566 2.4E3 293.1040 3.0E3 296.0912 2.8E3 297.1004 3.1E4 298.1079 5.7E3 299.1141 2.8E5 300.1162 9.7E3 302.0954 8.6E3 310.1148 2.2E4 311.1112 3.0E4 312.1458 2.6E3 313.1301 2.7E3 325.0935 4.7E4 329.0381 2.6E3 335.7658 2.4E3 336.0936 3.4E4 337.1914 1.1E4 340.1402 2.1E4 341.1123 2.7E4 352.1398 5.7E3 352.2126 5.2E3 363.1696 3.5E3 366.0951 4.0E3 368.1323 6.8E3 368.2075 4.3E3 373.1644 6.4E3 378.1934 2.7E4 394.1429 7.6E3 396.1319 1.3E4 396.2027 2.0E4 398.1496 4.7E3 399.1450 1.5E4 400.1778 7.1E3 401.1358 8.1E4 402.1349 3.1E3 414.1401 3.0E4 415.1494 6.2E3 416.1718 6.0E4 418.1824 2.7E3 427.1397 4.6E4 440.1230 7.3E3 444.1674 4.5E4 456.1418 3.4E3 472.1595 8.6E3 518.1951 3.1E3 559.1927 6.2E3 579.3061 3.1E3 587.1882 3.7E3 595.2131 1.7E4 608.2667 2.5E3 669.3976 2.7E3 711.7042 2.6E3 740.2660 3.9E4 741.2672 2.8E3 800.6078 2.6E3 808.6974 2.3E3 END IONS BEGIN IONS FEATURE_ID=298 PEPMASS=282.1494 SCANS=298 RTINSECONDS=349.819 CHARGE=1+ MSLEVEL=2 MERGED_STATS=8 / 8 (0 removed due to low quality, 0 removed due to low cosine). 46.3250 2.1E3 51.3577 2.4E3 51.8416 2.2E3 52.5308 2.4E3 57.0698 2.7E3 57.6017 2.4E3 58.1726 2.3E3 59.8766 2.3E3 62.7747 2.5E3 63.0022 2.6E3 64.5842 2.5E3 67.0518 2.6E3 67.8538 2.0E3 70.3190 2.3E3 77.7230 2.9E3 77.9594 2.3E3 83.0858 5.6E3 84.7702 2.9E3 88.2069 2.4E3 89.4502 2.4E3 93.5135 2.3E3 95.9347 2.2E3 96.6856 3.0E3 96.7416 2.2E3 100.0656 2.7E3 107.7147 2.2E3 118.6508 2.4E3 118.8200 2.4E3 127.7190 2.4E3 129.9370 2.4E3 131.6122 2.6E3 134.0963 8.8E4 142.8487 2.3E3 150.6740 2.5E3 152.5268 2.3E3 165.0709 4.2E3 167.0850 5.1E3 173.5235 3.9E4 173.5373 7.5E4 173.5435 3.4E3 173.8466 2.5E3 177.0689 2.8E3 177.2141 2.4E3 178.0775 6.0E3 179.0842 3.3E3 189.0710 3.1E3 190.0780 3.5E4 190.2023 2.3E3 191.0651 9.7E3 191.0856 8.0E5 191.1058 1.1E4 191.1154 3.1E3 193.0644 3.1E3 193.1009 6.8E3 194.0726 4.8E4 195.0803 9.1E4 197.4783 2.3E3 201.0693 1.1E4 203.0850 6.8E3 204.5715 2.4E3 205.1008 3.3E4 207.0809 2.5E4 208.0886 7.1E4 211.1353 2.1E4 218.0721 6.5E3 219.0302 3.1E3 219.0560 9.2E3 219.0806 2.3E6 219.1055 1.4E4 221.0967 4.3E4 223.1117 3.4E4 229.0761 6.2E4 236.0833 3.5E5 249.1257 2.3E3 249.6671 2.3E3 251.0763 4.7E3 251.1066 3.0E6 269.5633 2.4E3 275.5179 2.5E3 282.1490 3.1E3 282.2219 2.3E5 289.5362 2.3E3 END IONS BEGIN IONS FEATURE_ID=299 PEPMASS=610.2878 SCANS=299 RTINSECONDS=350.717 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 8 (5 removed due to low quality, 0 removed due to low cosine). 65.0523 4.8E3 70.0651 4.1E6 70.0706 3.9E4 70.0740 1.4E4 72.0806 5.7E5 72.0876 7.9E3 91.0543 3.4E4 97.0758 5.0E4 98.0599 2.4E5 107.0489 1.4E4 109.0769 9.0E3 115.0865 5.9E5 115.0960 1.0E4 118.0650 1.6E5 119.0733 2.3E4 120.0806 1.6E5 125.0708 2.7E5 126.0548 1.2E5 134.2791 5.5E3 136.0757 7.9E4 137.0708 1.6E5 141.1384 1.5E4 146.0599 1.5E6 151.1231 3.8E4 152.0818 3.9E4 153.0769 3.7E3 153.0895 2.8E5 153.1386 1.8E4 155.0449 6.2E3 158.9574 4.8E3 160.0760 2.4E4 160.1121 9.0E3 162.0920 4.8E3 164.0705 4.8E4 165.0550 4.0E4 166.1336 6.5E3 167.1180 8.6E4 169.1092 6.4E3 169.1335 1.1E6 169.1504 1.1E4 172.1121 3.5E5 173.5221 1.4E4 173.5349 1.2E5 174.0553 2.9E4 174.1277 6.6E4 176.0708 3.8E3 179.1179 5.4E4 180.1124 4.8E4 180.1261 8.8E4 182.0813 2.2E5 187.0870 1.2E4 187.1230 4.4E4 188.0707 7.2E4 192.6137 3.6E3 194.1288 1.4E4 195.1145 2.7E4 195.1367 8.1E4 196.1445 4.7E4 197.1075 3.8E3 197.1284 3.7E5 199.1229 8.3E4 205.0971 9.7E4 205.2103 3.7E3 215.0818 1.9E4 215.1178 8.9E4 216.1258 7.9E5 217.0975 3.8E4 217.1102 3.5E3 217.1336 2.6E5 219.7606 4.8E3 223.0760 1.1E4 223.1079 7.7E4 225.1023 4.1E4 231.0772 1.6E4 233.0921 5.0E5 233.1192 4.9E3 236.1070 1.2E5 236.1343 2.0E4 243.0730 3.5E3 243.0786 3.8E3 243.1128 4.0E5 243.1405 7.9E3 245.1285 4.4E3 249.0649 5.1E3 249.0870 3.6E5 251.1024 9.3E4 253.1675 3.6E3 261.0870 7.4E4 264.1018 2.9E4 265.0862 1.2E5 269.1131 2.1E5 270.1128 6.5E4 273.1231 1.1E4 277.0815 1.9E4 279.0977 8.6E4 282.0761 3.7E3 282.1127 5.6E5 294.1107 5.0E3 295.0929 1.3E5 296.1761 1.1E5 298.1617 4.2E3 298.1917 7.1E5 299.1383 2.4E4 300.1340 4.6E4 309.1226 4.1E3 310.1090 6.4E3 314.1869 1.7E4 315.1952 2.6E4 322.1073 2.8E4 323.1391 1.2E5 324.1708 7.7E4 327.1341 1.6E4 330.1436 3.0E4 336.1210 1.1E4 340.1151 3.3E3 340.1652 4.4E3 342.1314 1.4E4 342.1447 1.1E4 342.1812 1.4E6 343.1890 9.5E4 350.1870 4.5E3 351.1330 5.0E4 355.1301 3.5E4 357.0938 5.0E3 357.1442 3.1E5 369.1443 3.1E5 378.1410 6.6E3 386.1717 3.4E4 396.1558 6.6E4 397.1392 3.8E4 398.1715 6.4E4 414.1661 2.1E5 424.1504 7.5E4 438.1980 1.5E4 442.1606 7.6E5 465.2135 1.4E4 466.1960 1.5E4 477.2483 1.9E4 483.2233 4.3E5 493.2071 1.0E5 511.2182 4.6E5 523.2530 3.0E4 581.7455 4.1E3 592.2734 2.4E4 610.2857 2.2E5 END IONS BEGIN IONS FEATURE_ID=300 PEPMASS=388.1609 SCANS=300 RTINSECONDS=351.41 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 53.0386 5.6E3 55.0176 2.0E4 57.0334 9.7E3 61.0282 1.6E4 69.0332 9.6E4 69.5418 2.1E3 70.1988 2.1E3 71.0488 1.7E4 73.0281 2.8E4 73.0388 2.2E3 80.6482 3.0E3 81.0332 6.3E4 85.0280 4.1E5 87.0021 3.9E3 87.0073 1.3E5 87.0441 2.7E3 96.1107 2.2E3 97.0281 1.2E5 99.0437 7.2E4 105.0179 1.7E5 105.0695 2.4E4 108.0443 8.8E3 109.0281 1.2E5 116.6524 2.1E3 117.6007 2.5E3 126.0545 9.4E3 127.0386 2.6E5 129.0182 1.6E4 145.0492 4.6E4 147.0285 1.1E4 148.8159 2.9E3 155.3797 2.4E3 159.0285 7.7E4 173.5253 1.2E4 173.5372 3.2E4 179.3307 2.6E3 189.0391 3.8E3 231.0499 2.0E4 247.6759 2.5E3 327.6671 3.0E3 334.1415 2.5E3 END IONS BEGIN IONS FEATURE_ID=301 PEPMASS=316.1912 SCANS=301 RTINSECONDS=352.562 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 49.1107 2.3E3 49.7811 2.2E3 50.1786 2.2E3 51.7741 2.7E3 56.3446 2.4E3 58.0650 3.6E3 60.4808 2.6E3 63.9823 2.3E3 70.1951 2.3E3 79.0541 2.9E3 81.0701 2.9E3 82.6084 2.5E3 84.4261 2.4E3 89.1330 3.0E3 91.0540 3.2E4 93.0696 2.2E4 95.0489 6.9E3 96.5466 2.6E3 99.8739 2.5E3 103.0539 7.9E3 104.4215 2.3E3 105.0696 1.7E4 107.0489 1.5E5 109.0649 2.8E3 117.0696 7.9E3 119.0490 5.1E4 119.0855 2.9E4 121.0646 6.8E5 121.0729 3.8E3 123.0800 2.6E3 124.0524 3.7E3 125.0595 8.2E3 126.7158 2.4E3 128.7556 2.0E3 129.0703 3.7E3 130.0780 2.5E3 131.0488 8.3E3 131.0856 5.4E3 133.0646 7.2E4 134.0723 3.0E3 135.0803 3.8E4 137.0596 2.2E4 139.0752 2.2E4 145.0646 4.0E4 147.0803 2.3E5 147.3833 2.6E3 149.0601 8.8E3 149.0960 1.7E4 150.0673 4.4E4 151.0752 2.1E5 151.1122 3.3E3 152.0829 5.0E3 156.0150 2.5E3 157.0640 3.9E3 159.0803 2.2E4 160.0881 3.3E4 161.0599 2.8E3 161.0959 2.8E4 163.0592 8.4E3 163.0753 5.9E5 164.0830 1.2E4 165.0910 2.8E5 168.9863 2.4E3 173.0964 7.4E3 173.5353 5.5E4 176.0834 2.0E4 177.0912 4.5E4 179.1068 2.7E4 183.0804 1.6E4 191.1066 1.2E5 193.1008 3.2E3 195.0807 2.9E3 196.0886 1.6E4 197.0961 4.1E4 202.5575 2.6E3 207.1166 6.8E3 209.0967 2.8E3 210.1047 4.1E3 211.1118 9.9E3 215.1053 2.7E3 221.0976 6.9E3 224.0837 1.4E4 225.0916 1.6E4 225.1277 6.1E4 226.0980 3.7E3 238.0992 3.5E4 239.1062 1.4E4 241.0859 2.2E4 242.0935 9.3E3 251.4297 2.4E3 253.1224 5.8E4 254.1304 7.6E4 255.1010 1.5E4 256.1094 1.7E5 257.1171 1.5E4 267.1371 3.2E3 270.1253 8.7E4 285.1489 1.2E5 END IONS BEGIN IONS FEATURE_ID=302 PEPMASS=311.1107 SCANS=302 RTINSECONDS=353.889 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 53.4129 2.2E3 54.5664 2.5E3 57.0947 2.5E3 64.4022 2.2E3 75.7804 2.3E3 86.0514 2.3E3 86.4816 2.7E3 112.4124 2.4E3 115.5320 2.7E3 116.9314 2.3E3 129.0992 2.3E3 164.6703 3.0E3 173.5206 8.7E3 173.5301 1.3E4 173.5389 2.0E4 197.1024 3.0E3 199.8403 2.2E3 227.0818 3.0E3 230.5485 2.7E3 237.0667 7.7E3 239.5149 2.6E3 253.1735 3.3E3 255.0768 8.1E3 265.0605 1.1E4 283.0716 1.3E4 311.0661 1.1E4 321.5013 2.7E3 END IONS BEGIN IONS FEATURE_ID=303 PEPMASS=289.1287 SCANS=303 RTINSECONDS=353.901 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 6 (0 removed due to low quality, 0 removed due to low cosine). 47.3938 2.4E3 52.9558 3.0E3 53.0385 1.9E4 53.8702 2.2E3 54.3471 2.4E3 55.0176 1.2E5 55.0540 2.3E5 56.0827 2.3E3 56.5942 2.3E3 57.0332 5.5E4 57.0697 3.0E4 57.3442 2.3E3 57.6024 2.5E3 58.1967 2.6E3 58.5807 2.2E3 59.0488 5.6E3 59.6836 2.6E3 60.6997 2.1E3 60.7616 2.1E3 62.9813 2.6E3 64.7648 2.4E3 65.0385 1.4E4 65.0518 2.4E3 67.0539 4.8E5 68.6918 2.2E3 68.8209 2.3E3 69.0332 1.0E5 69.0658 4.2E3 69.0696 2.7E5 69.9724 3.1E3 71.0160 2.3E3 71.0489 8.2E5 71.2763 2.4E3 73.0282 2.8E4 76.9690 2.5E3 77.0383 1.3E4 77.2480 2.2E3 79.0539 1.2E6 79.0593 4.2E3 81.0331 3.4E4 81.0647 4.2E3 81.0696 4.7E5 82.7308 2.2E3 83.0488 2.2E5 83.0851 1.0E4 85.0281 1.1E4 85.0645 2.1E5 85.9822 2.3E3 86.5830 2.8E3 87.0073 8.0E4 87.0437 1.6E5 87.3041 2.4E3 91.0484 2.7E3 91.0539 2.0E5 92.3596 2.8E3 93.0333 1.9E4 93.0696 1.5E6 93.0760 3.7E3 95.0488 6.0E4 95.0852 4.2E5 97.0282 2.9E3 97.0585 2.4E3 97.0644 2.5E5 97.1008 8.5E3 99.0438 9.0E3 99.0801 1.5E4 100.3758 2.3E3 101.0593 5.5E4 103.0538 3.0E3 105.0182 4.0E3 105.0446 9.2E3 105.0696 1.7E5 107.0488 1.4E5 107.0773 4.6E3 107.0852 4.9E5 108.7696 2.2E3 109.0645 5.5E3 109.1010 2.9E4 110.5618 2.5E3 111.0437 5.7E4 111.0512 2.3E3 111.0802 6.8E4 111.1166 5.3E3 113.0595 3.5E4 115.0387 2.9E4 115.1018 2.3E3 116.0620 3.0E3 119.0852 7.4E4 121.0645 5.4E4 121.0734 2.5E3 121.1008 1.2E6 121.1098 3.4E3 121.1110 2.9E4 121.4563 2.2E3 123.0801 8.5E4 124.9748 2.3E3 125.0593 9.1E4 125.0958 1.6E4 126.0160 2.7E3 129.0695 2.3E4 131.0747 9.3E3 131.0852 3.6E5 131.0966 3.6E3 137.0960 1.9E4 139.0996 5.2E3 139.1115 4.1E5 149.0958 3.7E5 157.1220 1.5E5 167.1067 6.5E4 173.5246 2.4E4 173.5395 4.7E4 185.1186 3.2E3 202.4617 2.2E3 203.6203 2.5E3 208.0164 2.4E3 213.6740 2.5E3 216.0558 2.6E3 222.9554 2.9E3 240.9804 2.7E3 243.5207 2.6E3 274.5161 2.5E3 291.4058 2.4E3 END IONS BEGIN IONS FEATURE_ID=304 PEPMASS=518.1877 SCANS=304 RTINSECONDS=358.556 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 60.5572 2.6E3 69.0332 3.0E4 69.5248 2.4E3 71.0488 6.5E3 73.0282 1.2E4 79.3494 2.2E3 79.6890 2.2E3 81.0332 5.3E4 83.0493 2.5E3 85.0281 1.4E5 87.0074 3.2E4 91.0539 2.5E5 97.0281 9.7E4 99.0437 4.8E4 103.0388 3.2E4 105.0179 8.1E4 109.0281 2.5E5 115.7576 3.0E3 127.0280 6.6E3 127.0387 3.3E5 129.0180 1.7E4 132.4423 2.6E3 145.0494 5.0E4 145.0619 7.7E3 146.0117 2.3E3 147.0286 1.7E4 158.5238 2.2E3 159.0286 6.7E4 163.6971 2.1E3 166.0767 2.6E3 169.0495 6.9E3 171.0796 3.0E3 173.5293 5.4E4 173.5435 9.4E3 181.0472 2.7E3 181.1164 2.6E3 181.7755 2.2E3 187.0594 3.7E3 199.0754 1.1E4 213.0397 2.5E4 229.4629 2.5E3 230.7838 2.6E3 231.0499 4.2E4 241.4174 2.4E3 291.0725 3.2E3 403.5247 2.5E3 413.0342 2.3E3 492.7175 2.7E3 523.6804 2.6E3 END IONS BEGIN IONS FEATURE_ID=305 PEPMASS=388.1606 SCANS=305 RTINSECONDS=359.211 CHARGE=1+ MSLEVEL=2 MERGED_STATS=8 / 8 (0 removed due to low quality, 0 removed due to low cosine). 55.1821 2.5E3 56.9599 2.3E3 57.0332 8.8E4 62.0513 2.3E3 65.6000 2.6E3 66.8195 2.3E3 67.0538 8.0E3 69.0332 6.3E4 70.1487 2.6E3 73.1925 2.6E3 75.0437 3.0E5 78.4670 2.3E3 79.0539 6.2E4 81.0696 8.4E4 85.0281 4.2E4 87.0438 9.2E3 89.0593 2.5E3 91.0539 4.9E4 92.6084 2.7E3 93.0696 1.4E6 93.0768 6.4E3 93.7917 2.4E3 95.0125 7.7E4 95.0488 2.6E4 95.0852 6.9E4 95.1098 2.3E3 97.0215 2.4E3 97.0281 3.9E5 97.0647 3.1E3 97.5643 2.6E3 98.8340 2.3E3 105.0696 2.5E4 107.0851 4.4E4 107.5752 2.9E3 111.0438 3.6E3 111.0801 2.3E5 113.0230 3.2E5 115.3383 2.3E3 115.6993 2.2E3 118.3032 2.7E3 119.0852 1.5E4 121.0910 9.8E3 121.1008 1.5E6 121.1096 3.2E3 121.1106 1.9E4 122.9984 3.2E3 123.0073 2.2E5 123.0804 7.1E3 123.1164 4.2E4 125.0229 1.1E5 125.0593 3.2E4 128.8748 2.3E3 129.3382 2.9E3 131.0856 1.6E4 134.5700 2.8E3 135.4649 2.2E3 136.0597 2.4E3 136.1670 2.3E3 139.1115 1.6E5 141.0066 8.2E3 141.0179 3.3E5 143.0213 4.0E3 143.0336 2.4E5 143.3228 2.6E3 144.1308 2.1E3 147.0798 6.2E3 149.0958 1.6E5 164.0656 2.6E3 167.1065 2.0E5 167.8523 2.5E3 168.9965 6.6E3 169.0130 3.8E5 173.5286 1.0E5 173.5388 4.7E4 181.6251 2.5E3 184.7528 2.6E3 185.4211 2.4E3 187.0237 7.7E4 189.1098 2.4E3 190.9228 2.3E3 194.9467 2.8E3 197.0973 2.6E3 201.8366 2.8E3 213.2370 2.6E3 214.5923 2.4E3 215.1061 2.4E3 215.5584 2.7E3 218.7932 2.8E3 225.0904 2.5E3 232.4896 3.0E3 233.1312 2.4E3 236.8718 2.7E3 236.9927 2.8E3 244.3097 2.2E3 250.1599 2.3E3 253.0864 2.5E3 254.5216 2.5E3 261.5017 2.2E3 285.1493 7.8E3 285.1844 3.2E3 290.0704 2.5E3 306.5377 2.5E3 309.6025 2.4E3 313.6131 2.3E3 396.3485 2.6E3 END IONS BEGIN IONS FEATURE_ID=306 PEPMASS=382.0354 SCANS=306 RTINSECONDS=360.229 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 5 (0 removed due to low quality, 0 removed due to low cosine). 53.2708 2.2E3 53.5818 2.5E3 55.8451 2.7E3 56.4011 2.5E3 58.4316 2.5E3 64.9510 2.4E3 66.0878 3.1E3 67.4934 2.1E3 68.2116 2.1E3 70.3309 2.1E3 71.0225 2.6E3 74.1177 2.4E3 74.1954 2.3E3 75.0535 2.2E3 75.8828 2.4E3 76.3702 2.3E3 79.7930 2.4E3 88.6335 2.3E3 89.3979 2.5E3 90.3703 2.3E3 92.8790 2.6E3 113.7491 3.0E3 123.4695 2.4E3 139.4204 2.2E3 140.9889 2.6E3 173.5288 6.9E4 173.5445 5.4E3 199.9283 2.4E3 202.5392 2.6E3 225.9926 1.7E4 249.0010 2.8E3 254.9586 1.1E4 269.9822 8.1E4 272.9696 6.1E4 273.6770 2.4E3 273.9797 2.7E3 287.9929 1.2E4 290.9790 2.5E3 312.6376 2.6E3 341.0179 2.5E3 345.3841 2.4E3 359.0256 1.5E5 366.6759 3.1E3 END IONS BEGIN IONS FEATURE_ID=307 PEPMASS=447.2855 SCANS=307 RTINSECONDS=360.808 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 4 (1 removed due to low quality, 0 removed due to low cosine). 58.0649 2.5E5 59.0699 3.3E3 59.0727 1.2E5 59.9165 2.2E3 77.3177 2.5E3 78.6347 2.7E3 93.5006 2.5E3 99.6311 2.3E3 107.0491 3.2E3 118.0661 2.0E4 118.0750 1.7E4 118.0858 7.3E6 118.0961 1.8E5 118.1055 7.6E4 118.1071 3.0E4 118.1113 9.3E3 118.1170 4.1E3 121.0644 8.7E3 130.9392 2.2E3 147.0804 1.0E4 163.0752 3.1E3 165.0898 5.7E3 167.0323 2.3E3 173.5307 5.5E4 173.5427 5.1E3 196.6853 2.3E3 209.2844 2.4E3 239.3462 2.6E3 249.2828 2.2E3 276.1531 2.7E3 285.1488 5.4E4 287.7311 2.4E3 296.1579 2.4E3 330.2069 2.6E4 424.2843 2.7E3 END IONS BEGIN IONS FEATURE_ID=308 PEPMASS=333.2155 SCANS=308 RTINSECONDS=360.839 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 52.4246 2.1E3 55.0087 2.2E3 58.0648 9.2E4 59.0682 3.2E4 64.9856 2.3E3 69.8018 2.4E3 89.3837 2.5E3 91.0540 8.1E3 92.0574 7.1E3 93.0696 9.3E3 94.0727 6.5E3 96.4196 2.0E3 104.0579 3.3E3 107.0488 3.7E4 108.0521 3.5E4 109.0549 1.3E4 109.2198 2.6E3 109.6958 2.7E3 114.6233 2.3E3 119.0487 8.8E3 119.0842 3.2E3 120.0520 1.2E4 120.0883 2.5E3 121.0554 1.4E4 121.0645 1.5E5 122.0579 3.3E3 122.0678 1.6E5 123.0703 9.3E4 124.0727 3.4E4 132.0513 2.5E3 133.0646 7.0E3 134.0674 1.4E4 135.0704 1.4E4 136.0838 8.0E3 138.0882 2.7E3 139.0657 2.8E3 140.0780 3.7E3 146.0681 1.1E4 147.0801 4.0E4 148.0724 5.6E3 148.0834 6.9E4 149.0862 4.1E4 150.0890 1.8E4 151.0744 2.4E4 152.0782 4.2E4 153.0804 4.1E4 154.0831 2.3E4 160.0848 6.4E3 161.0901 3.0E3 163.0750 5.1E4 163.0994 3.4E3 164.0785 1.2E5 165.0808 1.2E5 166.0832 5.3E4 166.0947 4.1E4 167.0964 6.7E4 168.0989 3.8E4 173.5254 2.3E4 173.5381 2.1E4 173.5450 4.8E3 175.5430 2.4E3 175.8376 2.5E3 178.0920 1.0E4 180.0997 2.6E3 181.1131 3.7E3 191.1067 6.8E3 192.1098 2.5E4 193.1124 2.6E4 194.1152 2.5E4 198.0977 5.8E3 199.1022 6.2E3 226.0907 2.5E3 226.1306 1.8E4 227.0951 3.1E3 227.1339 1.3E4 228.1002 6.2E3 228.1368 1.6E4 232.9579 2.5E3 237.1154 2.7E3 240.1052 6.9E3 241.1082 1.4E4 244.0942 3.0E3 254.1269 2.8E3 255.1295 1.2E4 256.1329 3.3E4 257.1111 1.1E4 257.1392 2.9E4 258.1148 4.4E4 259.1178 6.7E4 272.1307 1.8E4 273.1337 4.8E4 287.1549 2.6E4 288.1577 9.5E4 318.4601 2.7E3 END IONS BEGIN IONS FEATURE_ID=309 PEPMASS=330.2068 SCANS=309 RTINSECONDS=361.095 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 6 (4 removed due to low quality, 0 removed due to low cosine). 53.2002 6.3E4 55.0179 3.0E5 56.7349 5.5E4 56.9304 9.0E4 57.0336 1.8E5 58.0651 2.8E7 58.0680 2.0E5 58.0720 1.1E5 59.0493 6.8E4 59.3555 5.9E4 64.9590 7.9E4 65.0391 6.6E4 67.0541 1.2E5 70.0644 6.6E4 71.0490 2.6E5 72.0807 7.0E5 73.0380 8.8E4 73.0649 2.5E5 74.7465 6.5E4 75.0440 5.4E5 76.3587 5.2E4 77.0391 2.9E5 79.0542 4.7E5 81.0335 6.4E4 81.0698 6.7E5 82.7472 8.0E4 83.0490 8.3E4 85.0647 8.3E4 86.4915 6.4E4 87.1483 8.7E4 88.7797 5.3E4 91.0542 4.0E6 93.0698 2.9E6 94.9200 6.0E4 95.0491 1.4E6 96.2959 9.9E4 97.0646 3.3E5 101.0595 3.3E5 103.0541 1.3E6 105.0698 2.2E6 107.0491 1.9E7 107.0555 1.7E5 107.0854 1.1E5 109.0647 8.3E5 111.0439 3.6E5 111.0803 6.2E5 111.0877 6.3E4 113.0596 5.6E5 115.0553 1.0E5 117.0699 1.0E6 119.0393 2.1E5 119.0491 6.4E6 119.0583 1.4E5 119.0855 4.1E6 120.0573 2.2E5 121.0280 5.2E5 121.0438 2.6E5 121.0647 9.3E7 121.0728 7.4E5 121.0868 4.8E5 121.0907 1.2E5 123.0804 1.0E6 124.0518 1.0E6 125.0596 1.5E6 129.0698 5.5E5 131.0492 1.7E6 131.0855 7.9E5 132.0571 4.0E5 133.0648 8.6E6 133.0764 1.0E5 133.1015 3.1E5 134.0360 8.4E4 134.0726 7.6E4 135.0437 2.2E5 135.0804 5.0E6 136.0519 5.0E5 137.0597 2.8E6 137.0961 3.0E5 138.0676 3.2E5 139.0753 3.5E6 139.8009 6.0E4 141.0705 2.2E5 141.0909 5.2E5 144.0571 3.9E5 145.0518 7.8E4 145.0648 5.1E6 146.0726 5.6E5 147.0445 1.2E5 147.0804 3.4E7 148.0521 1.6E5 149.0598 1.7E6 149.0961 2.2E6 150.0676 5.0E6 150.0814 1.4E5 151.0606 1.5E5 151.0645 2.0E5 151.0753 2.9E7 151.1120 6.0E5 152.0831 1.3E6 153.0906 2.6E5 157.0648 7.3E5 159.0805 3.9E6 160.0884 4.1E6 160.1034 9.6E4 161.0606 3.2E5 161.0961 3.8E6 162.0677 3.6E5 163.0430 2.3E5 163.0638 7.1E5 163.0754 7.7E7 163.1008 2.5E5 163.1084 7.0E5 164.0833 2.3E6 165.0733 1.1E5 165.0911 4.0E7 166.0988 2.7E5 167.0862 1.6E5 167.1067 8.5E5 169.0642 9.3E4 169.1009 1.0E5 171.0801 3.1E5 172.0886 9.6E4 173.0962 1.2E6 173.5296 8.4E5 173.5444 1.5E5 175.0761 1.7E5 176.0834 2.9E6 177.0912 6.4E6 178.0800 1.2E5 178.0988 5.7E5 179.0862 5.7E5 179.1068 3.6E6 181.0651 4.1E5 182.0730 3.7E5 183.0806 2.2E6 185.0963 5.9E5 187.1119 3.3E5 189.0915 4.3E5 190.0979 1.0E5 191.1068 1.8E7 192.0937 8.2E4 192.1133 7.8E4 193.1012 4.0E5 195.0805 7.6E5 196.0885 2.4E6 197.0963 5.6E6 197.1297 2.8E5 198.1027 6.6E4 199.1115 4.5E5 201.0912 1.1E5 203.1068 2.8E5 206.0724 8.2E4 207.0809 2.3E5 207.1172 8.8E5 209.0967 3.2E5 210.0680 3.1E5 210.1039 8.5E5 211.0759 4.2E5 211.1121 8.9E5 213.0912 2.2E5 215.1067 2.8E5 220.0886 3.6E5 221.0962 1.0E6 222.1043 5.2E5 222.8869 6.0E4 223.0760 5.0E5 223.1128 3.9E5 224.0834 2.3E6 225.0911 2.8E6 225.1277 9.8E6 225.1459 1.0E5 225.1534 2.7E5 226.0992 6.5E5 227.1068 5.3E5 228.1135 1.1E5 229.1228 5.4E5 235.1122 1.1E6 236.1197 7.7E5 237.0901 1.0E5 238.0989 4.8E6 239.1066 1.4E6 241.0860 2.5E6 241.1169 8.5E4 242.0939 1.4E6 242.1202 7.5E4 242.1302 5.3E4 243.1008 2.2E5 243.1392 1.2E5 251.1049 1.2E5 252.1137 4.4E5 253.0912 1.3E5 253.1223 9.2E6 253.1535 2.1E5 254.1302 1.0E7 254.1545 6.3E4 255.1016 1.8E6 255.1331 1.3E5 256.1094 2.2E7 257.1172 1.9E6 257.1533 8.9E5 267.1382 9.7E5 270.1252 1.5E7 270.1519 9.8E4 285.1210 1.4E5 285.1488 2.6E7 330.2067 8.5E5 340.2628 9.2E4 END IONS BEGIN IONS FEATURE_ID=310 PEPMASS=339.0979 SCANS=310 RTINSECONDS=361.41 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 5 (0 removed due to low quality, 0 removed due to low cosine). 51.9752 2.4E3 53.8769 2.1E3 54.5058 2.5E3 54.9281 2.4E3 56.7436 2.2E3 57.4860 2.2E3 59.2681 2.2E3 59.5822 2.2E3 63.1415 2.0E3 63.5760 2.2E3 69.2749 2.4E3 69.6860 2.3E3 74.6576 2.7E3 81.3721 2.3E3 83.0704 2.2E3 89.9276 2.4E3 94.7028 2.1E3 96.0379 3.4E3 96.0440 1.9E5 98.2988 2.5E3 112.1685 2.4E3 115.4465 2.8E3 122.0233 1.1E5 124.0755 6.2E4 128.0664 2.6E3 129.4200 2.2E3 132.0446 5.9E3 138.9274 2.4E3 148.0389 1.2E5 151.0627 1.5E4 164.0337 1.5E4 173.5300 6.7E4 177.3436 2.4E3 177.9915 2.7E3 181.0766 2.9E3 188.0331 4.2E3 190.0502 4.4E3 193.0759 2.4E4 194.0601 9.2E3 197.5939 2.5E3 199.0870 1.6E4 199.4864 2.3E3 209.0709 1.8E5 210.0551 6.1E4 210.0762 5.6E3 211.0859 1.4E4 212.0716 1.2E4 213.0658 5.1E4 213.1023 6.5E3 215.0205 1.6E4 216.0291 2.3E4 221.0708 8.2E4 221.6424 2.2E3 222.0535 2.5E3 224.0584 3.6E4 225.0682 2.3E3 226.0508 3.9E3 226.0740 1.8E4 227.0814 9.9E4 228.0260 2.7E3 229.2237 2.4E3 233.0317 7.6E4 234.0399 4.4E4 236.0582 6.8E3 237.0658 2.5E5 237.0935 4.8E3 238.0496 1.5E5 238.0742 7.0E4 239.0815 3.1E4 240.0529 2.3E4 241.0608 1.0E5 246.8878 3.9E3 247.0511 4.1E3 249.0656 6.3E4 251.0453 2.4E4 253.0612 5.1E3 254.0684 1.0E5 255.0762 1.8E5 262.4569 2.4E3 264.0522 1.8E4 265.0287 5.8E3 265.0606 3.9E5 265.0916 4.7E3 266.0447 6.2E4 268.0482 1.2E5 269.0556 2.7E5 269.0908 3.7E4 270.5243 2.7E3 281.0575 2.9E3 282.0636 1.5E5 283.0715 2.2E5 283.1073 4.6E4 292.0484 1.5E4 293.0173 4.5E3 293.0560 4.5E5 293.0939 9.8E3 294.0390 1.4E4 297.0873 2.6E5 304.9319 2.5E3 310.0583 2.2E4 310.0956 2.5E3 311.0659 3.4E4 311.1035 6.6E4 319.8817 2.4E3 END IONS BEGIN IONS FEATURE_ID=311 PEPMASS=411.1592 SCANS=311 RTINSECONDS=363.534 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 5 (0 removed due to low quality, 0 removed due to low cosine). 54.5142 2.6E3 55.4201 2.3E3 58.1222 2.1E3 59.6843 2.3E3 62.6587 2.1E3 67.4263 2.1E3 67.8874 2.6E3 69.0695 2.5E4 78.2919 2.3E3 83.3727 2.3E3 84.0804 1.5E4 84.1449 2.8E3 86.0960 1.0E5 88.0389 4.7E4 95.2495 2.3E3 98.1183 2.8E3 100.6746 2.1E3 108.6057 2.4E3 109.8761 2.7E3 112.0753 1.1E5 121.3538 2.6E3 128.1065 2.8E3 139.4097 2.1E3 147.7834 2.4E3 149.6351 2.8E3 156.2650 2.7E3 168.6027 2.4E3 173.5275 1.9E4 173.5374 5.5E4 186.2275 2.4E3 191.6690 2.4E3 205.0175 2.4E3 206.0031 2.1E4 207.0652 3.2E4 218.9612 2.2E3 223.0061 3.3E3 224.0138 5.4E4 233.4886 2.6E3 238.0531 1.0E5 238.9799 6.6E3 239.0372 3.3E6 239.0934 8.8E3 241.3280 2.5E3 253.0961 3.1E3 284.0589 6.4E4 292.1545 2.7E3 312.1567 2.6E3 370.2343 2.4E3 404.0544 2.5E3 END IONS BEGIN IONS FEATURE_ID=312 PEPMASS=345.2251 SCANS=312 RTINSECONDS=363.633 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 51.2873 2.7E3 57.5463 2.1E3 63.5851 2.2E3 72.8148 2.6E3 76.5717 2.4E3 80.1206 2.3E3 96.9384 2.6E3 107.0488 1.1E4 117.0329 2.9E3 121.0645 4.5E4 122.0678 2.8E4 125.2742 2.4E3 131.7210 2.7E3 133.7786 2.4E3 139.6522 2.3E3 143.9525 2.4E3 145.0280 2.8E4 146.0315 2.9E4 147.0800 1.1E4 148.0833 1.0E4 149.6883 9.9E3 151.0750 1.7E4 152.0784 6.6E3 162.9711 2.1E3 163.0752 2.6E4 164.0785 3.0E4 165.0910 1.7E4 166.0943 1.9E4 173.5213 6.1E3 173.5309 1.2E4 173.5413 1.1E4 177.0546 4.4E4 178.0580 4.6E4 190.9182 2.8E3 191.1070 2.8E3 192.1103 5.5E3 214.6770 2.5E3 226.1317 3.2E3 254.1272 3.4E3 257.1122 3.4E3 271.1271 1.2E4 278.6917 2.2E3 286.1521 2.3E4 303.0533 2.5E3 355.4495 3.1E3 END IONS BEGIN IONS FEATURE_ID=313 PEPMASS=347.2310 SCANS=313 RTINSECONDS=363.791 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 7 (1 removed due to low quality, 0 removed due to low cosine). 50.5100 2.6E3 53.1509 2.2E3 55.0178 6.4E3 55.7108 2.3E3 58.8143 2.2E3 61.8985 2.5E3 62.9578 2.8E3 66.7303 2.5E3 76.0159 2.7E3 79.0533 2.5E3 81.0698 6.3E3 81.5506 2.3E3 83.9365 2.6E3 91.0542 3.5E4 91.2852 2.5E3 92.0576 2.8E4 93.0615 2.2E3 93.0698 2.1E4 94.0733 1.6E4 95.0490 3.0E3 103.0539 4.2E3 105.0698 9.4E3 106.0733 1.6E4 107.0490 1.4E5 108.0524 1.4E5 109.0546 6.5E4 109.0634 5.8E3 109.1760 2.6E3 110.0571 1.4E4 113.0596 2.7E3 118.0735 8.2E3 119.0490 4.4E4 119.0854 2.5E4 120.0525 5.2E4 120.0888 3.1E4 121.0558 3.4E4 121.0647 7.2E5 121.0793 2.9E3 121.0921 1.1E4 122.0589 8.8E3 122.0680 8.6E5 123.0704 4.5E5 124.0729 1.5E5 126.4779 2.5E3 132.0524 7.4E3 133.0647 5.5E4 134.0681 7.3E4 135.0706 4.1E4 135.0808 2.3E4 136.0735 1.5E4 136.0838 4.9E4 137.0589 9.9E3 137.0862 2.9E4 138.0634 2.4E4 139.0645 1.0E4 139.0757 8.0E3 140.0789 2.8E4 141.0807 2.4E4 141.5889 2.3E3 142.0832 1.1E4 145.0644 3.0E4 146.0682 5.3E4 147.0692 3.1E3 147.0803 2.0E5 147.1162 2.4E3 147.1900 2.3E3 148.0721 3.1E3 148.0837 3.5E5 148.0976 2.4E3 149.0865 2.3E5 150.0659 1.9E4 150.0888 9.3E4 150.0993 3.0E3 151.0747 1.3E5 151.1016 7.5E3 152.0784 2.0E5 153.0807 2.1E5 154.0835 9.4E4 155.0917 3.7E3 156.0867 2.4E3 158.0687 2.7E3 159.0803 1.4E4 160.0851 3.8E4 161.0897 3.1E4 162.0662 2.5E3 162.0891 2.5E3 162.0985 2.8E4 163.0753 2.5E5 163.1006 2.1E4 164.0630 3.9E3 164.0787 5.3E5 164.1035 8.5E3 165.0811 4.9E5 165.0946 1.0E4 166.0831 2.0E5 166.0946 2.6E5 167.0967 3.7E5 168.0992 1.8E5 171.7321 2.8E3 173.5209 1.0E4 173.5361 8.8E4 174.0998 4.1E3 175.1011 3.8E3 177.0888 2.3E4 178.0934 5.3E4 179.0966 4.5E4 180.0978 8.7E3 180.1116 7.1E3 181.1126 3.2E4 182.1154 1.1E4 184.0830 1.3E4 185.0859 7.5E3 191.1066 4.7E4 192.1099 1.3E5 193.1127 1.6E5 194.1151 1.0E5 196.0857 2.9E3 197.0929 2.8E4 198.0983 4.8E4 199.1019 4.3E4 200.1048 2.4E4 206.2189 2.6E3 212.1139 6.5E3 213.1160 9.3E3 214.1205 2.6E3 215.2969 2.4E3 222.0995 6.7E3 223.1032 1.1E4 224.1067 2.1E3 225.0871 1.4E4 225.1268 1.0E4 226.0904 2.4E4 226.1307 7.8E4 227.0946 4.1E4 227.1340 8.5E4 228.1012 3.2E4 228.1369 8.5E4 229.1100 6.2E3 236.1147 2.5E3 237.1211 2.9E3 238.1228 1.2E4 239.1017 2.0E4 239.1287 3.5E3 240.1053 3.4E4 241.1083 5.7E4 242.1148 7.3E3 243.0924 1.1E4 244.0959 2.0E4 245.1035 1.0E4 245.2386 2.5E3 253.1208 3.7E3 254.1255 6.0E4 255.1295 1.2E5 256.1326 1.9E5 257.1108 4.3E4 257.1393 1.1E5 257.2232 2.8E3 258.1150 2.0E5 259.1182 2.7E5 260.1261 1.9E4 260.1619 3.9E3 270.1455 1.0E4 271.1290 1.6E4 272.1313 1.4E5 273.1339 2.7E5 286.1526 3.1E4 287.1549 2.8E5 288.1035 3.3E3 288.1575 6.8E5 288.1961 4.0E3 292.1174 2.7E3 325.8726 2.7E3 347.2303 3.6E3 349.8903 3.1E3 END IONS BEGIN IONS FEATURE_ID=314 PEPMASS=687.4365 SCANS=314 RTINSECONDS=363.827 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 68.3514 2.4E3 69.2410 2.5E3 71.2847 2.2E4 71.2893 4.3E3 73.2087 2.4E3 75.0437 6.3E3 90.5180 2.1E3 91.0542 2.2E4 91.3598 2.5E3 93.0698 1.3E4 95.0491 1.4E4 97.0543 2.6E3 97.0646 3.2E3 101.0594 8.8E3 103.0549 4.7E3 105.0697 1.6E4 105.1505 2.3E3 107.0494 7.5E4 109.0650 4.6E3 111.0441 7.9E3 113.0597 1.4E4 113.3354 2.7E3 119.0490 3.5E4 119.0855 1.5E4 121.0647 7.6E5 123.0803 2.5E4 124.0515 4.8E3 125.0595 2.7E4 131.0492 1.3E4 133.0647 6.6E4 135.0688 3.1E3 135.0804 1.4E5 137.0596 3.3E4 137.0968 3.5E3 139.0753 7.8E4 141.0905 2.0E4 145.0647 6.8E4 147.0803 5.0E5 149.0596 2.5E4 149.0959 2.9E4 150.0675 1.7E4 151.0753 2.4E5 151.0890 2.8E3 152.0838 2.9E3 159.0803 4.2E4 159.0932 2.4E3 160.0883 1.2E4 161.0600 3.1E3 161.0961 1.1E5 162.0685 2.6E3 163.0755 3.1E5 163.0911 8.6E3 163.1108 1.1E4 164.0835 9.1E3 165.0910 5.8E5 165.1140 3.4E3 167.1068 2.8E4 171.8398 2.4E3 173.0962 3.1E4 173.5230 5.0E3 173.5317 3.7E4 173.5418 8.9E3 175.1113 1.5E4 176.0835 1.5E4 177.0911 6.3E4 179.1066 2.9E4 183.0804 1.8E4 183.5188 2.2E3 185.0967 4.3E3 187.1118 8.8E3 189.0911 8.0E3 190.0991 5.0E3 191.1066 1.8E5 196.0881 9.3E3 196.6382 2.4E3 197.0961 4.1E4 211.1120 1.7E4 212.9956 2.3E3 221.0964 1.1E4 223.1133 3.6E3 224.0833 1.5E4 225.0909 3.5E4 225.1275 2.3E5 225.1467 4.2E3 227.1061 9.0E3 235.1120 2.1E4 236.1210 3.5E3 238.0988 2.3E4 239.1062 7.5E3 239.1431 2.7E4 241.0853 6.9E3 241.1231 2.4E3 243.1373 3.7E3 253.0914 3.8E3 253.1221 3.5E5 253.1442 2.5E3 253.1529 3.1E3 254.1300 3.5E4 255.1367 4.0E3 256.1091 7.4E4 257.1179 2.0E4 257.1539 2.3E4 267.1379 6.5E4 270.1251 3.9E5 271.1334 2.7E3 273.0204 3.1E3 284.1406 2.7E4 285.0739 3.0E4 285.0912 2.4E4 285.1486 6.8E6 285.2082 1.0E4 285.2229 4.8E4 285.2433 4.6E3 299.1250 7.7E3 299.1642 3.0E5 344.0948 3.4E3 344.1223 7.8E3 344.2219 3.1E6 344.3194 2.0E4 358.2374 5.7E4 616.8180 3.2E3 634.3002 2.7E3 664.7059 2.9E3 END IONS BEGIN IONS FEATURE_ID=315 PEPMASS=344.2226 SCANS=315 RTINSECONDS=363.842 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 8 (2 removed due to low quality, 0 removed due to low cosine). 51.7483 1.2E5 53.0387 3.1E5 54.6817 5.0E4 55.0179 2.1E6 57.0334 2.9E5 57.5096 5.6E4 58.8904 5.6E4 59.0492 4.0E5 65.5257 5.3E4 67.0541 5.2E5 67.5341 1.1E5 67.7085 1.3E5 69.0335 2.2E5 71.0490 1.3E6 71.2850 5.8E4 73.0647 1.4E6 74.8486 2.0E5 75.0440 3.2E6 75.7499 1.6E5 77.0390 1.2E6 79.0542 2.4E6 81.0335 2.6E5 81.0698 3.5E6 83.0493 3.2E5 87.2332 5.6E4 89.5462 2.0E5 91.0542 1.8E7 93.0698 1.2E7 95.0491 7.8E6 97.0647 2.0E6 99.0438 2.4E5 99.0807 6.2E4 100.7643 1.1E5 101.0596 2.2E6 103.0542 5.3E6 105.0697 1.1E7 107.0406 9.7E5 107.0491 9.3E7 107.0557 4.3E5 107.0857 7.4E5 107.1887 5.4E4 108.8389 1.3E5 109.0647 4.9E6 111.0438 2.3E6 111.0803 2.8E6 111.7150 2.3E5 113.0597 2.9E6 115.0548 7.8E5 117.0698 5.1E6 119.0393 3.7E5 119.0490 3.6E7 119.0591 2.6E5 119.0854 1.9E7 119.0948 1.7E5 120.0570 1.2E6 120.7247 1.1E5 120.8754 1.3E5 121.0281 2.2E6 121.0383 2.3E5 121.0647 5.3E8 121.0729 5.7E6 121.0859 4.6E6 121.0914 5.3E5 121.1018 5.7E4 122.5411 2.1E5 123.0431 2.0E5 123.0803 6.1E6 123.6596 9.7E4 124.0517 5.8E6 125.0595 8.7E6 125.0953 6.3E4 127.8039 1.3E5 128.0604 5.1E4 129.0698 2.3E6 131.0490 8.6E6 131.0855 4.0E6 132.0570 2.1E6 132.9780 1.3E5 133.0526 6.5E4 133.0647 4.9E7 133.0759 8.9E5 133.1013 1.3E6 134.0358 5.7E5 134.0724 1.7E5 135.0437 1.3E6 135.0686 2.3E5 135.0803 3.1E7 135.0894 1.8E5 136.0519 2.0E6 137.0596 1.7E7 137.0958 1.4E6 138.0675 1.4E6 139.0629 1.5E5 139.0752 2.4E7 139.0847 4.1E4 141.0909 4.0E6 142.8166 6.7E4 143.0854 5.9E4 144.0569 1.4E6 145.0516 7.7E5 145.0646 3.1E7 145.0757 2.5E5 146.0725 2.1E6 147.0448 1.1E6 147.0803 2.1E8 147.0911 1.5E6 147.1073 2.5E5 148.0520 9.5E5 149.0596 9.6E6 149.0960 1.3E7 150.0546 2.0E5 150.0674 2.5E7 150.0814 8.0E4 151.0753 1.6E8 151.1119 3.4E6 152.0831 6.9E6 152.1823 1.3E5 153.0908 1.6E6 155.0850 1.9E5 157.0648 4.5E6 157.4081 6.5E4 157.6658 1.9E5 158.0722 2.0E5 159.0803 2.4E7 160.0741 3.1E5 160.0882 1.8E7 160.1033 1.6E5 161.0598 2.0E6 161.0809 2.5E5 161.0960 2.4E7 162.0676 1.8E6 163.0440 8.8E5 163.0753 3.9E8 163.1011 8.2E5 163.1072 5.4E6 163.1252 1.7E5 164.0832 1.1E7 165.0737 5.2E5 165.0910 2.5E8 165.1036 1.7E6 165.1234 1.7E5 166.0983 1.4E6 166.4220 2.1E5 167.0873 8.5E5 167.1067 5.8E6 169.0651 1.0E6 169.1013 3.8E5 171.0804 1.8E6 172.0883 1.0E5 173.0962 8.6E6 173.5234 1.1E6 173.5408 3.7E6 173.5420 4.4E5 175.0755 1.1E6 175.1121 6.5E5 176.0833 1.4E7 177.0734 2.7E5 177.0910 3.6E7 177.1055 5.2E5 178.0987 2.9E6 179.0862 2.9E6 179.1067 2.0E7 181.0650 2.1E6 182.0728 1.1E6 183.0506 2.4E5 183.0804 1.3E7 185.0963 3.0E6 187.0767 1.4E5 187.1116 1.8E6 189.0909 2.6E6 190.0994 6.1E5 191.1066 1.1E8 191.1226 7.9E5 191.1484 7.5E4 192.1138 2.1E5 193.1014 1.8E6 194.0732 6.7E4 195.0805 4.0E6 195.1162 6.1E4 196.0882 1.3E7 197.0961 3.2E7 197.1168 2.2E5 197.1309 1.4E6 199.0761 2.0E5 199.1121 2.3E6 200.8903 2.1E5 201.0909 9.2E5 202.0796 2.4E5 203.0861 4.8E5 203.1062 1.0E6 204.0699 6.2E4 206.0734 8.4E5 207.0809 1.6E6 207.1169 4.6E6 208.0878 3.0E5 209.0604 1.8E5 209.0960 1.9E6 210.0677 1.5E6 210.1042 3.8E6 211.0756 2.4E6 211.1119 6.0E6 212.0852 1.4E5 212.1208 2.1E5 213.0916 1.2E6 214.0976 2.9E5 215.1067 1.5E6 217.1022 2.2E5 220.0885 2.0E6 221.0960 5.5E6 222.1039 2.5E6 223.0757 2.0E6 223.1115 2.5E6 224.0579 6.6E4 224.0831 1.5E7 225.0909 1.7E7 225.1274 6.6E7 225.1536 8.1E5 226.0991 2.9E6 227.1069 3.0E6 228.1142 6.6E5 229.1221 3.3E6 231.6600 2.2E5 235.1119 6.5E6 236.1196 4.6E6 237.0903 1.4E5 238.0713 2.3E5 238.0987 2.6E7 238.1219 4.0E4 238.1274 7.9E4 239.1065 6.4E6 239.1406 6.9E5 241.0860 9.3E6 241.1207 1.9E6 242.0936 7.0E6 243.1018 1.1E6 243.1387 1.4E6 250.1250 1.2E5 251.1068 1.8E6 252.1142 2.6E6 253.0913 1.2E6 253.1220 6.6E7 253.1447 6.3E5 253.1534 7.0E5 254.1298 5.1E7 254.1557 8.1E4 255.1015 8.8E6 255.1347 1.3E6 256.1091 1.1E8 256.1325 1.4E6 257.1170 1.1E7 257.1531 5.5E6 267.1376 6.7E6 269.1157 4.3E5 270.1248 1.0E8 270.1512 3.1E5 285.1485 2.3E8 285.2218 3.2E5 286.6028 1.2E5 307.9029 2.0E5 344.2217 4.4E6 END IONS BEGIN IONS FEATURE_ID=316 PEPMASS=285.1488 SCANS=316 RTINSECONDS=363.876 CHARGE=1+ MSLEVEL=2 MERGED_STATS=10 / 10 (0 removed due to low quality, 0 removed due to low cosine). 47.4767 2.2E3 47.8834 2.3E3 48.1643 2.4E3 48.7931 2.3E3 49.0867 2.3E3 49.6984 2.2E3 50.3654 2.1E3 53.0385 8.7E3 53.1183 2.8E3 55.0178 4.2E4 55.0541 3.1E3 57.0334 3.3E3 60.0296 2.1E3 63.1433 2.3E3 63.8860 2.2E3 65.5993 2.1E3 67.0542 8.6E3 68.5954 2.3E3 69.0334 2.5E3 69.9570 2.2E3 70.6871 2.1E3 71.0489 3.0E3 71.1299 2.6E3 71.8146 2.2E3 72.4315 2.3E3 74.8672 2.7E3 75.0440 5.9E3 76.6602 2.4E3 77.0385 1.8E4 79.0542 7.7E4 79.1943 2.1E3 80.5163 2.2E3 81.0696 3.5E4 83.6936 2.8E3 84.0255 2.4E3 85.1023 2.3E3 86.3428 3.0E3 86.5974 2.6E3 86.7314 2.7E3 91.0445 2.7E3 91.0540 6.3E5 91.0593 2.8E3 91.0607 4.7E3 92.5943 2.3E3 93.0697 3.8E5 95.0490 1.2E5 96.0579 2.2E3 96.0717 2.6E3 97.0653 3.2E3 99.3835 2.5E3 103.0540 2.4E5 105.0337 2.4E3 105.0448 1.9E4 105.0697 3.0E5 107.0405 1.3E4 107.0490 1.4E6 107.0575 2.8E4 107.0854 2.5E4 108.0573 7.7E3 109.0646 4.9E4 109.0824 2.7E3 109.2134 2.4E3 109.4628 2.3E3 111.0804 1.1E4 114.0491 2.6E3 115.0544 2.6E4 115.9646 2.7E3 117.0697 1.1E5 118.0409 6.6E3 119.0403 3.9E3 119.0490 4.6E5 119.0584 7.2E3 119.0853 3.5E5 120.0568 6.2E4 121.0281 4.1E4 121.0552 4.4E3 121.0646 2.8E6 121.0748 2.5E4 123.0803 2.2E4 123.1250 2.6E3 123.5974 2.3E3 124.0518 4.3E4 125.0596 2.2E4 128.0618 2.3E3 129.0698 6.2E4 131.0489 8.1E4 131.0854 4.8E4 132.0568 6.0E4 133.0540 4.3E3 133.0647 4.1E5 133.0755 2.3E3 133.1012 7.3E3 134.0365 9.2E3 134.0725 2.7E4 135.0439 3.7E4 135.0803 2.3E5 136.0516 4.7E4 137.0596 1.5E5 137.0963 2.8E3 138.0674 1.7E4 139.0751 4.5E4 140.7574 2.7E3 144.0569 3.9E4 145.0645 2.1E5 146.0725 9.8E4 147.0435 3.2E3 147.0802 6.9E5 147.1668 2.4E3 147.4488 2.4E3 148.0518 1.6E4 148.0877 5.4E3 149.0595 1.0E5 149.0961 7.8E4 150.0547 2.4E3 150.0674 4.2E5 150.0814 3.6E3 151.0752 1.4E6 151.0892 1.6E4 151.1120 2.9E3 152.0827 2.3E4 152.8962 2.4E3 153.0907 3.4E3 155.0596 3.7E3 157.0646 3.3E4 157.1747 2.3E3 158.0727 5.9E3 159.0804 1.4E5 160.0882 2.8E5 161.0601 4.0E4 161.0961 5.9E4 162.0674 3.0E4 163.0593 8.2E3 163.0753 3.7E6 163.0982 3.2E3 163.1076 1.1E4 164.0699 3.0E3 164.0833 1.3E5 165.0715 4.0E4 165.0910 7.8E5 167.0856 2.3E4 169.1018 1.0E4 171.0812 4.3E3 173.0956 9.1E3 173.5212 1.0E4 173.5315 1.4E5 173.5416 1.2E4 176.0832 1.6E5 177.0747 3.7E3 177.0911 2.1E5 178.0794 9.6E3 178.0988 4.6E4 178.9726 2.5E3 179.0857 6.8E4 179.1065 9.5E4 179.2060 2.4E3 181.0648 9.2E4 181.0830 2.3E3 182.0729 4.7E4 183.0803 7.1E4 185.0959 1.2E4 185.1343 2.7E3 189.0925 5.7E3 189.5176 2.6E3 191.1066 2.1E5 192.0936 2.8E3 193.1011 1.3E4 194.0722 3.7E3 195.0805 1.4E5 196.0883 1.5E5 197.0961 1.6E5 197.1332 2.2E3 197.8714 2.3E3 199.0748 5.6E3 203.8837 5.7E4 207.0795 1.4E4 207.1166 1.3E4 209.0600 5.1E4 209.0959 1.9E4 210.0675 3.6E4 210.1041 5.6E4 210.8839 2.7E3 211.0439 2.4E3 211.0755 2.9E4 211.1118 5.0E4 213.0912 9.4E4 219.0802 2.7E3 220.0882 1.2E4 221.0965 4.9E4 222.1038 2.0E4 223.0756 1.5E5 223.1124 1.7E4 224.0835 1.5E5 225.0910 1.5E5 225.1278 9.8E4 226.0991 8.1E4 227.1070 3.7E4 231.9408 2.4E3 233.9008 3.0E3 235.1126 6.3E3 236.1197 2.7E4 237.0910 3.3E4 238.0988 2.0E5 238.8762 2.4E3 239.1067 2.4E5 241.0859 7.1E5 241.1142 5.1E3 242.0937 1.5E5 246.6246 2.4E3 252.1137 1.7E4 253.1221 1.0E5 254.1013 2.0E3 254.1299 4.7E5 255.1017 1.6E5 256.0778 1.6E4 256.1092 1.2E6 256.1412 2.6E3 257.1175 1.6E4 259.2775 2.5E3 270.1252 2.4E5 285.1481 3.8E4 285.2988 2.7E3 290.4687 3.0E3 END IONS BEGIN IONS FEATURE_ID=317 PEPMASS=461.3008 SCANS=317 RTINSECONDS=364.208 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 57.6899 2.2E3 69.0217 2.5E3 69.0680 2.2E3 70.0316 2.6E3 91.7929 2.3E3 92.7002 2.4E3 104.8318 2.2E3 107.0490 2.9E4 111.4262 2.4E3 114.3615 2.5E3 117.1744 2.7E3 119.0488 1.3E4 121.0645 2.7E5 121.0740 2.3E3 123.0806 2.7E3 125.0586 3.0E3 133.0646 2.5E4 135.0804 1.6E4 137.0595 5.0E3 139.0749 2.7E4 145.0648 2.0E4 147.0686 2.6E3 147.0801 1.6E5 151.0751 8.3E4 151.6718 2.3E3 156.2728 2.5E3 159.0797 1.0E4 161.0962 2.0E4 163.0752 1.2E5 164.0825 4.0E3 165.0907 1.7E5 165.1063 4.1E3 167.1067 7.4E3 169.2177 2.4E3 171.0803 2.5E3 172.7460 2.5E3 173.2223 2.6E3 173.5219 3.2E4 173.5403 4.2E4 177.0909 2.3E4 178.0995 2.6E3 178.7256 2.4E3 179.1070 6.8E3 185.5659 2.7E3 191.1063 6.8E4 192.5184 2.3E3 192.9059 2.3E3 197.0968 1.3E4 201.3723 2.8E3 222.1498 5.4E3 224.0832 3.6E3 225.0917 5.3E3 225.1274 7.3E4 233.7442 2.4E3 235.1123 2.4E3 237.1728 6.3E3 238.0987 6.6E3 238.6022 2.5E3 248.8866 2.6E3 251.9955 2.3E3 253.1221 9.7E4 254.1294 1.4E4 256.1098 3.3E4 257.1188 4.3E3 257.1523 2.9E3 262.0878 2.4E3 267.1376 1.0E4 270.1247 1.2E5 285.1106 5.0E3 285.1485 1.5E6 326.1181 2.7E3 344.1717 3.2E3 344.1828 2.0E3 344.2219 4.7E5 344.2699 1.5E4 346.1386 2.8E3 349.3935 3.0E3 401.3002 2.6E3 END IONS BEGIN IONS FEATURE_ID=318 PEPMASS=515.2327 SCANS=318 RTINSECONDS=365.465 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 80.8486 2.4E3 86.0961 1.3E4 99.0640 2.6E3 103.5919 2.7E3 110.0710 1.1E5 112.0867 9.1E3 121.2090 2.5E3 122.0598 3.1E3 129.0569 2.5E3 130.0648 1.3E5 134.0603 5.8E3 135.7315 2.4E3 136.0753 5.6E4 140.0815 2.9E3 145.1749 2.4E3 146.0602 6.7E3 156.0442 5.2E4 158.0596 2.5E4 160.0383 3.5E3 160.5765 3.4E3 163.0516 2.2E3 164.8708 2.4E3 168.9792 2.5E3 169.5822 8.5E3 173.5278 4.5E4 173.5363 1.3E4 174.0549 3.6E4 175.1192 1.8E4 180.5486 2.4E3 181.0719 2.5E4 188.0343 1.1E4 199.0996 5.6E3 209.7369 2.7E3 221.5905 4.3E3 227.1180 1.8E5 228.1122 5.3E4 228.6116 3.7E3 230.1176 5.7E4 235.1189 3.4E3 238.1240 2.1E4 245.1296 8.9E3 251.1137 9.2E4 251.6148 1.4E4 252.1467 2.6E3 253.0971 9.1E4 255.1126 1.0E5 256.1146 3.7E3 258.1122 2.5E3 273.1243 6.8E3 275.1393 1.2E4 277.1414 3.2E4 278.1252 8.5E4 279.1092 2.9E4 280.8891 2.9E3 281.0925 2.0E5 282.0948 1.4E4 294.1668 2.5E4 301.1195 2.9E4 302.3738 2.7E3 303.1200 3.7E4 312.1784 2.8E4 320.1465 6.1E3 321.1586 8.5E3 323.6729 2.5E3 336.2358 2.4E3 338.1573 4.2E4 353.6488 2.6E3 395.1141 2.7E3 396.1655 1.3E4 410.1834 3.3E3 410.2394 2.6E3 423.2235 2.7E3 438.1859 1.6E4 441.1892 1.7E4 442.1738 6.7E3 449.2003 2.6E3 458.2151 2.5E4 473.2291 3.1E3 475.2409 8.1E4 476.2421 1.1E4 484.1952 2.1E4 501.2214 2.7E4 508.3581 2.6E3 520.7061 2.6E3 533.2009 2.6E3 586.3063 2.7E3 612.2887 7.8E3 636.2887 2.8E4 646.2734 3.3E3 672.4435 2.5E3 749.3753 3.2E4 750.3655 2.6E3 750.3772 1.1E4 758.0978 2.7E3 775.3520 4.3E4 776.3574 3.4E3 END IONS BEGIN IONS FEATURE_ID=319 PEPMASS=515.7342 SCANS=319 RTINSECONDS=365.746 CHARGE=2+ MSLEVEL=2 MERGED_STATS=1 / 1 (0 removed due to low quality, 0 removed due to low cosine). 84.1218 2.7E3 109.7604 2.5E3 110.0710 8.4E3 130.0649 1.2E4 136.0755 3.7E3 156.0443 5.3E3 173.5264 1.3E4 173.5451 3.8E3 203.0068 2.3E3 227.1178 9.0E3 228.1133 4.7E3 230.1176 2.7E3 251.1140 2.8E3 253.0981 4.2E3 255.1134 6.2E3 278.1258 6.4E3 281.0930 1.1E4 365.0658 2.9E3 475.2414 4.5E3 574.3746 2.4E3 END IONS BEGIN IONS FEATURE_ID=320 PEPMASS=402.1398 SCANS=320 RTINSECONDS=366.619 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 6 (0 removed due to low quality, 0 removed due to low cosine). 57.5654 2.0E3 62.1544 2.1E3 62.2218 2.4E3 69.0331 3.6E4 69.4145 2.5E3 71.7878 2.3E3 75.6992 2.4E3 79.0541 1.6E4 81.0695 5.5E3 82.9631 2.6E3 84.7385 2.4E3 85.0282 1.2E4 86.2745 2.4E3 87.2035 2.7E3 90.0472 2.1E3 90.6548 2.3E3 91.0540 1.6E4 93.0694 3.3E3 95.0124 3.7E4 95.7503 2.4E3 97.0281 1.9E5 97.0646 6.1E3 97.3724 2.5E3 99.0437 3.5E3 99.7957 2.2E3 103.8570 2.4E3 103.9046 2.5E3 105.0698 2.8E3 105.7352 2.4E3 107.0493 5.5E3 107.0852 2.8E5 109.0641 3.0E3 109.1013 2.2E4 113.0230 1.4E5 116.7134 2.9E3 117.0697 2.5E4 119.4967 2.3E3 121.5194 2.5E3 123.0073 9.9E4 123.0438 2.9E3 125.0231 4.2E4 125.0958 4.8E4 135.0802 1.3E6 135.0896 1.8E4 135.0927 4.7E3 141.0065 4.2E3 141.0180 1.6E5 143.0337 1.1E5 149.6862 5.2E3 153.0909 6.0E4 160.9710 2.3E3 161.4300 2.3E3 163.0590 1.1E4 163.0753 1.0E6 163.0911 2.1E4 165.9697 2.5E3 169.0131 1.7E5 169.0284 4.3E3 173.5264 3.7E4 173.5364 3.4E4 181.0859 1.1E5 187.0239 3.6E4 190.6372 2.4E3 199.0974 3.0E3 204.0346 2.4E3 228.7551 2.3E3 293.0537 2.5E3 298.1811 2.7E3 387.8698 2.8E3 391.3299 2.5E3 404.3260 2.4E3 408.9921 2.4E3 END IONS BEGIN IONS FEATURE_ID=321 PEPMASS=211.0969 SCANS=321 RTINSECONDS=372.264 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 41.0385 1.4E4 43.0177 5.0E5 45.0333 1.4E5 47.6900 2.8E3 48.1603 2.2E3 51.3004 2.2E3 53.0385 3.1E3 53.3118 2.2E3 53.6859 2.4E3 55.0174 3.2E3 55.0540 9.1E4 55.7275 2.8E3 57.0332 1.1E5 57.0696 1.1E5 60.0088 2.1E3 62.8839 2.3E3 65.0383 5.5E4 67.0180 2.3E3 67.0540 7.1E5 67.0580 3.7E3 67.0604 5.1E3 68.9968 7.4E4 69.0332 2.1E4 69.9606 2.4E3 72.9516 2.1E3 73.0849 2.2E3 79.0538 2.7E4 81.0646 3.2E3 81.0696 2.1E5 83.0490 1.1E4 83.0851 8.0E3 85.0281 1.1E4 85.0644 5.7E5 85.0707 4.6E3 86.7319 2.7E3 91.0539 1.5E4 93.0697 6.6E3 95.0489 1.7E4 95.0852 2.7E4 99.0800 6.8E4 100.5199 2.5E3 100.8753 2.4E3 102.7358 2.4E3 105.0695 2.3E4 107.0489 5.0E3 107.0853 2.5E4 109.0286 4.0E3 109.0561 8.6E3 109.0644 4.0E5 109.0736 3.0E3 109.1006 2.6E3 109.9475 2.3E3 111.0073 1.9E4 111.0437 1.2E4 111.5399 2.2E3 113.0600 2.6E3 118.9631 3.1E3 119.0490 3.1E3 119.0852 2.4E4 119.9572 3.6E3 121.0645 2.3E4 123.0336 4.9E3 123.0437 6.4E5 123.0549 3.6E3 123.0715 3.7E3 123.0800 1.4E5 125.0956 8.1E4 127.0386 1.2E5 127.0750 4.3E5 127.0842 2.1E3 129.0696 2.0E4 133.0647 3.0E3 135.0439 2.6E3 137.0229 5.8E3 137.0594 9.6E4 137.0960 1.1E4 139.0274 4.9E3 139.0387 1.7E5 139.0511 3.9E3 139.9048 2.4E3 147.0801 3.9E4 149.0593 1.8E4 151.0386 7.4E4 151.0749 6.2E4 151.0867 3.2E3 153.0173 2.5E3 153.0543 5.8E4 153.3280 2.7E3 155.0335 2.0E5 155.0482 2.4E3 159.9886 5.7E3 160.0516 2.8E4 161.4671 2.2E3 163.0385 1.1E4 164.0466 1.0E5 165.0545 3.0E4 165.0908 1.2E5 166.3739 2.3E3 167.0699 9.6E3 173.5268 2.7E4 173.5396 2.4E4 175.0753 9.5E4 178.0621 7.5E3 193.0857 1.1E5 206.4661 2.1E3 END IONS BEGIN IONS FEATURE_ID=322 PEPMASS=264.2323 SCANS=322 RTINSECONDS=372.42 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 5 (0 removed due to low quality, 0 removed due to low cosine). 48.3573 2.7E3 49.0997 2.7E3 49.2782 2.3E3 54.8553 2.6E3 55.7528 2.5E3 57.2625 2.3E3 58.0648 3.5E4 58.4527 2.2E3 60.0481 2.1E3 64.4462 2.5E3 69.0695 1.8E4 69.9620 2.1E3 70.0647 2.6E4 71.0488 1.0E4 72.4496 2.8E3 74.2858 2.8E3 75.1304 2.5E3 78.8939 2.4E3 79.8744 2.4E3 81.0694 3.2E4 86.6528 2.5E3 93.0694 4.9E4 95.0852 2.9E4 95.4557 2.4E3 96.3756 2.7E3 99.0331 2.8E3 100.0753 9.0E3 100.6371 2.7E3 104.2718 2.4E3 105.0694 3.9E4 107.0851 4.9E4 108.0805 3.1E3 108.8218 2.8E3 109.1009 1.5E4 112.1115 2.5E3 119.0849 4.4E4 119.9670 2.3E3 121.1008 4.2E4 122.0957 2.5E3 123.0802 9.1E3 123.1160 1.2E4 123.4371 2.5E3 130.5157 2.2E3 133.1005 5.2E4 137.1320 1.0E4 138.1271 1.4E4 139.7482 2.5E3 145.1004 3.3E3 146.2184 2.6E3 147.1163 7.3E4 149.1320 1.4E5 151.1109 2.1E4 159.1161 7.4E3 159.9546 2.4E3 161.1322 3.4E3 163.1114 6.4E3 163.1474 4.1E3 173.1326 1.2E4 173.5211 4.4E3 173.5278 2.7E4 173.5398 2.3E4 187.1482 1.0E4 189.1635 1.0E5 191.1431 9.3E3 203.1782 7.0E3 204.1750 6.3E3 207.1745 1.5E4 212.9392 3.0E3 229.1949 2.5E4 246.2214 2.1E4 247.2044 3.1E3 264.1039 3.2E3 264.2319 7.3E5 265.1938 2.5E3 END IONS BEGIN IONS FEATURE_ID=323 PEPMASS=471.2132 SCANS=323 RTINSECONDS=373.257 CHARGE=1+ MSLEVEL=2 MERGED_STATS=7 / 7 (0 removed due to low quality, 0 removed due to low cosine). 61.3473 2.9E3 69.1678 2.4E3 69.8838 2.5E3 73.5411 2.6E3 74.4928 2.4E3 81.3190 2.4E3 82.0649 2.7E3 91.0542 3.4E4 92.8976 2.7E3 93.0530 2.4E3 93.4390 2.8E3 104.2593 2.3E3 111.0647 2.2E3 111.7653 2.3E3 112.6352 2.4E3 115.3149 2.9E3 119.0490 1.5E4 119.4039 2.6E3 120.6921 2.4E3 127.9030 2.7E3 133.1180 2.4E3 135.0440 2.9E3 137.0596 6.9E5 137.0692 3.1E3 138.8562 2.3E3 147.0441 1.9E4 147.3581 2.4E3 157.0650 3.2E3 158.9494 2.4E3 161.0594 2.6E3 162.0677 6.3E4 163.0391 8.1E3 163.0757 7.6E3 171.3859 2.4E3 172.5675 2.2E3 173.5283 9.9E4 173.5442 6.4E3 174.0303 2.7E3 175.0396 1.4E4 175.0757 3.9E3 176.0475 5.0E3 177.0555 1.2E4 178.0628 5.1E4 178.4880 2.6E3 189.0546 4.4E4 190.0429 9.2E3 190.0624 4.4E5 190.0795 3.7E3 190.0827 6.6E3 191.0339 8.1E4 191.0701 3.2E4 192.0812 3.0E3 192.1019 9.4E5 192.1219 1.5E4 193.0859 3.8E5 204.2693 2.7E3 205.8158 2.5E3 206.0575 1.6E5 206.0771 2.3E3 206.1794 2.5E3 206.7206 2.4E3 221.0307 1.2E4 221.0809 3.6E6 221.1067 2.8E3 221.1324 9.1E3 226.8391 2.4E3 251.1387 2.6E3 325.1648 2.4E3 327.6342 2.5E3 329.2260 2.7E3 338.1438 2.2E3 339.8834 2.5E3 349.5995 2.5E3 361.9400 2.5E3 366.7722 2.4E3 413.7135 2.6E3 429.4442 2.6E3 443.4627 2.5E3 454.5101 2.8E3 471.2571 5.7E3 END IONS BEGIN IONS FEATURE_ID=324 PEPMASS=346.2015 SCANS=324 RTINSECONDS=374.863 CHARGE=1+ MSLEVEL=2 MERGED_STATS=1 / 1 (0 removed due to low quality, 0 removed due to low cosine). 58.0652 9.5E3 66.0734 2.2E3 66.7098 2.2E3 70.4197 2.2E3 71.5952 2.3E3 75.0440 4.1E3 81.0701 4.6E3 91.0543 1.8E4 93.0698 1.0E4 95.0493 6.4E3 103.0544 4.5E3 105.0700 1.0E4 107.0492 1.0E5 107.0575 2.8E3 109.0648 4.0E3 110.1821 2.4E3 111.0803 2.6E3 117.0703 6.2E3 119.0491 3.1E4 119.0854 2.2E4 121.0284 3.4E3 121.0570 6.6E3 121.0648 4.8E5 122.0682 1.6E4 122.4887 2.5E3 123.0710 4.7E3 123.0806 7.0E3 124.0518 6.3E3 125.0597 7.4E3 129.0694 3.1E3 131.0492 7.6E3 131.0852 3.9E3 133.0649 5.0E4 135.0804 2.9E4 137.0601 1.5E4 139.0754 2.1E4 141.0910 2.9E3 145.0649 2.6E4 147.0609 3.6E3 147.0805 1.9E5 148.0839 8.0E3 149.0602 7.9E3 149.0846 4.2E3 149.0964 1.1E4 150.0676 2.4E4 151.0754 1.5E5 152.0811 9.7E3 157.0644 3.9E3 159.0806 2.0E4 160.0883 1.8E4 161.0600 4.9E3 161.0963 2.1E4 163.0634 7.4E3 163.0755 3.9E5 164.0808 1.6E4 165.0912 2.2E5 166.0948 9.9E3 167.0952 3.7E3 171.0823 3.0E3 173.0964 7.9E3 173.5380 1.3E4 176.0832 1.2E4 177.0913 3.1E4 178.0968 5.6E3 179.0895 4.5E3 179.1067 2.0E4 183.0812 9.0E3 185.0959 3.5E3 191.1068 8.9E4 192.1105 5.0E3 195.0798 3.9E3 196.0888 1.1E4 197.0963 2.8E4 207.1180 2.9E3 210.1045 4.3E3 211.1127 5.5E3 215.3264 2.5E3 221.0965 8.3E3 223.1118 2.6E3 224.0834 1.6E4 225.0911 1.4E4 225.1276 5.7E4 226.1004 3.6E3 227.1070 4.2E3 229.0328 2.6E3 229.1241 5.1E3 235.1122 6.6E3 238.0989 2.2E4 239.1069 6.4E3 241.0859 9.0E3 242.0923 7.0E3 253.1223 4.5E4 254.1300 4.7E4 255.1016 6.3E3 255.1307 5.7E3 256.1094 1.1E5 257.1153 1.1E4 257.1525 5.1E3 258.1156 6.7E3 267.1373 5.9E3 268.8536 3.0E3 270.1253 8.6E4 272.1314 5.5E3 285.1489 1.4E5 286.1528 3.5E3 287.1550 1.7E4 END IONS BEGIN IONS FEATURE_ID=325 PEPMASS=427.1734 SCANS=325 RTINSECONDS=388.542 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 9 (4 removed due to low quality, 0 removed due to low cosine). 57.0697 6.6E3 61.8594 2.5E3 64.0580 2.3E3 70.3860 2.3E3 71.0852 1.1E4 71.4235 2.4E3 78.8243 2.3E3 79.1027 2.3E3 85.1011 1.3E4 95.3305 2.7E3 95.7113 2.2E3 101.0598 7.5E3 109.1109 2.4E3 111.0436 1.1E4 127.7613 2.9E3 151.7661 2.5E3 154.4808 2.5E3 173.1705 2.6E3 173.5233 7.6E3 173.5316 6.9E4 173.5425 1.4E4 174.5852 2.3E3 175.0363 4.1E3 176.0442 3.7E3 341.3344 2.2E3 412.1486 3.4E3 415.5769 2.9E3 427.1732 4.1E5 433.5286 2.5E3 437.6942 2.9E3 END IONS BEGIN IONS FEATURE_ID=326 PEPMASS=201.0913 SCANS=326 RTINSECONDS=388.582 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 5 (1 removed due to low quality, 0 removed due to low cosine). 41.9223 2.1E3 42.7800 2.5E3 43.7122 2.2E3 46.4510 2.7E3 49.0140 2.0E3 50.0859 2.1E3 55.9314 2.7E3 55.9342 2.0E5 56.9346 7.3E4 58.1666 2.6E3 60.0441 2.3E3 62.2826 2.7E3 62.9016 2.1E3 65.9291 2.3E3 67.9114 2.0E3 68.6980 2.5E3 71.9289 3.2E3 72.9368 4.0E4 73.9373 8.7E3 74.8919 2.3E3 85.0179 2.1E3 87.1681 2.8E3 87.4454 2.2E3 89.9397 3.1E3 90.9474 5.0E4 91.9478 1.6E4 92.3038 2.3E3 93.8202 2.6E3 94.4117 2.7E3 96.9369 3.5E3 96.9605 2.8E3 102.9484 2.4E3 107.9501 2.2E4 108.0829 2.5E3 108.9503 2.6E3 108.9586 2.6E3 110.4654 2.4E3 110.6602 2.5E3 113.9633 1.2E4 114.9478 2.5E4 114.9711 1.7E4 115.0542 1.1E4 115.7045 2.5E3 115.9791 2.8E4 118.9426 8.2E3 125.9607 2.7E3 128.0619 1.1E4 128.9504 3.9E4 129.0695 2.0E4 129.9523 4.8E4 130.0776 2.7E4 131.9739 1.0E5 132.9586 1.4E4 135.9451 3.6E4 136.9464 1.1E4 137.9639 1.1E4 140.0619 3.7E4 141.0695 1.9E4 142.0783 2.7E3 149.6838 4.0E3 149.6938 3.2E3 149.9845 1.1E4 152.2750 2.5E3 155.9743 7.9E3 156.0568 1.5E4 157.0502 3.2E3 157.0646 4.2E5 158.0724 2.4E5 158.0873 4.2E3 171.0426 2.7E3 172.0509 3.8E3 173.5306 3.8E4 185.0600 3.3E4 186.0678 2.9E4 198.0145 2.8E3 201.0910 2.3E5 201.1126 2.3E3 201.5223 2.7E3 END IONS BEGIN IONS FEATURE_ID=327 PEPMASS=369.1700 SCANS=327 RTINSECONDS=388.604 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 9 (4 removed due to low quality, 0 removed due to low cosine). 52.4887 2.9E3 55.0177 4.0E3 55.9581 2.7E3 57.6570 3.0E3 61.3810 2.4E3 64.2234 2.4E3 64.6476 2.1E3 65.0392 5.1E3 65.1384 2.4E3 67.6801 2.2E3 69.0698 8.5E3 70.0650 1.1E5 71.0493 6.0E3 71.0685 3.0E3 71.4613 2.1E3 71.7219 2.7E3 74.8680 2.3E3 75.0439 3.1E4 79.0539 4.0E3 79.4964 2.3E3 80.0618 3.6E3 85.0164 2.6E3 86.0963 4.8E4 87.0997 4.2E3 87.1325 2.5E3 90.0464 8.6E3 91.0541 4.3E4 91.2405 2.1E3 93.0698 3.7E3 95.0490 6.7E4 97.3883 2.5E3 103.9659 2.1E3 106.0413 2.5E3 106.4561 2.7E3 107.0491 7.9E4 108.0568 4.4E4 109.0648 3.0E3 110.0712 1.5E4 118.0653 6.8E3 119.0486 2.4E3 120.5707 2.6E3 121.0647 7.5E4 123.0803 1.5E4 124.0520 1.1E4 128.0618 1.7E4 129.0696 7.9E3 135.0440 4.3E4 136.0517 5.7E5 136.0638 1.5E4 137.0596 3.6E4 138.0674 3.8E3 139.0647 3.2E3 139.0751 7.8E4 140.6530 2.4E3 143.0852 2.7E4 144.0566 2.4E3 145.0646 2.5E4 146.0601 1.2E4 146.0727 1.0E4 148.0519 2.9E3 149.0598 3.3E4 150.0675 2.0E4 151.0752 4.4E6 151.1034 1.9E4 151.1119 4.3E3 153.0906 6.2E3 156.0573 5.1E3 157.0648 4.5E4 158.0726 6.1E4 159.0807 2.4E4 160.0880 4.6E3 161.0597 2.5E4 162.0677 1.3E4 163.0754 4.1E4 165.0549 5.1E4 165.0910 1.4E5 166.9808 2.2E3 167.0704 2.5E4 167.2668 2.7E3 169.0642 2.7E3 170.0716 4.1E3 171.0802 5.9E4 172.0882 3.0E5 172.1097 9.5E3 173.0597 6.7E4 173.0960 1.1E4 173.5220 2.8E4 173.5398 5.3E4 174.0677 7.8E4 174.3368 2.6E3 175.0752 7.1E4 177.0910 9.4E4 179.0702 7.7E4 181.0714 3.7E3 181.0853 3.1E3 182.0726 7.2E3 183.0805 1.6E4 185.0590 4.3E3 186.0675 2.7E4 187.0753 3.3E4 188.0831 8.0E5 189.0909 2.9E5 189.1106 3.4E3 190.0983 3.2E3 191.0701 5.2E4 191.1063 2.7E4 193.0857 3.7E4 193.1085 2.9E3 198.0668 8.5E3 199.0752 1.3E4 200.0835 2.7E4 201.0692 1.3E4 201.0909 1.4E6 201.1130 9.8E3 202.0986 1.0E4 203.0892 3.2E3 203.1066 9.2E5 203.1380 3.6E3 205.0857 2.8E4 207.3678 2.6E3 213.0737 2.3E3 213.0911 2.2E5 215.1066 9.4E4 216.0780 3.8E4 217.0869 3.9E3 221.0974 5.7E3 223.4850 2.3E3 224.0834 1.7E4 225.0907 1.1E4 227.1059 3.7E3 231.1015 8.1E5 231.1401 3.7E3 233.0959 2.9E4 234.1048 3.6E3 238.0985 3.1E3 240.0778 8.9E3 241.0857 3.4E3 245.0958 4.5E4 246.1028 2.0E4 247.0760 3.4E3 247.1109 1.2E4 248.6856 2.8E3 249.0904 3.1E4 249.1293 2.5E3 251.1044 3.1E3 253.0859 3.4E4 254.0946 6.1E3 255.1014 2.0E5 257.0953 3.1E3 258.1043 1.1E4 259.1114 2.5E4 260.0855 2.9E3 260.1179 6.7E3 261.0907 1.2E5 262.0986 7.7E4 263.1066 2.8E4 264.1134 6.6E3 264.7245 2.7E3 265.1222 3.0E4 267.1004 1.2E4 268.0745 3.2E3 268.1092 2.4E5 269.0808 5.3E4 269.1116 3.5E3 272.0831 3.1E3 273.0909 5.5E4 274.0991 2.4E4 275.1066 1.3E5 276.0800 4.1E3 276.1143 2.0E5 277.0861 6.7E4 277.1222 2.1E5 278.0935 3.4E4 278.1262 8.6E3 279.1021 3.6E4 281.1169 4.7E4 282.1234 3.5E3 283.0598 2.6E3 283.0966 4.2E5 284.0694 3.0E3 284.1042 1.5E5 286.0409 2.4E3 286.1018 2.6E3 287.1070 3.4E4 288.1146 1.1E5 289.0859 6.3E4 289.1224 4.2E5 289.1596 5.8E3 290.0939 3.3E4 290.1279 8.0E3 291.1019 4.8E4 291.1337 5.8E3 292.1093 9.5E4 293.1172 4.4E5 294.0895 5.0E3 294.1253 6.7E4 295.0971 8.9E3 295.1320 1.6E4 296.1045 2.8E4 297.1137 7.0E3 298.1199 1.1E6 298.1528 3.3E3 299.1279 9.5E4 303.1010 2.6E4 304.1095 1.2E5 305.0767 9.6E3 305.1170 9.5E5 305.1470 2.8E3 305.1586 1.5E4 306.0885 1.3E4 306.1255 3.6E4 307.0960 1.3E4 307.1327 2.2E5 308.1032 2.1E4 308.1405 4.6E5 308.1802 4.5E3 309.1120 2.8E5 309.1515 1.0E4 310.1200 2.8E4 310.1558 3.6E3 311.1277 1.7E5 311.5631 2.9E3 312.1354 1.2E4 318.1252 2.0E4 319.1327 3.3E5 320.0982 5.6E3 320.1405 1.0E6 320.1736 2.1E3 321.1119 5.4E5 321.1547 1.1E4 322.1200 1.3E4 323.1278 9.2E4 324.1354 8.1E5 325.1433 5.6E4 326.1528 4.2E3 335.1278 8.0E4 336.1352 2.4E5 338.1513 7.2E4 339.1224 3.3E3 339.1585 1.8E5 351.1082 3.9E3 351.1587 4.5E5 366.4273 2.8E3 369.1691 3.1E4 370.8504 2.8E3 END IONS BEGIN IONS FEATURE_ID=328 PEPMASS=422.2180 SCANS=328 RTINSECONDS=388.66 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 7 (2 removed due to low quality, 0 removed due to low cosine). 55.0178 7.3E3 55.0542 5.9E3 55.4056 2.6E3 60.8776 2.7E3 62.4748 2.2E3 67.2502 2.4E3 67.4929 2.2E3 67.4969 2.7E3 69.0317 2.2E3 69.0401 2.3E3 71.5736 2.3E3 75.0437 4.3E3 75.3804 2.4E3 76.7021 2.2E3 79.0544 3.1E3 80.7699 2.6E3 83.0489 3.9E4 85.9625 2.2E3 87.2294 2.2E3 87.4144 2.0E3 87.7045 2.2E3 91.0542 6.0E3 94.6434 2.6E3 95.0489 3.9E4 104.2933 2.3E3 104.3940 2.3E3 107.0492 1.0E4 114.7487 2.4E3 115.2988 2.6E3 116.3541 2.4E3 117.0688 5.5E3 121.0646 4.0E4 124.0518 1.1E4 126.8570 2.5E3 128.0621 2.4E3 129.0699 3.5E3 130.6715 2.5E3 135.0443 5.1E3 136.0411 3.4E3 136.0517 1.6E5 136.0636 2.6E3 137.0595 3.3E4 138.0673 1.5E4 139.0750 1.0E5 139.4783 2.4E3 143.0853 2.6E4 145.0417 2.4E3 145.0645 5.9E3 146.0724 3.0E4 147.0797 9.8E3 147.8478 2.6E3 149.0595 7.1E3 149.6661 2.9E3 149.6862 1.1E4 151.0751 2.0E6 151.0870 2.9E3 151.1036 1.1E4 155.9653 2.3E3 156.0563 2.7E3 157.0649 1.1E4 158.0721 1.7E4 159.0802 8.1E3 160.0880 7.1E3 161.0596 5.6E4 162.0675 9.7E3 163.0757 1.7E4 165.0545 1.6E4 165.0908 2.6E4 167.0702 8.8E4 171.0807 1.9E4 172.0881 2.4E5 172.1140 3.2E3 173.0596 2.8E4 173.0958 1.2E4 173.5279 5.5E3 173.5304 3.2E4 174.0675 1.2E5 175.0752 1.3E5 175.1121 2.9E3 177.0909 6.2E5 179.0705 1.5E4 181.0864 5.6E3 188.0830 4.2E5 189.0709 8.3E3 189.0908 8.3E5 189.1106 2.8E3 189.4069 2.6E3 191.0705 8.5E3 191.1064 7.7E4 193.0862 8.1E3 193.1216 1.2E4 198.3534 2.4E3 199.0738 2.9E3 200.0831 5.0E3 201.0693 5.9E3 201.0909 8.5E5 202.0989 6.7E3 203.1065 1.1E6 203.1236 9.1E3 205.0848 3.2E3 205.1133 2.3E3 213.0909 4.3E4 215.1060 1.5E4 216.0782 1.7E4 219.1017 2.0E4 221.1171 1.7E4 231.1015 2.8E5 234.7764 2.4E3 243.8389 2.5E3 249.1119 3.2E3 252.6229 2.7E3 268.1098 2.9E4 275.1045 4.1E3 276.1138 2.3E4 277.1230 1.6E4 283.0958 2.4E4 284.1034 1.8E4 288.1142 1.3E4 288.8660 2.6E3 289.1220 3.2E4 292.1084 1.3E4 293.1170 2.8E4 294.1265 3.8E3 298.1198 1.6E5 299.1274 3.8E4 304.1085 1.4E4 305.0805 4.2E3 305.1171 7.6E4 307.1331 4.7E4 308.1409 1.1E5 309.1121 1.6E4 311.1279 6.5E4 319.1328 7.3E4 320.1406 2.1E5 321.1124 3.5E4 323.1298 3.2E3 324.1360 1.6E5 325.1435 1.2E4 335.1269 3.2E3 336.1351 6.0E4 338.1505 7.9E3 339.1589 2.2E5 351.1589 2.1E5 369.1719 1.5E4 398.4547 2.5E3 END IONS BEGIN IONS FEATURE_ID=329 PEPMASS=387.1808 SCANS=329 RTINSECONDS=388.699 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 8 (3 removed due to low quality, 0 removed due to low cosine). 54.2725 2.2E3 55.0178 2.9E4 55.0542 6.2E3 55.2505 2.3E3 58.2820 2.2E3 59.3020 2.2E3 60.8790 3.3E3 62.2828 2.6E3 65.6570 2.4E3 66.1039 2.8E3 66.8358 2.2E3 67.0539 2.4E3 70.8556 2.3E3 71.1097 2.5E3 73.2466 2.6E3 75.0440 1.7E4 79.0542 3.6E3 83.0492 1.3E4 86.0779 2.4E3 90.7856 2.1E3 91.0542 2.5E4 95.0491 8.7E3 98.9939 2.3E3 107.0491 4.1E4 108.0569 2.6E4 109.0646 4.4E3 111.3214 2.8E3 115.0547 9.0E3 117.0701 8.2E3 117.6163 3.0E3 118.6395 2.5E3 119.6913 2.3E3 121.0647 7.8E4 123.0803 6.2E3 124.0515 3.1E4 128.0625 1.4E4 129.0697 2.1E4 131.0490 8.3E3 132.0565 3.2E3 135.0439 1.7E4 136.0518 4.0E5 136.0640 3.7E3 137.0595 3.8E4 138.0673 1.4E4 139.0752 1.3E5 140.0625 4.1E3 141.0693 4.3E3 143.0853 2.6E4 145.0648 1.9E4 146.0725 5.4E4 147.0810 8.1E3 149.0595 2.1E4 149.6872 4.8E3 149.7076 2.7E3 150.0675 6.4E3 151.0645 4.9E3 151.0752 3.1E6 151.1034 9.3E3 153.6740 2.4E3 156.0569 5.0E3 157.0647 9.0E4 158.0726 1.3E5 159.0437 1.5E4 159.0802 2.1E4 160.0513 7.4E3 160.0880 1.4E4 161.0597 3.3E4 162.0673 1.4E4 162.9537 2.7E3 163.0753 5.2E4 165.0547 6.7E4 165.0909 9.2E4 167.0700 5.4E4 171.0807 3.5E4 172.0883 2.8E5 172.1054 4.5E3 173.0598 6.1E4 173.0953 7.9E3 173.5275 5.1E4 173.5385 2.0E4 173.5474 3.7E3 174.0502 4.4E3 174.0676 3.7E5 175.0755 8.9E4 176.0831 7.4E3 177.0910 3.1E5 179.0702 4.9E4 186.0676 3.1E4 187.0760 9.1E3 188.0831 6.1E5 189.0711 8.3E3 189.0910 1.7E6 189.1110 5.0E3 189.4647 2.4E3 191.0704 3.4E4 191.1066 7.9E4 193.0859 4.1E4 199.0760 6.1E3 200.0832 1.0E4 201.0470 5.6E3 201.0910 2.6E6 201.1347 7.5E3 202.0970 6.1E3 203.1067 9.7E5 205.0857 1.8E4 213.0911 1.3E5 215.0858 3.4E3 215.1067 6.2E4 216.0779 1.7E4 218.8784 2.6E3 219.1016 1.2E4 222.7876 2.6E3 224.0832 9.6E3 229.2517 3.2E3 231.1016 5.8E5 231.1269 3.8E3 233.0963 8.9E3 233.8132 2.8E3 245.0962 1.5E4 246.1037 2.8E3 249.0909 9.9E3 250.0978 3.2E3 253.0832 3.3E3 254.0923 2.7E3 255.1014 1.1E5 259.1113 9.4E3 260.1194 3.1E3 261.0906 5.5E4 262.0988 3.5E4 263.1070 7.7E3 263.5247 2.4E3 265.0885 3.2E3 265.1228 1.2E4 268.1094 1.4E5 269.0806 1.7E4 273.0920 2.3E4 274.0990 9.4E3 275.1068 6.8E4 276.1146 1.2E5 277.0871 3.4E4 277.1223 1.1E5 277.1543 3.8E3 278.0938 1.4E4 278.1287 9.9E3 279.1010 9.7E3 281.1175 2.0E4 283.0966 2.1E5 283.1320 3.1E3 284.1043 1.0E5 287.1066 1.2E4 288.1144 6.6E4 289.0870 3.5E4 289.1226 2.1E5 290.1268 3.3E3 291.1006 1.8E4 291.1358 4.4E3 292.1095 6.0E4 293.1171 2.5E5 294.1252 4.0E4 295.0966 4.7E3 295.1317 5.0E3 296.1045 9.0E3 298.1200 7.1E5 298.1756 3.7E3 299.1279 7.7E4 303.1014 1.0E4 304.1095 6.7E4 305.0767 4.3E3 305.1170 4.7E5 306.0898 2.4E3 306.1255 1.7E4 307.0936 5.5E3 307.1329 1.4E5 308.1407 3.8E5 308.3329 2.7E3 309.1121 1.4E5 309.1503 2.5E3 310.1215 1.5E4 311.1278 2.0E5 312.1353 8.6E3 318.1252 9.6E3 319.1328 2.0E5 320.1406 5.7E5 321.1120 2.7E5 321.1544 3.5E3 322.1195 8.8E3 323.1277 5.6E4 324.1355 5.4E5 325.1433 3.6E4 335.1271 4.0E4 336.1355 1.5E5 337.1411 3.6E3 338.1513 3.8E4 339.1587 2.2E5 351.1075 3.3E3 351.1587 3.5E5 351.2089 3.8E3 368.4077 2.6E3 END IONS BEGIN IONS FEATURE_ID=330 PEPMASS=450.2492 SCANS=330 RTINSECONDS=388.725 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 9 (4 removed due to low quality, 0 removed due to low cosine). 56.9954 2.4E3 58.5690 2.4E3 59.8616 3.0E3 59.9399 2.1E3 60.0862 2.4E3 63.9167 2.3E3 71.2909 2.3E3 73.2656 2.6E3 82.5887 2.7E3 83.0491 6.9E3 89.8796 2.4E3 91.7031 2.6E3 95.0491 9.7E3 100.8660 2.3E3 106.8790 2.9E3 121.0645 1.2E4 125.1759 2.4E3 136.0518 4.8E4 137.0600 3.7E3 139.0751 2.7E4 146.0721 3.0E3 151.0646 5.3E3 151.0753 7.6E5 153.5924 2.3E3 160.6594 2.7E3 161.0600 6.7E3 165.0543 5.3E3 165.0914 9.5E3 167.0701 3.2E4 172.0885 5.8E4 173.5242 1.1E4 173.5323 7.0E4 173.5434 9.0E3 174.0678 3.8E4 175.0751 2.6E4 177.0911 1.4E5 178.0868 7.1E3 179.0711 2.9E3 188.0834 1.1E5 188.7335 2.8E3 189.0912 3.0E5 189.1107 4.7E3 191.1066 1.5E4 201.0694 3.0E3 201.0914 2.9E5 203.0889 2.4E3 203.1070 3.6E5 203.1273 4.9E3 211.9285 2.6E3 213.0919 1.2E4 215.1062 3.6E3 216.0775 2.6E3 219.1030 6.0E3 221.1179 5.1E3 231.1019 1.2E5 239.8538 2.5E3 260.1827 2.8E3 268.1099 7.8E3 276.1146 4.3E3 283.0965 6.6E3 284.1046 4.8E3 289.1215 4.7E3 293.1183 3.7E3 298.1205 7.4E4 299.1287 1.5E4 305.1186 1.7E4 306.7919 2.5E3 307.1333 1.5E4 308.1419 3.4E4 309.1155 3.3E3 311.1281 2.2E4 319.1335 2.0E4 320.1418 7.7E4 321.1135 7.3E3 324.1367 4.9E4 336.1358 2.0E4 338.1495 2.5E3 339.1602 7.7E4 351.1601 8.4E4 369.1665 2.5E3 382.1143 2.5E3 412.4333 2.5E3 436.3380 3.4E3 END IONS BEGIN IONS FEATURE_ID=331 PEPMASS=236.1679 SCANS=331 RTINSECONDS=389.133 CHARGE=1+ MSLEVEL=2 MERGED_STATS=29 / 29 (0 removed due to low quality, 0 removed due to low cosine). 43.1644 2.5E3 43.4094 2.5E3 43.6706 4.3E3 43.9774 2.1E3 44.7300 2.1E3 45.2636 2.6E3 45.4377 2.6E3 45.7026 2.6E3 45.7859 2.2E3 46.1938 2.1E3 46.3857 2.1E3 46.7263 2.5E3 46.7958 2.4E3 47.6304 2.2E3 47.8471 2.4E3 47.9953 2.3E3 48.1232 2.3E3 48.4383 2.1E3 48.7522 2.3E3 48.9593 2.5E3 49.9886 2.3E3 50.6017 2.2E3 51.3817 2.7E3 52.6704 2.3E3 52.9529 2.0E3 53.0742 2.3E3 53.5283 2.4E3 53.9055 2.3E3 54.1218 2.3E3 54.2131 2.0E3 54.9509 2.2E3 54.9892 2.3E3 56.0492 1.4E6 56.1432 2.3E3 56.2128 2.3E3 56.3378 2.4E3 56.5761 2.7E3 57.0333 1.5E5 57.1004 2.0E3 57.4984 2.3E3 58.6534 2.6E3 58.8569 2.2E3 58.9555 2.7E3 59.2313 2.4E3 59.3372 2.2E3 59.6921 2.2E3 59.8836 2.2E3 61.0290 2.1E3 61.8858 2.6E3 61.9034 2.4E3 62.1698 2.7E3 62.4223 2.5E3 63.0102 2.9E3 63.5090 2.3E3 63.5573 2.2E3 63.6311 2.1E3 64.4649 2.3E3 65.7253 2.4E3 66.5248 2.6E3 66.8533 2.6E3 67.3755 2.4E3 67.8137 2.8E3 68.7983 2.4E3 68.9873 2.3E3 69.0491 2.6E3 69.5710 2.2E3 71.2672 2.3E3 71.9501 2.3E3 71.9998 2.4E3 72.2347 2.4E3 72.6670 2.3E3 73.0755 2.1E3 73.3492 2.2E3 73.9270 2.7E3 74.0597 6.1E4 74.1545 2.5E3 74.7435 2.4E3 75.0255 3.1E3 75.6546 2.1E3 77.0414 4.1E4 77.6437 2.7E3 78.2028 2.2E3 78.6642 2.1E3 79.1844 2.5E3 79.6680 2.7E3 79.7546 2.5E3 81.0330 2.2E3 81.1970 2.1E3 81.3737 2.4E3 82.0035 2.7E3 82.8345 2.1E3 83.9338 2.1E3 84.3057 2.3E3 84.4702 2.8E3 86.0597 2.8E3 86.2231 2.2E3 87.0622 9.4E4 87.8494 2.2E3 88.1257 2.2E3 88.5606 2.4E3 89.0045 2.1E3 89.1233 2.2E3 89.6130 2.3E3 92.0501 2.4E3 92.3005 2.4E3 92.3737 2.7E3 93.0364 5.0E4 95.0155 2.4E3 96.1742 2.5E3 98.7500 2.5E3 100.0833 2.3E3 100.3017 2.4E3 103.0572 2.2E3 103.9396 2.5E3 104.0702 4.1E5 105.0726 7.2E5 107.0519 2.8E5 108.9142 3.2E3 109.0313 3.4E4 109.3410 2.5E3 109.6103 2.8E3 110.5277 2.3E3 111.6376 5.1E3 112.5138 2.4E3 115.0934 1.3E5 115.6824 2.5E3 116.2611 2.3E3 117.0722 3.4E3 118.5095 2.3E3 119.1773 2.4E3 121.0678 1.8E4 121.9461 2.4E3 122.4070 2.4E3 123.0473 2.7E3 124.0951 2.5E3 124.4011 2.2E3 124.5177 2.5E3 125.6031 2.3E3 125.7540 2.3E3 127.0753 2.3E3 128.9499 3.2E3 129.8266 2.7E3 129.8891 2.7E3 130.7371 2.4E3 131.0699 2.4E3 133.1039 4.5E5 133.2449 2.2E3 133.6056 2.4E3 135.0832 2.5E5 135.9264 2.5E3 136.2713 2.5E3 136.9323 2.4E3 137.3470 2.9E3 138.3242 2.5E3 142.7601 2.1E3 143.0886 1.1E4 143.3631 2.1E3 144.2471 2.5E3 146.1685 2.7E3 146.3558 2.5E3 147.2009 2.5E3 148.9767 4.1E4 149.2888 2.9E3 149.3839 2.4E3 149.6855 4.3E3 149.8212 2.5E3 151.7059 2.6E3 152.3472 2.3E3 152.9464 2.2E3 157.9789 2.4E3 158.8627 2.3E3 160.2235 2.4E3 166.4773 2.3E3 166.8292 2.6E3 166.9874 1.1E4 167.4987 2.3E3 171.7861 2.6E3 172.5343 2.7E3 173.5259 1.1E5 173.5381 1.9E5 173.6306 2.4E3 174.7390 2.2E3 176.3890 2.6E3 177.1539 2.3E3 180.5618 2.6E3 184.2247 2.9E3 186.0950 2.4E3 187.7124 2.2E3 188.3746 2.3E3 190.0037 2.5E3 190.7835 2.4E3 191.5855 2.9E3 194.9433 2.1E4 201.8977 2.5E3 202.6203 2.3E3 204.0042 2.3E3 208.0158 2.4E3 210.6066 2.4E3 213.4124 2.6E3 214.1142 2.1E3 214.1919 2.5E3 217.9596 1.1E4 224.0444 3.5E3 226.1550 3.0E3 231.9755 2.3E3 233.2214 2.5E3 233.3086 2.4E3 END IONS BEGIN IONS FEATURE_ID=332 PEPMASS=455.2183 SCANS=332 RTINSECONDS=390.637 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 6 (1 removed due to low quality, 0 removed due to low cosine). 56.0494 7.7E4 59.9390 2.3E3 62.6820 2.5E3 63.3425 2.3E3 63.8137 2.6E3 69.5993 2.6E3 73.7249 2.4E3 74.4988 2.2E3 74.9473 2.2E3 75.3149 2.6E3 75.5746 2.3E3 79.0541 3.8E3 81.6740 2.6E3 82.0650 6.7E3 83.2632 2.3E3 91.0542 3.1E4 93.0698 4.4E4 95.0489 1.6E4 98.0601 1.3E4 102.0464 5.0E3 102.6551 2.2E3 103.0542 3.2E4 103.7707 2.5E3 105.0450 4.5E3 107.0492 2.4E4 116.7945 2.3E3 119.0490 1.2E4 121.0647 2.9E6 121.0729 2.0E4 121.0849 8.5E3 121.7253 2.7E3 129.7672 2.6E3 130.0414 1.8E4 131.0489 3.5E3 131.0851 7.0E3 132.0570 5.3E3 133.0649 1.8E4 135.0440 2.6E4 142.2152 2.6E3 143.1023 2.4E3 145.0585 2.4E3 147.0441 6.8E4 147.0801 1.5E4 147.5736 2.5E3 148.0516 2.7E3 149.0594 1.1E4 150.0682 7.1E3 159.0803 2.3E4 160.0523 1.1E4 161.0447 2.3E3 161.0595 3.7E4 162.0676 2.1E5 162.0818 2.3E3 162.6276 2.4E3 163.0390 7.1E4 163.0754 3.5E4 165.0914 5.9E3 165.1663 2.8E3 167.0700 1.0E4 173.5186 4.9E3 173.5360 1.0E5 174.0315 2.0E4 174.0912 1.1E4 175.0391 5.1E4 176.0472 4.3E4 176.0891 1.1E4 176.1071 2.6E6 176.1249 5.4E3 176.1429 7.7E3 177.0549 4.8E4 178.0626 1.8E5 188.0470 9.3E3 189.0547 1.5E5 190.0426 1.0E4 190.0624 1.5E6 191.0139 3.7E3 191.0339 2.7E5 191.0703 1.2E5 192.0415 8.3E3 193.0653 1.2E4 193.0860 1.2E6 193.1064 3.8E3 200.3410 2.2E3 205.0508 6.9E3 206.0348 5.7E3 206.0576 5.7E5 206.0777 4.4E3 221.0304 6.0E4 221.0405 2.2E4 221.0809 1.0E7 221.1204 3.1E4 221.1319 4.2E4 221.1465 1.1E4 235.1451 3.6E3 236.1275 3.0E3 239.6074 2.2E3 248.9868 2.3E3 260.9480 2.7E3 261.1121 2.6E3 262.7369 2.4E3 276.1261 2.6E3 290.9231 2.6E3 353.2533 2.6E3 END IONS BEGIN IONS FEATURE_ID=333 PEPMASS=265.1226 SCANS=333 RTINSECONDS=391.293 CHARGE=1+ MSLEVEL=2 MERGED_STATS=8 / 8 (0 removed due to low quality, 0 removed due to low cosine). 45.9905 2.2E3 48.1054 2.3E3 49.7407 2.1E3 49.7497 2.3E3 50.2539 2.3E3 58.6101 2.6E3 59.6169 2.3E3 62.4212 2.3E3 64.9010 2.7E3 67.3231 2.3E3 68.6055 2.3E3 68.7902 2.7E3 69.2881 2.6E3 69.4766 2.2E3 70.8793 2.2E3 73.4113 2.3E3 77.1229 2.3E3 88.9035 2.2E3 90.8340 2.3E3 93.2585 2.2E3 96.6292 2.2E3 97.2296 2.1E3 99.9703 2.4E3 104.9388 2.2E3 105.2511 2.4E3 108.4139 2.7E3 114.0498 2.1E3 117.8444 2.5E3 121.8812 2.4E3 129.8827 2.2E3 130.9200 2.7E3 138.0014 2.2E3 151.0707 2.7E3 152.8770 2.5E3 164.3467 2.4E3 173.5258 5.0E4 173.5382 5.7E4 178.0774 5.2E3 179.0851 4.3E4 189.0701 4.1E3 190.0777 3.5E4 191.0853 6.4E4 193.0647 2.4E3 194.1098 3.1E3 202.0776 1.3E4 203.0854 7.2E4 204.0934 1.5E4 205.0649 8.6E3 205.1011 5.2E4 206.0726 5.8E3 207.0804 9.1E4 212.9158 2.5E3 215.0858 6.5E3 217.0647 2.7E4 218.0725 1.0E5 219.0804 1.9E5 220.0881 8.6E3 221.0598 6.9E4 221.0962 9.8E4 222.0668 7.4E3 222.1039 3.9E4 226.2679 2.3E3 227.2912 2.5E3 229.4215 2.4E3 232.0889 3.6E3 233.0961 7.0E4 234.1039 4.8E5 234.1290 5.7E3 235.0481 1.0E4 235.0754 6.6E5 235.1025 1.0E4 236.0827 5.8E4 236.1798 2.5E3 237.3697 2.3E3 239.5350 2.3E3 249.0913 5.4E4 250.0988 3.9E5 250.1285 8.4E3 261.3658 2.6E3 265.0146 2.7E3 265.1222 1.4E5 265.2324 2.6E3 END IONS BEGIN IONS FEATURE_ID=334 PEPMASS=282.1494 SCANS=334 RTINSECONDS=391.421 CHARGE=1+ MSLEVEL=2 MERGED_STATS=12 / 12 (0 removed due to low quality, 0 removed due to low cosine). 46.3843 2.3E3 47.6509 2.1E3 48.2831 2.5E3 49.1566 2.6E3 49.2149 2.4E3 49.2525 2.3E3 49.7564 2.6E3 50.4411 2.5E3 51.0905 2.2E3 51.2110 2.5E3 51.3321 2.3E3 51.4877 2.3E3 54.5965 2.4E3 54.9411 2.3E3 55.6961 2.1E3 56.5533 2.4E3 57.0699 6.6E3 57.4012 2.2E3 58.4241 2.3E3 62.5228 3.8E3 62.5260 3.1E3 66.2796 5.3E3 66.8380 2.6E3 68.5619 2.0E3 69.0696 6.3E3 74.4410 2.6E3 75.0440 7.7E3 75.8798 2.5E3 76.4002 2.4E3 76.8567 2.5E3 80.8667 2.4E3 81.3843 2.6E3 83.0854 6.1E3 83.2365 2.0E3 86.4726 2.3E3 86.5046 2.3E3 89.4716 2.6E3 91.8584 2.3E3 92.3032 2.3E3 96.8017 2.4E3 97.1009 3.0E3 97.3805 2.7E3 103.7520 2.4E3 106.8051 2.3E3 107.1266 2.4E3 107.9347 2.2E3 118.4563 2.8E3 118.5407 3.0E3 123.0097 2.2E3 123.6411 2.5E3 124.4149 2.4E3 128.0619 3.1E3 128.4394 2.5E3 130.7869 2.7E3 133.0967 2.5E3 134.0962 1.3E5 136.0322 2.2E3 137.2152 2.5E3 146.3390 2.6E3 148.8792 3.1E3 165.0705 5.9E3 171.2160 2.6E3 173.5226 3.5E4 173.5371 1.3E5 173.5448 4.8E3 178.0788 3.9E4 179.0854 8.9E4 179.3588 2.4E3 184.0918 2.4E3 187.1943 2.4E3 188.2539 2.5E3 189.0707 4.5E4 190.0776 1.4E5 191.0855 1.6E5 191.1040 2.3E3 192.0934 1.3E4 192.3711 2.7E3 193.0648 1.2E4 193.1014 8.8E3 194.0720 2.5E3 194.1088 3.9E3 197.0141 2.7E3 202.0779 7.9E4 203.0855 2.5E5 204.0932 6.8E4 204.4242 2.5E3 205.0651 5.1E4 205.1012 3.6E5 206.0727 1.4E5 206.1090 7.6E3 207.0600 4.3E3 207.0805 2.5E5 208.0880 2.2E4 210.1276 6.1E3 211.1350 3.8E4 213.2336 2.7E3 215.0858 2.7E4 217.0650 7.0E4 218.0727 5.3E5 219.0805 5.5E5 220.0884 8.3E4 221.0598 2.8E5 221.0962 4.5E5 222.0674 9.3E4 222.1040 2.0E5 231.0806 1.4E4 231.3803 2.5E3 232.0884 6.9E4 233.0686 6.3E3 233.0962 6.7E5 233.1233 7.4E3 234.0487 5.5E3 234.1038 4.9E6 234.1316 3.5E3 234.1590 7.2E3 235.0353 2.8E3 235.0479 1.6E4 235.0752 3.3E6 235.1100 1.3E5 235.1328 3.0E3 236.0831 9.5E5 237.0908 1.4E5 237.4168 2.5E3 238.8124 2.6E3 243.0908 3.6E3 245.1411 2.9E3 247.9914 2.5E3 249.0909 2.2E5 250.0369 6.2E3 250.0680 1.7E4 250.0988 6.8E6 250.1591 2.2E4 254.7762 2.4E3 260.0371 2.4E3 263.9795 2.5E3 265.0559 1.8E4 265.1221 6.0E6 265.1902 2.9E3 268.3228 2.5E3 268.8039 2.5E3 272.5194 2.4E3 279.1075 2.5E3 281.8549 2.4E3 282.2218 3.3E5 292.3907 2.6E3 END IONS BEGIN IONS FEATURE_ID=335 PEPMASS=532.2033 SCANS=335 RTINSECONDS=394.633 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 61.0281 2.6E3 62.7556 2.2E3 69.0332 8.8E4 71.0489 1.4E4 73.0281 3.5E4 76.9292 2.3E3 80.4632 2.8E3 81.0331 1.8E5 83.0490 1.1E4 85.0281 4.5E5 87.0022 2.8E3 87.0073 1.2E5 91.5745 2.2E3 93.8297 2.6E3 97.0279 3.1E5 99.0437 1.5E5 103.0386 8.9E4 104.2056 2.3E3 105.0098 3.2E3 105.0179 2.5E5 105.0696 4.6E4 109.0281 8.0E5 109.0354 5.6E3 121.8897 2.3E3 122.9816 2.5E3 125.1565 2.4E3 127.0386 1.0E6 127.0475 1.7E4 127.3729 2.5E3 128.8108 2.7E3 129.0180 5.1E4 145.0492 1.7E5 147.0286 6.1E4 159.0286 1.9E5 163.0602 1.2E4 168.0531 2.5E3 169.0493 2.6E4 173.5216 8.4E3 173.5357 1.8E4 173.5425 8.2E3 176.3115 2.2E3 177.0392 4.3E3 180.1788 2.2E3 183.0290 2.3E3 183.7771 2.6E3 187.0603 3.4E4 195.2111 2.4E3 213.0396 7.4E4 227.1435 2.5E3 231.0502 1.6E5 231.1005 2.6E3 233.4278 2.6E3 248.8988 2.4E3 249.0611 3.2E3 255.0506 4.2E3 271.0822 3.0E3 273.0602 2.6E4 288.3718 2.6E3 291.0713 2.3E4 305.0522 2.2E3 339.0730 5.6E3 351.6642 2.3E3 357.0824 2.2E4 375.0911 6.9E3 508.2067 2.4E3 530.8592 2.8E3 END IONS BEGIN IONS FEATURE_ID=336 PEPMASS=344.1497 SCANS=336 RTINSECONDS=394.85 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 51.7647 6.6E3 52.4071 2.2E3 54.9874 2.3E3 55.6592 2.2E3 57.0890 2.6E3 70.2925 2.9E3 72.5560 2.3E3 77.0386 5.2E3 82.1906 2.2E3 83.9707 2.4E3 91.0541 2.1E5 93.0165 2.3E3 93.0698 1.5E5 95.0491 3.0E4 100.7096 2.6E3 101.9001 2.3E3 103.0541 7.5E4 103.4007 2.3E3 105.0447 5.9E3 109.9799 2.2E3 119.0492 7.2E5 119.0591 4.5E3 120.0568 5.0E3 121.0647 1.7E6 121.0728 8.1E3 125.2814 2.2E3 131.0491 9.0E3 132.8004 2.3E3 135.0449 3.3E3 145.0285 6.1E3 146.9754 2.6E3 147.0333 7.1E3 147.0440 1.1E6 157.0397 7.9E4 160.2927 2.7E3 164.0471 9.5E3 166.0627 1.9E4 173.5341 4.4E4 175.0042 5.6E3 175.0252 1.6E4 175.0391 3.4E6 175.0739 8.7E3 176.0461 3.1E3 177.0549 7.9E3 179.0704 4.1E4 179.0865 3.3E3 181.0858 9.6E3 192.0418 6.7E4 197.0047 2.2E3 202.9630 2.4E3 205.5237 2.4E3 207.0478 9.7E3 207.0653 2.3E6 207.1089 3.8E3 226.5950 3.1E3 250.1066 4.0E3 END IONS BEGIN IONS FEATURE_ID=337 PEPMASS=314.1392 SCANS=337 RTINSECONDS=396.421 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 12 (6 removed due to low quality, 0 removed due to low cosine). 49.4027 2.2E3 49.9349 2.3E3 51.0230 2.6E3 51.4363 2.5E3 53.0385 1.5E4 53.1692 2.3E3 53.5433 2.4E3 53.7884 2.4E3 54.4140 2.2E3 55.0177 1.2E4 56.0715 2.3E3 58.0648 3.7E4 58.8106 2.5E3 59.2250 2.3E3 60.2706 2.1E3 61.8502 2.9E3 62.1213 2.5E3 62.6362 2.5E3 63.0234 1.9E4 65.7431 2.4E3 66.2989 2.4E3 69.3803 2.3E3 77.0385 5.2E4 79.0536 4.3E3 82.2300 2.2E3 84.0495 2.4E3 89.0384 1.5E5 91.0539 4.0E5 93.0696 9.5E5 93.0763 3.5E3 95.0488 1.8E5 95.6511 2.4E3 103.0539 4.3E5 105.0444 5.7E4 106.0413 3.2E3 107.0489 2.1E4 117.0332 9.0E5 117.0418 2.2E3 117.0430 8.5E3 119.0489 5.9E4 121.0645 9.8E6 121.0739 2.2E5 121.0850 9.9E4 121.0863 3.2E4 121.0907 4.4E3 123.4548 2.5E3 125.3912 2.4E3 131.0477 2.6E3 133.9725 2.8E3 134.0359 2.8E4 135.0439 7.3E4 136.0518 4.9E4 137.0599 5.4E3 140.6590 3.1E3 144.0442 7.1E3 144.9088 2.8E3 145.0282 9.3E6 145.0389 1.4E5 145.0560 7.5E4 147.0440 1.1E5 149.0460 3.4E3 149.0595 4.0E5 149.0703 5.1E3 151.0754 6.5E4 153.7067 2.2E3 162.0308 3.2E4 163.0390 1.2E5 163.1255 2.4E3 164.0708 9.8E3 173.5252 2.7E4 173.5371 5.6E4 173.5471 2.4E3 176.0705 1.7E4 177.0180 3.7E4 177.0264 2.8E4 177.0547 1.2E7 177.0836 1.8E4 177.0911 8.4E4 177.1009 5.9E3 177.1110 4.3E3 183.0815 3.0E3 186.0552 1.0E5 191.6388 2.9E3 194.0814 1.7E5 203.7983 2.5E3 204.0657 3.0E3 220.0972 5.7E4 238.5526 2.5E3 258.2895 2.9E3 314.1394 3.7E4 314.1756 6.3E3 END IONS BEGIN IONS FEATURE_ID=338 PEPMASS=801.3460 SCANS=338 RTINSECONDS=401.637 CHARGE=1+ MSLEVEL=2 MERGED_STATS=12 / 18 (6 removed due to low quality, 0 removed due to low cosine). 74.0599 2.2E5 74.3103 2.5E3 74.5976 2.4E3 74.7771 2.2E3 75.7207 2.5E3 76.3874 2.3E3 76.7317 2.4E3 78.4610 2.2E3 79.3411 2.6E3 79.4907 2.7E3 82.5970 2.3E3 84.0443 2.5E5 85.1183 2.2E3 89.4489 2.5E3 89.8022 2.4E3 91.0542 2.2E5 93.2690 2.5E3 95.0165 2.3E3 95.0490 5.9E3 97.0758 1.1E5 98.0599 2.7E5 98.4421 2.4E3 100.9202 2.4E3 101.3614 2.4E3 102.0548 1.7E5 102.3379 2.2E3 103.0541 6.1E4 107.6725 2.8E3 108.6544 2.4E3 109.0758 1.3E4 112.3003 2.5E3 114.6352 2.2E3 115.0864 1.2E5 117.0574 8.9E3 118.0554 7.1E3 118.0650 6.9E5 118.5594 2.4E3 119.0493 2.2E4 119.0729 4.8E3 120.0708 4.2E3 120.0806 3.3E6 120.0896 2.8E4 120.7834 2.4E3 120.9261 2.4E3 122.6108 2.5E3 123.0438 2.4E4 124.0870 9.8E3 125.0708 4.9E5 126.0547 1.3E5 130.0498 4.0E4 130.0651 2.8E3 131.0491 2.2E4 132.0808 3.1E3 136.0642 1.4E4 136.0755 9.8E5 136.0876 5.6E3 137.0708 1.9E5 137.7579 2.5E3 137.7706 2.4E3 138.0499 2.5E3 139.0864 2.4E4 140.0704 1.5E5 146.0329 3.5E3 146.0598 6.4E6 146.0709 5.2E4 146.0869 3.1E3 146.9659 2.7E3 147.0437 1.3E4 148.0755 2.3E4 150.9807 2.5E3 152.0816 1.6E5 155.0814 3.1E3 158.0810 5.7E4 158.6437 2.6E3 162.0911 6.3E3 163.0867 3.3E3 163.5177 2.6E3 164.0705 1.5E5 165.0546 5.3E5 165.0699 3.4E3 167.0815 4.2E4 168.0652 2.8E3 168.7979 2.5E3 169.0974 2.4E3 172.1122 1.2E5 173.5215 6.0E3 173.5256 1.1E5 173.5389 1.4E5 174.0551 1.2E5 175.1891 2.4E3 176.1070 3.2E4 176.6319 2.7E3 182.0812 2.1E6 182.5566 2.2E3 182.9357 2.2E3 184.0749 1.8E4 185.0921 2.4E5 185.9821 2.9E3 186.0729 2.7E3 186.0916 4.6E4 187.1231 4.9E4 189.1395 2.7E3 190.0859 3.4E3 192.0656 2.4E3 193.0615 1.5E4 195.0763 1.2E5 197.0122 2.7E3 197.0561 3.6E3 197.1056 3.2E3 198.0910 6.9E3 199.1230 9.7E4 200.1061 3.3E3 201.1385 3.5E4 202.0868 1.4E4 202.1247 2.4E3 203.1028 1.6E5 204.1020 1.0E5 208.1129 2.3E4 211.0508 4.2E3 211.0714 3.8E5 212.0705 1.2E4 213.0871 2.7E5 214.1340 2.8E3 215.0817 4.3E4 215.1180 2.0E5 216.1259 1.1E5 217.1094 8.9E3 217.1336 3.2E6 217.1585 2.7E4 217.3048 2.4E3 217.9077 2.3E3 219.1129 2.3E4 220.0960 3.3E3 220.1146 3.4E3 221.0553 2.3E3 222.1283 2.4E3 223.0762 6.5E3 223.6275 2.7E3 225.1025 7.7E4 227.1181 1.3E5 228.1010 3.9E3 228.1259 2.3E4 229.0979 5.5E4 230.0812 5.0E4 231.0977 2.0E5 236.1070 1.5E5 236.1311 5.0E3 236.4693 2.5E3 237.1236 7.9E4 238.0820 3.1E4 239.0663 9.6E4 242.1282 1.3E4 243.1127 1.1E6 243.1381 4.4E4 244.1436 8.9E3 245.1283 4.7E5 247.1076 4.2E5 248.0904 3.8E4 248.5899 2.5E3 249.0859 1.3E4 249.1186 2.5E3 253.0972 6.2E3 254.1285 1.0E4 256.0932 4.5E3 257.0763 8.4E4 257.0951 2.5E4 257.6672 2.5E3 259.1093 3.0E3 265.0855 1.1E5 265.1184 1.6E5 267.1123 9.8E3 270.1121 1.0E5 272.0811 2.8E3 273.1235 3.3E4 275.0527 3.7E3 275.0685 4.7E3 275.1027 1.8E6 275.1382 6.3E3 275.7393 2.5E3 277.1215 2.6E3 282.1128 3.2E5 283.1291 7.3E5 284.1395 3.6E4 285.0883 3.2E4 285.1231 3.2E3 291.1345 8.0E4 293.1140 4.8E4 297.7827 2.4E3 299.1402 1.3E4 300.1346 5.3E4 301.1558 3.1E4 302.1502 3.8E3 303.0980 2.8E5 303.1302 3.6E3 305.1651 1.8E4 313.1200 4.4E3 319.1297 4.8E4 321.1232 4.1E4 330.1453 1.0E5 331.1282 1.3E4 332.1207 3.1E3 332.1637 2.5E3 333.1089 1.7E4 337.1502 2.9E3 339.9026 2.9E3 340.1287 1.6E4 341.9665 2.6E3 344.1182 3.8E3 344.1728 1.2E5 345.1570 2.8E3 345.5655 2.7E3 346.1914 5.1E5 346.2391 4.4E3 348.1554 6.5E4 349.1421 5.2E3 351.7133 2.7E3 352.5437 2.6E3 355.1271 2.9E3 358.0956 2.8E3 358.1394 1.3E5 364.2015 4.6E4 365.1507 1.1E4 371.1603 1.4E5 371.2063 3.2E3 372.1663 5.0E5 373.1564 2.7E3 374.1339 3.5E4 375.8340 2.6E3 376.1503 3.5E5 377.9148 2.6E3 383.1608 7.9E4 386.1351 6.9E4 390.1230 3.2E3 390.1814 1.0E6 392.1472 8.2E3 393.7055 2.9E3 394.1617 1.1E5 396.1945 1.0E4 402.1297 1.2E4 402.1387 2.8E3 404.1461 1.0E5 412.1711 1.8E4 420.1420 1.8E4 422.1621 1.6E4 424.1882 3.0E3 438.1482 6.6E3 438.1598 5.0E3 455.1943 3.7E3 456.1772 9.8E3 473.2080 4.5E4 490.9210 2.8E3 491.2288 9.9E3 500.2017 2.9E4 502.5123 2.6E3 519.2228 7.4E4 521.2020 2.1E4 524.2579 2.7E3 525.2387 6.1E3 539.2133 5.6E4 541.4777 2.7E3 549.2004 1.3E4 557.2270 3.8E4 559.3414 2.7E3 564.6324 2.4E3 567.2077 5.8E4 568.3361 2.3E3 571.2538 3.6E4 572.8826 2.7E3 585.2181 5.4E4 585.2338 3.3E3 586.0209 2.7E3 586.2251 2.6E3 587.9152 2.8E3 592.8614 3.2E3 608.2719 6.0E3 626.2758 2.6E3 636.2652 3.5E4 647.2521 3.1E3 647.8156 2.9E3 654.2756 8.0E4 672.2886 2.6E3 700.7612 3.0E3 783.3318 4.5E4 END IONS BEGIN IONS FEATURE_ID=339 PEPMASS=344.1497 SCANS=339 RTINSECONDS=406.449 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 51.8632 2.0E3 56.2421 2.4E3 56.7859 2.5E3 59.7495 2.5E3 60.2508 2.2E3 63.0235 8.0E3 66.2427 2.2E3 66.6907 2.1E3 73.1231 2.2E3 75.3669 2.2E3 89.0386 8.5E4 91.0484 4.6E3 91.0540 1.8E5 93.1358 2.2E3 94.0917 2.4E3 95.0490 5.5E4 96.4517 2.7E3 117.0240 1.5E4 117.0334 4.2E5 117.0418 2.1E3 117.0436 3.1E3 119.0490 2.1E5 121.0646 6.4E3 123.0795 2.7E3 132.7500 2.6E3 134.0363 2.0E4 135.0440 3.2E4 136.0518 2.3E4 137.0597 2.0E4 145.0009 8.1E3 145.0074 8.8E3 145.0142 6.4E3 145.0283 5.0E6 145.0395 2.4E4 145.0552 2.7E4 145.0634 7.4E3 147.0439 4.8E3 149.0462 2.5E3 149.0596 2.0E5 151.0602 2.7E3 151.0645 2.8E3 151.0752 8.7E5 151.0870 4.7E3 151.3109 2.6E3 154.9770 2.4E3 162.0307 3.8E3 163.0389 3.6E4 173.5286 5.2E4 173.5450 1.4E4 177.0072 5.5E3 177.0182 1.4E4 177.0267 1.2E4 177.0412 3.1E4 177.0546 7.4E6 177.0690 4.7E4 177.0911 5.2E4 177.1014 1.4E4 186.0550 6.1E4 188.5959 2.6E3 194.0822 5.3E3 195.0635 2.3E3 213.7522 3.0E3 220.0977 3.0E3 END IONS BEGIN IONS FEATURE_ID=340 PEPMASS=362.1790 SCANS=340 RTINSECONDS=407.643 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 70.0650 1.2E6 70.0693 9.3E3 70.0715 6.0E3 70.6026 2.5E3 71.0683 1.9E4 74.6259 2.4E3 75.7002 2.3E3 76.2106 2.1E3 81.3489 2.7E3 82.7349 2.6E3 86.0904 3.1E3 86.0961 1.8E5 91.0542 1.2E4 93.0842 2.6E3 95.0493 2.8E3 95.9034 2.9E3 97.0757 1.8E4 115.0537 2.6E3 115.0863 3.0E4 118.0649 3.5E4 119.0491 1.2E4 119.0728 7.3E3 120.0804 5.8E4 123.0439 1.7E4 125.0707 4.3E4 129.1025 6.7E3 130.0650 6.5E5 131.0490 1.5E4 131.0687 2.0E4 131.1172 6.8E3 132.0806 8.1E4 133.7570 2.4E3 135.0566 4.2E3 135.0677 1.4E5 136.0754 9.4E4 137.3301 2.5E3 138.8796 2.3E3 141.1015 2.2E3 142.0650 1.9E4 144.0805 3.9E4 145.8874 2.1E3 146.0599 2.2E5 146.0703 2.2E3 146.1504 2.2E3 147.0437 1.2E4 148.0754 2.6E4 157.0975 3.6E3 158.0610 2.9E3 158.0838 5.3E4 159.0916 5.1E5 160.0760 1.4E4 160.0949 1.7E4 162.9259 2.6E3 165.0547 5.1E4 167.3476 2.4E3 169.0761 5.3E4 170.0600 1.8E5 171.0638 6.7E3 172.1122 4.0E4 172.3485 3.1E3 173.5220 4.5E3 173.5369 4.1E4 174.0553 2.8E4 174.1288 6.7E3 182.0814 3.0E4 185.0713 2.5E4 187.0868 5.4E4 187.1237 1.2E4 188.0705 6.7E3 188.1428 3.4E3 198.0902 2.7E3 203.1544 4.6E3 213.1014 7.9E3 215.1183 2.0E4 216.1263 3.2E4 217.1339 8.6E4 224.1075 6.1E3 231.1498 4.9E4 231.1693 2.2E3 236.1076 2.0E4 236.6210 2.8E3 237.1394 2.1E4 241.0971 3.6E3 243.1132 1.7E5 244.1157 3.9E3 247.1241 3.5E3 253.1360 3.1E3 254.1651 5.1E3 259.1447 5.3E4 265.0861 3.6E3 270.0016 2.5E3 270.1130 3.0E4 272.1768 8.2E3 277.1328 3.2E3 281.1310 2.9E3 282.1135 2.7E4 292.2198 2.6E3 298.1561 1.3E5 298.1908 3.0E3 299.1623 2.8E3 323.1402 5.1E4 359.8248 2.3E3 396.1953 7.1E3 425.2836 2.7E3 445.2284 3.5E3 572.1758 2.8E3 679.8937 2.5E3 705.3685 3.2E3 END IONS BEGIN IONS FEATURE_ID=341 PEPMASS=723.3506 SCANS=341 RTINSECONDS=407.643 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 70.0651 1.6E6 70.0687 1.0E4 70.0741 4.0E3 82.0653 3.0E3 83.5653 2.6E3 85.0395 2.9E3 86.0904 5.5E3 86.0963 4.2E5 86.1011 2.0E3 86.1037 7.3E3 87.3997 2.2E3 88.4491 2.7E3 90.5328 2.4E3 91.0542 2.0E4 97.0759 1.0E5 106.0650 2.8E3 109.0758 2.4E4 113.1069 1.5E4 115.0865 7.8E4 117.0575 2.8E3 118.0650 4.1E4 119.0488 8.9E3 120.0807 7.9E4 123.0440 4.8E3 125.0608 5.1E3 125.0708 2.9E5 130.0483 3.1E3 130.0651 3.1E5 130.0763 1.3E4 131.0489 1.6E4 132.0807 1.2E5 136.0647 5.3E3 136.0756 2.1E5 137.0705 9.5E3 141.0869 7.8E3 141.1021 3.3E5 144.0806 1.3E5 146.0599 5.5E5 146.0742 6.5E3 147.0440 3.8E3 148.0755 4.8E4 155.0811 5.4E3 158.0603 6.4E3 158.0837 1.6E4 159.0916 1.5E6 159.1031 7.2E3 160.0760 3.7E3 161.6826 2.8E3 162.0548 9.2E3 163.0867 7.1E3 164.0703 7.2E3 165.0546 1.3E5 169.0761 3.1E4 170.0601 8.2E4 170.0964 6.1E3 171.0909 3.3E3 172.1121 1.7E5 173.5230 5.8E3 173.5378 3.2E4 174.0550 6.5E4 174.1278 7.6E4 181.0972 1.2E4 182.0812 2.4E5 185.0710 3.7E4 186.1283 3.9E3 187.0866 1.2E5 187.1226 1.9E4 188.0712 1.1E4 188.1432 2.1E4 188.5212 2.8E3 191.0808 7.5E3 197.0711 1.6E4 197.1077 4.4E3 198.0914 3.3E4 199.1227 1.6E4 200.1433 1.8E4 203.1540 2.0E4 204.1381 2.5E4 208.0604 1.4E4 211.1213 3.4E3 214.1223 4.2E3 215.1178 7.7E4 216.1258 1.2E5 216.1463 4.5E3 217.1335 2.9E5 220.1123 5.0E4 227.1543 4.2E4 231.1493 1.7E5 232.1117 1.3E4 232.1338 3.4E3 236.1072 2.0E4 237.0876 4.3E3 237.1388 2.6E4 238.1213 3.2E3 239.1543 1.2E4 241.1330 1.9E4 243.1126 1.0E6 243.1530 1.7E4 247.1227 1.3E5 250.1518 2.8E3 253.1344 3.2E3 254.1655 1.9E4 255.1489 1.8E4 259.1132 6.1E3 259.1438 3.7E5 260.1401 4.4E3 265.0865 4.3E3 269.1283 1.7E4 270.1123 6.5E4 272.1756 1.8E5 280.1443 1.3E4 281.1287 2.1E4 282.1128 5.0E4 282.1599 4.0E4 287.1389 5.7E4 298.0988 3.3E3 298.1550 6.2E5 299.1397 2.0E4 300.1708 8.9E4 300.2063 1.1E4 305.1298 3.3E3 308.1381 2.7E3 309.1222 8.9E3 310.1549 2.0E4 310.1906 3.1E3 322.1531 3.3E3 323.1398 3.7E4 326.1496 1.1E5 327.1363 3.4E3 328.2015 4.0E4 332.1403 5.9E3 337.1148 3.0E3 339.4539 2.5E3 351.1334 5.5E5 356.1965 1.0E5 360.2064 7.1E4 368.1598 6.1E4 378.1452 1.6E4 378.5025 2.6E3 388.2010 1.4E4 396.1916 4.4E4 400.2017 1.7E4 401.2372 3.3E3 408.3700 2.7E3 417.2244 4.2E3 419.1946 8.0E3 424.1860 2.4E4 428.1955 1.2E4 429.5744 2.7E3 439.1660 1.1E4 445.2219 1.6E4 451.1667 1.2E4 463.2322 2.1E4 468.1955 3.1E4 473.2195 1.4E4 480.1894 2.6E3 491.2267 1.1E4 507.2244 2.9E3 541.2057 3.4E4 582.2696 1.6E4 654.2899 1.0E4 END IONS BEGIN IONS FEATURE_ID=342 PEPMASS=419.2010 SCANS=342 RTINSECONDS=411.077 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 81.0700 2.7E3 85.1008 1.0E4 85.7487 2.8E3 86.0911 3.9E3 86.0961 1.4E5 87.0550 1.3E5 91.0540 7.9E3 99.0074 1.2E4 103.0537 3.1E3 107.0490 5.4E3 107.3786 2.6E3 108.8945 2.4E3 115.0540 2.2E3 115.0862 1.1E4 118.0647 3.8E4 118.9132 2.6E3 119.0490 1.3E4 119.0728 6.5E3 120.0805 4.2E4 123.0437 1.7E4 123.7689 2.5E3 125.0707 5.9E4 125.5091 2.3E3 128.6120 2.7E3 130.0649 5.3E5 130.0758 1.3E4 131.0685 2.0E4 131.1177 3.1E3 132.0805 7.8E4 135.0677 1.2E5 135.1164 1.1E4 136.0755 1.2E5 136.6065 2.9E3 138.9358 2.9E3 141.1018 3.0E4 142.0648 8.0E3 143.0727 3.2E3 144.0807 3.9E4 146.0598 2.3E5 147.0443 1.1E4 147.0631 8.7E3 148.0759 9.3E3 149.0232 5.1E4 152.5501 2.6E3 156.0447 7.1E3 157.0971 1.1E4 158.0837 6.2E4 159.0916 5.8E5 160.0762 7.0E3 160.0947 2.0E4 162.0554 2.7E3 165.0546 8.4E4 167.0812 5.6E3 169.0759 4.3E4 170.0600 1.7E5 171.0648 5.0E3 172.1117 3.0E3 173.5225 1.0E4 173.5333 3.9E4 173.5414 2.0E4 174.0550 1.5E4 174.2761 2.3E3 181.0994 2.6E3 182.0813 6.8E4 184.1083 2.4E4 185.0713 2.2E4 187.0867 8.4E4 188.0699 5.9E3 188.1440 6.0E3 195.0765 1.4E5 195.7641 2.4E3 196.0789 2.7E3 200.0703 4.1E3 210.1129 3.1E3 212.1028 1.7E4 216.1251 3.5E3 217.1339 5.9E4 225.1017 3.4E3 227.1183 3.8E4 231.1499 5.4E4 234.0875 2.7E4 236.1082 1.2E4 241.0988 3.3E3 243.1131 9.5E4 244.1165 4.3E3 248.1067 1.6E4 251.1142 2.3E4 252.1136 9.3E3 253.0976 2.4E4 253.1330 6.3E3 254.1296 6.5E3 255.1128 3.2E4 259.1445 6.3E4 260.1063 4.5E3 260.1488 2.4E3 262.6360 1.0E4 270.1120 1.9E4 272.1392 8.4E3 272.1766 2.1E4 272.6350 3.0E3 276.1426 5.3E3 277.1319 3.0E3 277.4025 2.7E3 279.1125 2.7E3 280.1089 2.3E4 280.1421 3.1E3 281.0931 1.3E5 282.1138 1.7E4 287.1389 2.5E3 292.0983 1.3E4 296.1402 8.7E3 297.1242 3.4E4 297.6402 4.7E3 298.1196 3.2E4 298.1560 9.1E4 299.1386 7.8E3 300.1717 1.5E4 309.1219 3.3E3 311.4349 2.8E3 313.1669 2.8E3 322.1200 3.5E4 323.1030 3.3E4 323.1400 1.1E5 324.1419 5.9E3 326.1500 1.0E4 339.1462 7.5E4 340.1301 7.7E4 348.1839 3.7E3 351.1352 3.2E4 356.1985 7.3E3 357.1567 7.6E4 366.1833 3.2E3 388.1671 2.5E3 396.1937 3.0E3 405.9441 2.6E3 408.1949 3.0E3 424.9548 2.6E3 440.2258 3.5E3 514.3420 2.6E3 521.1957 2.3E3 524.2685 3.2E3 593.9263 2.7E3 701.7225 2.8E3 750.0775 2.6E3 789.0916 2.6E3 END IONS BEGIN IONS FEATURE_ID=343 PEPMASS=837.3937 SCANS=343 RTINSECONDS=411.172 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 8 (4 removed due to low quality, 0 removed due to low cosine). 81.7676 2.5E3 85.4557 2.4E3 86.0963 2.5E5 87.0553 2.0E4 88.0033 2.5E3 91.0543 4.1E4 97.0763 5.8E3 98.5048 2.4E3 107.2653 2.3E3 113.1072 8.0E3 115.0864 1.6E4 116.9983 2.4E3 118.0650 1.9E5 120.0806 1.2E5 123.0439 5.7E3 123.4197 2.3E3 125.0708 9.5E4 126.9326 2.3E3 127.2324 2.5E3 130.0650 2.2E5 130.0762 3.5E3 131.0495 4.1E3 131.7617 2.3E3 132.0807 7.7E4 136.0755 1.8E5 137.0708 2.9E4 141.0896 6.6E3 141.1021 2.8E5 141.8680 2.6E3 142.9967 2.5E3 144.0806 6.4E4 146.0329 3.1E3 146.0598 2.0E6 146.0705 2.3E3 146.3199 2.4E3 147.0442 2.3E3 148.1894 2.3E3 149.0713 2.9E3 152.0831 2.6E3 153.0656 1.0E4 154.0969 6.6E3 158.0603 3.1E3 158.0843 7.1E3 159.0915 5.2E5 159.1033 3.2E3 160.0756 2.2E3 163.0868 9.6E3 165.0546 1.1E5 165.0906 6.8E3 167.0671 2.4E3 167.0814 3.3E4 169.0762 2.5E4 170.0600 4.8E4 173.5115 2.5E3 173.5171 3.2E3 173.5258 2.5E4 173.5394 3.9E4 174.1277 1.9E4 177.0658 1.5E4 182.0812 2.1E5 184.1080 2.0E5 185.0713 2.8E4 186.1281 3.5E3 187.0866 9.8E4 188.1433 4.2E4 192.0769 1.6E4 193.0840 1.3E4 194.0921 1.6E4 195.0763 2.9E5 197.0703 4.0E3 200.0707 2.6E3 200.1443 3.8E3 203.1538 4.7E3 206.0927 1.3E4 212.1030 8.7E4 214.1235 3.5E3 215.0767 2.3E3 215.1186 2.7E3 216.0752 2.3E3 216.1247 3.3E3 217.1335 1.1E5 220.1122 1.8E4 225.1028 1.3E4 227.1179 2.8E4 227.1545 2.3E4 231.1492 3.5E5 231.1759 3.3E3 232.1125 6.4E3 234.0873 4.4E5 234.1085 2.6E3 236.1077 8.8E3 237.1384 2.4E4 238.1486 2.4E3 239.0839 2.5E3 239.1536 7.3E3 243.1127 1.7E5 247.1226 5.2E4 251.1136 4.2E5 252.1126 7.0E4 253.0970 2.7E3 254.1284 1.2E5 254.1615 1.1E4 255.1124 1.1E4 255.1475 7.1E3 259.1437 4.7E5 269.1288 1.4E4 270.1143 3.1E4 272.1393 4.6E4 272.1757 1.8E5 276.1145 2.7E3 278.1281 1.1E4 280.1080 1.6E5 280.1431 1.3E4 281.0922 2.6E4 281.1270 1.3E4 282.1132 2.7E4 282.1599 1.5E4 282.6591 2.3E3 284.1013 3.1E3 287.1410 1.1E4 294.1236 4.3E4 296.1397 1.1E5 297.1236 1.1E5 298.1183 2.0E5 298.1552 4.9E5 299.1393 2.8E4 300.1708 1.3E5 308.1386 6.4E3 312.1339 2.5E4 313.1661 8.1E4 314.1496 2.4E4 316.1664 3.0E3 319.1786 7.4E3 322.1183 3.3E5 322.1505 2.4E3 323.1022 9.5E4 323.1404 1.7E4 326.1495 8.6E4 339.1449 4.7E5 339.1831 4.3E3 339.1920 5.5E3 340.1287 4.8E5 340.1641 3.5E3 347.1702 1.8E4 351.0855 5.6E3 351.1334 3.2E5 356.1966 4.2E4 357.1552 4.7E5 358.1427 4.1E3 360.2055 2.4E4 364.1982 1.8E4 365.1937 4.4E3 366.1799 1.2E4 368.1601 7.8E4 372.2078 3.3E3 378.1519 5.3E3 381.1605 2.8E3 383.2075 1.0E4 388.1994 2.8E3 393.1919 2.8E3 396.1901 8.7E3 400.2007 1.1E4 407.2071 1.5E4 408.1925 2.3E4 411.2001 4.1E3 411.2063 8.8E3 419.1978 3.7E3 424.2342 4.2E4 425.2180 3.1E4 428.1941 3.6E3 435.2023 1.5E4 445.2212 4.2E3 451.1662 1.2E4 452.2276 4.2E4 453.2129 3.3E4 463.2346 1.7E4 468.1923 1.6E4 470.2392 8.0E3 475.2009 2.7E3 477.2123 3.6E3 503.1898 9.7E3 521.2031 4.7E4 538.2284 1.7E4 617.1343 3.0E3 636.2852 4.1E3 639.2844 2.9E3 639.2972 4.4E3 654.2805 2.9E3 695.3405 2.7E3 707.2795 1.9E4 802.3569 3.3E3 803.3373 2.7E3 END IONS BEGIN IONS FEATURE_ID=344 PEPMASS=501.2600 SCANS=344 RTINSECONDS=412.47 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 5 (2 removed due to low quality, 0 removed due to low cosine). 64.0834 2.1E3 69.9028 2.3E3 75.8037 2.2E3 91.0544 5.9E3 92.3771 2.8E3 93.0701 4.8E3 93.1228 2.4E3 93.6564 2.6E3 98.0602 2.4E3 99.0441 5.8E3 107.0986 2.5E3 117.0545 1.4E4 121.0647 4.6E5 123.5608 2.3E3 126.0911 4.7E3 144.1025 4.5E3 145.0860 4.3E4 147.0446 7.0E3 150.0689 2.8E3 150.0918 1.1E4 160.0526 2.8E3 162.0676 3.3E4 163.0396 7.6E3 163.0757 5.6E3 164.1072 9.7E3 173.5345 5.2E4 175.0393 6.2E3 176.0934 7.5E3 176.1072 1.1E6 176.1430 6.3E3 177.0558 2.7E3 178.0628 3.0E4 178.0927 2.9E3 187.1077 1.5E4 189.0549 2.0E4 190.0625 2.5E5 190.0811 4.2E3 191.0340 3.5E4 191.0705 2.3E4 193.0651 3.9E3 193.0862 2.2E5 206.0576 9.7E4 217.1329 4.5E3 219.1132 2.0E4 221.0307 3.7E4 221.0810 5.7E6 221.1206 1.4E4 221.1322 2.7E4 236.1284 1.1E4 238.1076 2.2E4 263.1753 4.0E4 264.1595 3.8E4 266.3561 3.0E3 281.1867 3.9E4 290.1401 3.7E3 290.3269 2.3E3 305.4653 2.5E3 307.1654 2.5E4 329.6103 2.5E3 336.1449 1.4E4 350.9579 2.3E3 364.1216 4.3E3 364.1374 1.3E4 364.1757 9.2E5 381.2024 2.1E4 386.4982 2.6E3 444.0071 2.7E3 484.2335 3.0E4 501.2597 1.1E5 END IONS BEGIN IONS FEATURE_ID=345 PEPMASS=287.1259 SCANS=345 RTINSECONDS=414.061 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 48.2464 2.3E3 49.1959 2.2E3 49.9667 2.4E3 52.0937 2.1E3 52.6920 2.6E3 55.0539 2.6E3 62.2561 2.2E3 62.5577 2.3E3 64.5791 2.1E3 68.2457 2.3E3 69.0697 6.5E3 70.3609 2.7E3 79.7791 2.1E3 81.0696 1.4E4 85.1547 2.3E3 86.5262 2.7E3 86.9564 2.3E3 93.0601 2.6E3 95.0500 2.7E3 95.0853 1.1E4 97.3842 2.3E3 105.0696 1.8E4 107.0850 3.2E3 119.0854 3.3E4 121.1006 5.3E3 133.1004 4.0E3 133.6786 2.4E3 136.8241 2.2E3 142.0605 2.4E3 145.1008 1.1E4 147.1169 2.5E3 157.1010 4.3E3 159.1164 1.3E4 173.1319 3.5E3 173.5253 2.5E4 173.5383 2.8E4 193.6845 2.3E3 193.7917 2.4E3 201.1637 1.2E4 286.6232 2.4E3 287.1260 1.5E4 END IONS BEGIN IONS FEATURE_ID=346 PEPMASS=247.1331 SCANS=346 RTINSECONDS=414.166 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 10 (4 removed due to low quality, 0 removed due to low cosine). 44.6272 2.3E3 46.1934 2.7E3 46.8654 2.6E3 47.3780 2.5E3 48.9178 2.0E3 49.0937 2.4E3 51.1957 2.4E3 53.0385 1.3E5 53.4515 2.3E3 54.1326 2.5E3 55.0178 3.4E4 55.0542 1.1E5 56.2518 2.4E3 57.0334 3.1E3 57.0698 3.0E4 58.6393 2.2E3 59.0491 1.2E4 63.7787 2.1E3 65.0384 1.1E5 67.0541 1.1E5 68.9969 4.8E3 69.0333 4.8E5 69.0377 5.5E3 69.0698 3.3E4 70.3297 2.2E3 71.2955 2.3E3 74.3108 2.4E3 75.0806 2.2E3 75.6532 2.3E3 77.0385 1.9E4 79.0541 1.7E5 81.0333 3.5E3 81.0697 2.4E5 83.0489 4.7E5 83.0854 5.0E3 85.0280 2.4E3 85.0647 3.5E3 91.0541 2.8E5 93.0334 1.2E5 93.0428 2.5E3 93.0697 3.4E5 95.0490 1.5E5 95.0854 4.0E4 97.0283 1.2E5 97.0647 2.5E4 98.3510 2.4E3 100.8158 2.4E3 103.0541 5.8E3 105.0447 1.6E4 105.0697 2.8E5 105.0781 2.7E3 106.0777 2.2E3 107.0490 3.5E4 107.0854 4.4E5 108.0569 6.6E3 108.0927 2.1E3 109.0283 4.4E5 109.0647 2.9E5 109.1011 5.2E4 110.0727 6.4E3 111.0439 1.1E5 111.0803 3.5E4 112.6637 2.4E3 113.5002 2.3E3 115.0544 3.7E4 116.0621 6.8E3 117.0697 1.9E5 119.0490 1.5E4 119.0768 4.8E3 119.0854 4.7E5 119.0941 2.1E3 120.0928 2.4E3 121.0282 9.3E4 121.0552 8.3E3 121.0647 4.8E5 121.1010 1.9E5 122.0724 1.7E4 122.1644 3.0E3 123.0437 7.3E3 123.0802 5.1E4 125.0236 3.0E3 125.0592 1.1E4 125.0956 2.8E3 128.0620 4.6E4 129.0698 9.4E4 130.0778 3.0E4 131.0854 5.3E5 131.1436 2.4E3 132.0568 4.3E4 133.0649 1.8E4 133.0903 4.5E3 133.1011 3.1E5 135.0437 9.0E3 135.0685 4.7E3 135.0803 7.3E5 135.1176 2.7E3 136.0891 5.5E3 137.0596 5.8E4 137.0960 7.9E4 139.0394 9.2E3 141.0700 4.3E4 142.0776 6.6E4 143.0854 2.0E5 144.0560 3.3E3 144.0933 2.6E5 145.0646 2.5E5 145.0888 4.2E3 145.1011 3.8E5 146.0725 2.1E4 147.0803 9.2E4 149.0595 2.5E4 149.0829 4.9E3 149.0960 4.8E5 149.1165 3.8E3 150.1037 5.9E4 151.0750 1.3E4 151.1117 7.8E4 153.0697 3.6E4 153.0908 2.4E4 154.0777 1.7E4 155.0854 1.3E5 156.0936 2.6E4 157.0640 1.2E4 157.1010 1.0E5 157.8274 2.6E3 158.0726 5.2E4 158.1089 4.5E5 158.1238 5.0E3 159.0804 3.0E5 159.1167 9.0E5 160.0882 1.1E5 160.7195 2.7E3 161.0960 9.6E4 161.1319 5.6E3 163.0753 3.5E5 163.1115 5.0E4 165.0914 3.2E4 166.0784 2.6E3 167.0851 7.9E3 168.0934 1.4E5 169.1013 7.1E4 170.1090 1.3E5 170.6821 2.4E3 171.0805 1.2E5 171.1169 4.2E4 172.0739 9.2E3 172.0883 4.2E5 173.0601 3.4E4 173.0962 7.2E5 173.1326 1.0E6 173.1501 5.0E3 173.5264 1.3E4 173.5342 4.3E4 174.0678 3.5E3 175.0752 2.7E4 175.1118 5.6E3 177.0912 1.6E4 177.1282 4.1E3 178.0779 5.7E3 179.7822 2.6E3 181.0649 4.5E4 181.1026 2.9E3 183.1169 2.2E5 184.1240 2.6E3 185.0962 3.6E4 185.1330 8.0E3 186.0845 1.9E4 186.1039 8.1E5 186.1234 1.9E4 187.0747 5.0E4 187.1117 2.0E6 188.1199 5.2E3 189.0909 3.8E4 189.1289 2.2E3 191.0509 3.0E3 191.0702 5.7E5 193.1011 4.1E4 195.0800 6.4E3 196.0882 1.7E5 199.0754 4.5E4 199.8130 2.4E3 201.0941 1.1E4 201.1064 3.6E3 201.1274 5.7E5 201.1496 3.6E3 203.1417 3.6E3 205.1227 3.2E4 211.1119 1.3E5 214.0990 9.8E4 219.1386 9.2E3 229.1224 1.5E5 231.4461 2.4E3 247.1328 7.5E4 252.5036 2.4E3 END IONS BEGIN IONS FEATURE_ID=347 PEPMASS=229.1227 SCANS=347 RTINSECONDS=414.186 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 6 (0 removed due to low quality, 0 removed due to low cosine). 43.0177 3.1E4 44.0663 2.3E3 44.3565 2.2E3 44.8417 2.1E3 46.7723 3.0E3 50.2294 2.4E3 51.4071 2.6E3 51.7790 2.5E3 53.0384 4.3E4 54.8022 2.1E3 55.0542 5.6E3 55.9343 2.2E4 57.1620 2.2E3 58.8598 2.4E3 59.2016 2.2E3 59.4060 2.2E3 59.5264 2.3E3 67.0537 3.4E3 67.3477 2.6E3 68.3763 2.3E3 69.0332 1.1E5 71.7085 2.4E3 73.5437 2.4E3 79.8610 2.6E3 81.0694 3.0E3 83.0489 1.0E4 83.1692 2.6E3 84.2997 2.2E3 90.9478 6.1E3 91.0540 3.0E4 91.7231 2.6E3 92.1012 2.4E3 93.0696 3.7E4 95.5067 2.6E3 97.8593 2.6E3 103.3496 2.8E3 103.6052 2.5E3 105.0695 3.3E4 105.8606 2.7E3 109.0280 8.6E4 109.0644 3.0E3 109.3680 2.2E3 115.9639 2.4E3 116.7131 2.3E3 117.0697 7.6E3 119.0852 4.8E4 121.0645 3.4E4 123.4089 2.4E3 123.4883 2.5E3 128.0620 2.5E3 129.0696 1.5E4 129.3423 2.4E3 130.9187 2.6E3 131.0853 9.9E4 133.1009 6.5E4 133.1109 3.0E3 141.0697 5.3E3 143.0854 5.5E4 144.0293 2.5E3 144.0931 3.3E4 145.0648 7.0E3 145.1010 7.2E4 147.1358 2.7E3 154.0781 2.6E3 154.1783 2.4E3 155.0851 2.8E4 157.1008 3.2E3 158.1088 1.3E5 159.0803 4.3E4 159.1165 7.1E4 164.9518 3.2E3 168.0936 2.9E4 169.1001 5.5E3 170.1089 3.5E4 171.0802 2.0E4 172.0883 5.1E4 173.0960 1.8E5 173.1122 3.4E3 173.1158 4.0E3 173.1325 2.4E5 173.5239 7.1E3 173.5326 5.0E4 173.5416 6.1E3 181.0654 3.0E3 183.1169 4.1E4 185.1310 2.5E3 186.1038 1.6E5 187.1116 2.8E5 196.0884 3.8E4 199.0767 5.2E3 201.0920 2.9E3 201.1273 9.0E4 211.1120 2.3E4 214.0982 1.8E4 214.7946 2.8E3 229.1219 3.1E4 234.8754 2.6E3 END IONS BEGIN IONS FEATURE_ID=348 PEPMASS=353.1388 SCANS=348 RTINSECONDS=422.221 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 6 (1 removed due to low quality, 0 removed due to low cosine). 52.2154 2.2E3 52.3228 2.1E3 52.7565 2.5E3 56.1450 2.1E3 56.8318 2.1E3 56.9681 2.5E3 57.7743 2.3E3 58.5089 2.6E3 61.0286 2.3E3 61.2034 2.3E3 61.9453 2.9E3 64.3054 2.4E3 66.1501 2.3E3 67.2121 2.3E3 67.7341 3.0E3 71.6192 2.3E3 79.0543 2.7E3 79.7822 2.3E3 80.3220 2.1E3 84.0686 2.2E3 84.6098 2.0E3 86.4109 2.3E3 86.5414 2.4E3 87.0985 2.4E3 87.9134 2.9E3 95.0488 3.9E3 107.0491 9.1E3 117.2921 2.6E3 117.4121 2.5E3 121.0651 2.3E3 127.9657 2.6E3 129.0696 7.9E4 135.0330 4.2E3 135.0439 5.7E5 136.0517 7.3E4 139.0754 7.3E3 142.9782 2.6E3 144.3843 2.5E3 145.0654 3.3E3 147.0434 3.0E3 149.0596 1.7E4 151.0752 5.0E5 155.8832 2.9E3 157.0646 1.0E5 160.7364 2.2E3 161.0600 1.0E4 165.0546 5.1E3 165.0912 1.4E4 170.9245 2.3E3 171.0811 5.8E3 172.0510 2.9E3 172.0884 1.9E4 173.0596 4.5E4 173.5216 3.2E4 173.5309 1.6E4 173.5404 5.8E4 174.0671 3.3E3 175.0754 6.7E3 177.0920 2.8E3 179.0714 8.4E3 181.0643 2.4E3 185.0597 2.3E5 185.0789 4.9E3 186.0681 3.1E3 187.0753 1.1E5 188.0834 5.9E4 189.0909 2.1E4 197.0596 3.3E4 199.0751 3.6E4 201.0910 1.2E5 203.1067 7.1E4 208.8849 2.6E3 213.0909 1.5E4 215.0703 9.5E4 217.1016 4.3E3 218.0767 2.7E3 231.0794 6.2E3 231.1019 6.0E4 233.0964 1.6E4 239.0702 3.8E4 245.0960 2.7E4 246.0758 2.7E3 246.1036 4.8E4 247.0759 2.0E4 247.1101 3.0E3 249.0906 8.1E3 251.1067 7.1E3 252.0777 4.6E4 253.0857 3.5E3 258.0674 2.5E3 259.0736 7.2E3 260.0821 1.8E4 261.0907 5.2E4 262.0985 6.1E4 263.0701 6.1E3 265.0894 5.2E3 265.1219 3.0E4 267.0649 6.4E4 268.0729 4.2E4 272.0827 6.5E3 273.0910 5.9E4 274.0990 6.9E4 275.0701 1.2E4 275.1073 3.3E3 276.0788 1.3E4 277.0862 4.6E4 277.1225 8.5E4 278.0936 3.4E4 279.1019 7.2E3 282.0888 3.8E5 283.0963 4.6E4 288.0783 2.2E4 289.0863 1.3E5 290.0942 5.3E4 291.1018 4.3E4 292.0762 3.6E3 292.1095 1.0E5 293.0810 3.0E4 293.1179 3.7E4 295.0968 4.8E4 303.1017 9.6E4 304.1097 2.6E5 305.0804 7.0E4 305.1177 1.2E5 306.0881 1.3E4 307.0965 7.1E3 308.1047 1.9E5 309.1122 1.4E4 319.0969 1.8E4 320.1045 7.1E4 322.1205 1.3E4 323.1275 3.7E4 335.1279 1.0E5 353.1385 9.6E3 END IONS BEGIN IONS FEATURE_ID=349 PEPMASS=718.3243 SCANS=349 RTINSECONDS=424.359 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 9 (6 removed due to low quality, 0 removed due to low cosine). 68.0496 1.2E4 70.0650 4.0E6 70.0703 3.4E4 70.0719 1.8E4 70.0739 1.9E4 70.9643 4.2E3 72.1860 3.6E3 86.1571 2.7E3 87.5680 3.1E3 91.0541 1.8E5 93.0696 5.3E3 95.0491 1.0E4 97.0759 5.1E4 98.0600 1.2E5 103.0541 5.4E4 107.0499 3.4E3 109.0769 3.1E3 110.7038 4.2E3 115.0864 2.4E5 117.0574 5.8E3 118.0650 2.3E5 119.0728 4.1E4 120.0806 3.6E6 120.0888 2.3E4 120.1005 4.2E3 124.0867 5.2E4 125.0708 2.8E5 126.0547 6.2E4 130.0651 3.3E4 131.0490 2.4E4 132.0805 2.5E4 133.8563 4.9E3 135.6938 4.2E3 136.0757 1.6E5 136.9508 5.8E3 137.0708 4.2E5 137.0831 3.2E3 144.6035 4.0E3 146.0599 2.2E6 146.0702 1.2E4 146.0738 1.2E4 148.0751 8.8E3 151.0739 2.1E4 152.0817 4.2E5 162.0550 1.6E4 164.0706 7.6E4 165.0546 4.8E4 172.0966 9.1E3 172.1122 3.0E5 173.0713 6.1E3 173.5270 4.5E4 174.0549 2.8E4 182.0813 1.8E5 185.1097 5.5E3 187.1231 4.6E4 189.1398 2.9E3 191.0819 8.2E3 192.0661 5.0E3 199.1230 1.7E5 200.1069 6.5E3 201.1391 3.3E4 208.1123 9.5E4 214.1337 1.4E4 215.0815 3.0E4 215.1179 1.9E5 216.1258 4.6E5 217.1336 1.2E6 217.1517 7.7E3 217.1588 9.8E3 220.1124 3.0E4 221.5500 2.6E3 222.1280 1.0E5 223.0752 1.4E4 225.1021 9.8E4 227.1179 2.0E5 228.1024 2.2E4 228.1259 6.9E4 236.1071 1.3E5 237.1385 1.7E4 238.1228 4.6E4 242.1283 1.8E4 243.1126 4.3E5 243.1371 6.5E4 244.1444 5.4E4 245.1284 1.9E5 248.1069 5.2E4 253.1340 3.9E3 254.1285 6.8E4 256.1437 2.0E4 262.1545 4.0E3 264.1017 2.0E4 265.0856 7.9E4 265.1335 2.8E5 266.1179 1.2E4 270.1125 8.5E4 272.1395 5.5E4 277.1337 9.7E4 281.1278 3.3E4 282.1128 3.1E5 283.1447 2.0E4 284.1393 3.2E4 293.1287 3.3E5 293.1660 3.8E3 299.1381 4.7E4 299.3519 2.9E3 300.1347 1.6E5 301.1698 2.5E4 302.1518 3.5E3 305.1649 2.8E4 309.1235 5.5E5 311.1378 4.6E3 312.1233 6.1E3 318.1949 1.6E4 321.1232 6.3E4 327.1361 2.0E4 329.1501 2.2E5 339.1338 4.9E4 344.1756 2.1E5 346.1406 4.2E3 346.1536 4.5E3 346.1914 1.0E6 355.1287 2.0E5 362.1865 2.9E4 372.1707 2.8E5 383.1754 2.3E4 390.1811 2.2E6 391.1859 1.1E4 391.1954 5.7E3 396.1471 3.6E3 396.1975 2.1E4 400.1543 2.2E4 406.1771 1.1E4 415.1398 5.7E3 417.1811 2.5E5 424.1896 1.1E4 429.1807 1.3E5 446.2059 2.1E4 456.1913 2.8E4 458.2069 7.6E4 474.2020 9.9E4 484.1820 4.4E3 498.2371 1.6E4 502.1967 6.5E5 502.2817 1.6E4 525.2488 2.9E4 526.2322 2.0E4 543.1831 3.9E3 543.2592 1.4E5 553.2433 6.9E4 571.2541 1.6E5 578.4147 2.9E3 718.3220 3.3E4 END IONS BEGIN IONS FEATURE_ID=350 PEPMASS=685.2768 SCANS=350 RTINSECONDS=432.619 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 79.4136 2.8E3 81.0160 2.4E3 81.1545 2.2E3 93.7566 2.3E3 96.3507 2.5E3 103.0540 2.4E3 114.1704 2.6E3 115.1549 2.2E3 121.0551 9.6E3 121.0646 2.4E5 124.7740 2.4E3 138.1700 2.7E3 138.7051 2.5E3 155.0701 2.4E3 155.5782 2.6E3 162.6816 2.8E3 164.0700 3.7E3 168.8496 2.2E3 173.5254 2.8E4 173.5412 3.6E4 182.2631 2.4E3 219.0816 5.0E3 231.0388 1.0E4 231.0651 3.8E5 233.0601 7.0E3 235.0746 2.8E3 235.3224 2.4E3 237.0905 2.1E4 247.0740 2.8E3 250.0629 2.9E3 250.5087 2.5E3 262.1345 2.8E3 263.0701 8.1E4 265.0855 8.0E4 274.0708 2.0E4 291.0655 1.3E4 293.0809 1.1E5 297.1119 5.3E4 298.8282 2.7E3 305.0809 2.9E3 307.4566 2.3E3 308.0672 2.0E4 318.0488 2.7E3 321.0765 2.9E3 323.0913 7.5E4 325.1072 9.5E4 342.1095 8.9E4 351.0857 1.2E6 351.1233 6.9E3 352.0948 6.7E3 355.1129 3.0E3 355.4034 2.5E3 357.1328 9.2E4 368.0908 3.0E3 383.0565 5.3E3 383.1124 3.7E5 390.3831 2.7E3 394.1287 4.7E4 401.2897 2.6E3 406.4375 2.4E3 411.1084 2.7E4 429.1188 1.8E4 509.9370 2.7E3 520.1957 7.7E4 548.1907 6.3E3 611.9456 2.7E3 END IONS BEGIN IONS FEATURE_ID=351 PEPMASS=221.0812 SCANS=351 RTINSECONDS=437.201 CHARGE=1+ MSLEVEL=2 MERGED_STATS=8 / 9 (1 removed due to low quality, 0 removed due to low cosine). 42.6381 4.6E3 43.4796 2.4E3 44.3123 2.1E3 45.3966 2.5E3 48.8900 2.4E3 48.9450 2.2E3 50.7338 2.3E3 51.6834 2.7E3 52.4820 2.4E3 52.6724 2.1E3 53.0850 2.4E3 53.5937 2.4E3 55.1248 2.4E3 55.1543 2.5E3 56.2748 2.2E3 56.6497 2.2E3 56.6815 4.3E3 58.8682 2.2E3 59.3874 3.0E3 60.8214 2.4E3 63.6555 2.3E3 65.2295 2.3E3 67.2312 2.2E3 69.6635 2.4E3 70.0399 2.1E3 72.8697 2.3E3 74.2084 2.3E3 75.4155 2.1E3 78.0462 2.7E4 79.0540 5.6E4 79.1635 2.6E3 85.3479 2.3E3 85.5059 2.6E3 85.8306 2.2E3 88.1002 2.3E3 90.0465 3.5E3 91.0540 9.1E4 93.4984 2.8E3 95.0489 1.3E4 95.1051 2.6E3 102.0095 2.4E3 102.0463 1.1E5 103.0540 5.2E4 104.0618 4.5E4 104.7275 2.6E3 105.0335 6.2E3 105.0699 3.8E4 107.0489 1.0E5 109.8305 2.8E3 114.6340 2.7E3 115.0547 3.5E3 116.0620 2.6E3 117.0338 2.9E3 117.8939 2.4E3 118.0411 6.5E4 119.0489 1.9E5 120.0566 1.5E4 121.0646 4.1E4 121.4312 2.4E3 122.0725 1.4E4 122.5399 2.7E3 130.0412 1.8E5 131.0490 7.9E4 132.0205 3.5E3 132.0466 2.7E3 132.0568 1.4E5 132.3839 2.3E3 133.0284 3.5E4 133.0646 5.1E4 134.0370 3.5E3 134.0726 8.6E3 135.0330 4.5E3 135.0439 2.4E5 135.3654 2.2E3 136.0256 2.7E3 136.6818 2.4E3 137.7898 2.3E3 140.8732 2.4E3 141.0690 2.5E3 144.0568 2.6E3 145.0282 2.2E4 145.1130 2.4E3 146.0360 3.0E4 147.0439 6.0E5 147.0571 4.4E3 148.0517 9.3E4 149.0596 1.3E5 150.0674 4.7E4 150.1903 2.5E3 152.6988 2.3E3 156.9736 8.1E3 157.0396 1.4E4 158.0361 2.7E3 159.0438 2.6E4 160.0518 1.6E5 161.0230 2.8E4 161.0597 1.2E5 162.0531 4.8E3 162.0675 4.1E5 162.0829 3.8E3 163.0388 7.4E5 163.0751 6.8E4 173.5255 3.3E4 173.5362 5.5E4 174.0314 3.8E4 174.9850 3.7E4 175.0390 4.0E5 176.0468 1.1E5 176.0739 6.8E3 177.0547 1.1E5 177.7835 2.6E3 178.0625 3.8E5 178.0805 3.3E3 187.0396 3.6E3 188.0468 5.5E4 188.1798 2.4E3 189.0546 2.3E4 190.0427 9.3E3 190.0625 5.2E5 190.0808 4.5E3 191.0338 2.3E5 191.0705 1.4E4 191.6745 2.5E3 193.0861 2.4E5 205.0499 6.9E3 206.0576 1.2E5 217.7240 2.6E3 221.0810 3.5E4 221.1899 5.2E3 223.5993 2.3E3 227.6747 2.3E3 END IONS BEGIN IONS FEATURE_ID=352 PEPMASS=334.1291 SCANS=352 RTINSECONDS=437.262 CHARGE=1+ MSLEVEL=2 MERGED_STATS=8 / 9 (1 removed due to low quality, 0 removed due to low cosine). 50.2103 2.8E3 51.4262 2.1E3 53.1050 2.4E3 54.6978 2.3E3 55.2697 4.1E4 55.2714 4.8E3 55.2914 2.4E3 55.6588 2.7E3 57.5358 2.5E3 62.0729 2.2E3 63.6303 2.1E3 63.6873 2.2E3 63.8988 2.3E3 64.9927 2.3E3 68.9858 2.6E3 70.7663 2.6E3 71.0760 2.3E3 71.2149 2.2E3 72.6389 2.1E3 73.0831 2.6E3 74.2426 2.3E3 79.0541 6.2E3 80.6623 2.2E3 88.7573 2.5E3 91.0541 1.8E4 95.3024 2.2E3 98.3747 2.3E3 100.3336 2.5E3 102.0465 1.4E4 103.0540 8.6E3 103.3380 2.7E3 104.0622 6.9E3 105.0699 9.9E3 107.0492 5.4E3 107.1606 2.5E3 108.2694 2.4E3 114.0543 2.6E3 115.4316 2.7E3 118.0411 2.5E4 119.0492 4.4E4 120.0577 2.8E3 122.0720 2.9E3 130.0413 6.4E4 131.0491 2.2E4 132.0571 3.5E4 133.0286 2.8E3 133.0647 5.7E4 135.0442 6.0E4 144.0099 2.4E3 146.0359 9.9E3 147.0440 2.7E5 148.0521 3.2E4 149.0597 4.6E4 150.0675 4.1E4 158.0360 3.5E3 159.0438 1.6E4 160.0519 7.5E4 161.0598 1.4E5 162.0676 7.9E5 162.0831 1.9E4 163.0390 2.6E5 163.0753 1.4E5 165.0912 3.1E4 167.0703 2.8E4 167.6844 2.3E3 170.6510 2.2E3 173.5266 2.7E4 173.5368 4.8E4 173.5463 4.2E3 174.0167 2.4E3 174.0314 8.0E4 175.0392 1.9E5 176.0470 1.9E5 177.0549 1.4E5 178.0484 2.5E3 178.0626 7.2E5 178.0806 1.4E4 178.4034 2.5E3 181.6827 2.4E3 188.0468 6.6E4 189.0547 3.7E5 189.0724 4.7E3 190.0221 7.9E3 190.0426 1.1E4 190.0624 4.0E6 190.6677 2.3E3 191.0138 2.1E4 191.0338 8.2E5 191.0701 3.1E5 192.0416 4.0E4 193.0860 3.0E6 193.1066 6.4E3 202.0693 2.6E3 202.7986 2.4E3 205.0494 2.4E4 206.0346 1.5E4 206.0413 3.8E3 206.0575 1.5E6 206.0801 1.8E4 207.5310 2.4E3 220.8655 2.4E3 221.0305 6.3E4 221.0809 1.0E7 221.1199 9.1E3 221.1323 4.6E4 222.0847 2.0E4 267.0266 2.4E3 270.2938 2.8E3 291.1017 2.7E3 298.3531 2.6E3 318.0905 2.4E3 343.1904 2.6E3 END IONS BEGIN IONS FEATURE_ID=353 PEPMASS=356.1108 SCANS=353 RTINSECONDS=437.423 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 52.0490 2.3E3 52.1674 2.6E3 53.1675 2.1E3 53.9535 2.5E3 54.3920 2.4E3 75.4029 2.6E3 79.5402 2.1E3 86.0625 2.2E3 87.0532 2.2E3 96.0670 2.5E3 106.1401 2.3E3 108.1613 2.7E3 173.5210 1.1E4 173.5323 4.9E4 173.5401 2.3E4 184.0157 2.7E3 200.5066 2.2E3 201.9275 2.2E3 210.0161 3.1E3 237.1799 2.8E3 255.5580 2.4E3 286.7584 2.6E3 307.5224 2.4E3 309.9000 9.0E3 313.6196 2.6E3 END IONS BEGIN IONS FEATURE_ID=354 PEPMASS=245.0136 SCANS=354 RTINSECONDS=438.559 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 47.0586 2.2E3 50.0403 2.3E3 53.0572 2.3E3 55.9342 2.3E4 65.3099 2.3E3 66.9751 2.2E3 75.4600 2.3E3 82.7495 2.1E3 88.2843 2.4E3 88.5484 2.4E3 92.1079 2.3E3 96.7269 2.7E3 102.7498 2.4E3 113.1016 2.3E3 114.7087 2.4E3 115.7152 2.4E3 117.1599 2.5E3 137.3131 2.2E3 137.7341 2.7E3 167.0000 3.1E3 173.5224 4.7E3 173.5363 4.0E4 175.9916 9.0E3 184.9966 3.1E3 203.9866 7.6E3 219.5722 2.6E3 220.9896 1.8E4 221.9303 2.8E3 221.9967 1.6E4 222.7486 2.6E3 240.0078 7.7E3 END IONS BEGIN IONS FEATURE_ID=355 PEPMASS=219.1020 SCANS=355 RTINSECONDS=438.792 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 42.5982 2.0E3 43.0177 1.6E4 44.8793 2.3E3 45.0334 6.4E3 47.6885 2.5E3 50.6115 2.7E3 53.3773 2.3E3 55.0173 2.5E3 55.9343 6.5E3 56.2341 2.2E3 57.0333 2.0E4 58.5440 2.3E3 61.9156 2.4E3 63.9235 2.2E3 66.1915 2.5E3 67.0127 2.1E3 67.0542 1.2E4 81.2674 2.7E3 82.3532 2.5E3 85.0283 2.9E3 90.9475 3.0E3 91.0539 1.2E5 103.0539 2.9E4 104.1130 2.4E3 105.0697 1.1E4 107.0852 2.3E3 107.4827 2.3E3 109.0642 2.4E3 112.8421 2.7E3 115.0540 9.2E4 116.0617 3.3E4 117.0696 3.7E4 119.0861 2.5E3 123.0787 2.6E3 128.0618 9.5E4 129.0589 4.9E3 129.0695 5.8E5 129.0795 3.8E3 129.9507 2.7E3 130.0775 3.4E4 131.0488 9.0E4 131.0852 5.0E5 131.0946 2.6E3 131.0987 6.1E3 133.1013 1.1E4 137.0594 6.0E4 141.0696 5.1E5 141.0807 2.6E3 141.0829 4.1E3 141.8279 2.5E3 142.0773 3.5E3 143.0488 2.6E4 143.0850 3.1E4 144.0568 7.3E4 145.0644 7.7E4 146.0725 7.2E4 147.0438 8.0E3 148.0518 1.9E4 151.0766 3.6E3 152.1979 2.3E3 153.0703 2.5E3 154.7886 2.3E3 155.0607 5.2E3 156.0564 6.7E3 157.0507 8.3E3 157.0645 2.5E5 158.0724 3.1E5 158.0874 9.6E3 159.0438 3.1E4 159.0802 2.0E5 160.0516 7.9E4 161.0595 1.6E4 161.0960 5.1E4 162.0673 1.3E4 163.0753 2.4E4 168.0570 1.7E4 169.0646 1.6E5 170.0726 1.0E5 171.0442 4.1E3 171.0802 1.6E4 172.0885 2.8E3 173.0597 6.0E4 173.0961 7.6E3 173.5249 1.3E4 173.5384 3.0E4 174.0502 4.3E3 174.0674 1.1E6 175.0752 1.1E5 183.0815 6.1E3 184.0347 2.9E3 185.0596 8.8E3 186.0674 2.6E5 187.0756 1.3E4 188.0833 7.4E4 189.0909 4.8E5 189.1111 9.2E3 191.0699 3.5E3 191.1073 3.3E3 196.2653 2.3E3 201.0910 2.5E5 203.1432 9.8E3 217.9115 2.6E3 219.1017 3.8E4 219.1745 1.5E4 221.2251 2.4E3 END IONS BEGIN IONS FEATURE_ID=356 PEPMASS=467.1819 SCANS=356 RTINSECONDS=439.193 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 57.5665 2.5E3 66.1873 2.3E3 68.6225 2.3E3 71.6511 2.3E3 72.7022 2.2E3 73.2864 2.3E3 74.8404 2.2E3 75.1911 2.2E3 78.5216 2.2E3 98.0598 2.6E4 101.9975 2.5E3 120.1961 2.3E3 121.5909 2.9E3 122.0589 3.5E3 125.7450 2.4E3 132.0445 3.1E3 135.0452 3.1E3 147.0440 2.1E4 150.0546 1.5E5 161.0594 7.1E3 162.0537 2.5E3 162.0673 7.6E4 163.0384 1.7E4 163.0751 8.6E3 163.4233 2.4E3 173.5374 2.9E4 174.0312 4.1E3 175.0390 1.4E4 176.0467 1.5E4 177.0553 1.6E4 178.0624 4.7E4 189.0544 5.2E4 190.0622 5.2E5 190.0773 7.8E3 191.0337 9.4E4 191.0702 4.6E4 193.0655 3.6E3 193.0857 4.4E5 193.1004 4.4E3 193.1063 9.8E3 206.0410 2.3E3 206.0572 1.9E5 211.3005 2.5E3 219.1131 2.9E3 221.0297 1.9E4 221.0807 4.9E6 221.1001 2.3E4 221.1200 1.0E4 221.1316 2.5E4 230.0817 2.4E4 247.1075 3.9E5 247.1368 4.6E3 355.6633 2.5E3 412.6211 2.5E3 470.4674 2.5E3 END IONS BEGIN IONS FEATURE_ID=357 PEPMASS=326.1005 SCANS=357 RTINSECONDS=442.622 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 10 (4 removed due to low quality, 0 removed due to low cosine). 49.9320 2.1E3 55.2694 2.3E3 57.0418 2.4E3 58.0648 3.1E3 59.0103 2.2E3 60.6661 2.5E3 62.3907 2.2E3 63.6597 2.3E3 63.7292 2.4E3 68.2430 2.3E3 69.8033 2.8E3 70.9844 2.2E3 76.1463 2.3E3 76.3557 2.2E3 77.1628 2.1E3 81.7430 2.4E3 83.5551 2.4E3 90.1629 2.4E3 91.0080 2.2E3 100.4659 2.2E3 116.9707 2.7E3 117.4213 2.6E3 120.0416 2.8E4 122.9545 2.2E3 147.0438 2.7E3 153.8955 2.6E3 157.9082 2.6E3 163.7060 2.3E3 173.5252 1.5E4 173.5350 5.8E4 173.5452 5.0E3 175.0392 1.1E4 205.6184 2.5E3 207.0644 1.1E4 207.8290 2.3E3 212.8014 2.5E3 221.4570 2.6E3 229.0447 2.6E3 233.8999 3.1E3 249.0160 2.4E3 250.2650 2.4E3 262.0706 2.4E3 288.3494 2.3E3 297.9064 2.4E3 311.1159 5.4E3 326.1005 7.0E4 END IONS BEGIN IONS FEATURE_ID=358 PEPMASS=303.1108 SCANS=358 RTINSECONDS=442.64 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 6 (1 removed due to low quality, 0 removed due to low cosine). 48.1599 2.1E3 49.6031 2.2E3 50.5534 2.2E3 53.8455 2.4E3 57.8911 2.6E3 59.1999 2.6E3 64.8517 2.2E3 71.8515 2.6E3 73.9428 2.5E3 81.0333 6.3E3 82.0650 1.7E4 83.3530 2.3E3 84.6237 2.4E3 86.1373 2.2E3 91.0541 1.0E5 93.3271 2.6E3 96.0446 6.4E3 98.0599 3.0E4 102.0462 4.0E3 104.5537 2.3E3 114.7555 2.5E3 119.0392 6.4E3 119.0490 4.2E5 119.0592 3.7E3 119.0636 3.0E3 122.0594 3.0E3 124.1600 2.3E3 126.4150 2.2E3 129.0332 1.0E4 130.0412 8.2E4 130.5675 2.6E3 132.0567 2.3E4 133.0282 4.8E3 146.0609 2.6E3 147.0244 3.3E3 147.0440 5.8E5 147.0546 3.4E3 148.0512 5.8E3 149.0233 2.8E3 149.0589 2.3E3 150.6854 2.3E3 157.0397 4.5E4 158.4852 2.3E3 160.0520 7.2E3 160.4484 2.3E3 161.0232 4.8E3 163.0388 2.7E4 164.0690 2.3E3 165.0545 2.6E4 173.5261 5.7E4 173.5413 4.0E4 175.0203 3.1E3 175.0391 1.6E6 176.0470 7.4E4 176.0710 1.5E4 177.0553 2.0E4 178.0625 2.1E5 179.0704 3.0E4 180.0783 1.5E5 181.0496 3.8E4 188.0472 8.8E3 191.0343 3.2E3 194.1441 2.7E3 195.0889 5.9E3 203.5169 2.3E3 204.1403 3.3E3 205.0494 1.4E4 206.0541 3.1E4 207.0448 6.9E3 207.0654 1.1E6 207.0849 2.1E4 222.0511 2.9E3 225.0776 2.9E3 232.0974 1.1E4 241.8602 2.4E3 243.0899 7.4E3 244.3784 2.7E3 258.1122 2.9E4 260.0911 2.9E4 274.1078 2.7E4 275.1154 1.3E5 301.1961 2.6E3 303.1068 1.4E4 END IONS BEGIN IONS FEATURE_ID=359 PEPMASS=207.0655 SCANS=359 RTINSECONDS=442.712 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 11 (5 removed due to low quality, 0 removed due to low cosine). 43.0178 1.5E4 43.6260 2.2E3 45.0334 8.1E3 45.7621 2.3E3 47.1602 3.6E3 48.2659 2.2E3 48.5217 2.1E3 51.0228 3.0E4 51.5200 2.2E3 52.7145 2.6E3 53.0020 2.6E4 53.0384 2.6E3 53.1113 2.2E3 54.8576 2.3E3 55.0177 2.5E4 55.8927 2.6E3 57.9346 5.6E3 60.0992 3.5E3 60.4740 2.1E3 61.3368 2.2E3 62.3013 3.8E3 63.0230 7.5E3 64.0306 6.5E3 65.0383 4.2E5 65.0990 3.9E3 66.0461 1.1E4 66.6843 2.4E3 67.0539 5.0E3 68.2229 2.6E3 75.4374 2.3E3 76.0305 6.3E4 77.0383 8.0E4 77.9646 2.8E3 78.0462 2.1E4 79.0539 6.5E4 80.0617 7.4E4 80.7219 2.7E3 83.8379 2.3E3 84.9154 2.3E3 84.9454 2.7E3 85.1585 2.4E3 86.8438 4.0E3 88.6888 2.2E3 89.0327 5.3E3 89.0383 2.9E5 90.0461 8.8E4 91.0466 9.0E3 91.0540 7.3E6 91.0642 3.1E4 91.0651 1.6E5 91.0671 2.2E4 91.0712 1.0E4 93.0333 3.8E4 93.0698 4.9E3 94.0412 1.7E4 95.0488 7.9E4 95.0852 6.8E3 97.9531 1.4E4 98.9611 3.9E4 101.0384 1.4E5 102.9563 1.4E4 103.0539 1.2E5 104.0188 3.5E3 104.0254 1.2E5 105.0333 4.7E4 105.0444 1.8E4 105.0695 6.5E3 106.0410 2.7E4 106.6398 2.6E3 107.0488 1.3E5 108.0567 1.1E5 108.1304 3.4E3 109.0653 2.9E3 109.4606 2.4E3 110.2562 2.4E3 110.9721 2.3E3 112.7176 2.1E3 115.0173 2.5E3 115.9550 7.9E3 115.9638 3.7E5 116.6454 2.2E3 116.9716 1.2E5 117.0333 1.4E5 118.0411 2.4E5 119.0381 2.7E3 119.0488 4.8E6 119.0572 7.2E4 119.7441 2.4E3 121.0281 9.4E4 121.0372 3.4E3 121.0643 9.2E3 122.0361 5.3E4 122.0473 3.8E3 123.0803 9.1E3 126.9674 2.6E3 129.0227 3.9E3 129.0333 2.4E5 129.0445 5.9E4 129.6956 4.1E3 129.9777 2.3E3 130.0413 1.9E4 131.0489 2.6E4 132.0092 1.5E4 132.0203 6.5E5 133.0282 7.1E4 133.0642 2.6E3 133.9745 9.0E3 134.0360 5.7E4 135.0438 3.2E5 136.0517 2.1E5 137.0600 7.2E3 137.9868 4.1E3 145.0282 2.0E5 146.0361 2.2E5 147.0438 2.8E6 147.0548 1.0E4 148.0516 2.8E4 149.0106 8.3E3 149.0232 5.9E5 149.0600 9.5E3 150.0310 5.8E4 151.0748 5.0E3 155.9965 7.0E3 157.0264 1.1E4 157.0395 3.8E5 157.0529 2.1E3 159.8195 2.7E3 160.0153 5.0E4 162.0311 9.9E4 163.0388 7.8E4 164.0467 2.8E5 173.5274 4.3E4 173.5405 1.1E4 174.0312 1.5E5 175.0390 5.3E5 175.0551 9.4E3 176.0467 1.9E4 177.0181 1.6E4 178.0264 1.7E4 179.0703 3.9E5 192.0419 9.6E4 192.4723 2.9E3 207.0662 3.4E4 208.8910 2.6E3 END IONS BEGIN IONS FEATURE_ID=360 PEPMASS=304.1184 SCANS=360 RTINSECONDS=442.712 CHARGE=1+ MSLEVEL=2 MERGED_STATS=7 / 13 (6 removed due to low quality, 0 removed due to low cosine). 48.4502 2.2E3 50.0159 2.5E3 51.0233 3.0E3 51.7657 5.3E4 52.7576 5.0E3 52.9206 3.1E3 53.3639 2.6E3 55.0180 1.2E4 55.9199 2.1E3 60.2277 2.4E3 60.4778 2.4E3 60.5609 2.3E3 60.9109 2.7E3 64.2280 2.6E3 65.0385 1.1E5 71.1446 2.5E3 71.5701 3.7E3 71.9835 2.2E3 75.0232 2.5E3 75.1849 3.2E3 76.0314 3.8E4 76.5775 4.7E3 77.0385 4.9E4 77.6285 2.3E3 80.0620 8.2E3 82.2669 2.6E3 87.8484 2.8E3 87.9430 2.3E3 88.3873 3.3E3 88.4913 2.6E3 89.0387 7.2E4 90.3075 2.1E3 91.0321 2.6E3 91.0542 3.4E6 91.0651 1.0E4 92.4382 2.4E3 95.0489 2.2E4 98.0599 4.0E5 99.7293 2.4E3 101.0387 3.0E4 101.8845 2.4E3 103.0540 1.5E5 103.9829 5.0E3 104.0257 1.7E4 105.0336 4.5E4 105.0445 3.1E3 107.0124 2.7E3 107.0493 2.5E4 108.0568 2.3E4 108.7783 6.1E3 109.0650 5.7E3 111.6175 2.5E3 117.0333 3.7E4 118.0414 4.9E4 119.0292 4.3E4 119.0351 2.1E4 119.0492 1.1E7 119.0575 6.6E4 119.0675 1.3E5 119.0804 3.6E3 120.0524 3.0E4 121.0286 2.7E4 129.0334 1.0E5 129.0438 1.7E4 129.7225 2.2E3 131.0490 1.3E5 132.0205 1.7E5 133.0283 9.9E4 135.0440 6.6E4 136.0521 7.4E4 137.0596 3.5E3 142.3279 2.3E3 145.0283 1.3E5 146.0362 4.7E4 147.0169 3.0E4 147.0438 1.4E7 147.0550 7.9E4 147.0716 9.7E4 148.0477 5.7E4 148.2290 2.7E3 149.0232 1.2E5 149.0598 2.3E4 149.1314 2.4E3 151.0749 4.6E3 155.3340 2.4E3 156.6008 3.3E3 157.0293 1.1E4 157.0395 1.3E6 157.0520 2.4E3 157.0552 3.1E3 160.0156 5.3E4 161.0589 7.8E3 162.0308 4.7E4 163.0391 3.1E4 164.0467 2.3E5 171.6096 2.6E3 172.5596 3.9E3 173.0227 5.9E3 173.5257 1.4E4 173.5362 6.6E4 174.0314 5.5E4 175.0027 1.4E5 175.0389 3.1E7 175.0531 1.4E5 175.0673 3.0E4 175.0746 2.1E5 175.0851 3.2E4 175.0944 1.8E4 176.0434 1.7E5 177.0546 6.9E4 178.0264 8.9E3 178.0625 9.7E3 179.0527 1.0E4 179.0703 9.1E5 180.8885 1.6E4 189.0549 7.0E3 190.8732 3.3E3 191.0339 9.5E3 192.0417 2.0E5 193.0493 1.7E4 203.6704 2.5E3 207.0191 5.5E4 207.0652 1.5E7 207.1108 7.5E4 207.1237 8.9E3 208.0687 1.1E5 208.8831 1.4E5 226.8938 1.1E5 236.1910 2.5E3 239.3767 3.6E3 244.1490 2.3E3 276.1185 1.5E4 281.1500 2.5E3 305.3842 2.7E3 311.1550 2.5E3 END IONS BEGIN IONS FEATURE_ID=361 PEPMASS=325.1441 SCANS=361 RTINSECONDS=445.35 CHARGE=1+ MSLEVEL=2 MERGED_STATS=9 / 9 (0 removed due to low quality, 0 removed due to low cosine). 49.6554 2.6E3 49.9412 2.4E3 50.0750 2.0E3 51.2698 2.2E3 51.7231 2.4E3 54.3679 2.2E3 56.1825 3.2E3 58.6506 2.2E3 59.0006 2.2E3 59.9179 2.2E3 67.0361 2.5E3 67.9456 2.3E3 67.9844 2.4E3 72.3683 2.9E3 72.8744 2.7E3 74.8398 2.4E3 77.4731 2.3E3 81.0441 2.9E3 81.1113 2.2E3 86.2786 2.5E3 86.4911 2.4E3 89.0701 2.2E3 90.8117 2.1E3 91.0539 2.7E3 94.2389 2.1E3 95.2583 2.1E3 98.3006 2.4E3 98.9417 2.2E3 100.3262 2.4E3 104.9412 2.3E3 105.0695 2.5E4 108.0577 2.5E3 109.3844 2.7E3 114.6588 2.4E3 125.4742 2.3E3 127.9121 2.5E3 127.9819 2.8E3 129.0694 5.2E4 129.6219 2.4E3 133.0646 3.2E4 135.0438 8.4E3 136.0516 5.8E4 137.0594 1.5E4 145.4498 2.7E3 147.6365 2.7E3 148.4645 2.5E3 149.6872 4.4E3 149.6971 3.3E3 149.7074 3.0E3 151.0751 3.8E5 151.0888 2.7E3 155.0489 3.3E4 156.0570 2.8E3 158.2028 2.4E3 159.0803 6.4E4 161.0596 3.2E4 163.0754 1.0E4 167.4079 2.3E3 173.5291 1.0E5 173.5413 1.8E4 175.0746 2.5E3 187.0753 1.2E5 188.4244 2.6E3 203.0858 7.1E3 204.6281 2.3E3 218.0737 1.8E4 219.0805 2.2E4 221.0957 8.1E3 231.0803 3.5E3 232.0915 3.0E3 233.0961 5.0E4 234.1040 1.3E5 235.0758 1.4E4 238.2869 2.2E3 242.9659 2.5E3 246.0652 2.4E3 247.0757 1.3E4 249.0910 1.1E4 250.0986 4.2E4 251.1066 6.5E3 256.0941 2.7E3 260.0826 2.7E3 261.0916 4.2E4 262.0989 9.9E4 263.0695 6.1E3 263.1060 5.7E3 263.6810 2.6E3 265.0894 3.9E3 265.1224 3.2E5 265.1516 4.4E3 267.1023 9.4E3 272.1324 2.4E3 278.0948 4.1E4 279.1019 9.1E4 293.1180 6.3E4 294.1258 7.8E4 295.0973 4.4E4 296.9040 2.6E3 303.9229 2.3E3 308.9879 2.7E3 309.1110 7.3E3 310.1201 3.6E4 311.5187 2.2E3 312.3401 2.4E3 312.3866 2.7E3 318.6327 2.4E3 325.1438 2.2E4 333.1533 2.3E3 END IONS BEGIN IONS FEATURE_ID=362 PEPMASS=355.1545 SCANS=362 RTINSECONDS=445.399 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 6 (2 removed due to low quality, 0 removed due to low cosine). 54.0528 2.3E3 55.0177 4.5E3 55.3256 2.9E3 57.1246 2.4E3 59.2563 2.2E3 59.5005 2.3E3 60.7846 2.3E3 70.0648 3.5E3 72.0805 2.8E3 75.0439 3.6E3 76.2580 2.8E3 79.0541 1.3E4 80.9572 2.3E3 82.1307 2.2E3 82.9382 2.3E3 83.5640 2.5E3 90.0460 2.6E3 90.7316 2.4E3 91.0540 6.4E4 92.9990 2.5E3 93.0697 4.6E3 95.0491 2.3E3 103.0542 9.2E3 104.0620 5.1E3 105.0336 2.4E3 105.0697 1.3E5 106.0414 2.8E3 107.0489 7.8E4 108.0567 2.8E4 109.0643 4.4E3 110.7226 2.2E3 114.0775 2.3E3 115.0541 5.0E4 117.0697 2.2E4 118.0412 4.6E3 119.0853 6.5E4 121.0645 2.7E4 123.0803 8.3E3 124.0519 6.3E3 125.0602 2.9E3 125.1643 2.4E3 126.2872 2.4E3 127.5179 2.1E3 128.0621 1.4E4 129.0696 9.6E4 131.0489 3.2E4 131.0856 8.0E3 132.0567 3.5E4 132.9091 2.4E3 133.0646 1.7E5 135.0438 4.5E4 136.0396 2.6E3 136.0517 2.8E5 136.0641 4.3E3 137.0246 2.5E3 137.0596 4.4E4 139.0756 9.5E3 141.0692 8.3E3 143.0491 1.5E4 143.0604 1.2E4 144.0569 2.9E3 145.0647 3.3E4 146.0718 2.8E3 147.0801 1.1E5 149.0593 2.3E3 149.6331 2.3E3 151.0473 4.1E3 151.0751 2.6E6 151.0868 1.3E4 151.1032 1.0E4 153.2157 2.7E3 155.0488 4.2E4 156.0576 2.6E3 157.0644 2.7E4 159.0803 1.2E5 160.0516 1.2E5 161.0595 2.3E5 161.0952 8.4E3 162.0677 1.9E4 163.0752 3.4E4 165.0908 1.8E4 167.0494 2.7E3 168.0574 6.8E3 169.0646 1.2E4 171.0800 3.7E4 172.0518 4.6E4 173.5206 4.7E3 173.5359 5.6E4 174.0678 7.4E3 175.0753 8.2E5 175.0916 7.3E3 176.0834 1.9E4 176.2462 2.4E3 177.0907 1.5E4 180.5222 2.5E3 181.0638 3.7E3 181.0858 1.5E4 184.0521 2.1E4 184.4079 2.4E3 185.0590 1.8E4 187.0558 3.8E3 187.0752 2.8E5 187.0945 2.3E3 189.0906 4.0E4 190.0783 2.7E3 193.0853 6.9E3 199.0752 1.8E5 201.0905 1.4E4 201.4819 2.4E3 202.0790 5.9E3 203.0854 1.9E4 205.1010 1.8E4 207.0810 6.5E3 214.8740 8.4E3 215.0857 1.8E4 218.0728 2.7E4 218.8684 5.6E3 219.0799 3.1E4 220.0883 2.6E3 221.0958 8.2E3 230.0723 5.7E3 231.0800 4.1E4 232.0877 1.3E4 233.0959 9.9E4 234.1038 1.4E5 235.0757 2.1E4 235.1108 9.5E3 243.0791 3.6E3 244.0884 6.6E3 245.0957 3.5E4 246.0685 1.7E4 246.1035 6.9E4 247.0472 2.8E3 247.0752 3.8E4 247.1127 6.5E3 248.0821 2.9E3 249.0910 2.3E4 250.0986 6.2E4 251.1066 1.2E4 256.0886 2.7E3 257.0915 2.5E3 259.0746 2.4E4 260.0837 1.2E4 261.0908 1.0E5 262.0984 1.8E5 263.0717 1.6E4 263.1064 5.9E4 264.1133 3.6E3 265.0891 3.5E3 265.1219 5.5E5 265.1558 1.2E4 267.1018 1.4E4 273.0912 3.3E4 274.0987 6.9E4 275.0715 1.4E4 275.1066 7.5E4 276.0767 3.1E3 276.1154 3.3E3 277.0891 1.8E4 277.1222 7.8E4 278.0937 7.0E4 278.1293 1.7E4 279.1015 9.3E4 281.1174 1.6E4 282.0909 6.3E3 289.0866 1.3E4 290.0941 4.0E4 290.8928 2.8E3 291.1016 1.8E5 292.1077 7.2E3 293.1172 1.3E5 294.1249 1.4E5 295.0964 5.9E4 296.1028 2.7E3 305.1170 7.1E4 306.1248 1.3E5 307.0963 3.6E4 308.9004 4.2E4 309.1114 1.6E4 309.1485 1.1E4 310.1197 6.6E4 314.1125 2.6E3 317.3673 3.0E3 321.1113 2.6E3 322.1191 2.3E4 323.1318 3.1E3 324.1355 4.9E3 325.1434 5.1E4 328.0218 2.8E3 364.2522 2.6E3 END IONS BEGIN IONS FEATURE_ID=363 PEPMASS=271.0604 SCANS=363 RTINSECONDS=453.315 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 49.4632 2.5E3 51.3722 2.5E3 67.0174 7.0E3 68.9971 6.2E3 71.1266 2.1E3 82.6472 2.6E3 84.8868 2.4E3 85.6994 2.2E3 87.2548 2.4E3 94.0591 2.4E3 100.6661 2.2E3 119.0487 3.8E4 121.0280 1.0E4 126.9676 2.4E3 134.4333 2.3E3 145.0283 7.4E3 153.0058 3.4E3 153.0177 9.2E4 160.0820 2.4E3 163.0388 4.6E3 171.0285 1.9E4 173.5236 1.2E4 173.5405 2.2E4 187.0388 2.6E3 200.1190 3.1E3 224.9051 2.6E3 225.0544 5.8E3 243.0645 3.1E3 269.7808 2.5E3 271.0252 4.6E3 271.0600 1.6E6 271.1286 7.1E3 END IONS BEGIN IONS FEATURE_ID=364 PEPMASS=292.1550 SCANS=364 RTINSECONDS=454.247 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 5 (0 removed due to low quality, 0 removed due to low cosine). 49.4264 2.2E3 50.5584 2.5E3 51.6664 2.3E3 51.7672 2.7E3 54.2156 2.3E3 56.3775 2.1E3 56.7684 2.3E3 58.8050 2.5E3 59.6924 2.3E3 60.1001 2.1E3 60.7323 2.5E3 61.1228 2.7E3 66.1976 2.7E3 67.0541 2.4E3 67.8543 2.4E3 69.0697 2.1E5 70.0650 5.4E3 74.5719 2.5E3 79.8014 2.2E3 84.0806 5.2E4 85.0619 2.1E3 85.3982 2.4E3 86.0903 3.5E3 86.0962 5.4E5 86.1026 3.8E3 88.1818 2.3E3 91.0541 1.7E5 103.0537 6.9E3 105.2605 2.2E3 105.3254 2.1E3 112.0755 1.8E5 112.6572 2.3E3 114.1111 2.6E3 119.0390 4.9E3 119.0491 7.2E5 119.0563 3.1E3 119.0592 7.5E3 125.2400 2.9E3 131.0486 4.2E3 132.0208 2.7E3 133.0292 2.6E3 136.0066 2.5E3 140.1960 2.5E3 141.7226 2.3E3 147.0439 9.6E5 149.0591 2.6E3 151.5681 2.7E3 153.1555 2.4E3 154.5279 2.5E3 157.0397 8.3E4 164.0467 7.1E3 167.0699 6.9E3 173.5254 1.3E4 173.5360 5.4E4 175.0390 3.0E6 175.0742 9.4E3 176.0478 2.8E3 179.0701 4.0E4 180.1549 2.3E3 192.0420 6.2E4 204.0280 2.7E3 207.0197 3.1E3 207.0653 2.5E6 207.1106 3.7E3 222.1037 2.5E3 251.2592 2.4E3 280.4131 2.4E3 282.5216 2.5E3 292.0713 8.0E3 292.1542 1.0E4 END IONS BEGIN IONS FEATURE_ID=365 PEPMASS=262.1441 SCANS=365 RTINSECONDS=458.546 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 4 (1 removed due to low quality, 0 removed due to low cosine). 45.1596 2.2E3 47.8606 2.2E3 49.6561 2.4E3 55.0433 2.2E3 56.6231 2.2E3 56.9639 2.3E3 58.3066 2.4E3 59.6155 2.3E3 61.3040 2.8E3 61.3382 2.6E3 61.9591 2.3E3 67.8880 2.1E3 69.0696 1.1E5 69.7788 2.4E3 70.0649 4.4E3 72.9954 2.5E3 84.0805 3.0E4 86.0961 1.5E5 89.0384 1.4E4 100.8866 2.6E3 106.2384 2.3E3 112.0754 1.1E5 114.3535 2.4E3 117.0333 7.4E4 119.5998 2.2E3 135.0441 5.7E3 138.4687 2.3E3 145.0282 7.0E5 145.0393 7.6E3 149.0596 3.6E4 149.2230 2.4E3 150.2850 2.5E3 153.4618 2.4E3 163.0388 9.5E3 173.5266 2.9E4 173.5426 9.0E3 174.7217 2.8E3 177.0548 1.1E6 178.4462 2.3E3 186.0553 5.3E3 186.6136 2.4E3 189.8034 2.7E3 191.1036 2.3E3 262.1442 6.3E4 END IONS BEGIN IONS FEATURE_ID=366 PEPMASS=341.1389 SCANS=366 RTINSECONDS=459.707 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 55.0537 2.5E3 56.2096 2.1E3 62.4060 2.2E3 65.7784 2.6E3 71.0489 3.2E4 72.5176 2.4E3 77.5930 2.3E3 79.0545 2.3E3 81.0701 3.1E3 82.5559 2.2E3 91.0539 3.8E3 94.0413 2.9E3 94.3678 2.3E3 99.6931 2.4E3 107.0496 2.9E3 109.0647 1.4E4 119.7133 2.6E3 122.0362 1.4E4 122.6928 2.4E3 123.0432 2.9E3 125.0590 8.8E3 129.0697 3.0E4 131.0491 1.3E4 131.0856 2.6E3 131.8613 2.6E3 133.0282 4.6E4 137.0595 6.5E5 137.0695 2.8E3 143.0491 1.2E4 143.0860 4.1E3 144.0571 7.2E3 145.0651 5.6E3 149.0595 2.6E4 151.0385 1.3E4 151.0752 5.2E4 157.0645 4.3E4 160.0519 1.8E4 161.0598 1.7E4 161.0958 2.9E3 163.0757 1.8E4 165.0546 3.0E4 169.3563 2.7E3 172.0523 7.1E3 173.5314 7.3E4 174.0676 5.3E4 175.0754 1.1E5 176.0831 6.4E3 177.0547 3.9E4 177.0912 1.6E4 178.1992 2.4E3 179.0703 2.4E4 183.2585 2.7E3 187.0753 3.2E5 187.0950 4.3E3 188.0831 1.1E4 189.0909 9.7E4 191.0687 3.1E3 196.0529 3.5E3 199.0753 3.2E4 203.0856 5.7E4 205.0859 8.5E3 211.0753 1.2E5 211.0961 3.6E3 212.0828 3.7E3 213.0896 2.6E3 217.0860 7.4E4 219.0805 4.1E4 220.0888 8.8E3 221.0964 3.9E3 225.0915 7.6E3 227.0702 2.4E4 228.0781 8.1E3 231.0804 1.3E5 232.0885 2.0E4 233.0956 8.6E3 237.0905 5.9E3 239.0701 1.3E5 239.2848 2.3E3 240.0780 9.4E4 241.0862 3.0E4 243.1026 1.3E4 245.0980 3.8E3 247.0756 4.7E4 248.0830 1.2E5 249.0906 1.7E4 251.1062 4.4E4 253.0876 3.0E3 253.1236 6.9E3 254.0936 3.8E3 255.0648 1.2E5 256.0727 9.5E4 259.0752 5.4E4 260.0830 3.3E4 261.0899 2.6E4 262.0976 6.5E3 263.0749 2.4E3 263.1064 1.9E5 263.9187 2.5E3 264.0778 2.7E4 265.0858 3.1E4 268.0734 1.6E4 269.0814 4.3E3 270.0549 4.4E3 270.0885 4.0E5 270.1230 3.1E3 271.0636 3.3E3 271.0964 1.9E5 276.0783 1.4E5 277.0861 5.5E4 279.1019 1.1E5 280.1100 2.3E4 281.0818 1.5E4 281.1168 8.9E3 282.0888 3.5E3 283.0966 1.1E5 283.1285 4.1E3 290.0931 9.1E3 291.1017 3.6E5 292.1092 5.3E4 293.0811 6.5E4 294.0886 1.2E4 295.0976 8.7E3 296.1047 8.0E4 297.1120 2.2E4 305.1161 2.2E4 307.0970 7.1E3 308.1041 7.6E4 311.1282 1.6E4 323.1275 4.6E4 342.3858 2.4E3 END IONS BEGIN IONS FEATURE_ID=367 PEPMASS=326.1006 SCANS=367 RTINSECONDS=461.69 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 6 (0 removed due to low quality, 0 removed due to low cosine). 49.6342 2.9E3 52.5462 2.3E3 52.5946 2.5E3 53.3046 2.1E3 53.7681 2.5E3 54.8921 2.4E3 56.3631 3.0E3 57.2522 2.1E3 58.8825 2.2E3 59.3613 2.2E3 60.0240 2.4E3 60.6071 2.5E3 63.7603 2.4E3 66.1048 2.6E3 67.3697 2.3E3 67.8808 2.1E3 70.4414 2.4E3 76.3572 2.3E3 86.0962 4.1E3 90.3740 2.5E3 91.0542 3.6E3 96.3688 2.9E3 118.2078 2.4E3 120.1182 2.3E3 120.8873 2.6E3 122.8808 2.2E3 125.2210 2.4E3 126.8323 2.6E3 131.0492 3.8E3 132.0515 6.2E3 133.0636 2.7E3 134.0686 6.8E3 135.0442 1.6E4 136.0478 4.7E3 137.0596 6.3E3 138.0624 3.0E3 138.0821 2.7E3 148.5722 2.4E3 149.6880 8.9E3 164.9702 2.2E3 173.5237 2.5E4 173.5380 5.8E4 174.8524 2.4E3 178.7276 2.5E3 198.7485 3.0E3 233.8984 6.5E3 236.6215 2.2E3 238.8760 2.6E3 262.0975 2.5E3 263.6006 3.2E3 310.7369 2.9E3 313.5652 2.5E3 326.1016 2.9E3 END IONS BEGIN IONS FEATURE_ID=368 PEPMASS=207.0656 SCANS=368 RTINSECONDS=461.761 CHARGE=1+ MSLEVEL=2 MERGED_STATS=8 / 10 (2 removed due to low quality, 0 removed due to low cosine). 41.0834 2.6E3 41.6070 2.2E3 42.7031 2.2E3 42.8012 2.3E3 43.0178 5.3E3 43.4020 2.7E3 44.4629 2.4E3 44.9298 2.4E3 45.0334 1.2E4 45.4263 2.5E3 45.5921 2.1E3 46.8451 2.6E3 47.1693 2.5E3 48.9755 2.3E3 52.2439 2.4E3 52.7167 2.4E3 54.9151 2.3E3 55.0177 2.5E3 55.0543 2.1E3 57.9347 1.5E4 58.0443 2.2E3 58.3540 2.6E3 60.8936 2.8E3 62.3356 2.4E3 63.5480 2.3E3 65.0383 8.9E4 69.8656 2.7E3 72.1792 2.1E3 73.0277 3.4E3 74.9377 5.6E3 76.0306 3.5E4 77.0385 2.4E3 78.0459 5.1E3 79.0541 1.6E4 80.0618 1.8E4 83.0348 2.3E3 83.0648 2.2E3 83.3936 2.7E3 84.9454 2.1E4 87.1358 2.6E3 89.0384 5.8E4 89.0474 2.3E3 90.0462 4.0E4 91.0540 9.9E5 91.0608 5.7E3 91.0638 3.3E3 93.0332 5.5E3 94.0415 7.3E3 94.3595 2.5E3 95.0487 1.8E4 95.0851 5.8E3 95.5979 2.5E3 97.1903 2.2E3 97.2974 2.2E3 97.9539 3.7E3 98.8623 2.3E3 98.9613 3.6E4 101.0376 2.7E3 102.2010 2.7E3 102.9560 3.9E4 103.0539 1.3E4 104.0253 1.1E5 105.0330 1.0E4 106.0416 2.4E3 107.0125 5.5E3 107.0489 2.4E4 108.0567 3.5E4 108.8164 2.2E3 114.9702 9.1E3 115.1858 2.4E3 115.9551 1.7E4 115.9638 6.7E5 116.8122 2.4E3 116.9646 2.8E3 116.9715 2.7E5 117.0333 3.1E4 118.0410 1.2E5 119.0393 1.2E4 119.0489 7.1E5 119.0591 6.6E3 121.0281 8.6E4 121.0645 1.8E4 122.0360 5.8E4 126.9673 6.1E3 129.0335 2.0E4 129.9253 2.5E3 130.0414 3.5E3 131.7376 2.4E3 132.0203 2.2E5 133.0282 3.4E4 133.9746 5.8E4 134.0359 3.1E4 135.0439 9.5E4 136.0516 8.9E4 137.9872 2.5E3 145.0281 4.8E4 146.0360 1.4E5 146.3251 2.4E3 147.0438 5.9E5 147.0570 4.7E3 148.0516 3.5E4 149.0231 1.9E5 150.0309 5.7E4 150.6754 2.3E3 151.0751 2.8E4 155.9968 1.7E4 157.0396 2.6E4 158.4371 2.8E3 160.0153 2.4E5 162.0310 1.1E5 163.0388 6.6E4 164.0466 1.9E5 173.5287 6.7E4 173.5415 2.2E4 174.0312 5.1E4 174.0483 2.7E3 175.0390 1.3E5 176.0473 6.4E3 177.0182 7.8E3 178.0259 7.2E4 179.0702 1.1E5 182.0338 2.4E3 185.3900 2.6E3 192.0416 4.5E4 207.0652 6.3E3 207.1392 2.6E3 213.8795 2.4E3 216.4771 2.5E3 END IONS BEGIN IONS FEATURE_ID=369 PEPMASS=304.1186 SCANS=369 RTINSECONDS=461.932 CHARGE=1+ MSLEVEL=2 MERGED_STATS=7 / 9 (2 removed due to low quality, 0 removed due to low cosine). 48.6330 2.3E3 48.9736 2.2E3 51.0326 2.3E3 52.9779 2.5E3 53.2022 2.5E3 53.8098 2.3E3 54.2511 2.0E3 54.7943 2.3E3 55.0705 2.3E3 55.5773 2.3E3 57.1463 2.1E3 57.4336 2.4E3 60.2156 2.6E3 65.0388 2.6E3 65.3730 2.9E3 65.5393 2.2E3 65.7920 2.2E3 67.8124 2.5E3 69.4741 2.2E3 70.0338 2.4E3 70.6001 2.7E3 70.8153 2.1E3 70.8819 2.7E3 73.2773 2.1E3 74.4616 2.3E3 76.7121 2.8E3 77.0388 2.6E3 77.3720 2.3E3 79.5244 2.3E3 80.4773 2.7E3 80.8556 2.8E3 85.6346 2.3E3 85.7099 2.5E3 88.2795 2.5E3 88.4876 2.5E3 90.0462 2.2E3 90.7078 2.5E3 91.0072 2.4E3 91.0540 3.6E5 92.7396 2.5E3 94.0407 2.9E3 95.0493 2.5E3 97.9611 2.3E3 98.0598 1.8E5 101.6927 2.3E3 101.7305 2.3E3 103.0542 1.8E4 103.8009 2.3E3 104.0253 9.9E3 105.5568 2.2E3 106.4819 2.4E3 107.0126 2.7E3 108.7093 2.4E3 117.0334 5.7E3 118.0411 5.9E3 118.0810 2.6E3 119.0393 9.6E3 119.0489 9.8E5 119.0563 3.7E3 119.0592 2.3E4 121.0283 1.7E4 122.0363 2.5E3 124.8759 2.3E3 129.0335 1.6E4 132.0205 5.0E4 132.7117 2.1E3 133.0284 4.2E4 133.0650 3.2E3 134.0365 5.7E3 135.0442 4.3E3 136.0521 6.0E3 140.1956 2.4E3 144.5055 2.6E3 145.0283 6.8E4 145.5869 2.5E3 146.0361 2.7E4 147.0438 1.5E6 147.0547 2.4E3 148.0517 2.2E4 149.0236 2.4E4 149.0593 7.0E3 150.0311 3.6E3 151.0752 4.4E4 157.0395 7.2E4 157.7851 2.4E3 160.0153 3.2E5 161.0233 1.8E4 162.0309 6.9E4 163.0394 1.0E4 164.0465 1.1E5 164.8164 2.8E3 173.5205 1.3E4 173.5352 1.0E5 174.0311 1.3E4 175.0389 4.2E6 175.0530 1.6E4 175.0741 1.3E4 176.0464 4.2E4 177.0547 7.6E3 178.0259 1.0E5 179.0526 3.5E3 179.0702 4.6E5 180.8882 4.2E4 181.1928 2.3E3 184.0505 2.9E3 190.8729 6.7E3 192.0415 2.1E5 193.0494 1.5E5 201.2515 2.4E3 202.1462 2.6E3 204.2671 2.5E3 207.0651 2.7E6 208.8828 1.9E5 223.9633 2.4E3 226.8935 1.4E5 236.1299 2.4E3 239.4833 2.3E3 244.9993 2.3E3 250.6964 2.6E3 295.0185 2.7E3 END IONS BEGIN IONS FEATURE_ID=370 PEPMASS=817.3925 SCANS=370 RTINSECONDS=469.618 CHARGE=1+ MSLEVEL=2 MERGED_STATS=8 / 8 (0 removed due to low quality, 0 removed due to low cosine). 72.0805 8.5E4 72.3169 2.6E3 78.2532 2.4E3 78.8165 2.0E3 78.8444 2.8E3 83.7567 2.5E3 87.5835 2.6E3 91.9558 2.4E3 94.7487 2.3E3 94.9060 2.3E3 96.6049 2.1E3 96.6998 2.1E3 97.0757 2.3E4 100.8767 2.2E3 103.2123 2.5E3 107.6285 2.4E3 115.0862 1.3E5 118.0644 9.4E3 118.4597 2.3E3 120.0062 2.4E3 120.0804 6.5E5 120.0908 5.7E3 125.0706 9.9E4 127.1812 2.6E3 132.6114 2.4E3 136.0755 2.2E4 141.1074 2.2E3 146.0597 1.6E5 157.9588 2.5E3 164.0705 3.8E4 165.0539 2.5E3 166.2442 2.4E3 172.1119 1.4E5 173.5188 5.5E3 173.5262 1.2E5 173.5397 1.0E5 173.5595 2.9E3 174.0547 3.4E3 176.5750 2.5E3 178.9335 2.2E3 181.7436 2.3E3 182.0812 4.5E4 183.7961 2.4E3 187.1227 4.6E3 210.4335 2.6E3 213.7599 3.0E3 215.1182 2.7E4 215.5921 2.3E3 216.1257 2.2E5 217.1335 1.3E5 218.3157 2.5E3 219.1492 2.1E5 222.4129 2.3E3 230.9083 2.5E3 234.6483 2.5E3 236.1071 3.4E4 238.1231 3.2E3 240.8219 2.3E3 243.1127 1.6E5 245.1279 2.6E3 247.1441 6.6E4 248.2709 2.5E3 249.3286 2.1E3 249.7784 2.4E3 258.9864 2.6E3 261.4822 2.5E3 265.0860 9.7E3 265.1333 4.4E4 270.1129 5.8E3 277.1336 3.9E4 281.4485 2.4E3 282.1130 9.5E4 288.7039 2.5E3 293.1283 1.0E5 300.7679 2.4E3 309.1236 1.2E5 321.1249 7.2E3 329.1500 6.4E4 339.1355 5.3E3 355.1292 6.6E4 372.1725 4.1E3 377.6888 2.8E3 389.5153 2.8E3 390.1815 6.8E4 391.8868 2.6E3 396.1969 5.7E3 417.1820 9.1E4 429.1810 5.2E4 433.4802 2.4E3 446.2092 4.2E3 450.0389 2.4E3 458.2078 2.9E4 465.4306 2.5E3 469.0143 2.5E3 474.2012 2.8E4 489.6938 2.4E3 496.4499 2.8E3 497.6633 2.6E3 502.1977 2.9E5 502.3789 2.6E3 543.2617 6.2E4 553.2457 2.1E4 571.2565 2.7E4 591.4986 3.7E3 670.5769 2.7E3 740.2322 2.6E3 754.6219 2.8E3 766.4645 2.6E3 END IONS BEGIN IONS FEATURE_ID=371 PEPMASS=288.1236 SCANS=371 RTINSECONDS=469.736 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 13 (8 removed due to low quality, 0 removed due to low cosine). 47.7667 9.6E4 47.7688 1.7E4 48.5363 2.2E3 53.0023 2.7E3 55.0179 1.4E4 55.7566 2.6E3 56.6864 2.1E3 57.7544 2.9E3 59.2382 2.1E3 59.9195 2.1E3 65.0387 3.1E3 68.8068 2.5E3 69.2916 2.1E3 72.8175 2.2E3 77.0392 9.0E3 78.6623 2.9E3 79.0541 1.0E5 79.3186 2.3E3 79.5113 2.4E3 89.0390 1.4E4 90.0465 1.2E4 91.0542 1.1E5 92.0620 2.0E4 93.2894 2.5E3 94.1978 3.7E3 95.0491 2.5E4 95.6789 2.5E3 98.0600 7.7E4 98.8762 3.0E3 100.3736 2.5E3 101.3351 2.8E3 102.0470 2.4E4 102.6104 2.7E3 103.0541 2.2E5 103.0615 2.3E3 105.0335 6.1E4 105.0698 3.2E5 107.0492 9.1E3 107.3987 2.9E3 110.0218 2.1E3 115.0542 3.7E4 117.0334 1.6E4 117.0701 4.4E3 118.0413 5.5E4 119.0490 1.9E5 120.0569 1.5E5 121.0649 6.6E3 127.4061 3.4E3 130.0410 2.3E4 131.0492 3.9E4 132.0455 3.3E3 132.0569 3.6E5 132.0685 8.5E3 133.0283 1.4E5 133.0647 3.5E5 135.0803 1.2E5 137.0599 7.2E3 143.0606 1.0E4 146.0363 8.7E4 147.0441 1.5E5 148.0518 1.3E6 148.0652 4.9E3 158.0365 6.9E3 159.0441 1.8E4 160.0398 2.2E3 160.0519 6.9E5 160.0667 4.5E3 161.0597 2.0E5 163.0433 4.7E4 163.0504 1.1E4 163.0753 6.0E6 163.1073 2.6E4 173.0594 1.0E4 173.5250 1.4E4 173.5309 4.7E4 173.5423 1.5E4 173.9314 2.5E3 176.0289 4.4E3 176.0470 8.0E5 176.0647 3.8E3 178.0876 3.6E3 190.9150 3.8E3 191.0178 1.5E4 191.0293 1.6E5 191.0379 7.3E4 191.0702 2.7E7 191.1019 1.0E5 191.1114 1.8E5 191.1230 6.3E4 191.1345 3.3E4 191.1455 8.9E3 192.0733 2.7E4 226.5506 2.4E3 246.1135 1.3E4 256.3578 3.4E3 287.9934 2.9E3 294.3731 2.7E3 END IONS BEGIN IONS FEATURE_ID=372 PEPMASS=333.1814 SCANS=372 RTINSECONDS=469.762 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 6 (0 removed due to low quality, 0 removed due to low cosine). 54.1663 2.1E3 56.3450 2.5E3 65.4677 2.3E3 69.4984 2.3E3 78.9769 2.3E3 87.9058 2.6E3 90.4940 2.7E3 97.1174 2.6E3 98.0600 9.2E3 100.9936 2.5E3 101.8991 2.2E3 103.0540 3.3E3 105.0696 1.4E4 108.4807 2.3E3 111.0092 2.4E3 119.0487 2.6E3 120.0567 3.4E3 129.6854 2.7E3 132.0567 6.5E3 133.0646 1.7E4 135.0806 5.8E3 135.4077 2.7E3 147.0431 4.0E3 147.5118 2.5E3 148.0514 6.2E4 153.5185 2.4E3 155.3859 2.8E3 156.6935 2.3E3 159.9850 2.6E3 160.0516 4.7E4 161.0597 1.1E4 163.0752 3.8E5 163.0898 5.2E3 173.5239 5.8E4 173.5342 4.1E4 173.5437 3.6E4 176.0467 6.5E4 191.0289 1.0E4 191.0701 6.9E6 191.0857 2.3E4 191.1017 1.1E4 191.1111 3.6E4 194.3326 2.4E3 199.2266 2.4E3 228.8761 1.2E4 230.1275 2.5E3 234.0649 2.4E3 264.8114 2.5E3 268.6578 2.4E3 273.2300 3.3E3 286.8587 2.7E3 298.4527 2.2E3 330.6624 2.9E3 END IONS BEGIN IONS FEATURE_ID=373 PEPMASS=310.1056 SCANS=373 RTINSECONDS=469.805 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 11 (7 removed due to low quality, 0 removed due to low cosine). 49.4338 2.0E3 54.9309 2.2E3 58.4139 2.3E3 73.0282 2.9E3 74.5549 2.1E3 75.7530 3.0E3 77.8686 2.9E3 79.8749 2.5E3 88.2425 2.3E3 88.7537 2.6E3 92.5560 2.4E3 93.0702 2.9E3 95.6981 2.4E3 101.3768 2.9E3 109.4398 2.5E3 112.5432 2.4E3 120.0337 2.9E3 120.0417 1.3E5 125.1018 3.0E3 144.3583 2.7E3 148.0505 2.8E3 168.8233 2.5E3 173.5260 2.0E4 173.5358 2.7E4 173.5440 7.0E3 190.5068 2.5E3 191.0701 6.1E4 199.3271 3.0E3 217.6597 2.4E3 219.8335 2.2E3 222.6232 2.2E3 228.9855 2.3E3 231.9217 2.3E3 241.1103 4.5E3 250.7983 2.3E3 250.8741 2.7E3 252.1733 2.6E3 254.2963 2.4E3 280.7161 2.6E3 302.3255 2.4E3 310.1055 9.3E4 END IONS BEGIN IONS FEATURE_ID=374 PEPMASS=597.2217 SCANS=374 RTINSECONDS=469.959 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 75.3085 2.6E3 80.3049 2.6E3 99.1469 2.4E3 101.0954 2.7E3 101.1445 2.7E3 105.6455 2.7E3 114.9495 2.2E3 120.0415 2.0E4 134.4387 2.4E3 137.1543 2.5E3 145.6323 2.6E3 149.6844 5.7E3 173.5236 2.7E3 173.5340 5.8E4 187.9825 2.8E3 191.0987 2.3E3 252.6109 2.3E3 310.0628 5.4E3 310.1050 8.7E5 314.4269 3.0E3 462.7966 2.6E3 510.0106 2.4E3 END IONS BEGIN IONS FEATURE_ID=375 PEPMASS=403.1759 SCANS=375 RTINSECONDS=473.125 CHARGE=1+ MSLEVEL=2 MERGED_STATS=7 / 7 (0 removed due to low quality, 0 removed due to low cosine). 55.0178 3.0E3 55.0538 2.8E3 55.3637 2.8E3 55.5910 2.2E3 57.1593 2.2E3 57.6603 2.4E3 63.4999 2.4E3 65.0389 2.1E3 66.8657 2.2E3 68.2745 2.2E3 70.0778 2.5E3 72.2075 2.3E3 72.9382 2.3E3 74.7943 2.6E3 79.0542 1.9E4 79.8733 2.1E3 80.0614 2.4E3 81.0334 2.0E6 81.0380 9.3E3 81.0701 2.6E3 81.8281 2.3E3 82.2027 2.2E3 84.0786 3.3E3 87.9496 2.7E3 88.6377 2.6E3 90.2100 2.2E3 91.0544 1.4E4 95.0491 1.0E4 96.1769 2.3E3 97.7270 2.5E3 103.0020 2.5E3 104.5387 2.2E3 105.0443 2.9E3 106.7701 3.1E3 107.0489 1.3E4 109.0644 6.8E3 117.0701 2.5E3 119.0141 2.6E3 121.0648 3.6E4 121.6321 2.7E3 122.0359 1.2E4 123.5267 2.2E3 123.8202 2.8E3 125.8659 2.2E3 126.1567 2.7E3 127.0393 3.1E3 129.0700 4.0E3 135.0434 2.6E3 136.0518 1.7E5 137.0596 3.5E4 138.0673 6.5E3 139.0751 8.3E4 140.2473 2.2E3 140.4349 2.3E3 143.0851 1.3E4 145.0649 1.7E4 146.0726 1.3E4 147.0803 1.7E4 147.9903 2.4E3 148.8617 2.8E3 149.0600 1.9E4 151.0604 3.9E3 151.0646 3.5E3 151.0752 1.7E6 151.0892 1.1E4 155.0700 6.8E4 157.0644 2.9E3 158.0725 2.2E4 159.0802 2.8E4 160.0889 8.4E3 161.0595 3.7E4 161.0960 2.5E5 163.0754 3.0E3 164.0465 2.7E3 165.0223 4.1E3 165.0546 3.7E6 165.0670 3.9E3 165.0882 1.8E4 167.0704 5.9E4 167.1341 2.3E3 168.1918 2.4E3 171.0805 6.1E3 172.0883 2.0E5 173.0597 1.9E4 173.5259 1.5E4 173.5344 1.1E5 173.5444 6.0E3 174.0678 4.9E4 175.0755 6.8E4 175.1121 2.8E3 175.3183 2.5E3 176.0817 3.3E3 177.0910 3.7E4 177.3208 2.3E3 179.0702 1.3E5 181.0859 3.1E3 186.0676 3.9E4 188.0830 2.0E5 189.0909 2.4E5 189.1108 4.5E3 190.0621 3.5E4 191.0702 1.6E4 191.1065 9.6E4 195.0646 3.4E3 198.0661 3.9E3 201.0910 8.7E4 202.0620 3.4E4 202.0988 1.8E4 203.0724 1.7E4 203.1066 3.9E5 204.0779 1.3E4 205.0860 2.4E5 214.0628 8.7E3 217.0613 6.7E3 217.0858 9.4E5 217.1105 1.4E4 219.1016 9.2E4 224.9516 2.3E3 229.0859 1.2E5 231.9662 2.8E3 235.0975 7.0E3 243.6152 2.4E3 247.0963 9.4E4 271.0965 1.9E4 274.7761 2.6E3 275.1068 4.0E3 277.0859 2.6E3 283.0965 1.3E4 284.1025 2.5E3 291.1014 1.5E4 292.1095 2.8E4 293.1175 3.3E4 294.1267 2.6E3 299.0915 9.1E4 303.1012 1.7E4 304.1104 8.4E3 305.1177 4.2E4 306.1247 3.3E4 307.0952 3.0E3 307.1336 2.6E3 308.1053 5.5E3 308.1413 5.5E4 309.1125 1.8E4 310.1199 1.6E4 312.1357 1.4E4 312.2518 2.5E3 313.1069 8.5E4 313.1432 3.9E3 314.1149 5.4E5 315.1194 2.9E3 318.1244 4.8E4 319.0957 1.5E4 320.1041 3.4E3 321.1127 4.2E4 322.1191 6.9E3 323.1267 2.1E4 324.1356 1.8E5 325.1051 3.2E3 325.1440 1.6E4 327.1601 7.7E3 334.1202 2.0E4 335.1275 3.6E4 336.1354 7.2E4 337.1041 1.0E4 337.1436 5.9E4 337.6057 3.1E3 339.1597 1.7E4 340.1301 8.4E4 349.1431 6.4E4 352.1295 2.3E4 354.1470 2.2E4 355.1533 4.7E4 367.1530 1.8E4 END IONS BEGIN IONS FEATURE_ID=376 PEPMASS=448.2337 SCANS=376 RTINSECONDS=473.149 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 62.2914 2.1E3 68.1861 2.3E3 81.0331 2.5E5 81.0389 4.3E3 97.4606 2.6E3 107.5782 2.6E3 107.9335 2.3E3 125.2783 2.4E3 136.0518 8.3E3 137.5106 2.1E3 138.9126 2.3E3 139.0759 3.2E3 151.0751 2.5E5 157.7810 2.6E3 161.0959 3.3E4 165.0545 3.7E5 165.0701 5.5E3 167.0702 5.1E3 172.0882 1.4E4 173.5215 9.4E3 173.5347 6.6E4 175.0758 3.8E3 179.0709 2.1E4 188.0833 1.6E4 189.0909 2.1E4 191.1068 8.3E3 201.0899 7.8E3 203.1068 7.9E4 205.0860 2.8E4 217.0860 1.2E5 217.1077 3.7E3 219.1015 3.7E4 229.0856 1.8E4 231.1733 2.4E3 235.0963 3.5E3 247.0964 3.1E4 251.3038 3.3E3 312.1368 2.9E3 313.1076 2.9E3 314.1146 5.7E4 324.1354 1.6E4 335.1293 3.7E3 336.1356 2.5E3 337.1440 4.8E3 339.1591 5.3E3 340.1340 2.5E3 349.1424 1.3E4 355.1538 2.2E4 367.1517 4.6E3 END IONS BEGIN IONS FEATURE_ID=377 PEPMASS=219.1020 SCANS=377 RTINSECONDS=475.53 CHARGE=1+ MSLEVEL=2 MERGED_STATS=10 / 10 (0 removed due to low quality, 0 removed due to low cosine). 43.0178 1.2E4 43.2266 2.3E3 44.3060 2.5E3 45.0335 5.4E3 45.7680 2.2E3 45.8230 2.1E3 47.9100 2.2E3 47.9522 2.9E3 48.0309 2.2E3 48.2129 2.4E3 48.7421 2.5E3 49.3627 2.1E3 51.0479 2.4E3 51.5590 2.7E3 52.3898 2.5E3 55.1382 2.3E3 55.9341 3.0E4 56.6835 2.5E3 56.9348 2.4E3 57.0334 2.0E4 59.7176 2.9E3 61.5548 2.3E3 61.8399 2.3E3 65.1483 2.2E3 65.4644 2.4E3 67.0541 1.5E4 71.5316 2.4E3 72.7044 2.8E3 74.0248 2.4E3 74.4648 2.4E3 80.1208 2.3E3 81.0332 1.2E4 83.2669 2.7E3 84.6706 2.2E3 85.1419 2.3E3 86.4540 2.6E3 86.6676 2.6E3 91.0539 1.6E5 92.1245 2.4E3 92.3536 2.4E3 93.0697 3.3E3 93.0942 2.3E3 94.3477 2.5E3 95.6690 2.3E3 101.2464 2.3E3 103.0544 2.6E4 105.0695 1.6E4 115.0541 1.2E5 116.0619 4.2E4 117.0696 4.4E4 119.0855 6.8E3 120.2918 2.5E3 121.1008 2.7E3 123.4537 2.5E3 124.0336 2.9E3 127.8521 2.5E3 128.0619 1.3E5 128.9506 1.1E4 129.0697 7.5E5 129.0816 3.2E3 130.0777 4.3E4 131.0490 1.1E5 131.0585 2.2E3 131.0747 7.4E3 131.0853 6.5E5 131.0966 4.3E3 133.1008 7.1E3 135.6893 3.0E3 135.9447 2.9E3 136.0849 2.3E3 137.0596 7.3E4 140.0625 3.0E3 141.0571 3.9E3 141.0697 6.6E5 142.0774 6.8E3 143.0492 2.3E4 143.0854 3.9E4 144.0569 1.0E5 145.0646 9.6E4 146.0725 8.3E4 148.0518 1.1E4 149.5484 2.7E3 149.6879 1.1E4 151.0757 6.4E3 153.0689 3.4E3 155.0612 3.5E3 155.0850 2.5E3 156.0564 7.4E3 157.0646 3.1E5 157.0789 5.2E3 158.0726 3.9E5 158.0873 4.5E3 159.0439 3.7E4 159.0804 2.5E5 159.0958 4.4E3 159.3424 2.9E3 160.0519 8.8E4 161.0596 2.2E4 161.0960 5.8E4 163.0754 2.4E4 163.9802 2.4E3 164.7654 2.8E3 168.0571 1.3E4 169.0647 2.0E5 170.0728 1.3E5 170.5052 2.6E3 171.0449 2.9E3 171.0806 1.1E4 173.0599 7.9E4 173.0963 1.0E4 173.5233 5.6E3 173.5311 1.1E5 173.5413 1.5E4 174.0498 1.4E4 174.0676 1.4E6 174.0852 1.3E4 175.0194 2.3E3 175.0756 1.3E5 181.6154 2.3E3 183.0809 5.2E3 185.0588 8.5E3 186.0676 3.5E5 187.0748 7.0E3 188.0833 8.2E4 189.0911 6.2E5 189.1108 1.1E4 191.0706 9.5E3 191.1064 5.4E3 192.5181 2.2E3 195.9437 2.7E3 201.0910 3.1E5 202.2190 3.1E3 203.1434 2.9E4 206.1606 2.3E3 206.8612 3.0E3 211.9441 2.8E3 219.1020 3.5E4 219.1742 3.7E4 END IONS BEGIN IONS FEATURE_ID=378 PEPMASS=363.1917 SCANS=378 RTINSECONDS=480.788 CHARGE=1+ MSLEVEL=2 MERGED_STATS=12 / 12 (0 removed due to low quality, 0 removed due to low cosine). 51.8203 2.2E3 52.3305 2.4E3 52.8298 2.1E3 53.9746 2.1E3 55.2682 9.3E3 55.2703 1.6E5 55.3962 2.3E3 55.5456 2.3E3 56.3397 2.1E3 56.9465 2.0E3 57.3988 2.4E3 58.7806 2.8E3 59.3167 2.4E3 59.4822 2.1E3 60.6534 2.3E3 61.9387 2.2E3 63.5308 2.2E3 63.5479 2.7E3 65.0849 2.4E3 66.8534 2.1E3 68.1353 3.0E3 71.5048 2.6E3 71.9737 2.0E3 75.3476 2.7E3 76.8605 2.5E3 77.5116 2.6E3 81.2918 2.5E3 82.4992 2.4E3 84.6129 2.7E3 85.8376 2.5E3 86.2876 2.4E3 86.4746 2.7E3 88.1579 2.2E3 88.4618 2.4E3 91.0549 2.4E3 92.1261 2.3E3 94.8200 2.5E3 95.7111 2.1E3 95.8549 2.2E3 96.8323 2.2E3 98.0543 3.2E3 98.0599 2.5E5 98.2282 2.3E3 100.6527 2.3E3 103.0540 2.6E3 105.0700 4.5E3 109.0824 2.3E3 109.4553 2.2E3 111.0495 3.5E3 115.0528 2.6E3 115.5218 2.9E3 118.0413 3.1E3 118.8621 2.3E3 119.0487 1.3E4 119.6706 2.8E3 120.4460 3.0E3 122.0493 2.5E3 127.4205 2.3E3 127.5669 2.3E3 127.7535 3.0E3 130.0412 1.9E4 130.2559 2.5E3 131.0493 8.3E3 132.0571 6.3E3 133.0305 2.2E3 133.0649 5.3E4 133.6557 2.8E3 134.8226 2.4E3 135.0444 2.4E4 138.0623 2.4E3 138.9653 2.7E3 143.8658 2.5E3 144.2828 2.8E3 145.7760 2.3E3 147.0441 1.6E5 148.0516 2.7E3 149.0598 1.1E4 150.0675 2.3E4 155.4127 2.2E3 160.0519 3.8E4 161.0596 1.0E5 162.0675 7.7E5 162.0832 8.6E3 163.0390 1.4E5 163.0752 1.1E5 165.0917 3.4E4 165.1920 2.3E3 167.0701 2.2E4 168.3163 2.2E3 169.7234 3.2E3 172.2128 2.3E3 173.5235 8.5E3 173.5328 1.2E5 173.5415 1.8E4 174.0312 6.7E4 175.0391 1.1E5 176.0470 1.4E5 177.0548 1.4E5 177.0710 2.4E3 178.0626 5.7E5 178.3077 2.7E3 178.5753 2.9E3 178.5848 2.6E3 179.1389 2.7E3 181.5943 2.6E3 188.0468 5.7E4 189.0369 8.0E3 189.0547 5.8E5 189.0721 2.9E3 190.0220 3.9E3 190.0426 4.5E3 190.0624 5.4E6 190.0795 4.2E4 191.0140 1.7E4 191.0339 9.4E5 191.0702 4.8E5 192.0413 4.4E4 193.0649 7.3E3 193.0860 4.6E6 204.9375 2.6E3 205.0497 1.9E4 206.0344 2.7E4 206.0575 2.2E6 206.0802 2.1E4 214.1625 2.7E3 215.1209 3.0E3 216.5460 2.4E3 220.9741 3.7E3 220.9877 4.2E3 221.0021 3.8E3 221.0155 3.2E4 221.0301 2.7E5 221.0406 1.6E5 221.0809 4.4E7 221.0999 2.9E5 221.1201 2.1E5 221.1319 3.0E5 221.1464 1.1E5 221.1605 1.5E4 221.1742 5.4E3 221.2185 3.0E3 226.6671 2.3E3 232.5295 2.5E3 247.1748 2.2E3 255.4262 2.7E3 270.1270 3.3E3 276.1206 4.2E3 289.6578 2.5E3 291.0976 2.3E3 296.6392 2.7E3 317.5465 2.8E3 330.8629 2.5E3 332.3331 2.6E3 332.9954 2.6E3 349.9943 2.8E3 END IONS BEGIN IONS FEATURE_ID=379 PEPMASS=356.0898 SCANS=379 RTINSECONDS=481.008 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 6 (2 removed due to low quality, 0 removed due to low cosine). 58.8133 2.3E3 60.7576 2.2E3 62.3498 2.4E3 64.3278 2.3E3 70.2050 2.7E3 73.7983 2.2E3 81.1371 2.3E3 81.6448 2.2E3 81.6874 2.4E3 90.8777 2.1E3 121.7889 2.3E3 123.1827 2.4E3 136.8218 2.7E3 142.4376 2.3E3 149.6846 4.8E3 149.6948 3.4E3 153.0936 2.5E3 158.4981 2.4E3 164.0692 2.4E3 173.5256 3.7E4 173.5400 2.5E4 195.4477 2.5E3 220.8724 2.3E3 280.2412 2.5E3 309.9010 3.9E3 312.8931 2.7E3 322.5323 2.6E3 325.5750 2.9E3 328.6613 2.4E3 END IONS BEGIN IONS FEATURE_ID=380 PEPMASS=206.0577 SCANS=380 RTINSECONDS=481.051 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 43.5453 2.5E3 43.7969 2.2E3 45.0334 8.3E3 49.5665 2.2E3 51.9975 2.6E3 52.8893 2.4E3 55.9342 3.0E3 60.3137 2.0E3 62.1796 2.1E3 63.1640 2.7E3 63.6538 2.1E3 73.0282 5.9E4 75.3369 2.1E3 77.0370 2.1E3 78.0460 4.1E3 79.0540 9.3E3 88.0752 2.5E3 91.0538 9.4E3 98.5197 2.4E3 102.0462 7.7E3 103.0540 4.2E3 104.0620 6.2E3 107.0489 4.2E4 108.2958 2.2E3 110.1237 2.3E3 117.0329 3.2E3 118.0411 5.2E3 118.9624 2.7E3 119.0491 5.2E3 120.0206 3.7E3 120.0569 4.9E3 121.0646 1.3E4 124.9601 2.4E3 130.0412 1.6E4 131.0490 1.5E4 132.0566 5.0E3 133.0280 1.5E4 135.0224 2.6E3 135.0438 4.9E4 141.5249 2.8E3 141.9778 2.4E3 145.0290 5.3E3 147.0441 7.7E3 149.0594 1.6E4 149.6801 3.1E3 149.6907 5.3E3 152.8878 2.3E3 161.2869 2.7E3 163.0388 1.2E5 173.5337 4.2E4 175.0385 2.6E3 176.0469 2.7E3 177.0544 5.1E3 178.0626 2.6E4 179.9739 2.3E3 191.0338 3.2E4 206.0564 3.9E3 206.1904 1.3E4 END IONS BEGIN IONS FEATURE_ID=381 PEPMASS=321.1420 SCANS=381 RTINSECONDS=481.051 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 52.5793 2.2E3 56.2694 2.1E3 58.5989 2.1E3 58.8263 2.2E3 60.3393 2.7E3 60.4973 2.7E3 62.6963 2.5E3 75.6257 2.4E3 76.8995 2.3E3 77.8962 2.5E3 88.3500 2.5E3 90.7642 2.5E3 98.9650 2.6E3 101.1733 2.4E3 103.6910 2.3E3 112.2681 2.3E3 162.0667 4.8E3 163.0705 1.5E4 163.4186 2.3E3 164.0417 2.3E3 165.0754 7.8E3 173.5246 1.7E4 173.5353 1.3E4 173.5435 7.8E3 178.0629 3.1E3 179.0654 8.4E3 180.0670 1.3E4 181.0706 1.0E4 181.1276 2.3E3 190.0613 2.2E4 191.0650 5.7E4 192.0373 5.1E3 192.0677 6.7E4 193.0391 1.2E4 193.0704 6.2E4 193.0865 6.9E3 194.0416 1.3E4 194.0891 4.0E4 195.0914 4.2E4 195.2741 2.3E3 196.0939 5.1E4 207.0606 1.3E4 208.0625 3.0E4 209.0656 3.6E4 221.0810 2.7E4 222.0842 8.3E4 223.0864 1.6E5 224.0890 2.4E5 244.1690 2.6E3 END IONS BEGIN IONS FEATURE_ID=382 PEPMASS=426.0667 SCANS=382 RTINSECONDS=481.051 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 55.0238 2.6E3 58.4174 2.3E3 62.3204 2.1E3 66.7496 2.3E3 67.7599 2.4E3 69.5474 2.2E3 88.3796 2.4E3 145.3866 2.9E3 161.0599 2.7E3 161.3634 2.3E3 162.0670 1.4E4 173.5254 2.4E4 173.5415 1.3E4 177.0546 2.6E3 178.0624 1.5E4 189.0547 1.1E4 190.0622 1.4E5 191.0337 2.7E4 191.0697 1.2E4 193.0858 1.0E5 205.0859 1.1E4 206.0574 4.7E4 221.0808 6.5E5 222.0836 1.2E4 249.8274 2.4E3 283.7291 2.3E3 325.1529 2.5E3 367.7258 2.6E3 END IONS BEGIN IONS FEATURE_ID=383 PEPMASS=435.0615 SCANS=383 RTINSECONDS=481.051 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 57.1918 2.4E3 73.2208 2.5E3 76.8119 2.1E3 81.0336 3.9E3 84.0649 2.5E3 94.3244 2.4E3 98.8773 2.4E3 129.2353 2.3E3 145.5167 2.3E3 151.2013 2.4E3 162.0673 1.3E4 173.5239 1.4E4 173.5365 2.5E4 173.5424 5.4E3 175.0389 2.7E3 177.0549 1.2E4 178.0627 6.1E3 179.0706 7.4E3 189.0546 6.4E3 190.0625 8.4E4 191.0339 1.6E4 191.0690 2.0E4 192.0782 1.8E4 193.0860 6.1E4 194.0935 3.0E4 201.8911 2.4E3 205.0497 9.3E4 206.0578 2.9E4 207.0641 2.8E3 220.0739 2.5E4 221.0810 1.4E6 222.0856 8.7E4 234.0756 1.3E4 234.9964 2.2E3 236.0681 3.2E4 246.1118 6.5E3 246.5889 2.5E3 250.9998 7.4E3 253.4320 2.3E3 258.1121 2.7E3 260.1287 9.3E3 261.1360 3.7E3 272.1283 7.6E4 274.0726 2.3E3 274.1075 3.7E5 274.1424 3.2E3 278.9955 1.7E4 286.1079 1.1E4 288.1227 2.8E3 289.0937 1.0E4 289.1310 3.5E5 302.1025 1.8E5 315.0192 2.8E3 317.0823 1.4E4 317.1259 4.2E5 317.1577 3.1E3 330.0425 1.8E4 333.0322 3.1E3 369.5236 2.8E3 396.4172 2.7E3 END IONS BEGIN IONS FEATURE_ID=384 PEPMASS=657.2424 SCANS=384 RTINSECONDS=481.071 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 10 (4 removed due to low quality, 0 removed due to low cosine). 66.5230 4.9E3 66.5434 2.9E3 68.3956 2.9E3 68.7513 2.7E3 82.1912 2.6E3 83.6800 2.4E3 85.0254 9.9E3 85.0294 4.5E4 86.6715 2.4E3 87.8326 2.5E3 92.4336 2.3E3 93.0154 2.4E3 93.6540 2.4E3 95.3612 2.3E3 96.2362 5.8E3 108.8827 2.8E3 117.9991 2.5E3 120.0325 5.4E3 120.0414 3.1E5 120.6659 2.4E3 121.3445 2.9E3 147.3396 5.0E3 151.0733 3.1E3 158.8676 2.8E3 173.5170 5.1E3 173.5346 1.5E5 173.5480 1.2E4 192.3146 2.3E3 216.2906 3.3E3 219.4858 2.6E3 221.0813 5.0E4 232.4030 2.7E3 236.4835 2.7E3 240.4857 4.9E3 242.0778 4.5E3 243.0630 4.2E4 244.8969 3.5E3 306.6900 2.3E3 318.4491 2.3E3 325.0921 1.1E5 327.8982 3.3E3 335.0405 2.3E3 339.9919 1.0E4 340.0187 1.0E5 340.0382 2.9E4 340.1151 1.6E7 340.1897 6.0E4 340.2125 9.6E4 340.2397 1.6E4 483.8683 2.7E3 504.1042 2.4E3 604.2342 2.4E3 612.3163 2.8E3 636.7711 2.4E3 END IONS BEGIN IONS FEATURE_ID=385 PEPMASS=317.1267 SCANS=385 RTINSECONDS=481.085 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 5 (1 removed due to low quality, 0 removed due to low cosine). 49.0768 2.2E3 52.8525 2.5E3 53.0386 1.2E4 56.5067 2.1E3 58.7247 2.3E3 64.2920 2.1E3 72.9926 2.3E3 75.2511 2.4E3 81.0335 5.6E4 81.0381 3.0E3 82.4304 2.3E3 83.9783 2.2E3 91.0540 8.2E3 93.2076 2.5E3 96.0439 2.7E3 98.0600 5.2E4 98.3370 2.4E3 105.9300 2.3E3 111.4918 2.6E3 113.9165 2.2E3 117.0333 1.5E4 118.0418 3.1E3 118.0655 3.1E3 119.0490 1.2E4 125.2784 2.2E3 129.6453 2.7E3 131.0491 3.0E3 132.0569 2.9E3 133.0649 1.2E4 135.0435 5.7E3 145.0283 1.1E4 146.0599 3.6E4 147.0440 4.6E4 148.0526 3.2E3 149.0595 3.9E4 150.0667 2.9E3 151.0752 9.4E3 153.6581 2.3E3 157.5151 2.6E3 159.8370 2.5E3 161.0595 2.7E4 162.0676 1.4E5 162.1171 2.3E3 163.0390 3.4E4 163.0753 2.7E4 166.0442 2.7E3 167.0716 3.2E3 173.5208 5.3E3 173.5294 4.1E4 173.5401 2.2E4 174.0311 1.1E4 174.0551 3.1E4 175.0391 3.8E4 176.0469 2.4E4 176.0714 3.6E3 177.0548 2.5E5 178.0626 1.1E5 178.0866 2.5E4 178.7818 2.6E3 179.0705 6.8E4 189.0547 8.2E4 190.0624 7.5E5 191.0339 1.4E5 191.0703 8.1E4 192.0423 3.9E3 192.0782 5.0E4 193.0653 1.1E4 193.0860 5.9E5 193.1067 1.1E4 194.0940 3.8E4 195.0656 5.0E4 202.3645 2.7E3 203.2681 2.2E3 205.0495 2.8E5 206.0575 2.8E5 206.0798 1.6E4 207.0651 2.8E3 214.0866 1.8E4 217.0863 3.3E3 220.0725 3.4E3 221.0322 4.1E3 221.0809 2.8E6 221.1326 3.2E3 222.0756 8.8E3 229.8398 2.8E3 230.2410 3.4E3 231.0893 1.4E4 234.0760 6.9E4 236.0673 2.4E4 239.0942 4.7E3 242.0813 2.6E4 244.0967 3.2E3 246.1123 5.5E4 253.2927 2.4E3 256.0964 8.2E3 258.1113 7.9E3 259.0846 2.9E3 270.0766 6.4E3 271.0864 2.8E3 272.1283 6.0E4 274.0725 1.0E4 274.1075 1.1E6 274.1418 4.9E3 286.1077 1.8E4 288.1251 3.2E3 289.1312 5.1E4 302.1025 6.4E4 317.1243 7.5E3 END IONS BEGIN IONS FEATURE_ID=386 PEPMASS=221.0811 SCANS=386 RTINSECONDS=481.128 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 8 (4 removed due to low quality, 0 removed due to low cosine). 44.0300 3.8E4 44.9930 2.7E4 45.3541 2.7E4 47.2526 3.8E4 53.0020 1.6E5 55.0177 1.4E5 56.1372 1.4E4 56.9267 2.9E4 60.3060 3.7E4 63.0506 3.2E4 65.0384 4.3E4 68.9970 8.2E4 73.3723 3.0E4 76.0315 1.5E4 77.0385 4.2E5 78.0462 8.6E5 79.0492 5.6E4 79.0539 1.6E6 80.1544 3.3E4 82.2922 3.1E4 83.4014 2.9E4 89.0384 2.0E5 90.0462 3.6E5 91.0539 2.1E6 92.0259 6.2E4 92.0617 1.6E5 93.0697 1.2E5 95.0489 3.5E5 99.0454 3.7E4 102.0461 2.9E6 103.0540 1.2E6 104.0263 1.6E4 104.0618 1.5E6 105.0332 3.5E5 105.0440 5.4E4 105.0697 8.1E5 107.0488 2.5E6 108.7435 1.3E4 114.0462 1.1E5 115.0541 1.9E5 116.0620 3.4E5 117.0334 3.1E5 117.0699 4.9E4 118.0410 1.9E6 119.0392 8.6E4 119.0489 4.2E6 120.0205 1.2E5 120.0568 6.1E5 121.0646 1.1E6 121.3212 3.3E4 122.0724 5.4E5 122.1620 3.0E4 129.0333 3.7E4 130.0411 4.7E6 130.0525 7.3E4 131.0489 2.3E6 132.0201 3.5E5 132.0453 3.5E4 132.0567 4.4E6 132.0652 1.0E4 133.0283 9.6E5 133.0646 1.5E6 134.0360 2.2E5 134.0723 3.4E5 135.0438 6.3E6 135.0557 1.3E5 135.0798 1.1E5 136.0515 4.5E4 142.0416 2.1E4 144.0568 3.2E5 144.6485 1.4E4 145.0281 6.6E5 145.0399 1.8E4 145.0647 2.1E5 146.0360 8.6E5 147.0438 1.4E7 147.0548 8.6E4 147.1073 2.7E4 148.0517 2.2E6 149.0594 3.4E6 149.0714 3.0E4 149.8863 3.2E4 150.0673 1.5E6 157.0395 2.9E5 157.6892 3.0E4 158.0361 4.7E5 159.0075 2.8E5 159.0439 7.9E5 160.0516 4.1E6 161.0232 7.2E5 161.0440 1.7E4 161.0595 3.3E6 161.0746 6.1E4 162.0326 7.3E4 162.0512 2.6E4 162.0674 1.1E7 163.0388 1.9E7 163.0553 2.1E5 163.0749 1.8E6 163.7675 3.3E4 165.0907 9.2E4 167.0699 4.4E4 173.0234 3.3E5 173.5259 3.1E5 173.5397 3.1E5 174.0313 1.2E6 175.0389 1.0E7 175.0531 3.4E4 175.0641 4.0E4 176.0468 2.6E6 176.0645 4.2E4 177.0394 2.2E4 177.0547 2.9E6 177.0722 2.5E4 178.0441 1.4E5 178.0624 9.9E6 178.0808 6.5E4 187.0389 2.6E5 188.0468 1.6E6 189.0544 6.5E5 190.0623 1.3E7 190.0813 1.6E5 191.0139 2.0E5 191.0337 5.6E6 191.0492 2.1E4 191.0698 4.8E5 192.0409 9.1E4 193.0859 6.4E6 193.1067 1.3E5 205.0493 4.2E5 206.0574 3.2E6 221.0808 1.1E6 END IONS BEGIN IONS FEATURE_ID=387 PEPMASS=318.1342 SCANS=387 RTINSECONDS=481.128 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 8 (5 removed due to low quality, 0 removed due to low cosine). 51.1772 4.2E4 51.2941 4.9E4 51.5131 5.1E4 51.6064 4.1E4 55.0852 4.5E4 55.2693 6.7E5 55.2718 1.4E5 59.6455 5.1E4 64.5021 4.7E4 64.8488 5.0E4 66.2185 4.2E4 71.0532 4.2E4 76.1331 4.3E4 77.9406 4.2E4 78.0465 1.7E5 79.0541 4.0E5 87.8550 4.5E4 91.0542 6.2E5 95.0493 1.2E5 98.0600 1.8E6 102.0464 5.9E5 103.0542 4.3E5 104.0621 3.1E5 105.0699 6.8E5 107.0491 4.8E5 110.7275 4.8E4 112.5921 4.1E4 115.0543 7.8E4 116.0622 1.1E5 117.0699 6.5E4 118.0413 6.0E5 119.0491 1.1E6 120.0570 1.7E5 121.0646 3.2E5 122.0724 2.4E5 129.1180 4.5E4 130.0413 1.7E6 131.0491 7.3E5 132.0571 1.2E6 133.0285 1.4E5 133.0649 1.7E6 134.0725 1.7E5 135.0441 1.7E6 135.0803 2.8E5 144.0568 3.5E5 145.0290 2.0E5 145.0655 6.4E4 145.1977 5.0E4 146.0364 4.1E5 147.0441 6.7E6 148.0290 4.2E4 148.0519 9.4E5 149.0597 1.2E6 150.0677 1.3E6 151.0761 6.9E4 158.0358 2.0E5 159.0443 4.6E5 160.0520 2.3E6 161.0234 1.0E5 161.0599 3.4E6 162.0513 6.5E4 162.0677 2.0E7 163.0232 2.5E5 163.0391 7.3E6 163.0755 3.7E6 165.0913 8.3E5 167.0705 6.5E5 172.0518 1.3E5 173.0233 7.8E4 173.5283 4.5E5 173.5453 8.9E4 174.0315 2.5E6 175.0393 5.4E6 176.0471 5.1E6 176.0647 6.8E4 177.0549 3.5E6 178.0471 2.2E5 178.0627 1.8E7 188.0469 1.9E6 189.0349 1.5E5 189.0401 4.8E4 189.0549 8.6E6 189.0746 1.9E5 189.0836 5.8E4 190.0226 7.2E5 190.0626 9.6E7 190.0947 1.5E5 190.1032 4.5E5 191.0341 2.1E7 191.0704 7.4E6 192.0417 8.2E5 193.0448 3.8E5 193.0529 2.6E5 193.0862 7.1E7 193.1273 4.8E5 205.0501 7.7E5 206.0129 8.8E4 206.0577 3.7E7 206.1163 6.3E4 217.0154 5.3E4 221.0025 7.9E4 221.0153 1.5E5 221.0304 1.6E6 221.0407 1.4E6 221.0811 2.1E8 221.1207 5.7E5 221.1322 1.4E6 221.1610 1.0E5 222.0851 1.5E5 255.2440 4.3E4 273.0267 4.9E4 307.6411 4.1E4 END IONS BEGIN IONS FEATURE_ID=388 PEPMASS=223.0863 SCANS=388 RTINSECONDS=481.158 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 43.6588 2.1E3 43.7981 2.5E3 44.5539 2.8E3 45.0332 3.0E3 47.2586 2.1E3 47.3518 2.1E3 49.7886 2.3E3 50.4921 2.4E3 50.7676 2.4E3 52.3109 2.3E3 55.0175 2.1E3 57.2075 2.2E3 57.3709 2.2E3 63.0795 4.9E3 68.9758 2.8E3 72.9224 2.3E3 78.0458 2.4E3 79.0540 2.0E4 83.8309 2.4E3 90.6828 2.2E3 91.0540 2.0E4 95.5035 2.1E3 101.7162 2.4E3 102.0461 2.3E4 102.8500 2.5E3 104.0619 3.6E3 105.0702 2.3E3 107.0489 1.4E4 108.0516 2.7E3 109.1009 1.2E4 114.2150 2.3E3 116.0620 2.3E3 118.0413 2.7E3 119.0488 2.1E4 120.0524 7.7E3 121.0546 9.1E3 121.0648 5.5E3 123.0800 6.9E4 130.0407 2.5E4 131.0463 1.0E4 132.0466 1.3E4 132.0573 6.1E3 134.0629 1.1E4 134.1027 2.5E3 135.0438 2.3E4 135.8551 2.3E3 136.0473 1.7E4 137.0493 3.4E4 140.6601 2.4E3 147.0437 5.7E4 148.0474 3.6E4 149.0493 8.4E4 150.0592 5.6E3 151.0654 1.9E4 152.0837 2.6E3 156.6834 2.6E3 160.0518 9.3E3 161.0584 9.7E3 162.0552 1.5E4 162.0674 3.1E4 163.0387 4.1E4 163.0682 2.5E4 163.3362 2.5E3 164.0422 5.3E4 164.0732 8.2E4 165.0439 1.5E5 165.0798 1.5E4 173.5241 9.9E3 173.5370 4.6E4 175.0390 1.8E4 176.0414 1.6E4 176.9802 3.1E3 177.0445 9.5E4 178.0508 1.0E4 178.0628 6.3E3 179.0623 2.8E4 180.0676 8.9E4 187.1481 2.5E3 190.0514 3.3E3 190.0628 1.5E4 191.0642 1.3E4 192.0379 1.3E4 192.0679 1.3E5 193.0391 6.7E4 193.0853 3.5E3 194.0892 3.0E3 195.0910 6.3E4 207.0573 3.2E3 208.0381 8.8E3 208.0625 4.2E4 223.0855 8.4E3 END IONS BEGIN IONS FEATURE_ID=389 PEPMASS=340.1159 SCANS=389 RTINSECONDS=481.202 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 8 (4 removed due to low quality, 0 removed due to low cosine). 53.2336 1.3E4 56.0795 1.7E4 58.0594 1.3E4 59.7033 1.4E4 60.2691 1.4E4 63.2113 1.3E4 63.9992 1.5E4 65.5548 1.3E4 77.5002 1.7E4 86.1416 1.4E4 89.4362 5.4E3 93.1695 1.5E4 110.0180 4.2E3 110.9308 5.1E3 120.0417 1.1E6 125.8308 1.5E4 168.5506 4.7E3 173.5249 3.6E5 173.5429 2.0E5 175.6927 4.6E3 183.0837 1.6E4 187.7118 1.4E4 190.0620 9.0E4 193.0859 7.5E4 206.0597 1.8E4 221.0810 4.8E5 243.0598 1.5E4 246.5439 1.4E4 246.8267 1.7E4 261.5005 6.1E3 279.0908 1.6E4 325.0916 6.8E4 340.1156 1.1E6 340.1642 1.9E4 END IONS BEGIN IONS FEATURE_ID=390 PEPMASS=208.0439 SCANS=390 RTINSECONDS=481.228 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 2 (0 removed due to low quality, 0 removed due to low cosine). 41.3484 2.2E3 52.9306 2.2E3 54.6653 2.1E3 56.4002 2.2E3 70.1250 2.2E3 73.0282 9.1E3 76.9669 2.6E3 77.4386 2.4E3 84.9593 6.8E4 85.8034 2.2E3 92.5701 2.1E3 102.9703 7.8E3 107.1876 2.2E3 115.9637 1.2E4 116.9610 2.8E3 126.0621 2.7E3 132.6509 2.2E3 138.9862 2.7E3 149.0598 2.8E3 149.6700 3.4E3 149.6917 6.5E3 151.0557 2.1E3 173.5340 1.5E4 174.9846 4.2E3 221.5503 2.5E3 END IONS BEGIN IONS FEATURE_ID=391 PEPMASS=346.0937 SCANS=391 RTINSECONDS=481.264 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 69.7907 2.3E3 73.5208 2.5E3 74.1323 2.1E3 77.6922 2.4E3 78.4357 2.3E3 79.0119 2.9E3 84.6581 2.3E3 87.6967 2.2E3 99.5637 2.8E3 131.4254 2.5E3 139.4917 2.8E3 146.6867 2.3E3 149.6698 3.2E3 149.6819 8.6E3 149.6922 1.1E4 162.0670 4.0E3 173.5274 2.3E4 173.5432 8.0E3 174.4420 2.7E3 176.8679 2.5E3 190.0623 3.7E4 191.0342 8.1E3 193.0858 2.1E4 205.7346 2.8E3 206.0577 1.1E4 212.9087 2.7E3 221.0808 1.5E5 222.0840 1.6E4 385.3449 2.8E3 463.6243 2.7E3 532.4628 2.6E3 END IONS BEGIN IONS FEATURE_ID=392 PEPMASS=418.0588 SCANS=392 RTINSECONDS=481.264 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 55.0579 2.1E3 57.4196 2.2E3 57.6936 2.2E3 60.9186 2.2E3 64.7738 2.1E3 66.2125 2.2E3 75.6752 2.3E3 83.1468 2.5E3 100.1121 3.0E3 104.1131 2.2E3 124.1602 2.5E3 134.6714 2.2E3 147.0435 2.8E3 148.0507 3.0E3 148.7119 2.6E3 149.6701 2.9E3 149.6805 3.6E3 149.6914 5.8E3 161.0602 2.5E3 161.8407 2.3E3 162.0673 1.2E4 163.0406 2.4E3 163.0758 2.4E3 163.6168 2.7E3 169.9903 2.3E3 172.7964 2.4E3 173.5270 3.7E3 173.5365 3.0E4 178.0622 6.5E3 181.0856 1.0E4 189.0544 8.3E3 190.0623 9.0E4 190.5458 2.5E3 191.0338 1.6E4 191.0697 1.5E4 191.3733 2.4E3 193.0858 7.9E4 206.0574 3.2E4 221.0809 4.2E5 221.1001 3.3E3 222.0819 2.3E3 235.4782 2.7E3 247.6210 2.4E3 320.8605 2.5E3 326.0121 3.0E3 328.0271 9.5E3 331.0507 4.4E3 334.0366 5.6E3 344.0227 1.2E4 359.0456 3.0E4 362.0335 9.2E3 377.0560 2.0E4 410.2910 2.5E3 END IONS BEGIN IONS FEATURE_ID=393 PEPMASS=463.0563 SCANS=393 RTINSECONDS=481.264 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 58.6203 2.7E3 69.2764 2.8E3 69.8383 2.3E3 76.6200 2.7E3 78.8994 2.1E3 86.3127 2.4E3 92.3316 2.3E3 99.0706 2.4E3 99.3680 2.1E3 102.4248 2.4E3 149.6675 4.6E3 149.6883 5.2E3 149.7092 3.6E3 162.0677 3.2E3 165.0025 2.4E3 172.9781 7.4E3 173.5235 8.3E3 173.5392 2.1E4 177.0543 1.1E4 179.0707 2.7E3 181.0861 2.2E4 186.9575 1.8E4 190.0624 3.4E4 191.0347 5.8E3 191.0695 3.8E3 192.0782 1.6E4 193.0863 2.9E4 194.0937 2.4E4 205.0499 7.0E4 206.0577 1.1E4 220.0729 2.0E4 221.0810 9.6E5 222.0875 2.5E4 234.0771 4.6E3 236.0677 2.7E4 246.1156 3.4E3 260.1275 1.3E4 260.6922 2.9E3 272.1283 6.0E4 273.1373 2.9E3 274.1076 2.9E5 286.1067 1.1E4 289.1311 2.8E5 289.1596 2.3E3 302.1026 1.4E5 302.1382 3.6E3 305.9905 2.8E3 317.0827 4.1E3 317.1259 3.6E5 319.0141 3.1E3 320.0232 1.7E4 335.0470 5.5E4 350.8268 3.1E3 363.0424 1.5E4 378.0647 6.8E3 410.9435 2.9E3 460.3823 2.6E3 473.4468 2.8E3 END IONS BEGIN IONS FEATURE_ID=394 PEPMASS=342.1340 SCANS=394 RTINSECONDS=483.903 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 55.1323 2.1E3 55.4878 2.5E3 56.5342 2.6E3 59.0957 2.5E3 60.5257 2.9E3 61.4761 2.4E3 61.7303 2.4E3 63.0235 5.8E3 86.7316 2.3E3 87.8725 2.4E3 88.7077 2.6E3 89.0384 1.1E5 91.0483 3.0E3 91.0539 1.2E5 95.0488 4.2E4 105.5693 3.0E3 115.9718 3.0E3 117.0331 1.9E5 118.4624 2.2E3 119.0488 1.5E5 130.1520 2.6E3 131.5429 2.3E3 135.0438 1.1E5 136.0520 1.5E4 137.0593 1.3E4 145.0281 2.0E6 145.0390 1.9E4 147.0437 1.1E5 151.0751 6.3E5 151.0909 1.0E4 163.0387 9.4E5 163.0543 1.9E4 173.5242 4.2E4 173.5418 2.9E4 175.0388 6.3E6 175.0528 1.4E4 175.0744 4.5E4 175.0843 5.5E3 186.0549 2.5E4 236.6951 2.5E3 237.7991 2.5E3 265.0842 2.8E3 274.3448 2.5E3 292.4890 3.0E3 301.4977 2.2E3 331.4993 2.6E3 END IONS BEGIN IONS FEATURE_ID=395 PEPMASS=246.2218 SCANS=395 RTINSECONDS=483.998 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 6 (0 removed due to low quality, 0 removed due to low cosine). 44.0492 6.9E4 45.3217 2.6E3 49.4517 2.2E3 50.8873 2.3E3 55.0539 1.5E4 55.9342 2.4E4 58.6332 2.0E3 60.5088 2.4E3 63.8517 2.2E3 63.8785 2.1E3 63.9253 2.6E3 65.5205 2.3E3 66.5140 2.5E3 66.9123 2.6E3 67.0539 2.8E3 67.5725 2.2E3 69.0694 2.0E4 69.8983 2.7E3 70.0648 1.0E4 70.7149 2.4E3 75.7267 2.4E3 81.0695 4.6E4 83.0851 1.9E4 84.0803 8.8E3 88.9006 2.8E3 89.5259 2.3E3 91.0535 2.4E3 91.5752 2.2E3 93.0695 3.0E4 95.0851 4.9E4 96.0805 9.5E3 98.3845 2.3E3 101.0513 2.5E3 103.2914 2.4E3 105.0694 4.6E4 107.0851 3.5E4 108.0803 2.1E5 109.1010 2.4E4 110.0960 4.6E4 114.9712 2.5E4 117.9765 2.3E3 119.0851 5.3E4 121.1007 3.6E4 123.1166 2.0E4 128.9505 6.0E4 131.0851 2.8E4 132.9819 8.8E3 133.1009 3.9E4 134.5707 2.3E3 135.1162 1.6E4 135.9452 1.0E4 138.9697 3.2E3 142.8647 2.5E3 145.1009 6.5E4 146.9609 1.1E4 147.1165 5.8E4 148.1117 2.9E3 149.1321 2.1E4 152.1430 6.2E4 159.1164 4.9E4 161.1190 6.0E3 161.1324 3.4E3 162.1270 9.0E3 164.1436 1.3E4 172.8472 2.5E3 173.1323 4.7E4 173.5209 9.6E3 173.5368 8.0E4 175.1483 1.6E4 176.2134 2.4E3 176.9714 6.9E3 185.9665 2.3E3 186.1393 3.0E3 187.1478 2.7E4 188.1428 2.6E4 189.1635 1.1E5 190.1599 3.3E3 194.5434 2.5E3 195.8063 2.4E3 199.4202 2.6E3 203.1666 8.5E4 204.1747 8.6E4 205.7160 2.5E3 218.1897 2.0E4 221.7242 2.6E3 229.1948 5.8E4 243.0335 3.1E3 244.1374 2.5E3 246.2215 8.8E5 246.2508 5.3E3 END IONS BEGIN IONS FEATURE_ID=396 PEPMASS=290.1392 SCANS=396 RTINSECONDS=491.449 CHARGE=1+ MSLEVEL=2 MERGED_STATS=8 / 12 (4 removed due to low quality, 0 removed due to low cosine). 48.5618 7.5E3 50.0159 8.3E3 51.0236 3.1E3 51.7659 9.6E4 51.7671 9.1E3 52.6978 5.3E3 54.0337 9.8E4 54.4651 3.5E3 54.8432 6.0E3 55.0178 3.5E4 55.0541 7.8E4 56.0494 1.2E5 56.0847 3.0E3 59.8079 3.2E3 65.0385 1.7E5 65.5326 6.0E3 67.0415 1.7E5 67.0540 8.9E5 67.5806 6.0E3 67.8514 2.2E3 68.0493 7.7E4 68.6381 3.2E3 69.0331 1.6E4 71.2082 2.6E3 71.7064 2.4E3 73.2491 6.9E3 74.4022 5.8E3 75.6071 6.6E3 75.7217 2.5E3 76.0314 2.4E4 77.0385 4.4E4 78.8127 3.5E3 80.0493 1.4E5 81.6756 4.9E3 82.0285 1.6E6 82.0650 1.6E6 82.6969 2.4E3 83.0727 2.4E5 84.0754 1.4E4 84.0804 1.1E6 86.5557 2.4E3 87.9096 3.4E3 88.9997 6.1E3 89.0387 5.4E4 91.0541 3.1E6 91.0603 1.1E4 91.2254 3.0E3 91.3716 5.7E3 92.0494 2.3E4 93.0335 6.6E3 95.0490 2.8E4 96.0143 3.2E3 99.8008 5.2E3 101.0390 1.8E4 101.4794 5.0E3 103.0540 1.6E5 105.0335 4.6E4 107.0133 5.8E3 107.0493 1.1E4 108.0454 5.3E3 108.0805 6.8E4 110.0601 4.3E6 110.0676 1.4E4 112.8347 2.8E3 116.3850 3.0E3 117.0332 7.8E3 118.0415 7.2E4 119.0380 2.9E3 119.0490 1.2E7 119.0573 1.2E5 119.0688 3.3E4 119.3330 3.3E3 120.5289 2.9E3 121.0643 7.1E3 129.0334 9.6E4 129.0430 2.2E3 129.3644 2.7E3 130.4411 6.8E3 131.0490 1.2E5 131.6842 3.8E3 132.0205 1.0E5 133.0284 1.3E5 135.0442 3.1E4 136.0521 4.5E4 136.0752 1.7E4 137.0599 3.6E4 137.2685 5.8E3 140.7607 3.4E3 142.9736 2.2E3 145.0283 1.3E5 146.0362 7.2E4 147.0439 1.5E7 147.0548 1.3E5 147.0711 1.1E5 148.0502 9.4E3 149.0234 7.3E4 149.0595 4.4E4 149.2640 7.5E3 149.6682 4.6E3 153.0566 6.3E3 154.2397 2.4E3 157.0253 4.4E4 157.0395 1.3E6 160.0156 4.3E4 161.0235 1.4E4 161.0583 8.2E3 162.0306 1.8E4 163.0390 2.2E4 164.0467 2.3E5 165.0549 4.4E3 166.8979 5.8E3 167.0703 1.5E5 173.0238 1.7E4 173.5277 9.1E4 173.5391 6.4E4 174.0310 6.2E4 174.9926 1.0E4 175.0030 2.7E4 175.0113 2.1E4 175.0390 3.6E7 175.0746 2.8E5 175.0849 5.2E4 175.0943 2.4E4 176.0461 7.8E4 177.0174 6.0E3 177.0550 6.1E4 178.0263 6.4E3 179.0703 6.7E5 186.2518 3.1E3 189.0568 7.8E3 191.0334 9.7E3 192.0213 3.1E4 192.0418 2.0E6 192.0623 4.3E4 193.0497 4.8E5 195.0605 2.5E3 197.5588 5.9E3 199.0185 3.6E3 206.6020 5.9E3 207.0192 6.7E4 207.0297 4.3E4 207.0653 2.3E7 207.1112 1.6E5 207.1238 2.0E4 228.1024 6.9E3 230.1188 6.9E3 248.1278 7.6E4 258.1115 2.6E3 290.1391 7.6E4 299.0626 3.4E3 END IONS BEGIN IONS FEATURE_ID=397 PEPMASS=207.0656 SCANS=397 RTINSECONDS=491.491 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 5 (0 removed due to low quality, 0 removed due to low cosine). 43.0178 1.7E4 43.6421 2.5E3 45.0333 1.1E4 47.6106 2.3E3 48.0491 2.3E3 49.3235 2.4E3 49.3809 2.3E3 52.6281 2.2E3 54.5292 2.1E3 55.5460 2.1E3 56.4569 2.5E3 57.1696 2.1E3 57.9346 1.6E4 58.0927 2.2E3 62.6561 2.7E3 65.0383 2.6E4 65.2119 2.6E3 70.3697 2.5E3 72.3899 2.4E3 72.6283 2.3E3 74.3669 2.5E3 74.9375 1.2E4 79.0541 2.9E3 81.0697 2.5E3 84.8907 3.1E3 84.9455 2.5E4 87.4574 2.4E3 89.0384 1.1E4 91.0538 4.9E5 91.0607 5.1E3 92.9478 4.3E3 95.0853 8.0E3 95.6480 2.2E3 96.0467 2.3E3 97.9531 3.0E4 98.9611 5.2E4 101.0383 5.1E3 101.9474 2.4E3 102.8603 2.8E3 102.9559 2.7E4 103.0538 2.3E3 104.0250 2.3E3 104.2121 2.3E3 107.0493 1.0E4 108.0567 6.1E3 109.8374 2.3E3 114.9709 2.4E3 115.9551 9.1E3 115.9637 5.2E5 115.9733 5.2E3 116.9716 2.0E5 117.0335 2.5E3 118.0411 5.8E3 119.0488 3.2E5 119.0852 3.3E3 121.0640 3.1E3 124.5875 2.2E3 126.9676 5.5E3 129.0333 1.0E4 129.0442 3.1E3 130.7546 2.6E3 132.0203 4.1E4 133.9744 4.0E4 135.0438 2.1E4 136.0517 1.2E4 139.9842 2.7E3 140.7319 2.1E3 142.6509 2.2E3 145.0279 9.7E3 146.0356 6.3E3 147.0437 1.9E5 149.0231 4.1E4 155.9966 6.1E3 157.0397 2.9E4 162.0304 3.0E3 163.1344 2.8E3 164.0469 1.8E4 173.5269 3.2E4 173.5389 2.6E4 175.0389 3.0E4 179.0700 2.6E4 201.4166 2.5E3 207.3335 2.5E3 END IONS BEGIN IONS FEATURE_ID=398 PEPMASS=365.2073 SCANS=398 RTINSECONDS=495.36 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 63.3032 2.7E3 65.0202 2.2E3 73.3875 2.7E3 89.2609 2.2E3 100.0752 1.5E4 100.1044 2.3E3 105.7094 2.5E3 106.3752 2.1E3 119.1410 2.5E3 131.2660 2.5E3 135.0435 2.4E3 148.4705 2.3E3 149.6824 3.8E3 149.6896 1.1E4 162.0671 3.2E4 163.0394 3.7E3 173.5340 2.0E4 176.0474 2.7E3 177.0556 2.3E3 178.0622 1.9E4 189.0542 2.2E4 190.0622 2.3E5 191.0337 3.7E4 191.0699 2.0E4 193.0673 2.3E3 193.0857 1.8E5 206.0574 8.6E4 217.0270 2.9E3 221.0808 1.9E6 END IONS BEGIN IONS FEATURE_ID=399 PEPMASS=221.0811 SCANS=399 RTINSECONDS=495.374 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 5 (0 removed due to low quality, 0 removed due to low cosine). 43.0178 2.4E3 44.3567 2.1E3 44.6717 2.1E3 47.3494 2.6E3 47.7978 2.1E3 51.9672 2.7E3 54.1719 2.3E3 54.6339 2.3E3 61.0637 2.4E3 64.2489 3.0E3 64.5483 2.3E3 65.6664 2.5E3 65.6799 2.5E3 67.8384 2.4E3 72.8676 2.4E3 75.4007 2.3E3 76.7404 2.1E3 77.8684 2.1E3 78.0462 1.6E4 78.7252 2.3E3 79.0538 3.3E4 83.2383 2.2E3 88.2592 2.3E3 91.0539 4.6E4 93.9950 2.4E3 94.2427 2.3E3 94.7723 2.7E3 95.0488 2.7E3 98.8352 2.3E3 101.7137 2.4E3 101.8481 2.4E3 102.0460 5.2E4 103.0539 2.5E4 104.0618 3.0E4 105.0695 1.9E4 107.0487 4.6E4 118.0411 4.0E4 118.0498 2.8E3 119.0489 9.6E4 120.0567 7.1E3 121.0644 2.0E4 122.0721 9.4E3 130.0411 9.6E4 131.0489 4.1E4 132.0202 6.2E3 132.0566 7.4E4 133.0282 1.6E4 133.0647 3.2E4 135.0437 1.4E5 138.8042 2.7E3 140.0429 2.7E3 145.0279 1.4E4 145.8424 2.5E3 146.0357 1.0E4 147.0438 3.2E5 147.0570 4.3E3 148.0517 5.3E4 148.0634 2.8E3 149.0595 6.6E4 149.1349 2.3E3 150.0674 2.5E4 157.0405 2.5E3 157.6472 2.4E3 158.0368 6.1E3 159.0085 2.9E3 159.0442 1.3E4 160.0517 8.3E4 161.0232 7.8E3 161.0595 6.4E4 162.0530 4.3E3 162.0674 2.2E5 163.0232 8.9E3 163.0388 3.9E5 163.0754 4.2E4 168.7683 2.9E3 170.0955 2.5E3 173.5337 4.4E4 173.5421 4.6E3 174.0312 2.1E4 174.9849 2.2E4 175.0390 2.0E5 176.0469 5.2E4 177.0547 6.3E4 178.0624 2.0E5 188.0467 3.2E4 189.0546 7.6E3 190.0624 2.7E5 190.0809 4.3E3 191.0338 1.3E5 191.0692 1.2E4 193.0859 1.3E5 205.0502 1.1E4 206.0575 6.1E4 209.3329 2.3E3 221.0809 1.9E4 END IONS BEGIN IONS FEATURE_ID=400 PEPMASS=320.1499 SCANS=400 RTINSECONDS=495.444 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 9 (4 removed due to low quality, 0 removed due to low cosine). 49.1466 2.3E3 52.6124 2.4E3 53.3565 2.1E3 54.3722 2.3E3 55.0592 2.3E3 55.2699 1.3E4 64.6503 2.4E3 71.1124 2.3E3 72.1466 2.9E3 77.3549 2.7E3 77.7207 2.6E3 79.8426 2.4E3 83.2423 2.2E3 91.0539 3.8E3 100.0755 5.9E4 102.0461 7.7E3 103.0541 4.9E3 105.0696 6.5E3 106.6527 2.5E3 107.3761 2.6E3 111.3102 2.8E3 115.9145 2.3E3 116.6334 2.4E3 118.0415 8.0E3 119.0490 1.8E4 130.0411 2.7E4 131.0488 7.2E3 132.0565 1.9E4 133.0646 3.1E4 135.0440 3.4E4 139.8325 2.7E3 140.6259 2.5E3 141.7897 2.7E3 146.0355 2.8E3 147.0439 1.2E5 148.0517 1.9E4 149.0594 2.1E4 150.0673 2.2E4 154.6445 2.5E3 159.0439 9.1E3 160.0517 3.6E4 161.0595 6.3E4 162.0674 4.0E5 162.0830 1.2E4 163.0388 1.3E5 163.0752 7.3E4 165.0905 1.3E4 165.3507 2.4E3 167.0705 1.1E4 167.1555 2.5E3 173.5247 1.2E4 173.5348 3.9E4 174.0313 4.1E4 175.0389 1.0E5 176.0469 8.9E4 177.0546 6.7E4 178.0624 3.5E5 179.0780 2.3E3 181.4243 2.8E3 188.0470 3.3E4 189.0368 4.4E3 189.0545 1.7E5 190.0221 3.2E3 190.0623 2.0E6 190.0777 1.8E4 190.0831 6.0E3 191.0139 9.3E3 191.0337 4.1E5 191.0700 1.6E5 192.0415 2.0E4 193.0446 3.2E3 193.0651 4.9E3 193.0858 1.5E6 193.1036 1.7E4 205.0501 1.2E4 206.0346 1.5E4 206.0573 7.8E5 206.0800 2.0E4 210.5402 2.6E3 221.0308 8.7E3 221.0807 5.0E6 221.0999 3.8E4 221.1199 1.0E4 221.1315 1.6E4 222.0841 3.2E3 223.0864 5.4E3 255.8816 4.1E3 260.4284 2.6E3 272.7640 2.8E3 277.1261 2.7E3 END IONS BEGIN IONS FEATURE_ID=401 PEPMASS=342.1315 SCANS=401 RTINSECONDS=495.451 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 50.1191 2.3E3 60.4393 2.5E3 63.5241 2.1E3 64.6554 2.3E3 65.4683 2.1E3 70.6054 2.2E3 84.5063 2.5E3 85.8966 2.6E3 87.6182 2.4E3 110.8222 2.6E3 122.0573 2.0E4 125.4548 2.3E3 133.0672 2.4E3 136.5029 2.4E3 153.1274 2.6E3 173.5203 5.4E3 173.5351 4.8E4 193.0877 2.9E3 221.0796 6.7E3 233.2970 2.3E3 252.4319 2.7E3 252.4651 2.6E3 271.7657 2.6E3 328.8345 2.5E3 342.1311 4.0E4 END IONS BEGIN IONS FEATURE_ID=402 PEPMASS=625.2557 SCANS=402 RTINSECONDS=497.18 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 6 (0 removed due to low quality, 0 removed due to low cosine). 64.1522 2.5E3 64.5482 3.0E3 68.0125 2.5E3 71.3840 2.4E3 76.8163 2.4E3 77.9349 2.3E3 83.4219 2.2E3 84.8984 2.2E3 84.9734 2.4E3 88.5087 2.5E3 90.2587 2.3E3 90.5704 2.3E3 92.8587 3.2E3 93.0695 8.6E3 95.9276 2.6E3 96.5446 2.1E3 102.8067 2.5E3 102.9883 2.7E3 105.6078 2.2E3 121.0645 2.4E5 121.4203 2.3E3 122.7203 2.5E3 122.7827 2.7E3 133.0282 1.3E4 136.0753 2.8E4 136.1032 2.7E3 137.0592 3.8E4 138.0906 9.0E3 143.0487 7.5E3 149.0594 5.3E4 150.0672 2.5E4 161.0589 4.2E3 164.0702 5.2E4 173.5217 3.5E4 173.5394 1.0E5 173.5496 2.8E3 175.0388 7.8E4 175.0754 1.4E4 177.0548 3.6E4 181.6594 2.3E3 187.0385 1.9E4 198.8765 2.3E3 201.0545 1.4E5 203.0696 9.8E3 221.0972 6.1E3 227.0700 8.7E3 233.0593 2.7E4 237.0912 1.8E4 247.0051 2.5E3 247.0750 1.6E4 249.0917 2.6E3 251.0724 3.1E3 254.0567 2.3E3 261.0546 3.1E3 263.0698 1.3E4 264.0787 1.4E4 265.0857 1.1E5 266.0931 1.2E4 272.1282 1.1E4 275.0704 5.9E3 276.5277 2.4E3 278.0572 8.3E3 279.1012 2.6E4 292.0735 2.9E4 293.0443 7.2E3 293.0811 2.4E5 295.0960 1.6E4 297.0781 2.7E3 297.1123 4.9E4 307.0967 4.5E5 308.0681 2.1E5 310.0837 1.4E4 314.4610 2.2E3 319.0602 2.0E4 322.5711 3.0E3 323.0912 7.5E4 325.0612 5.1E3 325.0731 3.0E3 325.1069 5.7E5 325.1514 1.1E4 336.0628 1.4E4 340.1916 2.6E3 351.0362 5.6E3 351.0860 7.6E5 351.1233 3.3E3 371.9644 2.9E3 452.4577 2.3E3 459.1305 2.4E3 462.1897 2.2E4 488.1738 3.0E3 509.6094 2.8E3 511.9201 2.5E3 551.5922 2.8E3 564.8727 3.0E3 596.1522 2.5E3 607.8865 2.9E3 618.6901 2.4E3 END IONS BEGIN IONS FEATURE_ID=403 PEPMASS=266.0814 SCANS=403 RTINSECONDS=503.676 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 5 (2 removed due to low quality, 0 removed due to low cosine). 45.6968 1.2E4 46.0675 2.6E3 48.5298 8.7E3 50.4337 6.8E3 54.0099 2.7E3 57.5014 6.5E3 57.6992 8.8E3 59.0171 3.1E3 62.7625 8.4E4 62.7662 2.2E4 63.4869 7.8E3 63.5111 6.0E3 64.6030 3.8E3 65.5627 2.8E3 66.5183 4.0E4 66.5221 1.6E4 71.1826 7.9E3 76.3828 8.7E3 77.9306 8.1E3 87.6254 7.7E3 87.9531 6.9E3 99.5404 8.3E3 101.4497 3.1E3 102.4253 3.0E3 107.5177 3.7E3 117.8242 3.0E3 122.6549 8.9E3 130.4519 3.5E3 139.0560 3.5E4 140.0624 1.3E4 143.1882 8.4E3 161.9709 3.2E3 165.0698 3.1E4 166.0662 3.3E4 167.0731 4.6E5 168.0574 7.6E4 169.3020 3.3E3 171.0672 1.9E4 173.5245 3.5E4 173.5330 4.3E4 179.0497 1.2E4 179.0968 8.2E3 180.0812 4.1E4 182.0606 1.2E4 182.0965 6.1E4 192.0803 4.0E4 194.0603 3.8E4 195.0468 2.4E4 195.0679 1.1E6 195.0886 1.0E4 196.0518 6.3E4 196.0757 1.5E5 198.0548 1.4E4 199.0638 1.2E4 203.0970 8.9E3 206.0601 4.4E5 208.0760 6.4E4 210.0552 9.5E3 210.0917 1.2E5 211.0759 8.2E4 219.9454 8.1E3 220.0750 4.7E4 222.0555 4.5E4 223.0628 4.0E5 230.7548 3.1E3 234.0551 2.4E5 238.0864 4.0E5 243.4285 1.1E4 250.0503 2.2E4 250.9615 1.3E4 250.9959 6.4E4 251.0576 2.9E7 251.1194 1.9E5 251.1372 4.0E4 265.0747 1.1E4 266.0136 1.1E5 266.0290 6.1E4 266.0811 1.9E7 266.1482 1.2E5 266.1665 2.4E4 END IONS BEGIN IONS FEATURE_ID=404 PEPMASS=621.2449 SCANS=404 RTINSECONDS=508.137 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 2 (0 removed due to low quality, 0 removed due to low cosine). 64.5206 2.2E3 69.7881 2.1E3 72.4103 2.2E3 78.6021 2.4E3 79.0540 4.2E3 81.0332 3.4E5 81.0386 4.9E3 82.0284 3.5E3 94.0649 2.5E3 95.9429 2.2E3 98.0596 9.1E3 106.0655 3.0E3 107.8755 2.5E3 109.6856 2.1E3 110.0234 1.9E4 119.0497 2.7E3 122.0600 9.8E3 123.3927 2.5E3 132.0443 6.6E3 134.0600 4.5E3 134.2878 2.3E3 136.0388 7.7E3 147.0444 3.0E3 150.0547 1.4E5 150.0660 2.1E3 165.5482 2.7E3 173.5322 4.6E4 175.0388 8.7E3 178.0498 4.1E5 181.0495 1.6E4 195.0654 4.6E3 196.0589 2.3E3 205.0864 9.0E3 207.0652 3.2E4 221.0809 5.0E4 244.4942 2.3E3 245.0813 3.0E3 273.0754 3.4E3 290.1040 3.7E3 300.1219 4.4E3 336.1006 4.6E3 337.1089 3.5E3 339.1237 5.8E3 341.4686 2.6E3 353.1015 1.0E4 357.1335 5.2E3 361.0238 1.6E4 366.1123 5.3E3 367.1186 2.3E4 368.1253 1.8E4 381.1340 1.9E4 384.1213 3.9E3 385.1286 7.1E4 389.0979 2.6E3 395.1160 5.3E3 396.1203 9.7E3 399.1443 2.4E4 409.1270 2.9E3 412.1201 3.4E3 427.1407 2.3E4 459.2717 2.6E4 510.2023 3.2E3 615.9564 2.9E3 621.3231 1.4E4 END IONS BEGIN IONS FEATURE_ID=405 PEPMASS=597.2216 SCANS=405 RTINSECONDS=510.112 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 6 (0 removed due to low quality, 0 removed due to low cosine). 67.3207 2.4E3 73.5578 2.4E3 76.0916 2.3E3 76.2434 2.3E3 76.5205 2.2E3 76.9058 2.1E3 77.0276 2.2E3 79.7985 2.3E3 83.9468 2.4E3 89.0392 2.5E3 94.3516 2.4E3 97.8585 2.3E3 101.1221 2.7E3 104.9264 2.4E3 109.1179 2.5E3 118.9887 2.2E3 119.7462 2.3E3 120.0414 2.3E4 127.2334 2.1E3 133.2068 2.5E3 143.0789 2.9E3 148.0134 2.3E3 148.7233 2.3E3 159.3648 2.6E3 173.5221 7.3E3 173.5323 1.1E5 173.5411 1.1E4 206.0437 2.4E3 211.5775 2.7E3 214.7722 2.8E3 228.5142 2.4E3 237.5999 2.8E3 258.4243 2.4E3 263.7636 2.5E3 277.0904 2.3E3 294.9262 2.3E3 310.1050 2.4E6 310.1894 3.3E3 315.3971 2.4E3 334.1750 2.8E3 354.6057 2.3E3 364.1619 2.8E3 368.3382 2.8E3 422.9711 2.4E3 443.3141 2.7E3 466.3701 2.4E3 542.1138 2.7E3 END IONS BEGIN IONS FEATURE_ID=406 PEPMASS=288.1235 SCANS=406 RTINSECONDS=510.166 CHARGE=1+ MSLEVEL=2 MERGED_STATS=8 / 14 (6 removed due to low quality, 0 removed due to low cosine). 47.7672 5.6E5 47.7688 5.2E4 48.1445 5.2E3 48.9981 9.0E3 49.9679 5.0E3 53.0021 1.3E4 53.7223 2.4E3 54.2864 5.5E3 55.0178 9.8E4 55.3527 5.3E3 56.6153 2.1E3 57.4875 4.8E3 57.5946 4.9E3 57.6265 5.1E3 58.6221 8.5E3 59.5369 4.4E3 60.7405 5.3E3 62.9194 7.8E3 65.0385 1.4E4 65.8524 4.4E3 66.1151 6.3E3 68.1090 4.3E3 69.8579 4.8E3 70.5149 5.4E3 70.9716 4.1E3 72.4678 4.8E3 75.5449 6.9E3 76.7875 5.8E3 77.0391 6.4E4 79.0540 5.7E5 79.6578 6.2E3 84.2803 4.8E3 89.0389 1.0E5 90.0463 7.1E4 90.5189 3.9E3 91.0542 6.0E5 92.0620 1.5E5 92.9204 6.4E3 95.0490 1.5E5 97.0766 5.9E3 98.0599 4.0E5 101.2243 4.7E3 102.0469 1.4E5 103.0540 1.2E6 104.0619 2.2E4 105.0334 3.6E5 105.0426 1.4E4 105.0442 6.9E3 105.0618 2.2E4 105.0698 1.7E6 105.0782 7.6E3 107.0492 6.9E4 109.0642 7.4E3 112.1176 5.6E3 115.0543 1.6E5 116.2313 5.6E3 117.0338 9.7E4 117.0698 6.6E3 118.0413 3.3E5 119.0491 1.1E6 119.0579 1.4E4 120.0569 9.1E5 121.0646 6.5E4 123.2477 5.6E3 127.0811 8.3E3 130.0413 1.6E5 131.0491 2.2E5 132.0453 1.0E4 132.0569 1.9E6 132.0686 2.8E4 133.0179 8.8E3 133.0283 7.9E5 133.0648 2.0E6 133.0765 2.6E4 135.0445 9.9E3 135.0803 6.6E5 137.0602 9.1E4 137.6867 4.6E3 143.0608 5.4E4 145.0289 6.5E3 146.0362 4.7E5 147.0441 8.1E5 148.0402 2.3E4 148.0518 7.2E6 148.0629 2.6E4 149.0587 6.5E3 151.0760 8.9E3 152.5068 4.7E3 158.0366 4.5E4 159.0435 1.1E5 160.0398 9.2E3 160.0519 3.8E6 160.0641 2.0E4 160.1931 7.5E3 161.0597 1.1E6 163.0431 2.6E5 163.0496 2.9E4 163.0754 3.3E7 163.1010 3.8E4 163.1063 3.5E5 163.1162 8.6E4 165.0551 1.8E4 173.0590 7.1E4 173.5275 2.8E5 173.5435 5.9E4 176.0288 5.5E4 176.0470 4.5E6 178.0859 3.1E4 190.8802 6.4E3 190.9393 5.0E3 190.9854 9.3E3 190.9928 6.6E3 191.0177 2.4E4 191.0293 8.4E5 191.0378 7.1E5 191.0703 1.4E8 191.0855 3.3E5 191.1019 8.1E5 191.1112 9.8E5 191.1230 4.1E5 191.1343 1.9E5 191.1456 1.2E5 191.1574 4.3E4 192.0735 1.5E5 212.1146 7.9E3 246.1134 6.6E4 257.7062 6.3E3 270.2065 4.9E3 END IONS BEGIN IONS FEATURE_ID=407 PEPMASS=310.1055 SCANS=407 RTINSECONDS=510.17 CHARGE=1+ MSLEVEL=2 MERGED_STATS=12 / 13 (1 removed due to low quality, 0 removed due to low cosine). 49.0702 3.7E3 49.0852 2.5E3 49.5533 2.3E3 50.4455 2.4E3 50.6455 6.5E3 51.0067 2.8E3 51.2500 2.3E3 53.7444 3.9E3 53.7871 3.4E3 54.0377 3.8E3 56.9691 5.8E3 58.6394 3.4E3 60.2690 2.2E3 62.4704 7.9E3 62.5168 3.4E3 62.7679 3.6E3 64.4328 3.0E3 65.0066 3.2E3 65.8363 4.3E3 66.7575 5.6E3 66.9673 2.1E3 67.4563 2.7E3 67.9335 4.3E3 68.0017 2.2E3 68.0631 5.3E3 69.5623 5.8E3 69.9058 6.7E3 70.7297 5.4E3 71.8528 2.4E3 73.1315 2.7E3 73.4011 3.4E3 74.0071 2.2E3 76.4129 5.9E3 77.4598 2.1E3 79.6235 3.7E3 80.1221 4.2E3 80.6725 4.7E3 81.0736 5.9E3 82.3934 4.1E3 82.6129 2.9E3 84.4830 4.2E3 87.9397 2.8E3 88.3050 6.4E3 91.2175 3.7E3 92.2973 2.8E3 101.4904 4.9E3 103.6394 4.1E3 105.5498 2.5E3 109.5576 3.4E3 111.6654 3.5E3 112.4063 3.0E3 120.0416 2.0E5 120.3847 6.5E3 122.5571 2.3E3 123.1075 2.5E3 123.7517 7.0E3 124.9385 3.1E3 128.5806 2.7E3 130.7751 4.7E3 136.0439 2.1E3 142.5704 4.9E3 145.4341 4.2E3 150.0939 2.4E3 152.6160 4.1E3 163.0746 6.7E3 165.6185 3.7E3 170.3094 3.0E3 173.5061 4.4E3 173.5258 1.8E4 173.5348 2.6E5 173.5429 4.2E3 174.3187 4.1E3 175.3362 2.8E3 179.0784 6.0E3 179.2037 3.7E3 184.6666 2.3E3 191.0700 2.3E5 194.9328 4.9E3 195.0442 1.2E4 214.4281 2.5E3 225.0561 2.3E3 275.2114 4.6E3 277.3925 2.5E3 287.8205 2.1E3 288.4825 4.2E3 310.1053 4.3E5 313.7245 6.3E3 317.2225 4.9E3 END IONS BEGIN IONS FEATURE_ID=408 PEPMASS=304.1185 SCANS=408 RTINSECONDS=512.168 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 50.2857 2.7E3 52.4102 2.6E3 53.0052 2.5E3 53.0436 2.6E3 55.1048 2.2E3 56.3585 2.5E3 59.2426 2.2E3 59.8047 2.1E3 61.8677 2.5E3 62.9091 2.5E3 65.0385 3.1E3 69.9450 2.4E3 87.3698 2.4E3 91.0541 2.0E5 98.0600 2.4E4 103.0542 4.3E3 119.0394 3.9E3 119.0490 6.5E5 119.0565 4.2E3 119.0592 1.2E4 127.7641 2.6E3 127.8092 2.4E3 129.0341 3.8E3 131.0484 3.1E3 132.0204 1.0E4 133.0273 2.4E3 136.0520 2.6E3 136.2263 2.8E3 145.0285 3.0E3 147.0439 8.4E5 149.0231 6.4E3 157.0395 7.8E4 164.0467 1.2E4 173.5303 1.1E4 173.5351 2.5E4 175.0039 3.6E3 175.0390 1.8E6 176.0462 4.1E3 179.0703 4.9E4 179.0863 2.8E3 180.8884 2.2E4 188.0635 3.7E3 190.8730 7.1E3 191.0704 2.6E3 192.0420 8.7E3 207.0653 9.0E5 207.0978 3.5E3 208.8832 7.8E4 226.8937 5.6E4 256.4912 2.9E3 END IONS BEGIN IONS FEATURE_ID=409 PEPMASS=207.0655 SCANS=409 RTINSECONDS=512.317 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 42.3157 2.2E3 44.2245 2.2E3 45.0334 6.1E3 46.1742 2.4E3 46.9021 2.2E3 47.6328 2.4E3 47.8546 2.7E3 48.2165 2.2E3 48.9931 2.2E3 49.0663 2.4E3 54.7254 2.5E3 54.7291 2.1E3 56.8838 2.4E3 57.9347 1.3E4 58.5027 2.6E3 62.2982 2.3E3 65.0383 2.0E4 73.0281 4.7E3 74.9377 5.0E3 77.0384 5.2E3 79.0538 2.7E3 80.0618 3.1E3 84.9455 1.5E4 89.0383 1.8E4 91.0539 4.2E5 91.0608 6.0E3 92.4687 2.3E3 95.0486 3.7E3 97.9533 2.0E4 98.9611 4.6E4 101.0380 2.5E3 102.9560 2.4E4 104.0254 2.7E3 107.0491 6.0E3 108.0563 3.1E3 109.9381 2.6E3 115.9638 3.5E5 116.9716 1.4E5 117.0329 3.5E3 118.0412 1.1E4 119.0392 6.8E3 119.0488 3.0E5 121.0274 2.7E3 123.0802 2.4E3 126.9339 2.5E3 126.9663 3.5E3 129.0331 1.5E4 132.0203 3.7E4 133.9743 2.1E4 135.0437 1.8E4 135.7229 2.6E3 136.0517 1.2E4 136.7120 2.5E3 145.0278 1.3E4 146.0361 8.6E3 147.0438 1.7E5 147.4393 2.3E3 149.0232 3.1E4 155.9971 3.2E3 157.0396 2.5E4 162.0322 2.9E3 164.0471 1.8E4 171.8617 2.3E3 173.5241 2.3E4 173.5349 2.3E4 173.5433 9.7E3 174.0312 7.8E3 175.0387 3.4E4 179.0705 2.2E4 187.4260 2.6E3 191.3735 2.2E3 207.1745 2.5E3 END IONS BEGIN IONS FEATURE_ID=410 PEPMASS=339.1595 SCANS=410 RTINSECONDS=512.603 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 5 (0 removed due to low quality, 0 removed due to low cosine). 51.0694 2.2E3 53.7235 2.2E3 55.4288 2.3E3 60.0610 2.3E3 60.5072 2.2E3 65.3547 2.1E3 70.6270 2.1E3 73.2583 2.4E3 77.0392 2.8E3 79.0542 2.0E4 80.3636 2.4E3 83.2896 2.1E3 84.2608 2.3E3 87.9422 2.4E3 91.0541 2.3E4 93.0697 7.4E3 95.0491 6.6E3 99.3829 3.1E3 100.3395 2.8E3 101.5568 2.5E3 103.0541 2.9E4 103.4425 2.7E3 105.0697 6.0E4 107.0491 3.3E4 109.2186 2.7E3 115.0547 4.8E3 117.0696 3.5E4 118.3298 2.3E3 118.7145 2.9E3 119.0494 1.1E4 121.0646 1.2E5 123.0802 1.7E4 126.4411 2.3E3 129.0701 5.9E3 131.0490 8.2E4 133.0529 3.1E3 133.0647 5.1E5 133.0763 4.1E3 133.4564 2.5E3 134.4168 2.4E3 135.0319 3.1E3 135.0439 1.4E6 135.0680 3.4E3 135.0804 1.6E4 136.0518 1.2E5 137.0595 3.3E4 139.0747 2.5E3 143.0491 1.2E4 143.0858 3.6E3 143.1088 2.3E3 145.0646 9.2E4 146.0725 8.6E4 147.0803 8.0E4 147.8409 3.1E3 149.0595 6.5E4 149.0959 8.5E3 150.0674 7.3E4 151.0752 1.0E6 157.0648 3.7E4 157.5045 2.4E3 158.0733 2.7E3 159.0803 1.1E4 160.0526 3.3E3 160.0881 1.4E4 161.0595 7.5E4 162.0676 3.3E4 162.7819 2.4E3 162.9872 2.8E3 163.0754 1.2E5 164.0838 2.9E3 165.0910 2.0E5 166.8484 2.4E3 167.4245 2.5E3 171.0804 3.2E4 173.0597 1.6E4 173.5292 5.8E4 173.5435 9.0E3 174.0671 1.5E4 175.0757 2.2E4 176.0833 3.0E4 177.0732 5.1E3 177.0911 7.8E5 177.1079 6.1E3 177.6229 2.4E3 179.1062 6.9E3 179.7144 2.3E3 185.0603 2.5E3 187.0755 3.6E4 188.0835 1.5E4 189.0911 8.2E4 190.1001 3.9E3 191.1068 5.0E4 201.0910 4.6E4 202.0988 2.6E4 203.1066 8.2E4 209.1377 2.7E3 215.1064 3.8E3 217.1229 2.0E4 246.8864 6.9E3 247.1104 3.0E3 251.1053 2.4E3 276.1137 2.7E3 277.1228 4.2E3 278.1305 3.7E4 279.1382 2.6E3 281.1157 3.7E3 294.1259 9.4E3 296.4121 2.7E3 307.1330 7.0E3 308.1404 1.0E4 309.1501 1.1E4 318.6784 2.8E3 321.1494 6.0E3 324.1357 8.4E4 339.1575 2.9E3 END IONS BEGIN IONS FEATURE_ID=411 PEPMASS=276.1599 SCANS=411 RTINSECONDS=514.565 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 5 (0 removed due to low quality, 0 removed due to low cosine). 46.1321 2.1E3 46.5711 2.3E3 48.2629 2.2E3 50.5669 2.1E3 53.4301 2.5E3 56.0053 2.1E3 58.6666 2.7E3 63.6670 2.1E3 64.3031 2.4E3 67.0921 2.6E3 67.5775 2.3E3 67.7314 2.4E3 69.0695 1.2E5 71.3803 2.3E3 73.0281 5.4E4 74.0959 2.2E3 78.0574 2.3E3 78.8570 2.5E3 79.9755 2.3E3 84.0804 3.1E4 86.0961 6.8E4 88.9415 2.7E3 98.6266 2.3E3 105.0722 9.6E3 106.9366 2.2E3 109.4213 2.4E3 112.0754 1.3E5 115.0936 3.8E3 119.0486 2.7E3 130.7593 2.6E3 132.0567 6.0E3 133.0649 6.5E3 133.1040 2.4E4 137.3242 2.6E3 148.0516 3.8E4 160.0517 2.3E4 161.0592 3.0E3 162.4604 2.5E3 163.0753 2.2E5 173.5264 2.5E4 173.5399 3.6E4 174.4540 2.2E3 176.0469 3.9E4 180.8885 9.5E3 181.3941 2.5E3 181.9882 2.7E3 191.0703 2.1E6 205.1224 8.8E3 208.8829 2.4E4 211.8845 2.5E3 220.5303 2.5E3 226.8937 1.7E4 227.8512 2.6E3 233.8140 2.3E3 276.1598 3.4E4 END IONS BEGIN IONS FEATURE_ID=412 PEPMASS=233.1176 SCANS=412 RTINSECONDS=516.953 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 5 (2 removed due to low quality, 0 removed due to low cosine). 43.0178 1.3E4 45.0335 2.4E4 47.0197 3.8E3 47.0217 2.6E3 48.2765 2.3E3 52.3013 2.2E3 53.4501 2.6E3 57.0335 5.1E4 57.0698 5.4E3 59.0585 2.4E3 67.0542 5.5E4 69.0699 3.7E3 69.6283 2.4E3 75.0437 1.0E4 78.0846 4.5E3 79.0541 2.2E4 81.0696 3.1E3 85.8514 4.1E3 91.0542 3.4E4 95.0490 2.0E4 96.6518 2.3E3 103.0540 1.4E4 105.0698 2.7E4 107.0490 1.1E4 107.1977 4.7E3 108.0572 2.9E3 109.0651 4.1E3 115.0544 5.7E4 116.0622 3.1E3 117.0698 4.3E4 119.0855 8.3E3 121.0647 9.4E4 127.0557 4.6E3 128.0620 1.9E5 129.0318 2.7E3 129.0698 1.7E5 130.0777 2.6E4 131.0491 2.6E4 131.0854 8.9E4 132.0572 8.2E3 133.0649 2.9E4 134.0359 3.1E3 135.0806 2.5E4 136.0520 2.2E4 137.0597 5.3E4 138.0674 2.6E4 139.0753 1.2E4 140.0621 1.4E4 141.0698 1.2E5 142.0421 3.2E3 142.0776 4.6E4 143.0491 5.1E4 143.0855 1.6E5 144.0569 5.3E4 144.0930 1.1E4 145.0516 7.3E3 145.0647 2.7E5 145.1011 2.3E4 145.1140 2.9E3 146.0726 9.2E4 147.0439 1.0E4 147.0801 4.3E4 149.0596 3.2E4 151.0753 2.2E5 152.0620 1.3E4 153.0699 1.3E5 154.0776 7.5E4 155.0604 1.2E4 155.0854 8.4E4 156.0568 5.9E4 157.0647 4.1E5 158.0612 3.6E3 158.0726 3.3E5 158.0874 4.9E3 159.0442 4.9E4 159.0586 3.3E3 159.0804 6.7E5 159.4884 2.4E3 160.0518 1.5E4 160.0882 1.4E5 161.0596 1.2E5 161.0960 2.1E4 162.0675 9.3E4 163.0754 3.7E4 164.0825 9.1E3 165.0909 3.1E4 168.0571 1.0E5 169.0647 3.4E5 170.0727 1.2E5 171.0452 3.1E3 171.0805 4.7E5 171.0943 2.0E3 172.0532 1.5E4 172.0706 3.5E3 172.0883 1.7E6 173.0598 8.7E5 173.0962 1.7E5 173.5241 1.1E4 173.5373 4.2E4 174.0676 2.6E5 174.0857 5.2E3 174.1040 7.3E5 174.1220 3.2E3 175.0755 1.8E5 175.1120 2.9E4 176.0833 1.9E5 177.0550 7.5E3 177.0911 1.9E5 179.4014 2.9E3 181.0631 4.4E3 182.0729 2.3E4 183.0805 1.1E5 183.4664 2.7E3 184.0883 8.2E5 185.0598 3.4E5 185.0961 4.5E4 186.0680 2.3E4 187.0466 4.9E3 187.0754 2.3E5 188.0832 3.6E6 188.1222 7.0E3 189.0910 3.4E5 190.0622 1.5E4 190.0988 2.1E5 191.0691 4.9E3 191.1069 2.1E4 192.0777 3.4E3 199.0754 6.4E4 200.0832 6.1E5 201.0911 3.2E4 202.0809 3.6E3 202.0990 2.9E5 203.0720 5.0E3 203.1068 1.4E6 204.0787 3.1E3 204.1143 1.3E4 205.0860 4.8E4 205.1224 2.4E5 214.0983 2.7E3 215.1067 7.8E5 216.8414 4.4E3 218.0945 6.0E3 233.1172 2.0E5 239.6468 4.4E3 END IONS BEGIN IONS FEATURE_ID=413 PEPMASS=434.2546 SCANS=413 RTINSECONDS=516.996 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 62.4464 2.2E3 68.2326 2.3E3 72.9651 2.4E3 78.6583 2.1E3 84.6943 2.5E3 90.9716 2.7E3 97.0623 2.3E3 99.8145 2.3E3 101.8305 2.4E3 103.7365 2.1E3 109.7545 2.6E3 119.8107 2.4E3 126.0551 5.7E3 141.1139 2.3E3 144.5003 2.4E3 151.0755 1.2E4 157.0871 2.6E3 159.5227 2.3E3 159.5447 2.3E3 173.5246 3.4E4 173.5409 2.8E4 179.4624 2.3E3 197.4753 2.2E3 199.0540 2.4E3 201.0984 2.1E3 203.1065 1.5E4 227.9214 2.4E3 232.0054 2.3E3 233.1172 7.4E4 235.2630 2.6E3 252.4421 2.6E3 264.1577 2.6E3 275.9996 2.9E3 308.1404 2.4E3 313.8029 2.6E3 328.3606 2.7E3 END IONS BEGIN IONS FEATURE_ID=414 PEPMASS=355.1544 SCANS=414 RTINSECONDS=523.641 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 14 (8 removed due to low quality, 0 removed due to low cosine). 51.9466 2.2E3 51.9658 2.3E3 52.6781 2.3E3 60.8545 2.5E3 61.7455 2.3E3 63.4010 2.1E3 63.9355 2.4E3 68.9940 2.3E3 70.0369 2.6E3 70.8373 2.5E3 71.0490 6.6E4 71.1730 2.2E3 72.8608 2.1E3 75.0442 6.8E3 79.4247 2.6E3 91.0542 2.5E4 91.4210 2.6E3 94.0412 6.0E3 95.0493 2.4E3 97.2820 2.3E3 98.2524 2.1E3 101.3953 2.4E3 105.4021 2.3E3 105.4696 2.3E3 107.0489 2.6E4 108.0566 2.3E3 108.8546 2.5E3 109.0646 4.5E4 111.0439 5.7E3 117.0698 5.5E3 117.4394 2.3E3 119.0487 1.1E4 119.0849 2.7E3 120.3332 2.1E3 121.0646 2.4E4 122.0361 2.8E4 125.0595 7.6E3 127.6940 2.1E3 128.0617 3.2E3 129.0698 4.3E4 131.0491 2.3E4 131.0858 3.4E3 131.9810 2.3E3 132.8494 2.4E3 133.0284 5.9E4 133.2846 2.4E3 135.0441 2.2E4 136.0518 1.1E5 136.8270 2.4E3 137.0502 2.4E3 137.0596 1.4E6 139.0751 2.9E4 143.0490 2.1E4 143.0858 6.3E3 144.0575 3.7E3 145.0647 2.3E4 146.0724 2.6E3 147.0445 5.7E3 147.0803 2.7E3 148.0516 3.4E3 149.0595 6.2E4 151.0386 2.5E4 151.0753 1.0E6 151.0866 2.9E3 153.0541 9.2E3 157.0648 8.0E4 158.0725 3.9E4 158.9876 2.5E3 159.0810 7.0E3 160.0520 3.8E4 161.0596 2.8E4 162.0667 3.0E3 163.0753 6.4E4 165.0547 6.3E4 165.0909 6.7E4 167.0699 6.1E3 171.0807 1.7E4 172.0884 9.5E4 173.0597 2.3E4 173.0975 2.9E3 173.5240 2.6E4 173.5376 6.7E4 174.0676 1.2E5 175.0755 2.8E5 176.0853 3.2E3 177.0547 1.1E5 177.0911 6.5E4 178.0586 1.4E4 179.0703 1.3E5 181.0645 6.3E3 185.0590 6.9E3 186.0674 2.7E4 187.0754 2.4E5 188.0832 2.4E5 189.0910 2.9E5 190.0985 2.6E4 190.6228 2.3E3 191.0702 8.9E4 191.1066 2.9E4 193.0860 3.5E4 194.7189 2.5E3 194.7634 2.6E3 199.0753 3.2E4 201.0911 8.4E5 201.1129 1.6E4 202.0791 3.1E3 202.0983 3.8E4 203.0857 5.3E3 203.1067 2.6E5 204.8885 4.3E3 205.0858 1.3E4 205.9473 2.6E3 210.0680 4.7E3 211.0748 8.8E3 213.0911 8.7E4 214.1012 2.6E3 214.8737 1.8E4 215.0857 5.3E3 215.1074 2.6E3 216.0776 7.3E3 217.0860 6.3E4 218.8686 1.3E4 219.0807 1.2E4 219.1038 3.1E3 220.0880 2.6E3 221.0940 2.6E3 224.0828 1.5E4 225.0911 1.8E5 226.0626 3.0E3 227.0693 1.2E4 231.0795 2.7E4 231.1017 2.4E5 233.0526 2.3E3 233.0962 8.1E4 234.1041 2.8E4 239.0704 5.3E4 239.1064 6.6E3 240.0782 1.3E4 241.0860 2.3E5 242.0942 1.6E4 244.0880 1.1E4 245.0958 5.5E4 245.1400 2.7E3 246.1037 1.1E5 247.0751 6.6E4 247.1127 5.0E3 248.0828 1.6E4 249.0912 2.0E4 250.0988 1.5E4 251.0725 2.6E3 251.1064 3.0E4 253.0857 1.3E5 254.0627 1.5E4 254.0936 6.8E5 254.1247 1.4E4 255.0649 1.1E5 255.1011 6.8E4 257.1154 3.1E3 258.0664 3.3E3 259.0743 1.7E4 260.0820 6.2E3 260.4779 2.4E3 261.0907 2.3E5 262.0986 2.4E5 263.0739 2.4E4 263.1064 9.1E4 264.0774 7.2E3 264.1132 2.2E4 265.0885 2.1E4 265.1223 6.6E4 266.0946 2.8E3 267.1020 3.1E4 267.1377 1.1E4 268.1090 2.6E4 269.0478 4.8E3 269.0807 7.4E5 269.1075 4.2E3 269.1159 3.6E3 270.0546 4.7E3 270.0885 5.3E5 270.1208 6.0E3 272.8803 2.8E3 273.0911 7.0E4 274.0988 2.2E5 275.0704 5.6E4 275.1066 1.7E5 276.0787 7.1E3 276.1146 7.8E3 277.0877 4.0E4 277.1223 2.8E5 278.0938 8.2E4 278.1259 5.8E3 279.1016 1.9E5 280.1095 2.5E4 281.0816 1.4E4 281.1151 7.7E3 281.5390 3.2E3 282.0885 8.3E4 283.0964 2.3E4 284.1044 1.8E6 284.1321 5.0E3 284.1428 3.9E3 285.1123 4.4E5 285.1483 4.1E3 289.0858 3.4E4 289.1214 2.5E4 290.0938 2.6E5 290.8899 2.6E3 291.1017 6.1E5 291.1388 5.6E3 292.0750 2.7E3 292.1095 2.1E4 293.0820 1.6E4 293.1174 2.3E5 294.0905 4.2E3 294.1253 1.6E5 295.0962 1.0E5 295.1309 2.6E4 296.1042 2.4E4 296.1392 3.2E3 297.1123 5.0E5 297.1501 5.3E3 298.1195 1.1E4 304.1093 1.3E4 305.0770 5.6E3 305.1173 6.9E5 305.1476 2.5E3 305.1584 3.2E3 306.1252 7.0E5 307.0589 4.2E3 307.0966 3.4E5 307.1343 7.9E3 308.1047 2.8E4 308.9005 6.8E4 309.1125 6.1E4 310.0793 4.9E3 310.1199 4.0E5 311.1280 7.7E4 319.1327 3.1E4 321.1123 5.2E4 322.1199 3.1E5 324.1354 1.5E4 325.1057 3.1E3 325.1432 9.5E4 337.1432 1.8E5 355.1532 2.8E3 END IONS BEGIN IONS FEATURE_ID=415 PEPMASS=312.1212 SCANS=415 RTINSECONDS=524.52 CHARGE=1+ MSLEVEL=2 MERGED_STATS=7 / 7 (0 removed due to low quality, 0 removed due to low cosine). 48.5759 2.2E3 52.4638 2.2E3 53.4598 2.5E3 53.5886 2.0E3 54.0216 3.0E3 55.2701 2.7E3 55.9420 2.5E3 61.2105 2.0E3 67.0504 2.2E3 69.0697 3.0E3 70.7462 2.4E3 72.8426 2.1E3 74.4243 2.2E3 77.7304 2.2E3 78.7095 2.1E3 79.2457 2.2E3 82.9041 2.3E3 93.6971 2.4E3 94.1089 2.7E3 94.9957 2.4E3 97.7265 2.1E3 98.5913 2.7E3 101.2819 2.8E3 104.0605 2.1E3 112.0537 2.3E3 112.0755 7.4E3 112.1851 2.4E3 112.3974 2.6E3 117.7734 2.3E3 120.3650 2.5E3 122.0575 1.5E4 123.7249 2.4E3 125.0171 2.7E3 128.4594 2.5E3 130.6900 2.5E3 133.0123 2.5E3 134.7034 2.5E3 140.6333 2.2E3 141.0690 2.3E3 145.4997 2.6E3 155.6104 2.3E3 169.0646 6.0E3 173.5260 6.3E4 173.5420 3.5E4 191.0696 3.5E3 218.0699 3.2E3 224.2785 2.6E3 228.9928 2.3E3 231.4903 2.2E3 251.1286 2.8E3 251.2878 2.6E3 262.6259 2.6E3 278.8423 2.3E3 284.3403 2.3E3 286.6907 2.5E3 312.1209 6.4E4 END IONS BEGIN IONS FEATURE_ID=416 PEPMASS=290.1392 SCANS=416 RTINSECONDS=524.705 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 6 (0 removed due to low quality, 0 removed due to low cosine). 47.7662 4.9E3 47.7676 4.1E4 50.7570 2.2E3 52.0279 2.2E3 52.1454 2.2E3 52.3102 2.1E3 53.6914 2.1E3 54.7082 2.3E3 59.1438 2.3E3 63.5296 2.3E3 79.0541 3.3E4 79.1853 2.3E3 83.4400 2.4E3 86.6327 2.3E3 87.2104 2.5E3 90.0916 2.8E3 90.5867 2.4E3 91.0542 3.3E4 100.0757 3.7E4 101.9244 2.1E3 103.0541 6.4E4 105.0334 1.8E4 105.0698 9.5E4 108.0543 2.1E3 111.4639 2.3E3 111.9762 2.2E3 112.4293 2.5E3 115.0543 2.4E3 118.0416 1.5E4 118.5248 2.3E3 119.0491 5.5E4 120.0570 4.3E4 122.9821 2.4E3 128.0462 2.3E3 132.0569 1.2E5 133.0285 4.7E4 133.0647 1.1E5 135.0803 4.1E4 135.9671 3.0E3 146.0364 2.2E4 147.0441 5.1E4 148.0518 4.0E5 152.4822 3.2E3 160.0517 2.1E5 161.0595 5.3E4 163.0592 1.7E4 163.0753 1.9E6 168.9011 2.4E3 173.5296 8.1E4 173.5433 2.4E4 175.0395 3.0E3 176.0469 2.6E5 191.0183 6.9E3 191.0297 5.6E4 191.0703 9.2E6 191.1019 1.5E4 191.1113 4.3E4 192.0732 2.9E3 205.0499 6.0E3 218.0565 2.8E3 219.5424 2.6E3 235.8703 2.9E3 235.9046 2.4E3 276.7740 2.8E3 288.7917 2.4E3 298.2210 3.3E3 END IONS BEGIN IONS FEATURE_ID=417 PEPMASS=208.0439 SCANS=417 RTINSECONDS=527.941 CHARGE=1+ MSLEVEL=2 MERGED_STATS=7 / 7 (0 removed due to low quality, 0 removed due to low cosine). 41.9989 2.5E3 43.5056 2.2E3 49.2153 2.3E3 50.6305 2.3E3 56.7315 2.5E3 57.1722 2.3E3 58.7291 2.3E3 59.5123 2.6E3 59.6785 2.4E3 59.7155 2.3E3 59.9775 2.4E3 62.3521 2.2E3 65.6049 2.6E3 69.0922 2.7E3 69.8968 2.2E3 70.6314 2.4E3 74.6316 2.3E3 78.8735 2.5E3 84.9593 7.4E4 87.3570 2.9E3 91.0541 2.5E3 91.4286 2.2E3 95.1118 2.2E3 96.1833 2.7E3 102.9202 2.4E3 102.9696 4.9E3 109.7755 2.4E3 110.7536 2.7E3 111.3582 2.2E3 115.2060 2.5E3 115.9638 1.2E4 116.1051 2.4E3 116.9610 5.6E3 118.7829 2.4E3 123.9658 2.5E3 127.2121 2.3E3 130.5461 2.3E3 139.3409 2.4E3 141.8765 2.2E3 144.8033 2.5E3 149.0584 2.7E3 149.8080 2.3E3 157.1596 2.5E3 165.0435 4.4E3 165.6033 2.6E3 170.6631 2.4E3 173.5275 1.0E5 173.5416 4.1E4 184.9689 3.5E3 257.8578 2.5E3 282.0181 3.0E3 293.7610 2.7E3 297.1691 2.7E3 356.1404 3.0E3 END IONS BEGIN IONS FEATURE_ID=418 PEPMASS=436.0645 SCANS=418 RTINSECONDS=528.169 CHARGE=1+ MSLEVEL=2 MERGED_STATS=1 / 1 (0 removed due to low quality, 0 removed due to low cosine). 55.8912 2.4E3 68.8669 2.5E3 72.5220 2.4E3 98.8213 2.4E3 139.6370 2.6E3 173.5257 7.4E3 183.1141 2.6E3 190.0618 5.6E3 191.0661 7.8E3 193.0856 4.9E3 194.0906 5.3E3 205.0489 4.9E3 206.0536 8.3E3 221.0564 4.0E3 221.0809 8.4E4 222.0844 1.2E5 222.1093 5.3E3 223.0882 7.0E3 237.0700 3.9E3 273.1313 1.0E4 274.1081 1.2E4 275.1110 4.0E4 289.1316 7.6E3 290.1345 4.0E4 302.1026 5.0E3 303.1059 1.9E4 317.1266 7.6E3 318.1295 5.0E4 335.1277 2.4E3 434.3537 2.9E3 END IONS BEGIN IONS FEATURE_ID=419 PEPMASS=207.0437 SCANS=419 RTINSECONDS=528.273 CHARGE=1+ MSLEVEL=2 MERGED_STATS=1 / 2 (1 removed due to low quality, 0 removed due to low cosine). 42.8969 2.2E3 43.0543 2.3E3 57.9346 3.5E3 74.9372 3.2E3 91.5989 2.1E3 97.9532 5.7E3 98.9610 1.1E4 102.9559 5.0E3 115.9638 1.0E5 116.9716 3.1E4 133.9742 6.5E3 134.5491 2.4E3 137.8294 2.2E3 147.5058 2.6E3 164.0424 4.9E3 173.5359 4.6E3 190.9653 2.4E3 192.0374 3.6E3 207.1753 2.7E3 END IONS BEGIN IONS FEATURE_ID=420 PEPMASS=422.0549 SCANS=420 RTINSECONDS=528.439 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 2 (0 removed due to low quality, 0 removed due to low cosine). 61.4475 2.8E3 62.1763 2.4E3 64.8326 2.3E3 68.0840 3.1E3 72.5348 2.3E3 87.8647 2.4E3 89.5733 2.3E3 100.1854 2.6E3 114.9167 2.6E3 118.2989 2.6E3 149.6662 3.3E3 149.6810 4.1E3 149.6889 1.3E4 149.6976 4.3E3 168.3426 2.4E3 172.9783 3.7E3 173.5315 1.5E4 181.0858 1.6E4 186.9575 1.2E4 221.0814 1.6E4 238.4325 2.4E3 241.9905 2.8E3 246.5742 2.8E3 304.9990 3.5E3 308.3838 3.0E3 320.0242 8.8E3 335.0464 1.4E4 338.8463 2.4E3 388.6261 3.1E3 END IONS BEGIN IONS FEATURE_ID=421 PEPMASS=760.3339 SCANS=421 RTINSECONDS=528.46 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 2 (0 removed due to low quality, 0 removed due to low cosine). 70.0648 2.9E5 86.0962 2.7E4 87.4090 2.2E3 89.1825 2.6E3 89.8657 2.5E3 95.1867 2.5E3 97.0759 3.2E3 98.7970 2.6E3 115.0862 3.3E4 118.0647 7.2E3 120.0707 3.3E3 120.0804 1.6E5 124.9996 1.5E4 125.0706 2.7E4 136.0756 7.0E3 146.0598 3.9E4 146.6981 2.2E3 147.6681 2.3E3 162.0910 1.2E4 164.0709 9.9E3 172.1120 4.6E4 173.5202 3.1E3 173.5300 3.2E4 173.5387 1.4E4 174.0548 8.2E3 182.0810 1.0E4 184.0458 2.9E3 184.0733 3.3E5 185.0767 4.6E4 186.0779 1.5E4 187.1235 2.9E3 188.4652 2.5E3 190.0623 2.7E3 215.1180 8.3E3 216.1259 4.8E4 217.1336 3.6E4 221.0809 2.3E4 236.1075 1.2E4 243.1132 3.4E4 265.0847 4.7E3 265.1326 1.0E4 277.1342 1.1E4 282.1131 2.3E4 289.1321 6.3E3 293.1306 1.6E4 296.3721 2.5E3 309.1242 3.3E4 317.1264 2.5E4 329.1508 7.1E3 339.1335 3.2E3 355.1307 9.6E3 385.6527 2.4E3 417.1298 2.5E3 417.1836 2.1E4 429.1825 9.3E3 458.2100 4.0E3 477.9640 2.5E3 502.1989 4.2E4 543.2609 4.3E3 END IONS BEGIN IONS FEATURE_ID=422 PEPMASS=464.0596 SCANS=422 RTINSECONDS=528.56 CHARGE=1+ MSLEVEL=2 MERGED_STATS=1 / 1 (0 removed due to low quality, 0 removed due to low cosine). 89.3581 2.7E3 120.3530 2.2E3 121.8007 2.3E3 173.5331 3.2E4 177.0550 2.7E3 181.0878 2.4E3 190.0622 1.1E4 191.0660 3.3E3 193.0852 9.7E3 194.0912 5.9E3 195.0975 3.5E3 205.0491 7.7E3 206.0545 7.9E3 221.0808 1.4E5 222.0843 1.0E5 223.0888 2.9E3 236.0672 4.5E3 237.0706 4.5E3 272.1265 4.7E3 273.1324 8.4E3 274.1074 2.1E4 275.1110 3.8E4 289.1315 1.5E4 290.1344 3.9E4 302.1019 7.0E3 303.1060 1.9E4 317.1258 1.7E4 318.1292 5.3E4 321.0264 2.5E3 336.0488 7.8E3 END IONS BEGIN IONS FEATURE_ID=423 PEPMASS=426.0669 SCANS=423 RTINSECONDS=528.666 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 2 (0 removed due to low quality, 0 removed due to low cosine). 68.7647 2.2E3 69.6672 2.4E3 78.7807 2.4E3 89.0012 2.8E3 96.8536 2.5E3 110.7516 2.8E3 128.3629 2.3E3 150.2023 2.2E3 162.0674 2.3E4 163.0391 3.4E3 168.9965 2.6E3 173.5351 3.7E4 178.0625 1.6E4 189.0547 1.2E4 190.0624 1.3E5 191.0335 2.2E4 191.0708 1.2E4 193.0860 9.9E4 205.0856 1.3E4 206.0575 4.6E4 220.8858 2.4E3 221.0453 3.6E3 221.0810 5.4E5 221.7955 2.5E3 222.0851 1.1E4 287.3685 2.5E3 354.3951 2.8E3 382.0804 3.5E3 END IONS BEGIN IONS FEATURE_ID=424 PEPMASS=345.0935 SCANS=424 RTINSECONDS=528.776 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 67.2523 2.4E3 67.8676 2.2E3 72.4631 2.0E3 72.6777 2.5E3 74.6668 2.3E3 76.1174 2.7E3 82.6275 2.4E3 84.8658 2.3E3 85.6642 2.6E3 89.2644 2.1E3 130.0416 2.4E3 140.1195 2.4E3 147.0441 1.9E4 149.6877 5.6E3 150.0674 2.6E3 151.1216 2.2E3 153.2336 2.5E3 160.0530 2.9E3 161.0600 5.3E3 162.0674 4.9E4 163.0389 2.4E4 163.0753 3.9E3 173.5255 1.7E4 173.5372 2.4E4 174.0309 3.9E3 175.0390 1.4E4 176.0468 1.0E4 177.0545 6.1E3 178.0625 5.2E4 189.0545 2.6E4 190.0429 3.5E3 190.0624 2.8E5 191.0339 5.9E4 191.0680 2.7E4 193.0656 2.7E3 193.0860 2.1E5 194.0896 4.6E3 206.0576 9.8E4 221.0810 1.2E6 222.0845 6.8E4 249.0324 3.9E4 267.0428 5.7E4 356.0226 3.8E3 372.0555 6.3E3 375.0407 1.1E4 397.1961 2.5E3 414.5987 2.4E3 469.1103 3.2E3 520.0839 2.4E3 629.2126 2.4E3 680.0906 2.6E3 END IONS BEGIN IONS FEATURE_ID=425 PEPMASS=463.0564 SCANS=425 RTINSECONDS=528.856 CHARGE=1+ MSLEVEL=2 MERGED_STATS=8 / 8 (0 removed due to low quality, 0 removed due to low cosine). 58.7344 2.2E3 60.5699 2.3E3 62.2337 2.4E3 66.0394 2.4E3 66.7162 2.1E3 69.9997 2.3E3 71.0725 2.1E3 71.1396 2.5E3 71.9894 2.6E3 72.3320 2.9E3 74.1712 2.8E3 75.6361 2.6E3 76.9002 2.3E3 79.2706 2.2E3 81.0336 1.3E4 81.2545 2.6E3 88.0582 2.5E3 88.1935 2.4E3 93.4462 2.1E3 95.9074 2.1E3 96.0443 2.4E4 97.5205 2.0E3 98.0601 7.0E3 100.2269 2.5E3 103.2090 2.5E3 104.1997 2.4E3 104.3321 2.4E3 112.1032 2.4E3 112.3050 2.4E3 114.0807 2.6E3 116.4865 2.5E3 117.0685 2.2E3 120.1480 2.9E3 121.5198 2.5E3 124.9301 2.3E3 128.0871 2.3E3 131.2690 2.9E3 135.9315 2.3E3 141.2564 2.2E3 143.6214 2.3E3 144.7543 2.6E3 147.0436 2.2E3 147.0809 2.6E3 149.0587 2.9E3 149.6926 5.8E3 158.0350 2.6E3 162.0675 3.4E4 163.0769 5.1E3 168.0770 5.3E3 168.7355 2.7E3 169.4518 2.7E3 171.9708 6.5E3 172.9777 4.2E4 173.5304 1.1E5 173.5410 2.1E4 173.9859 3.7E3 175.0386 2.9E3 177.0548 6.8E4 178.0626 1.9E4 178.1080 2.6E3 179.0703 3.2E4 181.0858 9.5E4 186.4349 2.2E3 186.9571 7.7E4 189.0545 2.2E4 189.6450 2.9E3 190.0624 2.0E5 191.0343 3.7E4 191.0703 4.7E4 192.0778 7.1E4 193.0859 1.8E5 194.0937 1.1E5 195.0641 1.1E4 195.1027 3.1E3 205.0495 4.0E5 206.0572 7.6E4 206.0774 3.2E3 220.0730 1.0E5 220.0947 9.2E3 221.0808 5.2E6 221.0999 1.0E4 222.0875 1.5E5 222.1093 3.0E3 222.1859 2.5E3 234.0763 5.9E4 236.0679 1.5E5 237.1615 2.3E3 246.1129 3.2E4 255.9656 2.4E3 256.0049 2.8E3 257.0065 2.5E3 257.5792 2.2E3 258.1126 3.6E4 260.1282 4.8E4 261.1356 2.5E4 262.0161 3.0E3 269.9853 3.2E3 270.0760 9.8E3 271.0290 2.5E3 272.1280 3.3E5 273.0447 2.6E3 274.0725 2.2E4 274.1074 1.6E6 274.1422 2.1E4 274.1574 3.5E3 275.2202 3.0E3 286.1078 5.7E4 288.1238 3.2E3 289.0769 3.2E3 289.0937 9.8E3 289.1308 1.4E6 289.1592 6.1E3 289.1698 1.1E4 293.2161 2.4E3 297.9784 2.7E3 299.9971 2.8E3 302.0621 2.9E3 302.1023 7.5E5 302.1358 2.4E3 302.1420 7.1E3 305.0002 1.5E4 307.0185 3.0E3 317.0825 9.5E3 317.1256 1.8E6 317.1695 2.0E4 319.0137 4.0E3 320.0227 7.6E4 321.0258 2.4E3 335.0464 2.3E5 350.0698 3.6E4 351.7005 2.9E3 361.0302 2.8E3 363.0408 7.7E4 376.0495 3.5E3 378.0656 4.2E4 440.9575 2.6E3 END IONS BEGIN IONS FEATURE_ID=426 PEPMASS=435.0615 SCANS=426 RTINSECONDS=528.89 CHARGE=1+ MSLEVEL=2 MERGED_STATS=8 / 8 (0 removed due to low quality, 0 removed due to low cosine). 57.0403 2.4E3 57.9131 2.2E3 58.0549 2.6E3 58.8685 4.6E3 61.1539 2.8E3 62.6123 2.4E3 65.7743 2.4E3 66.4020 2.4E3 66.4162 2.2E3 68.3325 2.4E3 69.9514 2.1E3 69.9847 2.6E3 71.5864 2.2E3 73.3384 2.3E3 74.7777 2.2E3 77.0559 2.3E3 80.8800 2.8E3 81.0333 2.4E4 81.1116 2.3E3 81.8605 2.5E3 81.9953 2.4E3 82.0771 2.3E3 82.6364 2.4E3 83.4642 2.5E3 85.4497 2.3E3 88.8499 2.5E3 92.7646 2.4E3 93.7986 2.6E3 96.0442 1.5E4 96.1919 2.4E3 96.2327 2.4E3 98.0602 7.4E3 98.4511 2.4E3 100.2693 2.7E3 100.4267 2.3E3 107.3644 2.5E3 112.9663 2.5E3 113.4211 2.3E3 113.7368 2.5E3 117.3638 2.7E3 119.1030 2.3E3 120.3158 2.5E3 147.0436 3.0E3 151.4472 2.5E3 151.9128 2.7E3 152.8594 2.6E3 153.2533 2.2E3 161.0607 3.0E3 162.0675 4.9E4 163.0395 1.1E4 168.0769 2.8E3 173.5283 1.2E5 173.5443 2.4E4 175.0390 1.8E4 176.0463 6.0E3 177.0548 7.1E4 178.0622 3.6E4 179.0701 2.8E4 187.7707 2.4E3 189.0547 4.4E4 190.0624 3.6E5 190.0809 4.6E3 191.0338 6.2E4 191.0688 9.8E4 192.0781 7.2E4 193.0861 2.9E5 194.0930 1.4E5 195.0649 9.1E3 195.1007 3.1E3 200.2941 2.5E3 203.4987 2.3E3 205.0496 4.1E5 206.0573 1.3E5 207.0630 8.8E3 214.0285 8.7E3 220.0733 1.2E5 220.0946 1.3E4 221.0307 1.0E4 221.0809 5.9E6 221.1302 4.4E3 222.0855 3.6E5 222.3596 2.2E3 233.8663 2.5E3 234.0767 5.3E4 235.6414 2.6E3 236.0679 1.4E5 246.1130 2.5E4 250.9996 2.9E4 258.1124 3.2E4 260.1279 5.2E4 261.1356 3.0E4 266.0230 2.2E4 270.0764 1.3E4 272.1281 3.2E5 273.1366 3.0E3 274.0720 1.5E4 274.1075 1.6E6 274.1420 1.1E4 274.1581 3.1E3 278.9950 7.6E4 286.1072 6.5E4 288.1215 3.2E3 289.0939 8.4E3 289.1309 1.4E6 289.1692 6.9E3 302.0619 8.5E3 302.1024 7.4E5 305.1607 2.7E3 308.2385 2.5E3 315.0189 4.3E4 316.1154 3.8E3 317.0660 1.2E4 317.0831 8.8E3 317.1258 1.7E6 317.1694 1.9E4 318.0435 3.4E3 330.0426 6.2E4 330.0840 2.6E3 333.0294 1.3E4 338.0081 7.2E3 348.0531 7.7E3 358.0364 1.1E4 377.6124 2.9E3 395.9898 2.8E3 432.4557 2.9E3 441.4247 2.4E3 END IONS BEGIN IONS FEATURE_ID=427 PEPMASS=346.0938 SCANS=427 RTINSECONDS=528.952 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 6 (0 removed due to low quality, 0 removed due to low cosine). 67.0240 2.3E3 72.2162 2.1E3 73.1891 2.1E3 73.4074 2.6E3 76.1119 2.8E3 84.8442 2.4E3 85.1042 2.4E3 86.3864 2.6E3 89.0240 2.3E3 90.7860 2.5E3 92.3821 2.2E3 93.1195 2.1E3 93.5534 2.7E3 95.1948 2.2E3 97.4706 2.5E3 99.3122 2.3E3 104.2274 2.1E3 107.6452 2.3E3 108.3148 2.4E3 110.1568 2.1E3 110.8990 2.5E3 111.1717 2.1E3 120.3813 2.4E3 121.0643 2.6E3 123.2803 2.5E3 131.0756 2.6E3 133.0642 2.9E3 134.6268 2.6E3 138.5217 2.2E3 147.0438 3.0E4 149.6840 9.8E3 149.6946 9.5E3 152.0491 2.7E3 154.3428 2.3E3 161.0597 5.4E3 162.0672 8.0E4 163.0386 3.6E4 163.0745 8.1E3 171.3688 2.5E3 173.5271 2.3E4 173.5356 3.8E4 175.0390 2.7E4 176.0469 1.5E4 177.0545 7.2E3 178.0622 8.5E4 189.0540 3.0E4 190.0429 3.4E3 190.0622 3.9E5 191.0335 9.1E4 191.0670 6.5E4 192.0400 3.1E3 193.0674 4.6E3 193.0857 2.9E5 194.0894 3.2E4 206.0573 1.4E5 207.0612 3.7E3 211.9458 2.7E3 221.0808 1.7E6 222.0843 2.0E5 223.0865 4.7E4 232.2604 2.9E3 239.4087 2.4E3 274.1085 8.8E3 280.9966 2.9E3 317.0566 3.4E3 319.0713 2.1E4 321.2934 2.5E3 333.0476 6.1E3 359.0320 2.8E3 360.0370 1.4E4 374.0534 2.0E4 376.0779 2.3E3 389.3996 2.4E3 392.0612 2.7E3 411.1988 2.9E3 422.7998 2.4E3 441.4715 2.4E3 528.9417 2.7E3 589.2762 2.6E3 END IONS BEGIN IONS FEATURE_ID=428 PEPMASS=459.0617 SCANS=428 RTINSECONDS=529.127 CHARGE=1+ MSLEVEL=2 MERGED_STATS=1 / 1 (0 removed due to low quality, 0 removed due to low cosine). 61.0717 2.7E3 81.9173 2.3E3 162.0670 8.0E3 163.0749 2.9E3 167.0031 3.4E3 173.5289 1.4E4 175.0758 3.5E3 176.0830 1.1E4 179.0700 1.5E4 180.9827 9.9E3 181.0856 7.5E3 181.9898 3.0E3 182.9980 1.3E4 189.0554 3.7E3 190.0623 4.8E4 191.0333 6.5E3 191.0701 2.1E4 191.9736 3.2E3 192.9808 3.4E3 193.0857 3.6E4 194.0938 1.0E4 197.0134 1.2E4 197.9848 3.5E3 198.9930 8.6E3 205.0856 8.2E3 206.0575 1.9E4 207.0664 3.3E3 207.1016 3.9E4 210.9936 2.2E4 221.0809 3.9E5 222.0883 2.3E4 229.0036 2.3E4 238.0669 2.7E3 247.0151 3.7E3 310.5525 2.5E3 324.4321 2.8E3 326.0097 3.8E3 327.0178 3.9E3 327.0563 1.4E4 331.0512 1.1E4 334.0382 4.8E3 338.0509 2.7E3 341.0355 3.7E3 342.0791 7.0E3 344.0204 9.1E3 345.0290 3.0E3 349.0608 2.8E3 356.0593 2.1E4 358.0366 4.4E3 359.0460 5.1E4 362.0331 8.3E3 374.0701 7.3E3 377.0561 3.0E4 388.0492 8.4E3 418.0596 2.9E3 END IONS BEGIN IONS FEATURE_ID=429 PEPMASS=420.0594 SCANS=429 RTINSECONDS=529.21 CHARGE=1+ MSLEVEL=2 MERGED_STATS=8 / 8 (0 removed due to low quality, 0 removed due to low cosine). 57.3475 2.2E3 58.2450 2.3E3 59.0936 2.4E3 60.9861 2.4E3 62.2697 2.2E3 62.8543 2.5E3 63.4986 2.5E3 65.9973 2.3E3 67.6253 2.4E3 70.5150 2.3E3 74.2815 2.7E3 78.6605 2.5E3 87.9600 2.2E3 88.2857 2.4E3 92.3413 2.3E3 93.7038 2.4E3 94.4986 2.1E3 97.9121 2.6E3 102.6520 2.2E3 105.3230 2.3E3 105.7703 2.7E3 105.9817 2.3E3 106.2355 2.8E3 112.9429 2.3E3 115.1892 2.5E3 125.3305 2.8E3 135.3821 2.4E3 138.6445 2.6E3 142.1643 2.4E3 147.0804 6.0E3 149.0232 2.5E3 152.7717 2.3E3 152.9724 8.2E3 153.4349 2.3E3 157.7789 2.4E3 162.0673 5.1E3 169.9745 2.3E4 170.9824 9.2E4 171.9903 2.5E4 172.9978 1.1E4 173.5247 2.1E4 173.5349 9.4E4 173.5419 8.7E3 178.0620 2.9E3 180.9780 7.9E3 181.0858 1.7E5 184.9616 1.4E5 190.0623 5.1E4 191.0677 1.1E4 192.0681 2.7E3 193.0858 3.5E4 194.0893 6.0E3 204.8208 2.5E3 206.0579 9.2E3 212.2841 2.6E3 213.8401 2.6E3 221.0809 2.3E5 222.0844 6.6E4 223.0864 7.7E4 225.9763 2.6E3 229.0771 2.4E3 229.4311 2.5E3 232.4762 2.4E3 237.0068 5.7E3 239.9934 1.4E4 243.3525 2.1E3 253.2825 2.6E3 253.9723 1.3E4 254.0100 2.7E3 256.0256 1.2E4 256.8351 2.5E3 259.1283 2.5E3 267.9880 6.2E3 270.0037 1.5E4 271.7592 2.9E3 295.9842 7.1E3 303.0042 4.7E4 317.0182 1.9E4 318.0275 1.2E5 319.0356 2.9E3 329.4114 2.5E3 331.0355 5.0E3 333.0509 1.7E5 346.0222 8.9E3 354.1610 2.6E3 361.0462 6.8E4 379.0603 3.3E3 399.7035 2.6E3 END IONS BEGIN IONS FEATURE_ID=430 PEPMASS=503.1587 SCANS=430 RTINSECONDS=529.292 CHARGE=1+ MSLEVEL=2 MERGED_STATS=1 / 1 (0 removed due to low quality, 0 removed due to low cosine). 85.8794 2.2E3 91.3611 2.4E3 93.9157 2.6E3 102.5340 2.6E3 147.0441 2.9E3 149.6875 7.1E3 149.6988 4.8E3 162.0670 6.6E3 163.0393 4.0E3 173.5334 7.0E3 175.0399 4.0E3 178.0631 4.0E3 187.0438 2.9E3 189.0546 6.5E3 190.0622 6.4E4 191.0339 1.1E4 191.0690 6.5E3 193.0857 5.3E4 206.0574 2.0E4 221.0807 1.1E6 221.1319 8.1E3 222.0842 2.5E4 248.0357 6.9E3 249.0322 2.4E4 266.0447 3.0E3 266.1377 2.3E3 267.0424 3.0E4 340.1135 3.7E3 344.5939 7.5E3 345.0927 2.1E4 357.0293 3.6E3 371.0558 6.8E3 372.0531 1.6E4 375.0410 6.2E3 389.0684 3.0E3 390.0639 1.3E4 467.1080 4.0E3 468.1077 3.8E4 469.0291 5.3E3 469.1051 1.3E5 469.1638 2.4E3 485.1193 2.5E3 486.1189 5.8E3 487.1153 4.0E4 END IONS BEGIN IONS FEATURE_ID=431 PEPMASS=343.1245 SCANS=431 RTINSECONDS=529.294 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 6 (0 removed due to low quality, 0 removed due to low cosine). 51.9112 2.7E3 52.5339 2.2E3 52.7735 2.3E3 53.2835 2.6E3 54.5167 2.8E3 56.2068 2.3E3 60.9711 2.5E3 61.0166 2.6E3 64.9789 2.5E3 73.1740 2.5E3 75.8407 2.3E3 78.4318 2.3E3 84.1678 2.1E3 84.6097 2.2E3 85.4794 2.3E3 91.7002 2.6E3 96.7445 2.6E3 127.8625 2.8E3 131.3258 2.4E3 133.0540 2.8E3 147.4984 2.5E3 149.6839 1.0E4 149.6948 1.1E4 149.7056 3.3E3 155.4704 2.5E3 163.6428 2.5E3 173.5217 2.2E4 173.5367 7.6E4 174.6553 2.5E3 188.2211 2.5E3 207.5538 2.4E3 207.6844 2.3E3 267.4292 2.5E3 277.3464 2.8E3 287.2596 2.7E3 298.7066 2.2E3 343.1237 2.8E3 END IONS BEGIN IONS FEATURE_ID=432 PEPMASS=654.7352 SCANS=432 RTINSECONDS=529.33 CHARGE=1+ MSLEVEL=2 MERGED_STATS=1 / 1 (0 removed due to low quality, 0 removed due to low cosine). 97.8783 2.7E3 116.9995 2.6E3 120.4581 2.9E3 149.6836 6.8E3 149.6956 5.4E3 154.0179 6.2E3 162.0678 3.8E3 172.0277 4.2E3 173.5296 5.4E3 180.3922 2.5E3 190.0624 2.5E4 191.0341 3.4E3 191.0654 4.0E3 193.0859 2.3E4 194.0897 4.0E3 206.0573 5.8E3 221.0810 2.6E5 222.0846 4.8E4 233.0602 1.3E4 239.4126 3.4E3 251.0703 2.0E4 252.0722 3.3E3 274.1073 7.0E3 289.1312 1.2E4 302.1015 4.1E3 317.1262 1.8E4 323.4176 3.3E3 337.1082 2.7E4 337.6089 2.4E4 337.6454 3.0E3 339.7097 2.7E3 346.1144 4.0E3 356.0811 3.5E4 357.0846 1.4E4 374.0912 2.4E4 375.0957 6.1E3 453.1345 5.4E4 453.2010 4.1E3 454.1375 2.9E4 471.1455 9.8E3 472.1458 3.9E3 END IONS BEGIN IONS FEATURE_ID=433 PEPMASS=418.0589 SCANS=433 RTINSECONDS=529.364 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 54.7366 2.3E3 62.4903 2.3E3 63.3803 2.2E3 66.4638 2.3E3 67.4131 2.2E3 68.9007 2.7E3 73.6482 2.6E3 92.6239 2.3E3 99.9058 2.9E3 103.2616 2.4E3 108.2270 2.5E3 110.3922 2.1E3 128.3749 2.6E3 133.0646 2.7E3 146.9861 2.4E3 147.0439 1.2E4 153.9949 1.6E4 159.6009 2.3E3 161.0590 3.8E3 162.0672 5.6E4 163.0391 9.5E3 163.0750 2.3E4 163.9833 2.4E3 167.9746 2.3E3 169.9902 1.8E4 170.9975 6.8E3 173.5227 1.8E4 173.5373 5.5E4 173.5427 3.6E3 174.0316 3.2E3 175.0387 9.0E3 176.0471 8.8E3 176.7469 2.4E3 177.0542 4.6E3 178.0624 5.7E4 181.0858 6.6E4 189.0544 4.5E4 190.0427 4.3E3 190.0623 4.1E5 191.0338 8.0E4 191.0522 2.3E3 191.0702 7.3E4 193.0655 6.9E3 193.0858 3.3E5 197.9847 1.8E4 206.0573 1.5E5 206.4470 2.7E3 215.9228 2.5E3 215.9938 2.5E3 218.7966 2.9E3 221.0809 2.0E6 221.1066 4.4E3 223.0601 3.3E3 248.9823 2.4E3 249.9941 2.9E3 264.0091 2.8E3 273.0455 2.3E3 285.1715 2.7E3 293.0749 2.6E3 298.0161 5.5E3 299.0219 6.3E3 304.0274 3.6E3 311.9972 6.5E3 314.0109 1.3E4 316.0273 5.0E3 318.0415 3.3E3 326.0119 2.9E4 328.0272 2.7E4 328.9976 1.5E4 330.0051 1.2E4 330.0439 3.5E3 331.0502 2.9E4 332.0219 1.3E4 334.0377 5.7E4 344.0216 6.7E4 345.0307 1.1E4 347.0481 3.4E3 349.0621 1.8E4 358.0370 2.8E4 359.0455 9.5E4 359.0917 4.2E3 362.0325 7.6E4 367.8093 2.8E3 376.0478 3.0E3 377.0563 1.5E5 381.6749 2.5E3 END IONS BEGIN IONS FEATURE_ID=434 PEPMASS=317.1269 SCANS=434 RTINSECONDS=529.368 CHARGE=1+ MSLEVEL=2 MERGED_STATS=9 / 9 (0 removed due to low quality, 0 removed due to low cosine). 50.8862 6.6E3 52.4277 1.1E4 53.0386 9.6E4 53.3256 1.0E4 55.2692 4.2E4 55.7228 8.6E3 56.0968 7.1E3 59.2348 2.3E3 59.5498 7.6E3 60.6662 4.8E3 61.7545 8.2E3 62.2012 8.6E3 64.5412 8.3E3 68.6535 2.2E3 68.9570 6.6E3 69.3165 2.9E3 69.6913 8.1E3 70.5155 8.7E3 71.8881 8.1E3 72.8681 9.9E3 72.9529 3.5E3 81.0334 5.0E5 83.1672 4.9E3 86.7273 8.0E3 89.0384 8.5E3 89.6662 2.2E3 91.0543 7.1E4 94.4518 6.3E3 96.0442 9.8E4 98.0600 4.5E5 102.7040 9.2E3 103.0543 3.3E4 103.8067 2.2E3 107.0498 2.7E3 108.9371 5.6E3 113.0886 2.3E3 116.6850 8.3E3 117.0334 1.7E5 118.0652 4.1E4 119.0490 1.1E5 121.0647 6.4E3 126.7604 2.6E3 129.6036 2.3E3 130.0415 6.7E4 131.0490 3.2E4 131.7120 9.6E3 131.9669 3.5E3 132.0570 2.4E4 133.0648 1.1E5 134.0362 5.9E4 135.0441 9.7E4 137.0603 6.6E3 138.4746 3.5E3 145.0287 1.3E5 146.0366 9.8E3 146.0600 3.2E5 147.0441 4.5E5 147.0684 8.3E3 147.4410 2.4E3 148.0519 1.7E4 149.0596 3.6E5 150.0676 2.7E4 151.0750 5.9E4 153.0535 6.7E3 159.0442 9.6E3 159.6004 3.2E3 160.0519 9.8E4 161.0596 2.6E5 162.0315 4.0E4 162.0531 3.4E4 162.0676 1.2E6 163.0390 3.4E5 163.0756 2.1E5 164.0466 3.1E3 165.0908 1.7E4 165.6425 5.2E3 167.0702 3.6E4 168.0779 1.0E4 170.5191 4.0E3 173.5083 9.6E3 173.5234 5.9E4 173.5366 4.5E5 173.5469 6.4E3 174.0312 1.4E5 174.0550 2.6E5 175.0392 3.5E5 176.0470 2.3E5 176.0704 5.3E4 177.0380 2.3E4 177.0547 2.2E6 177.0721 2.5E4 178.0625 1.0E6 178.0860 1.9E5 179.0704 5.2E5 180.1873 1.1E4 188.0466 6.1E4 189.0547 7.0E5 190.0304 1.3E4 190.0624 6.7E6 190.0798 4.8E4 191.0339 1.3E6 191.0565 7.6E3 191.0703 6.8E5 192.0434 2.7E4 192.0781 4.5E5 193.0540 4.7E4 193.0654 5.7E4 193.0860 5.1E6 193.1066 7.2E4 193.4039 1.0E4 194.0938 2.6E5 195.0653 3.6E5 196.8422 8.7E3 201.8690 2.7E3 205.0497 2.3E6 205.0700 1.3E4 206.0351 1.3E4 206.0575 2.5E6 206.0800 1.6E5 207.1514 1.0E4 214.0866 1.4E5 215.7351 1.1E4 216.0642 2.1E4 217.0862 1.2E4 220.0735 5.2E4 221.0163 3.6E3 221.0310 7.9E4 221.0809 2.4E7 221.1000 4.0E4 221.1321 4.3E4 222.0760 4.0E4 231.0891 1.3E5 234.0761 6.4E5 236.0679 1.6E5 238.0863 2.7E3 239.0937 4.2E4 242.0810 2.2E5 242.1069 4.0E3 243.0891 3.2E4 244.0973 1.6E4 246.1123 4.3E5 256.0964 6.7E4 257.1039 2.1E4 258.1127 3.0E4 259.0843 3.5E3 260.1286 8.2E3 265.8239 2.6E3 270.0750 2.0E4 271.0827 3.9E4 272.0938 4.8E3 272.1283 5.4E5 274.0725 1.2E4 274.1076 9.0E6 286.1075 1.1E5 288.1232 3.1E4 289.1309 4.0E5 302.1026 5.3E5 317.1260 4.8E4 END IONS BEGIN IONS FEATURE_ID=435 PEPMASS=737.1861 SCANS=435 RTINSECONDS=529.39 CHARGE=1+ MSLEVEL=2 MERGED_STATS=1 / 1 (0 removed due to low quality, 0 removed due to low cosine). 116.5673 2.1E3 131.0005 2.2E3 137.8444 2.5E3 147.0806 5.9E3 152.9737 2.6E3 162.0675 4.7E3 169.9744 4.6E3 170.9825 1.5E4 171.9911 5.8E3 173.5370 2.9E4 177.0909 4.0E3 181.0861 3.4E4 183.9899 2.5E3 184.9620 1.9E4 186.0065 3.2E3 190.0620 1.1E4 191.0680 8.8E3 192.0707 2.7E3 193.0859 1.2E4 194.0875 2.8E3 205.0861 4.7E3 206.0571 6.9E3 209.0104 3.0E3 221.0809 2.7E5 222.0843 8.9E4 223.0863 3.2E4 237.0055 6.1E3 239.0215 2.8E3 241.0374 3.1E3 246.4074 2.7E3 254.0070 3.4E3 256.0262 8.0E3 258.0422 5.7E3 263.9924 3.2E3 267.0161 2.4E3 267.9888 4.9E3 269.0315 6.3E3 270.0031 5.6E3 271.0464 7.9E3 281.0348 2.5E3 283.0116 2.9E3 285.9998 2.7E3 286.0374 1.3E4 290.0338 3.5E3 295.9809 4.0E3 301.0256 5.1E3 301.9254 2.4E3 303.0044 6.0E3 303.0395 4.3E3 305.0196 6.2E3 305.0566 4.1E3 311.4079 2.7E3 316.0476 7.6E3 317.0186 1.1E4 317.0572 1.1E4 318.0271 3.6E4 318.0639 4.3E3 319.0346 9.7E3 319.5997 2.4E3 320.0408 3.3E3 320.0791 6.9E3 331.0374 1.0E4 332.0503 3.3E3 333.0039 5.9E3 333.0504 2.0E5 333.0975 3.8E3 346.0199 5.8E3 346.0604 6.4E3 348.0738 8.5E4 359.0399 1.1E4 360.0475 1.3E4 361.0454 7.3E4 374.0547 1.9E4 375.0721 3.9E3 376.0688 1.1E5 377.0545 7.2E3 378.0586 8.2E3 379.0591 7.8E3 394.0784 4.0E3 411.2636 2.5E3 418.0585 3.5E3 419.0599 4.7E3 420.0624 9.4E3 END IONS BEGIN IONS FEATURE_ID=436 PEPMASS=300.1234 SCANS=436 RTINSECONDS=529.439 CHARGE=1+ MSLEVEL=2 MERGED_STATS=7 / 9 (2 removed due to low quality, 0 removed due to low cosine). 47.5433 2.1E3 50.3126 2.5E3 50.9302 2.3E3 52.9406 2.2E3 53.0383 1.5E4 54.7525 2.4E3 55.0719 2.3E3 55.7748 2.5E3 55.8552 2.3E3 59.3386 2.4E3 59.8704 2.5E3 60.2579 2.2E3 61.8436 2.2E3 62.7354 2.3E3 64.7543 2.9E3 66.9626 2.2E3 69.9105 2.1E3 70.1577 2.5E3 71.2944 2.3E3 72.0807 2.4E3 72.2110 2.3E3 80.0492 1.3E4 81.0331 3.7E5 81.5530 2.0E3 83.4753 2.5E3 89.8208 2.5E3 98.3133 2.6E3 100.1205 2.2E3 103.0538 2.1E3 104.7384 2.1E3 107.5602 2.5E3 108.8192 2.8E3 114.5232 2.4E3 118.3790 2.5E3 125.7567 3.0E3 129.0038 2.8E3 133.7683 2.4E3 135.0442 6.5E3 138.5549 2.3E3 142.5053 2.6E3 144.0565 6.0E3 149.6846 1.1E4 149.6946 8.7E3 149.7071 3.4E3 160.0515 3.1E4 160.0757 8.2E3 161.0832 2.7E4 170.0604 5.4E3 171.0675 2.4E4 173.5311 9.2E4 173.5414 2.1E4 174.0547 2.5E4 183.0803 7.0E3 187.0620 2.6E3 188.0707 2.1E4 189.0782 4.2E4 197.8904 2.5E3 198.0549 3.4E3 199.0419 2.0E3 199.0627 2.0E4 202.0499 8.6E4 204.0649 6.5E3 217.0735 1.8E5 220.0966 3.1E4 232.0969 1.3E6 232.7917 2.6E3 234.1446 2.3E3 236.7184 2.7E3 238.0860 6.2E3 239.0556 2.8E3 239.0936 1.7E4 242.0812 3.2E4 249.7987 2.4E3 256.0974 3.7E4 257.1058 6.8E3 260.4371 2.7E3 270.0763 6.7E4 271.0962 2.8E4 284.0923 3.6E4 285.1003 2.5E4 291.6838 3.0E3 300.1236 8.9E4 END IONS BEGIN IONS FEATURE_ID=437 PEPMASS=206.0577 SCANS=437 RTINSECONDS=529.511 CHARGE=1+ MSLEVEL=2 MERGED_STATS=7 / 7 (0 removed due to low quality, 0 removed due to low cosine). 42.0156 2.2E3 42.5240 2.1E3 44.3268 2.5E3 45.0334 3.7E3 45.5679 2.1E3 45.8511 2.2E3 47.7170 2.1E3 48.6270 2.5E3 49.4058 2.1E3 49.4437 2.6E3 49.4628 2.2E3 49.9598 2.2E3 50.5549 2.2E3 51.0350 2.1E3 52.1206 2.4E3 53.0075 2.5E3 53.2198 2.6E3 53.5894 2.1E3 55.0176 7.6E3 56.7143 2.3E3 59.0430 2.1E3 61.1346 2.2E3 61.2441 2.3E3 61.7498 2.3E3 63.2619 2.3E3 64.3312 2.1E3 67.5736 2.8E3 68.2955 2.7E3 68.9697 2.6E3 68.9968 6.6E4 73.0281 8.2E4 73.3404 2.3E3 77.0386 5.8E3 78.0461 4.7E4 79.0540 9.8E4 81.1208 2.5E3 83.4029 2.3E3 88.0753 2.5E3 88.2877 2.3E3 89.0384 1.9E4 89.5731 2.3E3 90.0463 2.6E3 90.6342 2.3E3 91.0540 9.3E4 92.0257 9.6E3 95.0489 3.4E4 98.3831 2.4E3 98.6421 2.5E3 100.7420 2.2E3 100.9419 2.4E3 102.0461 8.1E4 103.0540 7.6E4 103.5042 2.2E3 104.0618 7.6E4 105.0335 2.0E4 107.0489 3.4E5 107.4240 2.7E3 115.0551 2.4E3 117.0332 3.7E4 118.0411 4.4E4 118.0935 2.3E3 119.0490 5.6E4 120.0204 4.9E4 120.0572 1.4E4 121.0282 8.7E3 121.0646 1.4E5 126.2959 2.4E3 130.0412 1.1E5 130.0513 2.3E3 131.0133 2.7E3 131.0490 1.4E5 132.0568 8.2E4 133.0283 9.3E4 133.0647 1.3E4 133.4686 2.4E3 135.0440 4.1E5 135.0559 8.9E3 138.0315 3.1E3 138.1689 2.5E3 138.2178 2.5E3 138.8314 2.5E3 141.8749 2.3E3 145.0283 6.2E4 145.0399 5.8E3 146.0366 2.6E4 147.0441 9.6E4 148.0153 2.1E4 148.0519 3.7E4 149.0233 2.1E4 149.0596 1.2E5 149.6661 3.0E3 149.6882 1.2E4 149.6988 6.3E3 151.9321 2.3E3 159.0440 2.7E4 160.0518 4.1E4 161.0231 2.5E4 161.0599 2.3E4 162.0314 7.0E3 163.0231 1.8E4 163.0390 9.5E5 163.0551 1.3E4 169.1415 2.5E3 171.5290 2.7E3 173.0236 4.7E3 173.5082 4.3E3 173.5228 3.3E4 173.5386 6.4E4 173.5516 4.5E3 175.0389 3.5E4 176.0107 6.3E4 176.0473 3.9E4 177.0549 8.1E4 178.0627 2.1E5 178.0805 3.5E3 187.0391 8.3E3 187.1610 2.6E3 188.0474 2.4E3 191.0341 2.7E5 191.0522 4.2E3 205.0493 2.9E3 206.0575 6.1E4 206.1908 5.5E3 END IONS BEGIN IONS FEATURE_ID=438 PEPMASS=690.1872 SCANS=438 RTINSECONDS=529.509 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 5 (1 removed due to low quality, 0 removed due to low cosine). 67.0675 2.1E3 74.0167 2.2E3 76.4583 2.2E3 77.9599 2.3E3 80.2257 2.4E3 81.3503 2.4E3 82.2761 3.0E3 82.2899 2.6E3 105.1982 2.4E3 118.9636 2.6E3 126.0130 2.5E3 135.0442 2.3E3 146.4452 2.5E3 149.6899 5.4E3 151.0748 1.1E4 164.3293 2.7E3 173.5194 5.7E3 173.5345 7.2E4 176.7318 2.1E3 177.0552 5.4E3 187.8898 2.8E3 190.0445 2.7E3 190.0624 3.4E4 193.0858 3.2E4 200.1559 2.2E3 200.7955 2.6E3 206.0578 6.2E3 206.1819 2.5E3 221.0303 3.1E3 221.0809 1.3E6 221.9705 2.9E3 222.0847 2.4E4 249.0322 7.5E4 267.0430 1.0E5 299.5104 3.0E3 357.0312 4.6E3 358.0375 1.1E4 372.0540 3.4E4 375.0411 2.0E4 380.7485 2.7E3 390.0636 1.9E4 396.1369 2.4E3 457.4067 2.6E3 469.1070 1.4E5 469.1773 6.9E3 470.1094 3.4E3 487.1174 4.7E4 505.0119 2.7E3 END IONS BEGIN IONS FEATURE_ID=439 PEPMASS=735.1849 SCANS=439 RTINSECONDS=529.51 CHARGE=1+ MSLEVEL=2 MERGED_STATS=7 / 8 (1 removed due to low quality, 0 removed due to low cosine). 69.9947 2.0E3 74.7919 2.7E3 76.3088 2.5E3 77.6432 2.3E3 79.4985 2.1E3 79.9180 2.9E3 81.3895 2.5E3 86.9459 2.5E3 90.8869 2.0E3 96.7081 2.2E3 102.2935 2.3E3 114.1141 2.2E3 118.9584 2.3E3 119.0488 2.8E3 121.2426 2.3E3 125.7419 2.1E3 127.8287 2.3E3 133.0641 2.6E3 135.0443 2.6E3 138.8076 2.0E3 147.0440 2.8E4 149.6758 3.7E3 149.6860 1.2E4 149.6964 6.9E3 153.9949 1.3E4 161.0598 1.6E4 162.0676 6.7E4 163.0390 2.3E4 163.0753 2.7E4 167.9740 3.2E3 169.9904 2.8E4 171.3902 2.4E3 173.5209 4.3E3 173.5335 1.1E5 175.0395 2.1E4 176.0470 6.4E3 177.0546 1.0E4 178.0627 5.5E4 181.0859 1.0E5 185.2944 3.2E3 189.0546 4.9E4 190.0431 2.5E3 190.0625 5.2E5 190.6023 2.4E3 191.0341 8.6E4 191.0702 2.4E5 193.0653 2.8E3 193.0860 4.3E5 197.9850 7.2E4 205.0861 6.7E4 206.0576 1.8E5 215.9961 7.0E3 221.0166 1.2E4 221.0306 6.1E4 221.0407 1.3E4 221.0809 1.1E7 221.1201 3.2E4 221.1320 5.1E4 221.1468 1.2E4 222.0845 1.0E5 263.0004 3.3E3 264.0035 2.7E3 270.9668 2.5E3 271.1531 2.4E3 277.0151 9.0E3 299.0227 4.0E3 304.0269 3.4E3 306.0441 2.9E3 307.1691 2.4E3 310.7662 2.6E3 311.9960 7.7E3 314.0077 3.3E3 316.0263 6.3E3 318.0419 2.6E3 326.0120 4.8E4 327.0186 1.4E4 328.0275 4.9E4 329.0348 1.2E4 330.0046 1.1E4 330.0478 4.1E3 331.0505 3.3E5 334.0378 5.2E4 342.0420 3.2E4 343.0555 2.6E3 344.0216 1.5E5 344.0585 2.3E4 345.0291 4.6E4 346.0746 2.4E4 347.0453 2.4E4 349.0609 1.1E5 358.0384 7.3E4 358.9928 1.1E4 359.0070 7.6E3 359.0452 1.1E6 359.0967 2.5E4 360.0523 2.9E4 361.0595 3.0E3 362.0321 1.0E5 362.0588 3.9E3 362.0737 2.5E4 364.0838 2.8E4 371.7932 2.6E3 372.0541 1.6E4 374.0143 7.5E3 374.0690 4.5E5 375.0418 1.8E4 376.0495 3.1E3 376.9990 3.3E3 377.0142 3.2E3 377.0561 1.1E6 390.0637 1.1E4 392.0799 2.0E5 417.9926 3.8E3 418.0111 2.1E3 418.0589 5.5E5 418.1245 3.6E3 502.3071 2.7E3 511.9328 2.3E3 534.7039 2.9E3 576.5334 2.7E3 654.9898 2.6E3 698.2972 2.7E3 END IONS BEGIN IONS FEATURE_ID=440 PEPMASS=752.1874 SCANS=440 RTINSECONDS=529.524 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 5 (0 removed due to low quality, 0 removed due to low cosine). 70.8484 2.3E3 94.8586 2.5E3 100.3456 2.4E3 120.9824 2.4E3 135.0439 4.9E3 137.2424 2.3E3 141.7969 2.9E3 148.9108 2.3E3 149.6708 3.0E3 149.6909 1.4E4 151.0754 9.0E3 154.6259 2.8E3 161.0960 2.5E3 167.3830 2.2E3 172.7525 2.1E3 173.0594 2.9E3 173.5245 2.6E4 173.5352 5.1E4 173.5435 1.1E4 176.1254 2.4E3 177.0549 2.9E3 178.0629 3.6E3 180.4834 2.7E3 181.0020 2.7E3 183.3415 2.5E3 189.0554 3.0E3 190.0623 4.3E4 191.0338 2.7E3 191.0702 9.3E3 191.3557 2.8E3 192.0781 3.6E3 193.0670 2.4E3 193.0858 2.7E4 194.0944 5.3E3 201.9765 2.9E3 203.6670 2.3E3 205.0498 2.4E4 206.0580 9.7E3 220.0729 1.6E4 221.0567 3.8E3 221.0809 6.4E5 222.0873 3.2E4 234.9305 2.6E3 236.0680 2.1E4 240.5964 2.8E3 241.3189 2.6E3 245.8944 2.2E3 261.1353 2.4E3 272.1287 4.3E4 274.1075 1.1E5 278.9939 9.0E3 289.0943 3.3E3 289.1309 2.7E5 291.9996 2.4E3 302.1027 8.1E4 317.0597 4.0E3 317.0670 2.6E3 317.0836 3.8E3 317.1259 1.3E6 317.1695 6.0E3 318.1267 2.5E3 330.0440 7.0E3 338.0085 3.4E4 358.0345 3.8E3 392.7502 2.8E3 432.2201 3.0E3 436.7552 2.8E3 438.7754 2.5E3 446.4049 3.0E3 470.1312 3.3E3 478.5570 2.7E3 490.7456 2.6E3 538.3663 2.6E3 546.6264 2.4E3 553.9721 2.9E3 628.1152 2.8E3 644.0045 2.4E3 END IONS BEGIN IONS FEATURE_ID=441 PEPMASS=357.0932 SCANS=441 RTINSECONDS=529.538 CHARGE=1+ MSLEVEL=2 MERGED_STATS=1 / 1 (0 removed due to low quality, 0 removed due to low cosine). 118.3100 2.2E3 147.0441 2.6E3 154.0169 7.7E3 172.0282 4.5E3 173.5275 8.9E3 190.0625 1.4E4 193.0858 1.1E4 206.0569 2.9E3 221.0810 4.0E4 233.0590 3.0E3 251.0705 4.9E3 333.3409 2.3E3 356.0827 3.2E3 END IONS BEGIN IONS FEATURE_ID=442 PEPMASS=743.1928 SCANS=442 RTINSECONDS=529.554 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 70.9744 2.7E3 80.0131 2.1E3 84.4470 2.3E3 86.5945 2.6E3 87.4012 2.3E3 98.3111 2.3E3 134.2498 2.5E3 138.7108 2.4E3 162.0678 5.1E3 163.0386 2.6E3 163.3254 2.6E3 173.5264 5.2E4 173.5396 3.7E4 174.6421 2.2E3 175.0396 2.4E3 178.0622 6.5E3 178.5326 2.6E3 189.0554 6.9E3 190.0623 6.2E4 190.3351 2.3E3 191.0341 5.5E3 191.0686 3.1E3 193.0859 5.2E4 205.0857 2.7E4 206.0578 2.3E4 207.2451 2.4E3 221.0810 1.3E6 221.1068 3.5E3 222.0845 2.1E4 265.7924 2.7E3 271.5688 2.5E3 317.1262 1.2E4 318.1314 6.0E3 329.0144 4.2E4 339.0420 6.3E3 367.0505 7.2E3 367.9574 2.9E3 370.0767 1.6E4 380.0611 1.1E4 382.0723 9.9E3 385.0643 2.7E3 398.0728 3.2E4 400.0898 7.3E3 426.0676 1.3E5 531.1086 2.5E3 551.5164 2.8E3 571.9158 2.3E3 628.3445 2.7E3 702.9330 2.8E3 END IONS BEGIN IONS FEATURE_ID=443 PEPMASS=340.1158 SCANS=443 RTINSECONDS=529.572 CHARGE=1+ MSLEVEL=2 MERGED_STATS=9 / 9 (0 removed due to low quality, 0 removed due to low cosine). 50.6461 1.8E4 51.2368 4.6E4 54.7958 6.2E4 54.9288 2.5E4 59.9246 2.2E4 60.1221 3.6E4 60.8310 4.7E4 61.1988 3.9E4 61.5019 2.1E4 62.1763 4.1E4 64.7705 4.3E4 65.9207 5.5E4 67.3299 5.4E4 67.4213 7.5E4 67.6441 6.0E4 68.4646 5.9E4 70.9272 5.3E4 71.1852 4.9E4 71.4508 5.8E4 71.6321 2.0E4 75.8391 5.5E4 76.4806 4.8E4 78.0300 2.1E4 79.7892 5.7E4 79.8021 5.7E4 81.3817 5.9E4 81.8639 5.0E4 84.6452 5.3E4 92.1259 2.1E4 99.3066 2.1E4 103.8141 2.4E4 110.9664 5.0E4 118.9344 4.7E4 119.0222 5.8E4 120.0416 2.6E6 122.0789 2.3E4 138.9852 4.5E4 149.7391 2.0E4 153.1600 4.3E4 156.1150 5.9E4 170.3530 5.5E4 173.5202 7.6E5 173.5271 5.4E5 173.5364 2.9E6 173.5450 1.3E5 177.0440 6.9E4 181.5113 4.8E4 188.6204 6.2E4 189.6936 3.8E4 190.0625 2.9E5 191.2400 2.2E4 193.0858 2.6E5 197.3502 5.3E4 207.7475 6.3E4 216.8710 2.2E4 221.0808 2.7E6 224.0020 5.1E4 224.3427 6.9E4 227.5790 2.2E4 231.8045 5.0E4 240.1217 5.4E4 243.8928 2.3E4 246.1991 6.7E4 263.8814 6.4E4 307.6894 5.9E4 313.8039 6.3E4 325.0926 3.0E5 325.5356 6.4E4 334.3928 7.4E4 340.1155 5.4E6 340.1594 6.8E4 341.3557 2.1E4 END IONS BEGIN IONS FEATURE_ID=444 PEPMASS=353.1157 SCANS=444 RTINSECONDS=529.573 CHARGE=2+ MSLEVEL=2 MERGED_STATS=8 / 9 (1 removed due to low quality, 0 removed due to low cosine). 68.7703 2.4E3 69.0260 2.6E3 72.2089 2.4E3 73.4699 2.4E3 75.0944 2.4E3 80.5157 2.3E3 84.9827 2.3E3 88.9785 2.6E3 91.5962 2.4E3 92.1092 2.2E3 92.8596 2.4E3 94.4079 2.1E3 103.6036 2.4E3 111.5030 2.4E3 114.9455 2.5E3 115.4921 2.4E3 119.9441 2.3E3 125.4235 2.6E3 125.7521 2.2E3 125.7710 2.4E3 130.0410 1.5E4 132.0561 5.2E3 133.0294 2.7E3 133.0650 5.3E3 134.9922 2.4E3 135.0440 5.4E4 136.4758 2.2E3 136.9650 2.4E3 138.7719 2.2E3 141.2660 2.3E3 143.8637 2.2E3 144.4349 2.9E3 147.0441 6.3E4 149.6699 3.6E3 149.6776 1.2E4 149.6891 2.9E4 149.6998 2.6E3 149.7125 3.5E3 154.5755 2.3E3 159.4728 2.5E3 161.0597 3.6E4 162.0674 1.7E5 163.0388 5.5E4 163.0750 2.2E4 164.8090 2.3E3 165.9048 2.3E3 173.5252 1.4E4 173.5358 6.0E4 174.0315 1.0E4 174.1398 2.3E3 175.0390 5.0E4 176.0470 4.8E4 177.0545 3.0E4 178.0624 1.6E5 180.0958 2.7E3 186.0348 6.1E3 188.3522 2.3E3 189.0546 6.2E4 190.0164 2.3E3 190.0425 3.1E3 190.0623 8.6E5 190.0773 2.3E3 190.0917 3.9E3 191.0338 1.7E5 191.0686 8.5E4 192.0402 3.0E3 193.0653 6.8E3 193.0859 6.2E5 193.1061 1.5E4 194.0893 2.0E4 199.4159 2.4E3 205.0501 3.3E3 206.0574 3.2E5 221.0809 3.7E6 221.0998 1.9E4 222.0844 1.6E5 226.8104 2.4E3 229.0817 3.3E3 237.0816 9.6E3 244.7499 2.7E3 253.0765 5.2E4 254.3345 2.7E3 255.0918 5.2E5 255.1229 2.5E3 256.0944 1.0E4 265.0788 3.5E3 274.1066 1.8E4 283.0874 1.5E5 307.6958 2.9E3 317.1263 3.0E3 334.1236 2.2E4 353.1432 4.6E3 377.3588 2.9E3 378.1135 8.2E4 393.1279 2.8E3 396.1239 4.7E4 400.8575 2.4E3 424.6825 2.3E3 439.1426 2.8E3 457.1559 5.8E3 502.6617 2.7E3 526.0426 2.7E3 542.2989 2.7E3 546.4318 2.4E3 576.6441 2.4E3 598.5823 2.5E3 623.0079 2.3E3 679.1888 2.8E3 END IONS BEGIN IONS FEATURE_ID=445 PEPMASS=221.0810 SCANS=445 RTINSECONDS=529.58 CHARGE=1+ MSLEVEL=2 MERGED_STATS=9 / 9 (0 removed due to low quality, 0 removed due to low cosine). 43.0178 8.9E4 45.0335 1.5E6 45.3927 8.2E4 45.6816 5.2E4 45.9445 6.4E4 47.7668 6.8E4 48.3278 2.0E5 48.3545 2.1E5 50.0703 1.8E5 50.2464 1.9E5 50.9700 6.9E4 51.8387 1.6E5 52.3566 7.2E4 52.5302 2.8E5 53.0021 1.4E6 53.0384 2.7E5 54.7656 1.9E5 55.0178 2.8E6 55.3609 2.6E5 58.4849 7.1E4 59.9140 2.3E5 63.0239 2.0E5 65.0385 5.9E5 68.9970 1.9E6 69.2576 2.3E5 69.8086 5.9E4 72.7088 1.8E5 75.6815 1.9E5 76.0311 6.4E5 76.8711 2.2E5 77.0385 7.6E6 78.0463 1.4E7 79.0540 2.3E7 80.8581 5.8E4 81.1990 2.3E5 81.4054 2.2E5 85.9231 1.9E5 89.0386 2.5E6 90.0463 4.7E6 91.0482 4.0E5 91.0541 3.3E7 92.0258 1.3E6 92.0620 2.4E6 93.0332 2.3E5 93.0697 2.1E6 94.8881 5.4E4 95.0489 4.2E6 98.5288 1.8E5 102.0463 4.3E7 102.3266 2.0E5 103.0540 2.1E7 104.0619 2.2E7 105.0334 5.6E6 105.0697 1.2E7 106.0412 8.5E5 107.0408 1.7E5 107.0490 3.7E7 107.4647 5.8E4 108.0570 1.1E6 108.9139 2.5E5 109.7461 8.1E4 112.9857 2.2E5 114.0462 1.5E6 115.0542 3.1E6 116.0620 5.0E6 117.0334 5.1E6 117.0697 9.3E5 118.0412 2.8E7 119.0392 3.6E5 119.0490 6.3E7 119.0574 3.0E5 120.0207 1.8E6 120.0569 9.1E6 120.6111 2.2E5 121.0284 8.4E5 121.0647 1.4E7 122.0362 7.4E4 122.0725 8.0E6 129.0334 3.1E5 130.0412 6.7E7 130.0521 1.5E6 131.0128 7.7E5 131.0381 2.7E5 131.0490 3.6E7 131.0597 3.9E5 132.0205 5.3E6 132.0464 1.5E5 132.0568 6.6E7 132.0680 1.1E6 133.0283 1.4E7 133.0647 2.3E7 134.0361 3.4E6 134.0725 5.4E6 134.9403 7.4E4 135.0319 8.4E4 135.0353 8.9E4 135.0440 9.6E7 135.0559 2.7E6 135.0802 1.4E6 142.0410 6.1E5 144.0569 4.8E6 144.8115 2.5E5 145.0282 1.1E7 145.0395 5.5E5 145.0646 2.7E6 146.0361 1.4E7 147.0439 2.2E8 147.0547 4.2E5 148.0517 3.2E7 149.0459 5.2E5 149.0596 4.8E7 149.0700 3.5E4 150.0674 2.0E7 152.0467 1.1E5 157.0397 5.2E6 158.0362 8.4E6 159.0076 3.8E6 159.0440 1.3E7 160.0370 9.6E5 160.0518 6.1E7 160.0639 1.5E5 161.0233 1.1E7 161.0596 4.7E7 162.0333 1.8E6 162.0514 1.3E6 162.0675 1.6E8 163.0389 2.7E8 163.0551 1.6E6 163.0751 2.7E7 163.0892 3.9E5 163.1076 7.9E4 165.0911 4.3E5 167.0713 3.5E5 170.0190 8.8E4 170.0363 1.4E6 172.0519 1.1E5 173.0233 4.1E6 173.5253 3.0E6 173.5386 3.4E6 174.0312 1.8E7 175.0252 3.1E5 175.0390 1.5E8 175.0531 2.7E5 176.0106 3.9E5 176.0469 3.7E7 177.0546 4.4E7 178.0440 2.0E6 178.0625 1.4E8 178.0805 1.3E6 179.8972 2.6E5 187.0391 3.9E6 188.0468 2.1E7 188.1717 1.9E5 189.0547 9.4E6 190.0624 1.9E8 190.0808 1.4E6 191.0141 1.4E6 191.0338 8.3E7 191.0489 5.0E4 191.0698 6.9E6 192.0424 8.3E5 193.0652 1.7E6 193.0859 9.0E7 193.1065 2.3E6 193.1154 2.9E5 195.8264 2.6E5 205.0497 6.4E6 206.0349 2.3E5 206.0574 4.8E7 206.0789 6.8E5 221.0808 1.4E7 END IONS BEGIN IONS FEATURE_ID=446 PEPMASS=495.6707 SCANS=446 RTINSECONDS=529.581 CHARGE=1+ MSLEVEL=2 MERGED_STATS=8 / 9 (1 removed due to low quality, 0 removed due to low cosine). 78.6569 2.3E3 83.4447 2.1E3 83.6543 2.4E3 90.1615 2.5E3 92.3516 2.2E3 96.3799 2.4E3 99.3890 2.6E3 100.1647 2.5E3 103.6847 2.7E3 113.9671 2.5E3 123.2428 2.3E3 125.7333 2.3E3 127.1538 2.7E3 132.4378 2.3E3 133.2538 2.9E3 137.6744 2.3E3 137.8189 3.3E3 140.9651 2.6E3 149.6799 5.0E3 149.6861 3.3E4 149.6951 8.9E3 149.7055 1.3E4 151.8273 2.4E3 152.8832 2.5E3 154.0176 5.5E4 162.0673 2.8E4 172.0280 4.1E4 173.5216 7.5E3 173.5313 4.8E4 173.5406 2.1E4 175.0390 3.1E3 178.0627 1.6E4 181.4489 2.9E3 189.0546 1.2E4 190.0623 2.1E5 190.0791 2.1E3 191.0338 4.3E4 191.0696 1.5E4 193.0858 1.8E5 206.0572 7.8E4 221.0809 2.5E6 222.0844 1.5E5 227.0709 1.9E4 233.0598 1.6E5 242.7145 2.1E3 244.9637 2.7E3 249.0543 2.8E3 251.0701 2.1E5 252.0722 2.5E3 281.2065 2.6E3 283.1591 2.6E3 285.6104 2.4E3 288.5813 1.3E4 288.9194 2.5E3 303.8138 2.4E3 322.0443 2.8E3 337.0600 3.4E3 337.1070 5.8E5 337.1514 8.1E3 337.6087 1.4E5 340.1145 3.8E3 346.1114 4.1E4 356.0804 4.5E5 356.1290 4.0E3 357.0835 3.7E4 358.0953 5.5E3 364.9249 2.8E3 371.1387 2.5E3 374.0910 2.8E5 375.0954 1.6E4 376.1080 6.3E3 376.3892 2.4E3 424.9853 2.6E3 453.0604 1.4E4 453.1329 7.5E5 453.1929 3.3E3 454.1358 1.0E5 471.1432 2.2E5 472.1456 2.8E4 476.3156 2.9E3 506.1270 2.5E3 509.5169 2.4E3 542.4359 2.4E3 608.1223 2.4E3 616.3077 2.7E3 626.8461 2.6E3 673.5921 3.2E3 900.2186 2.9E3 903.6804 2.9E3 921.5503 3.0E3 955.5005 2.6E3 955.7282 2.4E3 956.6084 2.7E3 END IONS BEGIN IONS FEATURE_ID=447 PEPMASS=657.2421 SCANS=447 RTINSECONDS=529.591 CHARGE=1+ MSLEVEL=2 MERGED_STATS=9 / 9 (0 removed due to low quality, 0 removed due to low cosine). 67.0427 1.7E4 67.1784 5.8E3 70.9159 2.3E4 74.9209 8.3E3 78.7813 2.2E4 80.3025 2.0E4 85.0256 4.3E4 85.0286 5.7E5 85.2693 1.4E4 85.7267 6.6E3 88.0131 2.9E4 90.3172 2.6E4 91.9530 3.1E4 93.4123 7.7E3 95.4173 1.5E4 96.8663 1.4E4 100.1500 8.3E3 100.5628 3.3E4 103.4986 2.7E4 104.6164 8.1E3 106.0100 2.0E4 112.7211 6.3E3 113.3092 2.5E4 117.4175 2.5E4 118.5522 7.4E3 118.7727 2.3E4 120.0414 1.6E6 123.0005 9.3E3 124.4694 2.1E4 140.8465 6.2E3 142.0125 1.7E4 146.8342 3.7E4 154.4585 8.0E3 157.5153 2.6E4 159.8393 2.0E4 164.0059 7.9E3 173.5306 1.3E6 173.5432 1.7E5 185.2439 1.0E4 213.0290 3.0E4 214.9982 3.1E4 221.0810 4.1E5 233.1968 7.9E3 243.0625 2.9E5 247.3641 8.2E3 249.7774 3.3E4 250.9080 2.5E4 262.0824 8.4E3 276.2711 6.0E3 281.1024 2.6E4 281.5604 2.1E4 288.1079 6.0E3 289.3401 8.8E3 324.0855 9.2E3 325.0555 7.1E3 325.0923 1.0E6 339.9655 1.1E4 339.9925 5.4E4 340.0185 9.4E5 340.0381 1.9E5 340.1151 1.4E8 340.1903 6.3E5 340.2125 1.0E6 340.2402 1.8E4 350.4508 1.9E4 358.1254 2.6E4 381.1431 6.7E4 389.5147 7.1E3 395.4147 4.4E4 413.6479 7.7E3 437.2217 1.9E4 460.6855 2.7E4 468.2763 2.9E4 476.2042 6.1E3 482.0459 2.0E4 601.1395 3.6E4 END IONS BEGIN IONS FEATURE_ID=448 PEPMASS=504.6572 SCANS=448 RTINSECONDS=529.601 CHARGE=1+ MSLEVEL=2 MERGED_STATS=8 / 9 (1 removed due to low quality, 0 removed due to low cosine). 79.0543 4.5E3 83.8119 4.9E3 87.1956 5.1E3 87.2950 5.2E3 91.0544 1.2E4 91.8441 4.3E3 93.4473 3.6E3 94.0523 4.1E3 97.7024 4.7E3 98.6454 3.8E3 102.0468 1.9E4 103.0537 5.4E3 105.0698 5.0E3 106.6108 4.9E3 114.6025 4.4E3 114.9594 2.4E3 118.0408 4.7E3 118.7422 4.6E3 119.0489 4.2E4 121.7077 4.7E3 127.2189 4.7E3 130.0412 3.8E4 133.0651 2.5E4 135.0444 6.8E4 144.5155 2.5E3 147.0442 2.1E5 148.0506 1.1E4 149.0592 2.4E4 150.0681 4.6E3 154.9876 5.1E3 159.0430 2.9E3 160.0522 2.3E4 161.0598 9.4E4 162.0676 5.3E5 163.0390 1.9E5 163.0741 1.1E5 165.0912 5.5E3 165.8247 4.6E3 173.5201 1.1E4 173.5284 1.4E5 173.5395 7.3E4 174.0312 6.6E4 175.0393 1.6E5 176.0469 9.9E4 177.0548 1.1E5 178.0626 4.5E5 179.0666 5.4E3 180.1943 4.5E3 188.0470 5.4E3 188.6447 3.0E3 189.0548 3.5E5 190.0426 5.8E3 190.0624 3.4E6 190.0831 6.8E3 191.0339 6.4E5 191.0682 4.8E5 192.0393 4.9E4 192.0738 3.0E4 193.0654 5.6E4 193.0860 2.8E6 193.1066 2.9E4 193.1157 1.8E4 194.0896 2.3E5 205.0498 2.7E4 206.0576 1.2E6 206.0803 2.4E4 207.0612 1.1E5 209.7434 3.7E3 220.9886 6.1E3 221.0153 3.8E4 221.0303 3.1E5 221.0405 7.7E4 221.0809 4.6E7 221.1205 1.8E5 221.1322 3.3E5 221.1465 6.1E4 221.1895 4.9E3 221.4299 4.1E3 222.0598 2.8E4 222.0844 4.4E6 223.0866 4.2E5 238.9330 3.1E3 240.7090 5.7E3 249.0147 5.6E4 249.0353 5.1E4 250.0341 1.7E4 251.0326 4.3E5 252.0326 1.3E4 253.1505 7.5E3 260.1293 5.8E3 265.9709 5.9E3 267.0429 1.5E5 268.0451 7.1E4 269.0440 3.2E4 272.1283 1.7E4 273.1336 4.1E3 274.1077 1.4E5 278.2780 5.1E3 280.9953 5.9E4 282.0039 1.3E4 289.1312 2.6E5 290.1314 5.5E3 294.9772 6.4E3 295.9821 1.0E4 296.6845 4.1E3 299.0057 2.3E4 302.1026 9.7E4 304.0478 1.6E4 317.0172 2.0E4 317.0572 9.3E4 317.1260 9.7E5 318.1297 9.5E4 318.4981 7.2E3 319.0718 3.2E5 331.0347 4.5E4 333.0513 1.2E5 338.7983 4.4E3 345.5941 3.8E4 346.0562 6.0E4 346.0942 3.3E5 346.5943 9.4E4 347.0660 3.0E5 348.0735 3.2E5 349.0793 9.4E3 351.0623 3.2E3 359.0297 1.7E5 360.0375 7.9E5 361.0413 8.1E4 365.0747 2.4E3 372.0489 4.2E4 373.0569 2.5E4 373.9736 6.6E3 373.9976 3.8E4 374.0534 2.3E6 374.1092 2.4E4 375.0573 3.4E5 376.0690 9.3E5 377.0739 8.4E4 378.0493 1.7E5 379.0552 7.0E4 390.0614 3.2E4 391.0647 8.1E3 392.0644 4.3E5 393.0687 5.2E4 394.0809 1.0E4 407.0526 3.5E4 467.5582 5.1E3 469.1058 2.8E5 470.1086 3.2E5 470.9513 5.9E3 471.1060 6.1E6 472.1084 9.5E5 472.1801 3.4E3 487.1163 8.9E4 488.1183 9.9E4 489.1224 2.0E4 568.5278 5.3E3 821.8644 4.2E3 850.2739 4.7E3 852.6832 8.6E3 1012.1895 4.2E3 END IONS BEGIN IONS FEATURE_ID=449 PEPMASS=654.2336 SCANS=449 RTINSECONDS=529.612 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 6 (0 removed due to low quality, 0 removed due to low cosine). 139.7873 2.3E3 140.4471 2.0E3 149.6695 3.4E3 149.6804 3.1E3 149.6912 5.8E3 149.7110 2.5E3 152.5227 2.2E3 154.0173 3.1E4 162.0674 1.8E4 162.2163 2.2E3 163.5810 2.2E3 165.3454 2.4E3 168.2288 2.3E3 168.9195 2.6E3 172.0280 3.0E4 173.5329 1.1E5 178.0623 1.2E4 189.0542 9.4E3 190.0623 1.3E5 191.0339 2.4E4 191.0694 6.2E3 193.0859 1.2E5 195.0052 2.1E3 195.0754 2.2E3 196.1118 2.4E3 204.3928 2.4E3 206.0574 5.1E4 209.8960 2.4E3 212.7683 2.2E3 213.0959 2.2E3 221.0449 3.1E3 221.0809 2.1E6 222.0844 1.1E5 227.0698 2.0E4 233.0597 8.3E4 236.0768 3.6E3 244.1942 2.3E3 251.0701 1.5E5 267.2971 2.3E3 269.7252 2.2E3 277.8198 2.2E3 279.5318 2.1E3 283.9771 2.5E3 288.5805 1.8E4 298.6017 2.4E3 305.6606 2.9E3 308.6058 2.5E3 313.7148 2.4E3 315.6365 2.4E3 317.1245 6.1E3 329.5948 7.4E3 332.1830 2.4E3 337.0599 5.7E3 337.1068 1.8E6 337.1545 7.9E3 337.6087 3.0E5 341.2549 2.4E3 346.1117 1.2E5 346.6140 2.4E4 356.0803 3.1E5 357.0823 2.0E4 357.6187 1.3E4 369.4576 2.4E3 374.0911 2.6E5 375.0958 7.0E3 375.6708 2.4E3 375.9579 2.9E3 386.5495 2.8E3 421.3757 2.5E3 453.0602 4.7E3 453.1328 7.8E5 454.1357 7.9E4 471.1429 3.0E5 472.1466 2.8E4 494.4342 3.0E3 495.6714 9.3E3 521.9778 2.8E3 548.2067 2.6E3 657.1511 2.5E3 743.1285 2.8E3 838.4246 2.7E3 1075.1172 3.0E3 1216.0023 2.6E3 1251.2197 2.6E3 END IONS BEGIN IONS FEATURE_ID=450 PEPMASS=356.0897 SCANS=450 RTINSECONDS=529.643 CHARGE=1+ MSLEVEL=2 MERGED_STATS=10 / 10 (0 removed due to low quality, 0 removed due to low cosine). 52.1297 2.1E3 53.9701 2.2E3 55.7090 2.1E3 56.6251 2.7E3 58.1560 2.4E3 59.5040 2.3E3 61.7300 2.2E3 62.0420 2.5E3 63.0369 3.0E3 68.5101 2.1E3 68.7114 3.1E3 69.0725 2.3E3 69.9584 2.5E3 71.4153 2.2E3 74.1754 2.3E3 79.0368 2.8E3 80.2033 2.7E3 80.4279 2.1E3 80.9781 2.3E3 84.1033 2.4E3 89.0384 6.4E3 90.4322 2.8E3 94.8662 2.5E3 95.7331 2.1E3 99.4671 2.6E3 102.9667 2.8E3 103.9377 2.6E3 107.6410 2.4E3 107.7671 3.1E3 109.2586 2.5E3 114.8885 2.3E3 117.0332 1.6E4 118.5325 2.8E3 120.8388 2.5E3 121.4561 2.2E3 124.6740 2.5E3 125.4467 2.4E3 126.1046 2.5E3 129.3497 2.7E3 135.0440 1.2E4 136.4380 2.5E3 137.5538 2.4E3 140.6586 2.3E3 144.0179 2.4E3 145.0281 1.4E5 148.6039 2.4E3 149.6834 5.7E3 149.6946 5.5E3 150.0666 4.5E3 156.6907 2.5E3 163.0388 5.3E4 165.0910 3.1E4 169.1011 2.3E3 173.5253 1.0E5 173.5417 7.2E4 175.0389 4.4E5 176.4583 2.8E3 178.9358 2.5E3 187.6461 2.3E3 188.0598 2.8E3 193.2057 2.7E3 197.3414 2.4E3 209.9914 2.2E3 231.4875 2.9E3 237.3052 2.7E3 237.7040 3.0E3 241.6182 2.8E3 258.8228 2.3E3 274.9722 2.7E3 278.3742 2.4E3 294.8816 2.3E3 299.4209 3.8E3 309.9031 4.5E3 311.7851 2.8E3 317.7308 2.4E3 320.8284 2.3E3 322.3896 2.2E3 345.6474 2.3E3 END IONS BEGIN IONS FEATURE_ID=451 PEPMASS=223.0863 SCANS=451 RTINSECONDS=529.651 CHARGE=1+ MSLEVEL=2 MERGED_STATS=9 / 9 (0 removed due to low quality, 0 removed due to low cosine). 43.0179 2.6E3 43.6834 7.3E3 44.3729 2.2E3 45.4068 2.4E3 46.0433 2.6E3 48.6676 4.3E3 49.6896 2.0E3 50.2759 5.0E3 51.0806 2.5E3 52.2474 3.9E3 53.0022 5.2E3 53.0387 4.0E3 53.8756 2.4E3 54.7170 2.2E3 55.0175 1.6E4 55.6767 6.1E3 58.1261 2.6E3 59.5251 3.6E3 61.4845 5.3E3 62.2198 5.4E3 62.3324 5.1E3 65.9048 4.2E3 70.5860 4.8E3 70.7099 4.4E3 70.8198 2.3E3 73.0078 4.7E3 77.0387 2.5E3 78.0462 1.2E5 79.0499 6.6E3 79.0537 2.5E5 79.8128 2.4E3 80.0574 8.8E4 81.0607 2.0E4 82.0549 2.5E3 86.9354 5.1E3 89.0386 1.8E4 89.0974 4.9E3 90.0465 2.2E4 91.0540 2.7E5 91.5245 5.9E3 92.0574 1.1E5 93.0606 5.8E4 93.4299 4.3E3 95.0490 5.8E4 96.8017 4.0E3 97.6738 4.3E3 98.4302 4.2E3 98.8784 2.5E3 100.1554 6.0E3 100.5025 3.7E3 102.0462 3.2E5 103.0483 7.3E3 103.0520 1.8E5 103.2573 3.9E3 104.0530 7.9E4 104.0618 1.4E5 105.0333 1.3E4 105.0447 6.0E3 105.0605 1.7E4 105.0702 7.1E4 106.0369 6.2E3 106.0686 2.5E4 107.0490 2.5E5 107.0765 2.8E4 108.0523 1.3E5 109.0547 9.6E4 115.0539 3.8E3 116.0621 4.2E3 117.0336 6.5E3 117.1967 2.8E3 118.0411 1.5E5 119.0487 3.8E5 120.0523 1.8E5 121.0548 2.4E5 121.0644 7.5E4 122.0703 4.5E3 123.0703 2.3E4 123.0803 4.0E3 123.2646 3.1E3 124.0786 6.2E3 127.2785 4.9E3 127.4371 3.7E3 129.2310 5.9E3 130.0411 4.1E5 131.0466 2.0E5 132.0216 4.9E3 132.0472 2.8E5 132.0566 2.5E5 133.0280 2.7E4 133.0543 8.7E4 133.0643 7.5E4 134.0312 9.4E3 134.0629 2.5E5 135.0338 6.6E4 135.0439 4.1E5 135.0704 1.0E5 136.0472 3.1E5 136.0787 1.5E4 137.0492 5.5E5 144.0578 4.7E3 145.0287 9.7E3 146.0355 3.5E4 146.0632 1.4E4 147.0320 1.4E4 147.0438 8.7E5 147.2778 2.5E3 148.0474 6.3E5 149.0495 1.4E6 149.0620 3.3E3 150.0579 1.6E5 150.0667 1.4E4 151.0652 3.0E5 152.0447 5.9E3 152.0727 1.4E5 156.4654 2.5E3 156.7286 4.1E3 157.0401 7.4E3 157.2572 4.0E3 158.0413 4.8E3 159.0444 5.3E4 160.0515 2.3E5 161.0117 1.2E4 161.0578 2.0E5 162.0276 1.2E4 162.0564 2.8E5 162.0676 3.9E5 163.0388 5.9E5 163.0680 3.9E5 164.0282 4.2E3 164.0422 7.9E5 164.0732 1.3E6 165.0441 2.4E6 165.0810 2.0E5 167.0972 6.1E3 173.5228 4.8E4 173.5362 2.3E5 174.0308 1.3E4 175.0387 3.1E5 176.0419 3.7E5 177.0445 1.5E6 178.0520 2.6E5 178.0629 1.4E5 179.0621 5.0E5 179.9189 6.3E3 180.0678 1.4E6 188.0463 4.4E4 189.0475 1.9E4 190.0340 2.4E3 190.0498 1.1E5 190.0621 2.4E5 191.0649 2.7E5 192.0370 1.6E5 192.0680 2.1E6 193.0391 9.7E5 193.0726 7.8E3 193.0855 1.2E5 194.0472 2.9E4 194.0891 1.1E5 195.0915 9.9E5 202.6004 5.3E3 207.0575 1.1E5 208.0628 5.8E5 214.8316 2.8E3 223.0864 2.0E5 END IONS BEGIN IONS FEATURE_ID=452 PEPMASS=318.1342 SCANS=452 RTINSECONDS=529.651 CHARGE=1+ MSLEVEL=2 MERGED_STATS=9 / 9 (0 removed due to low quality, 0 removed due to low cosine). 49.7237 2.9E5 51.3870 1.0E5 51.5138 7.1E5 51.5777 3.3E5 51.8031 8.3E4 54.4283 3.1E5 55.0179 1.3E6 55.2698 1.2E7 55.2718 1.0E6 56.3211 2.1E5 57.1785 3.8E5 58.9922 3.3E5 60.8568 2.1E5 62.8681 8.3E4 65.1889 9.2E4 67.4263 7.4E4 67.4546 7.2E4 75.1309 1.1E5 75.5717 2.7E5 76.0316 8.1E4 76.4395 3.6E5 77.0394 5.6E5 78.0464 2.9E6 79.0542 6.6E6 79.8199 2.8E5 80.0028 2.6E5 81.3173 2.8E5 83.0437 7.7E4 86.8722 3.6E5 88.3418 2.3E5 89.0390 1.7E6 90.7665 1.2E5 91.0542 1.2E7 91.6408 9.2E4 93.0329 2.8E5 95.0490 1.6E6 96.8002 1.1E5 97.7850 1.3E5 98.0600 2.9E7 102.0464 1.0E7 103.0542 8.2E6 104.0265 3.1E5 104.0619 5.1E6 105.0338 4.2E5 105.0698 9.8E6 107.0491 8.5E6 110.7501 2.6E5 111.4896 3.2E5 115.0544 1.8E6 116.0618 1.1E6 117.0698 4.9E5 117.9878 1.0E5 118.0414 1.0E7 119.0491 1.9E7 120.0571 3.6E6 121.0648 4.9E6 122.0726 4.1E6 128.3874 3.2E5 128.9328 3.5E5 130.0413 2.9E7 130.2981 7.3E4 131.0491 1.3E7 132.0205 2.1E6 132.0570 2.2E7 133.0283 3.7E6 133.0649 2.8E7 134.0360 1.2E5 134.0729 3.5E6 135.0442 3.0E7 135.0802 4.4E6 136.0523 1.1E5 141.3777 8.0E4 144.0572 5.6E6 145.0287 2.3E6 145.0653 1.5E6 146.0363 7.8E6 146.0717 1.5E6 146.9026 2.1E5 147.0333 5.0E5 147.0441 1.2E8 147.0549 1.7E5 148.0519 1.7E7 149.0597 2.1E7 149.0725 3.7E5 150.0676 2.1E7 151.0762 4.4E5 158.0366 4.4E6 159.0080 1.1E5 159.0441 1.0E7 160.0520 3.6E7 161.0243 2.9E6 161.0599 5.8E7 161.0754 1.3E5 162.0351 3.1E5 162.0537 4.8E6 162.0677 3.3E8 162.1285 8.4E4 163.0232 2.4E6 163.0391 1.2E8 163.0755 6.0E7 163.0899 5.9E5 165.0913 1.4E7 167.0705 1.2E7 170.0375 1.1E5 172.0523 3.0E6 173.0237 7.0E5 173.5249 1.5E6 173.5369 5.9E6 174.0314 4.1E7 175.0254 7.4E4 175.0393 9.5E7 176.0313 5.3E5 176.0317 1.6E5 176.0471 8.4E7 176.0645 2.6E5 177.0379 2.0E5 177.0549 5.9E7 177.0764 3.1E5 178.0441 2.2E6 178.0627 3.1E8 179.1681 2.9E5 179.6245 3.0E5 188.0469 3.2E7 189.0364 2.6E6 189.0549 1.4E8 189.0747 2.1E6 189.9995 1.6E5 190.0224 1.1E7 190.0302 4.0E5 190.0626 1.6E9 190.0775 5.8E6 190.0938 5.5E6 190.1031 1.1E7 190.1147 1.5E6 191.0340 3.4E8 191.0704 1.2E8 191.0858 9.0E5 192.0418 1.2E7 193.0211 1.5E5 193.0448 1.8E6 193.0535 1.4E6 193.0714 2.9E6 193.0862 1.2E9 193.1191 1.3E6 193.1273 9.6E6 193.1391 1.5E6 204.4747 3.4E5 205.0501 1.2E7 206.0415 1.5E6 206.0577 6.2E8 206.1030 1.2E6 220.9879 8.4E5 221.0151 2.3E6 221.0303 2.2E7 221.0407 2.0E7 221.0810 3.5E9 221.1000 8.2E6 221.1203 1.2E7 221.1321 2.4E7 221.1464 5.8E6 221.1607 1.1E6 221.1750 4.4E5 222.0852 1.3E6 227.8999 2.5E5 237.3688 1.2E5 239.5881 2.8E5 240.2256 1.2E5 243.5342 2.7E5 276.1238 8.4E4 282.5518 3.9E5 289.5307 2.8E5 END IONS BEGIN IONS FEATURE_ID=453 PEPMASS=507.6600 SCANS=453 RTINSECONDS=529.687 CHARGE=1+ MSLEVEL=2 MERGED_STATS=1 / 1 (0 removed due to low quality, 0 removed due to low cosine). 93.2393 2.3E3 94.1034 2.4E3 123.6145 2.7E3 162.0671 6.5E3 173.5405 7.6E3 178.0625 6.0E3 183.8750 3.2E3 189.0540 4.6E3 190.0621 4.3E4 191.0338 8.7E3 191.0686 5.0E3 193.0856 3.8E4 194.0897 3.4E3 206.0577 1.5E4 221.0303 3.5E3 221.0808 6.3E5 222.0842 6.7E4 223.0860 7.4E3 252.0457 4.4E3 275.0511 1.9E4 281.0251 2.5E3 289.1292 2.6E3 300.1233 4.7E3 300.5715 1.2E4 317.1291 2.6E3 349.0952 4.7E3 380.0594 9.3E3 398.0720 2.9E4 399.0748 3.4E3 476.1079 2.8E3 477.1079 1.7E4 495.1249 1.7E4 496.1278 5.1E3 611.6529 2.5E3 764.3062 2.6E3 END IONS BEGIN IONS FEATURE_ID=454 PEPMASS=321.1421 SCANS=454 RTINSECONDS=529.714 CHARGE=1+ MSLEVEL=2 MERGED_STATS=9 / 9 (0 removed due to low quality, 0 removed due to low cosine). 51.8787 2.4E3 51.9755 2.7E3 52.1231 2.3E3 52.7981 2.3E3 53.2510 2.4E3 54.0126 2.6E3 55.3599 2.3E3 55.3705 2.5E3 55.7019 2.7E3 56.0477 2.2E3 59.9764 2.3E3 60.7693 2.2E3 66.0335 2.6E3 66.4686 2.6E3 67.5769 2.2E3 72.2572 2.4E3 74.5561 2.1E3 77.3933 2.2E3 77.8404 2.3E3 78.1812 2.5E3 81.7461 2.5E3 82.2740 2.2E3 83.5674 2.3E3 84.3835 2.5E3 88.1527 2.5E3 89.9944 2.3E3 91.0258 2.0E3 91.0540 2.8E3 91.5774 2.3E3 95.0980 2.3E3 96.1629 2.3E3 96.5350 2.4E3 98.0599 3.9E4 99.0633 2.2E4 100.0657 2.6E3 103.0682 2.8E3 104.7782 2.6E3 107.1056 2.2E3 114.8803 2.4E3 119.1144 2.5E3 120.0528 2.9E3 120.5152 2.5E3 130.0411 1.2E4 131.0450 2.0E4 131.2581 2.3E3 131.7951 3.1E3 133.0628 1.7E4 134.0679 1.8E4 135.0444 7.1E3 135.0816 2.5E3 136.0478 2.0E4 137.0497 7.4E3 143.8699 2.5E3 144.6676 2.3E3 147.0439 6.4E4 148.0474 9.2E4 148.1413 2.3E3 149.0495 5.9E4 149.6854 4.5E3 149.6961 4.3E3 150.0519 3.6E4 150.0652 8.8E3 152.0706 8.4E3 152.6425 2.3E3 160.0504 5.6E3 161.0578 3.9E4 162.0668 1.8E5 163.0388 3.7E4 163.0708 3.0E5 164.0424 7.8E4 164.0733 2.2E5 164.2028 3.1E3 165.0443 9.0E4 165.0763 1.9E5 166.0469 7.1E4 166.0832 2.2E4 168.0747 5.6E3 170.0780 5.3E3 173.0531 2.4E3 173.5009 3.0E3 173.5237 4.4E4 173.5372 1.0E5 175.0373 3.7E4 176.0425 6.8E4 177.0481 6.1E4 178.0476 4.4E4 178.0620 9.1E4 179.0651 2.0E5 180.0673 2.7E5 181.0705 2.4E5 181.8700 2.2E3 183.8326 2.6E3 185.0171 2.5E3 189.0535 5.5E4 190.0617 5.4E5 191.0340 6.6E4 191.0656 1.2E6 192.0370 1.6E5 192.0678 1.4E6 192.0951 9.9E3 192.0965 2.8E3 193.0390 3.4E5 193.0706 1.5E6 193.0862 2.0E5 194.0420 3.7E5 194.0892 8.5E5 195.0480 2.7E3 195.0914 1.0E6 195.3383 2.4E3 196.0940 1.1E6 196.1244 3.4E3 200.4365 2.6E3 205.6877 2.6E3 206.0571 1.0E5 207.0607 3.0E5 208.0626 6.2E5 209.0655 7.1E5 221.0809 5.2E5 222.0586 2.1E4 222.0844 1.7E6 222.1100 5.6E3 223.0598 5.4E3 223.0865 3.3E6 223.1380 3.0E3 224.0379 4.1E3 224.0891 4.9E6 224.1160 9.7E3 227.2908 2.3E3 235.8435 2.9E3 241.6922 2.6E3 265.9282 2.5E3 273.6423 2.3E3 281.8108 2.7E3 316.0755 2.6E3 END IONS BEGIN IONS FEATURE_ID=455 PEPMASS=487.6817 SCANS=455 RTINSECONDS=529.715 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 9 (3 removed due to low quality, 0 removed due to low cosine). 78.2086 2.2E3 79.9039 2.0E3 88.9711 2.2E3 90.4846 2.2E3 91.9076 2.5E3 96.2482 2.1E3 105.1315 2.6E3 115.7502 2.3E3 118.7828 2.7E3 120.3584 2.6E3 130.1573 2.5E3 147.0440 1.4E4 149.6881 6.2E3 149.7092 3.8E3 155.2031 2.5E3 161.0587 2.6E3 162.0674 4.6E4 163.0390 1.1E4 163.0777 2.5E3 168.7694 2.3E3 173.5278 1.3E4 173.5359 8.0E4 175.0398 7.3E3 177.0546 2.5E3 178.0623 4.2E4 189.0549 3.9E4 190.0624 3.2E5 191.0337 6.1E4 191.0694 4.2E4 193.0858 2.9E5 193.2407 2.3E3 194.0887 2.9E3 206.0575 1.3E5 220.3934 2.2E3 221.0306 5.3E3 221.0808 4.8E6 221.1468 3.4E3 222.0842 2.7E5 228.0862 7.7E3 228.5883 2.5E3 233.0775 2.9E3 235.0927 5.0E4 240.9324 2.6E3 253.1040 6.0E3 257.3762 2.6E3 264.6660 2.5E3 265.5699 2.9E3 269.7893 2.4E3 273.0803 3.6E4 273.5822 8.0E3 280.5920 6.1E4 281.0933 1.1E4 289.5976 5.0E4 290.0989 7.6E3 325.5898 2.8E3 329.0729 5.4E3 329.1181 1.1E6 329.1654 6.5E3 329.6194 3.8E5 329.6874 2.9E3 338.0768 5.3E3 338.1233 4.4E5 338.6244 1.4E5 340.1059 7.7E4 343.0894 1.2E4 349.6298 2.2E4 350.1310 3.3E3 358.1133 1.9E5 359.1159 2.7E4 365.4707 2.6E3 392.9101 3.3E3 428.6263 2.7E3 437.1557 7.4E5 438.1579 1.5E5 448.7527 2.5E3 455.1655 1.4E6 456.1679 2.9E5 474.0577 2.8E3 494.2832 2.7E3 518.7738 2.7E3 615.4286 2.7E3 782.3442 2.9E3 792.5682 2.7E3 END IONS BEGIN IONS FEATURE_ID=456 PEPMASS=208.0438 SCANS=456 RTINSECONDS=531.268 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 2 (0 removed due to low quality, 0 removed due to low cosine). 42.0642 2.1E3 42.1690 2.0E3 43.0633 2.3E3 51.2244 2.3E3 60.0447 2.3E3 71.6340 2.4E3 73.8809 2.2E3 77.9232 2.9E3 78.0674 2.6E3 83.9598 2.6E3 84.9592 6.6E4 93.1959 2.2E3 99.9122 2.2E3 102.9697 5.8E3 105.4785 2.8E3 106.6242 2.2E3 115.9639 9.6E3 116.9611 2.8E3 132.4751 2.5E3 142.2786 2.6E3 173.5255 2.0E4 173.5404 2.0E4 174.9851 3.6E3 187.6609 2.7E3 198.1743 2.2E3 END IONS BEGIN IONS FEATURE_ID=457 PEPMASS=233.1175 SCANS=457 RTINSECONDS=533.186 CHARGE=1+ MSLEVEL=2 MERGED_STATS=7 / 9 (2 removed due to low quality, 0 removed due to low cosine). 43.0179 2.7E4 45.0335 6.5E4 47.0199 3.4E4 47.0217 9.2E3 48.0644 2.3E3 48.5013 3.5E3 48.9296 2.4E3 51.0521 2.3E3 51.4915 2.3E3 53.7778 2.4E3 54.4649 2.3E3 55.0179 2.1E4 55.0541 1.1E4 57.0334 1.8E5 57.0699 2.7E4 59.0489 2.7E3 60.4256 2.3E3 65.0387 6.5E3 67.0541 2.0E5 68.8842 2.2E3 69.0701 2.1E4 75.0441 2.7E4 77.0394 5.1E3 79.0542 5.2E4 81.0699 1.0E4 82.7927 7.3E3 85.6576 2.3E3 87.6809 6.2E3 88.4743 2.8E3 90.6475 2.7E3 91.0543 1.1E5 93.0704 2.9E3 95.0491 5.5E4 97.6766 2.3E3 97.7138 2.8E3 98.7907 3.5E3 102.0466 7.6E3 103.0541 4.8E4 105.0698 9.9E4 107.0492 4.5E4 108.0567 9.4E3 109.0647 2.5E4 113.0404 4.4E3 115.0544 2.0E5 116.0620 3.0E4 117.0698 1.4E5 119.0854 2.3E4 121.0286 2.7E3 121.0648 2.8E5 121.8686 2.4E3 127.0547 6.4E3 127.6186 6.9E3 128.0621 6.0E5 129.0590 7.3E3 129.0699 7.0E5 130.0413 1.6E4 130.0776 9.5E4 131.0491 9.8E4 131.0855 3.0E5 132.0578 1.6E4 133.0648 8.7E4 133.7100 7.2E3 134.0364 2.6E4 135.0441 7.6E3 135.0804 9.0E4 136.0519 8.6E4 136.0631 2.6E3 137.0596 1.7E5 138.0676 7.7E4 139.0754 5.6E4 140.0618 4.4E4 141.0699 4.4E5 142.0418 8.4E3 142.0777 1.6E5 143.0491 2.0E5 143.0728 3.9E3 143.0855 5.8E5 144.0570 2.2E5 144.0932 6.3E4 144.1215 2.4E3 145.0516 1.5E4 145.0648 8.6E5 145.0782 3.1E3 145.1011 8.2E4 146.0726 3.0E5 147.0439 4.0E4 147.0803 1.4E5 148.0514 1.5E4 149.0597 1.3E5 149.0956 8.9E3 151.0753 6.5E5 151.0891 5.3E3 152.0618 4.6E4 153.0698 4.1E5 154.0776 2.4E5 155.0483 2.5E4 155.0610 5.0E4 155.0854 2.9E5 156.0569 2.5E5 156.0937 4.3E3 157.0472 7.5E3 157.0648 1.5E6 157.0769 5.8E3 158.0726 1.2E6 158.0873 5.1E3 159.0441 2.0E5 159.0568 1.7E4 159.0804 2.3E6 159.0924 2.1E3 160.0520 8.4E4 160.0883 4.2E5 161.0598 4.1E5 161.0960 7.0E4 162.0676 3.4E5 162.1045 2.8E3 163.0755 1.3E5 164.0833 8.8E3 165.0554 4.1E3 165.0699 8.8E3 165.0911 1.1E5 165.6891 6.7E3 168.0570 3.4E5 169.0482 2.6E3 169.0649 1.1E6 169.0819 3.5E3 170.0728 3.8E5 171.0453 2.5E4 171.0806 1.6E6 171.0944 6.8E3 172.0531 6.7E4 172.0749 3.9E4 172.0884 5.5E6 172.1228 7.1E3 173.0466 1.3E4 173.0598 3.7E6 173.0786 2.1E4 173.0962 5.8E5 173.1134 1.7E4 173.5363 9.5E4 174.0500 1.8E4 174.0677 9.1E5 174.0892 9.4E3 174.1040 2.3E6 174.1220 2.0E4 175.0755 6.2E5 175.1119 9.8E4 176.0661 3.4E3 176.0833 5.7E5 177.0549 2.8E4 177.0911 5.4E5 178.5006 2.4E3 181.0640 1.9E4 181.0772 3.0E3 182.0729 8.5E4 183.0639 4.2E3 183.0805 3.8E5 183.0990 3.6E3 184.0612 3.9E3 184.0740 1.5E4 184.0884 2.8E6 184.2844 2.8E3 185.0450 8.4E3 185.0599 1.5E6 185.0790 1.0E4 185.0962 1.3E5 186.0678 8.4E4 187.0556 9.0E3 187.0607 5.1E3 187.0755 8.9E5 187.0947 1.5E4 188.0436 3.8E4 188.0833 1.1E7 188.1002 2.0E4 188.1237 3.4E4 189.0528 2.9E3 189.0911 9.5E5 189.1100 1.2E4 190.0624 9.5E4 190.0989 6.4E5 191.0705 1.2E4 191.1068 7.8E4 196.0195 4.4E3 199.0755 2.3E5 200.0529 3.5E3 200.0833 2.0E6 200.1002 4.9E3 201.0912 9.8E4 202.0991 8.2E5 202.1210 3.6E3 203.0713 5.5E4 203.1068 3.9E6 203.1237 6.5E3 204.0798 1.3E4 204.1148 4.3E4 205.0863 1.7E5 205.1225 6.7E5 205.8690 2.4E3 211.2647 2.4E3 215.0873 1.2E4 215.1069 2.3E6 215.1254 3.1E3 218.0943 4.2E4 230.3832 2.5E3 230.8228 2.3E3 233.1174 5.6E5 234.0210 2.7E3 END IONS BEGIN IONS FEATURE_ID=458 PEPMASS=306.1705 SCANS=458 RTINSECONDS=533.761 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 9 (4 removed due to low quality, 0 removed due to low cosine). 48.0242 2.4E3 48.8488 2.1E3 51.3956 2.3E3 55.2684 5.5E3 55.2707 2.9E4 55.3168 2.6E3 55.8450 2.7E3 57.3192 2.1E3 57.7157 2.3E3 57.7630 2.5E3 59.3284 2.4E3 59.3873 2.3E3 60.6520 2.4E3 61.0516 2.2E3 64.4273 2.4E3 65.5709 2.4E3 65.8210 2.6E3 67.0543 2.9E3 68.2373 2.6E3 69.0697 4.2E5 69.0736 2.6E3 69.4909 2.8E3 70.0651 1.3E4 71.5717 2.2E3 76.3117 2.4E3 76.5992 2.2E3 79.5614 2.4E3 83.7299 2.7E3 84.0806 1.0E5 84.8565 2.2E3 86.0963 8.7E5 86.1013 4.2E3 86.1025 6.3E3 91.0540 1.2E4 93.8673 2.6E3 97.1753 2.4E3 98.1114 2.5E3 99.9636 2.2E3 100.0270 2.6E3 102.0461 3.6E3 102.1545 2.3E3 103.0542 3.2E3 103.0898 2.4E3 103.4719 2.2E3 104.1180 2.5E3 105.0699 1.4E4 106.7925 2.7E3 107.0489 7.7E3 112.0668 5.4E3 112.0756 3.7E5 118.0413 7.1E3 118.4829 2.5E3 119.0492 1.8E4 130.0415 2.2E4 130.4950 2.3E3 131.0489 1.3E4 132.0568 1.9E4 133.0648 4.3E4 135.0441 2.6E4 140.5687 2.5E3 144.0582 2.8E3 146.0366 8.9E3 147.0440 1.4E5 148.0523 1.3E4 149.0596 2.3E4 150.0677 3.0E4 159.0440 1.0E4 160.0520 4.8E4 161.0233 2.2E3 161.0599 8.2E4 162.0513 3.3E3 162.0557 2.4E3 162.0675 5.2E5 162.0823 7.1E3 162.0903 2.9E3 163.0390 1.3E5 163.0752 8.1E4 165.0915 1.5E4 167.0703 2.2E4 172.6502 2.3E3 173.5258 9.6E4 173.5433 3.7E4 174.0314 5.5E4 175.0392 1.1E5 176.0470 8.6E4 177.0548 1.1E5 178.0626 4.4E5 178.0807 1.4E4 181.0861 2.6E4 182.6768 3.1E3 188.0469 2.7E4 189.0349 2.5E3 189.0548 3.0E5 190.0223 6.4E3 190.0625 2.9E6 190.0783 2.2E4 191.0137 8.5E3 191.0339 6.7E5 191.0702 2.3E5 191.0891 4.9E3 192.0420 3.0E4 192.6328 2.3E3 193.0652 1.1E4 193.0860 2.3E6 193.1065 1.1E4 193.1275 4.0E3 193.1628 2.7E3 205.0504 2.0E4 206.0349 6.5E3 206.0576 1.2E6 206.0797 3.3E3 220.0366 5.4E3 221.0024 3.9E3 221.0150 7.4E3 221.0303 7.0E4 221.0407 3.4E4 221.0809 1.1E7 221.0998 5.4E4 221.1202 3.4E4 221.1321 6.2E4 221.1464 2.1E4 235.0608 8.8E3 245.1404 1.1E4 258.1128 1.4E4 262.3618 2.5E3 276.1206 3.3E3 305.2305 2.7E3 306.1704 1.4E4 END IONS BEGIN IONS FEATURE_ID=459 PEPMASS=217.0863 SCANS=459 RTINSECONDS=537.218 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 15 (10 removed due to low quality, 0 removed due to low cosine). 42.0983 2.4E3 43.0178 3.6E4 43.1097 4.3E3 44.0115 2.1E3 45.0334 2.2E4 46.1822 2.5E3 47.7549 2.2E3 51.6509 2.4E3 53.0383 3.2E3 53.3133 2.1E3 54.0070 3.7E3 55.0177 1.9E4 57.0333 9.3E4 62.0158 2.4E3 63.0235 4.3E3 65.0386 1.2E4 67.0541 3.2E4 67.3353 2.2E3 67.7136 3.0E3 68.4436 2.6E3 68.7397 2.5E3 74.0680 2.1E3 74.4423 2.2E3 77.0392 2.4E3 79.0543 2.7E3 80.3931 4.0E3 83.5636 2.7E3 89.4293 2.6E3 90.3462 2.2E3 91.0474 4.1E3 91.0540 5.1E5 91.0595 2.9E3 91.0609 6.1E3 94.1330 2.3E3 95.0490 6.2E3 96.0135 3.8E3 102.0468 8.1E3 103.0540 1.0E5 105.0696 1.6E4 111.0438 2.5E3 112.5529 2.4E3 113.3045 2.5E3 114.0462 3.2E3 115.0540 7.5E5 115.0628 6.3E3 116.0619 1.5E5 116.0707 3.1E3 117.0697 2.0E5 119.0849 2.5E3 120.0604 2.7E3 120.1012 2.5E3 127.0547 1.9E4 128.0618 6.7E5 129.0696 8.7E6 129.0787 1.1E5 129.0921 1.0E5 129.0982 9.2E3 129.9904 2.3E3 130.0410 2.1E4 130.0774 1.4E4 131.0490 3.1E5 131.0853 2.3E6 131.0948 1.4E4 133.0647 4.2E4 135.0439 1.7E5 135.0803 2.2E4 138.5620 2.2E3 139.0549 3.1E3 141.0369 3.1E3 141.0571 4.9E3 141.0696 4.3E6 141.0796 7.3E4 141.0895 9.6E3 141.0952 3.5E4 142.5558 2.2E3 143.0489 2.4E5 143.0601 6.6E3 143.0853 1.3E5 144.0441 3.8E3 144.0568 2.8E5 145.0519 4.2E3 145.0646 2.2E5 147.0438 7.4E3 149.0595 3.3E4 153.0695 2.3E4 155.0603 7.3E4 156.0568 5.4E4 156.6914 2.3E3 157.0646 3.7E6 157.0764 1.7E4 158.9918 2.4E3 159.0439 8.0E4 159.0803 1.1E6 159.1018 3.7E3 159.1423 2.6E3 160.0519 6.2E4 161.0596 1.6E5 168.0567 1.4E4 169.0407 3.3E3 169.0647 1.4E6 169.0795 2.8E3 171.0439 2.5E4 171.0804 1.6E4 172.0345 3.1E3 172.0519 5.3E5 172.0691 1.2E4 173.0597 5.0E5 173.5218 1.2E4 173.5355 7.1E4 174.0680 3.3E4 175.0398 1.6E4 175.0756 3.2E4 176.0463 1.6E4 179.0603 2.8E3 184.2193 2.6E3 185.0597 1.6E5 186.0488 3.4E3 186.0675 5.5E5 187.0754 2.5E6 188.0834 2.3E4 189.0544 4.7E4 189.0911 8.0E4 194.2068 2.7E3 198.0913 2.4E4 199.0754 1.6E6 199.0920 4.7E3 199.1060 3.7E3 202.0622 6.0E3 217.0860 3.0E5 END IONS BEGIN IONS FEATURE_ID=460 PEPMASS=342.2431 SCANS=460 RTINSECONDS=539.567 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 5 (0 removed due to low quality, 0 removed due to low cosine). 50.7967 2.8E3 52.9881 2.2E3 53.5343 2.1E3 53.6843 2.3E3 55.0541 1.2E5 57.0698 1.1E4 58.5566 2.1E3 63.2813 2.5E3 65.0384 6.2E3 67.0500 4.2E3 67.0541 4.9E5 67.9391 2.2E3 68.0781 2.3E3 69.0697 1.2E5 71.4072 2.5E3 74.3335 2.1E3 74.9286 2.1E3 75.1045 2.7E3 78.1236 2.3E3 78.8121 2.1E3 79.0540 2.5E5 80.8174 2.1E3 81.0697 4.2E5 83.0853 3.0E4 83.2544 2.2E3 91.0540 1.1E5 93.0697 2.8E5 94.8645 2.5E3 95.0488 1.0E4 95.0853 3.0E5 95.0959 2.7E3 95.4865 2.3E3 97.1010 4.7E3 103.0541 1.5E4 105.0697 6.4E4 107.0853 1.6E5 109.0648 3.0E3 109.1010 8.9E4 109.8595 2.4E3 115.0542 6.8E3 117.0697 4.1E4 118.0650 2.9E3 119.0853 7.9E4 120.6799 2.3E3 121.1010 9.8E4 123.0439 3.2E5 123.1170 1.5E4 127.6258 2.8E3 129.0698 4.2E4 131.0490 1.0E5 131.0855 5.0E4 133.0647 4.4E3 133.1010 4.7E4 135.0434 3.5E3 135.1166 2.1E4 137.0481 4.4E3 137.0596 3.7E5 137.0715 1.0E4 141.0697 1.5E4 143.0489 4.0E4 143.0856 2.1E4 143.7858 2.3E3 145.0646 1.3E5 145.1007 1.8E4 145.8622 2.3E3 146.0597 1.5E4 147.0439 4.2E4 147.0807 2.8E3 147.1165 1.9E4 148.0504 2.9E3 149.0596 4.2E5 151.0752 6.6E4 152.0706 1.1E4 152.3993 2.8E3 153.0690 4.6E3 155.0854 6.0E4 157.0648 7.3E4 157.1007 1.7E4 159.0804 7.4E4 160.0521 1.9E4 161.0440 1.4E4 161.0597 7.7E5 161.0755 9.3E3 162.0679 1.2E4 163.0612 4.4E3 163.0754 1.6E5 164.0706 4.1E4 165.0704 5.5E3 166.0862 2.7E4 167.0859 1.5E4 169.0648 3.3E4 169.1011 3.1E4 171.0805 5.4E4 173.0599 3.2E5 173.0965 1.2E4 173.5220 2.4E4 173.5315 1.0E4 173.5405 5.1E4 174.0680 2.5E4 175.0756 4.7E5 175.0928 3.2E3 176.0829 2.3E3 177.0911 5.3E4 181.0649 1.4E4 181.1005 6.2E3 183.0805 9.4E4 183.1171 1.1E4 185.0961 6.1E4 186.0681 5.8E3 187.0756 1.4E5 187.1113 3.4E3 188.0831 1.9E4 189.0912 1.3E5 189.1090 3.5E3 191.1068 1.7E4 195.0805 2.2E4 195.1169 6.3E3 197.0963 5.5E4 197.1320 5.3E3 199.0756 5.9E4 199.1116 1.8E4 200.0834 2.4E4 201.0697 4.0E3 201.0913 4.0E5 202.0991 2.6E4 203.1069 8.6E4 203.5521 2.4E3 209.0970 1.2E4 209.1323 7.4E3 211.1119 1.9E4 213.0915 8.2E4 213.1272 3.8E3 214.0989 1.8E4 215.0699 3.0E3 215.1070 2.4E5 216.1146 1.5E4 217.1229 2.3E4 223.1120 2.5E4 225.1270 8.6E3 227.1068 3.4E4 228.1145 5.1E3 229.1228 6.2E4 237.1283 1.0E4 241.1226 4.6E4 243.1375 2.7E4 252.7187 2.4E3 255.1379 4.0E4 256.0748 2.6E3 256.1463 6.7E3 266.5213 2.5E3 271.5031 2.5E3 277.8061 3.0E3 312.7333 2.7E3 328.3362 2.3E3 342.2432 1.0E5 352.4108 2.7E3 END IONS BEGIN IONS FEATURE_ID=461 PEPMASS=296.0923 SCANS=461 RTINSECONDS=541.435 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 3 (1 removed due to low quality, 0 removed due to low cosine). 50.8728 2.4E3 58.2399 2.1E3 61.1827 2.4E3 70.4413 2.4E3 70.8358 2.2E3 92.8881 2.6E3 99.8900 2.5E3 121.9053 2.5E3 152.0623 7.2E3 173.5302 2.4E4 179.0737 3.2E3 181.0648 3.9E4 190.0668 3.0E3 206.0601 3.9E3 207.0682 1.9E4 208.0760 2.7E4 209.0594 1.5E4 210.0553 3.0E3 219.0676 3.2E3 225.0790 1.0E4 226.9528 2.6E3 234.0550 4.1E4 235.0628 1.4E6 235.0840 6.2E3 236.0705 1.1E5 238.0497 5.1E4 247.0631 1.6E4 249.0410 9.6E3 251.0577 7.0E3 252.0383 2.5E3 252.0651 1.5E4 253.0725 7.5E3 262.0501 7.1E3 263.0574 7.8E5 263.0813 4.9E3 264.0654 1.7E5 264.0981 4.7E3 265.0730 4.5E4 266.0448 1.1E5 266.0764 4.4E3 267.0529 4.0E4 280.0606 8.0E4 281.0684 3.9E5 282.0760 2.1E4 296.0919 3.6E5 296.1479 3.9E3 END IONS BEGIN IONS FEATURE_ID=462 PEPMASS=221.0812 SCANS=462 RTINSECONDS=544.058 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 10 (5 removed due to low quality, 0 removed due to low cosine). 42.3367 8.0E3 45.0335 4.8E4 45.3118 6.6E3 45.5287 6.5E3 47.0760 9.4E3 47.2708 7.5E3 48.0781 7.7E3 48.4353 7.4E3 53.0022 4.8E4 53.0384 6.7E3 55.0178 7.6E4 58.1275 8.3E3 58.9015 8.2E3 61.6656 9.2E3 63.5221 8.9E3 65.0386 8.4E3 68.9970 4.0E4 74.2648 6.8E3 77.0386 1.0E5 78.0463 3.4E5 79.0540 6.6E5 81.5063 6.6E3 89.0387 8.4E4 90.0463 1.3E5 91.0541 8.6E5 92.0258 8.4E3 92.0619 8.6E4 93.0699 4.8E4 95.0490 1.5E5 96.7099 7.4E3 97.4128 8.5E3 102.0386 1.1E4 102.0463 1.2E6 103.0099 9.6E3 103.0541 5.6E5 104.0619 5.3E5 105.0335 1.4E5 105.0443 1.0E4 105.0697 3.5E5 106.0412 8.4E3 107.0488 1.0E6 109.0646 9.0E3 114.0463 1.2E4 115.0542 6.6E4 116.0621 1.4E5 117.0335 1.5E5 117.0698 9.4E3 118.0412 7.8E5 119.0394 2.0E4 119.0490 1.7E6 119.0591 2.4E4 120.0206 3.6E4 120.0569 2.3E5 121.0286 4.2E4 121.0647 4.2E5 121.8178 1.1E4 122.0725 2.0E5 129.0337 2.9E4 130.0413 1.9E6 130.0523 1.8E4 131.0130 7.7E3 131.0490 9.0E5 132.0206 1.4E5 132.0453 9.3E3 132.0569 1.6E6 132.0657 7.1E3 132.0685 2.3E4 133.0283 3.6E5 133.0648 5.8E5 134.0364 9.0E4 134.0725 1.3E5 134.5787 1.1E4 135.0440 2.6E6 135.0560 4.9E4 135.0804 2.3E4 136.0520 7.9E3 137.0603 9.1E3 141.5996 7.7E3 142.0415 3.8E4 144.0568 1.3E5 145.0284 2.4E5 145.0401 1.3E4 145.0647 5.6E4 146.0362 3.6E5 147.0440 5.8E6 148.0518 9.3E5 149.0229 9.2E3 149.0459 1.0E4 149.0596 1.3E6 149.0698 6.4E3 150.0675 5.4E5 151.0759 1.8E4 157.0395 1.4E5 158.0362 1.9E5 159.0076 1.2E5 159.0441 2.8E5 160.0370 1.3E4 160.0519 1.6E6 160.0668 1.9E4 161.0233 2.9E5 161.0479 5.3E3 161.0598 1.3E6 162.0335 4.0E4 162.0516 1.3E4 162.0529 4.4E4 162.0676 4.4E6 163.0390 7.5E6 163.0552 2.1E4 163.0752 7.3E5 165.0913 1.9E4 170.0359 1.8E4 172.0527 1.0E4 173.0231 1.1E5 173.5261 8.1E4 173.5340 1.1E5 173.5426 1.7E4 174.0313 4.5E5 175.0255 1.7E4 175.0391 4.1E6 176.0104 1.7E4 176.0307 7.9E3 176.0470 1.1E6 176.0643 8.4E3 177.0548 1.1E6 178.0465 5.2E4 178.0626 3.9E6 187.0389 6.0E4 188.0470 5.6E5 189.0548 2.5E5 190.0625 5.2E6 190.0831 1.5E4 191.0137 4.5E4 191.0340 2.2E6 191.0705 2.1E5 192.0418 7.7E4 193.0677 2.6E4 193.0694 9.2E3 193.0861 2.4E6 193.1065 4.3E4 205.0497 1.8E5 206.0576 1.2E6 218.1167 7.4E3 221.0811 4.1E5 224.3188 7.6E3 226.5350 7.7E3 END IONS BEGIN IONS FEATURE_ID=463 PEPMASS=320.1497 SCANS=463 RTINSECONDS=544.058 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 8 (3 removed due to low quality, 0 removed due to low cosine). 55.0180 3.3E4 55.2697 2.9E5 55.2718 2.9E4 55.8978 8.2E3 59.5028 8.8E3 62.2987 7.6E3 63.0335 9.1E3 66.2296 8.5E3 66.5701 1.1E4 68.2727 9.2E3 69.1544 9.7E3 70.2281 1.0E4 75.1260 8.6E3 76.3852 8.3E3 78.0464 5.5E4 79.0542 1.3E5 81.7542 7.8E3 82.0651 1.0E4 86.7176 1.1E4 86.7463 7.9E3 89.8204 1.1E4 91.0543 2.4E5 92.8048 1.1E4 93.0702 1.1E4 95.0490 2.3E4 100.0757 1.1E6 102.0466 2.0E5 103.0542 1.5E5 104.0619 8.3E4 104.1587 8.1E3 105.0333 1.3E4 105.0699 2.3E5 107.0492 1.6E5 113.5255 1.0E4 113.8215 1.1E4 116.0620 3.9E4 117.0332 1.4E4 118.0414 1.9E5 119.0492 3.8E5 120.0570 4.2E4 121.0648 1.2E5 122.0727 9.3E4 130.0414 6.0E5 130.2535 8.5E3 131.0493 2.3E5 132.0211 2.3E4 132.0571 4.1E5 133.0281 7.9E4 133.0649 6.0E5 134.0727 8.5E4 135.0442 6.2E5 135.0804 1.1E5 141.4679 1.3E4 144.0572 9.5E4 145.0289 1.6E4 145.0649 1.1E4 146.0364 1.7E5 147.0332 6.9E3 147.0442 2.4E6 148.0519 3.4E5 149.0598 4.4E5 150.0677 4.5E5 157.0397 1.3E4 157.4046 1.1E4 158.0362 6.0E4 159.0442 2.0E5 160.0521 7.1E5 161.0249 3.0E4 161.0599 1.2E6 162.0513 9.3E4 162.0677 7.1E6 163.0233 4.7E4 163.0391 2.4E6 163.0755 1.3E6 163.3336 1.3E4 165.0914 2.9E5 167.0705 2.6E5 172.0522 8.8E4 173.0229 1.9E4 173.5253 2.5E4 173.5330 1.6E5 173.5425 1.9E4 174.0314 8.5E5 175.0393 1.9E6 176.0471 1.7E6 176.0647 2.7E4 177.0549 1.2E6 178.0441 6.9E4 178.0490 2.3E4 178.0628 6.4E6 188.0470 6.3E5 189.0343 6.9E4 189.0396 1.0E4 189.0549 3.3E6 189.0746 9.5E4 190.0111 1.8E4 190.0227 2.9E5 190.0307 5.4E4 190.0626 3.5E7 190.0937 5.4E4 190.1031 1.8E5 191.0341 7.3E6 191.0704 2.7E6 191.4475 9.2E3 192.0419 3.3E5 192.0610 8.6E3 193.0448 1.1E5 193.0539 8.6E4 193.0714 9.8E4 193.0862 2.6E7 193.1193 2.5E4 193.1273 1.8E5 193.1390 2.7E4 194.0902 1.9E4 205.0502 2.4E5 206.0130 9.7E3 206.0415 1.0E5 206.0578 1.4E7 206.1031 1.4E4 221.0021 2.0E4 221.0158 1.2E5 221.0305 6.0E5 221.0410 4.7E5 221.0811 8.7E7 221.1210 2.9E5 221.1322 5.8E5 221.1467 1.7E5 221.1608 2.2E4 222.0846 1.5E5 223.0865 1.4E5 273.0711 9.4E3 277.1270 9.3E4 293.6410 1.2E4 299.0117 1.1E4 308.0672 1.0E4 END IONS BEGIN IONS FEATURE_ID=464 PEPMASS=661.2738 SCANS=464 RTINSECONDS=544.11 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 6 (1 removed due to low quality, 0 removed due to low cosine). 71.8631 2.2E3 72.5924 2.5E3 72.6618 2.3E3 78.5499 2.3E3 80.1661 2.2E3 80.4231 2.7E3 80.8726 2.5E3 85.5333 1.7E4 85.5348 3.0E3 86.4695 2.5E3 88.0691 2.7E3 98.4324 2.3E3 104.3528 2.8E3 108.3343 2.3E3 109.3349 2.5E3 114.2908 2.3E3 117.0564 2.2E3 118.0293 2.6E3 118.5687 2.3E3 118.8716 2.1E3 122.0572 5.3E4 122.3333 2.2E3 123.0412 2.6E4 125.8711 2.6E3 130.4611 2.2E3 133.9412 2.1E3 136.0168 2.4E3 140.3046 2.3E3 158.1349 2.2E3 173.5253 4.4E4 173.5392 2.7E4 188.7172 2.9E3 199.5022 2.8E3 202.8856 2.8E3 217.3739 2.5E3 221.0802 1.1E4 243.0622 3.1E3 244.6397 2.8E3 254.7350 2.7E3 304.4031 2.6E3 327.1077 3.6E4 330.1187 2.6E3 342.0344 3.5E4 342.1307 6.1E6 342.2059 1.9E4 342.2291 3.1E4 343.1330 3.5E3 345.1059 2.9E3 350.5670 2.6E3 383.1559 9.0E3 455.6665 2.5E3 479.3565 2.3E3 525.0709 2.6E3 593.6865 2.7E3 END IONS BEGIN IONS FEATURE_ID=465 PEPMASS=342.1316 SCANS=465 RTINSECONDS=544.13 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 9 (3 removed due to low quality, 0 removed due to low cosine). 50.0380 3.7E3 51.1809 3.5E3 52.2676 3.6E3 54.7629 3.9E3 55.4169 3.5E3 57.4390 3.2E3 57.9043 2.8E3 58.3144 2.9E3 58.8868 2.5E3 59.1161 2.8E3 60.3916 2.8E3 60.6754 2.7E3 63.6259 3.7E3 66.2391 3.3E3 67.6569 3.4E3 69.4720 3.1E3 71.6597 2.4E3 81.0696 3.9E3 82.9908 2.4E3 94.3600 2.7E3 97.5236 2.7E3 106.5579 3.3E3 114.5182 3.5E3 121.3991 2.8E3 122.0572 1.3E5 123.0413 4.8E4 127.0245 2.8E3 129.1971 4.4E3 135.0802 2.5E4 138.7210 2.5E3 142.5800 4.2E3 146.3728 3.3E3 160.7299 3.5E3 161.0601 2.9E3 163.0751 5.5E3 164.0699 1.2E4 167.2154 3.2E3 173.4065 3.0E3 173.5220 2.9E4 173.5379 1.3E5 179.3049 3.6E3 181.6029 4.4E3 187.6984 2.2E3 190.0639 2.9E3 191.0702 7.7E4 193.0866 2.8E3 197.2691 2.9E3 221.0807 1.1E5 228.2761 3.1E3 228.5988 3.6E3 230.4212 3.0E3 264.1868 3.8E3 265.0842 2.9E3 267.0241 3.5E3 280.0956 2.5E3 281.1040 3.0E3 296.7270 4.3E3 299.1133 3.6E3 322.3414 3.9E3 327.1082 3.7E4 342.0834 1.3E4 342.0967 2.5E3 342.1311 5.8E5 END IONS BEGIN IONS FEATURE_ID=466 PEPMASS=358.1053 SCANS=466 RTINSECONDS=544.328 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 58.0657 2.2E3 66.4586 2.2E3 66.8823 2.4E3 76.2765 2.2E3 79.8854 2.6E3 80.7193 2.4E3 84.7846 2.2E3 87.4338 2.1E3 90.1713 2.5E3 97.5473 2.6E3 103.6037 2.4E3 103.6117 2.3E3 112.3789 2.5E3 124.8552 2.1E3 149.6879 5.5E3 149.7392 2.4E3 170.2379 2.3E3 173.5308 5.5E4 173.5448 1.4E4 180.0106 2.6E3 183.6175 2.6E3 217.9704 2.6E3 222.2153 2.8E3 239.4520 2.2E3 276.3654 2.9E3 318.1549 2.9E3 END IONS BEGIN IONS FEATURE_ID=467 PEPMASS=467.1817 SCANS=467 RTINSECONDS=544.881 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 4 (2 removed due to low quality, 0 removed due to low cosine). 61.4240 4.0E3 65.2249 5.0E3 73.6868 2.2E3 73.8828 3.9E3 79.0541 1.6E4 81.2988 5.3E3 81.8453 5.4E3 88.5311 4.7E3 91.0542 1.6E4 95.0494 2.8E3 98.0601 1.3E4 99.2362 4.3E3 102.0464 2.1E4 103.0541 1.0E4 105.0697 1.1E4 107.0490 1.6E4 118.0411 1.5E4 119.0490 3.0E4 120.0573 8.7E3 130.0414 2.7E4 131.0490 1.4E4 132.0569 1.8E4 133.0280 3.1E3 133.0649 2.9E4 135.0440 3.9E4 146.0373 4.7E3 147.0440 1.3E5 148.0520 1.8E4 149.0595 3.0E4 150.0548 1.5E4 150.0676 1.9E4 159.0444 3.7E3 160.0521 3.2E4 161.0598 5.5E4 162.0675 3.6E5 162.0832 1.3E4 163.0390 1.3E5 163.0752 5.5E4 165.0914 1.4E4 167.0703 1.7E4 173.5236 2.0E4 173.5325 2.3E4 173.5428 1.9E4 174.0313 3.9E4 174.0466 2.3E3 175.0391 9.6E4 176.0471 7.1E4 177.0548 6.8E4 178.0626 2.9E5 181.0876 2.5E3 188.0463 2.6E4 189.0547 2.2E5 190.0624 2.2E6 191.0140 1.6E4 191.0339 4.2E5 191.0701 2.0E5 192.0413 2.0E4 193.0860 1.8E6 193.1276 9.6E3 205.0498 1.1E4 206.0575 8.5E5 219.0490 5.7E3 221.0302 9.0E4 221.0405 5.6E4 221.0809 1.4E7 221.1203 6.8E4 221.1321 9.2E4 221.1465 2.7E4 221.1606 6.6E3 221.1748 8.9E3 222.0844 8.4E4 223.0865 1.5E4 231.4379 5.3E3 247.1068 1.5E4 422.5200 5.1E3 END IONS BEGIN IONS FEATURE_ID=468 PEPMASS=342.2431 SCANS=468 RTINSECONDS=551.506 CHARGE=1+ MSLEVEL=2 MERGED_STATS=1 / 1 (0 removed due to low quality, 0 removed due to low cosine). 53.9134 2.1E3 55.0540 2.8E4 57.0699 3.7E3 60.0022 2.1E3 67.0539 1.4E5 67.0580 2.1E3 69.0695 2.3E4 69.8596 2.3E3 77.0384 2.6E3 77.7704 2.2E3 79.0539 8.1E4 81.0695 9.0E4 83.0852 8.7E3 91.0539 2.7E4 93.0695 8.7E4 94.7934 2.6E3 95.0488 5.3E3 95.0852 7.6E4 97.1003 3.1E3 103.0544 3.5E3 105.0698 8.9E3 105.9464 2.4E3 107.0852 4.8E4 109.1009 3.3E4 117.0700 3.6E3 119.0491 3.2E3 119.0853 1.2E4 121.0645 5.7E3 121.1009 2.9E4 123.0438 2.6E4 123.1164 5.1E3 129.0700 5.6E3 131.0489 1.7E4 131.0857 5.4E3 133.0648 3.4E3 133.1019 6.0E3 135.0436 1.5E4 135.1164 1.2E4 136.0474 1.1E4 137.0595 6.3E4 143.0496 5.0E3 143.0855 3.4E3 145.0645 1.4E4 146.0596 5.7E3 147.0440 1.0E4 147.1163 4.0E3 149.0595 8.7E4 150.0545 2.8E3 151.0752 8.1E3 155.0852 4.8E3 157.0646 1.0E4 159.0803 9.7E3 161.0596 9.6E4 162.0665 6.5E3 163.0754 2.2E4 164.0706 3.3E4 164.8962 2.5E3 166.0862 3.7E4 169.0649 5.2E3 169.1015 2.4E3 171.0810 4.7E3 173.0598 4.3E4 173.5306 1.8E4 175.0756 4.2E4 177.0913 1.1E4 178.0859 4.5E3 180.1006 2.4E3 181.0660 3.7E3 183.0803 8.6E3 185.0955 6.0E3 187.0754 2.0E4 189.0912 1.6E4 191.1062 3.1E3 197.0962 3.2E3 199.0757 6.6E3 201.0913 3.1E4 203.1070 8.1E3 204.1025 6.8E3 206.1907 1.2E4 213.0915 1.0E4 215.1071 1.9E4 217.1210 3.6E3 227.1073 4.4E3 229.1207 3.0E3 240.8427 2.9E3 241.1218 3.1E3 255.1390 3.9E3 342.1409 3.1E3 342.2439 4.9E4 END IONS BEGIN IONS FEATURE_ID=469 PEPMASS=407.2587 SCANS=469 RTINSECONDS=551.506 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 6 (0 removed due to low quality, 0 removed due to low cosine). 54.5185 2.3E3 54.6474 2.3E3 55.0268 2.2E3 55.0541 6.0E3 57.0696 2.6E4 59.0491 7.1E3 59.8205 2.1E3 61.0361 2.3E3 62.2288 2.9E3 64.0299 2.4E3 65.4182 2.3E3 67.0539 3.5E3 67.8966 2.4E3 69.0333 1.6E4 69.0694 3.1E3 70.7878 2.9E3 70.8039 2.3E3 70.9203 2.4E3 71.7860 2.3E3 74.2407 2.4E3 78.6276 2.1E3 79.0540 2.0E4 81.0695 6.5E4 83.0489 1.3E4 84.1830 2.5E3 85.0645 2.2E4 85.2406 2.1E3 91.0539 2.3E4 91.3247 2.4E3 93.0695 8.8E4 95.0488 1.3E5 95.0852 3.0E4 97.0645 1.5E4 100.1085 2.5E3 105.0173 2.4E3 105.0695 1.0E5 107.0851 7.6E4 108.4658 2.5E3 109.0645 4.3E4 109.0721 2.6E3 109.1015 3.1E3 111.0798 2.8E3 113.3712 3.0E3 117.0695 1.0E4 119.0470 2.3E3 119.0851 9.5E4 119.4161 2.5E3 121.0645 5.2E4 121.1009 4.0E4 123.0800 4.7E4 123.1169 3.6E3 128.0997 2.3E3 129.0697 9.3E3 131.0853 5.8E4 133.0646 2.6E4 133.1008 4.8E4 135.0802 4.6E4 137.0585 2.8E3 137.0960 2.2E4 137.8877 2.8E3 139.0746 9.6E3 142.0773 6.8E3 143.0851 8.0E4 144.0931 7.2E3 144.3839 2.3E3 145.1008 1.2E5 146.1425 2.4E3 147.0800 5.7E4 147.1164 1.6E4 147.1488 2.4E3 149.0957 4.9E4 151.0751 9.3E4 155.0854 1.3E4 156.0930 2.2E4 157.1009 9.8E4 157.3207 2.6E3 159.0805 2.3E4 159.1166 9.3E4 161.0958 4.9E4 161.1324 6.7E3 163.1118 9.1E3 165.0907 7.9E4 167.0853 6.0E3 167.4821 2.6E3 168.0930 2.8E3 169.1009 5.2E4 170.1086 3.3E3 171.0807 3.9E3 171.1167 8.5E4 173.0962 2.8E4 173.1325 2.6E4 173.5315 1.0E5 173.5442 7.7E3 175.1115 1.3E4 177.0908 5.6E4 177.1273 6.9E3 181.1008 4.0E4 182.1092 6.2E3 183.1168 4.4E4 183.8065 2.8E3 185.0960 1.3E4 185.1328 1.8E4 186.1018 2.9E3 187.1115 4.1E4 189.1271 4.1E4 193.1011 3.2E3 194.1092 9.3E3 195.1169 3.4E4 197.0950 2.6E3 197.1323 3.5E4 199.1117 6.3E4 199.1478 1.5E4 201.1276 1.6E4 203.1426 2.7E4 207.1166 2.3E4 207.1381 3.7E4 209.1328 4.1E4 211.1116 1.4E4 211.1485 4.8E3 213.1272 2.4E4 215.1436 6.8E3 216.7920 2.8E3 217.1219 2.9E3 221.1322 1.1E4 221.1541 1.3E4 223.1122 8.5E3 223.1479 1.5E4 224.1223 2.7E3 225.1284 8.9E3 225.1637 1.2E4 227.1429 2.1E4 229.1229 3.5E4 231.1384 1.2E4 235.1481 6.9E3 237.1276 8.7E3 241.1227 2.3E3 247.1450 4.3E3 249.1279 3.5E3 249.1625 2.7E3 253.1559 2.7E3 267.1424 2.3E3 267.1746 1.0E4 271.1710 5.7E3 278.4828 2.3E3 279.1730 2.8E3 285.1843 1.2E4 286.1926 9.2E3 287.2004 9.8E3 289.1647 2.7E3 298.9062 2.4E3 302.2735 2.3E3 365.1493 2.4E3 389.2461 2.6E3 407.2590 5.3E4 END IONS BEGIN IONS FEATURE_ID=470 PEPMASS=340.1161 SCANS=470 RTINSECONDS=551.718 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 3 (1 removed due to low quality, 0 removed due to low cosine). 55.4184 2.5E3 59.5615 2.4E3 61.3331 2.2E3 72.6618 2.3E3 73.8085 2.3E3 78.0461 5.8E3 95.2487 2.5E3 106.0412 3.6E3 115.0541 3.2E3 116.0616 6.3E3 129.0694 8.3E3 131.0488 9.7E3 133.0648 2.9E3 135.0437 6.5E4 136.0515 4.5E4 143.0484 3.6E3 144.0567 8.0E3 146.0598 3.4E3 148.0513 7.4E3 149.0593 7.4E3 157.0643 2.3E4 160.0500 2.5E3 161.0595 9.6E3 173.0597 1.2E5 173.5351 2.9E4 174.0672 1.4E4 176.0698 7.8E3 186.0675 1.1E4 187.0753 3.6E4 189.0551 4.8E3 192.0781 7.2E3 204.0783 2.3E4 209.8509 2.3E3 296.2670 2.4E3 340.1132 3.6E3 END IONS BEGIN IONS FEATURE_ID=471 PEPMASS=358.1413 SCANS=471 RTINSECONDS=551.9 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 51.9764 2.2E3 54.9947 3.0E3 57.1512 2.3E3 65.7971 2.2E3 68.4135 2.4E3 71.7677 2.7E3 71.8349 2.2E3 73.7339 2.3E3 78.0421 2.4E3 78.0463 8.0E4 79.0544 3.4E3 100.2885 2.4E3 103.0543 2.1E4 104.2242 2.8E3 106.0412 5.9E4 112.0034 2.9E3 114.9802 2.8E3 115.0543 2.3E4 116.0619 7.8E4 117.0695 3.6E3 119.0491 8.7E3 122.0361 3.3E4 124.0517 1.6E4 128.0625 4.0E3 128.2476 2.4E3 129.0697 1.5E5 131.0490 1.8E5 132.0568 6.1E3 133.0646 3.5E3 135.0439 9.6E5 135.0535 5.5E3 136.0517 5.0E5 136.0633 8.0E3 137.0607 3.3E3 143.0490 4.1E4 144.0568 1.8E5 145.0646 1.5E4 146.0704 2.6E3 147.0437 8.0E3 147.0804 5.6E3 148.0518 1.8E5 149.0596 4.2E4 150.0671 1.3E4 157.0501 3.7E3 157.0647 2.8E5 159.0430 3.1E3 160.0516 6.4E3 161.0596 1.2E5 162.0674 2.6E4 171.9829 2.5E3 172.0519 2.2E4 173.0598 8.0E5 173.5265 3.6E4 173.5426 1.0E4 174.0676 2.2E5 174.0850 3.3E3 175.0753 2.2E4 176.0829 4.0E3 185.0599 1.3E4 186.0675 9.6E4 187.0754 3.9E5 187.0950 1.3E4 189.0546 4.2E4 191.0702 2.6E4 192.0780 9.1E4 200.0835 2.0E4 201.6768 2.9E3 204.0783 1.0E5 224.1502 2.6E3 259.8222 2.3E3 310.7884 2.5E3 342.1336 3.0E3 END IONS BEGIN IONS FEATURE_ID=472 PEPMASS=205.0862 SCANS=472 RTINSECONDS=552.115 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 43.0177 1.6E4 43.0447 2.2E3 44.0806 2.2E3 45.0334 5.9E4 46.1540 2.4E3 48.7722 2.3E3 50.3096 2.1E3 50.8683 2.4E3 54.1265 2.3E3 55.0179 8.0E3 55.0540 3.2E3 55.9342 2.1E4 62.0916 2.7E3 64.9454 2.3E3 70.8420 2.5E3 72.9370 2.2E4 73.2091 2.1E3 73.3746 2.5E3 74.2605 2.2E3 75.6827 2.0E3 79.3038 2.3E3 81.0696 6.3E3 90.9475 2.3E4 91.0540 5.6E4 99.0954 2.8E3 100.5651 2.5E3 103.0539 3.1E4 105.0697 2.5E4 107.0487 5.1E3 107.0850 6.1E3 112.5130 2.6E3 113.9636 4.3E4 114.9713 2.7E3 115.0541 4.2E4 116.0619 2.9E4 117.0698 4.4E5 117.0786 3.4E3 119.0853 7.7E4 123.1169 8.4E3 126.2507 2.5E3 127.0542 9.4E3 128.0618 1.1E5 128.9507 1.1E4 129.0538 3.1E3 129.0696 1.3E6 129.0792 6.8E3 131.0489 1.1E5 131.0854 4.0E4 133.0647 5.2E4 135.0333 4.3E3 135.0439 1.2E5 135.1165 2.8E3 135.9446 2.9E3 144.0568 9.7E4 145.0515 6.3E3 145.0646 1.2E6 145.0761 1.0E4 147.0673 4.2E3 147.0802 1.4E5 149.0602 1.3E4 155.0600 2.2E4 157.0500 4.1E3 157.0646 7.4E5 157.0767 3.6E3 159.0437 2.4E3 159.0805 5.8E3 160.0515 3.8E3 161.0596 3.7E4 163.0392 1.1E4 163.0745 8.2E3 172.0518 6.1E4 173.0596 6.4E3 173.5198 4.0E3 173.5346 8.0E4 174.0500 7.4E3 174.0675 3.3E5 174.0857 4.6E3 175.0576 3.4E3 175.0753 3.0E5 175.0934 9.1E3 176.0460 8.3E3 177.0915 1.3E4 187.0753 7.2E5 187.0950 4.2E3 196.3267 2.5E3 204.8578 2.3E3 205.0859 4.5E4 210.8929 2.6E3 END IONS BEGIN IONS FEATURE_ID=473 PEPMASS=219.1019 SCANS=473 RTINSECONDS=552.115 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 3 (1 removed due to low quality, 0 removed due to low cosine). 43.0176 5.6E3 43.5267 2.3E3 46.6674 2.0E3 51.4949 2.9E3 55.0177 8.4E3 55.8503 2.4E3 55.9343 2.5E3 57.5654 2.3E3 79.0539 1.0E4 91.0540 1.1E4 92.7588 2.3E3 103.0541 4.2E3 105.0694 8.7E3 107.2093 2.5E3 115.0451 7.7E3 115.0539 1.3E5 117.0695 3.6E4 127.0538 5.6E3 128.0617 3.1E5 128.0706 2.0E3 128.0777 3.3E3 129.0695 1.7E4 131.0489 1.5E4 131.0853 5.1E4 133.0650 3.3E3 135.0437 1.6E4 137.0945 2.6E3 141.0695 2.1E4 142.0764 3.0E3 143.0490 8.2E4 143.0589 3.6E3 143.0853 7.5E5 143.0957 8.2E3 144.0574 3.1E3 145.0644 5.5E4 145.1011 1.4E4 149.0595 1.8E4 149.6829 4.6E3 149.6937 5.6E3 153.0698 1.7E4 153.8537 2.6E3 155.0602 1.9E4 156.0569 9.7E3 156.2221 2.5E3 158.0722 3.1E3 159.0439 1.3E4 159.0802 4.6E4 160.0514 1.1E4 161.0596 1.4E4 161.0965 4.6E3 171.0446 1.1E4 171.0803 3.9E5 172.0518 9.5E4 173.0597 2.1E5 173.0758 7.4E3 173.5244 2.2E4 173.5428 1.9E4 175.0748 9.8E3 185.0594 6.9E3 186.0675 1.2E5 189.0910 1.0E4 191.3161 2.5E3 196.5987 2.5E3 201.0910 1.4E5 203.1436 2.7E3 219.1759 4.3E3 END IONS BEGIN IONS FEATURE_ID=474 PEPMASS=458.0663 SCANS=474 RTINSECONDS=552.115 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 2 (0 removed due to low quality, 0 removed due to low cosine). 56.3121 2.4E3 74.6019 2.4E3 78.0460 3.4E3 81.0333 3.7E3 92.9048 2.3E3 101.0376 2.5E3 106.0404 3.1E3 109.7862 2.6E3 117.0696 2.0E4 120.0858 2.3E3 129.0694 4.0E3 131.0486 1.5E4 135.0437 1.6E5 136.0515 5.0E4 143.9119 2.3E3 145.0647 1.6E4 145.8534 2.4E3 148.0519 8.4E3 149.0587 2.4E3 149.5386 2.3E3 157.0647 1.2E4 161.0594 1.7E4 162.0677 9.3E3 167.9863 2.6E3 172.0524 3.9E3 173.0596 6.4E4 173.5214 7.1E3 173.5366 2.8E4 174.0674 2.0E4 175.0752 3.6E4 178.9795 7.5E3 179.9866 2.5E4 186.0674 1.1E4 187.0751 5.3E4 191.0693 2.6E3 191.9866 3.1E4 192.0780 1.9E4 193.9659 1.1E4 194.9737 1.4E4 195.9814 1.1E4 197.9980 2.6E3 204.0780 4.3E4 207.9590 8.0E3 207.9817 2.2E5 208.6454 2.3E3 208.9907 2.8E3 209.9612 2.9E3 209.9987 3.1E3 211.9765 7.0E3 221.9610 9.7E4 221.9986 3.2E3 223.9770 3.1E3 225.9922 8.0E4 232.9907 3.4E3 235.9768 1.8E4 244.0179 2.5E3 245.9980 7.3E3 247.0051 4.2E4 249.0087 3.6E3 262.0111 3.0E3 263.0158 6.8E3 264.0192 1.1E4 265.0149 1.0E4 276.0085 1.9E4 277.0164 3.2E4 288.1343 2.4E3 295.0270 2.0E4 322.0285 1.0E4 334.0329 2.8E3 343.0949 2.3E3 352.0397 7.5E4 364.0397 5.9E4 369.0575 3.7E3 382.0512 8.9E4 457.8282 2.6E3 END IONS BEGIN IONS FEATURE_ID=475 PEPMASS=770.2024 SCANS=475 RTINSECONDS=552.115 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 74.5140 2.5E3 81.0335 1.2E4 89.3626 2.7E3 90.9474 3.0E3 90.9800 2.2E3 94.6348 2.2E3 133.0644 3.1E3 135.0439 1.6E5 149.0595 2.7E4 149.6788 3.4E3 149.6874 1.0E4 149.6974 6.6E3 157.9660 1.2E4 161.0595 3.8E3 164.2085 2.4E3 173.0598 3.1E3 173.5308 2.1E4 173.5422 2.5E3 179.9867 2.9E3 186.0749 2.3E3 187.0756 6.9E3 191.9868 6.4E4 193.9657 3.4E3 194.9739 2.3E4 195.9817 1.3E4 206.9743 2.8E3 207.9817 8.0E4 208.9881 6.0E3 209.9975 6.9E3 210.9686 2.4E3 211.9761 7.3E3 212.9849 2.8E3 219.0109 4.9E3 219.9816 4.1E3 220.9887 1.1E4 221.9608 1.9E4 221.9979 5.9E3 225.9923 2.7E4 231.0103 3.1E4 232.9896 1.6E4 233.9975 7.7E3 237.9922 2.1E4 245.9978 1.6E4 247.0053 4.8E4 248.0129 1.4E4 249.0199 8.0E3 249.9918 1.3E4 251.0005 9.5E3 251.9749 2.9E3 252.0067 7.4E3 260.0123 1.4E4 261.0199 1.2E4 264.0072 2.5E3 265.0151 1.6E4 266.0236 2.9E3 268.0033 3.3E3 276.0081 2.8E5 276.0429 5.1E3 277.0159 1.8E5 278.9968 4.9E3 279.0315 7.1E4 288.8136 2.7E3 294.0188 3.0E3 295.0265 1.5E5 295.0620 2.5E3 312.0084 2.8E4 318.0398 3.7E3 322.0290 2.7E4 324.0435 1.4E4 326.0607 1.5E4 331.8773 2.5E3 334.0300 8.3E3 336.0421 5.1E3 340.0390 1.9E4 352.0390 4.6E5 353.0469 8.2E3 353.2236 2.8E3 354.0541 3.3E3 364.0393 3.9E4 365.0303 2.6E3 366.0546 4.4E4 372.0645 4.8E3 382.0498 9.6E4 383.0574 2.6E4 384.0656 2.2E4 385.8365 2.9E3 396.0659 1.4E4 400.0599 1.7E4 412.0605 1.0E5 414.0760 2.3E5 430.0713 1.0E4 517.0949 8.8E3 545.1454 2.3E3 679.1110 2.8E3 END IONS BEGIN IONS FEATURE_ID=476 PEPMASS=293.1177 SCANS=476 RTINSECONDS=552.195 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 6 (3 removed due to low quality, 0 removed due to low cosine). 49.0697 2.8E3 52.0645 3.0E3 53.3063 2.6E3 54.7219 2.8E3 55.0178 5.8E4 62.1784 2.7E3 63.3009 2.6E3 69.0337 3.8E3 77.0388 1.3E4 79.0541 5.1E4 89.1291 3.0E3 91.0073 2.7E3 91.0541 8.8E4 93.0697 3.4E4 95.0491 3.2E4 103.0541 5.8E5 103.0602 3.9E3 103.0623 4.1E3 105.0444 4.0E3 105.0617 6.5E3 105.0697 5.5E5 105.0770 6.7E3 105.0782 2.5E3 107.0490 2.2E5 115.0542 6.1E4 117.0698 2.2E4 119.0490 2.9E4 121.0551 5.4E3 121.0647 4.8E5 121.0733 3.6E3 125.2261 2.6E3 128.0623 1.7E4 129.0695 1.6E4 130.0411 1.2E4 131.0263 6.7E3 131.0490 2.8E6 131.0578 2.6E4 131.0725 3.5E3 132.0569 2.6E4 132.1028 2.6E3 133.0647 3.1E6 133.0882 1.9E4 135.0319 2.8E3 135.0440 4.8E5 135.0559 1.3E4 138.2175 3.0E3 141.0693 1.1E4 143.0491 6.2E4 143.0857 1.3E4 144.0569 2.3E4 145.0527 4.7E3 145.0647 2.1E5 147.0443 3.7E3 149.0459 3.7E3 149.0596 7.6E5 149.0738 1.5E4 153.0698 1.0E4 154.0777 2.9E3 156.0571 1.8E4 157.0648 1.1E5 159.0443 4.1E3 160.0518 9.8E4 160.2818 3.0E3 161.0597 2.2E6 161.0910 1.4E4 165.0705 3.5E3 169.0647 1.7E4 171.0806 5.8E4 172.0522 8.3E3 173.0599 2.8E5 173.0767 5.5E3 173.5341 5.3E4 174.0675 2.5E4 179.0857 2.1E4 181.0642 4.1E3 185.0421 5.7E3 185.0598 1.8E5 186.0676 2.0E5 187.0752 1.7E4 192.0938 1.6E4 193.0655 9.5E3 193.1008 1.4E4 194.0730 1.7E4 195.0806 7.5E3 199.0758 2.1E4 202.0780 4.5E4 203.0868 3.4E3 204.1354 3.4E3 205.0655 2.8E3 205.1027 3.0E3 206.0733 5.0E3 207.0806 5.2E4 207.1171 4.8E4 214.1008 2.6E3 217.1015 1.1E5 218.0745 3.5E3 219.0806 2.0E4 220.0885 1.2E5 221.0964 1.4E4 222.1150 2.5E3 223.0752 1.5E4 227.0848 8.0E3 231.0809 1.4E4 233.0960 2.1E4 235.0759 2.4E4 235.1120 3.4E5 237.0911 2.7E3 238.0628 4.9E3 241.6271 2.8E3 244.0885 3.7E3 245.0669 3.2E3 245.0961 1.4E5 247.0756 1.3E4 248.0833 9.3E4 250.0981 3.6E3 251.0700 1.1E4 251.8999 3.1E3 260.0829 2.9E3 261.0913 3.6E3 263.0812 2.5E3 263.1066 2.2E5 264.0790 1.0E4 265.0872 7.9E3 265.1221 1.1E4 275.1067 3.5E3 278.0942 4.3E4 293.1174 1.5E5 END IONS BEGIN IONS FEATURE_ID=477 PEPMASS=341.1387 SCANS=477 RTINSECONDS=552.195 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 6 (3 removed due to low quality, 0 removed due to low cosine). 50.4080 8.6E3 51.0234 5.7E4 52.8484 5.5E3 52.9605 5.2E3 53.0386 2.7E4 53.2851 5.4E3 55.0179 1.0E5 60.5185 5.0E3 62.6741 9.7E3 65.0388 6.1E3 66.8095 5.6E3 67.0542 5.7E4 69.0335 4.9E4 74.7486 8.6E3 77.0389 1.2E5 78.0463 4.8E4 79.0542 3.1E5 81.0334 8.7E4 81.0699 4.5E4 81.5633 8.8E3 83.0491 4.7E4 91.0542 2.7E5 93.0700 6.9E4 94.0774 6.9E3 95.0491 3.8E5 100.4656 9.1E3 103.0542 5.0E5 103.0615 1.7E4 105.0335 1.2E5 105.0446 7.1E4 105.0698 9.0E5 106.0414 9.4E4 107.0046 1.2E4 107.0491 5.1E5 108.2462 9.9E3 109.0650 5.4E4 115.0543 1.1E5 115.0947 5.8E3 117.0698 2.3E5 119.0492 1.9E5 121.0285 8.1E4 121.0647 5.1E5 123.0338 6.1E3 123.0440 5.5E5 123.0536 6.7E3 128.0621 7.8E4 129.0699 1.9E5 130.0776 6.2E4 131.0491 3.5E6 131.0856 7.7E4 132.0571 5.2E4 133.0648 4.4E6 133.4532 1.2E4 134.0363 1.4E6 134.0452 6.6E3 135.0210 1.6E5 135.0247 5.2E4 135.0441 2.3E7 135.0634 4.7E4 135.0682 1.6E5 135.0816 2.6E4 136.0514 6.9E3 137.0597 3.1E5 141.0699 6.6E4 143.0491 1.7E5 143.0856 2.5E5 144.0568 4.4E4 145.0516 1.5E4 145.0648 8.2E5 146.0724 3.2E4 147.0442 3.9E4 147.0809 3.9E4 148.0517 8.8E4 149.0597 3.9E6 151.0386 1.3E4 151.0766 1.1E4 153.0695 4.9E4 155.0610 1.2E4 155.0857 4.2E4 157.0648 4.1E5 158.0725 5.6E4 159.0441 1.4E5 159.0806 1.2E5 160.0520 2.0E5 161.0437 2.2E4 161.0598 3.3E6 162.0684 7.6E3 163.0756 3.2E5 165.0546 6.5E4 165.0698 4.1E4 167.0857 3.9E4 169.0649 1.3E5 171.0806 4.6E5 172.0513 3.0E4 173.0464 3.8E3 173.0599 1.0E6 173.0963 3.5E4 173.5322 2.6E5 174.0675 2.1E5 175.0757 2.7E5 175.0880 1.0E4 179.0857 4.3E4 181.0647 6.1E4 183.0805 1.0E5 185.0600 2.7E5 185.0963 5.6E3 186.0677 3.6E5 187.0756 1.2E6 187.0950 4.0E4 188.0830 2.9E4 189.0552 7.5E3 189.0908 4.3E4 191.0873 7.4E3 192.0924 2.0E4 193.0650 5.8E3 193.1019 2.1E4 194.0731 1.8E4 195.0806 1.0E5 197.0600 2.5E5 197.0958 3.6E4 199.0755 1.4E5 200.0839 8.0E3 201.0913 4.1E5 202.0784 1.9E4 203.0705 2.3E5 204.0777 5.8E4 205.0846 3.5E4 205.1037 1.1E4 207.0811 8.9E4 207.1171 7.5E4 209.0598 8.8E4 209.0956 3.3E4 210.0678 8.6E3 211.0758 1.3E5 212.0482 6.9E3 213.0914 9.5E4 214.0629 2.2E4 217.1016 1.4E5 219.0796 2.6E4 219.1181 1.4E4 220.0883 1.0E5 221.0964 6.0E4 223.0753 9.3E4 223.1117 1.4E4 224.0842 1.1E4 225.0555 1.1E4 225.0916 6.7E4 227.0708 1.2E5 227.1080 7.4E3 228.0773 1.0E4 229.0863 3.1E5 231.1019 4.4E4 232.0895 1.2E4 233.0967 3.6E4 234.0674 2.4E4 234.1054 5.9E3 235.0761 8.3E4 235.1119 3.7E5 236.0828 1.7E4 237.0912 8.0E4 237.1302 6.1E3 239.0706 4.3E4 239.1087 7.7E3 240.0790 6.8E3 241.0865 4.4E4 242.0959 1.2E4 245.0963 2.0E5 247.0756 1.0E4 247.1118 6.4E4 248.0838 1.1E5 249.0913 2.8E4 251.0709 2.4E4 251.1069 5.5E4 253.1217 7.1E3 255.1027 6.3E3 257.0811 7.2E4 261.0911 1.5E4 263.1068 3.2E5 265.0871 4.7E4 265.1224 6.9E4 267.1384 2.3E4 269.1179 6.6E3 275.1076 4.6E4 277.1220 7.1E3 278.0954 3.3E4 293.1176 1.9E5 295.1334 2.2E4 308.1048 4.0E5 323.1281 4.2E5 323.1668 1.6E4 326.0706 1.3E4 326.1153 7.6E5 326.1598 6.8E3 326.3135 5.4E3 332.4500 1.2E4 341.1385 3.0E6 END IONS BEGIN IONS FEATURE_ID=478 PEPMASS=201.0912 SCANS=478 RTINSECONDS=552.206 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 4 (1 removed due to low quality, 0 removed due to low cosine). 40.7065 2.4E3 43.0177 9.5E3 44.0317 2.9E3 49.3053 2.2E3 50.5924 2.3E3 55.0176 3.3E4 55.9341 8.0E4 56.9346 3.0E4 57.4864 2.8E3 63.0241 2.7E3 63.0386 2.5E3 65.0384 9.1E3 66.0719 2.3E3 66.1063 2.1E3 68.6626 2.8E3 72.9369 1.5E4 73.9370 3.3E3 78.7123 2.3E3 79.0539 4.1E4 81.1232 2.4E3 86.0232 2.3E3 87.7482 2.6E3 89.9396 2.9E3 90.3203 2.4E3 90.9474 2.0E4 91.0539 2.1E4 91.9480 4.9E3 92.0676 2.4E3 95.0488 1.3E4 103.0540 2.4E4 103.6395 2.3E3 105.0694 1.6E4 107.9503 1.3E4 113.9636 2.2E3 114.9481 5.8E3 114.9714 9.1E3 115.0450 4.4E3 115.0539 6.0E5 115.0663 2.5E3 115.0683 3.4E3 115.9793 3.2E3 116.0618 6.4E3 117.0696 6.0E4 122.0360 5.9E3 123.3959 2.2E3 127.0541 5.7E4 128.0618 2.3E6 128.0713 3.3E4 128.0837 1.6E4 128.9506 1.7E4 129.0696 6.8E4 129.9517 1.2E4 130.0410 8.2E3 130.0776 1.0E4 131.0489 2.5E4 131.0852 9.4E3 131.9739 3.0E4 132.9590 6.0E3 133.5971 2.5E3 135.0439 2.9E4 135.9456 1.1E4 136.9455 2.9E3 141.0697 1.3E5 142.0776 3.9E4 143.0363 4.7E3 143.0490 2.3E5 143.0568 2.4E3 143.0853 2.8E6 143.0957 3.7E4 143.1095 2.2E4 145.0645 1.6E5 145.1006 1.1E4 149.6814 5.7E3 149.6923 4.3E3 152.0618 4.4E4 153.0698 8.3E4 154.0768 3.0E3 155.0473 4.5E3 155.0601 1.4E5 156.0568 6.4E4 158.0728 6.3E3 159.0441 3.6E4 159.0802 4.4E3 160.0518 3.5E4 161.0594 1.4E4 169.0636 3.1E3 170.0731 5.9E3 171.0444 5.5E4 171.0804 9.6E5 172.0520 3.1E5 172.0691 5.4E3 173.0598 3.6E5 173.0844 3.0E3 173.5286 1.9E4 173.5362 8.1E3 181.0765 1.1E4 185.0600 3.2E4 186.0676 2.5E5 199.0753 8.8E3 201.0912 1.5E5 203.5991 3.1E3 END IONS BEGIN IONS FEATURE_ID=479 PEPMASS=717.2909 SCANS=479 RTINSECONDS=552.206 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 3 (1 removed due to low quality, 0 removed due to low cosine). 69.3799 5.6E3 77.0389 2.3E4 79.0542 3.3E4 81.0696 5.2E3 82.8545 6.3E3 84.3353 5.2E3 91.0542 1.8E4 95.0490 2.2E4 95.0854 1.1E4 102.8276 2.9E3 103.0542 3.8E4 105.0340 1.2E4 105.0698 5.0E4 107.0492 3.7E4 115.0548 4.3E3 117.0702 1.2E4 121.0647 1.3E5 123.0438 7.9E3 128.0624 7.6E3 131.0491 2.5E5 133.0648 1.4E6 135.0440 3.6E6 135.0679 1.0E4 137.0597 3.2E3 143.0491 1.1E4 143.0853 2.3E4 145.0647 9.0E4 149.0458 6.9E3 149.0597 3.6E5 149.0697 3.1E3 151.0756 4.5E3 157.0647 5.2E4 159.0431 3.2E3 160.0516 1.2E4 161.0598 1.4E6 163.0754 7.8E4 171.0807 9.3E4 172.0528 3.1E3 173.0599 1.2E5 173.5116 3.4E3 173.5252 4.9E4 173.5445 2.4E4 173.5531 3.6E3 175.0756 6.1E4 185.0598 4.4E4 186.0677 4.9E4 187.0755 2.4E5 199.0759 1.1E4 201.0912 3.0E5 205.0861 8.1E4 219.1013 1.0E4 235.1120 5.0E4 244.6003 3.0E3 245.0960 1.9E4 247.1120 7.6E3 249.7090 5.2E3 263.1063 1.2E5 263.6326 3.7E3 293.1175 3.9E5 305.1170 2.0E4 308.1046 3.7E4 321.1113 5.6E3 323.0823 1.2E4 323.1281 1.0E6 341.1383 1.8E5 576.5006 9.4E3 END IONS BEGIN IONS FEATURE_ID=480 PEPMASS=323.1284 SCANS=480 RTINSECONDS=552.285 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 11 (8 removed due to low quality, 0 removed due to low cosine). 51.0234 2.6E5 52.3967 2.1E4 53.0386 1.7E5 54.5985 4.2E4 55.0178 6.8E5 55.9577 4.1E4 59.7099 4.1E4 62.9096 3.6E4 64.9243 4.8E4 64.9842 4.9E4 69.0331 4.5E4 77.0388 5.6E5 77.8410 3.9E4 79.0541 1.4E6 81.5071 1.9E4 91.0541 1.6E6 91.3679 1.9E4 92.0617 4.4E4 93.0698 4.0E5 95.0490 8.2E5 103.0463 5.9E4 103.0541 4.6E6 103.0623 2.5E4 105.0334 3.9E5 105.0448 1.3E5 105.0617 1.5E5 105.0698 6.9E6 105.0763 3.9E4 105.0783 1.5E5 107.0415 8.5E4 107.0490 2.9E6 109.8139 4.3E4 115.0542 8.8E5 117.0698 1.2E6 119.0490 1.2E6 120.0567 2.2E5 121.0647 5.7E6 121.0728 2.8E4 123.0434 5.1E4 123.0804 2.0E5 128.0620 3.8E5 129.0697 7.1E5 131.0490 3.6E7 131.0579 6.1E5 131.0716 8.5E4 131.1275 5.2E4 132.0568 4.8E5 133.0647 5.0E7 133.0881 3.9E5 135.0196 2.2E5 135.0439 9.9E7 135.0654 1.1E6 135.0704 4.9E5 135.0771 1.8E5 136.0524 4.3E4 137.0597 3.8E5 141.0699 1.8E5 143.0378 3.4E4 143.0490 1.8E6 143.0854 7.4E5 144.0568 2.9E5 145.0514 9.7E4 145.0646 6.1E6 145.0752 3.7E4 145.0777 1.4E5 145.9323 4.6E4 147.0440 1.2E5 148.0517 3.4E5 148.2723 4.6E4 149.0596 1.6E7 149.0699 1.1E5 151.0752 3.5E5 153.0699 9.1E4 155.0605 8.9E4 156.0575 8.4E4 157.0503 3.1E4 157.0647 2.7E6 158.0727 6.2E4 159.0440 9.9E5 160.0518 1.9E6 161.0596 3.9E7 161.0911 2.6E5 162.0679 4.3E4 163.0753 1.5E6 165.0699 8.8E4 169.0648 4.3E5 171.0445 2.0E5 171.0804 2.1E6 172.0522 3.6E5 173.0597 6.3E6 173.5302 5.5E5 174.0677 3.9E5 175.0755 1.2E6 179.0864 1.5E5 181.0647 1.1E5 181.0987 4.5E4 184.7684 4.5E4 185.0455 1.4E4 185.0597 3.3E6 186.0488 8.2E4 186.0675 4.1E6 187.0753 4.9E6 187.0947 1.3E5 188.4013 4.6E4 192.0935 1.6E5 194.0727 1.6E5 195.0800 1.1E5 199.0753 4.3E5 201.0910 1.3E6 202.0780 3.2E5 202.1679 2.4E4 205.1010 1.2E5 207.0804 4.9E5 207.1167 6.8E5 213.2760 2.3E4 217.1011 1.5E6 219.0807 2.0E5 219.1171 4.4E4 220.0883 8.0E5 221.0957 3.7E5 223.0757 1.5E5 227.0853 3.9E4 231.0818 1.1E5 232.0890 4.1E4 233.0960 4.2E5 235.0762 2.9E5 235.1117 4.3E6 245.0958 2.5E6 247.0760 9.7E4 247.1113 2.4E5 248.0829 1.1E6 249.0913 7.3E4 251.0701 1.7E5 260.0815 4.4E4 261.0903 2.7E5 263.1063 4.3E6 263.1381 9.8E4 264.0789 5.6E4 265.0867 1.8E5 265.1218 3.2E5 275.1068 4.0E5 278.0935 4.5E5 291.1019 2.0E5 293.1171 2.7E6 305.1164 2.0E5 308.1043 8.8E6 308.1648 6.4E4 323.0819 3.2E4 323.1277 1.4E7 326.1146 3.6E5 END IONS BEGIN IONS FEATURE_ID=481 PEPMASS=381.1314 SCANS=481 RTINSECONDS=552.328 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 2 (0 removed due to low quality, 0 removed due to low cosine). 58.1469 2.5E3 80.2254 2.1E3 88.1143 2.2E3 93.2006 2.2E3 97.9833 2.3E3 110.8176 2.2E3 150.0174 2.8E3 167.3757 2.3E3 173.5306 3.3E4 200.0451 3.0E3 339.7369 2.4E3 END IONS BEGIN IONS FEATURE_ID=482 PEPMASS=739.2728 SCANS=482 RTINSECONDS=552.328 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 2 (0 removed due to low quality, 0 removed due to low cosine). 134.9584 2.3E3 149.6708 3.2E3 149.6880 1.5E4 149.6980 2.8E3 158.8779 2.3E3 173.5321 1.0E4 204.5017 2.6E3 381.1311 6.2E4 698.9624 3.0E3 END IONS BEGIN IONS FEATURE_ID=483 PEPMASS=453.0874 SCANS=483 RTINSECONDS=552.532 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 60.6835 2.4E3 62.3043 2.8E3 65.3401 2.3E3 65.6422 2.5E3 73.5053 2.4E3 75.1777 2.3E3 77.6741 2.3E3 77.9807 2.8E3 79.2792 2.6E3 79.4616 2.7E3 79.7202 2.2E3 81.0331 1.5E4 83.2675 2.2E3 86.9792 2.4E3 87.3459 2.8E3 95.8337 2.5E3 96.4345 2.5E3 99.6397 2.4E3 99.7636 2.6E3 103.6625 2.2E3 110.0206 2.2E3 117.1173 2.3E3 118.6746 2.3E3 129.8795 2.3E3 130.0672 2.6E3 135.0332 1.2E4 135.0435 1.7E5 140.9543 2.3E3 148.4102 2.7E3 149.6862 5.5E3 149.6968 3.4E3 149.7075 3.0E3 157.9656 2.3E4 166.8358 2.6E3 168.3423 2.4E3 169.3694 3.3E3 173.5310 3.2E4 173.5435 4.7E3 178.9797 3.2E3 179.9867 1.6E4 191.9863 1.4E5 193.9668 3.2E3 194.9736 3.4E4 195.8286 2.4E3 195.9811 2.2E4 207.9813 6.4E4 208.9893 2.1E4 209.9616 6.0E3 209.9966 1.6E4 211.9773 1.0E4 212.9843 3.1E3 213.9917 3.5E3 219.0108 1.6E4 219.9816 4.9E3 220.9895 1.1E4 221.9607 3.5E4 221.9973 2.9E3 225.9922 1.7E4 231.9821 9.4E3 232.9894 2.1E4 237.9913 2.0E4 242.2039 2.4E3 245.9968 9.1E3 246.6092 2.6E3 247.0049 5.6E4 248.0124 7.0E3 249.0216 3.1E3 250.9993 8.5E3 253.7913 2.4E3 259.0038 2.7E3 265.0161 1.8E4 266.0386 6.5E3 276.0077 7.0E4 277.0157 9.3E4 278.9964 3.5E3 280.0187 2.9E3 288.3813 2.3E3 295.0265 5.8E4 297.6846 2.4E3 318.4551 2.8E3 322.0283 6.9E4 340.0391 1.3E4 352.0389 4.9E5 356.2320 2.2E3 382.0495 1.2E4 383.2539 2.5E3 END IONS BEGIN IONS FEATURE_ID=484 PEPMASS=233.1175 SCANS=484 RTINSECONDS=552.841 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 4 (1 removed due to low quality, 0 removed due to low cosine). 50.7952 2.5E3 51.1890 2.3E3 53.8000 2.4E3 55.0174 2.4E3 56.0318 2.5E3 57.0333 1.1E4 67.0541 7.7E3 71.3092 2.3E3 73.6477 2.5E3 76.1577 2.8E3 79.0548 2.4E3 84.2937 2.6E3 85.7582 2.5E3 91.0541 5.0E3 95.0490 2.6E3 105.0695 5.6E3 109.1891 2.1E3 115.0542 8.3E3 117.0697 9.5E3 121.0646 1.8E4 122.9789 2.3E3 128.0620 2.8E4 129.0695 4.1E4 131.0488 2.5E3 131.0855 1.6E4 131.8670 2.3E3 135.0806 4.6E3 137.0596 7.0E3 141.0697 2.3E4 142.0775 5.7E3 143.0489 1.0E4 143.0854 3.4E4 144.0565 1.0E4 145.0645 4.7E4 146.0724 1.6E4 147.0806 6.2E3 149.0597 9.9E3 149.0975 2.8E3 151.0751 4.3E4 153.0695 2.1E4 154.0775 1.2E4 155.0855 1.6E4 156.0568 1.3E4 157.0646 8.9E4 158.0726 6.2E4 159.0442 9.2E3 159.0658 3.4E3 159.0803 1.4E5 160.0883 2.6E4 160.3345 2.3E3 161.0597 2.7E4 162.0670 2.1E4 163.0754 2.7E3 165.0904 3.8E3 167.8182 2.4E3 168.0569 1.7E4 169.0648 5.9E4 170.0725 2.2E4 171.0804 9.0E4 172.0706 2.7E3 172.0883 3.1E5 172.1053 5.7E3 173.0598 2.0E5 173.0960 3.0E4 173.5246 3.3E4 173.5379 4.6E4 174.0676 4.8E4 174.0861 4.0E3 174.1039 1.3E5 175.0755 3.2E4 175.1115 4.4E3 176.0835 3.3E4 177.0912 2.9E4 183.0808 1.9E4 184.0883 1.6E5 185.0597 8.5E4 185.0961 7.6E3 186.0674 4.8E3 187.0754 5.3E4 188.0832 6.1E5 189.0911 5.4E4 190.0988 4.0E4 191.1067 3.6E3 199.0759 1.3E4 200.0833 1.1E5 200.4867 3.0E3 201.0909 3.7E3 202.0991 5.1E4 203.1068 2.3E5 205.0867 6.5E3 205.1223 4.2E4 212.5296 2.5E3 215.0839 3.0E3 215.1069 1.3E5 223.6319 2.4E3 233.1174 3.0E4 END IONS BEGIN IONS FEATURE_ID=485 PEPMASS=274.1442 SCANS=485 RTINSECONDS=554.245 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 6 (0 removed due to low quality, 0 removed due to low cosine). 46.4163 2.3E3 47.7670 1.1E4 53.0383 2.3E3 54.0337 6.5E3 55.0542 4.7E3 56.0494 1.1E4 59.6715 2.5E3 62.4028 2.6E3 63.1364 2.6E3 65.0382 8.0E3 65.9783 2.9E3 66.7375 2.1E3 67.0415 1.6E4 67.0541 1.1E5 67.1082 2.4E3 67.9335 2.2E3 68.0489 2.7E3 69.2978 2.2E3 70.3344 2.9E3 73.6821 2.2E3 75.7527 2.5E3 79.0541 3.9E3 80.0201 2.7E3 80.0494 1.2E4 81.4407 2.3E3 82.0286 1.8E5 82.0650 1.8E5 84.0806 3.8E4 91.0540 3.2E4 92.5621 2.5E3 93.4972 2.8E3 94.1595 3.0E3 96.3233 2.3E3 103.0539 2.2E4 104.1929 2.6E3 105.0697 4.2E4 107.3894 2.2E3 108.0807 6.1E3 110.0517 4.8E3 110.0599 5.2E5 119.0489 8.4E4 120.0569 1.5E4 121.2481 2.1E3 122.2011 2.4E3 126.8860 2.6E3 131.0489 5.3E3 131.4156 2.6E3 132.0570 3.4E4 133.0281 3.3E3 133.0647 4.5E4 135.0804 1.5E4 137.8905 2.4E3 145.1007 1.0E4 147.0439 8.3E4 148.0517 1.6E5 148.4745 2.2E3 149.6876 6.9E3 150.3226 2.2E3 151.0754 1.3E4 152.8549 2.3E3 157.0387 2.7E3 159.1168 2.2E4 160.0518 9.8E4 161.0598 3.0E4 163.0594 1.3E4 163.0753 7.9E5 163.0912 9.6E3 168.6919 2.2E3 168.8450 2.5E3 169.1013 1.2E5 170.7454 3.5E3 171.1044 4.1E4 173.5228 1.5E4 173.5357 8.5E4 173.5425 5.0E3 175.0390 1.1E5 176.0469 1.4E5 177.0552 7.9E3 182.4776 2.2E3 186.1278 1.5E5 187.1116 2.1E4 191.0300 2.3E4 191.0703 4.9E6 191.1018 7.6E3 191.1113 9.4E3 207.0657 2.1E4 232.1334 1.2E4 233.6312 2.7E3 240.8978 2.3E3 241.3600 2.5E3 242.7877 2.2E3 247.8932 2.3E3 257.2697 2.8E3 258.5764 2.6E3 274.1439 4.2E4 END IONS BEGIN IONS FEATURE_ID=486 PEPMASS=337.1440 SCANS=486 RTINSECONDS=554.255 CHARGE=1+ MSLEVEL=2 MERGED_STATS=10 / 10 (0 removed due to low quality, 0 removed due to low cosine). 50.8732 2.1E3 52.3792 2.2E3 53.2375 2.2E3 53.7096 2.1E3 53.8619 2.6E3 54.5357 2.4E3 54.7109 2.4E3 54.7695 2.3E3 56.1881 2.3E3 57.1310 2.4E3 61.1011 2.5E3 61.4789 4.7E3 61.8284 2.3E3 62.0284 2.2E3 62.0588 2.3E3 63.8709 2.3E3 63.8928 2.3E3 64.3365 2.6E3 66.6438 2.2E3 67.0489 2.5E3 67.4178 2.4E3 67.9218 2.3E3 70.1702 2.2E3 71.3034 2.3E3 74.3535 2.1E3 76.8262 2.4E3 78.0523 2.3E3 79.0968 2.1E3 83.1273 2.2E3 83.7184 2.6E3 85.3545 2.3E3 88.2437 2.7E3 91.0540 1.8E4 98.4965 2.4E3 102.0526 2.4E3 102.0990 2.5E3 103.0216 2.6E3 103.0541 1.8E4 105.0704 3.5E3 108.4787 2.8E3 110.2788 2.2E3 112.0350 2.6E3 113.6519 2.4E3 116.5172 2.6E3 117.0695 1.3E4 120.0291 2.1E3 121.0646 4.2E4 125.6716 2.9E3 131.0489 2.2E5 135.0438 2.3E5 136.0520 2.0E4 136.1056 2.2E3 141.0694 2.3E3 145.0647 3.0E3 145.7187 3.0E3 146.0726 1.0E5 147.0798 1.1E4 147.8440 2.6E3 149.0458 7.7E3 149.0594 7.6E5 149.0705 2.3E3 149.4098 2.7E3 150.0672 1.1E5 151.0622 4.5E3 151.0751 3.9E5 151.2981 2.9E3 152.7339 2.3E3 158.0728 6.4E3 161.0441 7.5E3 161.0595 6.2E5 161.0752 3.3E3 162.0681 1.5E4 163.4538 2.5E3 165.0909 1.0E6 165.1037 2.4E3 169.0661 2.5E3 173.0597 1.2E5 173.5262 5.9E4 173.5390 7.4E4 174.0680 3.2E4 176.8054 2.4E3 177.0649 3.2E3 177.0735 7.6E3 177.0910 1.0E6 177.1046 5.3E3 179.7452 2.6E3 185.0598 9.2E4 187.8721 2.8E3 189.0910 2.8E5 189.1060 2.6E3 199.0758 2.2E4 201.0914 5.5E4 207.9743 2.5E3 208.1940 2.9E3 215.1070 1.3E4 221.3699 2.3E3 231.5782 2.7E3 233.3309 2.4E3 236.4697 2.5E3 241.9740 2.6E3 242.2448 2.6E3 243.3297 2.5E3 243.3405 2.5E3 244.0714 2.3E3 247.9185 2.6E3 248.1197 3.8E4 256.2276 2.7E3 256.7129 2.5E3 261.0909 4.0E3 264.1147 3.3E3 274.1929 2.3E3 275.1066 1.1E4 276.1146 2.7E4 277.0854 5.6E3 278.9993 2.5E3 279.1383 7.5E4 291.1025 1.2E4 292.1109 7.4E3 305.1173 3.7E3 306.1254 2.0E5 307.0953 2.8E3 307.1336 6.5E4 319.0524 2.6E3 322.1202 3.2E4 337.1430 2.8E4 END IONS BEGIN IONS FEATURE_ID=487 PEPMASS=538.2076 SCANS=487 RTINSECONDS=560.091 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 9 (5 removed due to low quality, 0 removed due to low cosine). 64.8575 5.4E3 66.1577 7.4E3 67.0298 2.2E3 69.4969 4.7E3 73.7944 2.2E3 75.0440 3.3E4 77.1964 5.0E3 77.3240 6.3E3 77.5330 4.6E3 79.0542 6.5E3 80.0497 5.6E3 81.0333 1.4E6 81.0382 8.0E3 82.0286 4.8E4 83.5453 4.5E3 94.0652 1.8E4 98.0598 4.2E4 99.8395 4.4E3 104.0492 1.3E4 105.0546 6.4E3 107.9046 4.9E3 110.0235 1.5E5 115.7956 2.6E3 116.5057 2.6E3 122.0597 4.0E4 122.6199 6.3E3 123.1155 4.8E3 132.0442 3.3E4 134.0599 1.7E4 136.0385 1.7E4 150.0410 7.0E3 150.0548 4.8E5 153.6891 2.8E3 173.5220 8.4E4 173.5409 8.6E4 177.0785 4.8E3 178.0332 1.7E4 178.0500 7.9E5 178.0679 2.2E4 181.0859 2.0E5 181.8041 7.0E3 184.2473 5.1E3 195.0653 7.0E4 203.9076 4.4E3 206.0588 7.7E3 220.0966 8.0E3 221.0810 2.0E5 225.0742 2.7E3 225.2206 2.4E3 231.1012 1.7E4 232.0968 2.6E5 245.0786 1.5E4 247.0958 1.6E4 256.9136 5.3E3 270.0747 3.8E3 271.0971 3.8E4 272.1276 7.3E3 273.0759 1.4E5 276.1224 3.3E4 285.0998 5.4E4 287.4367 7.0E3 289.4883 2.3E3 292.1073 5.2E3 293.8439 7.9E3 299.2804 3.1E3 300.0829 2.0E4 300.1233 1.3E6 300.1626 3.2E4 307.0968 1.8E4 308.1035 6.9E3 319.0954 7.5E3 320.1040 9.9E3 321.1124 3.0E4 322.1204 1.1E4 323.1280 3.6E4 335.0898 4.8E4 335.1277 1.0E5 336.0983 7.5E3 337.1051 3.9E4 339.1216 4.2E4 349.1064 4.0E4 350.1142 5.3E4 351.0847 1.9E4 351.1224 3.6E5 352.0911 4.0E3 353.1402 7.5E3 354.1461 6.6E4 363.0866 1.2E4 365.0992 7.2E4 365.1389 1.8E5 366.1461 4.0E5 367.1175 3.5E5 367.1645 8.9E3 368.1255 7.9E3 370.1392 1.0E4 377.1028 7.2E3 379.0712 1.9E4 379.1173 1.1E5 380.1254 1.0E5 381.1329 1.6E5 382.1412 5.0E5 383.1132 4.7E4 385.1648 6.6E4 393.0968 5.8E4 394.1053 2.2E4 395.1074 1.6E5 395.1497 3.1E5 397.1640 7.6E4 398.1365 5.1E4 408.1208 1.8E5 409.1283 2.0E5 410.0895 4.1E3 410.1363 4.7E5 411.1075 1.3E5 413.1594 2.0E5 421.1545 7.8E3 423.1442 1.7E5 424.1751 4.0E4 426.1314 1.1E5 426.1975 7.1E3 428.8657 2.7E3 441.1541 1.9E5 452.1709 3.2E3 470.1747 7.1E3 492.1998 6.7E4 514.1749 5.2E3 527.1172 6.8E3 END IONS BEGIN IONS FEATURE_ID=488 PEPMASS=680.3183 SCANS=488 RTINSECONDS=560.098 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 10 (7 removed due to low quality, 0 removed due to low cosine). 71.9725 5.7E3 75.0441 7.1E3 78.8986 5.7E3 79.0542 3.4E4 80.0494 4.2E4 81.0221 2.9E4 81.0334 6.5E6 81.0446 4.6E4 82.0288 3.0E4 85.1654 5.7E3 91.9504 3.3E3 94.0650 5.4E4 95.0491 2.6E4 98.0235 1.3E4 98.0599 6.3E4 104.0493 2.0E4 106.0650 4.4E4 108.3368 2.9E3 110.0238 2.3E5 121.2577 3.2E3 121.5298 2.9E3 122.0599 1.3E5 132.0444 1.4E5 134.0599 1.3E5 136.0392 1.5E5 136.2110 6.2E3 142.7097 6.0E3 145.9958 3.6E3 148.6008 3.0E3 150.0548 2.8E6 160.0389 3.6E4 164.6030 5.3E3 173.5299 1.5E5 173.5447 2.9E4 175.9359 6.2E3 178.0024 5.9E3 178.0144 1.3E5 178.0210 2.4E4 178.0499 1.4E7 178.0793 3.5E4 178.0865 1.2E5 178.0966 2.6E4 178.1073 1.5E4 179.0532 1.1E4 181.0860 9.0E4 195.0654 2.8E4 196.0608 3.2E4 210.8199 6.0E3 220.0592 6.1E3 221.0810 2.3E5 232.0970 2.7E4 235.6011 5.3E3 266.4121 5.7E3 268.9666 3.1E3 273.0764 4.2E4 275.1032 2.5E4 277.1801 5.0E3 283.0330 3.2E3 300.1232 4.6E5 335.1295 1.1E4 345.1356 7.8E3 350.1134 6.2E3 351.0821 7.6E3 351.1239 5.0E4 352.1205 3.0E3 354.1458 2.4E4 360.1553 4.5E4 365.1386 4.5E4 366.1016 2.8E4 366.1464 9.5E4 367.1173 8.8E4 379.1213 7.2E3 380.1247 1.9E4 381.1330 1.4E5 382.1407 3.5E5 383.1125 1.3E4 385.1646 3.3E4 395.1489 2.7E5 397.1655 3.3E4 398.1360 4.1E4 399.1411 4.5E3 408.1207 2.6E4 409.1284 7.9E4 410.1359 2.1E5 411.1069 3.6E4 413.1592 4.5E5 423.1436 8.5E4 426.1313 6.7E4 441.1539 3.9E5 492.2007 5.4E4 495.7410 3.2E3 520.1976 1.0E4 538.2060 3.0E4 END IONS BEGIN IONS FEATURE_ID=489 PEPMASS=652.2871 SCANS=489 RTINSECONDS=560.122 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 10 (6 removed due to low quality, 0 removed due to low cosine). 67.0182 1.5E4 68.3170 4.5E3 79.0541 8.3E4 80.0494 9.8E4 81.0270 2.9E4 81.0332 1.7E7 81.0417 1.0E5 81.0426 3.0E5 81.0443 6.4E4 81.0823 1.4E4 82.0053 1.8E4 82.0285 5.7E4 83.6679 4.5E3 86.7967 4.8E3 89.0612 1.2E4 94.0648 1.6E5 94.5330 1.4E4 95.0491 6.1E4 95.6453 4.8E3 98.0598 1.5E5 104.0493 4.3E4 106.0648 1.1E5 108.0439 3.1E4 110.0235 5.9E5 115.7782 1.4E4 122.0597 3.4E5 128.6942 1.2E4 132.0441 3.2E5 134.0599 3.4E5 136.0390 3.9E5 150.0547 7.0E6 150.0662 8.9E4 160.0392 9.1E4 160.4429 1.9E4 166.6921 1.3E4 173.5240 3.4E5 173.5425 1.8E5 175.8281 5.4E3 176.9941 1.3E4 178.0130 1.7E5 178.0218 3.8E4 178.0498 3.2E7 178.0624 1.3E5 178.0861 3.0E5 178.0967 6.4E4 179.0525 1.8E4 181.0858 1.8E5 192.4123 1.2E4 195.0655 6.4E4 196.0605 2.3E4 203.4387 1.3E4 213.9153 5.5E3 221.0808 4.7E5 222.8239 1.7E4 223.0591 1.4E4 232.0976 7.6E4 271.1717 1.7E4 273.0762 9.6E4 275.1009 1.2E4 276.1220 1.4E4 300.1234 1.3E6 316.6608 1.4E4 335.1266 6.9E3 345.1346 1.7E4 351.1229 1.8E5 352.1109 1.2E4 353.1352 1.7E4 354.1467 3.1E4 360.1555 7.7E4 365.0960 7.3E3 365.1398 1.1E5 366.1012 4.0E4 366.1463 3.1E5 367.1181 2.4E5 380.1262 4.8E4 381.1335 3.2E5 382.1412 9.0E5 382.1936 2.6E4 383.1070 1.5E4 385.1640 8.5E4 392.5600 1.4E4 395.1492 7.3E5 397.1664 7.9E4 398.1359 1.1E5 408.1227 6.9E4 409.1285 2.1E5 410.1365 5.6E5 411.1084 9.3E4 413.1597 9.8E5 423.1444 2.3E5 426.1315 1.7E5 441.1542 8.7E5 451.0037 1.2E4 492.2020 1.4E5 499.3958 1.5E4 520.1976 5.6E3 533.7605 1.4E4 538.2064 5.0E4 538.7529 1.4E4 626.4964 5.3E3 END IONS BEGIN IONS FEATURE_ID=490 PEPMASS=635.2606 SCANS=490 RTINSECONDS=560.151 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 9 (5 removed due to low quality, 0 removed due to low cosine). 66.2638 1.2E4 67.8465 1.0E4 75.0440 4.0E4 79.0540 1.5E5 80.0493 2.3E5 81.0221 5.5E4 81.0333 2.6E7 81.0448 4.4E5 81.0479 2.4E4 82.0286 2.6E5 83.0499 1.9E4 87.7259 4.9E3 88.5378 1.2E4 91.7383 1.2E4 94.0650 2.9E5 94.3216 1.8E4 95.0489 1.7E5 96.0445 3.8E4 98.0235 4.4E4 98.0599 3.2E5 104.0493 1.6E5 105.6802 1.6E4 106.0649 1.8E5 107.0492 3.3E4 108.0440 7.9E4 110.0147 1.7E4 110.0235 1.3E6 113.9402 5.1E3 122.0599 6.2E5 129.3912 1.2E4 132.0442 5.8E5 134.0598 4.6E5 136.0392 5.5E5 138.0542 1.2E4 144.0938 1.1E4 150.0266 1.5E4 150.0548 1.1E7 150.0659 3.1E4 160.0395 1.4E5 165.5224 2.0E4 173.5212 7.6E4 173.5304 2.6E5 173.5397 2.0E5 178.0133 1.9E5 178.0217 1.3E5 178.0366 6.2E4 178.0500 2.8E7 178.0862 2.2E5 178.0967 4.9E4 181.0860 3.4E5 195.0653 1.4E5 196.0608 8.3E3 221.0810 6.5E5 232.0736 6.2E3 232.0972 2.1E5 247.0961 3.6E4 250.3851 1.2E4 254.2039 5.8E3 260.8401 1.1E4 271.0971 2.1E4 273.0762 1.7E5 285.1011 3.8E4 300.1235 1.3E6 314.1395 1.5E4 322.1207 3.5E4 323.1275 1.4E4 335.1298 4.9E4 336.1001 2.5E4 337.1035 6.1E4 339.1228 6.7E4 345.1342 8.1E4 349.1066 7.2E4 350.1148 1.0E5 351.0847 5.7E4 351.1230 5.3E5 352.1310 6.4E4 354.1466 1.5E5 360.1566 7.5E4 362.1155 1.8E4 365.0981 1.4E5 365.1400 1.5E5 366.1078 1.9E5 366.1472 3.5E5 367.1181 7.2E5 370.1383 2.0E4 377.1058 5.3E3 379.1195 8.6E4 380.1272 1.9E5 381.1333 5.0E5 382.1414 1.6E6 383.1133 1.6E5 385.1636 1.1E5 393.0971 2.2E4 394.1071 1.5E4 395.0998 9.6E3 395.1495 1.3E6 397.1664 2.2E4 398.1372 2.2E5 399.1423 2.6E4 408.1206 1.6E5 409.1285 2.1E5 410.1368 8.8E5 411.1078 1.9E5 413.1600 1.3E6 413.2218 2.1E4 423.1447 1.9E5 426.1315 2.5E5 441.1549 7.2E5 492.2020 1.4E5 520.2013 4.0E4 END IONS BEGIN IONS FEATURE_ID=491 PEPMASS=441.1548 SCANS=491 RTINSECONDS=560.174 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 59.7066 2.5E3 65.4059 2.2E3 76.8368 2.2E3 81.5381 2.2E3 84.1402 3.0E3 89.7768 2.5E3 95.2742 2.7E3 136.7432 2.4E3 136.8347 2.3E3 140.7748 2.3E3 156.2292 2.2E3 162.2687 2.7E3 173.5221 2.1E4 173.5386 5.5E4 181.0859 7.8E3 193.0424 2.9E3 195.0657 4.1E3 221.0810 1.2E4 304.1220 2.7E3 336.0989 7.1E3 337.1062 5.2E3 339.1236 4.4E3 351.1235 1.3E4 354.1453 7.2E3 365.1020 3.8E3 367.1178 4.5E4 379.1216 3.3E3 381.1334 6.0E3 382.1415 2.6E4 395.1123 2.0E4 410.1359 1.1E4 411.1080 1.1E4 426.5862 2.8E3 END IONS BEGIN IONS FEATURE_ID=492 PEPMASS=657.2423 SCANS=492 RTINSECONDS=560.194 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 8 (5 removed due to low quality, 0 removed due to low cosine). 73.0244 6.4E3 73.0272 2.9E4 73.1528 3.9E3 73.1904 3.9E3 78.7360 4.7E3 81.0332 3.3E4 85.0261 6.7E3 85.0314 6.6E3 89.1942 3.9E3 92.1320 4.2E3 93.4483 4.0E3 118.0260 1.0E4 119.1409 4.1E3 120.0415 9.0E4 125.3417 3.8E3 134.0592 1.6E4 136.9306 4.3E3 149.6820 3.3E3 149.6917 4.2E3 149.7124 3.5E3 150.0546 1.8E4 155.7374 2.4E3 156.0421 6.9E3 158.0576 1.6E4 172.0365 1.2E4 173.5221 2.3E4 173.5313 6.1E4 173.5412 3.4E4 178.0494 4.1E4 200.0316 6.8E4 221.0829 5.2E3 253.0941 8.4E4 269.0396 7.4E3 269.0568 5.0E3 269.0894 5.2E5 273.0749 3.0E4 297.0071 8.6E3 297.0845 2.4E6 300.1232 2.7E4 310.0683 5.4E3 324.0837 7.0E3 325.0917 8.4E4 332.7985 4.9E3 340.0194 2.7E4 340.1151 4.6E6 352.1153 1.1E5 383.1460 2.5E4 385.1656 5.9E3 389.0963 4.8E3 405.0919 1.2E4 413.1604 1.9E4 420.1178 1.6E4 433.0886 3.0E3 435.1415 9.8E4 448.1112 6.0E3 457.8185 2.8E3 463.1357 9.1E4 470.1523 7.8E3 486.0750 8.7E3 486.0857 3.1E3 486.1517 3.7E5 486.2305 6.9E3 490.8794 4.7E3 501.1754 1.3E5 502.1476 1.6E4 516.1987 1.4E5 517.1645 5.4E3 530.1402 9.4E3 530.2321 3.1E3 532.1935 3.9E5 532.2831 3.1E3 545.1615 6.8E3 559.2029 6.7E3 560.1887 2.6E5 655.6205 4.8E3 657.2408 6.5E5 END IONS BEGIN IONS FEATURE_ID=493 PEPMASS=673.2161 SCANS=493 RTINSECONDS=560.209 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 69.0444 7.8E3 70.8921 2.2E3 75.0798 2.3E3 81.2289 2.3E3 90.7057 2.3E3 103.4242 2.2E3 108.8116 2.3E3 127.4758 2.2E3 160.0558 2.4E3 173.5236 2.1E4 173.5390 4.3E4 175.0314 2.3E3 176.5130 2.3E3 178.0498 1.0E4 184.9680 2.2E3 215.0733 2.3E3 235.7083 2.7E3 255.2967 2.4E3 274.7345 2.5E3 290.0449 2.5E3 317.1878 2.7E3 322.1158 2.3E3 340.1208 2.6E3 348.7607 2.8E3 356.0928 2.8E3 383.3275 2.8E3 385.2351 2.7E3 518.6226 2.6E3 599.5239 2.5E3 624.4489 2.6E3 639.7154 2.6E3 673.2185 1.1E4 END IONS BEGIN IONS FEATURE_ID=494 PEPMASS=275.1028 SCANS=494 RTINSECONDS=560.282 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 53.0383 4.2E4 59.7097 2.5E3 78.3469 2.5E3 80.2895 2.2E3 81.0332 2.3E5 84.7184 2.2E3 88.9397 2.3E3 94.0644 2.3E3 110.0234 1.4E4 122.0597 8.2E3 132.0440 7.8E3 149.6836 4.2E3 149.6938 4.1E3 150.0547 7.4E4 161.4264 2.9E3 166.6876 2.3E3 173.5231 6.9E3 173.5375 3.2E4 177.8173 2.6E3 178.0499 4.6E4 219.0998 2.2E3 221.2430 3.4E3 221.8019 2.4E3 252.0600 2.3E3 261.6609 2.4E3 267.5663 2.5E3 END IONS BEGIN IONS FEATURE_ID=495 PEPMASS=605.2498 SCANS=495 RTINSECONDS=562.133 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 4 (1 removed due to low quality, 0 removed due to low cosine). 69.5875 2.7E3 79.0541 1.6E4 80.0493 2.2E4 81.0333 2.8E6 81.0427 4.8E4 82.0286 3.1E4 94.0650 2.6E4 95.0490 1.5E4 96.0444 2.6E3 98.0234 6.7E3 98.0598 6.0E4 104.0493 1.4E4 106.0649 1.7E4 108.0441 7.0E3 110.0235 1.4E5 110.0315 4.7E3 122.0597 6.2E4 125.5786 2.7E3 130.0718 2.5E3 132.0442 5.3E4 134.0598 4.7E4 136.0391 5.9E4 150.0547 1.1E6 150.0672 1.2E4 151.0754 1.5E4 157.8183 2.6E3 160.0394 1.6E4 165.0544 9.0E3 173.5259 4.2E4 173.5435 1.6E4 174.4055 2.7E3 178.0131 9.7E3 178.0220 6.6E3 178.0498 3.2E6 178.0862 2.5E4 195.0651 5.6E3 196.0616 3.3E3 201.5282 2.7E3 218.9644 2.1E3 221.0805 1.4E4 232.0974 9.6E3 241.4177 2.4E3 243.0650 9.8E3 244.6260 2.3E3 252.9173 2.6E3 275.9795 2.3E3 300.1235 5.7E4 305.0809 2.8E3 305.1175 4.3E3 307.0964 6.5E3 320.1046 3.2E3 321.0745 3.6E3 321.1129 3.1E4 324.1358 1.4E4 330.1476 7.1E3 335.0896 1.3E4 335.1292 2.1E4 336.0972 1.6E4 336.1363 2.5E4 337.1071 3.7E4 340.1262 3.0E3 349.1072 7.0E3 349.4732 2.4E3 350.1150 2.0E4 351.1225 5.7E4 352.1304 1.8E5 353.1001 1.3E4 355.1549 2.3E4 364.0941 3.2E3 365.1380 1.5E5 368.1249 3.4E4 369.1333 1.2E4 378.1087 6.3E3 379.1175 2.8E4 380.1256 1.2E5 381.0966 1.9E4 383.1491 2.0E5 393.1330 2.5E4 396.1206 3.5E4 411.1437 1.4E5 411.2017 4.9E3 459.6936 2.5E3 462.1913 8.3E3 END IONS BEGIN IONS FEATURE_ID=496 PEPMASS=508.1968 SCANS=496 RTINSECONDS=562.205 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 61.1377 2.2E3 67.0806 2.2E3 73.3478 2.1E3 81.0330 2.1E5 82.0287 2.9E3 92.8768 2.5E3 97.7559 2.5E3 98.0600 4.0E3 110.0235 1.9E4 122.0599 2.7E3 132.0438 2.6E3 141.7641 2.3E3 149.5976 2.1E3 150.0546 7.1E4 151.0747 1.4E4 159.1713 2.4E3 165.0554 3.4E3 166.1593 2.5E3 173.5266 3.0E4 173.5366 4.7E4 178.0497 1.0E5 195.0641 2.4E3 195.3294 2.4E3 221.0803 2.6E3 232.0969 2.3E4 243.0653 1.6E4 246.1139 5.6E3 300.1235 9.7E4 305.0811 2.8E3 305.1173 1.2E4 320.1030 3.8E3 321.1124 2.4E4 324.1348 1.4E4 335.0886 8.7E3 335.1279 3.8E4 336.1356 4.7E4 336.1749 3.1E3 337.1069 2.9E4 347.9841 2.3E3 349.1102 3.0E3 350.1146 1.3E4 351.1227 2.8E4 352.0863 3.9E3 352.1303 6.4E4 353.1011 6.2E3 355.1524 7.2E3 365.0951 8.9E3 365.1388 3.7E4 366.1461 2.8E3 367.1545 1.2E4 368.1249 6.5E3 378.1093 1.4E4 379.1176 2.4E4 380.1259 5.9E4 381.0966 1.5E4 383.1500 3.2E4 393.1330 2.2E4 396.1204 1.9E4 411.1443 3.8E4 462.1908 5.2E3 489.8201 2.6E3 504.1050 2.6E3 END IONS BEGIN IONS FEATURE_ID=497 PEPMASS=627.2318 SCANS=497 RTINSECONDS=562.205 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 64.4985 2.5E3 66.0129 2.8E3 71.8074 2.3E3 73.7290 2.1E3 92.3542 2.5E3 96.2721 2.7E3 96.6293 2.2E3 99.6871 2.3E3 103.6257 2.6E3 120.0415 2.0E4 124.9443 2.8E3 140.6468 2.7E3 141.3251 2.3E3 143.4313 2.1E3 149.6839 9.3E3 149.6944 7.7E3 152.3682 2.5E3 162.5410 2.5E3 173.5290 3.8E4 173.5444 8.4E3 178.0495 7.0E3 200.0319 7.4E3 215.4245 2.6E3 220.9111 2.4E3 252.2368 2.4E3 253.0940 1.6E4 269.0894 1.1E5 297.0846 4.4E5 310.1050 4.3E5 310.1466 5.3E3 316.4331 2.4E3 322.1043 8.5E3 325.0886 2.8E3 330.0111 2.7E3 340.1152 3.8E5 340.1649 3.0E3 352.1143 3.9E3 377.0509 2.7E3 382.8930 2.4E3 405.1318 9.5E3 433.1226 8.1E3 456.1411 3.9E4 471.1655 1.7E4 486.1883 2.0E4 502.1832 7.4E4 530.1789 3.7E4 589.5360 2.8E3 627.2310 7.9E4 END IONS BEGIN IONS FEATURE_ID=498 PEPMASS=650.3076 SCANS=498 RTINSECONDS=562.421 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 65.3230 4.7E3 67.6509 2.8E3 71.3265 2.2E3 81.0333 6.7E5 81.0389 5.8E3 87.5815 2.5E3 91.1967 2.8E3 94.0650 2.6E3 98.0598 6.3E3 99.6665 2.6E3 101.3937 2.5E3 102.1403 2.4E3 106.0645 2.7E3 107.9032 2.9E3 110.0235 2.1E4 110.3071 3.0E3 122.0599 1.3E4 132.0441 1.5E4 134.0598 1.5E4 136.0395 1.3E4 137.7339 2.4E3 146.4731 2.5E3 150.0411 3.7E3 150.0547 2.8E5 162.1989 2.3E3 166.2465 2.5E3 172.5361 2.6E3 173.5202 5.6E3 173.5356 8.1E4 178.0498 1.4E6 185.0715 2.5E3 219.6758 2.6E3 252.8792 2.5E3 258.7371 2.8E3 279.8394 2.6E3 285.2986 2.5E3 292.5379 2.6E3 300.1238 2.4E4 330.1470 3.6E3 351.1220 6.0E3 352.1298 2.4E4 354.8698 2.5E3 365.1376 2.1E4 380.1253 1.7E4 383.1493 4.9E4 396.1208 4.6E3 411.1438 4.5E4 450.4547 3.0E3 507.4238 2.4E3 594.6995 2.9E3 END IONS BEGIN IONS FEATURE_ID=499 PEPMASS=280.0948 SCANS=499 RTINSECONDS=562.857 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 49.1195 2.2E3 54.8663 2.3E3 58.4264 2.2E3 59.2393 2.3E3 60.8363 2.6E3 63.1085 2.5E3 65.2857 2.2E3 70.2721 2.2E3 81.8484 2.7E3 83.2903 2.1E3 93.0574 2.4E3 93.7606 2.5E3 95.5203 2.3E3 96.4257 2.2E3 98.9281 2.9E3 98.9819 2.3E3 109.4923 2.3E3 111.6050 2.7E3 115.3264 2.6E3 118.2450 2.2E3 120.0415 5.2E3 121.1257 2.7E3 137.9423 2.3E3 161.0584 2.7E3 164.9294 2.3E3 173.5285 5.4E4 175.6325 2.4E3 180.9866 2.3E3 202.0500 2.9E3 219.0571 1.9E4 220.0599 4.1E4 221.4831 2.2E3 280.0962 8.3E4 END IONS BEGIN IONS FEATURE_ID=500 PEPMASS=675.2670 SCANS=500 RTINSECONDS=570.55 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 5 (0 removed due to low quality, 0 removed due to low cosine). 66.8021 1.8E4 66.8049 4.0E3 66.9711 2.5E3 68.4060 2.4E3 69.2673 2.5E3 70.3603 8.8E4 70.3641 1.5E4 75.0269 2.2E3 79.4357 2.5E3 81.0088 2.3E3 82.1458 2.7E3 83.3850 2.5E3 84.6698 2.5E3 85.1773 2.4E3 86.3357 2.3E3 88.8576 2.3E3 101.0737 2.3E3 115.3543 2.4E3 129.5169 2.6E3 158.3077 2.2E3 173.5265 1.6E4 173.5372 6.2E4 180.7317 2.7E3 197.1542 2.3E3 209.7531 2.4E3 222.0257 2.3E3 223.9460 2.7E3 286.0149 2.4E3 287.0610 2.5E3 287.4895 2.5E3 324.0716 2.4E3 349.3474 2.5E3 368.0897 2.4E3 369.7715 2.5E3 372.8662 2.2E3 394.1755 2.9E3 408.1696 2.6E3 424.5204 3.2E3 426.3569 2.8E3 443.0478 2.7E3 444.1785 6.3E3 445.1895 3.5E3 457.1499 6.7E3 469.1817 2.9E3 472.1745 8.8E4 473.1837 1.0E4 478.1956 3.0E3 486.1535 1.1E4 497.1789 1.5E4 497.1874 3.0E3 500.1703 3.5E4 501.1780 1.5E4 527.1922 3.5E3 544.2276 7.8E3 545.2323 5.0E4 556.1954 5.7E4 560.3754 2.5E3 573.1254 4.6E3 573.2351 1.2E6 573.3389 5.0E3 574.2354 6.6E3 597.2650 2.9E3 601.2303 4.5E5 605.2508 1.8E4 615.2452 4.6E3 632.2523 3.4E3 633.0097 9.0E3 633.2557 2.5E6 643.2397 2.5E4 657.2556 2.6E4 675.2673 1.2E5 682.7578 2.4E3 END IONS BEGIN IONS FEATURE_ID=501 PEPMASS=288.1235 SCANS=501 RTINSECONDS=572.338 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 47.0495 2.4E3 47.4871 2.2E3 47.7664 4.4E3 47.7687 7.6E3 48.7824 2.5E3 52.2479 2.4E3 55.7401 2.7E3 61.3253 2.6E3 61.6237 2.5E3 65.5028 2.2E3 66.1370 2.3E3 70.6197 2.7E3 73.0755 2.4E3 74.0960 2.4E3 78.0612 2.2E3 78.3179 2.2E3 79.0542 1.4E4 80.3113 2.6E3 91.0542 1.8E4 91.7476 2.5E3 92.0333 2.2E3 98.0598 8.4E3 102.0463 2.5E3 103.0541 3.1E4 105.0336 3.3E3 105.0697 4.3E4 106.2332 2.4E3 108.6786 2.8E3 111.5691 2.1E3 115.0543 2.5E3 118.0420 9.2E3 119.0491 3.1E4 119.7404 2.5E3 120.0569 1.9E4 121.0645 2.6E3 129.9304 2.3E3 132.0569 5.1E4 133.0285 2.0E4 133.0648 5.3E4 133.5214 2.4E3 135.0803 1.5E4 135.1898 2.3E3 136.3133 2.4E3 146.0357 7.8E3 147.0439 4.7E4 148.0515 1.9E5 151.0415 2.5E3 151.3949 2.2E3 156.6224 2.6E3 160.0518 9.5E4 161.0595 2.7E4 163.0590 1.1E4 163.0753 8.4E5 163.0914 5.0E3 167.0341 4.6E4 168.0375 3.8E4 173.5232 5.2E3 173.5317 7.4E4 173.5412 6.9E3 176.0470 1.1E5 184.0328 2.3E3 187.5032 2.5E3 191.0302 1.8E4 191.0703 3.9E6 204.1093 3.0E3 211.0842 2.8E3 239.4389 2.8E3 245.2666 2.7E3 250.4921 2.3E3 261.6057 2.2E3 284.4380 2.4E3 288.0959 7.9E3 END IONS BEGIN IONS FEATURE_ID=502 PEPMASS=627.2320 SCANS=502 RTINSECONDS=572.338 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 66.6221 2.4E3 66.7017 2.2E3 68.7749 2.5E3 74.6857 2.4E3 78.7250 2.5E3 82.9803 2.1E3 101.9928 2.3E3 106.1061 2.5E3 107.2946 2.2E3 108.9042 2.5E3 112.2516 2.3E3 120.0414 2.2E4 126.9754 2.3E3 128.9849 2.1E3 132.3295 2.5E3 136.3172 2.4E3 138.2757 2.7E3 140.5775 2.4E3 141.3815 2.3E3 153.3820 2.0E3 162.5913 2.6E3 172.0696 2.5E3 173.5304 9.8E4 173.5420 1.5E4 177.8176 3.0E3 188.0312 1.4E5 191.0704 3.0E3 226.2144 2.9E3 297.0851 2.7E3 310.0742 2.1E3 310.1049 3.3E5 310.1461 3.7E3 325.0917 3.0E3 340.1153 2.8E5 365.1355 7.7E3 406.5245 2.6E3 416.1407 2.6E3 433.1257 1.1E5 433.1891 3.9E3 530.1771 5.0E4 537.1439 2.5E3 627.2298 6.0E4 END IONS BEGIN IONS FEATURE_ID=503 PEPMASS=304.1548 SCANS=503 RTINSECONDS=573.752 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 9 (3 removed due to low quality, 0 removed due to low cosine). 48.2715 5.2E3 48.8502 2.2E3 49.2096 2.4E3 52.4772 2.2E3 52.6415 2.3E3 54.0338 2.3E4 55.0179 6.6E3 55.0542 1.1E4 55.2684 5.3E3 55.2709 4.4E4 55.4605 2.4E3 56.0494 3.0E4 56.0967 2.6E3 60.1426 2.1E3 62.2501 2.3E3 65.0386 2.2E4 67.0415 4.0E4 67.0540 2.5E5 68.0493 3.0E4 69.0334 8.9E3 71.0269 2.2E3 79.0540 7.0E3 80.0494 2.9E4 82.0232 5.4E3 82.0285 4.5E5 82.0649 4.5E5 83.0728 1.2E5 84.0806 1.5E5 91.0542 3.3E4 92.0494 7.0E3 102.0465 1.0E4 103.0541 1.9E4 104.0621 7.0E3 105.0220 2.5E3 105.0697 3.9E4 107.0489 3.1E4 108.0805 3.9E3 110.0600 1.2E6 113.0595 7.3E4 113.8139 2.6E3 118.0411 3.0E4 119.0490 4.8E4 120.2167 2.7E3 121.0647 7.1E3 122.0721 3.6E3 130.0314 3.1E3 130.0413 6.9E4 131.0490 3.3E4 132.0568 3.9E4 133.0647 1.1E5 134.0724 1.4E4 135.0441 7.7E4 135.0804 6.4E3 136.0750 3.6E3 138.8455 3.1E3 139.2962 2.9E3 144.0568 3.5E3 145.7888 2.4E3 146.0362 2.3E4 147.0440 3.6E5 148.0519 4.4E4 149.0596 5.6E4 150.0675 6.4E4 158.0350 6.6E3 158.2866 2.7E3 159.0441 2.2E4 160.0518 9.1E4 161.0597 2.3E5 162.0513 4.5E3 162.0675 1.1E6 163.0389 3.3E5 163.0753 1.9E5 164.0479 2.5E3 164.4524 2.2E3 165.0912 4.8E4 167.0702 5.1E4 172.0516 5.1E3 173.5212 1.0E4 173.5338 7.6E4 173.5488 2.8E3 174.0161 2.5E3 174.0313 1.2E5 175.0391 2.9E5 176.0470 2.3E5 177.0547 2.4E5 178.0442 9.1E3 178.0493 4.4E3 178.0626 1.0E6 178.0807 1.5E4 179.0705 8.7E3 180.8879 1.3E4 181.0860 4.2E4 188.0469 6.5E4 189.0347 7.9E3 189.0547 6.1E5 189.0744 7.3E3 190.0226 2.1E4 190.0624 5.6E6 190.0773 3.0E4 190.1017 4.7E3 190.4612 2.3E3 190.8697 2.7E3 191.0141 5.1E3 191.0339 1.6E6 191.0701 4.5E5 191.0880 6.9E3 192.0415 8.1E4 193.0445 8.4E3 193.0860 4.2E6 193.2549 3.1E3 195.0516 2.4E3 201.8845 2.5E3 205.0499 6.1E4 206.0347 5.9E3 206.0575 2.5E6 207.0652 1.4E5 208.8832 7.0E4 221.0019 4.0E3 221.0301 8.9E4 221.0406 2.1E4 221.0809 1.4E7 221.0999 3.6E4 221.1202 4.6E4 221.1318 6.3E4 221.1466 1.7E4 226.8941 5.5E4 242.1184 2.4E4 262.1436 1.9E4 270.1116 6.9E3 END IONS BEGIN IONS FEATURE_ID=504 PEPMASS=217.0862 SCANS=504 RTINSECONDS=574.169 CHARGE=1+ MSLEVEL=2 MERGED_STATS=9 / 11 (2 removed due to low quality, 0 removed due to low cosine). 42.2832 2.2E3 42.4815 5.1E3 43.0178 7.6E4 44.0087 2.2E3 45.0335 5.8E4 45.1593 2.3E3 45.7493 3.1E3 45.8503 2.5E3 47.0591 2.6E3 47.9032 2.4E3 47.9599 2.3E3 48.2750 2.4E3 49.5677 4.9E3 50.9607 4.9E3 53.0386 1.2E4 55.0177 4.3E4 55.4483 2.2E3 57.0333 2.2E5 57.3061 2.2E3 57.7436 2.4E3 58.3207 2.9E3 58.6886 2.5E3 58.7185 2.2E3 59.4079 2.4E3 63.6705 2.4E3 64.0696 5.1E3 67.0541 7.2E4 68.0680 2.3E3 70.2039 2.1E3 73.5758 2.2E3 73.6768 2.8E3 75.4901 2.3E3 77.0389 5.3E3 77.5863 2.5E3 78.1659 2.5E3 79.5820 2.2E3 80.5172 2.3E3 81.0331 2.5E3 81.8470 2.4E3 82.3509 2.2E3 91.0541 1.2E6 91.0592 5.0E3 91.0608 1.0E4 94.9671 2.8E3 95.0493 1.9E4 102.0460 2.8E3 103.0540 2.1E5 105.0697 5.1E4 110.9998 2.4E3 111.4513 2.5E3 114.4518 2.2E3 115.0406 2.9E3 115.0449 3.8E3 115.0541 1.7E6 115.0624 9.4E3 116.0619 3.4E5 117.0697 4.3E5 119.1364 3.4E3 121.6561 3.0E3 125.4110 2.3E3 127.0544 6.0E4 127.6007 2.1E3 128.0512 5.3E3 128.0619 1.5E6 128.0709 4.2E3 129.0469 9.9E3 129.0696 1.9E7 129.0789 1.8E5 129.0875 2.0E4 129.0923 1.8E5 129.1120 2.8E3 130.0411 4.1E4 130.0776 3.9E4 131.0489 6.9E5 131.0616 4.6E3 131.0853 5.2E6 131.0948 3.7E4 131.1085 4.3E3 132.8973 4.8E3 133.0646 8.5E4 133.3363 3.2E3 135.0439 3.9E5 135.0802 1.2E5 139.0547 8.9E3 140.0612 6.0E3 141.0441 2.8E4 141.0697 9.9E6 141.0798 1.1E5 141.0926 3.3E4 141.0953 9.0E3 141.1030 4.6E3 141.5743 2.3E3 143.0489 5.2E5 143.0610 3.2E4 143.0854 2.9E5 144.0440 1.2E4 144.0568 6.5E5 144.0692 1.1E4 145.0531 5.7E3 145.0646 4.8E5 147.0445 1.4E4 148.0194 2.8E3 148.9005 2.5E3 149.0229 4.3E3 149.0595 7.8E4 151.0535 2.5E3 152.0622 3.1E4 153.0698 8.2E4 155.0484 6.3E3 155.0602 1.7E5 156.0568 1.5E5 157.0350 5.1E3 157.0646 8.1E6 157.0763 8.0E4 157.0943 2.7E4 158.0727 1.2E4 159.0440 1.6E5 159.0803 2.4E6 159.0924 7.2E3 160.0518 1.6E5 161.0596 3.6E5 168.0571 5.1E4 169.0647 3.2E6 171.0439 5.5E4 171.0804 6.9E4 172.0519 1.1E6 172.0689 3.2E4 173.0597 1.0E6 173.0767 5.2E3 173.5215 3.2E4 173.5367 1.2E5 174.0677 4.8E4 175.0393 2.3E4 175.0755 7.2E4 176.0470 4.3E4 179.0599 1.8E4 185.0598 3.7E5 186.0485 9.9E3 186.0676 1.3E6 186.0827 5.5E3 187.0556 5.1E3 187.0754 5.3E6 187.0897 6.5E3 188.0467 6.6E3 188.0833 4.4E4 189.0546 1.1E5 189.0734 2.4E3 189.0912 1.7E5 195.3627 3.5E3 198.0713 6.0E3 198.0911 5.0E4 199.0753 3.5E6 199.0925 2.6E3 199.1057 3.4E3 202.0627 6.7E3 215.0696 2.5E3 217.0861 6.3E5 END IONS BEGIN IONS FEATURE_ID=505 PEPMASS=680.3184 SCANS=505 RTINSECONDS=574.906 CHARGE=1+ MSLEVEL=2 MERGED_STATS=7 / 11 (4 removed due to low quality, 0 removed due to low cosine). 68.0829 2.4E3 74.1151 3.9E3 74.5746 4.2E3 76.4496 2.5E3 81.0334 1.0E5 85.0082 2.4E3 90.4356 2.3E3 91.0362 2.4E3 98.0598 1.3E5 98.4926 5.3E3 112.7393 2.5E3 117.2045 2.3E3 119.0490 2.9E3 129.0287 2.6E3 130.0403 4.5E3 134.0397 2.7E3 135.0439 5.8E3 135.9472 2.4E3 136.5608 2.9E3 140.3099 2.6E3 147.0441 3.6E4 150.0549 1.6E4 161.0601 3.0E3 162.0675 7.3E4 163.0388 3.2E4 163.0753 3.7E3 165.1206 2.4E3 169.7104 2.5E3 173.5256 7.3E4 173.5374 1.4E5 173.5452 1.4E4 175.0396 2.9E4 177.0557 9.5E3 178.0497 7.5E4 178.0634 4.2E4 181.0857 9.4E3 181.1599 2.6E3 183.0345 2.5E3 189.0547 4.1E4 190.0624 5.1E5 191.0340 8.4E4 191.0705 5.3E4 193.0859 4.4E5 195.0652 2.6E5 205.0859 8.1E4 206.0574 1.9E5 219.1021 1.2E4 220.9722 3.7E3 221.0154 3.1E4 221.0299 1.5E5 221.0408 4.4E4 221.0809 2.2E7 221.1200 6.6E4 221.1320 1.5E5 221.1465 2.8E4 221.1610 1.1E4 222.0847 1.8E4 240.0055 2.5E3 244.7450 2.6E3 245.0807 1.4E4 273.0757 6.3E4 288.4161 3.1E3 289.8533 2.3E3 290.1028 5.7E4 299.8408 2.7E3 300.1237 1.3E5 300.7198 2.8E3 310.1067 8.7E3 318.1334 5.2E4 326.1404 4.6E3 339.7556 2.7E3 342.1338 3.9E4 353.1021 1.4E4 354.1449 3.1E4 367.1180 6.5E3 368.1262 3.3E4 369.0950 3.9E3 370.1324 1.9E4 371.1490 7.9E4 382.1401 3.4E4 384.1222 6.8E3 385.1651 3.6E4 399.1440 1.1E6 399.2055 1.3E4 413.1602 1.2E5 441.1544 1.9E5 459.3759 2.7E3 461.7388 2.5E3 512.6680 2.5E3 520.1962 1.0E4 584.2372 2.6E3 591.6115 4.5E3 613.1817 4.8E3 622.0554 4.9E4 667.1505 2.8E3 END IONS BEGIN IONS FEATURE_ID=506 PEPMASS=637.2727 SCANS=506 RTINSECONDS=574.915 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 75.9065 2.3E3 76.2147 2.8E3 81.0333 2.9E5 81.0390 4.0E3 82.0288 3.2E3 82.0650 3.0E4 98.0599 5.6E3 108.0443 3.6E3 110.0234 1.1E5 119.4248 2.8E3 124.0393 1.1E4 131.0747 2.3E3 134.0599 4.7E3 136.0391 5.6E4 136.0755 5.5E4 147.0443 2.9E3 150.0547 1.1E5 152.0705 6.6E4 153.0177 2.3E3 162.0669 6.8E3 171.9509 2.3E3 173.5235 1.6E4 173.5317 5.9E4 173.5429 1.2E4 175.1404 2.8E3 178.0498 3.2E5 178.0676 3.9E3 179.0532 6.3E3 180.0654 4.3E5 180.0841 6.0E3 181.0856 3.8E3 190.0621 2.0E4 191.0670 1.7E4 192.0687 4.0E3 193.0860 1.6E4 194.0890 5.7E3 195.0651 5.5E4 196.0684 2.9E4 197.0699 1.3E4 205.0858 1.5E4 206.0564 5.0E3 206.0895 9.6E3 219.1018 3.0E3 221.0808 3.0E5 221.0997 3.3E3 222.0843 2.2E5 222.1097 3.2E3 223.0864 1.0E5 273.0752 7.9E3 274.0787 3.5E3 275.0811 2.7E3 280.5205 2.9E3 290.1023 4.3E3 300.1230 2.8E4 301.1256 1.7E4 302.1327 1.1E4 326.1312 2.4E3 351.1221 8.2E3 353.0977 3.1E3 354.1013 3.0E3 355.1505 4.1E3 367.1162 1.4E4 368.1229 9.1E3 369.1253 1.0E4 370.1328 4.9E3 371.1469 6.6E3 372.1506 1.5E4 373.1553 1.6E4 381.1333 1.0E4 382.1402 3.0E4 383.1463 3.8E3 384.1499 5.5E3 386.1654 3.5E3 387.1710 7.2E3 395.1485 2.4E4 398.1322 2.6E3 399.1431 6.7E4 400.1468 1.5E5 401.1495 1.8E5 409.1243 3.7E3 410.1360 1.7E4 413.1596 3.5E4 414.1614 9.2E3 415.1641 1.6E4 426.1316 3.1E3 441.1529 2.5E4 442.1573 1.4E4 443.1601 2.6E4 510.1209 2.5E3 END IONS BEGIN IONS FEATURE_ID=507 PEPMASS=657.2425 SCANS=507 RTINSECONDS=574.934 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 9 (5 removed due to low quality, 0 removed due to low cosine). 66.6954 2.4E3 73.0246 7.8E3 73.0276 1.2E4 81.9320 2.5E3 83.5111 3.3E3 85.0263 1.5E4 85.0309 4.5E3 86.4609 2.5E3 90.3373 3.8E3 107.0635 2.4E3 115.6994 3.7E3 117.0223 2.7E3 119.0342 2.8E3 120.0417 1.7E5 130.3307 2.9E3 135.6241 2.6E3 147.0301 2.6E3 157.7898 2.4E3 165.0095 3.2E3 173.5295 1.2E5 173.5419 3.0E4 188.0119 5.5E3 188.0317 1.2E6 188.0517 7.6E3 205.0858 3.3E3 215.4759 4.4E3 217.0470 3.6E3 221.0812 3.8E4 243.0631 1.2E4 279.0892 5.6E3 296.0903 5.0E3 297.0848 1.5E4 300.1218 3.1E3 310.0705 7.3E3 320.1288 2.6E3 324.0851 8.9E3 325.0924 1.0E5 338.1001 6.3E3 340.0198 2.9E4 340.1154 5.7E6 340.1899 6.4E3 340.2126 1.0E4 364.1180 3.0E3 389.0952 5.0E3 395.1468 1.6E5 399.1437 1.1E4 431.6431 2.6E3 433.0877 1.3E4 448.1099 1.8E4 461.1663 3.8E3 463.0582 1.5E4 463.1362 1.4E6 463.2120 7.6E3 486.1530 2.9E3 516.1989 3.1E4 530.1367 3.1E3 532.1969 4.3E3 559.2039 3.1E4 560.1889 4.4E5 567.6682 3.9E3 657.2406 5.8E5 657.3655 5.7E3 END IONS BEGIN IONS FEATURE_ID=508 PEPMASS=221.0812 SCANS=508 RTINSECONDS=575.006 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 15 (11 removed due to low quality, 0 removed due to low cosine). 43.0177 1.2E4 45.0335 1.4E4 46.2724 2.4E3 46.9784 5.7E3 53.0021 2.6E4 54.5171 7.4E3 55.0178 3.2E4 55.7278 5.6E3 61.6214 5.6E3 65.0385 1.7E4 66.5371 8.1E3 68.9970 2.8E4 69.1203 2.5E3 69.7910 5.7E3 71.9108 5.8E3 72.0274 7.4E3 73.4358 7.5E3 73.9448 4.2E3 76.0502 6.0E3 77.0385 4.4E4 78.0462 1.8E5 79.0539 3.2E5 82.1317 7.5E3 85.2460 4.8E3 85.4241 8.7E3 89.0385 3.9E4 90.0462 5.5E4 91.0483 1.3E4 91.0539 4.7E5 92.0257 1.5E4 92.0619 5.3E4 93.0700 3.0E4 94.0411 6.3E3 95.0488 8.8E4 102.0387 9.8E3 102.0462 6.2E5 103.0540 2.9E5 103.8139 4.4E3 104.0618 3.0E5 105.0333 8.9E4 105.0444 8.9E3 105.0697 2.1E5 105.5639 6.9E3 106.0411 1.8E4 107.0489 5.2E5 115.0539 4.1E4 116.0619 5.7E4 117.0332 5.5E4 117.0699 1.3E4 118.0320 6.2E3 118.0411 4.0E5 118.9845 7.3E3 119.0489 9.3E5 119.0575 2.9E3 119.0588 1.8E4 120.0209 7.0E3 120.0568 1.2E5 120.6358 5.9E3 121.0288 1.8E4 121.0646 2.2E5 122.0726 1.1E5 123.3236 4.7E3 130.0412 9.9E5 130.0519 2.4E4 131.0490 5.1E5 131.0602 3.0E3 132.0205 7.3E4 132.0454 1.4E4 132.0568 8.1E5 132.0657 3.8E3 132.0684 5.0E3 133.0283 2.0E5 133.0647 3.2E5 134.0360 4.1E4 134.0724 7.7E4 135.0439 1.4E6 135.0527 8.1E3 135.0559 4.2E4 135.0808 1.9E4 142.0412 2.6E4 144.0568 6.0E4 145.0282 1.5E5 145.0396 2.7E3 145.0645 3.2E4 146.0361 1.9E5 147.0439 3.2E6 147.0550 2.9E4 148.0390 8.9E3 148.0517 5.1E5 149.0233 2.8E4 149.0596 7.0E5 149.0720 1.4E4 150.0674 2.9E5 152.0472 8.6E3 157.0393 8.3E4 157.3586 4.2E3 158.0362 7.8E4 159.0076 5.9E4 159.0440 1.7E5 160.0518 8.6E5 160.0645 4.0E3 161.0233 1.6E5 161.0596 6.8E5 161.0754 7.0E3 162.0332 2.6E4 162.0513 2.0E4 162.0675 2.3E6 163.0389 4.1E6 163.0508 2.5E4 163.0751 3.9E5 163.0902 4.1E3 165.0911 1.2E4 167.0711 6.5E3 170.0360 6.5E3 173.0230 5.3E4 173.5247 5.3E4 173.5369 1.2E5 174.0313 2.4E5 175.0255 2.6E3 175.0391 2.2E6 176.0105 5.8E3 176.0469 5.6E5 176.0646 1.8E4 177.0547 6.3E5 177.0723 2.3E4 178.0439 3.6E4 178.0626 2.1E6 187.0388 5.1E4 188.0469 2.9E5 189.0549 1.5E5 190.0624 2.8E6 191.0138 3.0E4 191.0339 1.2E6 191.0700 1.2E5 192.0410 4.5E4 193.0707 3.4E3 193.0860 1.3E6 193.1067 4.3E4 205.0276 2.4E3 205.0498 9.1E4 206.0348 6.8E3 206.0576 7.0E5 206.0798 2.6E3 221.0810 2.2E5 END IONS BEGIN IONS FEATURE_ID=509 PEPMASS=319.1373 SCANS=509 RTINSECONDS=575.078 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 2 (0 removed due to low quality, 0 removed due to low cosine). 49.1485 2.1E3 50.4843 3.2E3 69.3746 2.5E3 82.2281 2.5E3 82.7067 2.2E3 86.1739 2.9E3 86.9223 2.5E3 92.0003 2.4E3 98.8868 2.2E3 119.7210 3.0E3 128.1728 2.6E3 161.0568 2.7E3 162.0670 1.0E4 163.0707 1.7E4 173.5244 2.2E4 173.5405 2.1E4 175.0363 3.1E3 177.0507 2.8E3 178.0617 1.0E4 179.0655 1.5E4 190.0617 4.6E4 191.0344 9.9E3 191.0658 6.8E4 192.0371 1.5E4 192.0723 2.6E3 193.0860 2.7E4 194.0892 6.3E4 206.0574 1.8E4 207.0607 3.3E4 221.0809 9.5E4 222.0843 1.9E5 248.5656 2.7E3 322.1586 2.5E3 END IONS BEGIN IONS FEATURE_ID=510 PEPMASS=635.2604 SCANS=510 RTINSECONDS=575.182 CHARGE=1+ MSLEVEL=2 MERGED_STATS=8 / 10 (2 removed due to low quality, 0 removed due to low cosine). 71.2226 2.7E3 71.5626 2.6E3 73.0126 2.7E3 74.9574 2.4E3 75.7471 2.1E3 76.4388 2.3E3 77.0877 2.4E3 79.0542 4.1E3 81.0333 8.0E5 86.2994 2.3E3 86.6182 2.7E3 88.3152 2.2E3 91.0543 2.4E3 95.0491 2.8E3 96.9330 2.8E3 97.8429 2.1E3 98.0599 7.1E4 99.7799 2.4E3 99.8680 2.8E3 104.0358 2.6E3 105.0698 2.6E3 106.5278 2.8E3 107.0482 2.9E3 108.6111 2.5E3 109.5444 3.0E3 110.0237 2.0E4 113.9639 2.3E3 117.4006 2.5E3 119.0490 9.8E3 122.0600 1.6E4 124.5589 2.2E3 125.1312 2.1E3 129.7932 2.3E3 130.0410 4.2E3 131.0486 2.6E3 132.0439 7.8E3 132.0571 9.0E3 133.0645 3.3E3 134.0602 6.9E3 135.0439 1.6E4 136.0397 1.1E4 137.1669 2.4E3 138.0550 4.8E3 139.0501 2.1E3 145.9628 2.3E3 147.0439 5.3E4 148.0518 5.6E3 149.0596 7.4E3 150.0411 4.4E3 150.0548 2.6E5 150.0674 2.8E3 151.0874 2.4E3 152.0469 2.5E3 154.8757 2.8E3 158.1589 3.1E3 158.8133 2.3E3 160.0520 1.2E4 161.0595 9.2E3 162.0676 7.1E4 163.0389 7.4E4 163.0749 2.3E4 163.6432 2.2E3 166.0489 3.2E3 167.0702 3.6E3 167.9789 2.1E3 173.5105 3.1E3 173.5304 1.3E5 173.5377 4.0E4 174.4620 2.3E3 175.0388 3.0E4 175.8249 2.4E3 175.8693 2.5E3 176.0468 5.1E3 177.0551 5.7E3 178.0335 2.2E4 178.0499 9.1E5 178.0636 5.6E4 180.0420 3.5E3 181.0859 5.0E4 182.6070 2.2E3 189.0548 1.3E4 190.0624 2.9E5 191.0340 6.4E4 191.0697 1.2E4 193.0859 2.2E5 194.7467 2.7E3 195.0652 7.1E5 197.0780 2.4E3 198.0572 2.3E3 198.2822 2.2E3 205.0860 2.5E5 206.0575 1.0E5 211.2224 2.8E3 219.1017 4.1E4 221.0165 3.8E3 221.0304 1.6E4 221.0809 4.6E6 221.1322 1.3E4 222.0847 2.0E4 226.7964 2.4E3 244.9753 2.4E3 245.0808 6.6E4 247.0955 2.6E3 248.1203 2.5E3 273.0759 1.2E5 274.1064 8.4E3 274.9985 2.3E3 275.1109 7.7E3 283.0956 4.3E3 285.6404 2.4E3 289.1313 1.3E4 290.1024 9.6E4 290.1354 5.9E3 291.6359 2.5E3 300.1234 2.9E5 300.1622 6.4E3 302.1020 7.7E3 302.2538 2.6E3 309.1034 2.8E3 310.1084 1.2E4 312.3416 2.6E3 313.1084 2.6E3 314.1384 1.0E4 317.1270 1.1E4 318.1308 1.3E4 322.1203 4.7E3 324.1220 2.6E3 325.1069 4.1E3 326.1388 2.1E4 327.1210 5.5E3 328.1184 3.9E3 330.1458 3.7E3 337.1016 3.5E3 338.1154 5.0E3 339.1220 2.3E4 340.1309 3.2E3 341.1004 4.5E3 342.1336 5.7E4 350.1153 3.6E3 351.1235 2.4E4 352.0923 7.3E3 352.1241 8.4E3 353.1016 7.0E4 353.1399 3.1E3 354.1460 1.1E5 355.1166 6.3E3 356.1257 1.6E4 357.3820 3.4E3 358.1427 4.4E3 365.1008 1.0E4 366.1087 2.4E4 367.1176 1.2E5 368.1253 1.4E5 369.0970 2.3E4 370.1338 3.9E4 371.1488 2.4E5 380.1259 1.1E4 381.1331 6.5E4 382.1410 2.4E5 383.1102 2.3E4 384.1203 4.8E4 385.1646 1.2E5 395.1008 2.5E3 395.1493 1.2E5 398.1355 3.0E4 399.0220 7.8E3 399.0839 5.0E3 399.1438 2.9E6 399.2048 5.1E3 399.2676 3.3E3 409.1286 1.2E4 410.1368 4.1E4 411.1061 7.6E3 413.1597 3.5E5 413.2210 3.3E3 417.0536 3.2E3 423.1456 6.0E3 426.1315 1.2E4 441.1542 4.2E5 520.1952 3.0E4 596.1783 2.7E3 608.5355 2.8E3 634.1426 2.7E3 635.0578 2.2E4 END IONS BEGIN IONS FEATURE_ID=511 PEPMASS=318.1341 SCANS=511 RTINSECONDS=575.215 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 19 (14 removed due to low quality, 0 removed due to low cosine). 49.0042 3.7E3 51.1122 9.0E3 55.0179 1.9E4 55.2697 1.6E5 55.2717 3.4E4 57.5317 4.1E3 71.3720 1.0E4 76.0322 9.3E3 76.0544 1.1E4 78.0463 3.2E4 78.8432 8.0E3 79.0541 9.2E4 81.8558 3.5E3 88.2640 3.8E3 89.0390 4.1E3 89.0935 3.6E3 91.0543 1.5E5 95.0492 3.8E4 95.0853 1.2E4 98.0600 4.0E5 102.0464 1.1E5 103.0542 8.4E4 104.0619 7.3E4 105.0339 2.0E4 105.0697 1.3E5 105.3645 9.2E3 105.4479 7.7E3 107.0490 1.3E5 111.0443 7.6E3 112.1824 3.6E3 115.0546 6.5E3 116.0623 2.0E4 116.1013 7.9E3 118.0412 1.1E5 118.0493 4.1E3 119.0491 2.5E5 120.0571 2.4E4 121.0649 6.5E4 122.0723 5.0E4 125.6304 7.4E3 125.9626 1.3E4 130.0413 3.8E5 131.0489 1.5E5 132.0568 2.6E5 133.0284 4.5E4 133.0648 3.8E5 134.0729 5.5E4 134.2550 1.4E4 135.0441 3.8E5 135.0805 4.5E4 137.8393 4.4E3 144.0571 6.0E4 145.0288 2.1E4 145.0654 5.0E3 146.0363 1.0E5 147.0441 1.5E6 147.0552 3.2E3 148.0519 2.0E5 149.0596 2.6E5 150.0675 2.6E5 151.0757 5.3E3 158.0359 4.1E4 159.0442 1.2E5 160.0519 4.7E5 161.0244 1.7E4 161.0598 7.2E5 161.4831 4.4E3 162.0559 9.4E3 162.0676 4.2E6 163.0390 1.4E6 163.0550 4.0E3 163.0754 7.9E5 165.0912 2.1E5 167.0704 1.5E5 172.0515 4.2E4 173.0233 2.3E4 173.5299 2.3E5 173.5576 9.4E3 174.0313 4.6E5 175.0391 1.2E6 176.0470 1.1E6 176.0646 4.9E3 177.0548 7.8E5 178.0438 1.6E4 178.0626 4.0E6 188.0470 4.2E5 189.0348 1.8E4 189.0547 1.9E6 189.0746 2.6E4 190.0111 6.1E3 190.0225 1.1E5 190.0625 2.1E7 190.0936 8.3E4 190.1031 1.2E5 191.0339 4.5E6 191.0703 1.5E6 191.0855 1.2E4 192.0416 2.2E5 193.0328 1.4E4 193.0861 1.5E7 193.1272 1.0E5 193.1392 6.5E3 203.9860 8.1E3 205.0500 1.6E5 206.0576 8.0E6 221.0155 1.5E4 221.0302 3.1E5 221.0405 1.4E5 221.0810 4.8E7 221.1203 2.0E5 221.1320 2.9E5 221.1467 3.0E4 221.1747 7.4E3 235.4184 1.3E4 290.4157 4.6E3 294.5280 8.7E3 310.7798 1.1E4 323.4232 1.2E4 END IONS BEGIN IONS FEATURE_ID=512 PEPMASS=538.2075 SCANS=512 RTINSECONDS=575.286 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 60.5983 2.3E3 67.1325 2.2E3 69.1531 2.2E3 69.8118 2.4E3 74.5811 2.2E3 77.9835 2.3E3 81.0334 4.1E4 82.6481 2.6E3 83.7689 2.2E3 85.0040 2.7E3 95.8071 2.6E3 97.3638 2.2E3 98.0601 2.3E4 99.6887 2.5E3 104.7732 2.7E3 111.8771 2.3E3 114.3934 2.5E3 122.0601 2.7E3 132.1276 2.7E3 140.8200 3.0E3 145.4023 2.2E3 149.6874 5.0E3 149.6978 3.7E3 152.0467 5.7E3 156.4637 2.4E3 163.0757 1.2E4 163.7101 2.5E3 167.0701 2.7E3 173.5221 1.4E4 173.5310 5.8E4 173.5412 1.7E4 173.6847 2.4E3 178.0489 2.8E3 178.5824 2.1E3 181.0861 1.1E4 185.2636 2.5E3 190.0622 3.0E4 192.3059 2.8E3 193.0859 2.3E4 195.0444 2.6E3 195.0653 3.4E5 195.0859 6.4E3 205.0862 1.7E5 206.0576 2.5E4 219.1021 2.2E4 221.0809 1.0E6 238.7744 2.9E3 244.5509 2.5E3 245.0811 3.3E4 269.5546 2.6E3 273.0756 2.4E4 279.9697 2.4E3 290.1006 3.8E3 300.1230 2.1E4 307.0966 2.6E3 309.1125 2.3E3 310.1086 6.2E3 317.3214 2.4E3 318.1318 2.6E3 324.1234 5.7E3 327.1220 4.5E3 337.0686 4.2E3 337.1096 4.1E3 338.1161 7.3E3 339.1236 1.9E4 340.1293 3.2E3 341.1014 1.1E4 342.1331 3.5E4 351.0845 3.2E3 351.1254 3.7E3 352.0921 2.3E4 352.1192 7.3E3 353.1015 8.5E4 354.1464 5.1E4 356.1257 2.1E4 358.1400 3.0E3 358.4862 2.4E3 366.1084 6.6E3 367.1180 4.7E4 368.1253 1.3E5 369.0961 4.2E4 370.1412 7.2E3 371.0959 3.4E3 371.1487 1.9E5 381.1329 1.1E4 382.1405 4.4E4 383.1122 7.4E3 384.1203 4.8E4 385.1651 3.0E4 391.0242 2.6E3 395.1528 4.3E3 398.1364 6.3E3 399.1437 1.9E6 399.2063 3.1E3 410.1312 3.6E3 413.1594 4.2E4 415.6976 2.5E3 419.8490 3.1E3 423.1384 2.6E3 423.1476 3.4E3 426.1320 2.4E3 441.1541 8.5E4 444.4185 2.6E3 530.7488 2.5E3 END IONS BEGIN IONS FEATURE_ID=513 PEPMASS=617.2500 SCANS=513 RTINSECONDS=575.286 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 67.6746 2.7E3 68.1033 2.7E3 74.2001 2.2E3 81.4061 2.2E3 82.8903 2.2E3 86.7954 2.3E3 102.5100 3.1E3 118.2173 2.5E3 122.0597 1.9E4 131.8907 2.7E3 140.4890 2.6E3 145.1713 2.4E3 148.1218 2.6E3 149.6888 1.6E4 159.3089 2.5E3 162.0669 3.6E3 173.5230 2.9E4 173.5408 3.6E4 178.0632 2.6E3 178.4566 2.3E3 181.0859 1.9E4 184.0144 2.4E3 185.0126 3.1E3 189.0551 3.1E3 190.0623 5.8E4 191.0702 5.0E3 193.0859 4.7E4 198.1912 2.3E3 203.5112 2.5E3 206.0572 2.6E4 211.4095 2.1E3 219.1017 7.1E4 221.0808 1.6E6 270.0760 2.7E3 285.1001 1.7E4 300.1232 2.4E6 300.2031 7.6E3 324.1234 1.0E4 337.1024 2.9E3 339.1206 2.5E3 346.9607 2.5E3 352.1176 1.4E5 353.1027 1.1E4 356.1249 7.7E3 368.1262 1.9E4 369.0982 3.9E3 371.1485 7.8E4 384.1203 1.5E4 385.4730 2.5E3 399.0820 5.4E3 399.1436 9.0E5 399.2054 4.7E3 407.3198 2.5E3 416.2353 2.6E3 441.1548 2.4E3 446.1585 2.8E3 462.1538 2.9E3 474.1503 3.2E3 490.1463 4.4E3 492.2025 4.7E3 505.1721 1.8E4 520.1958 3.6E5 520.2844 5.5E3 END IONS BEGIN IONS FEATURE_ID=514 PEPMASS=673.2163 SCANS=514 RTINSECONDS=575.286 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 66.7947 2.5E3 72.3760 2.5E3 72.6427 2.5E3 74.1050 2.3E3 79.0448 2.4E3 79.5301 2.7E3 79.8030 2.0E3 120.5487 2.4E3 121.2148 2.4E3 125.2849 2.5E3 128.8920 2.2E3 142.7443 2.6E3 156.6030 2.5E3 161.4902 2.7E3 173.5276 5.5E4 173.5440 1.6E4 201.4119 2.3E3 201.5685 2.7E3 207.2705 2.3E3 234.8189 2.2E3 420.7230 3.9E3 500.5100 2.6E3 526.7961 2.9E3 628.6236 2.9E3 630.8904 2.6E3 END IONS BEGIN IONS FEATURE_ID=515 PEPMASS=222.0844 SCANS=515 RTINSECONDS=575.348 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 51.2875 2.2E3 54.7291 2.4E3 55.4732 2.3E3 57.9563 2.4E3 58.0649 1.7E4 61.2676 2.7E3 62.0658 2.5E3 62.1786 2.3E3 65.2754 2.3E3 65.5809 2.5E3 65.7319 2.2E3 70.8441 2.9E3 73.0266 2.5E3 91.0539 1.2E4 98.2808 2.3E3 103.0491 2.5E3 107.0485 2.6E3 109.9041 2.4E3 111.9676 9.4E3 112.9535 6.3E3 117.8855 2.4E3 119.0486 1.8E4 120.0521 2.7E3 120.2300 2.2E3 121.6127 2.4E3 122.3107 2.7E3 131.0444 3.8E3 133.0600 2.8E3 134.0695 2.5E3 135.0434 1.8E4 135.9696 5.1E3 136.0472 4.0E3 147.0438 8.3E3 148.0473 2.2E4 149.0549 3.7E3 149.6865 1.2E4 150.9102 2.3E3 153.9803 6.1E3 154.8577 2.9E3 162.0643 4.9E3 163.0390 1.3E4 163.0708 2.5E4 164.0421 3.7E4 173.5281 1.2E4 173.5388 1.7E4 176.0422 1.9E4 178.0580 2.8E3 178.1378 2.3E3 179.0661 1.8E4 190.0618 2.6E3 191.0658 3.3E4 192.0373 1.0E4 194.0894 1.2E4 203.1971 2.3E3 207.0603 3.1E3 207.6944 2.4E3 214.6943 2.1E3 226.7880 2.2E3 228.2394 2.5E3 END IONS BEGIN IONS FEATURE_ID=516 PEPMASS=346.0937 SCANS=516 RTINSECONDS=575.348 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 2 (0 removed due to low quality, 0 removed due to low cosine). 67.8304 2.1E3 92.0291 2.6E3 95.7843 2.3E3 98.0595 7.3E3 112.9802 2.1E3 128.4985 2.2E3 129.8371 2.8E3 132.9700 2.4E3 147.0434 5.5E3 147.0798 1.2E4 162.0664 4.3E3 166.9439 2.2E3 169.9749 2.9E3 171.9899 1.6E4 173.5368 4.4E4 178.0620 2.7E3 190.0623 3.2E4 191.0628 2.9E3 193.0858 2.4E4 206.0572 1.1E4 220.0185 7.0E3 221.0808 1.2E5 222.0851 1.3E4 238.8313 2.7E3 245.0810 1.8E4 251.0316 6.6E3 320.0430 2.7E3 324.7066 2.4E3 374.0593 2.6E3 END IONS BEGIN IONS FEATURE_ID=517 PEPMASS=285.0762 SCANS=517 RTINSECONDS=578.243 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 8 (4 removed due to low quality, 0 removed due to low cosine). 50.4616 1.1E4 51.6802 4.5E3 53.7261 4.5E3 56.5819 1.3E4 56.8111 9.8E3 57.0335 3.2E4 61.3590 1.3E4 61.6680 9.4E3 61.7781 1.3E4 67.0178 9.0E4 68.9969 3.0E4 69.6632 1.1E4 71.2675 3.5E5 71.2713 6.7E4 79.4117 1.2E4 80.2408 5.3E3 81.0334 1.0E5 86.6309 1.2E4 87.8713 4.7E3 88.9825 1.2E4 91.0540 5.2E4 113.4745 4.0E3 119.0404 3.2E4 119.0490 7.0E5 120.0569 7.5E4 121.0284 2.7E5 122.8445 1.2E4 124.0156 3.2E5 131.6000 1.1E4 140.2294 1.3E4 141.0547 1.9E4 145.0283 5.7E5 154.5737 1.1E4 157.0206 1.6E4 157.2990 1.2E4 160.0526 2.9E4 160.2501 4.1E3 163.0406 1.3E4 167.0339 3.0E6 167.0484 2.6E4 168.0573 2.1E4 169.0649 1.4E4 173.5235 1.3E5 173.5374 2.5E5 177.1128 4.6E3 177.9384 1.4E4 185.0445 3.5E5 185.0604 4.8E4 186.0675 3.3E4 187.0389 1.5E5 194.0032 4.8E3 196.0522 5.6E4 197.0597 2.2E5 204.7347 1.1E4 210.8850 6.7E3 213.0551 1.7E5 214.0631 1.0E5 217.0834 1.5E4 223.5446 5.2E3 224.0459 5.6E4 225.0546 5.1E5 228.8949 8.5E3 233.9002 5.5E3 238.8799 7.2E3 242.0278 3.6E4 242.0574 7.2E6 243.0645 1.1E5 253.0481 6.8E4 257.0810 1.4E5 267.0653 1.9E4 268.0762 4.6E4 270.0272 4.9E4 270.0523 9.0E6 283.0616 3.5E4 284.0667 1.7E4 284.9589 6.5E4 284.9799 2.0E5 285.0010 6.8E5 285.0168 4.0E5 285.0758 9.9E7 285.1350 6.5E5 285.1502 7.3E5 285.1717 2.5E5 285.1922 1.3E5 285.2124 2.2E4 END IONS BEGIN IONS FEATURE_ID=518 PEPMASS=344.2587 SCANS=518 RTINSECONDS=578.469 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 50.1026 2.1E3 52.1903 2.1E3 53.4097 2.1E3 55.0540 2.8E4 56.7834 2.7E3 57.0696 4.3E3 58.8214 2.6E3 62.3495 2.4E3 64.7196 2.2E3 67.0505 3.6E3 67.0539 7.6E4 69.0695 4.4E4 79.0538 1.3E4 81.0695 8.3E4 83.0853 1.6E4 89.4987 2.6E3 91.0540 1.4E4 93.0696 1.9E4 95.0852 7.1E4 96.0511 2.9E3 96.5419 2.4E3 97.1010 3.5E3 102.0912 3.2E3 105.0694 3.6E3 107.0851 8.8E3 107.6464 2.4E3 109.1008 3.4E4 113.7577 2.2E3 117.0701 5.8E3 121.0645 2.8E4 121.1010 2.3E4 122.3651 2.6E3 122.8413 2.6E3 123.0437 6.2E4 123.1170 6.8E3 124.6432 2.4E3 129.0700 2.4E3 131.0488 1.6E4 133.0646 2.9E3 135.1166 4.4E3 137.0595 7.2E4 143.0494 2.8E3 145.0647 1.7E4 147.0431 3.3E3 147.0802 1.1E4 149.0595 1.1E5 151.0752 2.3E4 153.1762 2.2E3 155.0851 9.0E3 157.0648 1.4E4 159.0802 1.6E4 161.0595 1.9E5 161.0735 2.4E3 163.0753 6.4E4 164.0699 9.7E3 165.0909 1.3E4 166.0861 3.0E3 169.1017 8.8E3 171.0808 1.0E4 173.0598 6.0E4 173.5282 3.6E4 173.5437 7.0E3 175.0591 4.4E3 175.0754 1.3E5 177.0906 9.5E3 180.1730 2.5E3 183.0806 2.1E4 185.0970 6.6E3 187.0750 2.1E4 189.0912 3.0E4 191.1066 3.5E3 197.0968 1.7E4 199.1113 2.9E3 200.0816 3.0E3 201.0910 1.1E5 202.0980 8.7E3 203.1071 1.6E4 211.1131 3.5E3 215.1068 7.0E4 216.1159 8.2E3 225.1285 5.9E3 229.1226 2.1E4 256.1133 2.9E3 266.4879 2.4E3 267.8271 2.8E3 285.1485 8.1E3 338.4112 2.4E3 344.2588 2.0E4 END IONS BEGIN IONS FEATURE_ID=519 PEPMASS=274.2744 SCANS=519 RTINSECONDS=582.416 CHARGE=1+ MSLEVEL=2 MERGED_STATS=8 / 12 (4 removed due to low quality, 0 removed due to low cosine). 46.6638 2.4E3 48.8792 2.4E3 49.0975 2.3E3 51.2184 2.7E3 51.3112 2.4E3 53.9977 2.3E3 56.8766 2.7E3 57.0696 4.8E5 57.0729 6.0E3 58.0649 2.1E4 58.2056 2.1E3 61.1669 2.5E3 62.0597 2.6E4 65.4177 2.3E3 70.0647 5.7E5 71.0852 1.9E5 73.2670 2.4E3 74.1980 2.2E3 79.8893 2.3E3 83.2880 2.1E3 85.0958 2.2E3 85.1008 8.0E4 85.5941 2.3E3 86.0595 5.4E3 88.0753 1.2E6 88.0815 7.2E3 89.6535 2.1E3 89.9420 2.5E3 100.9722 2.3E3 102.0909 3.3E5 102.8923 2.3E3 106.0857 7.3E5 108.3354 2.2E3 109.6266 2.4E3 112.2785 2.2E3 112.2924 2.2E3 118.3263 2.6E3 122.1773 2.4E3 124.2654 2.4E3 124.4293 2.3E3 127.5950 2.8E3 130.1417 2.4E3 132.1663 3.2E3 135.0437 5.2E4 135.9440 2.5E3 136.2128 2.4E3 142.5065 2.3E3 143.0489 8.9E3 144.9044 2.3E3 148.1663 2.7E3 153.7845 2.4E3 155.5312 2.2E3 157.3738 2.3E3 157.8199 2.2E3 161.5601 2.5E3 162.3169 2.6E3 167.9583 2.6E3 169.1014 2.8E3 171.0439 5.0E3 171.3253 2.7E3 173.0608 2.8E3 173.5309 9.3E4 173.5412 9.1E3 186.1264 4.5E3 201.0545 4.9E4 211.4755 2.4E3 212.2376 2.0E4 230.2478 8.0E4 237.0153 2.4E3 246.3383 2.3E3 248.7885 2.3E3 256.2167 3.3E3 256.2322 7.1E3 256.2631 5.5E5 274.1830 2.9E3 274.2486 8.9E3 274.2741 2.2E6 274.3085 1.7E4 274.3438 3.5E3 274.5629 2.3E3 274.7158 2.4E3 END IONS BEGIN IONS FEATURE_ID=520 PEPMASS=369.1700 SCANS=520 RTINSECONDS=583.308 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 8 (2 removed due to low quality, 0 removed due to low cosine). 54.6503 2.6E3 55.6055 2.2E3 57.7276 2.3E3 68.4192 2.3E3 70.0035 2.2E3 70.0650 7.6E3 71.0490 3.2E4 71.7564 2.3E3 75.0440 1.7E4 77.1853 2.4E3 77.2516 2.3E3 79.0539 2.3E3 80.0387 2.7E3 80.4389 2.5E3 81.4792 2.5E3 88.8327 2.5E3 91.0541 2.0E4 93.2460 2.4E3 95.0236 2.4E3 104.6685 2.7E3 107.0493 1.8E4 108.0571 5.0E3 112.5147 2.2E3 121.0647 3.4E4 123.0811 2.7E3 124.0521 2.5E3 135.0442 2.2E4 136.0519 2.3E5 136.8790 2.4E3 137.0596 1.0E4 139.0753 6.7E4 143.0852 3.0E3 146.0726 1.6E4 148.0519 1.4E4 149.0599 1.3E4 150.0675 1.4E4 150.4885 2.9E3 151.0753 2.0E6 151.1001 6.8E3 153.0907 7.0E3 154.1996 2.4E3 157.0649 1.8E4 158.0726 3.1E4 159.0803 9.6E3 160.0882 5.5E3 161.0594 4.8E3 161.0963 3.1E3 162.0034 2.7E3 162.0677 4.7E3 163.0755 5.9E4 165.0549 5.9E4 165.0911 1.7E5 167.0704 2.2E4 170.7088 2.2E3 171.0804 1.5E4 172.0885 8.9E4 173.0602 1.6E4 173.0962 2.7E3 173.5227 3.0E4 173.5346 4.4E4 173.5429 2.9E4 174.0676 1.4E5 175.0753 4.0E4 177.0911 7.9E4 179.0703 1.8E5 186.0676 9.5E3 187.0752 4.3E3 188.0832 2.9E5 188.0962 2.0E3 189.0721 7.8E3 189.0911 4.3E5 189.1108 7.7E3 190.0992 2.1E4 191.0703 1.7E5 191.1067 6.0E4 193.0860 7.9E4 195.0798 3.4E3 200.0821 3.8E3 201.0689 3.8E3 201.0911 8.4E5 201.1132 6.7E3 202.0998 3.0E3 203.0860 2.7E3 203.1068 3.5E5 205.0858 2.1E4 205.3423 2.4E3 213.0913 8.5E4 214.4826 2.9E3 215.1067 4.1E4 216.0769 4.3E3 223.9019 2.6E3 224.0834 5.9E4 225.0919 1.6E4 227.1061 4.0E3 231.0762 5.7E3 231.1017 2.6E5 233.0960 8.5E3 237.0902 3.4E3 238.0975 2.6E3 239.1073 8.1E3 240.0780 2.9E4 241.0858 2.6E4 245.0967 1.9E4 246.1030 9.6E3 247.1111 3.4E3 249.0929 8.0E3 250.0998 3.0E3 252.0787 3.7E3 253.0859 7.9E4 254.0940 1.9E4 255.0699 3.3E3 255.1016 4.5E5 255.1322 9.6E3 258.1048 7.1E3 259.1125 1.0E4 261.0907 6.2E4 262.0988 5.8E4 263.1049 1.4E4 265.0873 7.7E3 265.1231 1.5E4 267.1015 3.9E4 268.0761 1.4E4 268.0840 7.5E3 268.1095 7.8E5 268.1429 5.4E3 269.0809 1.6E5 269.1124 7.5E3 273.0909 3.4E4 274.0986 1.3E4 275.1068 7.9E4 275.1379 2.8E3 276.1144 1.0E5 277.0881 2.9E4 277.1224 1.3E5 278.0949 2.3E4 278.1280 6.2E3 279.1017 2.2E4 281.0831 7.6E3 281.1179 2.3E4 282.1242 1.2E4 283.0599 8.9E3 283.0968 1.1E6 284.0688 8.6E3 284.1045 5.1E5 284.1353 2.2E3 287.1072 3.3E4 288.1147 7.3E4 289.0866 4.7E4 289.1227 3.5E5 289.1599 4.8E3 290.0938 1.6E4 290.1282 8.4E3 291.1019 2.1E4 292.1098 5.7E4 293.1174 2.2E5 294.0904 3.3E3 294.1253 2.4E4 295.0970 2.3E4 295.1323 1.5E4 296.1045 6.5E4 297.1104 3.9E3 298.0898 1.1E4 298.1201 2.3E6 298.1768 3.5E3 299.1280 3.1E5 303.1014 1.1E4 304.1098 8.9E4 305.0767 4.8E3 305.1173 7.8E5 305.1583 8.8E3 306.0901 7.6E3 306.1261 2.1E4 307.0952 5.4E3 307.1331 1.2E5 308.1035 1.3E4 308.1408 1.8E5 309.1122 1.1E5 310.1191 1.0E4 310.1558 3.8E3 311.0967 3.1E3 311.1280 5.8E5 311.1695 5.0E3 312.1363 1.0E4 318.1264 5.2E3 319.1330 3.1E5 320.0978 5.7E3 320.1408 8.7E5 321.1122 3.2E5 321.1542 6.4E3 322.1207 2.6E4 323.1278 5.9E4 324.1357 3.3E5 325.1436 6.1E4 335.1283 5.7E4 335.7509 2.8E3 336.1356 2.3E5 338.1507 2.3E4 338.2554 3.0E3 339.1591 7.2E4 351.1590 1.8E5 369.1692 5.3E3 END IONS BEGIN IONS FEATURE_ID=521 PEPMASS=320.2589 SCANS=521 RTINSECONDS=584.479 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 6 (0 removed due to low quality, 0 removed due to low cosine). 49.3713 2.8E3 54.2575 2.2E3 55.0541 7.0E3 56.9231 2.4E3 57.0697 4.1E4 61.7036 2.3E3 62.4118 2.2E3 65.7565 2.4E3 66.7768 2.2E3 67.0541 2.4E3 67.2091 3.0E3 67.2997 2.1E3 69.0696 1.4E4 70.4219 2.4E3 71.0853 1.7E4 71.2148 2.2E3 78.6963 2.7E3 81.0698 3.1E3 83.0855 3.0E3 83.6439 2.4E3 84.5862 2.2E3 86.2624 2.4E3 91.0539 2.6E3 91.1086 2.4E3 91.2841 2.7E3 92.4935 2.7E3 94.8475 2.3E3 95.0852 5.6E3 98.0599 1.3E4 98.6497 2.2E3 101.3940 2.3E3 103.0539 4.6E4 104.7960 2.5E3 104.8675 2.1E3 109.1009 3.1E3 110.1730 2.3E3 112.3963 2.5E3 117.0696 4.5E4 118.7121 2.5E3 123.0438 9.2E4 131.0379 3.4E3 131.0489 3.0E5 131.0854 3.1E4 133.0646 2.0E4 135.2416 2.6E3 136.8669 2.4E3 137.0594 1.3E5 145.0517 3.7E3 145.0646 2.5E5 147.0808 5.7E3 149.0460 5.0E3 149.0595 1.9E6 149.0715 2.2E4 151.0752 4.0E5 151.4746 2.5E3 157.4730 2.1E3 159.0804 1.6E5 159.1685 2.2E3 159.5185 2.1E3 161.0956 3.1E3 161.6728 2.6E3 162.0671 7.6E3 162.8421 2.4E3 163.0593 1.4E4 163.0753 8.5E5 163.0910 6.4E3 166.0860 7.5E3 173.0958 2.7E4 173.5228 1.7E4 173.5332 5.2E4 173.5406 1.9E4 173.9456 2.9E3 177.0911 1.7E5 181.0852 5.9E3 184.2056 5.9E3 185.4158 2.7E3 185.7187 2.3E3 187.1126 2.5E3 190.0627 3.7E4 191.1066 2.1E4 192.0676 1.3E4 193.0858 1.7E4 194.4414 2.6E3 194.7891 2.4E3 195.0911 1.4E4 199.3297 2.6E3 208.0632 3.4E3 221.0810 6.0E4 222.0844 2.7E4 223.0867 6.0E4 234.5180 2.5E3 235.9824 2.9E3 269.6816 2.4E3 289.9384 2.3E3 299.6201 2.2E3 302.1753 2.5E3 303.2325 1.0E5 303.2631 2.1E3 320.2587 3.2E4 END IONS BEGIN IONS FEATURE_ID=522 PEPMASS=280.0973 SCANS=522 RTINSECONDS=586.659 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 4 (1 removed due to low quality, 0 removed due to low cosine). 56.9234 2.3E3 60.3084 2.7E3 63.7083 2.1E3 65.3376 2.3E3 66.2678 1.3E4 66.2694 3.6E3 68.0716 2.4E3 70.0223 2.4E3 70.0260 2.6E3 77.0277 2.3E3 81.1427 2.6E3 86.3203 2.5E3 93.5881 2.2E3 96.3070 2.3E3 114.8332 2.3E3 151.0892 2.4E3 152.0624 5.5E3 166.3522 2.2E3 171.9772 2.3E3 173.5356 3.2E4 180.0807 1.5E4 181.0885 2.0E4 196.1126 2.8E3 205.2169 2.4E3 208.0753 8.7E3 209.0834 9.4E4 210.0914 8.9E3 219.0576 1.0E4 219.0675 3.8E4 219.6660 2.4E3 220.0594 2.6E4 220.0773 1.2E4 224.1069 4.2E3 234.0912 6.0E3 235.0629 1.3E4 236.0486 2.0E3 236.0704 9.9E4 237.0779 2.9E4 247.0622 1.0E4 248.0702 2.1E4 250.0499 2.7E4 251.0573 1.7E4 252.1016 2.7E4 262.0494 3.1E3 264.0652 3.2E5 265.0060 9.9E3 265.0213 6.7E3 265.0477 8.1E3 265.0731 3.8E6 265.1389 2.1E4 280.0253 7.9E3 280.0968 2.5E6 283.4260 2.5E3 END IONS BEGIN IONS FEATURE_ID=523 PEPMASS=315.0868 SCANS=523 RTINSECONDS=589.351 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 48.5859 2.1E3 56.5633 2.2E3 58.0651 2.9E3 59.8907 2.2E3 63.0706 2.3E3 65.5606 2.2E3 68.2237 2.0E3 69.5511 2.4E3 69.6290 2.2E3 86.1674 2.2E3 102.1345 2.3E3 111.7377 2.8E3 115.4245 2.2E3 115.7423 2.3E3 118.4971 2.3E3 128.2579 2.6E3 130.2905 2.3E3 141.2922 2.5E3 167.0345 2.8E3 173.5257 1.2E4 173.5375 3.5E4 240.7740 2.6E3 267.4456 3.0E3 272.0372 4.2E3 272.0676 1.3E5 300.0629 1.1E6 315.0861 1.2E6 315.1300 5.3E3 END IONS BEGIN IONS FEATURE_ID=524 PEPMASS=354.0975 SCANS=524 RTINSECONDS=592.69 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 57.0723 2.2E3 57.1085 2.2E3 60.4962 2.5E3 74.2880 2.1E3 85.4691 2.5E3 95.3651 2.3E3 114.1837 2.9E3 125.3895 2.7E3 126.9706 2.7E3 139.6184 2.3E3 157.0898 2.2E3 165.5317 2.8E3 173.5252 2.9E4 173.5429 1.3E4 197.8988 2.3E3 220.2382 2.6E3 228.3292 2.4E3 232.8390 2.9E3 237.0789 6.0E3 264.0659 1.7E4 265.0732 6.3E4 272.2767 2.4E3 278.0450 1.7E4 287.9755 2.8E3 292.0606 2.7E4 293.0683 2.7E5 294.0784 3.1E3 296.0555 2.0E5 302.2051 2.7E3 306.0400 1.6E4 307.8028 2.9E3 308.0551 1.3E4 310.0711 7.5E4 320.0123 4.2E3 320.0554 2.5E5 321.0635 8.7E4 322.0732 3.3E3 324.0060 5.4E3 324.0503 5.5E5 336.0874 6.6E3 338.0659 8.0E4 339.0737 4.0E5 354.0972 2.0E5 END IONS BEGIN IONS FEATURE_ID=525 PEPMASS=376.0797 SCANS=525 RTINSECONDS=592.69 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 3 (1 removed due to low quality, 0 removed due to low cosine). 59.1717 2.3E3 61.4017 2.4E3 71.6481 2.5E3 73.0916 2.4E3 74.5493 2.3E3 77.2176 2.6E3 87.6243 2.3E3 90.3647 2.2E3 99.6096 2.5E3 102.7040 2.5E3 135.0441 4.0E3 159.1650 2.7E3 165.5156 2.4E3 173.5229 1.3E4 173.5410 1.9E4 198.4497 2.4E3 325.0091 3.4E3 346.0321 4.2E4 360.0489 1.6E4 361.0559 7.9E4 376.0796 4.5E4 END IONS BEGIN IONS FEATURE_ID=526 PEPMASS=438.0403 SCANS=526 RTINSECONDS=595.385 CHARGE=1+ MSLEVEL=2 MERGED_STATS=9 / 9 (0 removed due to low quality, 0 removed due to low cosine). 55.4689 2.1E3 56.3678 2.5E3 57.0537 2.2E3 57.1849 2.2E3 58.0193 2.4E3 58.6654 2.4E3 59.6465 2.0E3 61.2632 2.5E3 61.7972 2.4E3 62.4362 2.2E3 62.5796 2.4E3 63.3415 2.5E3 63.4731 2.1E3 63.5347 2.4E3 70.6670 2.3E3 73.5390 2.4E3 75.7399 2.3E3 76.6343 2.2E3 78.3070 2.4E3 81.1449 2.7E3 82.0740 2.1E3 83.1321 2.3E3 84.7207 2.1E3 84.8133 2.2E3 85.9388 2.6E3 89.5368 2.2E3 93.0192 2.3E3 99.9061 2.5E3 101.5553 2.2E3 114.5615 2.1E3 120.9331 2.5E3 122.0557 2.2E3 125.3192 2.1E3 126.4161 2.3E3 137.8711 2.7E3 148.0515 8.5E4 148.2032 2.3E3 152.0125 2.4E3 154.3319 2.8E3 163.3406 2.2E3 172.0509 2.9E3 173.5191 1.1E4 173.5342 1.5E5 194.1139 2.3E3 206.2779 2.7E3 207.9816 7.3E4 221.9609 5.6E4 225.9924 1.4E4 231.9814 7.1E4 237.7536 2.6E3 237.7817 2.6E3 239.9714 2.2E4 244.1127 2.2E3 249.9919 3.3E3 267.7767 2.9E3 274.7808 2.7E3 279.0896 6.9E3 286.4091 2.6E3 288.2338 2.5E3 291.7493 2.3E3 304.0728 5.6E4 306.0900 6.4E3 308.1303 2.7E3 309.4935 2.3E3 320.0140 2.0E4 322.0280 2.6E3 334.0284 3.6E3 336.0081 2.7E4 338.0222 1.0E4 341.1256 2.4E3 350.9944 2.6E4 362.0235 3.4E5 364.0027 2.5E5 364.0454 6.9E3 366.0186 1.9E5 366.9450 2.6E3 370.6427 2.4E3 371.4949 2.3E3 376.0028 3.7E4 378.0154 3.8E3 379.9916 2.9E4 380.0376 6.4E4 382.0131 2.3E4 387.8307 2.5E3 392.0371 2.8E4 393.0068 2.6E4 394.0140 1.5E5 407.9926 6.7E3 412.0259 1.4E4 436.5729 3.1E3 END IONS BEGIN IONS FEATURE_ID=527 PEPMASS=356.1257 SCANS=527 RTINSECONDS=595.675 CHARGE=1+ MSLEVEL=2 MERGED_STATS=9 / 9 (0 removed due to low quality, 0 removed due to low cosine). 54.0907 2.4E3 54.1086 2.2E3 55.0429 2.2E3 57.6983 2.2E3 58.8011 2.3E3 59.7163 2.1E3 62.8749 2.2E3 65.0385 8.9E3 66.8829 2.4E3 67.0540 1.0E4 69.5968 2.9E3 71.4122 2.3E3 71.9770 2.3E3 72.1077 2.4E3 72.6165 2.4E3 73.0280 5.2E3 73.3019 2.3E3 74.7907 2.5E3 75.6858 2.3E3 76.1386 2.5E3 77.0389 7.2E3 77.1395 3.4E3 77.1803 2.2E3 77.2129 2.2E3 77.8735 2.2E3 78.0461 2.3E5 78.6432 2.4E3 79.0539 4.3E4 81.0331 2.9E5 81.0695 9.7E3 81.1679 2.1E3 82.8425 2.4E3 85.0280 3.5E4 88.8614 2.3E3 91.0539 3.5E3 93.0332 1.7E4 93.3476 2.1E3 94.9458 2.4E3 95.0488 2.0E4 99.0438 4.8E4 102.1047 2.1E3 102.6884 2.6E3 103.0539 6.2E4 103.9115 2.3E3 104.0617 5.8E3 106.0410 1.7E5 107.0415 3.2E3 107.0487 2.0E5 108.8886 2.2E3 111.0437 7.4E4 113.4314 2.2E3 114.1086 2.2E3 115.0540 6.7E3 117.0696 1.2E5 118.3157 2.2E3 121.6838 2.2E3 122.0358 9.0E4 123.0437 2.6E5 124.0515 7.1E4 125.0593 8.1E3 128.6112 2.8E3 130.0411 1.2E4 131.0378 5.8E3 131.0488 5.0E5 132.0561 3.9E4 133.0639 3.4E3 135.0318 4.4E3 135.0437 1.3E6 135.0542 1.5E4 136.0515 2.0E6 136.0630 2.7E4 137.0480 9.5E3 137.0594 1.1E6 137.0704 1.1E4 143.0489 3.2E4 144.0567 1.6E4 145.0645 4.7E5 145.4563 2.8E3 147.0439 6.4E3 148.0516 2.4E5 149.0595 4.4E4 150.0672 3.9E4 151.0386 3.2E4 158.0711 2.8E3 159.0436 1.7E4 159.0795 3.7E3 160.0517 2.4E5 161.0595 2.7E5 162.0672 2.4E5 163.0750 1.0E4 163.6372 2.7E3 164.0464 7.0E3 169.9879 2.3E3 172.0517 2.8E4 173.0596 5.9E5 173.5267 6.8E4 173.5404 7.7E4 174.0671 4.3E4 175.0391 3.0E4 175.0753 1.3E5 178.0632 6.1E3 185.0598 3.9E4 186.0670 6.7E3 187.0757 9.2E3 188.0828 3.5E4 189.0544 6.0E4 190.0624 3.5E4 193.0491 5.8E3 202.0625 9.3E4 203.0702 1.8E5 221.0821 2.8E3 228.2996 2.5E3 228.5574 2.8E3 232.0849 1.1E4 243.5901 2.4E3 243.9493 2.3E3 245.3372 2.5E3 249.1549 3.0E3 253.8699 2.4E3 255.0248 2.6E3 256.0188 2.5E3 256.3854 2.3E3 260.0789 2.5E3 260.3901 2.8E3 261.2241 2.6E3 262.0957 1.5E4 283.0023 2.4E3 290.0919 1.1E4 291.8182 2.3E3 294.3462 2.5E3 295.0746 1.3E4 298.0606 8.8E3 303.4907 2.7E3 303.7538 2.6E3 305.0807 1.3E4 309.4739 2.2E3 309.5268 2.3E3 309.9009 3.8E4 322.0614 1.1E4 323.0685 2.7E3 325.0541 3.4E3 326.0568 3.4E4 339.7089 2.7E3 340.0737 7.0E3 341.0800 2.5E4 345.7777 2.3E3 356.1031 1.2E4 END IONS BEGIN IONS FEATURE_ID=528 PEPMASS=321.1127 SCANS=528 RTINSECONDS=595.758 CHARGE=1+ MSLEVEL=2 MERGED_STATS=8 / 20 (12 removed due to low quality, 0 removed due to low cosine). 49.9257 6.1E3 51.0236 1.6E4 51.0729 2.5E3 53.0386 3.1E3 53.8603 7.6E3 55.0178 5.6E3 55.8138 3.5E3 58.4759 4.0E3 62.8531 4.7E3 63.3137 3.1E3 63.3646 8.9E3 63.4958 3.2E3 65.0388 9.6E4 65.8188 2.0E3 66.6279 3.3E3 67.6938 3.3E3 68.0679 2.3E3 68.6277 3.3E3 68.7627 2.2E3 69.0336 4.1E3 70.3315 3.1E3 70.7252 7.0E3 72.5415 2.2E3 72.5887 2.4E3 73.3436 3.2E3 74.8638 2.2E3 76.0314 2.6E3 76.3894 2.3E3 77.0391 9.2E4 77.0712 9.1E3 79.0541 8.5E4 81.0398 5.2E3 83.9864 5.4E3 87.9717 3.4E3 89.0394 3.2E3 91.0483 1.4E4 91.0542 7.7E5 91.8416 4.3E3 93.0698 2.6E5 94.5913 7.5E3 95.0491 2.0E5 95.3076 5.8E3 100.7332 2.9E3 101.4891 3.2E3 101.5960 3.9E3 102.0465 1.4E4 103.0462 2.5E4 103.0542 1.7E6 103.0659 4.1E3 104.3284 6.3E3 105.0327 3.8E3 105.0447 6.5E4 105.1209 3.5E3 107.0484 8.8E3 111.3415 4.6E3 112.4190 3.2E3 115.0542 5.7E5 117.0700 6.6E4 119.0491 4.5E5 120.4695 4.1E3 121.0646 3.7E4 123.0625 3.3E3 127.8131 2.5E3 130.0420 4.6E3 131.0262 3.8E4 131.0491 1.3E7 131.0576 1.3E5 131.0669 8.1E3 131.0723 1.4E4 131.2004 7.7E3 135.0168 1.3E4 135.0253 3.5E3 135.0440 1.1E7 135.0680 3.9E4 137.0596 5.2E4 138.3120 7.5E3 140.8444 2.3E3 141.0698 2.4E5 143.0362 6.5E3 143.0491 1.0E6 143.0864 8.7E3 145.1183 4.6E3 147.0436 1.5E4 148.0521 5.7E4 149.0238 6.0E3 149.0334 3.3E5 149.0370 3.3E4 149.0596 3.3E7 149.0699 9.0E4 149.0814 4.4E4 149.0862 3.8E5 149.0958 9.3E4 149.1082 1.1E4 152.6825 3.3E3 155.0485 9.3E3 157.1644 3.1E3 157.7364 4.9E3 159.0441 1.0E5 160.0518 2.0E5 161.0013 6.0E3 161.0105 7.2E3 161.0191 3.1E4 161.0295 3.2E5 161.0341 3.2E4 161.0597 3.2E7 161.0845 4.7E4 161.0892 3.8E5 161.1001 6.8E4 161.1090 1.9E4 161.2029 3.2E3 162.3525 3.0E3 164.9110 3.3E3 167.8214 8.1E3 169.0648 3.9E5 171.0802 3.4E3 172.0516 3.5E4 172.0746 5.3E3 173.0256 5.3E3 173.0457 3.2E4 173.0598 9.4E6 173.5248 8.7E4 173.5374 1.7E5 181.2193 2.5E3 185.0433 2.1E4 185.0598 2.7E6 185.0781 1.4E4 185.0874 6.2E3 189.0705 1.0E4 190.0780 9.7E4 199.0755 9.9E5 199.0960 5.1E3 203.0862 7.6E4 204.8351 3.0E3 205.0672 1.7E4 205.1013 1.1E6 207.1160 2.5E3 209.0596 9.1E3 210.0678 1.3E4 212.0053 3.7E3 215.0858 2.3E5 217.1005 5.7E3 218.0510 3.8E3 218.0728 2.2E5 219.0806 7.4E3 222.0669 2.3E4 225.3396 5.3E3 231.0808 3.4E4 232.3476 3.4E3 233.0565 1.8E4 233.0962 3.7E6 233.1237 2.9E4 235.0754 1.7E5 235.1113 2.8E4 243.0808 1.3E5 243.5561 2.5E3 245.0957 4.9E4 246.0674 7.5E4 248.0833 1.8E5 249.0912 3.1E4 259.0758 1.5E4 261.0586 3.0E4 261.0909 1.8E6 261.1234 2.6E4 262.0625 5.9E4 262.0968 8.0E3 263.0714 2.9E5 263.1065 4.2E6 263.1321 8.3E3 266.0577 1.5E4 273.0910 3.9E5 275.0715 2.0E4 276.0784 4.4E5 279.0642 2.4E4 289.0863 1.7E5 290.0961 3.3E3 291.0725 1.2E4 291.1017 3.7E6 292.0731 7.0E4 293.0817 9.1E4 306.0889 5.9E5 321.1121 8.2E5 328.3031 3.1E3 END IONS BEGIN IONS FEATURE_ID=529 PEPMASS=657.2426 SCANS=529 RTINSECONDS=599.107 CHARGE=1+ MSLEVEL=2 MERGED_STATS=9 / 12 (3 removed due to low quality, 0 removed due to low cosine). 69.5401 2.4E3 70.3161 2.7E3 71.2360 2.4E3 73.0265 1.3E4 73.0286 3.4E3 74.2701 1.0E4 74.2726 3.3E3 75.7288 2.4E3 81.0334 3.7E3 82.8564 2.1E3 85.4258 2.3E3 91.0965 2.2E3 91.9379 2.4E3 96.4299 2.2E3 101.3614 2.3E3 103.3523 2.6E3 103.9486 2.6E3 111.4624 3.1E3 118.0260 3.0E4 120.0416 8.4E4 121.4809 2.4E3 123.2829 2.7E3 123.4102 2.4E3 125.1958 2.3E3 125.9313 2.6E3 127.8638 2.5E3 128.0465 9.5E3 129.0857 2.3E3 130.7989 2.5E3 134.0606 3.2E3 139.5122 2.3E3 143.1979 2.3E3 150.0542 5.8E3 152.9121 2.3E3 156.0414 3.5E4 157.0496 8.6E3 157.3009 2.6E3 158.0575 3.2E4 160.2936 2.4E3 160.3954 2.4E3 162.2449 2.5E3 163.1235 2.2E3 172.0366 3.1E4 173.5218 4.2E4 173.5334 1.6E5 173.5418 2.9E4 175.7199 2.3E3 176.5773 2.5E3 178.0504 1.4E4 180.4850 2.7E3 188.0308 7.3E3 190.0811 2.5E3 199.0482 2.6E3 200.0314 1.6E5 212.8433 2.9E3 213.7520 2.5E3 224.1710 2.5E3 253.0943 2.1E5 254.9108 2.5E3 267.6843 2.8E3 269.0569 5.7E3 269.0895 1.4E6 269.1152 2.7E3 273.0766 2.4E4 277.0181 2.5E3 279.0870 2.5E3 285.1712 2.6E3 297.0074 1.4E4 297.0226 8.4E3 297.0542 4.7E3 297.0846 6.2E6 297.1625 3.9E3 310.0689 1.4E4 325.0917 8.4E4 340.0465 3.4E3 340.1152 1.6E6 352.1150 1.1E5 354.1443 4.4E3 357.0715 2.6E3 359.3719 2.7E3 368.1237 9.4E3 378.2383 2.8E3 383.1457 1.2E4 385.1631 4.1E3 402.4492 2.9E3 405.0943 1.8E4 413.1599 2.0E4 420.1199 2.1E4 433.0899 2.9E3 435.1415 1.1E5 449.7007 2.6E3 450.7814 2.5E3 460.3309 2.4E3 463.1361 9.7E4 486.1520 8.4E4 501.1759 1.9E4 502.1463 5.7E3 516.1995 2.2E4 517.1709 1.2E4 525.2804 2.5E3 530.1401 7.6E3 532.1939 4.4E5 541.5800 3.0E3 559.2042 3.1E3 560.1893 2.4E5 633.2497 3.1E3 657.2417 6.6E5 END IONS BEGIN IONS FEATURE_ID=530 PEPMASS=680.3185 SCANS=530 RTINSECONDS=599.16 CHARGE=1+ MSLEVEL=2 MERGED_STATS=8 / 10 (2 removed due to low quality, 0 removed due to low cosine). 67.3818 2.3E3 67.5017 2.2E3 67.8150 2.0E3 68.6541 2.0E3 75.0439 1.9E4 76.8574 2.4E3 77.4450 2.6E3 78.6082 2.2E3 78.7981 2.5E3 79.2810 3.1E3 80.0493 8.9E3 80.2780 3.0E3 81.0334 2.2E6 81.0391 1.5E4 82.6039 2.5E3 83.7367 2.3E3 85.2999 2.2E3 87.0985 2.6E3 88.0700 2.4E3 88.6792 2.4E3 89.7544 2.1E3 91.2676 2.4E3 93.1271 2.4E3 94.0651 1.6E4 94.8628 2.3E3 95.0489 6.2E3 98.0598 8.8E4 99.6021 2.3E3 100.0724 2.4E3 101.9805 2.3E3 103.3939 2.4E3 104.0495 2.5E3 106.0648 1.0E4 107.5551 2.5E3 110.0236 7.1E4 111.9317 2.3E3 122.0599 4.1E4 128.7872 2.4E3 132.0443 3.7E4 134.0599 4.5E4 134.3303 2.5E3 136.0393 4.4E4 138.0543 6.6E3 149.6829 4.8E3 149.6931 4.2E3 150.0547 9.2E5 150.0652 2.7E3 160.0386 6.4E3 161.9327 2.7E3 165.4109 2.9E3 168.0752 2.5E3 173.5253 7.0E4 173.5380 1.3E5 174.3482 2.7E3 178.0313 9.1E3 178.0498 4.4E6 178.0862 1.8E4 178.0971 3.5E3 178.8394 2.8E3 181.0858 1.0E5 188.9303 2.2E3 190.0624 1.1E4 193.0858 9.3E3 193.4137 2.4E3 195.0649 7.9E4 196.0604 9.5E3 199.7958 2.3E3 206.0576 1.3E4 207.1013 8.4E3 221.0565 3.6E3 221.0809 9.8E5 221.1072 2.6E3 223.0610 4.9E3 223.0944 2.4E3 230.3379 2.6E3 245.0809 2.8E3 247.0963 1.0E4 262.6172 2.4E3 263.9194 2.3E3 265.0698 2.4E3 273.0764 3.5E4 275.1029 4.2E4 281.7560 2.6E3 300.1223 1.7E4 314.1152 2.7E3 321.1883 2.6E3 322.1203 1.1E4 324.6585 2.6E3 325.1538 2.4E3 330.1455 1.1E4 337.1034 8.5E3 339.1246 1.2E4 349.1066 5.0E3 350.1173 6.1E3 351.0843 8.0E3 351.1227 5.2E4 352.1230 1.2E4 353.1378 2.9E3 354.1460 3.6E4 361.1654 1.8E4 364.3216 2.5E3 365.1010 1.8E4 366.1083 5.5E4 366.1520 1.3E4 366.6527 2.5E3 367.1174 1.3E5 370.1373 2.8E3 380.1265 2.3E4 381.1332 2.0E5 382.0847 1.0E4 382.1412 5.1E5 382.1933 3.7E3 383.1115 2.5E4 385.1647 6.3E4 394.1040 3.3E3 395.1011 2.8E3 395.1491 3.5E5 398.1362 6.0E4 399.1436 3.2E4 409.1290 1.2E4 410.1363 1.5E5 411.1078 4.7E4 413.1596 5.8E5 422.0588 3.4E3 423.1445 5.7E3 426.1307 6.5E4 441.1543 3.5E5 485.5563 2.3E3 486.0357 2.9E3 492.1919 3.0E3 520.1966 7.8E3 538.9649 2.6E3 640.2341 2.4E3 652.5799 2.8E3 END IONS BEGIN IONS FEATURE_ID=531 PEPMASS=275.1030 SCANS=531 RTINSECONDS=599.19 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 8 (4 removed due to low quality, 0 removed due to low cosine). 51.0230 3.0E3 51.5989 2.3E3 53.0384 7.1E5 53.0414 6.6E3 53.0428 6.6E3 54.8832 2.2E3 55.0176 6.6E4 55.0540 2.0E4 55.4395 2.4E3 57.0697 1.3E4 63.2458 2.7E3 67.0539 2.2E4 69.0331 3.8E3 69.0697 1.7E4 69.8992 2.3E3 70.4164 2.4E3 71.0488 3.7E4 71.2616 2.6E3 74.9169 2.1E3 75.4866 2.1E3 76.1200 2.2E3 79.0539 6.2E4 80.0492 5.1E4 81.0270 5.9E3 81.0332 3.9E6 81.0417 2.2E4 81.0425 9.2E4 81.0453 1.7E4 81.0696 2.5E4 82.0286 1.2E4 83.0489 1.2E4 83.0852 3.4E3 84.9064 2.2E3 85.0646 1.3E4 85.3787 2.3E3 87.1895 2.3E3 87.8256 2.2E3 91.0539 2.2E4 93.0695 4.9E4 94.0597 2.2E3 94.0648 7.6E4 95.0489 4.2E4 95.0851 5.6E4 95.4853 2.3E3 97.0644 1.1E4 98.0598 1.2E4 100.3921 2.2E3 104.0491 3.0E4 104.2853 2.6E3 105.0696 4.7E4 106.0648 2.1E4 107.0490 1.2E4 107.0852 5.6E4 108.0442 2.1E4 108.1408 2.5E3 109.0644 3.0E4 109.1008 2.0E4 110.0148 2.7E3 110.0233 2.3E5 111.0801 5.1E4 117.0695 1.7E4 119.0852 5.5E4 121.1009 5.8E4 121.1179 2.2E3 122.0506 3.8E3 122.0597 1.6E5 123.0801 3.5E3 125.2422 2.4E3 125.6163 2.4E3 129.0703 9.5E3 131.0853 7.9E4 132.0441 1.4E5 133.1009 6.1E4 134.0597 3.6E4 135.0801 4.3E4 135.1174 2.8E3 136.0390 6.3E4 137.0958 1.9E4 142.0773 8.9E3 143.0574 2.5E3 143.0853 3.3E4 144.0935 8.6E3 145.1009 6.2E4 147.1165 2.0E4 149.0959 2.5E3 150.0409 5.3E3 150.0546 1.2E6 150.0670 2.0E4 154.8214 2.4E3 155.0854 7.0E3 156.0934 1.2E4 157.1009 5.4E4 158.1089 2.7E4 159.1166 1.0E5 160.0389 1.3E4 161.0963 7.9E3 168.0935 5.8E3 169.1009 1.2E4 171.1016 2.5E3 171.1169 3.2E4 173.0968 2.5E3 173.1324 1.0E5 173.5242 4.3E3 173.5359 4.3E4 174.1404 7.6E3 175.1115 1.5E4 175.2018 3.0E3 177.1271 2.4E4 178.0498 8.1E5 178.0677 3.0E3 183.1169 1.9E4 184.1232 2.4E3 186.2849 2.6E3 187.1111 1.4E4 187.1484 8.9E3 189.1278 2.6E3 191.1433 2.9E3 197.1322 8.8E3 197.9650 2.4E3 198.4580 2.3E3 199.1483 2.7E4 201.1273 9.0E3 206.7172 2.3E3 233.1541 3.5E3 257.1532 2.7E3 END IONS BEGIN IONS FEATURE_ID=532 PEPMASS=635.2606 SCANS=532 RTINSECONDS=599.214 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 11 (7 removed due to low quality, 0 removed due to low cosine). 66.3650 2.6E3 70.3409 3.5E3 73.7488 3.4E3 75.0439 4.8E4 79.0541 3.8E4 80.0494 5.8E4 81.0221 2.2E4 81.0270 7.5E3 81.0334 6.5E6 81.0421 2.2E4 81.0433 8.6E4 81.0444 1.9E4 81.0478 9.0E3 82.0286 7.5E4 93.2355 2.8E3 94.0649 9.2E4 95.0490 3.8E4 96.0446 4.1E3 98.0235 1.2E4 98.0599 3.7E5 98.1606 3.1E3 100.3413 2.4E3 104.0494 4.4E4 106.0648 3.8E4 107.0492 7.0E3 108.0444 2.6E4 110.0235 3.8E5 110.0321 6.7E3 115.4350 2.3E3 122.0599 1.7E5 130.8395 3.8E3 132.0443 1.6E5 134.0599 1.2E5 136.0392 1.3E5 138.0546 3.2E4 150.0548 2.6E6 150.0655 1.7E4 151.0754 4.0E3 160.0394 3.2E4 161.0840 2.8E3 167.0708 1.2E4 173.4549 3.4E3 173.5285 1.5E4 173.5365 4.2E4 176.0845 4.6E3 178.0132 3.6E4 178.0215 2.1E4 178.0499 8.1E6 178.0863 5.7E4 178.0966 1.2E4 181.0860 3.2E5 188.0464 2.7E3 193.0858 8.1E3 195.0652 2.7E5 195.1002 7.3E3 196.0606 2.8E4 205.0840 3.9E3 206.0576 6.5E4 207.0666 2.9E3 207.1016 3.5E4 209.0019 3.9E3 219.1009 1.0E4 221.0562 4.7E3 221.0809 7.7E5 221.0997 4.9E3 223.0598 2.1E4 230.0585 5.9E3 235.0959 1.7E4 243.0769 3.9E3 245.0809 4.1E4 245.1065 3.6E3 247.0966 7.7E4 273.0759 8.2E4 275.1034 4.4E4 276.1222 5.3E3 300.1232 5.9E4 307.0966 2.7E4 308.1036 1.2E4 315.1222 5.9E3 319.0974 4.9E3 321.1125 3.0E4 322.0816 3.4E3 322.1197 6.1E4 323.0907 2.1E4 323.1287 1.6E4 330.1467 6.0E4 334.1200 1.0E4 335.0906 2.3E4 335.1299 1.4E4 336.0997 3.5E4 337.1033 8.5E4 338.1161 1.1E4 339.1220 8.5E4 345.1328 8.7E3 348.1023 1.3E4 349.1070 5.6E4 350.1145 8.6E4 351.0840 9.6E4 351.1228 3.9E5 352.0880 2.9E4 352.1271 6.6E4 353.1380 5.0E4 354.1460 1.9E5 355.1164 2.9E4 360.1574 1.3E4 361.1637 2.2E4 362.1145 3.4E4 365.1013 1.7E5 365.1390 3.5E3 366.1092 3.0E5 366.1464 4.5E4 367.0629 3.1E3 367.1175 7.3E5 367.1705 1.3E4 368.1270 2.8E4 369.1346 1.4E4 370.1404 5.7E4 371.1494 3.4E4 377.1015 7.2E3 378.1105 2.2E4 379.1191 2.8E4 380.1255 1.7E5 381.0773 5.3E3 381.1334 6.1E5 381.1760 4.1E3 382.1410 1.9E6 382.1832 1.1E4 383.1128 2.0E5 384.1218 4.3E3 385.1648 1.7E5 392.1239 4.5E3 393.0961 2.8E4 394.1047 1.5E4 395.1490 1.5E6 395.1954 2.5E3 396.0853 6.0E3 396.8714 3.0E3 397.1248 2.8E4 398.1360 2.8E5 399.1433 6.0E4 401.1621 4.6E3 407.1165 8.2E3 408.1208 4.5E4 409.1280 6.9E4 410.0721 5.4E3 410.0874 2.9E3 410.1362 6.8E5 411.1075 2.5E5 413.1112 7.0E3 413.1594 1.6E6 423.1432 6.1E4 425.1225 3.1E3 426.1306 2.3E5 426.1890 3.4E3 441.1004 2.4E3 441.1542 7.3E5 460.7765 3.0E3 488.1689 9.3E3 490.1505 1.3E4 492.2006 2.3E4 520.1969 4.9E4 548.1200 4.3E3 END IONS BEGIN IONS FEATURE_ID=533 PEPMASS=538.2076 SCANS=533 RTINSECONDS=599.248 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 5 (1 removed due to low quality, 0 removed due to low cosine). 65.4961 2.7E3 66.9267 2.7E3 67.9693 2.6E3 75.0440 1.8E4 77.5681 2.3E3 79.7132 2.4E3 81.0333 9.6E4 84.3839 2.2E3 90.0193 2.6E3 91.0079 2.2E3 91.0611 2.3E3 91.8283 2.5E3 96.0245 2.2E3 98.0599 3.7E4 98.5226 2.3E3 105.0548 2.7E3 105.5511 2.7E3 110.0237 8.5E3 111.8514 2.3E3 118.8395 2.7E3 119.5060 2.4E3 134.0602 1.3E4 135.8470 2.5E3 136.7418 2.1E3 138.0546 1.1E4 139.7973 2.2E3 150.0549 3.0E4 173.5250 4.8E4 173.5415 1.4E4 178.0497 5.3E4 181.0859 1.2E5 188.9390 2.4E3 191.7885 2.6E3 195.0652 4.9E4 206.0575 3.1E4 208.7415 2.7E3 211.2634 2.8E3 221.0810 3.1E5 223.0604 1.4E4 232.0958 3.0E3 245.0814 4.6E3 247.0970 1.6E4 270.5121 2.5E3 273.0762 1.9E4 276.1226 6.4E3 300.1236 3.6E4 310.1003 2.6E3 321.1136 2.6E3 322.1194 1.3E4 323.0948 3.5E3 332.6324 2.6E3 335.0892 3.2E3 336.0985 8.1E3 337.1005 3.4E4 338.1145 2.9E3 339.1237 2.0E4 349.1072 1.5E4 350.1155 1.4E4 351.0842 2.0E4 351.1234 7.4E4 351.9967 2.4E3 352.1217 2.1E4 353.1406 6.3E3 354.1461 5.0E4 355.1176 4.2E3 365.1007 3.4E4 366.1082 4.6E4 366.1485 3.1E4 367.1177 1.8E5 370.1421 8.8E3 380.1262 2.9E4 381.1330 1.3E5 382.1413 3.6E5 383.1131 4.9E4 385.1649 4.4E4 393.0978 3.2E3 395.0999 1.3E4 395.1493 1.8E5 397.1251 4.5E3 398.1358 5.2E4 399.1422 7.5E3 408.1226 2.9E3 409.1290 1.9E4 410.1361 1.0E5 411.1077 8.1E4 413.1598 2.2E5 423.1441 8.8E3 426.1310 5.1E4 441.1544 9.3E4 454.0001 2.6E3 479.4773 2.8E3 END IONS BEGIN IONS FEATURE_ID=534 PEPMASS=318.1341 SCANS=534 RTINSECONDS=602.513 CHARGE=1+ MSLEVEL=2 MERGED_STATS=11 / 15 (4 removed due to low quality, 0 removed due to low cosine). 49.0249 2.3E3 49.0854 2.6E3 50.6198 2.4E3 51.1843 2.2E3 54.5540 2.2E3 54.5642 2.4E3 55.2696 2.1E4 55.2716 4.9E3 55.6971 2.8E3 58.3470 2.6E3 59.3915 2.8E3 60.1071 2.3E3 61.3810 2.4E3 61.5481 2.8E3 63.5813 2.1E3 64.3996 2.6E3 67.0500 2.5E3 68.3050 2.6E3 69.2304 2.1E3 69.2979 2.6E3 69.5592 2.7E3 71.5748 2.2E3 71.7893 2.4E3 73.0274 2.3E3 73.7964 2.3E3 75.0707 2.5E3 77.0762 2.3E3 79.1940 2.6E3 80.3205 2.1E3 83.1811 2.3E3 84.6304 2.5E3 85.8403 2.4E3 89.6142 2.2E3 89.7127 2.3E3 91.0542 9.0E3 95.0421 2.3E3 96.3975 2.3E3 98.0599 6.0E4 99.1202 2.5E3 99.6186 2.8E3 102.0464 5.3E3 102.9933 2.5E3 103.0541 6.5E3 105.0696 1.3E4 106.8321 2.7E3 107.0495 5.2E3 111.5992 2.3E3 112.4934 2.4E3 113.0263 2.6E3 117.8120 2.3E3 118.0413 1.5E4 118.4471 2.1E3 119.0489 3.4E4 119.4879 2.8E3 120.9664 2.5E3 121.6937 2.3E3 121.7688 2.4E3 122.9342 3.0E3 123.4853 2.5E3 126.1848 2.3E3 128.6980 2.4E3 130.0412 5.1E4 131.0491 1.7E4 131.8754 2.2E3 132.0570 3.8E4 133.0288 2.6E3 133.0646 5.8E4 135.0440 6.1E4 135.0798 2.8E3 135.9261 1.1E4 138.9534 2.2E3 144.0565 2.7E3 146.0350 6.1E3 147.0439 2.6E5 148.0518 2.6E4 149.0593 4.8E4 149.3014 2.4E3 150.0676 3.6E4 158.0344 2.5E3 159.0440 1.4E4 160.0517 7.3E4 160.1781 2.1E3 161.0597 1.2E5 162.0523 6.9E3 162.0675 7.5E5 162.0828 4.2E3 163.0249 2.8E3 163.0389 2.6E5 163.0752 1.3E5 163.9485 2.6E3 165.0915 1.6E4 167.0701 2.1E4 172.0517 2.4E3 173.5248 9.2E3 173.5322 9.6E4 173.5403 8.5E3 174.0313 6.4E4 174.4539 2.3E3 175.0391 2.0E5 176.0469 1.8E5 177.0548 1.4E5 177.2268 2.2E3 178.0460 4.3E3 178.0625 7.1E5 178.0805 3.1E3 178.2322 2.7E3 180.7873 2.6E3 188.0466 6.5E4 188.5958 2.7E3 189.0545 3.3E5 190.0225 3.5E3 190.0337 3.4E3 190.0624 3.7E6 190.0773 1.2E4 191.0139 9.4E3 191.0338 7.8E5 191.0701 2.9E5 191.2175 2.3E3 192.0416 3.5E4 193.0653 1.3E4 193.0859 2.8E6 193.1064 1.5E4 205.0499 2.0E4 206.0246 3.3E3 206.0344 9.9E3 206.0574 1.4E6 206.0801 1.1E4 220.3872 2.5E3 221.0306 3.1E4 221.0809 8.6E6 221.1002 8.0E3 221.1201 1.5E4 221.1319 1.9E4 227.0305 2.6E3 227.1946 2.7E3 244.8707 2.9E3 247.1098 3.2E3 248.2289 2.5E3 256.2666 2.3E3 271.8933 3.1E3 277.7099 2.5E3 END IONS BEGIN IONS FEATURE_ID=535 PEPMASS=221.0811 SCANS=535 RTINSECONDS=602.681 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 8 (2 removed due to low quality, 0 removed due to low cosine). 43.0178 2.7E4 43.5153 2.7E3 49.0350 2.5E3 55.0504 4.9E3 56.8599 2.3E3 57.0695 2.6E3 59.9913 2.1E3 61.7190 2.4E3 62.3450 2.7E3 67.0540 1.2E4 68.9968 2.5E3 69.0696 1.1E4 69.1803 2.1E3 71.0125 5.2E4 72.8767 2.6E3 73.4608 2.4E3 77.0386 2.4E3 78.0462 2.1E4 79.0540 4.8E4 81.0696 1.0E4 85.0435 2.5E3 86.6803 2.1E3 88.5534 2.4E3 89.0376 2.7E3 90.0465 3.6E3 91.0539 6.0E4 92.9712 2.2E3 93.0074 2.5E3 93.0698 8.9E3 95.0490 2.6E4 95.0854 3.7E4 96.4261 2.8E3 102.0461 7.4E4 103.0541 4.2E4 103.3642 2.3E3 104.0618 4.0E4 104.9515 4.6E3 105.0333 7.1E3 105.0698 4.3E4 107.0488 6.9E4 107.0852 1.2E4 107.9700 2.4E3 109.0645 2.4E3 109.1011 2.2E4 113.0594 8.4E4 115.0543 3.6E3 116.0624 4.5E3 118.0411 5.0E4 119.0489 1.3E5 119.0850 7.1E3 120.0572 1.1E4 121.0296 3.0E3 121.0646 3.1E4 121.1010 2.6E3 122.0726 1.0E4 129.5522 2.3E3 130.0412 1.3E5 131.0490 6.7E4 132.0207 2.9E3 132.0567 1.1E5 133.0283 2.6E4 133.0647 4.3E4 134.0361 2.7E3 134.0724 4.2E3 135.0438 1.9E5 137.0595 1.3E4 139.0751 2.4E3 144.0572 3.2E3 145.0281 1.2E4 145.0648 3.6E3 146.0361 2.2E4 146.4111 2.8E3 147.0438 4.6E5 147.1176 6.0E3 148.0518 6.6E4 149.0595 9.4E4 150.0676 4.4E4 157.0396 7.0E3 158.0360 5.6E3 159.0077 9.6E3 159.0441 1.5E4 160.0518 1.2E5 161.0237 1.5E4 161.0598 9.9E4 162.0675 3.2E5 163.0232 6.0E3 163.0389 5.7E5 163.0552 3.3E3 163.0752 5.9E4 163.1117 2.5E3 172.1248 2.4E3 173.0234 3.3E3 173.5231 4.4E3 173.5350 6.2E4 174.0311 3.5E4 174.9846 6.3E3 175.0391 3.0E5 176.0470 7.7E4 177.0547 8.3E4 178.0626 2.9E5 180.7751 2.8E3 187.0408 2.9E3 187.4121 2.3E3 188.0471 4.0E4 189.0542 1.2E4 190.0431 5.5E3 190.0625 3.9E5 190.0809 4.7E3 191.0143 2.7E3 191.0340 1.8E5 191.0704 6.8E3 192.0424 3.1E3 193.0861 1.9E5 203.1803 3.8E3 205.0497 6.3E3 206.0576 9.7E4 221.0813 2.3E4 221.1539 2.8E3 230.5667 2.5E3 END IONS BEGIN IONS FEATURE_ID=536 PEPMASS=657.2422 SCANS=536 RTINSECONDS=603.505 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 2 (0 removed due to low quality, 0 removed due to low cosine). 66.0822 2.2E3 70.3943 2.7E3 73.0243 6.4E3 73.0275 1.5E4 78.9676 2.3E3 120.0416 3.2E4 123.2837 2.5E3 173.2940 2.6E3 173.5271 2.3E4 188.0315 1.0E5 221.0806 8.8E3 269.0896 3.4E4 279.0867 4.3E3 296.0883 3.8E3 297.0847 1.6E5 310.0688 1.1E4 324.0836 4.3E3 325.0919 6.5E4 340.0198 8.5E3 340.1153 1.8E6 352.1161 3.0E3 395.1467 1.5E4 397.1727 3.1E3 437.1679 1.1E4 461.1693 3.8E3 463.1364 1.2E5 463.2105 3.2E3 516.1961 7.3E3 532.1916 1.0E4 559.2032 1.3E4 560.1890 6.7E4 592.1245 2.3E3 641.2083 4.5E3 657.2418 4.6E5 END IONS BEGIN IONS FEATURE_ID=537 PEPMASS=322.1083 SCANS=537 RTINSECONDS=603.786 CHARGE=1+ MSLEVEL=2 MERGED_STATS=1 / 1 (0 removed due to low quality, 0 removed due to low cosine). 57.8927 2.7E3 79.0220 2.4E3 88.0754 2.9E3 103.0541 3.0E3 104.8949 2.3E3 113.2651 2.9E3 131.0490 3.1E4 132.0524 2.2E4 135.0439 3.0E4 136.0472 1.8E4 143.0490 3.5E3 149.0595 7.7E4 149.0735 3.3E3 150.0629 6.2E4 151.5632 2.3E3 161.0596 5.7E4 162.0630 6.5E4 173.0598 2.0E4 173.5294 1.1E4 174.0632 2.2E4 185.0595 4.1E3 186.0627 4.1E3 200.0793 4.2E3 206.1024 3.0E3 223.0990 1.1E4 232.0769 2.6E3 233.0838 1.1E4 234.0969 1.6E4 236.0724 2.8E3 241.5709 2.7E3 249.0544 2.6E4 249.0790 4.9E3 250.0609 4.1E3 250.0867 1.5E4 251.0940 9.9E3 261.0783 1.5E5 262.0872 3.8E4 263.0942 2.7E4 264.0660 2.4E4 264.1095 1.5E4 265.0720 6.9E3 274.0504 7.4E3 276.0679 2.5E3 277.0739 2.9E4 278.0812 6.1E5 279.0891 1.1E5 279.1253 3.0E3 280.0975 1.0E4 289.0734 5.4E4 290.0812 1.5E5 292.0228 5.4E3 292.0605 1.6E5 292.1023 1.3E4 293.0684 6.5E4 294.0758 5.3E3 294.1124 6.7E4 304.0954 3.0E3 306.0762 5.8E5 307.0432 6.1E3 307.0841 3.2E5 322.1075 1.0E6 322.1956 8.5E3 END IONS BEGIN IONS FEATURE_ID=538 PEPMASS=344.0897 SCANS=538 RTINSECONDS=603.786 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 50.1755 2.3E3 53.1991 2.1E3 54.6006 2.0E3 58.6880 2.5E3 59.7580 2.2E3 66.9168 2.1E3 70.0128 2.1E3 70.4130 2.4E3 73.0281 3.1E3 78.0403 2.7E3 78.9812 2.1E3 89.0595 6.2E3 89.4323 2.3E3 101.9023 2.3E3 102.0917 2.9E3 121.0642 3.6E3 126.6119 2.4E3 168.0546 2.9E3 173.5246 1.0E4 173.5332 4.3E4 173.5429 4.7E3 174.7614 2.9E3 179.4126 2.2E3 184.7393 2.6E3 189.1400 2.3E3 190.8225 2.8E3 201.5177 2.6E3 216.8742 2.3E3 226.6540 2.6E3 249.1342 2.3E3 283.0617 3.8E3 297.6001 2.6E3 298.5577 2.4E3 300.0633 1.5E4 328.0584 1.2E5 329.0665 3.4E4 344.0407 8.0E3 344.0893 3.0E5 344.1338 4.3E3 353.1429 2.4E3 END IONS BEGIN IONS FEATURE_ID=539 PEPMASS=235.0967 SCANS=539 RTINSECONDS=604.157 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 6 (0 removed due to low quality, 0 removed due to low cosine). 43.0177 2.6E5 57.0697 4.4E4 64.0509 2.2E3 66.4037 3.1E3 66.9280 2.2E3 73.0281 4.7E4 73.8421 2.4E3 74.0315 1.3E4 74.0658 2.4E3 77.1060 2.1E3 82.6991 2.4E3 83.2346 2.6E3 84.1024 2.2E3 86.8922 2.7E3 88.2441 2.4E3 91.0537 2.3E3 93.3368 2.6E3 94.1228 2.3E3 95.1604 3.0E3 105.0696 4.8E4 110.0361 6.3E3 112.2705 2.3E3 114.4297 2.8E3 118.6412 2.3E3 119.0853 6.4E3 123.0437 1.8E5 127.1042 2.2E3 129.0698 3.2E4 133.0647 2.2E4 137.0964 2.7E3 140.0802 2.8E3 147.0805 2.7E3 148.8951 2.5E3 149.6877 5.5E3 149.7077 3.0E3 151.0751 1.3E5 157.0646 1.3E4 170.0621 2.6E3 173.5188 5.6E3 173.5271 3.5E4 173.5367 5.8E4 173.5451 4.5E3 175.0754 3.4E4 178.7573 2.3E3 179.1068 1.1E4 191.9401 2.3E3 224.1932 2.4E3 233.6104 2.4E3 235.1706 2.5E3 235.2044 6.8E3 240.1218 2.4E3 END IONS BEGIN IONS FEATURE_ID=540 PEPMASS=252.1232 SCANS=540 RTINSECONDS=604.165 CHARGE=1+ MSLEVEL=2 MERGED_STATS=8 / 9 (1 removed due to low quality, 0 removed due to low cosine). 44.6790 2.3E3 45.0334 2.3E3 46.8770 2.3E3 46.9190 2.1E3 48.4233 2.2E3 51.2491 2.2E3 51.6129 4.3E3 52.2811 2.3E3 53.5259 2.0E3 55.0177 2.6E4 56.7203 2.1E3 57.9511 2.7E3 59.2137 2.1E3 60.0442 1.3E5 60.0946 2.3E3 61.7003 2.1E3 62.1615 2.4E3 65.0826 2.4E3 67.2627 2.2E3 67.4504 2.6E3 70.5787 2.2E3 73.0283 5.4E3 76.0451 2.7E3 77.4131 2.3E3 78.6005 2.7E3 79.0542 3.4E3 81.0268 2.4E3 81.0762 2.6E3 84.8195 2.6E3 88.2154 2.4E3 104.9469 2.3E3 105.0697 5.8E5 105.0782 3.1E3 110.0362 9.3E4 111.3769 2.4E3 114.3826 2.5E3 115.0051 2.6E3 116.7414 2.1E3 120.2876 2.3E3 123.0336 5.2E3 123.0439 3.1E6 123.0524 1.4E4 123.0802 4.3E4 128.4812 2.8E3 129.0697 1.9E5 131.0494 6.6E3 131.2776 2.4E3 131.4033 2.3E3 133.0647 4.7E5 134.4084 2.3E3 135.0438 3.2E4 135.1349 2.6E3 147.0803 4.5E4 149.0597 1.4E4 151.0646 1.5E4 151.0752 7.4E6 151.1036 4.0E4 151.6829 2.5E3 157.0647 3.7E5 160.0519 2.9E4 161.1329 3.1E3 170.5922 3.1E3 173.5256 1.9E4 173.5365 6.6E4 175.0496 3.5E3 175.0577 1.1E4 175.0755 8.9E5 175.0933 2.1E4 184.0374 3.4E3 193.0860 1.5E5 196.0607 1.1E5 199.0729 2.6E3 209.0596 1.2E4 224.0927 1.2E4 237.0552 2.8E3 242.9261 2.6E3 END IONS BEGIN IONS FEATURE_ID=541 PEPMASS=257.0785 SCANS=541 RTINSECONDS=604.316 CHARGE=1+ MSLEVEL=2 MERGED_STATS=7 / 7 (0 removed due to low quality, 0 removed due to low cosine). 46.7374 2.4E3 47.1028 2.1E3 47.8609 2.5E3 49.3147 2.4E3 53.6092 2.0E3 55.1173 2.3E3 56.3257 2.3E3 56.5515 2.7E3 56.9112 2.8E3 58.6465 2.3E3 61.1267 2.3E3 62.2545 2.3E3 62.6299 2.2E3 63.1568 2.2E3 63.7080 2.7E3 65.4400 2.5E3 67.5453 2.0E3 73.0280 9.9E3 74.9629 2.3E3 78.5836 2.4E3 84.3362 2.4E3 88.2274 2.3E3 92.3691 2.6E3 101.9817 2.3E3 115.2569 2.3E3 121.1010 2.4E3 122.7333 2.5E3 122.9322 2.9E3 125.1232 2.3E3 132.0837 2.2E3 134.8343 2.2E3 135.3615 2.3E3 136.2451 2.6E3 139.2821 2.3E3 141.8745 2.5E3 142.6911 2.2E3 150.2340 2.4E3 151.4302 2.7E3 154.1213 2.5E3 167.1236 3.1E3 173.5302 8.3E4 173.5433 8.6E3 195.5680 2.4E3 205.8802 9.5E3 229.7865 2.6E3 238.7921 2.4E3 242.6510 2.5E3 253.4232 2.3E3 END IONS BEGIN IONS FEATURE_ID=542 PEPMASS=643.2266 SCANS=542 RTINSECONDS=604.696 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 65.0252 2.6E3 66.5678 2.6E3 69.8385 2.3E3 73.4904 2.1E3 82.4392 2.3E3 94.4738 2.1E3 95.0491 2.5E3 108.4457 2.2E3 119.0336 2.8E4 120.0415 1.8E4 147.0286 1.8E4 173.5243 7.0E3 173.5315 4.2E4 173.5429 4.1E3 215.0677 2.8E3 217.0833 3.1E4 221.0804 2.8E4 229.0462 6.2E3 255.8605 2.5E3 259.1942 2.7E3 275.1009 3.3E3 279.0865 3.5E3 282.1103 2.9E3 297.0908 2.4E3 318.2956 2.4E3 324.0849 1.5E4 325.0917 5.6E4 326.0346 3.4E3 326.0996 2.7E5 340.1150 3.0E5 341.1235 2.9E4 362.3222 2.5E3 401.2767 3.1E3 430.2971 2.7E3 449.1181 2.7E3 457.5725 3.2E3 465.9429 2.7E3 529.7254 2.4E3 563.5421 2.6E3 603.5651 2.6E3 END IONS BEGIN IONS FEATURE_ID=543 PEPMASS=201.0912 SCANS=543 RTINSECONDS=604.909 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 43.2472 2.2E3 49.4013 2.1E3 50.0300 2.4E3 51.1922 2.4E3 55.1201 2.3E3 55.7068 2.4E3 55.9341 1.1E5 56.9346 4.3E4 56.9420 2.6E3 59.1215 2.2E3 60.5174 2.4E3 60.7242 2.4E3 60.9088 2.2E3 66.2700 2.3E3 68.3778 2.4E3 72.9368 2.3E4 73.9372 3.9E3 75.0023 2.6E3 76.9327 2.7E3 78.0568 2.2E3 78.4805 2.2E3 79.3495 2.2E3 86.5817 2.5E3 89.9389 2.5E3 90.9474 3.1E4 91.9479 8.2E3 92.5452 2.2E3 102.9484 3.2E3 107.9499 1.4E4 114.9479 1.2E4 114.9716 6.0E3 115.0541 4.0E4 115.9793 9.2E3 116.0617 2.6E3 116.8582 2.3E3 117.9593 7.0E3 119.0860 2.6E3 123.5697 2.2E3 128.0620 2.2E4 128.9507 2.5E4 129.0696 7.7E4 129.9524 2.4E4 130.0776 1.1E5 131.0853 3.9E3 131.9740 5.3E4 132.3290 2.5E3 132.9584 2.8E3 135.9450 1.1E4 136.9449 3.1E3 140.0619 4.6E4 141.0697 2.4E4 143.0491 2.0E4 145.1005 3.8E3 147.9635 2.4E3 149.6702 3.5E3 149.6893 9.7E3 149.9850 9.0E3 155.9746 3.2E3 156.0569 2.0E4 157.0433 3.3E3 157.0647 5.8E5 158.0610 2.8E3 158.0726 3.7E5 159.1176 2.5E3 168.0559 3.3E3 171.0444 1.2E4 173.5314 3.9E4 174.8613 2.7E3 185.0598 5.5E4 186.0677 1.1E5 201.0914 1.4E5 201.1104 4.2E3 END IONS BEGIN IONS FEATURE_ID=544 PEPMASS=231.1018 SCANS=544 RTINSECONDS=604.909 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 43.9363 2.5E3 44.2961 2.2E3 45.1480 2.3E3 47.1645 2.3E3 53.4535 2.3E3 53.5275 2.2E3 55.0176 1.2E4 59.9899 2.5E3 67.4150 2.1E3 72.6941 2.2E3 86.1037 2.2E3 86.5946 2.2E3 91.0803 2.4E3 111.5048 2.5E3 128.0619 1.2E4 129.0695 3.5E4 129.0787 2.5E3 130.0771 4.5E3 141.0696 9.0E3 142.0773 6.3E3 143.0851 1.8E4 145.0644 2.8E4 151.7653 2.1E3 156.0571 1.3E4 157.0645 7.8E4 158.0724 5.7E4 159.0802 2.0E4 170.0724 2.3E4 171.0804 1.7E4 172.0882 1.2E5 173.0596 1.3E5 173.5258 6.5E3 173.5368 2.6E4 175.0759 3.0E3 185.0598 3.7E3 186.0674 3.0E4 187.0752 4.7E4 188.0830 1.2E5 189.0906 1.7E4 194.6114 2.3E3 198.0689 2.4E3 200.0826 3.8E3 201.0553 1.1E4 201.0910 8.3E4 203.1065 2.2E4 216.0788 1.9E4 216.2197 2.6E3 216.4366 2.1E3 229.6114 2.3E3 231.1020 1.4E4 240.0811 2.2E3 END IONS BEGIN IONS FEATURE_ID=545 PEPMASS=597.2213 SCANS=545 RTINSECONDS=604.909 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 67.4399 2.1E3 69.2834 2.4E3 70.4552 2.2E3 70.7399 2.4E3 80.2378 2.3E3 82.4149 2.7E3 85.1307 2.5E3 91.8269 2.3E3 96.9382 2.4E3 99.0699 2.2E3 105.1746 2.2E3 106.4459 2.3E3 120.0420 2.5E3 135.3561 2.9E3 149.6781 2.6E3 149.6884 5.8E3 149.7088 3.7E3 159.9151 2.4E3 173.5239 1.8E4 173.5395 2.5E4 184.6228 2.5E3 193.7400 2.8E3 219.6734 2.7E3 230.1158 2.3E3 233.7334 2.3E3 236.8440 2.4E3 264.3713 2.4E3 269.0893 3.1E4 280.0948 1.3E5 297.0849 1.3E5 318.2243 2.5E3 340.1157 1.3E5 363.8860 2.7E3 398.0560 2.5E3 426.1292 7.7E3 456.1753 3.1E3 472.1733 2.3E4 500.1712 8.3E3 539.2056 2.5E3 597.2212 3.0E4 END IONS BEGIN IONS FEATURE_ID=546 PEPMASS=741.2907 SCANS=546 RTINSECONDS=604.909 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 70.2539 2.7E3 71.0492 2.6E3 71.2864 2.4E3 73.1898 2.5E3 77.0388 3.4E3 79.0541 1.0E4 81.0333 2.5E4 85.3184 2.1E3 87.6720 2.2E3 91.0541 7.2E3 92.7060 2.2E3 92.7846 2.3E3 95.0492 1.5E4 96.1125 2.1E3 96.1510 2.3E3 102.6226 2.5E3 103.0541 1.3E4 107.0490 1.7E4 108.2852 3.0E3 109.9822 2.4E3 111.0437 3.2E3 115.0542 6.6E4 117.0700 1.5E4 119.9066 2.3E3 121.0648 8.2E3 123.0440 7.8E3 124.0520 3.2E3 128.0623 9.4E3 129.0699 4.0E4 131.0490 3.9E4 131.7847 2.8E3 133.0279 6.2E3 135.0314 3.5E3 135.0439 1.4E6 136.0517 4.1E4 137.0592 2.8E3 139.0752 2.9E4 143.0490 1.5E5 143.0867 3.1E3 143.0999 2.9E3 145.0646 2.2E5 146.0718 3.9E3 147.0439 1.6E4 148.7585 2.5E3 149.0233 2.0E4 149.0596 2.9E4 151.0096 3.1E3 151.0387 5.0E4 151.0647 4.3E3 151.0753 5.7E5 151.0891 4.2E3 155.0609 3.2E3 157.0647 6.8E4 158.0725 2.4E4 159.0441 5.5E4 159.0802 3.5E3 161.0459 3.0E3 161.0596 9.2E4 163.0384 3.1E3 163.0764 3.0E3 165.0549 1.3E4 165.0906 1.4E4 167.0702 4.2E4 171.0810 9.4E3 172.0883 3.5E4 173.0597 1.5E6 173.0948 4.2E3 173.5331 3.2E4 173.5415 6.6E3 174.0676 1.8E5 175.0393 1.4E4 175.0753 5.0E4 177.0549 1.4E4 177.0911 8.1E4 179.0705 1.2E4 181.0663 3.0E3 181.0843 5.1E3 185.0455 3.1E3 185.0598 5.0E5 185.0785 3.4E3 186.0676 1.2E4 187.0754 1.2E5 188.0832 7.9E4 189.0710 9.0E3 189.0911 7.9E5 191.0712 7.8E3 191.1067 1.4E4 193.0862 1.2E4 197.0596 4.3E3 199.0752 2.7E4 201.0692 1.0E4 201.0911 4.9E5 201.1131 1.0E4 203.0704 1.0E5 203.1068 1.7E5 205.0877 2.5E3 209.0598 4.1E3 211.0758 3.0E3 213.0909 1.3E4 215.0704 5.9E4 216.0783 1.3E4 219.0804 3.7E3 219.1021 2.5E4 223.0753 2.7E3 224.0084 2.7E3 225.0936 2.6E3 231.0764 1.1E4 231.1018 1.8E5 233.0808 3.2E4 234.1052 2.5E3 237.0548 3.2E3 239.0710 9.7E3 245.0966 1.1E4 246.1041 1.3E4 247.0761 6.9E3 249.1143 3.1E3 251.1057 3.3E3 252.0781 1.0E5 253.0503 6.8E3 253.0861 1.4E4 260.0836 5.8E3 261.0909 4.3E4 262.0985 2.3E4 265.1228 1.4E4 267.0650 3.1E4 267.1385 2.6E3 268.0732 6.9E4 273.0910 2.6E4 274.0990 4.8E4 275.0719 7.3E3 275.1064 6.9E3 277.0878 1.0E4 277.1226 4.5E4 278.0942 1.1E4 280.0734 2.9E3 282.0891 1.6E5 283.0970 1.5E5 288.0784 9.9E3 289.0863 3.5E4 290.0941 2.5E4 291.1020 1.6E4 292.1097 5.7E4 293.0838 4.3E3 293.1173 3.5E4 295.0965 5.8E4 295.1323 5.1E3 303.1021 5.7E4 304.1098 2.3E5 304.1495 5.5E3 305.0808 2.5E4 305.1179 1.0E5 308.1049 9.0E4 309.1138 1.3E4 320.1046 1.2E5 321.8253 2.7E3 322.1205 7.8E3 323.1282 1.3E5 325.1435 7.3E3 335.1279 1.9E5 335.1732 7.8E3 353.1379 2.3E4 491.9146 2.4E3 591.7997 2.5E3 622.7922 2.6E3 END IONS BEGIN IONS FEATURE_ID=547 PEPMASS=282.0891 SCANS=547 RTINSECONDS=605.092 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 48.4799 2.3E3 51.9759 2.3E3 54.9257 2.1E3 57.0696 4.8E3 60.8527 2.6E3 64.4317 2.3E3 68.9695 2.3E3 69.0695 6.4E3 69.4250 2.4E3 70.9517 2.3E3 72.1451 2.1E3 83.0855 5.8E3 88.5463 2.3E3 97.1012 2.1E3 101.2062 2.5E3 128.1067 2.4E3 132.0132 2.8E3 132.6491 2.6E3 134.0960 3.6E4 149.6809 4.1E3 149.6913 4.4E3 153.0697 3.8E4 155.0849 2.8E3 171.6535 2.4E3 173.5288 2.5E4 181.0646 1.1E5 197.0603 7.3E3 207.8872 1.2E4 209.0598 9.6E4 211.0754 1.5E5 211.1361 5.5E3 221.0597 5.3E4 222.0680 5.6E3 224.0468 1.1E4 225.0553 1.3E4 235.8853 2.5E3 237.0557 4.4E3 238.0623 6.3E4 239.0702 6.5E5 239.0976 5.8E3 249.0544 9.7E3 267.0319 7.6E3 267.0650 2.6E5 282.0888 1.8E5 282.2216 9.5E4 END IONS BEGIN IONS FEATURE_ID=548 PEPMASS=323.1281 SCANS=548 RTINSECONDS=605.092 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 55.2431 2.4E3 60.0460 2.3E3 63.2548 2.4E3 64.8662 2.7E3 71.6075 2.4E3 77.2159 2.2E3 78.7251 2.5E3 79.0537 1.3E4 80.6902 2.2E3 86.6844 2.5E3 89.1894 2.2E3 95.0486 8.9E3 96.5484 2.4E3 97.8162 2.4E3 105.0333 2.8E3 107.0488 3.7E3 111.3217 2.3E3 118.5415 2.4E3 118.8570 2.7E3 130.3574 2.3E3 133.6820 2.5E3 135.0437 5.1E5 135.0534 6.5E3 136.0515 5.7E4 138.7821 2.7E3 147.0438 1.4E4 151.0750 1.2E5 158.0724 3.6E3 159.0521 2.5E3 167.7924 2.3E3 173.5280 2.3E4 173.5375 1.7E4 173.5455 5.1E3 185.0597 3.2E4 186.0679 5.4E3 188.7027 2.5E3 201.0907 5.8E4 218.0724 3.4E3 219.0790 6.6E3 222.1531 2.3E3 224.5349 2.5E3 231.0804 5.5E3 233.0961 4.1E4 234.1037 4.0E4 235.0753 9.3E3 239.6478 2.7E3 247.0752 1.4E4 247.7713 2.7E3 248.0841 4.0E3 249.0912 5.4E3 249.7983 2.4E3 250.0991 1.3E4 261.0907 7.2E4 262.0984 6.4E4 263.0702 9.8E3 263.1059 7.4E3 264.1135 2.6E3 265.0905 4.7E3 265.1221 6.4E4 267.0655 1.7E4 274.0983 6.7E3 276.0783 9.2E3 276.8560 6.0E3 277.0861 2.9E4 278.0936 3.1E4 280.0732 9.4E3 282.0886 1.3E4 290.0948 3.0E3 291.1017 2.2E4 292.1096 1.7E5 292.1460 7.2E3 293.0809 4.0E4 293.1175 4.4E4 295.0969 4.8E4 308.1046 1.1E5 323.1280 2.7E4 END IONS BEGIN IONS FEATURE_ID=549 PEPMASS=335.1281 SCANS=549 RTINSECONDS=605.257 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 6 (3 removed due to low quality, 0 removed due to low cosine). 50.0860 2.5E3 51.1231 2.2E3 52.9210 2.1E3 53.7308 2.3E3 58.1180 2.1E3 58.2879 2.7E3 60.1467 2.2E3 63.1227 2.6E3 66.5441 2.7E3 67.0969 2.5E3 68.3873 2.1E3 68.6087 2.9E3 69.1587 2.2E3 70.8388 2.7E3 75.0438 3.7E4 75.2592 2.4E3 78.5580 2.2E3 83.0052 2.5E3 91.0542 3.6E3 96.6306 2.2E3 98.0144 2.2E3 105.6439 2.2E3 119.6056 2.1E3 122.9611 2.5E3 123.5877 2.5E3 131.3128 2.5E3 135.0436 1.4E4 147.0438 2.5E4 151.0752 1.3E4 152.9813 2.8E3 158.5887 2.4E3 161.0580 5.5E3 173.5274 3.4E4 173.5392 2.9E4 185.0594 1.1E4 191.1062 2.2E4 199.0751 9.8E4 202.0787 2.3E4 203.0855 1.9E4 204.8959 2.7E3 212.8648 5.8E3 213.0906 2.0E4 215.0852 2.9E4 215.1066 3.6E3 217.1010 3.0E4 219.0805 2.1E4 230.0721 2.6E4 230.8740 2.1E4 231.0800 6.0E4 232.0881 1.9E4 233.0962 3.1E4 234.1036 2.5E4 235.0742 2.9E3 239.0700 7.8E3 242.0740 3.2E3 243.0801 2.5E4 244.0875 1.7E4 245.0957 1.2E5 246.1035 2.0E5 247.0750 8.1E4 247.1110 2.6E4 248.0826 5.5E3 248.1184 9.0E3 249.0905 1.8E4 251.1062 4.0E4 257.0955 6.0E3 258.0676 2.5E4 259.0750 7.1E4 259.1081 4.3E3 260.0826 7.9E4 261.0905 1.6E5 262.0668 3.9E3 262.0983 1.7E5 263.0711 1.6E4 263.1050 8.0E3 264.4411 2.6E3 267.0646 4.0E4 271.0764 9.8E3 272.0834 6.1E4 273.0568 8.9E3 273.0908 3.2E5 274.0987 2.8E5 275.0701 8.8E4 275.1060 4.3E4 276.0780 3.6E4 276.1148 2.8E4 277.0862 9.3E4 277.1222 2.6E5 279.0662 4.5E3 279.1026 1.5E4 279.1375 2.1E4 280.0742 2.9E3 282.0887 6.7E4 287.0699 2.1E4 288.0780 1.6E5 289.0469 3.1E3 289.0859 6.5E5 289.1173 1.1E4 290.0584 7.5E3 290.0936 1.7E5 291.0646 2.6E4 291.1013 2.3E4 291.6312 2.4E3 292.0729 1.9E4 292.1089 2.0E4 302.0944 1.7E4 303.0434 3.5E3 303.1015 7.0E5 303.1314 3.5E3 303.1433 3.8E3 304.1094 1.2E6 304.6696 2.7E3 305.0804 3.4E5 305.1177 2.2E5 306.0886 1.1E5 307.0964 7.0E4 307.1331 8.4E3 319.0964 1.2E5 320.0610 5.0E3 320.1041 3.1E5 320.1367 2.1E3 335.1276 2.3E5 345.7503 2.6E3 END IONS BEGIN IONS FEATURE_ID=550 PEPMASS=353.1387 SCANS=550 RTINSECONDS=605.288 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 14 (11 removed due to low quality, 0 removed due to low cosine). 51.0235 2.5E4 53.0387 1.1E4 53.2316 1.3E4 53.9766 1.7E4 55.0179 2.8E4 57.4447 8.9E3 59.0708 1.3E4 64.6072 8.8E3 65.0386 2.6E4 71.0491 6.4E5 73.8480 8.8E3 75.0440 1.1E5 77.0387 6.9E4 79.0542 2.8E5 91.0542 1.7E5 93.0336 8.7E4 95.0491 1.4E5 96.4787 8.9E3 97.3009 9.7E3 100.9398 1.6E4 103.0540 3.2E4 105.0336 8.3E4 105.0447 4.6E4 107.0492 2.2E5 111.0441 7.3E4 115.0547 1.3E5 115.1400 1.1E4 117.0697 1.0E5 119.0491 1.5E5 121.0647 1.2E5 123.0440 1.7E5 123.0807 1.2E4 124.0520 1.2E4 128.0622 6.5E4 129.0698 4.1E5 131.0490 1.9E5 131.0850 1.1E4 133.0284 2.8E5 133.0647 1.4E4 135.0440 1.6E7 135.0668 1.1E5 135.0755 1.0E4 135.0812 1.1E4 135.7093 1.4E4 136.0518 8.7E5 136.9529 1.4E4 137.0598 1.0E5 137.6118 1.6E4 138.0675 2.2E4 139.0754 2.2E5 141.0697 1.7E4 143.0491 2.1E5 143.0855 1.2E5 143.1938 9.3E3 145.0649 2.2E5 146.0731 7.2E4 147.0440 4.7E5 147.0805 1.2E4 148.0521 9.6E4 149.0233 2.9E5 149.0457 1.4E4 149.0596 1.0E6 149.0710 9.2E3 150.0677 7.5E4 151.0388 3.0E5 151.0753 5.8E6 152.0826 1.2E4 153.0693 1.1E4 156.0570 2.0E4 157.0648 8.2E5 157.0767 6.4E3 158.0726 3.3E5 159.0441 1.6E5 159.0802 1.2E5 160.0880 6.3E4 161.0597 3.3E5 162.0672 4.5E4 163.0390 2.0E5 163.0754 2.0E5 165.0547 2.4E5 165.0686 1.4E4 165.0911 4.2E5 167.0490 2.2E4 167.0699 1.5E4 170.0726 6.1E4 171.0805 2.2E5 172.0521 5.4E4 172.0884 1.0E6 173.0598 2.5E6 173.0958 8.1E4 173.5286 1.6E5 173.5442 1.9E4 174.0676 4.2E5 175.0391 6.6E5 175.0755 5.0E5 176.0834 1.0E4 177.0549 2.9E5 177.0912 3.7E5 179.0704 8.4E5 181.0652 7.3E4 182.0734 1.6E4 183.0808 6.7E4 185.0426 3.6E4 185.0598 9.0E5 186.0676 2.4E5 186.5006 8.5E3 187.0579 1.7E4 187.0754 7.8E5 188.0832 2.7E6 188.0984 1.3E4 189.0549 8.5E4 189.0765 2.2E4 189.0911 1.0E6 190.0643 9.8E3 190.0989 2.6E5 191.0703 4.3E5 191.1066 1.6E5 193.0860 3.1E5 197.0598 1.7E5 198.0676 3.4E4 199.0755 4.4E5 200.0832 8.7E4 201.0563 4.5E4 201.0911 8.3E6 201.1351 2.5E4 202.0787 8.0E4 202.0983 5.7E4 203.0880 1.1E5 203.1068 3.1E6 205.0857 1.5E5 209.0599 2.1E5 211.0755 1.1E5 211.0972 9.4E3 213.0706 3.4E4 213.0911 8.5E5 213.1144 1.3E4 215.0701 3.1E5 215.0897 4.9E4 216.0785 2.3E5 217.1017 9.7E4 218.0731 7.8E4 219.0805 1.9E5 220.0875 2.1E4 221.0598 7.5E4 221.0965 4.9E4 222.0690 2.1E4 223.0758 1.9E5 224.0837 6.7E4 225.0545 9.2E4 225.0912 8.3E5 230.0731 7.8E4 231.0802 2.3E5 231.1018 3.0E6 231.1226 1.8E4 232.0890 7.8E4 233.0961 5.9E5 234.1039 3.1E5 235.0749 9.9E4 235.1123 8.8E4 236.0477 8.7E3 236.0838 2.3E4 236.1192 3.7E4 237.0546 2.0E5 237.0914 3.5E4 238.0621 8.8E4 238.0986 7.1E4 239.0703 9.7E5 239.1061 3.6E4 240.0775 3.4E4 242.0733 3.1E4 243.0801 1.2E5 244.0881 1.1E5 245.0664 1.2E4 245.0960 6.8E5 246.0724 4.8E4 246.1038 1.2E6 246.1286 9.9E3 247.0752 5.8E5 247.1107 1.1E5 248.0832 1.8E5 249.0910 2.1E5 250.0617 1.1E4 250.0988 1.5E5 251.0704 1.9E5 251.1065 2.9E5 252.0780 5.5E6 252.1017 9.9E4 253.0497 7.0E5 253.0858 8.6E5 255.1020 1.0E5 258.0673 1.3E5 259.0754 3.0E5 260.0829 4.6E5 261.0584 4.1E4 261.0908 1.9E6 261.1230 1.5E4 262.0696 2.6E4 262.0986 1.9E6 262.1230 2.5E4 262.1316 4.0E4 263.0701 2.5E5 263.1062 1.7E5 264.0808 5.6E4 264.1144 1.8E5 265.0860 2.0E5 265.1220 8.8E5 266.0934 1.1E5 267.0317 5.9E4 267.0651 2.6E6 267.0946 5.0E4 267.1370 2.1E5 268.0729 4.2E6 269.0809 3.6E4 271.0749 3.6E4 272.0832 2.0E5 273.0569 1.7E4 273.0910 1.3E6 274.0989 2.0E6 275.0704 4.5E5 275.1067 3.2E5 276.0781 2.6E5 276.1148 1.1E5 277.0865 8.2E5 277.1224 2.7E6 277.1583 6.4E4 278.0598 1.9E4 278.0939 7.5E5 279.0662 8.5E4 279.1015 3.1E5 279.1360 3.8E4 280.0734 2.8E5 280.1087 9.0E4 281.0814 6.7E4 281.1154 1.1E4 282.0887 8.4E6 283.0602 2.0E4 283.0967 3.5E6 287.0696 5.4E4 287.1045 1.3E4 288.0243 9.9E3 288.0781 6.0E5 289.0861 3.5E6 290.0596 4.5E4 290.0938 1.6E6 290.1225 1.7E4 291.0666 6.1E4 291.1018 6.8E5 292.0765 7.8E4 292.1094 1.8E6 292.1481 1.2E4 293.0808 5.6E5 293.1175 1.3E6 294.0887 1.6E5 294.1253 9.6E4 295.0572 6.6E4 295.0966 3.0E6 295.1315 1.8E5 295.1667 1.0E4 296.1047 2.2E5 297.1118 5.9E4 302.0943 6.8E4 303.0622 3.8E4 303.1016 2.6E6 304.1095 6.5E6 305.0804 1.8E6 305.1176 3.4E6 305.1596 9.6E3 306.0887 2.5E5 307.0965 3.9E5 307.1322 4.1E4 308.1045 3.2E6 309.1123 7.5E5 310.1200 7.5E4 319.0965 4.2E5 320.0609 3.5E4 320.1043 2.5E6 321.1118 5.1E4 322.1199 2.9E5 323.0610 1.0E4 323.0937 1.4E4 323.1279 1.3E6 324.1362 1.4E4 325.1435 1.0E5 335.1276 1.6E6 335.1632 8.9E3 338.1155 7.5E4 353.1381 1.1E5 END IONS BEGIN IONS FEATURE_ID=551 PEPMASS=370.1413 SCANS=551 RTINSECONDS=605.959 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 6 (1 removed due to low quality, 0 removed due to low cosine). 54.2409 2.3E3 55.0176 7.5E3 59.4156 2.2E3 61.1380 2.7E3 63.2638 2.8E3 64.9870 2.2E3 65.5564 2.5E3 66.8096 2.9E3 67.0539 5.7E3 73.3100 3.0E3 79.0540 7.2E3 81.0696 6.5E3 81.9193 2.2E3 82.1300 2.8E3 82.5278 2.6E3 86.8409 2.3E3 91.0541 1.1E4 93.0695 7.6E3 95.0492 3.4E3 96.3862 2.2E3 101.8567 2.4E3 103.0538 2.3E4 104.4261 2.3E3 106.0413 2.7E3 107.0490 1.6E4 109.0646 4.2E4 109.1008 2.6E3 110.4167 2.1E3 110.9871 2.2E3 117.0696 2.2E4 117.9870 2.9E3 119.0494 4.8E3 119.5339 2.1E3 119.8427 2.5E3 121.0646 1.8E5 121.8855 2.1E3 122.0359 2.4E4 122.0725 5.5E3 122.2622 2.6E3 127.3477 2.2E3 128.2834 2.3E3 131.0488 1.5E5 134.0792 2.3E3 135.0304 1.2E4 135.0439 1.2E6 135.0532 3.9E3 135.0613 2.9E3 136.0508 8.5E4 137.0596 1.6E5 138.0671 4.0E4 139.0749 8.7E3 143.0489 8.9E3 145.0644 2.4E4 146.0724 6.5E4 147.0443 4.0E3 147.0801 4.9E4 148.0516 8.0E4 149.0230 1.8E5 149.0595 4.7E4 149.0967 2.7E3 149.6818 3.1E3 149.6919 5.7E3 150.0671 1.5E4 150.3847 2.3E3 151.0384 9.7E3 151.0604 2.3E3 151.0647 3.0E3 151.0752 7.0E5 151.0872 2.6E3 152.0829 2.5E5 152.0970 4.4E3 157.0647 2.9E3 159.0447 2.9E3 160.0518 2.7E4 161.0597 9.7E4 162.0676 1.4E4 163.0402 2.6E3 163.0754 5.3E4 164.0830 6.7E4 165.0545 1.7E5 165.0698 2.7E3 165.0909 1.5E4 166.0617 3.4E3 166.0991 9.6E3 167.0703 3.3E3 173.0597 7.5E4 173.5272 4.4E4 173.5429 1.4E4 174.0677 8.0E3 175.0757 2.2E4 176.0453 2.6E3 176.0835 6.2E4 177.0547 6.8E3 177.0734 1.0E4 177.0911 3.8E5 178.0617 6.3E3 178.0988 7.0E4 186.0675 1.1E4 187.0754 2.3E4 188.0826 3.2E3 189.0545 9.4E3 189.0910 9.3E4 191.0704 1.0E4 191.1051 3.3E3 192.0415 4.8E4 194.0937 3.9E3 201.0545 2.6E4 201.9956 2.2E3 203.0703 1.6E4 203.1068 3.3E4 205.0505 7.4E3 205.0858 5.9E3 206.0573 1.2E4 211.1425 2.5E3 217.0859 4.2E4 219.0647 6.0E3 219.1021 3.6E3 232.0721 3.4E3 235.0958 3.3E3 271.0962 3.8E4 321.1115 5.3E3 338.2482 2.6E3 339.1232 4.6E3 339.6053 2.7E3 346.6095 2.6E3 346.9544 3.1E3 END IONS BEGIN IONS FEATURE_ID=552 PEPMASS=371.1489 SCANS=552 RTINSECONDS=606.229 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 8 (4 removed due to low quality, 0 removed due to low cosine). 54.7277 2.6E3 55.0180 5.9E3 55.0544 5.8E3 56.7640 2.4E3 57.0700 2.9E3 60.7781 7.3E3 63.0240 5.1E3 65.0387 3.1E3 67.0541 1.1E4 68.7726 2.1E3 71.0491 2.3E4 75.0443 1.2E4 77.0390 3.5E4 79.0542 8.4E4 81.0699 6.0E3 81.7127 2.9E3 82.0733 2.9E3 84.4878 2.4E3 91.0541 4.5E4 92.5953 2.7E3 93.0335 4.4E3 93.0696 4.0E3 94.0727 2.7E3 95.0490 5.3E4 95.0856 5.3E3 96.0891 2.4E3 101.0595 1.7E4 103.0544 2.3E4 104.0574 4.2E3 105.0336 2.7E4 105.0448 1.5E4 107.0492 3.8E4 108.0573 3.2E3 111.0440 2.4E4 115.0549 7.1E3 117.0697 4.2E4 119.0491 2.2E4 121.0647 3.7E5 121.0747 9.3E3 122.0355 3.8E3 123.0439 1.9E4 124.2316 5.0E3 125.0594 7.3E3 128.0621 3.8E3 129.0542 6.4E3 129.0698 1.9E4 131.0491 1.5E5 132.0526 2.4E4 133.0286 9.1E3 133.0647 1.9E4 135.0128 1.8E4 135.0197 4.7E4 135.0250 3.4E4 135.0440 1.1E7 135.0540 2.6E4 135.0634 3.6E4 135.0682 1.2E5 135.0814 9.1E3 136.0501 9.5E4 137.0596 3.1E4 138.0658 9.9E3 139.0751 3.4E4 143.0491 1.1E4 143.0861 3.9E3 145.0648 2.3E5 146.0725 2.2E5 147.0439 1.8E5 147.0804 1.2E5 148.0518 1.7E4 149.0234 7.1E4 149.0457 9.4E3 149.0596 5.0E5 149.0955 1.8E4 149.6815 4.7E3 149.6926 5.7E3 150.0269 2.6E4 150.0647 1.0E4 151.0390 2.5E4 151.0605 3.5E3 151.0627 7.5E3 151.0754 1.5E6 151.0877 3.2E3 152.0793 6.0E4 153.0873 1.1E4 156.0571 2.5E3 157.0647 6.0E4 158.0727 1.6E4 159.0442 3.8E4 159.0805 4.0E4 160.0522 3.0E3 160.0884 5.1E3 161.0597 1.4E5 162.0674 1.2E5 163.0389 2.2E5 163.0754 1.3E4 164.0823 8.5E3 164.2378 2.8E3 165.0549 8.8E4 165.0905 7.8E4 166.0585 2.4E4 166.0994 2.9E3 167.0698 4.1E3 171.0807 1.1E4 172.0886 6.1E4 173.0599 1.9E5 173.0952 4.7E3 173.5261 2.7E4 173.5399 3.4E4 174.0675 4.5E4 175.0392 4.4E5 175.0757 5.1E4 176.0467 1.1E4 176.0822 1.9E4 177.0546 4.4E4 177.0911 1.4E6 177.1097 3.0E3 178.0951 4.5E4 179.0705 1.0E5 179.1032 2.4E3 183.0810 3.7E3 185.0599 8.3E4 186.0683 6.1E3 187.0752 8.5E4 188.0835 1.8E5 189.0548 2.7E4 189.0762 2.9E3 189.0912 3.3E5 190.0628 1.2E4 190.0977 2.3E4 191.0705 2.3E4 191.1066 9.6E3 193.0862 3.7E4 197.0598 1.9E4 198.0684 3.4E3 199.0756 2.0E5 200.0838 4.2E3 201.0567 1.3E4 201.0913 6.4E5 202.0588 5.6E3 202.0793 3.8E3 202.0989 4.3E3 203.0879 1.0E4 203.1070 3.4E5 204.0750 3.3E3 204.1111 3.6E3 205.0862 1.2E5 206.0909 2.8E3 209.0605 2.5E3 213.0532 5.7E3 213.0914 6.7E4 215.0704 7.8E4 215.0897 3.7E3 216.0778 6.4E3 217.0857 4.8E4 218.0935 2.7E4 219.0798 5.3E3 219.1032 5.0E3 220.0896 9.4E3 223.0735 2.3E3 224.0837 3.4E3 225.0547 3.7E3 225.0916 3.4E4 230.0710 3.4E3 231.0805 2.7E4 231.1021 2.7E5 231.4897 2.4E3 232.0884 1.3E4 233.0965 2.5E4 234.1046 1.6E4 235.0754 3.7E3 235.1117 1.6E5 237.0541 3.8E3 238.0613 2.5E3 238.0997 3.3E3 239.0708 1.5E4 239.1061 3.8E3 244.0885 3.5E3 245.0961 1.2E5 246.1040 1.2E5 246.1307 4.6E3 247.0764 2.7E4 247.1110 5.6E3 248.0837 2.5E4 249.0914 6.4E3 250.0998 7.8E3 250.6525 4.8E3 251.0709 4.8E3 251.1067 1.7E4 252.0784 1.1E5 253.0501 1.2E4 253.0862 4.2E4 255.1014 4.5E3 258.0668 5.6E3 259.0752 1.1E4 260.0827 2.8E4 261.0587 3.2E3 261.0914 1.4E5 262.0670 5.1E3 262.0989 1.6E5 263.0706 9.9E3 263.1068 1.5E5 264.1139 1.1E4 265.0889 7.1E3 265.1227 6.6E4 265.1515 4.4E3 266.0939 8.3E3 267.0656 3.2E4 267.1382 7.1E3 268.0735 1.4E5 271.0764 5.1E3 271.1011 3.3E3 272.0836 1.1E5 272.1045 2.9E3 273.0914 2.1E5 273.1212 2.1E3 274.0993 1.9E5 274.1331 5.0E3 275.0705 2.7E4 275.1074 3.1E4 276.0792 8.7E3 276.1131 5.7E3 277.0869 3.5E4 277.1225 3.1E5 277.1590 3.8E3 278.0945 6.1E4 279.1018 3.2E4 279.5240 5.3E3 280.0755 5.8E3 280.1075 4.6E3 280.8148 4.9E3 281.0829 2.8E3 282.0604 2.6E3 282.0893 2.5E5 283.0595 3.7E3 283.0972 2.0E5 288.0787 1.2E5 289.0862 1.7E5 290.0577 4.0E3 290.0943 1.5E5 290.1276 2.5E3 291.1009 6.4E4 292.0724 4.9E3 292.1100 1.2E5 293.0821 3.6E4 293.1180 2.3E5 294.0894 5.7E3 294.1232 5.0E3 294.6905 2.6E3 295.0973 1.1E5 295.1333 1.2E4 296.1045 1.1E4 297.1136 5.2E3 302.0951 9.6E3 303.0621 1.2E4 303.1021 7.3E5 304.1100 4.7E5 305.0810 6.7E4 305.1179 3.6E5 306.0894 1.8E4 307.0969 1.7E4 308.0735 2.5E3 308.1050 1.9E5 309.1130 4.6E4 310.1205 8.5E3 319.0969 2.4E4 320.1049 1.6E5 321.1123 2.7E4 322.1199 1.9E4 323.1284 1.5E5 323.1724 4.8E3 325.1441 6.5E3 333.1139 5.2E3 335.1283 2.4E5 338.1125 3.1E3 353.1364 5.4E3 END IONS BEGIN IONS FEATURE_ID=553 PEPMASS=393.1314 SCANS=553 RTINSECONDS=606.325 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 5 (3 removed due to low quality, 0 removed due to low cosine). 77.8638 2.2E3 87.7853 2.8E3 91.1219 2.9E3 99.2615 2.4E3 138.2042 2.8E3 149.0235 2.9E3 150.0265 3.6E3 157.1986 3.1E3 168.1738 2.5E3 172.1904 2.6E3 173.5205 5.1E3 173.5382 2.9E4 185.1178 2.5E3 243.4988 2.3E3 255.1290 2.7E3 255.5178 2.5E3 393.1312 4.1E4 END IONS BEGIN IONS FEATURE_ID=554 PEPMASS=388.1761 SCANS=554 RTINSECONDS=606.897 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 8 (6 removed due to low quality, 0 removed due to low cosine). 56.0854 2.5E3 56.4513 3.1E3 59.2955 2.4E3 61.4338 3.1E3 72.8367 2.6E3 75.0439 1.3E4 77.0392 1.3E4 79.0543 1.8E4 91.0541 1.3E4 95.0491 1.6E4 98.1794 3.0E3 104.6613 2.5E3 105.0338 4.0E3 107.0490 6.6E3 107.9839 2.6E3 117.0698 1.6E4 121.0647 3.4E5 125.0598 8.5E3 126.5632 2.7E3 131.0491 5.1E4 133.0649 4.4E3 135.0127 1.7E4 135.0210 6.8E4 135.0247 2.1E4 135.0440 8.2E6 135.0633 3.5E4 135.0672 8.0E4 135.0753 2.2E4 135.0816 7.7E3 136.0519 2.8E4 137.0594 4.1E3 139.0753 1.6E4 139.7554 2.0E3 139.7578 2.0E3 145.0647 1.9E5 146.0726 8.5E4 147.0440 6.2E4 147.0804 1.2E5 149.0238 2.8E3 149.0596 6.5E5 149.0960 1.0E4 151.0646 7.1E3 151.0753 1.1E6 153.0914 4.7E3 157.0648 1.4E4 159.0441 2.5E4 159.0804 1.5E4 160.0517 6.3E3 161.0597 1.3E5 162.0676 5.7E4 163.0390 2.8E5 165.0547 5.0E4 165.0910 4.1E4 167.2248 2.5E3 171.0802 8.2E3 172.0525 3.0E3 172.0896 2.5E3 173.0600 2.3E4 173.5281 1.6E4 173.5376 1.1E4 174.0673 4.8E3 175.0391 5.8E5 175.0751 1.7E4 176.0468 1.7E4 177.0544 3.9E4 177.0911 1.5E6 179.0705 5.9E4 181.0857 4.6E3 185.0598 7.2E4 187.0754 3.4E4 188.0828 8.3E3 189.0548 1.9E4 189.0911 2.0E5 190.0630 3.4E3 193.0864 2.7E4 197.0598 1.2E4 199.0755 2.8E5 201.0541 4.4E3 202.0806 3.8E3 203.1069 7.9E4 205.0860 1.1E5 215.0705 6.5E4 217.0862 3.8E4 218.0942 3.8E4 231.0795 9.6E3 231.1023 1.4E4 232.0877 4.1E3 235.1119 1.3E5 245.0959 4.9E4 246.1039 2.2E4 247.1107 3.7E3 249.1124 1.8E4 260.0830 9.0E3 261.0909 1.4E4 262.0988 3.5E4 263.1066 1.7E5 271.0763 3.2E3 272.0835 5.5E4 273.0910 1.3E5 274.0989 7.9E4 275.1074 1.0E4 277.1223 1.6E5 278.0945 8.1E3 288.0784 5.2E4 289.0859 2.4E4 290.0939 5.1E4 291.1019 5.2E4 292.1101 9.6E3 293.0841 1.6E4 293.1173 4.3E5 293.1479 3.8E3 302.0931 4.1E3 303.1016 1.5E6 304.1096 2.0E5 305.0827 9.0E3 305.1173 2.1E5 306.0901 7.8E3 320.1042 7.9E4 321.1122 1.9E5 323.1247 3.1E3 325.1445 1.1E4 333.1111 1.3E4 335.1276 4.8E5 344.0879 2.4E3 353.1380 7.6E4 371.1484 1.5E4 END IONS BEGIN IONS FEATURE_ID=555 PEPMASS=286.1442 SCANS=555 RTINSECONDS=607.008 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 50.2622 4.8E3 50.2640 2.1E4 51.3615 2.3E3 55.0178 1.7E4 56.2332 2.3E3 56.7538 2.3E3 65.1188 2.6E3 67.0541 6.3E3 68.0945 2.5E3 69.0697 4.0E5 70.0650 1.5E4 71.6007 2.5E3 77.0385 3.0E3 82.6384 2.6E3 83.0487 2.4E3 84.0803 1.9E5 84.9852 2.1E3 86.0962 1.9E5 97.7038 2.3E3 98.0961 2.8E3 103.0543 7.3E3 109.0519 2.6E3 110.7901 2.5E3 112.0668 4.7E3 112.0755 4.2E5 114.0915 6.0E3 115.0541 5.7E5 117.0697 4.3E4 117.8797 2.8E3 118.9971 2.8E3 122.0964 2.7E3 127.0544 3.3E3 131.0492 1.3E4 133.4930 2.4E3 134.0962 3.6E4 135.0439 1.7E6 135.0537 8.9E3 135.0681 3.8E3 143.0490 7.6E5 143.0588 3.9E3 143.0625 4.6E3 145.0647 3.1E4 148.4277 3.0E3 150.0912 4.2E4 151.0860 4.2E3 151.0991 1.7E5 157.0636 3.4E3 157.1011 1.1E4 159.0439 1.9E5 161.0597 4.1E4 164.1073 2.7E3 171.0441 7.4E5 173.0598 4.1E5 173.5309 3.1E4 173.5378 1.1E4 185.0962 4.2E4 189.0547 2.8E4 201.0106 3.9E4 201.0197 1.9E4 201.0547 6.0E6 201.0898 3.8E4 201.0986 4.6E4 201.1104 1.0E4 215.1067 2.8E4 218.1182 1.3E4 224.9335 2.6E3 228.8449 2.4E3 243.1438 2.7E3 258.1489 1.7E4 286.1442 2.6E5 290.8540 2.9E3 END IONS BEGIN IONS FEATURE_ID=556 PEPMASS=409.1055 SCANS=556 RTINSECONDS=607.008 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 2 (0 removed due to low quality, 0 removed due to low cosine). 64.5840 2.1E3 72.8689 2.3E3 79.6982 2.2E3 80.9952 2.8E3 81.8253 2.8E3 89.8477 2.2E3 148.8029 2.5E3 173.5245 1.8E4 173.5423 1.1E4 180.1841 2.2E3 187.3542 2.2E3 217.5038 2.2E3 233.8568 2.4E3 237.7936 2.4E3 256.8086 2.5E3 395.8059 2.4E3 END IONS BEGIN IONS FEATURE_ID=557 PEPMASS=416.2075 SCANS=557 RTINSECONDS=607.867 CHARGE=1+ MSLEVEL=2 MERGED_STATS=9 / 9 (0 removed due to low quality, 0 removed due to low cosine). 54.2773 2.3E3 54.6293 2.6E3 56.0621 2.3E3 57.0543 2.5E3 61.1430 3.0E3 61.4403 2.8E3 61.9300 2.7E3 64.4444 2.5E3 64.9309 2.3E3 69.2977 2.5E3 70.0885 2.6E3 70.3024 2.5E3 71.5410 2.2E3 76.0375 2.8E3 78.6129 2.8E3 80.2817 2.3E3 81.3461 2.8E3 82.5479 2.2E3 83.9384 2.8E3 92.8510 2.1E3 94.2437 2.5E3 96.1386 2.4E3 102.6091 2.4E3 102.9090 2.2E3 115.2429 2.4E3 120.1310 2.3E3 142.2036 2.3E3 142.3933 2.3E3 145.0937 2.5E3 149.6682 2.9E3 149.6868 1.0E4 152.9341 2.4E3 166.9559 2.3E3 167.1409 2.3E3 170.8985 2.4E3 173.5305 1.3E5 173.5447 8.7E3 175.3706 2.6E3 194.5520 2.9E3 198.7619 2.3E3 210.9756 2.4E3 219.4265 2.3E3 225.3857 2.7E3 233.8110 2.9E3 241.7008 2.8E3 244.5836 2.6E3 245.8505 2.4E3 250.1075 2.5E3 270.7401 2.2E3 289.9318 2.4E3 290.4001 2.3E3 292.8149 2.8E3 306.3849 2.6E3 307.2819 2.8E4 318.4079 2.6E3 335.3113 2.3E3 343.0803 2.7E3 354.9639 2.6E3 376.8860 2.5E3 426.2382 2.7E3 END IONS BEGIN IONS FEATURE_ID=558 PEPMASS=383.1495 SCANS=558 RTINSECONDS=615.445 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 3 (1 removed due to low quality, 0 removed due to low cosine). 54.1219 2.4E3 55.5171 2.3E3 58.9801 2.2E3 61.9823 2.3E3 68.6298 2.4E3 72.4276 2.3E3 105.1055 2.4E3 115.5259 2.4E3 117.5144 2.3E3 127.6030 2.5E3 135.0437 1.1E5 147.9807 2.4E3 149.0591 3.7E3 150.3347 2.2E3 157.0633 3.8E3 166.0623 1.6E4 173.0600 8.3E3 173.5255 1.1E4 173.5411 1.4E4 179.6313 2.4E3 181.0861 2.9E4 185.0596 9.2E3 187.0752 1.2E4 198.0665 2.4E3 199.0766 2.9E3 202.0987 3.9E4 218.0939 1.3E4 219.1022 3.2E3 222.4384 2.2E3 230.0947 8.8E3 231.1015 6.8E4 233.1175 9.8E3 261.1119 2.6E4 269.0810 1.2E4 275.0705 5.5E3 276.0747 2.7E3 276.1166 2.9E3 277.0867 9.2E3 279.1021 3.6E3 282.0898 1.7E4 289.0865 3.3E3 290.0959 3.6E3 291.0680 3.2E3 291.1023 1.7E4 292.1099 7.2E3 293.0819 8.5E3 297.0758 5.0E4 303.1024 1.2E4 304.1099 1.7E4 305.0817 1.3E4 306.0887 3.3E3 307.0956 1.3E4 308.1039 1.1E4 308.8999 6.4E3 312.0993 4.7E4 319.0972 2.8E4 320.1079 2.8E3 322.1203 4.7E4 323.0914 2.2E4 325.1074 1.3E4 333.1116 1.0E4 334.1201 4.3E4 335.0919 1.9E4 338.1155 4.3E4 350.1149 1.3E4 360.0298 2.8E3 365.1381 7.9E3 END IONS BEGIN IONS FEATURE_ID=559 PEPMASS=310.1080 SCANS=559 RTINSECONDS=615.607 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 5 (2 removed due to low quality, 0 removed due to low cosine). 57.2756 3.4E3 57.4400 3.7E3 60.0415 2.1E3 62.2685 1.3E4 62.2713 7.4E3 69.2663 5.2E3 69.2692 1.1E4 71.1021 2.8E3 72.0445 2.5E3 72.7881 2.3E3 73.7689 3.8E3 73.7731 3.7E3 83.5479 2.2E3 86.7514 2.6E3 88.0378 2.6E3 89.3831 2.3E3 100.3593 2.9E3 117.8790 3.4E3 125.1674 2.2E3 128.4082 2.7E3 141.9945 2.4E3 142.3226 2.4E3 165.0703 4.5E3 173.5299 4.2E4 181.0645 1.2E4 184.3969 2.4E3 192.0813 2.2E4 193.0892 1.3E4 194.0968 1.1E4 195.0436 4.8E3 195.0807 8.7E3 196.0750 5.2E3 203.0731 2.1E4 204.0807 1.2E4 207.0688 2.7E3 209.0601 1.6E4 220.0757 4.7E4 221.0835 8.1E4 222.0916 7.4E4 223.9143 2.4E3 224.0708 2.5E4 231.0464 2.5E3 231.0680 2.3E5 231.0884 2.4E3 232.0758 1.2E5 232.6406 3.3E3 233.0859 3.7E3 235.0629 4.1E4 236.0723 4.7E3 238.0859 4.8E3 239.0942 1.9E4 241.0743 9.5E3 247.0615 5.1E3 248.0471 2.3E3 248.0706 2.3E5 249.0174 3.0E4 249.0299 1.9E4 249.0783 6.2E6 249.1268 2.4E4 249.1387 4.7E4 249.1556 9.0E3 249.1730 5.9E3 249.2703 3.3E3 250.0861 3.2E5 250.1162 7.6E3 252.0355 8.1E3 252.0653 2.4E5 260.0700 4.2E3 261.0783 7.8E4 263.0575 7.7E4 264.0654 1.6E4 264.1022 8.0E3 265.0730 5.3E4 266.0809 7.2E4 267.0876 5.2E4 267.7339 2.5E3 268.0584 5.1E3 276.0659 4.2E4 277.0024 1.9E4 277.0165 1.5E4 277.0733 3.9E6 277.1301 1.3E4 277.1445 1.8E4 278.0452 6.7E3 278.0813 5.3E5 278.1174 8.0E3 279.0890 1.5E5 280.0605 6.5E5 280.0883 6.8E3 281.0682 5.4E4 282.1142 8.3E3 294.0761 3.5E5 294.1147 7.2E3 295.0840 1.6E6 295.1242 4.4E3 296.0918 4.8E4 304.3950 2.5E3 310.0247 6.5E3 310.1074 1.8E6 319.5869 2.8E3 END IONS BEGIN IONS FEATURE_ID=560 PEPMASS=703.2982 SCANS=560 RTINSECONDS=623.042 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 6 (0 removed due to low quality, 0 removed due to low cosine). 70.0936 2.7E3 73.0255 8.1E3 73.0287 5.9E4 73.1374 7.9E3 73.1407 4.4E4 73.8513 2.2E3 76.1401 5.2E3 76.1434 3.1E4 78.1409 9.3E3 78.1448 6.9E4 78.4411 2.4E3 80.3706 2.5E3 89.5430 2.6E3 93.6621 2.4E3 99.4892 2.3E3 104.2512 2.5E3 106.4026 2.7E3 108.0292 2.8E3 111.1310 2.9E3 116.8486 2.5E3 123.1140 2.3E3 131.1565 2.4E3 131.6959 2.6E3 137.6426 2.7E3 140.2791 2.3E3 145.6417 2.4E3 153.2855 2.6E3 157.2042 2.7E3 164.0916 2.4E3 167.2474 2.6E3 168.8214 2.6E3 173.5262 4.6E4 173.5378 6.8E4 182.4478 2.4E3 204.9237 2.3E3 210.4547 2.6E3 221.0806 1.2E4 235.2644 2.5E3 236.3644 2.7E3 251.3943 2.6E3 278.7636 2.9E3 285.2690 3.4E3 293.6342 2.4E3 297.7747 2.6E3 383.0844 3.0E3 460.4120 2.6E3 469.1494 4.0E4 470.1598 3.3E3 474.3347 2.7E3 482.1632 2.5E3 483.1667 5.1E4 484.1774 7.8E3 496.1760 2.0E4 497.1822 3.8E5 498.1888 5.5E4 499.1974 2.8E4 510.1811 2.9E3 511.1972 1.6E4 515.1937 3.2E3 524.1678 3.8E3 525.2102 2.2E4 526.2205 1.5E4 528.1640 2.8E4 529.1719 3.0E4 541.1693 6.9E3 542.1795 2.9E4 543.1863 6.0E3 553.2117 2.6E3 555.1874 2.0E4 556.1956 3.2E5 556.2940 4.0E3 557.2031 2.5E5 569.2059 1.6E4 570.2065 3.2E3 573.2341 5.7E4 578.6572 2.9E3 584.2287 7.3E3 585.2345 4.8E4 597.2090 1.1E4 598.2168 2.9E3 599.2479 2.1E4 600.2565 3.0E4 601.2275 2.5E4 611.2137 6.9E3 614.2020 2.8E3 625.2324 1.5E4 627.2460 3.1E4 629.2243 1.9E5 630.2323 3.3E5 631.2467 7.8E3 633.2543 1.4E5 642.2362 2.4E3 643.2383 1.4E4 644.2485 8.8E4 657.1599 3.7E3 657.2556 1.6E6 657.4400 3.5E3 658.1334 1.5E4 658.2629 1.3E6 658.3563 3.3E3 658.3938 3.4E3 659.2677 1.8E5 674.2558 6.3E3 675.2643 3.4E3 685.1454 4.5E3 685.2867 1.1E6 685.4235 3.8E3 703.1885 3.2E3 703.2968 1.6E6 END IONS BEGIN IONS FEATURE_ID=561 PEPMASS=635.2606 SCANS=561 RTINSECONDS=624.437 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 4 (1 removed due to low quality, 0 removed due to low cosine). 65.0766 2.4E3 65.9533 2.3E3 70.9297 2.8E3 71.8809 2.4E3 80.0400 2.1E3 86.8875 2.9E3 86.9451 2.5E3 90.5909 2.2E3 98.0595 1.0E4 105.0413 2.7E3 106.2152 2.2E3 110.6513 2.2E3 116.0435 2.3E3 117.6650 2.2E3 126.4711 2.5E3 127.6923 2.5E3 137.7499 2.6E3 146.0959 2.9E3 147.0440 2.3E3 152.6493 2.4E3 156.3824 2.6E3 162.0677 1.1E4 173.5257 3.9E4 173.5363 1.7E4 173.5445 1.5E4 178.0628 5.8E3 189.0545 5.4E3 190.0625 5.6E4 191.0336 7.4E3 191.0695 3.4E3 193.0859 5.1E4 206.0574 1.4E4 221.0809 1.6E6 280.2769 2.9E3 290.8369 2.5E3 318.1340 9.2E3 410.0688 2.5E3 434.7419 2.7E3 491.7952 2.5E3 575.2330 4.6E3 634.4406 2.7E3 635.2565 4.6E3 641.1904 2.4E3 END IONS BEGIN IONS FEATURE_ID=562 PEPMASS=338.1027 SCANS=562 RTINSECONDS=627.563 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 3 (1 removed due to low quality, 0 removed due to low cosine). 61.8525 2.6E3 73.2590 2.8E3 77.9252 6.2E3 80.5152 3.0E3 84.5240 1.5E4 84.5282 1.0E4 100.2834 2.9E3 168.0391 2.8E3 173.5252 4.7E4 173.5355 1.8E4 173.5442 2.5E4 206.3674 2.7E3 209.0602 5.4E3 220.0751 6.6E3 221.0836 3.2E4 222.0914 1.9E4 231.0680 2.2E4 232.0763 8.3E3 233.0829 3.3E3 235.0643 5.7E3 236.0461 4.5E3 236.0707 7.2E3 237.0561 6.2E3 239.0925 7.6E3 248.0713 3.4E4 249.0542 5.8E3 249.0786 4.1E5 249.1079 1.7E4 250.0862 1.1E5 252.0661 2.3E4 260.0713 9.7E3 261.0782 1.1E4 263.0572 2.4E4 264.0413 1.5E5 264.0666 7.0E4 265.0495 3.2E5 265.0733 3.1E4 266.0815 6.5E3 267.0879 1.1E4 276.0665 1.6E4 277.0737 1.7E6 278.0815 2.3E5 279.0894 5.2E4 280.0609 2.8E5 281.0686 4.1E4 282.0521 2.4E4 282.1089 6.2E3 290.0457 3.6E4 291.0528 2.2E4 292.0616 4.5E3 292.0959 7.0E3 293.0682 6.6E4 294.0413 4.7E3 294.0766 1.7E5 295.0461 1.3E4 295.0843 4.3E5 296.0928 2.3E4 304.0607 1.1E4 305.0377 2.7E4 305.0686 2.7E6 305.1499 4.5E3 306.0415 1.4E4 306.0766 2.8E5 306.1167 7.2E3 308.0557 1.3E6 309.0620 4.1E3 310.1079 2.7E5 321.9814 2.2E4 322.0030 1.6E4 322.0384 4.8E4 322.0714 4.1E6 322.1595 2.6E4 323.0452 2.1E4 323.0792 1.9E6 338.0089 2.0E4 338.0276 2.4E4 338.1025 5.4E6 338.1777 9.5E3 338.1985 1.1E4 END IONS BEGIN IONS FEATURE_ID=563 PEPMASS=360.0845 SCANS=563 RTINSECONDS=628.659 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 3 (1 removed due to low quality, 0 removed due to low cosine). 56.3528 2.2E3 56.6625 2.4E3 62.2386 5.5E3 64.8140 2.5E3 70.2616 4.5E3 97.0332 2.5E3 132.6690 4.9E3 173.5257 4.1E4 173.5440 1.3E4 198.3626 4.9E3 208.4004 2.4E3 221.7029 2.3E3 294.7558 2.4E3 299.0537 1.0E4 313.1644 2.3E3 327.0474 7.4E3 344.0525 1.2E5 345.0610 1.6E4 360.0318 1.2E4 360.0837 4.6E5 360.1357 9.6E3 END IONS BEGIN IONS FEATURE_ID=564 PEPMASS=370.1413 SCANS=564 RTINSECONDS=629.325 CHARGE=1+ MSLEVEL=2 MERGED_STATS=7 / 10 (3 removed due to low quality, 0 removed due to low cosine). 53.1491 2.3E3 53.2980 2.1E3 55.0177 2.1E5 57.5350 2.1E3 61.9376 2.2E3 62.5960 2.3E3 63.0983 2.5E3 65.1053 2.1E3 69.0333 4.1E4 71.2709 2.2E3 76.8046 2.1E3 77.0392 4.5E3 79.0540 1.4E4 79.0808 2.3E3 80.0981 2.5E3 80.2898 2.3E3 81.0334 1.5E4 82.3847 2.1E3 83.3746 2.6E3 84.1687 2.3E3 90.4809 2.2E3 91.0541 2.6E4 93.0701 3.2E3 94.9180 2.3E3 95.0489 3.7E4 98.2493 2.3E3 102.7232 2.2E3 103.0540 2.1E5 104.0624 5.0E3 106.0414 3.3E3 106.4383 2.5E3 107.0490 3.9E4 109.0648 7.4E3 111.0442 3.3E3 115.0407 2.3E3 115.0541 2.7E4 115.3482 2.9E3 116.0617 2.4E3 117.0696 8.5E4 118.9187 2.4E3 119.0491 1.7E4 120.0566 1.3E4 121.0285 1.2E4 121.0646 1.6E5 122.0360 1.9E5 123.0437 5.1E4 124.0524 3.0E3 128.0610 3.2E3 128.3922 2.5E3 129.0701 8.8E3 130.0412 2.0E4 131.0379 5.0E3 131.0490 1.4E6 131.0597 1.1E4 131.0849 3.3E3 132.0566 2.1E4 133.0283 1.4E4 133.0647 1.8E4 135.0318 1.2E4 135.0439 1.8E6 135.0552 1.3E4 135.0684 3.5E3 135.0804 4.1E4 136.0509 1.2E5 137.0594 6.9E4 138.0559 3.9E3 138.0673 5.8E5 139.0751 1.1E5 143.0490 5.3E4 145.0647 9.8E4 146.0362 1.9E4 146.0725 2.0E5 147.0438 9.7E4 147.0803 1.1E5 148.0389 4.9E3 148.0517 6.4E5 149.0106 6.9E3 149.0232 1.4E6 149.0348 7.3E3 149.0596 1.2E5 149.0961 1.7E4 150.0307 4.0E4 150.0674 1.8E5 151.0387 1.3E5 151.0531 4.8E3 151.0752 1.8E6 151.0874 1.0E4 152.0802 9.8E4 155.0701 3.5E4 156.0569 6.3E3 157.0644 2.4E4 158.0722 1.5E4 159.0439 5.8E4 159.0803 2.7E4 160.0518 1.7E5 160.0870 5.4E3 161.0440 7.3E3 161.0596 7.2E5 161.0755 6.1E3 161.0957 3.7E4 162.0674 1.2E5 163.0388 1.6E4 163.0753 1.6E5 164.0474 1.6E4 164.0831 4.1E5 165.0418 3.5E3 165.0546 2.7E6 165.0686 1.1E4 165.0890 4.7E4 166.0602 9.0E4 166.0988 2.6E5 166.4016 2.8E3 167.0701 8.0E4 171.0439 1.8E4 172.0890 7.4E3 173.0597 1.2E5 173.5260 3.5E4 173.5345 1.2E4 173.5376 7.0E4 174.0671 7.0E4 175.0386 2.9E4 175.0753 1.4E5 176.0468 3.0E4 176.0831 1.1E5 177.0546 1.2E5 177.0741 6.6E3 177.0910 1.2E6 177.1055 4.6E3 177.6123 2.7E3 178.0625 1.3E5 178.0775 2.4E3 178.0989 9.8E4 179.0704 3.7E4 180.0780 6.5E4 185.0598 2.4E4 186.0674 6.4E4 187.0387 2.7E3 187.0753 1.0E5 188.0466 4.0E4 188.0835 3.7E4 189.0547 1.2E5 189.0910 1.9E5 190.0623 2.1E4 191.0702 8.3E4 191.1069 6.2E4 192.0780 1.7E5 193.0859 1.0E5 194.0937 1.7E5 201.0547 2.3E5 201.0889 5.5E3 202.0620 3.9E3 202.0990 2.7E4 203.0702 1.6E5 203.1068 1.4E5 204.0781 6.1E4 205.0859 1.4E5 205.1050 3.2E3 208.0729 2.6E3 213.0548 3.5E3 217.0860 1.1E5 219.0653 3.7E4 219.1017 9.8E4 229.3311 2.5E3 238.1680 2.6E3 241.7249 2.8E3 243.2477 2.4E3 263.3649 2.6E3 267.1014 5.4E3 267.6780 2.3E3 271.0965 3.4E5 277.0857 2.6E3 279.1011 4.4E3 284.1050 8.7E3 290.0926 2.3E3 291.1003 1.6E4 293.1184 3.1E3 296.1039 4.3E3 296.2743 2.7E3 297.1107 8.3E3 303.1009 3.4E4 308.1071 2.4E3 309.1124 1.9E4 312.0630 2.8E3 321.1124 9.3E4 323.1270 3.3E3 333.1117 1.6E4 337.1077 7.7E3 339.1226 1.1E5 343.5683 2.9E3 348.6028 2.5E3 351.1245 6.1E3 369.1337 2.7E4 376.5862 2.4E3 378.6587 2.5E3 END IONS BEGIN IONS FEATURE_ID=565 PEPMASS=282.0891 SCANS=565 RTINSECONDS=629.334 CHARGE=1+ MSLEVEL=2 MERGED_STATS=7 / 7 (0 removed due to low quality, 0 removed due to low cosine). 48.7390 2.1E3 53.3678 2.4E3 56.3064 2.6E3 57.0696 6.4E3 58.6529 2.5E3 61.2444 2.4E3 61.8848 2.4E3 62.0698 2.3E3 62.6607 2.3E3 63.3241 2.4E3 64.5198 2.6E3 65.0206 2.8E3 69.0694 8.8E3 72.8265 2.3E3 76.6170 2.3E3 76.7344 2.4E3 82.7582 2.2E3 96.4754 2.1E3 97.1010 2.6E3 102.3618 2.4E3 106.3235 2.4E3 108.3247 2.3E3 109.3299 2.1E3 113.6298 2.4E3 113.8236 2.3E3 114.9114 2.5E3 120.1605 2.2E3 121.4822 2.8E3 131.9359 2.3E3 134.0960 8.8E4 153.0696 9.3E4 153.7134 2.5E3 155.0851 3.1E3 156.2124 2.6E3 156.9629 2.5E3 158.8916 2.4E3 165.0702 5.6E3 169.0647 3.1E3 173.5245 2.6E4 173.5371 6.3E4 175.4448 2.3E3 177.1238 2.5E3 181.0646 2.6E5 183.0808 1.1E4 183.9686 2.4E3 194.7150 2.7E3 197.0593 1.1E4 203.5061 2.6E3 207.8866 1.9E4 209.0596 2.0E5 210.0667 2.4E3 211.0534 1.3E4 211.0754 3.4E5 211.0983 4.0E3 211.1350 2.7E4 221.0597 1.2E5 222.0662 8.7E3 223.6247 2.5E3 223.6746 2.3E3 224.0465 3.1E4 225.0544 3.6E4 225.5755 2.4E3 235.8822 3.2E3 237.0546 9.0E3 238.0625 1.4E5 239.0701 1.4E6 244.9338 2.2E3 249.0546 2.2E4 267.0318 4.6E3 267.0651 5.9E5 267.0967 6.5E3 273.0173 2.5E3 281.3972 3.3E3 282.0889 3.6E5 282.2219 2.4E5 END IONS BEGIN IONS FEATURE_ID=566 PEPMASS=393.1315 SCANS=566 RTINSECONDS=629.381 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 5 (0 removed due to low quality, 0 removed due to low cosine). 56.8152 2.1E3 58.4466 2.2E3 58.9179 2.1E3 60.8090 2.2E3 62.6708 2.4E3 62.8105 2.3E3 67.3683 2.4E3 70.9319 2.5E3 73.4612 2.3E3 75.3852 2.5E3 79.0828 2.9E3 80.6817 2.2E3 81.0424 2.2E3 89.3181 2.5E3 118.9813 2.3E3 119.4123 2.3E3 120.0204 2.5E3 125.1802 2.9E3 126.7061 2.7E3 128.5630 2.4E3 141.9415 2.4E3 149.0231 1.5E4 149.4453 2.6E3 149.6871 7.9E3 149.6957 3.9E3 150.0264 1.2E4 160.3044 2.5E3 173.5295 3.6E4 173.5385 1.8E4 179.0058 2.3E3 183.4441 2.7E3 198.5214 2.9E3 203.3902 2.4E3 212.4758 2.6E3 223.6416 2.4E3 234.3411 2.4E3 241.0804 2.6E3 256.8571 2.4E3 281.9948 2.8E3 309.0718 2.2E3 334.9219 2.6E3 347.2818 2.3E3 END IONS BEGIN IONS FEATURE_ID=567 PEPMASS=201.0913 SCANS=567 RTINSECONDS=629.427 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 7 (3 removed due to low quality, 0 removed due to low cosine). 41.0384 9.0E3 41.5681 2.1E3 43.0541 2.5E3 49.9467 2.3E3 50.6655 2.2E3 51.9214 2.1E3 54.5596 2.3E3 55.0540 5.3E3 55.9341 1.1E5 56.9346 3.6E4 57.0696 1.2E4 58.9774 2.2E3 61.8077 2.3E3 64.2483 2.3E3 67.0539 1.2E4 67.3483 2.8E3 67.8082 2.3E3 69.0696 1.4E4 72.9369 2.4E4 73.0278 2.4E3 76.9333 3.0E3 77.9332 4.9E3 79.0540 1.0E4 81.0651 2.7E3 81.0696 2.5E4 85.7363 2.3E3 86.9380 2.4E3 87.9919 2.2E3 90.9473 2.9E4 91.0539 1.6E4 91.9475 6.0E3 93.0696 1.8E4 95.0852 1.6E4 95.9094 2.2E3 97.2368 2.5E3 99.5828 2.5E3 99.6333 2.6E3 100.9911 2.4E3 102.7276 2.3E3 105.0696 4.9E4 107.0853 2.1E4 107.9499 9.3E3 109.1011 4.8E3 112.7226 2.5E3 113.9626 2.5E3 114.9480 7.2E3 114.9714 2.9E3 115.0541 6.5E4 115.9792 1.5E4 116.0619 1.1E4 117.0696 2.6E4 118.9418 2.9E3 118.9617 2.4E3 119.0852 1.8E4 119.7052 2.5E3 120.1522 2.6E3 121.1008 9.3E3 128.0619 3.5E4 128.9507 2.8E4 129.0696 1.2E5 129.9526 2.3E4 130.0775 1.8E5 131.0853 4.4E4 131.9740 4.9E4 132.9585 5.7E3 133.1010 1.1E4 135.9451 1.6E4 136.9466 3.0E3 137.9628 3.2E3 139.8985 2.4E3 140.0619 7.1E4 141.0696 3.4E4 143.0491 2.9E4 143.0853 1.4E4 144.0932 1.6E4 145.1010 1.1E5 146.1093 5.3E3 149.6840 4.5E3 149.6945 5.4E3 149.9847 6.4E3 155.0499 3.7E3 156.0570 3.2E4 157.0647 8.1E5 157.1012 1.5E4 158.0610 2.2E3 158.0725 5.2E5 158.0848 3.0E3 158.1088 9.1E3 159.1167 5.7E4 162.6636 2.8E3 164.6333 2.6E3 171.0435 1.5E4 171.1169 5.8E3 172.0525 3.5E3 173.1327 1.1E4 173.5283 3.2E4 173.5426 5.5E3 185.0599 7.2E4 186.0676 1.4E5 186.1403 5.3E3 188.5989 2.4E3 190.7523 2.8E3 201.0913 1.9E5 201.1105 4.1E3 201.1639 1.2E4 202.0642 2.6E3 END IONS BEGIN IONS FEATURE_ID=568 PEPMASS=323.1282 SCANS=568 RTINSECONDS=629.427 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 4 (1 removed due to low quality, 0 removed due to low cosine). 49.9263 2.5E3 51.5673 2.2E3 52.1535 2.3E3 52.3444 2.4E3 54.4615 2.1E3 57.3441 2.2E3 59.9646 2.4E3 62.5811 2.5E3 72.3462 2.3E3 79.0539 1.1E4 82.9731 2.5E3 83.4841 2.4E3 84.1746 2.6E3 88.8694 2.5E3 91.0540 3.7E3 95.0488 6.3E3 95.4372 2.3E3 111.1162 2.6E3 115.3248 2.4E3 127.7435 2.6E3 131.0489 4.8E3 133.0643 7.4E3 135.0332 4.5E3 135.0437 4.9E5 135.0540 9.5E3 136.0516 5.5E4 138.7193 3.0E3 141.6537 2.6E3 145.8242 2.3E3 147.0435 8.5E3 149.0590 3.8E3 150.1036 2.2E3 151.0751 1.1E5 157.0642 2.8E3 158.0724 6.7E3 161.0593 6.0E3 173.5232 5.6E3 173.5375 2.7E4 185.0596 3.8E4 186.0674 7.1E3 201.0911 5.7E4 203.0857 3.3E3 205.1015 2.8E3 218.0729 7.5E3 219.0808 7.6E3 231.0800 5.7E3 233.0959 3.9E4 234.1041 3.6E4 235.0747 3.6E3 246.0693 2.8E3 246.1031 5.8E3 246.4661 2.7E3 247.0753 1.4E4 249.0911 1.1E4 250.0993 9.8E3 261.0910 6.5E4 262.0984 5.9E4 263.0701 9.7E3 263.1042 4.2E3 265.0896 8.1E3 265.1223 5.0E4 267.0656 6.3E3 275.0663 2.6E3 276.0780 8.0E3 277.0858 2.4E4 278.0938 2.2E4 280.0730 1.1E4 282.0875 4.5E3 285.7668 2.6E3 290.0920 2.8E3 291.1017 1.8E4 292.1098 1.6E5 293.0807 3.3E4 293.1177 3.3E4 295.0969 4.7E4 297.4461 2.6E3 308.1047 9.7E4 323.1282 2.4E4 END IONS BEGIN IONS FEATURE_ID=569 PEPMASS=763.2727 SCANS=569 RTINSECONDS=629.433 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 7 (1 removed due to low quality, 0 removed due to low cosine). 76.5178 2.2E3 77.1607 2.8E3 83.9841 2.4E3 92.4698 2.5E3 93.2486 2.5E3 94.4176 2.5E3 96.0901 2.5E3 100.2355 2.4E3 100.7883 2.5E3 102.0604 2.2E3 104.5475 2.5E3 122.6984 2.9E3 132.2930 2.3E3 139.7861 2.6E3 142.3534 2.8E3 144.0563 2.6E3 149.6821 3.9E3 149.6924 4.4E3 160.1606 2.4E3 162.4340 2.5E3 173.5220 1.4E4 173.5362 7.8E4 179.9712 2.3E3 201.6233 2.3E3 225.9035 2.5E3 243.5724 2.5E3 249.7516 2.4E3 265.2819 2.6E3 335.6330 2.5E3 347.6269 2.6E3 358.3917 2.4E3 376.5699 2.5E3 393.1313 2.8E5 427.0495 2.6E3 484.4383 2.9E3 610.6620 2.5E3 646.4857 3.3E3 763.8313 2.6E3 END IONS BEGIN IONS FEATURE_ID=570 PEPMASS=233.0810 SCANS=570 RTINSECONDS=629.464 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 43.0177 8.3E3 43.5263 2.5E3 45.0070 2.5E3 45.3783 2.1E3 47.6456 2.4E3 54.6644 2.2E3 55.0179 3.1E3 58.4999 2.3E3 61.8606 2.6E3 66.8112 2.1E3 67.0539 5.9E3 67.0910 2.4E3 67.2715 2.5E3 71.0124 5.8E3 73.5343 2.0E3 75.6275 2.5E3 76.4410 2.2E3 77.9043 2.3E3 84.0965 2.3E3 87.5412 2.5E3 91.0539 2.9E3 95.0492 2.4E3 95.0854 3.3E3 98.3910 2.5E3 98.9812 2.3E3 100.3461 2.7E3 105.0698 8.5E3 108.6595 2.4E3 115.0540 9.5E4 117.0697 2.9E4 121.0638 2.6E3 123.0804 1.5E4 128.8372 2.3E3 129.0698 2.3E4 135.0439 3.6E4 138.7619 2.6E3 141.9814 2.7E3 143.0362 3.7E3 143.0490 1.5E5 145.0646 6.1E4 149.6823 3.5E3 149.6926 5.4E3 151.0752 5.5E5 155.0477 2.8E3 155.0603 6.0E3 157.0650 6.5E3 161.0601 4.7E3 167.0991 2.5E3 173.0599 1.5E5 173.5242 3.8E3 173.5318 1.6E4 173.5410 4.3E3 185.0599 1.4E5 END IONS BEGIN IONS FEATURE_ID=571 PEPMASS=325.1437 SCANS=571 RTINSECONDS=629.468 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 53.8083 2.5E3 65.0528 2.4E3 67.4240 2.3E3 76.4676 2.3E3 76.8560 2.1E3 79.0537 2.4E3 84.2889 2.4E3 86.0961 4.8E3 91.0535 4.0E3 96.6313 2.2E3 113.6760 2.3E3 116.7284 2.4E3 117.1041 2.4E3 120.2509 2.3E3 129.0696 3.8E4 129.2173 2.6E3 133.8569 2.5E3 135.0437 3.2E5 135.0558 4.2E3 136.0512 3.9E4 143.0485 1.1E4 149.0595 2.3E4 151.0621 4.3E3 151.0750 2.0E5 151.0889 3.5E3 153.0898 3.5E3 157.0645 5.6E4 158.0721 1.0E4 161.0592 1.5E4 171.2559 2.5E3 172.0882 2.1E4 173.0595 4.6E4 173.5033 2.3E3 173.5250 1.9E4 173.5386 2.3E4 174.0673 4.4E4 177.0905 2.5E4 187.0752 5.1E4 188.0827 2.7E4 189.0907 1.9E5 192.5157 3.1E3 203.1066 5.2E4 207.5430 3.1E3 283.6060 2.5E3 292.6616 2.4E3 294.1190 3.1E3 302.7157 2.3E3 END IONS BEGIN IONS FEATURE_ID=572 PEPMASS=231.1018 SCANS=572 RTINSECONDS=629.49 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 7 (3 removed due to low quality, 0 removed due to low cosine). 46.3400 2.2E3 50.6543 2.6E3 53.8429 2.1E3 55.0176 1.2E4 56.0628 2.4E3 57.2940 2.3E3 58.0649 2.3E4 59.0682 4.5E3 62.0598 3.9E3 64.0821 2.3E3 76.9332 2.5E3 79.4695 2.4E3 79.9137 2.6E3 81.0695 1.0E4 86.8078 2.5E3 87.3750 2.2E3 88.9942 2.3E3 89.0143 2.1E3 92.0278 2.4E3 106.1956 2.5E3 106.4823 2.2E3 109.0639 3.4E3 128.0618 2.0E4 129.0697 3.7E4 130.0773 4.1E3 136.7559 2.5E3 141.0691 3.3E3 142.0777 8.3E3 143.0851 2.5E4 145.0644 3.2E4 149.6763 3.3E3 149.6857 1.1E4 149.7052 3.7E3 156.0562 1.6E4 157.0644 9.4E4 158.0724 7.6E4 159.0803 2.6E4 159.5065 2.5E3 160.0883 5.4E3 170.0725 3.1E4 171.0801 2.3E4 172.0882 1.5E5 173.0596 1.5E5 173.1753 2.4E3 173.5302 3.0E4 173.5396 3.6E3 177.3859 2.6E3 185.0590 1.1E4 186.0672 4.1E4 187.0582 2.5E3 187.0751 4.9E4 188.0830 1.6E5 198.0678 2.8E3 200.0822 4.6E3 201.0558 1.3E4 201.0907 1.0E5 203.1065 2.9E4 216.0777 1.7E4 231.1020 1.3E4 231.1362 3.2E3 END IONS BEGIN IONS FEATURE_ID=573 PEPMASS=335.1282 SCANS=573 RTINSECONDS=629.511 CHARGE=1+ MSLEVEL=2 MERGED_STATS=7 / 10 (3 removed due to low quality, 0 removed due to low cosine). 50.4201 2.9E3 52.2129 2.5E3 52.5310 2.5E3 53.4254 2.2E3 53.6283 2.5E3 55.3019 2.8E3 57.3570 2.3E3 64.2941 2.3E3 65.5829 2.1E3 68.2069 2.2E3 69.6223 2.3E3 69.7663 2.1E3 75.0437 9.0E4 77.7792 2.2E3 80.6761 2.3E3 81.3214 2.8E3 85.2930 2.5E3 89.3344 2.5E3 91.0544 2.7E3 92.4856 2.6E3 95.4092 2.7E3 98.0198 2.2E3 100.3061 2.7E3 102.7098 2.3E3 102.9214 2.3E3 104.9732 2.3E3 112.4819 2.3E3 113.4471 2.3E3 116.2217 2.3E3 118.4744 2.4E3 125.1705 2.3E3 133.5295 2.2E3 135.0438 2.0E4 147.0437 4.9E4 150.8327 2.7E3 151.0750 2.4E4 151.4331 2.3E3 159.0439 6.8E3 161.0598 1.1E4 162.2013 2.2E3 163.4137 2.5E3 173.5193 1.6E4 173.5338 1.3E5 175.0758 3.7E3 182.0708 3.0E3 184.5555 2.4E3 185.0591 1.9E4 187.0753 5.6E3 197.0588 7.0E3 199.0751 2.2E5 202.0783 3.8E4 203.0854 4.5E4 210.0908 3.0E3 212.8633 4.5E3 213.0911 4.2E4 215.0858 5.7E4 216.0935 7.2E3 216.2051 2.5E3 217.1010 5.7E4 219.0798 4.1E4 230.0725 5.3E4 230.8739 4.1E4 231.0805 1.3E5 232.0881 3.9E4 233.0617 2.5E3 233.0957 6.0E4 234.1037 5.5E4 236.0820 2.9E3 238.4736 2.6E3 239.0713 9.8E3 242.0722 1.3E4 243.0802 5.6E4 244.0882 3.5E4 245.0704 3.1E3 245.0958 2.6E5 246.0742 9.1E3 246.1036 4.2E5 246.1335 2.6E3 247.0751 1.5E5 247.1108 5.0E4 248.0829 6.3E3 248.1190 1.8E4 248.2962 2.3E3 249.0913 2.5E4 251.0779 3.7E3 251.1063 8.1E4 257.0964 3.1E3 258.0670 5.3E4 259.0751 1.4E5 259.1066 1.5E4 260.0828 1.9E5 261.0906 3.3E5 262.0664 2.6E4 262.0984 3.7E5 263.0703 3.8E4 263.1053 1.1E4 264.0751 2.5E3 264.1133 7.0E3 265.1213 2.7E3 267.0650 6.6E4 270.8698 2.8E3 271.0749 2.3E4 272.0832 1.4E5 273.0569 9.3E3 273.0909 6.9E5 274.0721 3.3E3 274.0988 6.1E5 274.1327 5.0E3 275.0703 2.1E5 275.1066 1.0E5 276.0781 7.3E4 276.1145 5.7E4 277.0862 2.1E5 277.1222 5.5E5 277.1569 2.6E3 279.0670 1.4E4 279.1025 2.9E4 279.1381 6.0E4 280.0739 3.0E3 281.0812 2.9E3 282.0887 1.4E5 287.0703 4.1E4 287.1058 2.9E3 288.0415 3.5E3 288.0781 3.2E5 288.1122 2.1E3 289.0468 3.8E3 289.0860 1.4E6 289.1192 1.2E4 290.0575 1.7E4 290.0938 3.5E5 291.0650 5.8E4 291.1018 5.9E4 292.0740 3.7E4 292.1093 4.2E4 293.0789 2.9E3 301.0860 3.4E3 302.0941 3.2E4 303.1016 1.5E6 303.1316 9.0E3 303.1430 5.7E3 304.0677 5.1E3 304.1095 2.5E6 305.0806 7.3E5 305.1179 4.6E5 306.0888 2.3E5 307.0965 1.7E5 307.1333 3.0E4 312.9622 2.7E3 315.6210 2.8E3 319.0967 2.6E5 320.0612 9.5E3 320.1043 6.7E5 320.1369 4.5E3 333.1116 1.5E4 335.0817 5.2E3 335.1277 5.0E5 335.1689 6.8E3 END IONS BEGIN IONS FEATURE_ID=574 PEPMASS=353.1388 SCANS=574 RTINSECONDS=629.511 CHARGE=1+ MSLEVEL=2 MERGED_STATS=7 / 9 (2 removed due to low quality, 0 removed due to low cosine). 51.1278 3.8E3 53.0385 5.6E4 54.8337 8.8E3 55.0179 4.0E4 55.5620 7.9E3 56.9539 1.9E4 58.5970 7.3E3 62.3852 8.6E3 62.7296 7.5E3 65.0388 3.6E4 68.8238 9.2E3 71.0490 1.3E6 71.3945 7.7E3 72.9062 2.0E4 75.0439 2.9E5 76.6054 2.0E4 77.0388 1.2E5 78.8858 4.2E3 79.0541 5.2E5 81.0926 1.9E4 81.8583 1.0E4 82.3533 4.5E3 84.9828 7.1E3 85.4753 1.5E4 86.6518 7.2E3 87.8379 4.3E3 88.2512 1.9E4 91.0542 3.0E5 92.6732 8.3E3 92.7516 2.0E4 93.0335 1.6E5 94.4474 1.5E4 95.0491 2.8E5 101.9344 1.1E4 102.0536 1.9E4 103.0546 4.1E4 105.0334 1.7E5 105.0449 3.0E4 105.0697 2.5E4 106.8463 7.5E3 107.0490 4.8E5 108.0568 7.6E4 109.0646 1.8E4 111.0439 1.8E5 115.0545 2.2E5 117.0698 2.1E5 119.0490 2.7E5 121.0646 2.4E5 123.0439 3.1E5 123.0806 2.3E4 124.0519 3.2E4 128.0621 1.8E5 129.0698 9.0E5 131.0491 3.7E5 131.0849 1.6E4 133.0284 5.2E5 133.0650 9.0E3 135.0199 3.1E4 135.0248 2.4E4 135.0440 3.1E7 135.0680 2.4E5 136.0518 1.9E6 137.0596 1.7E5 139.0753 3.7E5 141.0700 4.0E4 143.0491 3.8E5 143.0856 2.5E5 144.0568 7.9E3 145.0647 4.0E5 145.1017 9.4E3 146.0728 1.3E5 147.0440 9.1E5 147.0808 8.2E3 148.0517 1.8E5 149.0234 6.0E5 149.0597 2.2E6 149.0723 3.7E4 150.0678 1.6E5 151.0389 5.2E5 151.0753 1.1E7 153.0699 3.4E4 153.0910 8.1E3 156.0572 6.3E4 157.0648 1.6E6 157.0789 1.5E4 158.0726 7.2E5 158.2497 1.3E4 159.0438 3.3E5 159.0804 1.7E5 160.0522 2.5E4 160.0881 9.8E4 161.0597 7.0E5 162.0678 1.4E5 162.3358 2.0E4 163.0390 4.5E5 163.0753 4.1E5 165.0547 5.4E5 165.0686 4.3E4 165.0764 2.6E4 165.0910 9.0E5 167.0505 1.6E4 167.0705 3.5E4 169.0641 7.8E3 170.0728 1.2E5 171.0806 4.4E5 172.0521 5.6E4 172.0725 4.8E4 172.0884 2.1E6 172.1053 1.1E4 173.0598 4.7E6 173.0739 1.7E4 173.0961 2.1E5 173.5256 6.5E5 173.5429 2.4E5 174.0676 8.7E5 175.0391 1.4E6 175.0754 9.8E5 176.0469 1.1E4 177.0547 6.1E5 177.0747 1.4E4 177.0912 7.4E5 178.0622 1.1E4 179.0703 1.5E6 179.0876 1.4E4 181.0654 1.4E5 181.0825 9.6E3 182.0727 4.1E4 182.3323 7.8E3 183.0808 6.5E4 185.0598 1.9E6 185.0784 3.8E4 186.0676 6.1E5 187.0577 1.4E4 187.0754 1.7E6 188.0832 5.4E6 188.0987 1.1E4 189.0545 1.8E5 189.0741 1.1E5 189.0911 2.2E6 190.0989 5.3E5 191.0702 8.3E5 191.1065 3.3E5 193.0672 2.5E4 193.0860 6.6E5 197.0597 3.9E5 198.0678 1.1E5 199.0754 9.1E5 200.0836 1.8E5 201.0563 7.0E4 201.0910 1.6E7 202.0788 1.6E5 202.0988 3.5E4 203.0882 2.0E5 203.1067 5.9E6 203.1248 2.0E4 205.0859 3.1E5 207.0815 9.8E3 209.0598 3.8E5 210.0679 9.4E3 211.0753 2.3E5 212.0833 9.0E3 213.0701 1.8E4 213.0911 1.6E6 213.1120 1.1E4 215.0702 6.6E5 215.0894 9.2E4 216.0781 4.9E5 217.1013 2.0E5 218.0727 1.5E5 219.0805 4.2E5 220.0888 2.9E4 221.0601 1.2E5 221.0958 4.7E4 222.0671 4.7E4 223.0756 4.4E5 224.0834 1.1E5 225.0547 1.8E5 225.0665 1.8E4 225.0910 1.6E6 230.0725 2.3E5 231.0803 4.4E5 231.1017 5.8E6 232.0887 2.0E5 233.0962 1.1E6 233.1207 1.5E4 234.1039 5.8E5 235.0757 2.4E5 235.1111 1.7E5 236.0838 1.3E4 236.1198 8.3E4 237.0546 3.6E5 237.0903 2.1E4 238.0627 1.8E5 238.0987 8.7E4 239.0703 2.1E6 239.1066 8.4E4 240.0776 8.2E4 242.0724 6.0E4 243.0805 2.3E5 244.0887 2.0E5 245.0960 1.3E6 246.0729 1.3E5 246.1038 2.4E6 246.1253 1.5E4 247.0754 1.1E6 247.1112 2.6E5 247.4503 8.5E3 248.0832 2.9E5 248.1159 3.6E4 249.0627 3.4E4 249.0912 4.1E5 250.0627 1.9E4 250.0985 3.0E5 251.0704 4.1E5 251.1064 5.6E5 252.0779 1.1E7 252.1056 1.3E5 252.1209 1.4E4 253.0498 1.5E6 253.0857 1.7E6 253.1138 7.9E3 255.1013 1.2E5 257.0955 2.1E4 258.0673 2.4E5 259.0754 6.3E5 259.1051 1.2E4 260.0830 8.9E5 261.0591 7.7E4 261.0676 8.1E3 261.0907 3.8E6 261.1148 3.7E3 261.1236 1.5E4 262.0671 1.4E5 262.0985 3.6E6 262.1226 1.2E4 262.1317 1.0E4 263.0702 4.7E5 263.1063 3.6E5 264.0797 1.2E5 264.1140 3.1E5 265.0553 1.1E4 265.0863 3.5E5 265.1221 1.9E6 265.1518 8.0E3 266.0938 2.6E5 267.0319 1.0E5 267.0650 5.4E6 267.0978 1.3E5 267.1372 3.7E5 268.0728 8.4E6 268.0992 3.2E4 269.0825 6.2E4 271.0758 4.5E4 272.0833 3.7E5 273.0571 3.2E4 273.0910 2.6E6 274.0710 2.3E4 274.0988 4.0E6 274.1330 7.2E4 275.0703 9.0E5 275.1068 6.5E5 276.0784 5.6E5 276.1144 2.2E5 277.0524 6.9E3 277.0864 1.7E6 277.1223 5.2E6 277.1484 3.3E4 277.1580 4.5E4 278.0939 1.6E6 279.0666 1.9E5 279.1015 6.7E5 279.1365 5.8E4 280.0728 6.3E5 280.1088 2.0E5 281.0814 1.6E5 281.1151 8.1E3 282.0886 1.7E7 282.1171 1.5E4 283.0596 1.8E4 283.0691 1.2E4 283.0966 6.9E6 283.1335 2.5E4 287.0706 8.1E4 287.1063 1.2E4 288.0782 1.2E6 288.1127 1.8E4 289.0581 2.8E4 289.0861 7.2E6 289.1166 3.8E4 290.0573 1.5E5 290.0938 3.2E6 290.1232 4.5E3 291.0666 1.5E5 291.1017 1.4E6 292.0767 1.1E5 292.1094 3.5E6 292.1382 2.2E4 292.1480 9.5E3 293.0807 1.1E6 293.1174 2.3E6 294.0883 3.2E5 294.1250 1.9E5 295.0576 1.2E5 295.0965 6.1E6 295.1315 3.8E5 296.1045 4.1E5 297.1117 1.5E5 302.0942 1.9E5 303.0620 1.1E5 303.1016 5.0E6 303.1311 2.1E4 303.1426 1.3E4 304.0793 3.8E4 304.1095 1.3E7 304.1908 1.4E4 305.0804 3.5E6 305.1175 6.7E6 305.1469 5.1E3 306.0886 5.0E5 306.1250 1.2E4 307.0965 7.9E5 307.1330 8.3E4 308.0616 1.5E4 308.0733 1.1E4 308.1045 6.3E6 309.1122 1.5E6 310.1196 2.0E5 319.0965 8.7E5 320.0610 7.9E4 320.1042 5.2E6 320.1369 1.9E4 320.1488 1.9E4 320.1687 6.7E3 321.1124 3.9E4 322.0808 2.0E4 322.1201 5.0E5 323.0889 1.0E5 323.1279 2.4E6 323.1714 3.2E4 325.1432 1.9E5 332.5588 5.1E3 333.1139 1.2E4 335.0820 7.2E4 335.1276 3.1E6 335.1625 7.5E3 338.1155 6.8E4 353.1378 2.3E5 END IONS BEGIN IONS FEATURE_ID=575 PEPMASS=741.2908 SCANS=575 RTINSECONDS=629.511 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 7 (1 removed due to low quality, 0 removed due to low cosine). 70.4097 2.4E3 71.0489 2.8E4 73.5939 2.5E3 75.0438 2.9E3 77.0389 1.8E4 77.1789 3.5E3 79.0541 5.3E4 80.4544 3.8E3 81.0334 1.0E5 82.4506 5.9E3 86.4610 2.3E3 86.5831 3.0E3 87.3689 3.0E3 88.9342 3.5E3 89.8824 2.4E3 90.0620 3.1E3 91.0542 3.2E4 93.7526 2.1E3 95.0493 3.9E4 99.1268 2.3E3 100.6660 3.2E3 103.0541 5.3E4 105.0335 1.8E4 105.0449 8.5E3 107.0490 4.2E4 108.0569 3.1E3 109.7213 2.7E3 111.0439 9.1E3 115.0542 2.5E5 117.0697 5.8E4 118.2261 3.4E3 119.0492 4.1E3 121.0646 3.8E4 123.0439 3.5E4 124.0520 5.6E3 127.0547 1.4E4 128.0622 4.0E4 129.0697 1.5E5 131.0490 1.6E5 131.4176 7.2E3 133.0283 1.1E4 135.0439 5.2E6 135.0541 7.1E3 135.0682 9.4E3 136.0517 1.7E5 137.0596 2.0E4 139.0751 1.2E5 143.0490 5.6E5 143.0854 1.2E4 145.0646 8.6E5 146.0723 2.7E4 147.0438 6.4E4 149.0231 7.8E4 149.0596 1.0E5 150.0677 1.1E4 151.0388 2.1E5 151.0533 3.2E3 151.0752 2.1E6 151.0868 2.1E3 153.0709 2.9E3 155.0483 2.9E3 155.0605 1.6E4 157.0647 2.9E5 157.2503 3.8E3 158.0725 7.8E4 159.0440 1.7E5 159.0799 3.2E3 160.7451 3.5E3 161.0596 3.3E5 163.0397 2.8E4 163.0749 1.4E4 165.0551 4.8E4 165.0909 5.0E4 167.0702 1.6E5 171.0807 3.8E4 172.0883 1.4E5 173.0465 1.4E4 173.0597 5.6E6 173.0739 6.4E3 173.0944 2.1E4 173.5217 5.2E3 173.5300 2.1E5 173.5416 4.3E4 174.0675 6.2E5 174.0852 9.6E3 175.0389 5.9E4 175.0753 1.7E5 177.0549 6.0E4 177.0910 3.3E5 179.0702 6.9E4 181.0667 3.2E3 181.0857 6.4E3 185.0399 1.3E4 185.0597 1.9E6 185.0758 6.9E3 185.4428 2.7E3 186.0676 6.3E4 187.0754 4.1E5 188.0831 2.8E5 189.0766 1.1E4 189.0910 3.0E6 190.0987 7.5E3 191.0705 3.4E4 191.1067 6.4E4 193.0029 4.7E3 193.0858 4.2E4 197.0592 1.6E4 199.0756 9.0E4 201.0692 3.2E4 201.0909 1.9E6 201.1131 1.9E4 202.0777 1.0E4 203.0703 3.9E5 203.1067 7.2E5 205.0851 2.5E4 209.0602 2.4E4 213.0911 5.1E4 215.0703 2.1E5 216.0777 7.0E4 218.0737 4.1E3 219.0802 2.6E4 219.1017 9.6E4 221.1178 3.2E3 231.0773 3.7E4 231.1016 6.8E5 233.0810 1.1E5 234.1038 9.7E3 235.0760 4.3E3 237.0559 3.3E3 239.0711 4.3E4 245.0952 4.0E4 246.1041 5.5E4 247.0750 2.7E4 251.2713 2.9E3 252.0779 4.2E5 253.0513 2.1E4 253.0861 4.2E4 259.0755 1.6E4 260.0836 1.2E4 261.0905 1.7E5 262.0982 7.3E4 263.0715 3.6E3 263.1055 6.8E3 264.1086 4.2E3 265.1218 5.3E4 267.0651 1.2E5 268.0729 2.8E5 272.0875 4.1E3 273.0909 9.1E4 274.0655 3.7E3 274.0991 1.6E5 275.0721 1.3E4 275.1068 3.7E4 276.0788 2.9E3 277.0889 3.1E4 277.1224 1.9E5 278.0588 2.4E3 278.0940 4.2E4 279.1016 7.6E3 282.0887 6.4E5 283.0967 5.5E5 283.1327 1.3E4 288.0785 4.2E4 289.0861 1.2E5 290.0940 1.0E5 291.1020 8.4E4 292.1095 2.2E5 293.0826 1.0E4 293.1175 1.3E5 295.0965 2.1E5 295.1313 5.4E3 296.1057 4.0E3 303.1016 2.2E5 303.1603 3.1E3 304.1095 8.7E5 304.1488 6.3E3 305.0805 8.7E4 305.1175 3.9E5 305.1539 4.6E3 305.6459 3.0E3 308.1045 3.5E5 309.1120 5.9E4 311.1288 3.1E3 320.1043 4.5E5 320.1447 1.3E4 321.1146 4.7E3 322.1202 3.2E4 323.0871 5.9E3 323.1278 5.1E5 325.1418 2.3E4 335.0817 5.6E3 335.1276 7.0E5 353.1384 9.6E4 438.1565 2.7E3 438.7866 3.2E3 450.7149 3.0E3 510.6321 5.2E3 520.7301 3.9E3 557.9916 4.1E3 575.0297 4.7E3 600.8340 3.6E3 681.1343 3.4E3 702.9866 4.0E3 END IONS BEGIN IONS FEATURE_ID=576 PEPMASS=488.0767 SCANS=576 RTINSECONDS=629.613 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 5 (0 removed due to low quality, 0 removed due to low cosine). 58.0955 2.8E3 66.8461 2.9E3 71.0566 2.3E3 74.1160 3.1E3 74.5337 2.5E3 76.1405 2.6E3 83.8405 2.2E3 84.1362 2.3E3 85.9671 2.7E3 96.0650 2.8E3 99.0572 2.6E3 108.8932 2.2E3 112.2301 2.3E3 122.0362 3.1E3 123.3552 2.5E3 129.5008 2.3E3 131.0488 7.4E4 134.7534 2.3E3 135.0437 9.9E4 136.0504 2.5E3 138.0675 2.0E4 144.0880 2.4E3 145.0645 3.3E3 148.0516 7.7E4 149.0230 1.9E5 150.0670 1.9E4 151.0387 3.0E3 151.0750 8.6E4 152.5051 2.5E3 160.0518 1.5E4 161.0594 1.1E5 162.0667 2.9E3 164.0831 8.6E4 165.0544 1.8E5 166.0989 2.0E4 167.0687 3.0E3 167.1501 2.3E3 173.0595 3.0E3 173.5249 3.1E4 173.5401 5.2E4 175.0762 7.8E3 176.0829 3.2E4 177.0552 1.3E4 177.0909 1.4E5 178.0623 3.7E4 178.0988 6.6E3 180.0774 3.4E3 183.3623 2.6E3 186.9447 2.3E3 187.0755 1.1E4 187.7981 2.4E3 189.0550 1.8E4 189.0909 2.0E4 191.0722 3.2E3 191.1073 2.4E3 192.0777 3.0E4 193.0857 7.3E3 193.3060 2.6E3 194.0937 5.1E4 201.0542 3.6E3 201.7891 2.4E3 203.0709 7.4E3 203.1064 3.4E4 204.0781 9.9E3 205.0857 1.7E4 206.8407 2.9E3 211.9758 3.2E3 217.0867 6.8E3 219.0652 2.0E4 219.1021 1.1E4 224.9574 2.7E3 247.7480 2.5E3 260.2621 2.5E3 271.0964 2.2E4 279.5744 2.7E3 281.9556 2.5E3 290.6296 2.4E3 310.1191 1.5E4 316.1339 3.0E3 321.1103 1.2E4 333.7725 2.7E3 338.1164 5.6E3 339.1228 7.9E4 340.2108 2.9E3 369.1301 7.8E3 373.5956 3.0E3 387.8727 2.5E3 410.1376 2.4E3 475.0615 2.6E3 END IONS BEGIN IONS FEATURE_ID=577 PEPMASS=219.1746 SCANS=577 RTINSECONDS=630.463 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 42.9097 2.2E3 43.0177 8.6E4 43.0541 7.4E3 47.6929 2.1E3 50.8636 2.3E3 53.0385 9.9E3 54.6675 2.1E3 55.0174 2.7E3 55.0540 5.1E4 57.0333 3.0E4 57.0697 1.8E4 58.1940 2.3E3 60.1425 2.3E3 61.8255 2.5E3 67.0539 4.9E4 67.7646 2.3E3 68.1278 2.4E3 68.1573 2.3E3 69.0333 1.4E4 69.0696 4.4E5 71.0487 1.5E5 77.0387 3.5E3 77.4452 2.3E3 79.0539 7.1E4 81.0696 1.0E5 83.0488 1.5E4 83.0851 2.0E4 85.5278 2.4E3 89.1706 2.1E3 89.7861 2.4E3 91.0539 9.8E4 93.0695 3.5E5 95.0488 2.2E4 95.0852 5.2E4 97.0643 1.6E4 98.1563 2.7E3 99.5638 2.5E3 99.9779 2.3E3 105.0443 2.6E3 105.0695 1.4E5 106.9663 2.2E3 107.0773 3.5E3 107.0852 1.6E5 109.0645 1.9E4 109.1008 5.4E4 110.9431 2.4E3 111.0798 3.7E3 111.2281 2.3E3 117.0696 2.7E4 119.0852 1.2E5 121.0646 1.5E4 121.0922 3.9E3 121.1009 1.4E5 123.0805 6.6E3 123.1165 2.8E4 129.0696 5.4E3 129.2448 2.5E3 130.0775 9.3E3 131.0853 4.8E4 131.6152 2.8E3 133.1009 6.1E4 133.5393 2.6E3 135.0802 1.3E4 135.1167 2.2E4 137.0591 3.8E3 137.0957 3.8E3 143.0851 5.6E3 144.0922 2.7E3 145.0648 9.5E3 145.1009 9.0E4 147.1172 4.2E3 149.0958 4.2E4 149.1322 9.2E4 151.0748 2.8E3 151.4933 2.7E3 157.0643 7.4E3 157.1011 6.0E3 158.0723 1.9E4 159.0439 9.8E3 159.1166 6.2E4 161.1322 7.7E4 163.1115 5.4E4 173.0596 7.4E3 173.1321 6.1E3 173.5350 3.5E4 173.5396 7.2E3 174.0674 4.3E4 175.1479 1.0E4 177.1267 3.1E3 181.5489 2.5E3 184.1828 2.3E3 188.0829 1.0E4 189.0908 1.9E4 201.0909 1.2E4 201.1639 2.0E4 203.1426 8.1E3 219.1744 3.4E4 END IONS BEGIN IONS FEATURE_ID=578 PEPMASS=302.1756 SCANS=578 RTINSECONDS=640.919 CHARGE=1+ MSLEVEL=2 MERGED_STATS=8 / 14 (6 removed due to low quality, 0 removed due to low cosine). 50.2052 2.4E3 51.0233 1.1E4 53.0385 1.6E4 53.9806 2.1E3 54.9604 2.7E3 55.0177 2.5E5 55.0540 2.6E3 56.0494 2.2E3 57.0698 1.9E6 57.0727 5.7E3 58.0651 6.2E3 63.0394 3.1E3 65.0386 3.8E3 66.0463 8.1E4 66.4981 2.2E3 66.8852 2.2E3 67.0541 3.0E5 68.0619 8.5E5 68.0656 3.6E3 68.0665 6.1E3 69.0697 2.2E4 71.0730 9.7E3 71.4679 2.4E3 72.0442 1.1E5 72.0806 4.7E4 74.0963 6.1E5 75.5571 2.4E3 77.0389 1.6E4 79.0541 1.7E5 80.3158 2.3E3 81.0333 8.2E3 81.0697 2.9E5 81.6947 2.4E3 82.0650 5.9E3 86.0600 1.9E4 86.0909 4.6E3 86.0962 2.0E5 87.1879 2.6E3 90.6273 2.5E3 94.0412 1.0E4 95.0490 9.3E4 96.0443 6.3E4 96.0807 1.9E4 98.0600 5.7E4 99.0382 2.4E3 100.0755 5.0E4 102.0114 2.3E3 102.0913 4.7E4 103.0541 6.2E4 104.6375 2.5E3 104.7578 2.4E3 105.0334 1.5E4 105.0440 2.2E3 107.0492 3.2E4 109.1901 2.3E3 109.9572 2.3E3 110.0600 2.8E4 111.0680 2.9E4 112.0756 6.3E4 113.0837 3.7E3 113.3662 2.2E3 115.0542 3.7E4 117.0697 6.2E3 117.2087 2.6E3 118.7189 2.2E3 119.0500 2.3E3 123.0440 1.6E5 124.0755 9.4E4 124.9677 2.4E3 125.0834 3.0E4 126.0912 1.6E4 128.0622 6.3E4 128.1069 1.8E5 129.0590 5.1E3 129.0698 5.3E5 129.0783 3.0E3 129.0817 2.8E3 131.0383 7.2E3 131.0490 4.5E5 131.0609 2.9E3 131.0860 3.8E3 133.0648 2.0E4 133.7113 2.4E3 135.0126 5.8E3 135.0197 5.9E4 135.0439 9.9E6 135.0536 4.9E4 135.0680 1.1E5 135.0774 1.0E4 137.0594 3.3E3 139.0990 1.4E4 140.6280 2.3E3 142.1224 1.5E4 143.0490 1.1E5 143.0855 1.4E5 145.0646 6.5E4 145.1011 1.9E4 147.4170 2.7E3 147.9938 2.5E3 149.0238 3.3E3 149.0599 3.3E4 152.1069 4.8E5 152.1209 5.4E3 153.0699 6.2E4 154.1226 5.0E4 155.0613 6.6E3 155.0854 1.8E4 157.0647 9.9E5 159.0440 1.0E5 160.0518 3.8E4 161.0437 5.2E3 161.0597 5.7E5 161.0754 3.5E3 161.5641 2.8E3 166.1227 2.3E4 167.1137 5.6E3 167.1304 6.9E5 167.1460 1.4E4 169.0654 1.2E4 171.0805 5.2E5 172.0524 1.7E4 173.0598 5.4E5 173.0962 6.6E4 173.5213 2.5E4 173.5366 8.0E4 175.0376 3.1E3 175.0756 3.0E4 180.1384 2.8E4 181.0648 1.5E5 183.0801 6.1E3 184.8903 2.6E3 185.0450 2.2E3 185.0597 3.6E5 185.0789 5.4E3 187.0362 9.3E3 187.0451 6.2E3 187.0558 4.0E3 187.0754 4.1E6 187.0951 7.9E3 187.1147 1.8E4 189.0910 1.4E4 199.0753 2.4E5 201.0548 1.2E5 201.0911 3.4E5 203.1077 9.5E3 211.0756 1.1E5 217.0857 6.5E3 218.1283 2.4E3 229.0860 5.6E5 236.5901 2.5E3 272.0899 2.5E3 302.1754 1.8E5 END IONS BEGIN IONS FEATURE_ID=579 PEPMASS=731.2105 SCANS=579 RTINSECONDS=642.39 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 4 (1 removed due to low quality, 0 removed due to low cosine). 71.1596 2.6E3 71.5777 2.3E3 82.7433 2.5E3 83.3424 2.3E3 89.3388 2.3E3 94.8337 2.1E3 101.9433 2.3E3 123.9065 2.5E3 128.2958 2.2E3 131.8024 2.4E3 135.0432 4.0E3 135.3118 2.8E3 140.2057 3.0E3 141.1878 2.6E3 146.4109 2.5E3 150.1700 2.6E3 151.4544 2.4E3 159.2485 2.3E3 172.1057 2.5E3 173.5238 3.8E4 173.5415 3.6E4 173.5599 2.6E3 174.0391 2.3E3 176.9782 2.8E3 218.4304 2.3E3 253.2195 2.5E3 299.2741 2.3E3 377.0993 4.6E5 377.1511 5.2E3 550.9951 2.7E3 END IONS BEGIN IONS FEATURE_ID=580 PEPMASS=377.1002 SCANS=580 RTINSECONDS=642.564 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 5 (1 removed due to low quality, 0 removed due to low cosine). 52.5857 2.4E3 64.8625 2.5E3 66.4661 2.3E3 82.3327 2.3E3 87.2760 2.5E3 87.7947 2.2E3 87.9036 2.1E3 93.3525 2.2E3 103.8430 2.3E3 117.0936 2.7E3 127.7168 2.7E3 137.5672 2.9E3 146.1490 2.4E3 151.7856 2.5E3 152.2966 2.3E3 161.6613 2.4E3 164.1252 2.2E3 173.5228 2.6E4 173.5335 8.9E4 173.5431 1.7E4 183.7318 2.6E3 216.1148 3.0E3 253.4881 3.2E3 284.9853 2.3E3 314.3392 2.3E3 325.7007 2.5E3 363.4915 2.8E3 377.0980 8.7E3 END IONS BEGIN IONS FEATURE_ID=581 PEPMASS=355.1176 SCANS=581 RTINSECONDS=642.588 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 6 (1 removed due to low quality, 0 removed due to low cosine). 51.0236 1.6E4 53.0386 2.8E3 54.0134 2.2E3 60.5581 2.5E3 61.7919 2.3E3 63.0238 2.9E3 64.8120 2.5E3 66.5046 2.1E3 73.0284 2.5E3 73.0986 2.2E3 77.0389 5.1E4 78.0464 2.7E4 79.0495 4.8E3 79.0540 9.9E4 79.9844 2.4E3 80.5396 2.5E3 91.0542 9.1E3 93.8871 2.3E3 95.0491 6.4E4 95.1140 2.3E3 97.5404 2.4E3 103.0541 2.6E5 105.0333 3.9E4 105.0446 2.3E4 105.4889 2.9E3 106.0411 1.4E4 107.0491 8.9E4 113.9639 3.7E3 115.0544 1.6E4 117.0691 3.2E3 119.0491 5.8E4 123.0437 5.3E3 129.0699 4.6E4 131.0262 6.8E3 131.0491 3.0E6 131.0602 3.1E4 131.0724 8.8E3 131.0854 4.0E3 132.0532 4.1E4 133.0646 4.8E4 134.0365 3.5E4 134.9990 3.8E3 135.0127 1.1E4 135.0197 9.7E4 135.0249 3.2E4 135.0440 1.6E7 135.0539 5.0E4 135.0634 3.4E4 135.0676 2.0E5 135.0772 3.3E4 135.0815 8.2E3 136.0482 3.0E5 137.0557 8.3E4 142.3143 2.7E3 143.0491 3.3E4 144.0524 3.7E3 145.0648 1.9E4 146.0367 8.0E3 146.0687 2.4E3 147.0440 1.8E5 148.0518 1.7E4 149.0234 8.7E4 149.0363 3.3E3 149.0596 2.7E5 151.0393 2.9E3 151.6838 2.6E3 157.0648 1.2E5 159.0442 6.8E4 159.6097 2.6E3 160.0518 2.3E4 160.3651 2.3E3 161.0597 1.4E6 161.0716 3.7E3 161.0753 1.1E4 162.0655 3.0E4 162.1607 3.2E3 163.0389 1.3E5 163.0713 2.0E4 165.0547 5.0E3 167.0320 2.7E3 173.0599 4.8E5 173.0766 4.4E3 173.5296 7.0E4 173.5441 5.4E3 174.0635 1.0E5 175.0390 8.9E4 175.0762 3.2E3 176.0470 2.3E5 177.0547 1.5E5 183.5581 2.4E3 185.0602 3.2E4 187.0755 2.1E5 188.0795 1.0E4 189.0547 1.5E5 189.0722 4.5E3 192.0415 1.2E4 193.0455 1.8E4 197.0595 2.3E4 201.0547 4.7E4 202.0608 1.1E4 202.0784 2.7E3 203.0857 3.2E5 205.1018 3.9E3 207.0607 3.1E3 214.8733 2.0E4 215.0706 1.2E5 217.0487 2.9E3 218.0578 3.6E4 218.8683 2.1E4 219.0615 3.1E4 220.2050 2.8E3 221.0957 4.5E4 231.0535 1.4E4 231.0806 6.6E5 231.1073 9.4E3 233.0974 1.1E4 235.0751 3.6E3 241.0653 4.3E3 242.8684 2.8E3 246.0667 4.2E3 247.0759 9.9E3 249.0912 5.7E4 251.1067 3.0E3 258.8625 5.2E3 259.0754 2.5E5 260.0829 3.2E3 261.0910 1.2E6 261.1234 1.4E4 271.0757 5.1E4 274.0616 2.3E3 276.1136 2.3E3 277.0860 7.9E3 279.1012 2.9E4 288.0777 4.6E3 289.0471 2.8E3 289.0863 7.9E5 289.1169 3.4E3 290.8881 6.5E3 304.0741 5.7E3 307.0943 7.5E3 308.9004 7.4E4 319.0969 1.4E5 330.6013 2.6E3 337.1072 3.4E4 340.0949 9.9E3 355.1179 6.9E4 END IONS BEGIN IONS FEATURE_ID=582 PEPMASS=337.1076 SCANS=582 RTINSECONDS=642.903 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 2 (0 removed due to low quality, 0 removed due to low cosine). 81.9063 3.2E3 88.8872 2.2E3 89.9419 2.2E3 98.7078 2.4E3 103.0539 3.1E4 104.4507 2.7E3 107.0489 1.0E4 110.5061 2.8E3 112.4717 2.3E3 119.0490 4.6E3 129.5287 2.5E3 131.0488 4.1E5 131.0577 4.5E3 133.0648 4.3E3 135.0437 1.7E5 135.0558 3.2E3 147.0437 2.5E4 149.0591 1.1E4 159.0429 3.0E3 161.0442 4.8E3 161.0594 2.2E5 163.0389 1.9E4 173.0594 5.6E3 173.5252 2.4E4 173.5439 1.1E4 175.0388 1.5E4 176.0466 3.8E4 177.0544 2.8E4 187.0742 3.2E3 189.0547 5.5E3 203.0852 1.9E4 231.0800 4.6E4 240.0097 2.4E3 249.0897 4.0E3 258.4724 2.2E3 259.0746 1.7E4 261.0903 1.3E5 261.8389 2.5E3 268.4039 2.3E3 268.4379 2.7E3 279.1013 3.9E3 289.0858 1.1E5 293.3932 2.5E3 307.0948 3.0E3 319.0958 3.1E4 337.1069 2.2E4 END IONS BEGIN IONS FEATURE_ID=583 PEPMASS=237.1851 SCANS=583 RTINSECONDS=644.48 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 43.0177 9.4E4 51.9399 9.8E3 55.0178 2.8E3 55.0540 4.3E4 55.9342 2.1E4 56.0494 1.2E4 57.0331 2.7E3 57.0698 2.3E4 59.0490 1.1E4 59.5154 2.2E3 64.0322 2.4E3 64.4562 2.4E3 67.0539 2.8E4 69.0333 8.9E3 69.0696 6.9E4 71.0488 2.2E5 73.8409 2.9E3 79.0541 1.9E4 81.0696 9.4E4 81.5711 2.4E3 83.0489 2.4E4 83.0853 3.4E4 83.2657 2.4E3 84.1174 2.3E3 85.0644 1.9E4 91.0541 1.3E4 93.0695 7.8E4 95.0491 5.4E3 95.0852 1.2E5 97.0645 1.8E4 97.1007 2.6E3 99.0437 4.1E4 100.6848 2.7E3 101.0595 6.6E3 101.7968 2.9E3 105.0697 5.3E4 107.0852 8.7E4 109.0646 2.5E4 109.1009 6.8E4 111.0801 2.6E4 119.0852 7.7E4 121.1008 7.2E4 123.0801 6.2E4 123.1165 4.4E4 123.7116 2.4E3 126.9721 2.7E3 131.0856 2.9E3 131.9510 2.8E3 133.1010 2.9E4 135.1167 3.2E4 135.7165 2.7E3 137.0954 1.2E4 137.1323 1.4E4 141.5834 2.4E3 145.1010 1.4E4 147.7081 2.5E3 149.0962 2.8E3 149.1322 1.2E4 151.1114 2.4E5 151.1483 8.9E3 159.1167 3.1E4 161.1323 7.8E4 163.1094 2.6E3 163.3782 2.4E3 167.1429 4.9E4 169.9336 6.2E3 173.5232 2.0E4 173.5411 2.4E4 175.1501 2.6E3 179.1429 3.0E5 183.9120 5.4E3 185.9288 2.4E3 194.3974 3.1E3 201.1642 2.9E3 217.6479 2.4E3 239.4211 3.1E3 242.5972 2.3E3 END IONS BEGIN IONS FEATURE_ID=584 PEPMASS=354.1099 SCANS=584 RTINSECONDS=645.587 CHARGE=1+ MSLEVEL=2 MERGED_STATS=1 / 4 (3 removed due to low quality, 0 removed due to low cosine). 77.0388 4.1E3 78.0414 5.4E3 78.0463 1.0E5 78.0509 2.1E3 78.3582 2.5E3 79.0541 1.2E4 91.0541 3.0E3 95.0490 8.3E3 103.0541 4.2E4 104.0619 2.8E4 105.0334 5.7E3 106.0335 4.8E3 106.0412 7.9E4 107.0493 4.7E3 115.0542 1.4E4 117.0696 1.6E4 119.0489 1.2E4 122.0361 1.0E4 124.0517 2.7E4 130.0412 1.6E4 131.0490 2.8E5 131.0578 4.8E3 132.0467 3.6E3 132.0567 4.6E4 132.7080 2.8E3 133.0648 3.9E3 135.0196 1.5E4 135.0439 2.4E6 135.0632 1.8E4 135.0680 1.9E4 135.0748 7.1E3 136.0517 6.0E5 137.0598 3.2E3 143.0489 4.7E4 144.0570 6.9E3 145.0648 1.1E4 146.0370 2.5E3 147.0442 9.6E3 148.0517 7.4E4 149.0595 3.8E4 151.0390 5.6E3 157.0647 7.3E3 159.0439 8.3E3 160.0192 2.3E3 160.0517 1.1E5 161.0441 4.1E3 161.0595 1.2E5 161.1881 2.4E3 162.0674 1.5E5 162.0830 4.5E3 163.0382 2.8E3 171.0446 5.0E3 172.0520 7.1E3 173.0596 5.1E5 173.5203 5.8E3 173.5383 1.2E4 174.0671 1.2E4 175.0387 1.3E4 176.0458 2.5E3 177.0541 7.3E3 186.0673 1.5E4 187.0753 5.9E4 187.9504 2.7E3 188.0464 8.2E3 188.0830 3.7E3 189.0545 2.0E4 191.0339 9.6E3 191.0699 7.8E3 192.0415 9.9E4 201.0544 3.4E4 205.0494 2.0E4 206.0571 2.6E4 218.0573 1.1E5 219.0651 2.5E4 232.0719 7.3E3 252.0783 3.7E3 253.0806 4.5E3 281.0803 3.4E3 283.0922 6.5E3 305.1115 3.7E3 326.0882 2.8E3 END IONS BEGIN IONS FEATURE_ID=585 PEPMASS=337.1075 SCANS=585 RTINSECONDS=645.762 CHARGE=1+ MSLEVEL=2 MERGED_STATS=9 / 12 (3 removed due to low quality, 0 removed due to low cosine). 50.0160 2.2E3 51.0232 6.1E3 51.8158 2.3E3 52.5130 2.2E3 53.0386 1.1E4 53.6885 2.2E3 54.4409 2.3E3 55.0178 2.2E4 60.3941 2.4E3 62.4067 2.2E3 63.2798 2.1E3 65.0384 9.7E3 65.2743 2.2E3 67.8290 2.6E3 67.8582 2.5E3 69.4373 2.1E3 71.0490 3.6E5 73.4173 2.5E3 77.0387 2.0E4 79.0541 1.0E5 79.0901 2.2E3 84.1155 3.2E3 84.9319 2.4E3 88.5783 2.5E3 91.0542 4.3E4 93.0334 1.2E4 93.1611 2.6E3 93.6506 2.6E3 95.0490 4.1E4 95.4043 2.3E3 100.5360 2.5E3 102.3665 2.2E3 103.0541 1.6E5 105.0334 2.6E4 105.0445 9.5E3 107.0491 7.6E4 111.0439 5.2E4 112.1137 2.3E3 115.0542 4.7E4 116.9828 2.3E3 117.0698 3.4E4 119.0490 8.8E4 123.0439 6.0E4 124.4799 2.4E3 125.6146 2.6E3 127.0553 6.2E3 128.0622 1.8E4 129.0698 5.2E5 131.0261 3.1E3 131.0491 2.1E6 131.0668 5.7E3 131.0724 8.8E3 131.0854 2.4E4 132.0574 2.9E3 133.0283 1.6E5 133.0646 2.9E4 134.4385 2.7E3 135.0316 3.1E3 135.0440 5.9E6 135.0559 3.0E3 135.0680 2.5E4 137.0595 1.2E4 139.0547 1.1E4 143.0491 8.6E4 145.0647 5.7E4 146.0362 7.4E3 147.0440 3.0E5 149.0233 1.1E5 149.0327 2.2E3 149.0459 6.5E3 149.0596 4.6E5 149.0699 2.1E3 149.2235 2.2E3 151.0389 9.5E4 153.0697 3.3E4 153.6330 2.8E3 155.0486 7.4E3 155.0840 2.7E3 155.1261 2.4E3 157.0526 2.6E3 157.0648 6.2E5 157.0762 2.3E3 159.0440 1.1E5 159.0806 2.5E3 160.4658 2.4E3 161.0438 4.6E3 161.0596 1.2E6 163.0390 2.2E5 165.0549 2.5E4 165.0706 2.5E3 167.0494 4.0E4 172.0521 3.8E4 173.0598 7.1E5 173.0768 4.3E3 173.5274 7.0E4 173.5388 3.1E4 173.5431 5.4E3 174.0677 8.2E4 175.0390 2.7E5 175.0756 8.9E4 176.0469 1.9E5 176.0647 4.1E3 177.0548 2.9E5 178.0818 2.7E3 181.0650 4.5E4 182.8700 2.8E3 185.0398 5.5E3 185.0598 2.2E6 185.0790 5.0E3 185.0987 3.6E3 187.0575 8.9E3 187.0755 7.1E5 187.0950 1.2E4 189.0545 9.4E4 189.0710 4.0E3 190.0782 1.6E4 191.0856 7.5E4 191.1458 2.6E3 192.9121 2.3E3 193.1013 2.7E4 196.0269 2.4E3 197.0597 3.8E5 201.0540 2.0E4 201.0736 2.8E3 202.0789 5.6E4 203.0664 3.2E3 203.0856 9.8E5 203.1061 6.8E3 205.0653 3.5E4 205.1012 6.1E4 206.0729 3.2E3 206.8045 2.6E3 207.0815 8.2E3 209.0598 7.8E5 210.0674 6.2E3 211.0757 6.5E4 211.3966 2.4E3 213.0714 1.3E4 215.0465 1.6E4 215.0704 7.0E5 215.0918 9.8E3 217.0641 2.7E3 218.0726 4.5E4 219.0560 3.4E3 219.0806 4.7E5 221.0599 6.1E3 221.0963 1.3E5 222.0685 1.8E4 223.0756 4.7E4 225.0548 7.7E4 231.0537 9.3E3 231.0805 1.9E6 231.1076 1.2E4 231.2829 2.6E3 232.8688 1.1E4 233.0600 5.0E4 233.0962 1.3E5 233.6464 2.6E3 234.0680 1.7E4 235.0754 2.0E5 237.0258 4.1E3 237.0547 9.3E5 237.0950 6.3E3 238.0625 1.7E4 239.0705 7.0E4 241.0650 2.4E4 242.0736 3.3E3 243.0803 3.6E4 246.0676 2.8E5 247.0754 3.7E5 247.1035 9.5E3 248.0829 3.1E4 248.3305 2.7E3 249.0603 1.6E4 249.0911 8.3E5 249.1206 1.1E4 250.6301 2.6E3 251.0700 4.7E4 251.1064 6.8E4 253.0498 3.0E4 258.0674 2.5E3 259.0753 6.5E5 259.1065 8.9E3 260.0836 3.2E4 261.0611 2.0E4 261.0908 2.9E6 261.1239 1.1E4 262.0624 2.2E5 262.0939 2.4E3 263.0703 1.6E5 263.1062 9.6E4 264.0790 1.3E4 265.0508 3.7E3 265.0847 1.3E4 266.0234 1.6E4 266.0574 1.9E6 266.0899 5.8E3 267.0651 1.6E6 267.0986 5.5E3 271.0755 1.0E5 272.0832 1.5E4 273.0909 5.0E4 274.0625 3.9E5 275.0017 3.0E3 275.0704 3.3E4 276.0782 7.5E4 277.0861 9.7E5 279.0282 3.2E3 279.0655 7.7E5 279.1006 1.2E5 280.0735 5.5E4 280.4632 2.3E3 281.0804 3.0E4 288.0774 2.4E4 289.0470 5.1E3 289.0574 1.1E4 289.0861 3.3E6 290.0577 1.1E5 290.0928 1.2E4 291.0654 1.2E5 291.1016 3.2E4 292.0733 1.1E5 293.0810 1.9E5 294.0899 8.8E3 295.0654 2.9E3 299.1973 2.5E3 303.0654 1.6E5 304.0732 4.5E5 305.0793 2.7E3 306.0887 4.0E4 307.0968 1.2E5 309.1118 1.9E4 317.0790 4.0E3 319.0966 4.5E5 322.0477 6.6E3 337.0669 3.5E3 337.1072 1.3E5 341.9952 2.6E3 END IONS BEGIN IONS FEATURE_ID=586 PEPMASS=319.0970 SCANS=586 RTINSECONDS=647.269 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 3 (1 removed due to low quality, 0 removed due to low cosine). 51.5691 2.3E3 62.9157 2.1E3 64.1870 2.2E3 66.7276 2.4E3 74.7658 2.7E3 83.0697 2.2E3 103.1584 2.6E3 108.2978 2.6E3 109.3777 2.7E3 135.0439 1.3E4 147.0441 3.7E3 150.2462 2.3E3 163.0708 3.7E3 173.5265 1.5E4 173.5414 7.5E3 179.0661 3.0E3 190.0615 1.9E4 191.0333 2.4E3 191.0658 3.7E4 192.0374 5.7E3 192.0751 3.3E3 193.0856 1.4E4 194.0891 2.5E4 202.0790 3.9E3 203.0853 6.9E4 205.1008 1.0E4 206.0574 5.5E3 207.0609 1.2E4 215.0858 6.4E3 218.0727 4.3E3 219.0799 2.8E3 221.0808 4.1E4 222.0842 8.9E4 225.9976 2.6E3 231.0804 1.4E5 233.0962 1.9E4 235.0752 2.4E4 241.5190 2.6E3 245.4857 2.4E3 246.0672 2.5E4 247.0760 3.7E3 248.0839 3.7E3 259.0752 3.6E4 261.0583 5.2E3 261.0907 1.6E5 261.2159 2.3E3 263.0744 5.1E3 263.1064 3.2E4 271.0765 4.4E3 273.0906 1.1E4 274.0623 3.2E4 276.0784 2.7E3 284.4814 2.6E3 289.0861 1.4E5 289.1219 3.1E3 290.0577 2.5E4 291.0651 2.6E4 291.1008 1.1E4 293.8459 2.3E3 303.0651 2.5E4 304.0731 3.3E4 319.0965 4.5E4 319.1336 2.5E3 END IONS BEGIN IONS FEATURE_ID=587 PEPMASS=353.1023 SCANS=587 RTINSECONDS=647.645 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 2 (0 removed due to low quality, 0 removed due to low cosine). 54.9983 2.1E3 56.7325 2.3E3 67.5334 2.1E3 77.0385 2.3E3 79.0538 2.4E3 86.3703 2.8E3 96.5419 2.4E3 117.0695 3.7E3 117.8545 2.5E3 135.0437 9.2E5 135.0527 1.5E4 136.0527 3.1E3 139.0018 2.6E3 143.0489 2.2E4 149.0230 1.0E5 149.0367 2.7E3 149.6855 4.7E3 149.6955 3.8E3 151.0748 1.8E4 157.0645 2.9E3 173.0596 4.1E4 173.5251 4.6E3 173.5376 4.6E3 177.0932 2.4E3 187.0751 3.9E3 188.0829 1.1E4 189.0917 2.6E3 201.0550 1.6E4 201.0909 3.2E4 203.0706 1.5E4 203.1064 1.1E4 231.1020 9.7E3 246.1037 3.0E3 252.0777 2.1E4 260.9713 2.4E3 267.0654 8.7E3 268.0728 1.8E4 273.0902 3.2E3 274.0989 4.5E3 277.1218 9.1E3 282.0890 2.9E4 283.0968 9.8E3 289.0860 9.5E3 290.0940 8.0E3 292.1097 7.8E3 293.1168 4.8E3 295.0959 6.5E3 303.1031 5.7E3 304.1098 2.1E4 305.0804 8.2E3 305.1161 1.0E4 308.1046 1.4E4 320.1045 6.9E3 323.0904 1.3E4 353.1020 3.3E3 END IONS BEGIN IONS FEATURE_ID=588 PEPMASS=257.1150 SCANS=588 RTINSECONDS=652.045 CHARGE=1+ MSLEVEL=2 MERGED_STATS=14 / 14 (0 removed due to low quality, 0 removed due to low cosine). 45.9153 2.1E3 45.9683 2.3E3 47.4723 2.4E3 47.8131 2.6E3 48.1540 2.3E3 49.3306 2.4E3 49.4842 2.1E3 50.3143 2.2E3 50.3232 2.2E3 50.6167 2.4E3 51.0880 2.3E3 51.2938 2.2E3 52.5852 2.1E3 52.8698 2.3E3 54.3412 2.3E3 55.1663 2.3E3 56.0876 2.5E3 56.1703 2.1E3 56.3955 2.5E3 59.2415 2.8E3 59.8707 2.1E3 60.4795 2.4E3 60.7311 2.6E3 60.8334 2.3E3 61.4622 2.3E3 61.6807 2.3E3 63.2371 2.1E3 65.9281 2.7E3 66.1473 2.2E3 66.7638 2.2E3 67.7939 2.5E3 69.4894 2.7E3 69.8553 2.7E3 71.7129 2.0E3 73.0280 8.5E3 73.1078 2.2E3 73.7255 2.3E3 73.8392 2.3E3 76.5023 2.2E3 76.9608 2.6E3 77.4736 2.2E3 77.5565 2.2E3 80.9225 2.4E3 82.0742 2.8E3 82.7852 2.5E3 83.0509 2.2E3 83.8404 2.4E3 92.5441 2.6E3 93.1947 2.3E3 93.8061 2.7E3 95.3515 2.4E3 96.2966 2.2E3 103.0471 2.4E3 103.4939 2.8E3 104.2158 2.5E3 106.7067 2.3E3 109.1022 2.3E3 110.2026 2.6E3 110.5622 2.5E3 115.6469 2.4E3 119.2913 2.4E3 127.4047 3.1E3 130.8733 2.2E3 132.2076 2.3E3 135.1766 2.9E3 146.9007 2.7E3 147.6447 2.7E3 149.9291 2.8E3 151.6771 2.2E3 152.6710 2.2E3 153.6455 2.2E3 159.9459 2.7E3 166.0191 2.3E3 169.4611 2.3E3 171.0858 2.5E3 171.8957 2.4E3 173.5287 1.5E5 173.5429 2.6E4 181.3611 2.4E3 189.3435 2.4E3 193.4830 2.4E3 204.2329 2.7E3 205.8809 1.1E4 207.2336 2.3E3 209.8600 2.6E3 211.1134 2.6E3 214.9753 2.8E3 215.0393 2.3E3 221.4903 2.3E3 222.4696 2.7E3 230.2893 2.5E3 230.9701 2.5E3 239.1054 6.2E3 242.2967 2.2E3 256.6807 2.1E3 257.1149 2.4E4 257.1513 1.1E4 257.2652 4.0E3 END IONS BEGIN IONS FEATURE_ID=589 PEPMASS=235.1332 SCANS=589 RTINSECONDS=652.167 CHARGE=1+ MSLEVEL=2 MERGED_STATS=14 / 16 (2 removed due to low quality, 0 removed due to low cosine). 43.0177 1.3E5 44.4674 2.8E3 46.3614 2.6E3 48.0420 2.2E3 49.3735 2.8E3 55.0176 4.2E3 55.0540 5.7E4 55.4507 2.5E3 56.4850 2.5E3 57.0332 8.5E3 57.0698 4.1E6 57.0730 1.4E4 57.0746 7.8E3 57.0764 6.7E3 59.0490 2.9E3 59.2630 2.5E3 60.2128 2.5E3 60.4482 2.2E3 60.6886 2.2E3 60.8507 2.4E3 64.0436 2.1E3 65.8443 2.3E3 67.0541 4.3E3 67.3144 2.5E3 67.5494 2.4E3 69.0333 2.8E3 69.0695 7.4E3 73.0281 8.9E4 74.0315 1.6E4 77.3142 2.5E3 79.0538 2.9E4 80.5041 2.7E3 80.9819 2.5E3 81.0696 1.2E4 82.6810 2.2E3 83.0487 2.2E4 84.4789 2.1E3 86.0190 2.3E3 87.4038 2.3E3 91.0540 2.4E4 91.5623 2.2E3 93.0697 4.9E4 94.5798 2.3E3 94.7950 2.1E3 95.0489 1.5E4 95.0855 1.7E4 96.0532 2.7E3 97.0648 2.9E3 99.0434 2.5E3 99.7592 2.3E3 103.1818 2.3E3 103.9727 2.3E3 105.0697 5.8E4 105.5589 2.2E3 105.6996 2.2E3 106.5182 2.9E3 107.0488 2.2E4 107.0854 2.3E4 107.3237 2.3E3 108.7492 2.7E3 109.0647 1.3E4 109.8068 2.4E3 111.0799 3.1E4 113.4778 2.3E3 114.1008 2.2E3 118.6914 2.6E3 119.0851 5.1E4 119.3531 2.1E3 121.0645 3.2E4 121.1009 3.4E4 123.0437 2.4E5 123.0803 2.0E4 124.6695 2.2E3 125.0052 2.6E3 130.2565 2.4E3 131.0856 2.5E3 131.2183 2.5E3 133.0646 6.1E4 133.1009 1.5E4 135.4389 2.5E3 135.8453 2.5E3 137.0598 9.5E3 137.0958 1.7E4 139.0447 2.2E3 141.0542 2.8E3 145.0643 2.6E3 145.1011 2.7E3 145.5687 2.4E3 147.0803 6.6E4 149.0961 3.1E4 149.1313 2.3E3 150.2971 2.7E3 151.0752 3.1E5 152.0789 1.6E4 153.0802 2.2E4 153.4896 2.6E3 154.8222 2.7E3 159.0800 1.4E4 159.5337 2.2E3 161.0361 2.8E3 161.0456 4.1E3 161.0595 4.8E5 161.0960 2.3E4 161.1327 1.5E4 162.0674 1.8E5 163.0754 6.4E3 165.0908 3.1E4 165.8491 2.4E3 166.6477 2.5E3 169.7906 2.4E3 171.1164 4.9E3 173.0958 6.8E3 173.5267 5.4E4 173.5375 8.8E4 174.1040 2.7E4 175.0754 1.2E5 175.1119 4.9E4 176.6663 2.2E3 177.0924 3.1E3 179.0702 5.8E5 179.1069 4.8E4 179.1427 3.6E3 180.0779 1.1E5 181.0251 2.5E3 189.0917 9.2E3 189.1273 1.2E5 189.7831 2.3E3 193.0857 2.4E4 193.1212 5.6E3 199.1131 3.0E3 202.0987 3.0E4 207.1370 8.2E3 208.2127 2.1E3 215.3935 2.7E3 217.1224 3.8E4 218.0522 2.3E3 235.1330 2.2E4 235.1693 2.4E4 235.2053 7.2E3 235.6279 2.3E3 236.5941 2.3E3 238.7010 2.7E3 242.5287 2.5E3 243.3119 2.5E3 END IONS BEGIN IONS FEATURE_ID=590 PEPMASS=353.2689 SCANS=590 RTINSECONDS=664.859 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 51.1580 2.5E3 53.9382 2.0E3 55.0179 2.0E3 55.0540 4.7E4 57.0332 3.6E4 57.0697 2.4E4 65.0383 2.9E3 67.0539 3.4E5 69.0696 6.4E4 71.0489 1.1E4 71.0854 8.4E3 75.0436 3.0E3 77.3159 2.2E3 79.0539 1.4E5 80.2231 2.4E3 80.2588 2.2E3 81.0696 4.6E5 81.0777 3.3E3 83.0488 5.9E3 83.0851 4.8E4 85.0645 1.5E4 91.0540 6.0E4 91.9528 2.1E3 93.0695 2.4E5 93.0766 3.7E3 95.0493 2.5E3 95.0852 3.9E5 97.0644 1.7E4 97.1011 1.5E4 99.0801 5.6E3 105.0695 6.1E4 107.0773 4.5E3 107.0852 2.0E5 109.0646 9.8E3 109.0928 4.2E3 109.1008 2.3E5 110.0984 2.5E3 111.0801 1.1E4 114.0799 2.2E3 117.0694 3.5E4 118.2054 2.3E3 119.0852 7.0E4 121.1008 2.0E5 123.0801 3.3E3 123.1165 1.1E5 126.1464 2.8E3 131.0852 9.6E4 132.7263 2.4E3 133.0921 2.8E3 133.1009 7.5E4 135.0437 5.4E4 135.0797 2.3E3 135.1165 1.7E5 137.0960 5.3E3 137.1322 2.7E4 139.1120 3.9E3 144.6595 2.8E3 145.1010 7.3E4 147.1165 6.9E4 149.1322 1.1E5 151.0751 1.6E4 151.1108 3.2E3 151.1481 4.6E3 157.0638 2.6E3 159.1166 7.2E4 161.1321 5.3E4 163.1480 5.7E4 173.0598 3.0E3 173.1325 7.4E4 173.5221 1.5E4 173.5354 4.8E4 175.1480 1.5E4 177.1275 2.7E3 177.1639 1.7E4 184.2542 2.6E3 187.1479 4.2E4 189.1620 2.5E3 199.0761 2.9E3 201.0911 2.5E4 201.1636 1.0E4 205.1574 2.5E3 210.7473 2.5E3 224.7777 2.4E3 231.0985 3.8E3 233.2267 1.0E4 243.2104 4.3E4 246.1033 2.7E3 252.0785 1.8E4 253.1242 2.9E3 261.2211 1.2E5 267.0651 7.4E3 268.0730 1.2E4 277.1227 2.9E3 282.0893 1.7E4 283.0955 4.3E3 289.0867 6.6E3 295.0956 1.0E4 304.1092 1.7E4 305.1168 3.4E3 320.1027 5.8E3 335.2583 2.6E3 END IONS BEGIN IONS FEATURE_ID=591 PEPMASS=694.4012 SCANS=591 RTINSECONDS=664.859 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 67.0500 3.8E3 67.0541 2.4E5 67.3027 2.1E3 69.0334 1.1E4 69.0697 4.3E4 71.0490 1.5E4 71.0855 7.6E3 73.0282 4.4E4 75.0440 7.3E3 79.0493 4.8E3 79.0541 1.1E5 81.0333 3.8E3 81.0697 4.4E5 83.0242 2.4E3 83.0491 7.1E3 83.0853 5.6E4 85.0224 4.2E3 85.0282 2.5E5 85.0646 2.0E4 90.1923 2.3E3 91.0324 5.0E3 91.0388 2.2E5 91.0541 6.7E4 93.0695 2.0E5 95.0493 4.1E3 95.0784 5.9E3 95.0854 4.4E5 95.0927 3.1E3 97.0283 1.3E5 97.0647 2.4E4 97.1010 3.8E4 98.9332 2.3E3 99.0438 1.4E4 99.0802 2.7E4 105.0697 7.6E4 107.0772 9.3E3 107.0853 2.1E5 109.0644 6.2E3 109.1010 3.2E5 111.0802 1.7E4 111.1165 9.0E3 112.5765 2.4E3 113.0960 8.6E3 115.0387 9.5E3 117.0697 4.4E4 118.7127 2.8E3 119.0854 1.1E5 121.0911 4.2E3 121.1010 3.2E5 123.0802 1.5E4 123.1167 2.0E5 125.0958 2.1E4 127.0388 8.8E4 131.0854 1.2E5 133.1010 1.4E5 135.1064 6.7E3 135.1167 3.4E5 137.0962 2.3E4 137.1323 8.1E4 139.1117 1.9E4 145.0494 1.0E5 145.1011 1.4E5 147.1167 1.5E5 149.0959 7.8E3 149.1324 2.9E5 149.1464 7.2E3 151.1117 2.0E4 151.1479 2.5E4 153.1274 1.8E4 159.1167 1.6E5 159.1317 3.9E3 161.1325 1.6E5 163.0601 3.4E4 163.1121 1.4E4 163.1326 4.4E3 163.1481 1.9E5 165.1275 3.0E4 165.1635 3.0E3 167.1429 3.6E3 173.1326 2.2E5 173.5307 4.7E4 173.5441 5.1E3 175.1482 5.1E4 177.1277 1.9E4 177.1640 7.6E4 179.1433 3.0E4 187.1482 1.5E5 189.1635 8.6E3 191.1431 1.8E4 193.1578 3.5E3 195.1369 6.8E3 201.1639 5.1E4 203.1794 5.6E3 205.1587 1.9E4 215.1802 1.7E4 217.1967 3.8E3 219.1746 1.8E4 223.1687 2.8E3 233.2266 5.2E4 237.1854 2.6E3 243.2108 3.2E5 261.1557 3.4E3 261.2212 1.0E6 261.2545 4.1E3 271.8958 2.4E3 272.2688 2.4E3 279.2325 5.4E4 283.8885 2.3E3 317.2473 5.1E3 335.2585 2.2E5 335.3030 4.5E3 353.2689 4.7E4 387.5933 2.3E3 388.4316 2.6E3 392.8884 2.4E3 593.2225 2.8E3 598.2143 2.5E3 END IONS BEGIN IONS FEATURE_ID=592 PEPMASS=314.1757 SCANS=592 RTINSECONDS=667.062 CHARGE=1+ MSLEVEL=2 MERGED_STATS=1 / 9 (8 removed due to low quality, 0 removed due to low cosine). 55.0177 1.7E5 56.0494 9.8E3 61.9011 5.3E3 67.0542 8.2E3 69.0697 3.2E5 69.0740 8.3E3 70.0650 7.3E3 79.0539 7.7E3 84.0806 5.8E5 84.0863 9.1E3 84.0893 6.9E3 86.0895 2.0E4 86.0962 3.9E6 86.1022 7.1E4 86.1055 6.1E4 86.1083 4.0E4 86.1120 1.9E4 98.0962 1.3E4 103.0540 1.6E4 112.0755 6.5E5 112.0834 7.6E3 115.0545 1.9E4 127.0558 8.0E3 128.0624 4.1E4 128.1069 1.3E4 129.0698 6.0E5 131.0491 9.1E4 131.0858 9.8E3 135.0440 6.6E5 135.0540 1.1E4 140.0947 1.3E4 140.1069 3.4E5 140.1171 5.0E3 143.0491 4.0E4 143.0854 2.5E4 145.0649 1.7E4 153.0699 2.3E4 153.9727 5.5E3 154.1225 5.1E4 155.0867 7.1E3 157.0647 1.2E6 157.0765 1.8E4 159.0440 6.1E4 160.0520 2.1E4 161.0597 9.2E4 163.1967 5.6E3 166.3805 5.7E3 169.0652 1.1E4 171.0806 2.4E5 171.0940 4.1E3 172.0517 1.4E4 173.0599 4.6E5 173.5290 3.3E4 175.0757 1.6E4 181.0648 5.9E4 183.0805 1.7E4 185.0599 3.4E5 185.0753 4.0E3 186.0692 6.0E3 187.0245 1.2E4 187.0358 3.9E4 187.0755 6.0E6 187.1068 4.7E4 187.1148 4.8E4 187.1260 1.7E4 199.0756 1.9E5 201.0551 1.3E5 201.0913 2.8E5 201.1131 1.1E4 211.0757 9.0E4 213.0917 2.3E4 229.0863 8.5E5 314.1757 4.1E4 END IONS BEGIN IONS FEATURE_ID=593 PEPMASS=599.4105 SCANS=593 RTINSECONDS=668.948 CHARGE=1+ MSLEVEL=2 MERGED_STATS=8 / 8 (0 removed due to low quality, 0 removed due to low cosine). 63.2712 2.2E3 64.7301 2.4E3 66.3469 2.5E3 67.0540 4.5E4 67.8198 2.4E3 67.9744 2.6E3 69.0333 3.8E4 69.0695 4.2E4 69.9296 2.2E3 79.0540 4.1E4 79.1254 2.0E3 81.0695 1.2E5 83.0488 6.4E4 83.0852 4.5E4 83.9115 2.2E3 85.0645 3.4E4 85.9933 2.7E3 86.7337 2.7E3 91.0539 4.1E4 91.2999 2.5E3 93.0695 1.7E5 95.0488 8.8E4 95.0852 1.1E5 97.0645 4.5E4 97.4588 2.6E3 102.7623 2.3E3 103.4045 2.6E3 103.6697 2.7E3 104.7556 2.2E3 105.0695 1.4E5 105.2872 2.5E3 107.0852 2.6E5 108.7143 2.2E3 109.0645 5.7E4 109.1009 1.1E5 111.0802 2.1E4 111.1168 2.6E3 113.0957 1.2E4 114.0863 2.3E3 117.0697 8.3E3 118.9788 2.4E3 119.0851 2.3E5 120.2731 2.7E3 121.0644 3.9E4 121.0919 1.1E4 121.1008 3.5E5 123.0801 9.8E4 123.1165 4.0E4 125.0595 3.0E4 125.0958 8.0E4 128.4469 2.2E3 129.0694 6.5E3 131.0852 1.1E5 133.0646 2.1E4 133.0916 2.5E3 133.1008 1.8E5 135.0801 1.1E5 135.1165 9.0E4 137.0595 6.7E3 137.0959 7.3E4 137.1652 2.6E3 139.0751 3.8E4 139.0876 2.8E3 139.1116 1.4E4 141.0705 4.3E3 141.1935 2.2E3 143.0852 1.8E5 144.0931 7.0E4 145.1009 2.2E5 147.0801 1.3E5 147.1164 8.1E4 149.0957 1.0E5 149.1320 1.1E4 151.0751 1.7E5 151.1116 1.0E4 153.0908 3.4E4 155.0849 2.9E4 155.1062 3.3E3 155.1712 2.4E3 156.0932 2.1E4 157.0865 3.0E3 157.1008 2.4E5 158.1091 1.1E4 159.0803 6.4E4 159.1166 1.6E5 160.0887 2.5E3 161.0959 1.1E5 161.1323 7.0E4 163.1114 9.6E4 165.0755 3.9E3 165.0908 4.2E5 167.0892 3.5E3 167.1065 1.5E5 168.0938 5.6E3 169.1012 1.1E5 170.1083 1.2E4 171.0809 2.5E3 171.1167 1.9E5 172.1251 7.7E3 173.0961 5.3E4 173.1323 1.2E5 173.5217 1.4E4 173.5358 1.4E5 173.5448 5.4E3 175.1117 7.0E4 175.1270 2.4E3 175.1482 3.5E4 177.0907 3.8E4 177.1275 2.9E4 179.1058 1.6E4 179.1427 2.6E3 180.0930 4.0E3 181.1010 4.4E4 181.1217 3.0E4 182.1086 9.4E3 183.1167 1.5E5 184.1247 1.3E4 185.0961 1.4E4 185.1325 9.9E4 187.1118 5.5E4 187.1482 4.5E4 189.1272 1.0E5 190.1353 1.8E4 191.1068 1.7E4 191.1433 4.2E4 193.1013 3.1E4 193.1214 1.7E4 194.1096 8.2E3 195.1169 9.3E4 195.1361 1.8E4 196.1246 7.0E3 197.1151 4.4E3 197.1324 1.5E5 198.1039 3.0E3 198.1405 3.5E3 199.1117 5.6E4 199.1481 6.3E4 201.1272 4.2E4 201.1630 1.1E4 203.1072 3.2E3 203.1430 1.9E5 205.1215 5.7E3 206.1099 5.7E3 207.1166 7.7E4 207.1381 1.3E5 208.1248 2.2E4 208.1461 1.5E4 209.0967 2.7E3 209.1324 1.2E5 209.1532 2.1E4 210.1403 4.1E3 211.1117 3.6E4 211.1481 7.0E4 213.1276 4.3E4 213.1633 1.8E4 215.1065 6.5E3 215.1429 4.5E4 217.1226 9.2E3 217.1575 1.5E4 219.1173 7.6E3 219.1393 6.6E3 220.1244 1.4E4 221.1322 7.1E4 221.1537 3.2E5 222.1402 7.0E3 223.1117 9.2E3 223.1482 9.4E4 225.1276 5.3E4 225.1639 5.4E4 226.7487 2.7E3 227.1430 3.6E4 227.1801 1.4E4 229.1223 2.2E4 229.1586 1.1E4 231.1394 6.9E3 233.1324 3.7E4 233.1537 4.2E5 235.1481 6.1E4 236.1544 2.9E3 237.1251 7.2E3 237.1475 7.7E3 237.1670 1.4E4 239.1427 1.9E4 239.1791 1.2E4 241.1582 2.4E4 243.1380 8.0E3 243.1749 3.1E3 245.1306 1.0E4 245.1559 2.6E3 246.1413 6.8E3 247.1471 3.7E4 247.1714 2.1E4 248.1553 8.3E3 249.1296 3.1E3 249.1637 4.1E4 251.1437 2.0E4 251.1792 3.8E4 253.1594 1.5E4 253.1919 3.2E3 255.1752 5.0E3 257.1900 5.8E3 259.1456 1.9E4 259.1720 8.8E3 260.1558 5.3E3 260.5780 2.3E3 260.9742 3.1E3 261.1624 2.4E4 262.7311 2.3E3 263.1465 2.7E3 263.1794 4.4E4 265.1591 1.9E4 265.1937 2.8E3 267.1738 2.1E4 269.1577 6.4E3 269.1899 3.7E4 271.1714 7.9E3 273.1607 9.4E3 273.1873 1.4E4 274.1942 1.6E4 275.1789 1.3E4 277.1584 3.6E3 277.1941 2.9E3 279.1745 3.7E3 281.1903 8.6E4 283.1675 3.0E3 285.1857 3.5E4 286.1934 6.0E4 287.2017 3.7E4 289.1948 2.5E4 291.1745 2.0E4 291.2120 6.9E3 293.1907 1.4E4 295.2065 1.7E4 297.1877 3.3E3 299.2010 4.5E4 307.2069 6.3E3 309.2219 1.2E4 311.2014 1.7E4 312.2085 4.5E4 313.2181 4.3E3 317.1859 2.9E3 325.2168 3.4E3 331.2063 6.4E3 333.2221 1.0E4 337.2150 3.2E3 349.2162 1.9E4 351.2337 7.4E3 352.2404 1.4E4 359.2361 3.8E3 364.2405 3.6E4 365.2481 8.6E3 373.2505 7.8E3 376.0547 2.4E3 377.2464 1.2E4 378.2538 3.0E3 391.2675 3.8E3 402.1107 3.0E3 449.3085 6.4E3 453.8662 2.4E3 471.3291 6.5E3 489.3352 1.5E4 507.3471 1.4E5 509.1846 2.9E3 556.4135 2.5E3 564.5301 2.6E3 581.3879 2.6E3 599.4104 5.3E4 END IONS BEGIN IONS FEATURE_ID=594 PEPMASS=518.3245 SCANS=594 RTINSECONDS=674.84 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 5 (0 removed due to low quality, 0 removed due to low cosine). 60.0804 7.2E4 61.9199 2.2E3 63.4553 2.3E3 64.2335 2.8E3 71.0726 6.1E3 72.6523 2.4E3 76.7497 2.2E3 76.7766 2.6E3 82.3125 2.5E3 82.8902 2.5E3 86.0960 3.8E5 95.0850 2.5E3 98.9842 5.9E3 104.1065 6.3E4 108.1634 2.6E3 124.5662 2.7E3 124.9995 1.7E5 125.3699 2.5E3 155.3001 2.4E3 159.9473 2.4E3 165.7000 2.8E3 173.5209 1.8E4 173.5340 9.7E4 173.5419 9.4E3 173.7021 2.2E3 183.8137 2.6E3 184.0351 1.8E4 184.0733 3.8E6 184.1030 4.9E3 184.1107 5.7E3 184.1701 2.6E3 195.4713 2.4E3 203.4951 2.5E3 212.3172 2.3E3 214.4784 2.1E3 218.9747 2.2E3 234.6160 2.7E3 304.5765 2.4E3 316.2156 2.4E3 329.7106 2.7E3 335.2576 9.5E3 360.2928 2.3E3 474.2836 2.4E3 500.3162 6.1E3 523.5347 2.8E3 END IONS BEGIN IONS FEATURE_ID=595 PEPMASS=398.1758 SCANS=595 RTINSECONDS=681.495 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 4 (2 removed due to low quality, 0 removed due to low cosine). 60.6830 2.1E3 63.0235 2.8E3 64.9220 2.1E3 66.3912 2.6E3 66.5929 2.3E3 77.0389 1.8E4 80.8175 2.1E3 82.0884 2.3E3 91.0535 5.9E3 95.0488 2.4E4 100.3465 2.5E3 102.0464 3.6E3 102.7401 2.4E3 103.0539 8.4E5 103.0618 1.1E4 103.0705 2.9E3 105.0332 9.9E3 105.0447 8.7E3 105.0697 1.0E4 115.9638 1.2E4 129.5988 2.5E3 131.0365 1.2E4 131.0488 7.4E6 131.0609 1.2E5 131.0687 7.2E4 131.0737 4.3E4 131.0788 1.4E4 148.0755 1.1E4 173.5249 1.1E4 173.5342 1.9E4 173.5441 5.7E3 174.0916 1.7E4 191.0854 2.3E5 191.1058 5.2E3 205.0645 3.9E3 205.1014 3.3E3 206.0963 1.2E4 207.0806 2.1E4 217.0636 6.4E3 218.0963 2.8E4 219.0555 5.5E3 219.0804 4.7E5 219.1020 1.1E4 220.0886 2.3E4 233.0977 2.3E3 234.0914 2.0E4 236.0825 4.0E4 236.1071 1.9E5 245.0956 1.6E4 247.0987 1.2E4 250.0863 3.6E3 251.1062 3.2E5 262.0840 3.8E3 263.0953 3.4E3 265.1086 3.8E3 266.1175 1.5E5 267.1165 9.7E3 268.1324 3.4E3 279.0867 2.5E3 281.1327 7.1E3 293.1328 1.8E4 295.1122 2.5E4 303.1176 6.7E3 309.1259 9.5E3 313.2475 2.7E3 321.1272 4.7E4 324.1390 3.5E3 337.1230 8.6E3 338.1547 1.0E4 349.5490 2.6E3 366.1489 1.5E4 377.9515 3.0E3 398.1757 6.3E3 END IONS BEGIN IONS FEATURE_ID=596 PEPMASS=350.2545 SCANS=596 RTINSECONDS=684.766 CHARGE=1+ MSLEVEL=2 MERGED_STATS=97 / 97 (0 removed due to low quality, 0 removed due to low cosine). 51.0275 2.2E3 51.1249 2.7E3 51.2267 2.2E3 51.2934 2.2E3 51.4973 2.4E3 51.5629 2.2E3 51.7031 2.5E3 51.7176 2.3E3 51.9229 2.1E3 51.9600 2.2E3 52.1510 2.0E3 52.4608 2.7E3 52.4983 2.3E3 52.5130 2.4E3 52.7100 2.5E3 52.7312 2.2E3 52.8134 2.1E3 53.1988 2.6E3 53.2339 2.3E3 53.4255 2.5E3 53.4424 2.4E3 53.5173 2.6E3 53.6867 2.7E3 53.7131 2.2E3 53.9858 2.1E3 54.0664 2.7E3 54.0867 2.3E3 54.0976 2.4E3 54.1902 2.3E3 54.2928 2.1E3 54.7351 2.3E3 55.1637 2.3E3 55.2857 2.3E3 55.3614 2.5E3 55.4494 2.3E3 55.5123 2.1E3 55.5441 4.6E3 55.5537 2.4E3 55.5759 2.3E3 55.5910 2.2E3 55.6990 2.4E3 55.7811 2.3E3 55.8598 2.3E3 55.9324 2.4E3 55.9508 2.7E3 56.0041 2.3E3 56.0492 9.5E5 56.0969 2.6E3 56.2281 2.1E3 56.3822 2.5E3 56.4658 2.0E3 56.4936 2.3E3 56.5619 2.6E3 56.6698 2.2E3 57.1699 2.2E3 57.2768 2.1E3 57.3390 2.3E3 57.3550 2.1E3 57.3973 4.7E3 57.4317 2.5E3 57.6277 2.5E3 57.7072 2.7E3 57.7368 2.4E3 57.8697 2.3E3 57.9655 2.2E3 58.2581 2.1E3 58.7666 2.3E3 58.8427 2.5E3 58.8696 2.4E3 59.0312 4.5E4 59.0732 2.4E3 59.1753 2.7E3 59.2001 2.2E3 59.2484 5.0E3 59.3136 2.6E3 59.6234 2.4E3 59.7446 2.0E3 59.9538 4.4E3 60.2302 2.2E3 60.2981 2.2E3 60.3066 2.3E3 60.3821 2.4E3 60.4190 2.6E3 61.0424 2.4E3 61.3106 2.8E3 61.4181 2.3E3 61.4641 2.4E3 61.6291 2.2E3 61.9005 2.2E3 61.9190 2.4E3 61.9729 2.2E3 62.2750 2.3E3 62.3221 2.2E3 62.3536 2.3E3 62.4788 2.5E3 62.6662 2.2E3 62.9896 6.1E3 63.0428 2.2E3 63.3815 2.3E3 63.3999 2.5E3 63.4797 2.5E3 63.5067 2.6E3 63.5916 2.3E3 64.4295 2.1E3 64.5416 2.3E3 64.6268 2.6E3 64.8540 2.1E3 64.9719 2.3E3 65.1410 2.5E3 65.2046 2.3E3 65.9888 2.2E3 66.2394 2.4E3 66.3002 2.5E3 66.5003 2.3E3 66.8850 2.2E3 67.2000 2.3E3 67.2526 2.0E3 67.4283 2.7E3 67.5517 2.4E3 67.7973 2.2E3 68.1427 2.6E3 68.9620 2.3E3 69.1515 2.4E3 69.2848 2.1E3 69.5272 2.6E3 69.6183 2.5E3 69.9043 2.1E3 70.0567 5.0E3 70.0924 2.3E3 70.5454 2.2E3 70.6574 2.4E3 70.9491 2.4E3 71.0952 2.4E3 71.3260 2.2E3 71.4153 2.6E3 71.4524 2.3E3 71.5679 2.3E3 71.6392 2.3E3 71.6887 2.3E3 71.9480 2.3E3 71.9585 2.1E3 72.0836 4.8E3 72.1061 2.5E3 72.2597 2.3E3 72.2689 2.2E3 72.5334 4.9E3 72.5560 3.1E3 73.3527 7.0E3 73.6917 2.2E3 73.8141 2.4E3 73.9598 2.2E3 74.0862 2.5E3 74.2811 2.5E3 74.3225 2.3E3 74.3458 2.3E3 74.8584 2.2E3 74.9507 2.3E3 75.0259 1.7E4 75.0645 2.6E3 75.1686 3.2E3 75.5585 2.0E3 75.6602 2.2E3 76.1172 2.4E3 76.1450 2.2E3 76.1892 2.2E3 76.3601 2.5E3 76.4722 2.4E3 76.6266 2.3E3 76.8053 2.5E3 77.0414 2.6E5 77.2633 2.3E3 77.2937 3.2E3 77.5530 2.2E3 77.7567 2.7E3 78.1204 2.3E3 78.2257 2.3E3 78.3419 2.3E3 78.4693 2.4E3 78.5667 2.6E3 78.5767 2.3E3 78.6688 2.5E3 79.0858 2.7E3 79.1911 2.3E3 79.2776 2.3E3 79.3115 2.3E3 79.7060 2.5E3 79.7907 2.3E3 80.2672 2.1E3 80.5631 2.3E3 81.4355 2.4E3 81.6724 2.6E3 81.6957 2.3E3 82.2124 3.0E3 83.1941 2.3E3 83.5150 2.1E3 83.5283 2.1E3 83.7047 2.3E3 83.8968 2.6E3 83.9311 2.3E3 83.9948 2.3E3 84.0768 4.8E3 84.1451 2.5E3 84.2574 2.3E3 84.3645 2.2E3 84.5035 2.4E3 84.5208 4.4E3 85.0601 2.3E3 85.3998 2.3E3 85.6135 2.2E3 85.8597 2.3E3 85.8842 2.8E3 85.9964 2.3E3 86.0596 1.4E4 86.6927 2.2E3 87.0622 8.3E5 87.5917 2.8E3 87.9027 2.5E3 88.1996 2.2E3 88.5274 2.7E3 88.6852 2.1E3 88.9862 2.8E3 89.0423 2.1E3 89.0592 5.3E3 89.0857 2.1E3 89.4832 2.1E3 89.5350 2.1E3 89.5735 2.5E3 89.5929 2.3E3 89.6431 2.7E3 90.0485 2.6E3 90.1560 2.5E3 90.1805 2.7E3 90.2293 2.5E3 90.5058 2.1E3 90.5714 2.2E3 90.6021 2.3E3 90.6320 2.6E3 90.8805 2.2E3 91.0207 3.3E5 91.0331 2.3E3 91.2357 2.7E3 91.2572 2.3E3 91.4051 2.5E3 91.8754 2.4E3 91.8887 2.4E3 91.9868 2.2E3 92.3771 3.0E3 92.6048 2.5E3 92.7415 2.3E3 92.8874 2.1E3 93.0363 7.6E4 93.0473 2.5E3 94.0061 2.6E3 94.2986 2.8E3 94.3148 2.6E3 94.3671 2.8E3 95.0153 5.2E3 95.2815 2.6E3 95.3942 2.2E3 95.4851 2.4E3 95.8118 2.2E3 95.9227 2.4E3 95.9446 2.2E3 96.0460 2.3E3 96.3373 2.3E3 96.4735 2.2E3 96.6865 2.6E3 97.1395 2.7E3 97.1842 2.4E3 97.9405 2.4E3 98.4566 2.9E3 98.9703 2.2E3 99.0520 2.7E3 99.4814 2.6E3 99.8737 2.3E3 99.9601 2.3E3 100.5336 2.1E3 100.6009 2.2E3 100.6576 2.5E3 101.6400 2.4E3 101.9168 2.1E3 102.3191 2.6E3 103.0571 1.5E4 103.3016 2.5E3 103.5436 2.6E3 104.2626 2.2E3 104.3585 2.3E3 104.4920 2.6E3 104.8192 2.3E3 105.0651 3.2E3 105.0726 4.6E6 105.7120 2.3E3 105.8847 2.2E3 105.8928 2.7E3 106.8574 2.2E3 107.0519 8.2E5 108.8411 3.0E3 109.0312 1.5E6 110.7627 2.6E3 111.0044 2.3E3 111.5475 2.3E3 111.5849 2.9E3 111.7176 2.4E3 111.7604 2.3E3 112.2320 2.4E3 112.5717 2.5E3 112.5918 2.2E3 112.7023 2.3E3 113.3419 2.6E3 113.3536 2.6E3 114.9967 2.4E3 115.0849 6.1E4 115.0934 3.8E6 115.3327 2.4E3 115.6062 2.5E3 116.1616 2.5E3 116.1742 3.0E3 116.3541 2.5E3 116.8701 2.3E3 117.0183 2.4E3 117.0399 2.4E3 117.0727 8.6E4 117.3142 2.5E3 117.5619 2.5E3 117.7728 2.7E3 118.1280 2.2E3 118.2892 2.8E3 118.7143 2.5E3 119.1740 2.2E3 119.4643 2.4E3 119.5025 2.5E3 119.6237 2.2E3 119.9795 2.4E3 120.1135 2.5E3 120.7244 2.8E3 121.0677 6.5E4 121.2368 2.5E3 121.4172 2.4E3 122.0836 2.3E3 122.1878 2.3E3 122.4628 2.2E3 122.5977 2.4E3 123.0470 2.7E3 123.4464 2.7E3 123.4611 2.3E3 123.9896 2.4E3 124.3609 2.3E3 124.4908 2.2E3 125.6551 2.5E3 125.7326 3.0E3 126.0271 2.4E3 126.4038 2.7E3 126.5342 2.6E3 126.5798 2.4E3 126.8078 2.9E3 127.6296 2.4E3 127.9981 2.4E3 128.0884 2.1E4 128.3255 2.7E3 128.7525 2.3E3 128.7633 2.3E3 129.1940 2.6E3 129.5907 2.3E3 130.1660 2.3E3 130.5318 2.3E3 130.7145 2.1E3 130.7590 2.5E3 130.7670 2.8E3 130.7808 2.7E3 131.3939 2.4E3 133.0311 2.3E4 133.0923 4.8E4 133.1040 1.1E7 133.1134 2.7E3 133.1159 2.2E5 133.8331 2.4E3 134.0988 2.2E4 134.2625 2.5E3 135.0732 2.1E3 135.0832 2.1E6 135.0941 4.2E3 135.1898 2.4E3 135.4919 2.6E3 135.6815 2.5E3 135.8719 2.4E3 138.2074 2.4E3 138.2416 2.3E3 138.6322 2.3E3 139.0233 2.2E3 139.3726 2.2E3 139.3871 2.3E3 139.8699 2.3E3 139.9806 2.3E3 140.3524 2.4E3 140.4959 2.6E3 140.5384 2.4E3 140.7359 2.5E3 140.9093 2.7E3 141.2949 2.3E3 141.5041 2.7E3 142.1761 2.4E3 142.4932 2.6E3 142.6451 2.2E3 143.0763 1.1E4 143.0884 3.2E6 143.3034 2.6E3 143.6806 2.3E3 144.0838 5.5E3 144.1198 1.7E4 144.5407 2.4E3 146.8083 2.7E3 148.3837 2.2E3 148.5170 2.3E3 148.6614 2.2E3 149.2744 2.7E3 149.3624 2.6E3 149.6886 4.6E4 149.7513 2.9E3 149.7747 4.7E3 151.1131 4.9E3 152.7621 2.6E3 153.4413 2.9E3 153.4622 2.6E3 154.0868 2.9E3 154.4245 2.4E3 154.5047 3.0E3 154.6857 2.6E3 155.1027 2.4E3 155.5502 2.5E3 155.6146 2.7E3 155.8361 2.6E3 156.1200 3.1E5 157.1033 2.6E3 157.3373 2.3E3 158.0621 2.6E3 159.1379 2.5E3 159.4736 2.3E3 159.6638 2.2E3 160.2652 2.4E3 161.3462 2.5E3 161.6281 2.3E3 163.2483 2.4E3 164.7636 2.3E3 165.6225 2.8E3 166.4516 2.7E3 168.6830 2.5E3 171.1045 1.2E4 171.1197 4.7E6 171.5303 2.5E3 171.5863 2.5E3 172.5585 2.7E3 172.7790 2.9E3 173.2243 2.3E3 173.5051 2.8E3 173.5226 5.8E4 173.5311 9.8E5 173.5413 2.0E5 173.9363 2.4E3 174.5925 2.4E3 174.6660 2.5E3 174.7063 2.6E3 175.4892 2.8E3 176.9658 2.7E3 178.5775 2.4E3 178.9971 2.4E3 179.4331 2.3E3 181.2516 2.5E3 181.4239 2.8E3 181.4551 2.6E3 181.7767 2.5E3 181.8515 2.4E3 182.5751 2.2E3 183.0041 2.5E3 183.6853 2.7E3 183.9302 2.3E3 184.4189 2.4E3 185.4682 3.1E3 186.1413 2.3E3 186.2896 2.7E3 187.2854 2.6E3 187.5785 2.8E3 188.9996 3.1E3 190.8006 2.4E3 191.9689 2.2E3 193.7301 2.9E3 194.2886 2.3E3 195.8554 2.2E3 196.4033 2.3E3 198.2370 2.2E3 199.0003 2.3E3 200.6815 2.6E3 200.8329 2.6E3 200.9635 2.5E3 201.9069 2.2E3 203.6576 2.2E3 204.0699 2.3E3 204.3649 2.3E3 205.4193 2.2E3 205.5362 2.2E3 206.3425 2.3E3 206.9900 2.4E3 207.3632 2.5E3 209.7462 2.3E3 210.4365 2.5E3 211.1646 5.1E3 212.3527 2.6E3 213.5910 2.7E3 215.2634 2.4E3 215.9323 2.4E3 216.0065 2.4E3 217.0353 2.6E3 217.8760 2.4E3 220.1911 2.7E3 220.8910 2.7E3 221.1268 2.9E3 221.5128 2.5E3 222.1603 2.6E3 222.2877 2.7E3 222.7228 2.3E3 223.3657 2.6E3 224.3403 2.4E3 224.4495 2.4E3 225.2272 2.9E3 225.2918 3.0E3 227.5407 2.4E3 228.7254 2.2E3 228.7693 2.4E3 229.7227 2.7E3 229.8704 2.4E3 229.8955 2.5E3 235.2062 2.8E3 236.4811 2.2E3 236.7232 2.3E3 237.4802 2.7E3 237.8376 2.3E3 238.2873 2.5E3 240.2872 2.8E3 240.7946 2.3E3 241.6144 2.5E3 242.5732 2.7E3 244.5068 2.3E3 244.6277 2.7E3 246.8703 2.4E3 247.3424 2.3E3 247.4389 2.5E3 248.5038 2.8E3 248.5459 2.5E3 249.3297 2.5E3 249.5053 2.6E3 249.6656 2.6E3 249.9931 2.5E3 250.8950 2.3E3 250.9384 2.4E3 252.0308 2.5E3 257.0433 2.5E3 257.8768 4.4E4 258.8232 2.6E3 259.2683 2.4E3 261.4128 2.6E3 262.5500 2.8E3 263.8472 2.3E3 268.0580 2.6E3 268.0963 2.2E3 268.7679 2.6E3 269.8347 2.8E3 270.0013 2.2E3 272.1714 2.5E3 274.2411 2.6E3 274.9742 2.4E3 275.8772 2.5E3 276.2070 2.4E3 277.2350 2.2E3 277.6232 3.1E3 279.3319 2.5E3 279.4880 2.4E3 279.5427 2.2E3 279.6365 2.8E3 280.3845 3.1E3 281.0750 2.5E3 284.5066 2.7E3 285.2954 2.6E3 285.8541 2.4E4 286.8210 2.3E3 290.0590 3.0E3 290.5071 2.5E3 290.6596 2.4E3 293.0753 2.4E3 293.3395 2.6E3 296.2132 2.4E3 296.4807 2.7E3 297.9010 2.5E3 300.0857 2.2E3 300.8087 2.4E3 301.2012 2.8E3 303.6741 2.6E3 308.8664 1.2E4 309.0964 2.6E3 311.2056 2.4E3 319.5931 2.4E3 320.3986 2.4E3 320.7358 2.7E3 321.4904 2.4E3 323.2941 2.9E3 323.3368 2.6E3 325.4007 2.6E3 326.9865 2.1E3 327.5533 2.6E3 327.5681 3.0E3 327.6856 2.5E3 328.3119 2.5E3 329.1792 2.6E3 329.8425 2.5E3 331.9803 2.4E3 332.7671 2.6E3 334.4041 2.9E3 335.4877 2.9E3 335.5607 2.3E3 335.7388 2.5E3 337.3741 3.0E3 340.0941 2.8E3 343.8904 2.7E3 349.2422 2.7E3 350.1245 2.5E3 352.4677 2.5E3 357.3807 2.3E3 358.5840 2.5E3 360.4021 2.4E3 END IONS BEGIN IONS FEATURE_ID=597 PEPMASS=299.0920 SCANS=597 RTINSECONDS=699.03 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 8 (5 removed due to low quality, 0 removed due to low cosine). 47.0833 1.1E4 48.6719 1.1E4 51.9165 8.8E3 57.3019 1.0E4 62.0609 1.1E4 64.0161 1.0E4 64.5549 1.0E4 66.0880 9.9E3 66.6513 1.0E4 67.0177 2.0E4 71.0151 1.3E4 73.8699 9.3E3 74.7716 2.1E5 74.7753 5.0E4 76.5144 1.1E4 87.6789 9.5E3 88.7850 1.3E4 98.9609 1.1E4 124.0154 8.7E4 124.0830 9.1E3 133.0647 6.6E5 135.0443 8.1E4 153.1485 1.1E4 159.0439 2.1E5 167.0339 9.8E5 173.5288 1.1E5 173.5387 9.8E4 185.0443 1.1E5 197.0598 4.3E4 201.0544 5.7E4 211.0752 3.5E4 213.0565 2.8E4 213.8484 1.4E4 227.0708 3.5E4 228.0782 1.4E4 239.0705 1.5E5 241.0511 2.8E4 255.0650 1.4E4 256.0728 8.4E6 256.1061 1.9E4 268.0741 2.4E4 270.0852 1.6E4 271.0970 7.0E4 284.0679 1.5E7 284.1426 3.5E4 286.5095 1.1E4 297.0784 4.7E4 299.0112 3.8E5 299.0275 2.9E5 299.0912 6.4E7 299.1530 3.7E5 299.1715 4.6E5 299.1943 1.8E5 299.2167 3.7E4 299.2392 2.1E4 END IONS BEGIN IONS FEATURE_ID=598 PEPMASS=315.0869 SCANS=598 RTINSECONDS=706.703 CHARGE=1+ MSLEVEL=2 MERGED_STATS=8 / 8 (0 removed due to low quality, 0 removed due to low cosine). 48.1964 2.3E3 49.1836 2.4E3 50.2492 2.2E3 51.2008 2.1E3 51.8524 2.6E3 52.5969 2.1E3 52.6758 2.3E3 52.7203 2.6E3 53.4665 2.3E3 53.6624 2.3E3 54.4452 2.2E3 54.6843 2.3E3 57.9510 2.4E3 58.2817 3.1E3 59.0313 2.3E3 66.2115 2.4E3 66.3426 2.5E3 72.7825 2.2E3 73.0279 9.7E3 74.3055 2.6E3 78.7733 3.1E3 84.9593 6.4E3 89.1124 2.4E3 90.8747 2.2E3 91.0536 2.2E3 93.2236 2.3E3 96.1532 2.6E3 97.2818 2.5E3 97.8324 2.1E3 98.0751 2.3E3 102.5436 2.4E3 104.8616 2.4E3 109.0075 2.9E3 109.5634 2.8E3 111.1920 2.7E3 111.8632 2.4E3 121.0643 1.8E4 121.3670 2.5E3 122.2517 2.1E3 126.1442 2.7E3 131.7908 2.7E3 132.8959 2.5E3 134.3795 2.9E3 135.0435 9.8E4 146.0748 2.3E3 147.3432 2.4E3 149.0595 9.4E3 151.0386 1.5E4 153.0541 1.2E5 160.6707 2.8E3 161.0594 3.5E3 162.3875 2.3E3 167.0336 1.2E5 168.5397 2.5E3 170.3310 2.5E3 173.5270 3.5E4 173.5373 8.5E4 176.9006 2.5E3 179.0336 5.9E4 181.4573 2.4E3 183.5353 2.4E3 187.8234 2.4E3 188.4073 2.4E3 194.9108 5.3E3 197.0440 2.4E4 227.0710 4.0E3 231.1553 2.6E3 241.0853 3.2E3 243.0652 1.1E4 244.0725 6.4E4 250.9005 2.3E3 255.0655 1.5E4 256.0737 4.8E3 259.0957 2.9E4 269.0801 2.7E3 271.0607 1.4E4 272.0677 2.4E5 272.6737 2.1E3 283.0599 2.3E4 283.7748 2.6E3 286.0833 4.0E4 287.2388 2.8E3 300.0629 4.6E5 300.1019 4.6E3 308.4360 2.5E3 315.0007 7.1E3 315.0862 3.2E6 315.1306 4.4E3 315.1494 3.2E3 315.1945 3.0E3 323.5969 2.7E3 END IONS BEGIN IONS FEATURE_ID=599 PEPMASS=408.2665 SCANS=599 RTINSECONDS=708.518 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 55.0541 1.3E4 55.7056 2.4E3 58.4270 2.3E3 58.8584 2.2E3 59.8275 2.1E3 60.8224 2.6E3 60.9696 2.3E3 67.0540 2.6E4 69.0332 1.8E4 69.0695 1.7E4 69.1515 2.6E3 70.0306 2.2E3 70.6765 2.1E3 77.6166 2.3E3 77.8262 2.2E3 78.0462 1.8E4 79.0539 2.5E4 80.0619 7.4E3 80.7467 2.5E3 81.0333 3.3E3 81.0695 4.6E4 82.0410 3.7E4 83.0489 3.3E4 83.0853 1.8E4 89.0592 1.2E4 91.0539 3.2E4 93.0695 8.0E4 93.8714 2.3E3 95.0435 2.4E3 95.0488 8.5E4 95.0852 4.6E4 97.0644 2.4E4 98.3559 2.3E3 102.0229 2.3E3 102.7054 2.2E3 105.0695 8.1E4 106.0773 1.3E4 107.0486 3.5E3 107.0783 3.3E3 107.0852 9.9E4 108.0566 8.4E3 108.4047 2.3E3 109.0645 3.4E4 109.1008 2.7E4 111.0797 2.5E3 115.0537 2.9E3 117.0695 5.2E4 119.0851 5.8E4 120.0932 6.1E3 121.0645 4.8E4 121.1009 8.5E4 123.0803 8.0E3 123.1165 9.3E3 125.0957 3.6E4 127.7903 2.4E3 129.0694 2.1E4 130.0773 6.4E3 131.0853 9.0E4 132.0931 8.2E3 133.0643 2.5E4 133.1007 4.1E4 135.0801 2.0E4 139.1120 3.4E3 142.0776 1.3E4 142.1235 2.4E3 143.0851 5.3E4 144.0934 1.5E4 145.0644 5.2E4 145.1009 1.1E5 146.0724 1.4E4 147.0801 5.4E4 147.1161 1.6E4 148.0887 2.4E3 148.9711 2.3E3 149.0958 4.2E4 149.6911 3.6E3 155.0851 1.4E4 156.0930 1.1E4 157.1009 6.2E4 158.0731 2.5E3 158.1088 7.6E3 159.0802 1.4E5 159.1165 5.2E4 160.0882 1.0E4 161.0959 4.2E4 163.1109 1.1E4 165.3541 2.9E3 167.0856 4.7E3 167.1065 5.8E4 167.1640 2.4E3 169.1012 2.9E4 170.1084 4.2E3 171.0802 1.4E4 171.1163 3.5E4 172.0881 3.2E4 173.0959 4.0E4 173.1325 1.2E4 173.5306 4.5E4 173.5471 4.2E3 174.1040 2.7E3 175.1115 1.7E4 181.1014 1.6E4 182.1083 6.3E3 183.1169 1.9E4 184.0881 2.6E3 185.0960 2.3E4 185.1323 1.7E4 186.4283 3.1E3 187.1117 3.9E4 189.1280 7.7E3 191.1071 3.3E3 193.1010 1.9E4 194.1090 7.0E3 195.1174 2.1E4 197.0971 9.8E3 197.1322 2.8E4 199.1123 1.5E4 199.1476 1.0E4 201.1273 1.3E4 202.1343 2.8E3 203.1437 8.1E3 205.1223 1.3E4 207.1170 1.4E4 208.1240 6.5E3 209.0977 4.4E3 209.1327 1.8E4 211.1119 2.2E4 211.1481 1.1E4 213.1274 3.5E4 213.1636 2.7E3 215.1428 1.3E4 220.1458 7.2E3 221.1321 1.2E4 223.1123 2.5E3 223.1475 5.1E3 225.1277 1.8E4 227.1435 1.8E4 228.5742 3.0E3 233.1316 3.5E3 233.1536 6.3E4 235.1118 8.9E3 235.1493 6.2E3 237.1270 7.9E3 239.1430 1.1E4 246.1613 2.7E4 249.1279 2.9E3 253.1580 3.7E3 255.1753 3.4E3 267.1733 3.0E3 271.1683 5.9E3 273.1855 1.1E4 282.9282 2.3E3 285.1851 9.0E4 297.1882 5.9E3 299.2006 1.4E4 335.2020 9.0E3 369.7441 2.7E3 END IONS BEGIN IONS FEATURE_ID=600 PEPMASS=373.2531 SCANS=600 RTINSECONDS=708.639 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 55.0174 2.6E3 55.0540 2.5E4 57.0697 3.0E3 61.0511 2.5E3 65.3253 2.4E3 65.9082 2.5E3 67.0539 4.0E4 68.6233 2.3E3 69.0696 2.6E4 70.0063 2.5E3 73.0822 2.4E3 77.0382 3.5E3 78.5005 2.2E3 79.0539 5.1E4 81.0696 9.2E4 83.0490 6.6E3 84.8896 2.4E3 90.7327 2.1E3 91.0493 2.4E3 91.0539 6.8E4 93.0695 9.1E4 95.0436 2.9E3 95.0488 8.8E4 95.0803 2.1E3 95.0851 6.6E4 97.0645 2.3E4 103.0233 2.2E3 103.0544 2.8E3 105.0693 1.6E5 107.0851 5.9E4 109.0644 3.3E4 109.1007 1.7E4 115.0539 2.4E3 117.0694 3.1E4 119.0852 1.4E5 121.0644 2.8E4 121.1008 4.4E4 128.0618 1.7E4 129.0695 3.3E4 130.0773 1.1E4 131.0853 6.3E4 133.0657 2.6E3 133.1008 8.9E4 135.0799 1.3E4 139.4755 2.6E3 140.8726 2.8E3 141.0695 9.9E3 142.0773 4.8E4 143.0852 9.1E4 144.0930 2.0E4 145.1009 9.0E4 147.0801 2.6E3 147.1166 1.7E4 149.0959 1.3E4 154.0781 3.0E3 155.0850 2.9E4 156.0930 3.6E4 157.1009 1.1E5 158.1087 2.1E4 159.0800 6.7E3 159.1166 4.4E4 161.0955 1.1E4 165.0698 5.8E3 167.0857 2.1E4 168.0933 6.5E3 169.1010 6.5E4 170.1087 1.7E4 171.1166 5.4E4 173.1325 3.3E4 173.5282 4.2E4 173.5430 1.1E4 179.0856 2.4E4 179.1028 3.0E3 180.0933 1.1E4 181.1011 4.2E4 182.1089 4.7E4 183.1165 4.4E4 184.1252 1.6E4 185.0972 4.2E3 185.1321 1.8E4 192.0933 1.0E4 193.1010 4.0E4 194.1087 2.8E4 195.1166 5.8E4 196.1245 2.5E4 197.1324 5.0E4 198.1401 5.8E3 199.1484 1.6E4 203.9821 2.5E3 205.1015 8.4E3 206.1087 2.5E4 207.1168 6.5E4 208.1249 2.6E4 209.1323 4.9E4 210.1403 7.5E3 211.1486 2.3E4 218.1092 3.9E3 219.1168 2.3E4 220.1247 2.5E4 221.1325 5.9E4 222.1404 2.1E4 223.1482 2.6E4 224.6698 2.5E3 231.1171 8.4E3 232.1244 1.2E4 233.1325 3.4E4 234.1398 1.8E4 235.1250 2.3E3 235.1479 4.9E4 236.1551 1.4E4 237.1641 1.7E4 245.1328 1.8E4 246.1390 1.4E4 247.1477 3.1E4 248.1551 1.4E4 249.1637 5.4E4 250.1713 2.8E3 251.1804 2.9E3 257.3180 2.4E3 258.1403 6.5E3 259.1476 1.3E4 260.1561 1.6E4 261.1641 2.3E4 263.1796 1.6E4 264.1872 7.3E3 265.1939 5.9E3 269.1337 3.3E3 271.1476 3.0E3 273.1638 1.0E4 274.1735 2.4E3 275.1787 1.3E4 277.1951 7.0E3 283.1494 2.8E3 284.1550 2.8E3 285.1650 2.5E3 289.1962 4.9E3 299.1797 6.2E3 317.1899 3.2E3 373.2509 1.6E4 END IONS BEGIN IONS FEATURE_ID=601 PEPMASS=391.2638 SCANS=601 RTINSECONDS=708.639 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 53.6201 2.4E3 53.7396 2.2E3 55.0540 3.0E4 57.0673 2.8E3 57.0696 7.8E4 58.9172 2.4E3 59.0491 3.1E3 59.9849 2.5E3 63.4338 2.6E3 64.8734 2.6E3 65.0382 2.4E3 67.0539 3.2E4 69.0218 2.2E3 69.0333 8.8E3 69.0696 3.0E4 71.0852 6.4E4 73.2610 2.2E3 76.6618 2.2E3 77.8715 2.1E3 79.0539 4.8E4 81.0696 1.2E5 83.0490 1.7E4 83.0854 1.4E4 85.0645 1.2E4 87.5983 2.3E3 91.0539 4.5E4 93.0639 3.7E3 93.0695 1.2E5 95.0426 3.3E3 95.0488 1.2E5 95.0851 6.5E4 97.0645 1.8E4 98.9144 2.4E3 105.0695 1.5E5 107.0487 2.6E3 107.0852 8.4E4 109.0645 3.1E4 109.1008 3.1E4 111.0798 2.3E3 112.9004 2.1E3 113.5312 2.3E3 115.0549 2.8E3 117.0695 2.5E4 119.0852 1.4E5 121.0279 8.5E3 121.0645 3.9E4 121.1008 8.0E4 123.0800 1.5E4 123.1167 1.1E4 128.0620 1.0E4 129.0697 2.2E4 130.0775 1.0E4 131.0853 7.5E4 133.0651 2.9E3 133.1009 5.7E4 135.0800 1.7E4 135.1166 1.1E4 141.0699 9.3E3 142.0775 2.2E4 143.0852 8.6E4 144.0932 1.7E4 145.0644 4.6E3 145.0889 4.1E3 145.1010 1.5E5 146.0722 2.5E3 147.0800 2.3E4 147.1166 4.1E4 149.0231 6.9E5 149.0958 1.8E4 149.1328 4.6E3 155.0852 3.1E4 156.0930 2.8E4 157.1009 1.2E5 158.1089 9.0E3 159.0805 1.8E4 159.1166 5.9E4 161.0960 2.7E4 161.1324 8.9E3 166.0781 2.8E3 167.0334 4.3E3 167.0854 1.6E4 167.1062 2.9E3 168.0930 7.0E3 169.1011 6.6E4 170.1087 1.7E4 171.0810 6.4E3 171.1167 6.7E4 173.0958 1.9E4 173.1325 6.6E4 173.5328 4.7E4 175.1117 1.8E4 179.0855 1.7E4 180.0938 6.1E3 181.1011 4.4E4 182.1091 2.4E4 183.1166 7.2E4 184.1246 1.4E4 185.0957 3.5E3 185.1324 3.7E4 187.1114 1.1E4 187.1480 1.2E4 189.1283 3.1E3 191.1429 1.4E4 192.0937 2.9E3 193.1011 3.1E4 194.1088 2.5E4 195.1167 6.3E4 196.1244 2.4E4 197.0958 6.2E3 197.1325 6.1E4 198.1412 2.4E3 199.1115 1.9E4 199.1476 2.0E4 201.1269 3.2E3 206.1092 1.8E4 207.1167 5.3E4 208.1246 2.5E4 209.1326 6.2E4 210.1396 7.6E3 211.1113 1.3E4 211.1482 3.5E4 213.1279 1.5E4 215.1421 9.5E3 216.0584 2.4E3 217.1576 6.0E3 218.1085 2.7E3 219.1171 2.0E4 220.1245 1.8E4 221.1325 5.0E4 222.1401 1.2E4 223.1121 7.2E3 223.1483 4.2E4 225.1278 1.4E4 225.1644 1.6E4 227.1438 1.2E4 231.1161 5.8E3 232.1240 4.2E3 233.1321 3.0E4 233.1547 1.6E4 234.1404 1.7E4 235.1484 3.7E4 236.1558 7.7E3 237.1274 4.6E3 237.1637 2.5E4 239.1429 3.6E3 241.1595 2.4E3 243.1163 3.1E3 244.1246 2.5E3 245.1320 1.2E4 246.1396 1.5E4 247.1482 2.2E4 248.1563 1.4E4 249.1636 7.0E4 251.1449 1.1E4 251.1794 1.6E4 253.1580 3.9E3 257.1329 3.6E3 258.1399 5.8E3 259.1478 1.4E4 260.1546 3.6E3 261.1639 2.1E4 262.1687 3.1E3 263.1791 2.1E4 264.1869 9.6E3 267.1745 2.8E4 269.7050 2.6E3 273.1645 1.4E4 275.1783 1.6E4 277.1609 3.3E3 277.1941 4.7E3 279.1761 3.5E3 281.1909 7.1E3 282.1984 1.7E4 283.2074 2.9E3 287.1800 4.9E3 289.1958 1.2E4 291.1746 9.2E3 293.1888 9.6E3 295.2059 3.4E3 297.1855 2.8E4 298.3142 2.4E3 299.1811 3.2E3 305.1909 3.1E3 308.2144 4.3E3 314.1997 3.1E3 315.2094 3.2E3 316.1808 2.6E3 322.9916 2.8E3 335.2005 3.9E3 354.2480 2.5E3 373.2528 7.4E3 391.2642 1.3E4 END IONS BEGIN IONS FEATURE_ID=602 PEPMASS=696.4172 SCANS=602 RTINSECONDS=712.648 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 67.0539 5.2E4 68.4625 2.6E3 69.0696 2.8E4 70.2788 2.5E3 71.0852 1.2E4 72.7335 2.1E3 73.0281 1.1E4 76.2591 2.3E3 79.0539 1.5E4 81.0693 1.4E5 82.4208 2.7E3 83.0851 3.9E4 85.0280 7.3E4 85.0648 3.2E3 85.1008 5.6E3 86.8740 2.4E3 87.2009 2.7E3 89.4514 2.2E3 90.0803 2.3E3 91.0386 5.7E4 91.0539 1.1E4 93.0696 2.3E4 93.8078 2.6E3 95.0851 1.3E5 97.0280 3.5E4 97.0645 1.6E4 97.1008 3.8E4 99.0799 7.7E3 105.0698 1.2E4 106.6604 2.7E3 107.0851 2.9E4 109.0929 3.4E3 109.1008 9.7E4 111.0802 8.2E3 111.1165 1.4E4 113.0177 2.3E3 113.0959 8.3E3 119.0852 2.2E4 121.1007 6.2E4 123.1164 6.7E4 125.0962 2.9E3 125.1320 3.2E3 127.0386 2.7E4 127.1117 2.7E3 133.1008 4.3E4 135.1165 4.3E4 137.1321 3.0E4 139.1114 2.8E3 141.1269 7.1E3 142.4720 2.3E3 145.0492 3.1E4 147.1165 3.7E4 149.1322 5.2E4 150.8089 2.8E3 151.1118 8.5E3 151.1476 2.8E4 153.1273 2.7E3 155.1420 8.0E3 157.6038 2.8E3 161.1323 4.9E4 163.0601 8.5E3 163.1479 4.8E4 164.3511 2.5E3 165.1272 3.2E3 165.1635 2.7E4 172.8626 2.2E3 173.3316 2.6E3 173.5229 1.9E4 173.5374 3.5E4 173.5430 5.5E3 175.1480 4.6E4 177.1638 8.8E3 179.1422 2.4E3 179.1795 2.0E4 181.1580 3.0E3 182.4646 2.2E3 189.1635 2.2E4 193.1585 4.4E3 198.5191 2.3E3 203.1786 3.0E3 217.1928 2.9E3 245.2263 1.7E5 249.3119 2.2E3 252.2625 2.6E3 259.0042 2.5E3 263.2368 2.0E5 296.9904 2.7E3 337.2742 1.6E5 337.3162 4.2E3 342.3297 2.8E3 366.8343 3.2E3 381.9319 2.5E3 577.9653 2.6E3 594.4008 2.8E3 611.5497 2.6E3 625.6497 2.8E3 654.4083 2.6E3 700.0663 3.1E3 END IONS BEGIN IONS FEATURE_ID=603 PEPMASS=231.1383 SCANS=603 RTINSECONDS=715.051 CHARGE=1+ MSLEVEL=2 MERGED_STATS=14 / 14 (0 removed due to low quality, 0 removed due to low cosine). 43.0178 1.8E5 47.3787 2.4E3 48.6402 2.6E3 49.5945 2.4E3 52.6296 2.6E3 53.0385 1.6E4 55.0177 9.8E4 55.0541 1.4E5 57.8925 2.6E3 59.0491 2.8E4 60.5402 2.2E3 61.2681 2.3E3 62.5296 2.2E3 62.6575 2.4E3 63.7831 2.5E3 67.0541 7.6E4 67.6718 2.3E3 68.9658 2.2E3 69.0333 7.1E4 69.0698 2.6E4 69.8303 2.1E3 70.1843 2.4E3 71.5995 2.2E3 71.8382 2.9E3 73.0279 2.1E3 73.1461 2.3E3 73.5106 2.1E3 74.9760 2.5E3 75.6747 2.5E3 77.4392 2.2E3 78.4588 2.2E3 79.0540 2.4E5 79.1336 2.3E3 79.6844 2.4E3 81.0696 6.5E5 83.0489 1.8E4 84.5681 2.4E3 85.8854 2.2E3 85.9739 2.6E3 86.0213 2.6E3 87.0439 2.1E4 90.9494 2.3E3 91.0540 2.5E5 91.1581 2.1E3 91.2742 2.1E3 92.3010 2.4E3 93.0696 2.6E5 93.5910 2.8E3 94.3589 2.6E3 95.0491 6.0E4 95.0853 2.1E5 96.0260 2.9E3 96.1710 2.3E3 97.0648 1.7E4 97.9651 2.5E3 99.3188 2.5E3 101.0027 2.5E3 101.6820 2.4E3 103.0538 2.3E4 103.9186 2.5E3 105.0616 1.6E4 105.0696 1.1E6 105.0759 2.1E3 105.0803 6.3E3 105.7186 2.3E3 107.0492 6.0E3 107.0854 1.3E5 107.9468 2.2E3 108.4551 2.7E3 109.0647 2.4E4 111.0439 1.3E5 111.0806 3.2E3 112.6879 2.3E3 115.0540 4.2E4 117.0697 4.6E5 119.0490 6.1E4 119.0757 5.3E3 119.0853 6.8E5 121.0646 2.4E4 122.0733 2.5E3 123.0802 9.2E4 125.0596 4.4E4 128.0619 1.6E5 128.2987 2.3E3 129.0697 2.8E5 130.0775 4.0E4 131.0854 1.7E5 133.0540 4.2E3 133.0646 4.6E5 133.0757 1.1E4 133.1011 1.7E5 134.2910 2.4E3 135.0804 6.8E4 136.8036 2.5E3 137.0595 4.5E4 140.6284 2.4E3 141.0698 8.3E4 141.2960 2.5E3 142.0659 4.8E3 142.0776 5.6E5 143.0727 5.5E3 143.0853 8.7E5 143.0978 5.3E3 144.0934 5.2E4 145.0645 3.3E4 145.1011 3.3E5 147.0803 2.9E4 147.1156 2.7E3 147.7541 2.7E3 149.5607 2.8E3 149.8992 2.5E3 151.0753 2.3E5 151.9343 2.8E3 152.9122 2.6E3 153.0699 9.7E3 154.0777 2.8E3 155.0853 1.8E5 156.0931 3.9E5 157.0639 2.8E3 157.0846 1.2E4 157.0887 2.1E3 157.1010 1.5E6 157.1156 1.8E4 157.4026 2.6E3 158.1090 7.3E4 159.0805 1.9E4 159.1168 1.0E5 161.0959 3.5E4 161.1315 2.3E3 163.0754 6.0E4 165.0699 1.3E5 166.1067 2.4E3 167.0857 1.9E4 169.1012 4.2E4 170.1090 8.9E5 170.1257 4.8E3 171.0805 1.1E5 171.1170 1.1E5 172.0883 5.6E4 172.1250 2.6E4 173.0963 1.6E4 173.5293 1.2E5 173.5399 4.1E4 173.8939 2.4E3 175.0754 4.1E4 175.1124 1.2E4 179.0856 6.2E3 180.0934 1.5E5 182.3112 2.7E3 182.4987 2.5E3 183.0804 1.0E5 183.1167 9.8E3 183.4947 2.6E3 184.0884 5.8E4 185.0956 4.4E4 185.1131 3.1E3 185.1325 1.1E6 185.1516 1.9E4 186.1398 1.3E4 187.1486 6.2E3 189.0914 3.1E4 191.2516 2.7E3 195.1169 1.7E5 197.0957 5.2E3 197.6038 2.6E3 198.1040 2.5E5 203.1429 5.6E3 208.0374 2.7E3 213.1275 4.6E5 215.2694 2.4E3 216.1155 2.4E3 216.1633 2.3E3 216.2934 2.3E3 217.7238 3.0E3 220.6388 2.4E3 223.4744 2.3E3 231.1380 5.0E4 239.1339 2.2E3 240.9255 2.5E3 241.5020 2.3E3 END IONS BEGIN IONS FEATURE_ID=604 PEPMASS=478.2935 SCANS=604 RTINSECONDS=720.285 CHARGE=1+ MSLEVEL=2 MERGED_STATS=12 / 12 (0 removed due to low quality, 0 removed due to low cosine). 59.1614 2.3E3 59.8224 2.4E3 61.5100 2.5E3 61.5486 2.3E3 62.0597 1.0E4 62.6551 2.3E3 64.9351 2.7E3 67.0538 8.1E5 67.0581 3.6E3 67.4460 2.3E3 68.3832 2.3E3 69.0694 7.3E5 69.0739 4.1E3 70.5146 2.6E3 70.6403 2.0E3 71.0488 2.5E4 71.0851 5.6E4 79.0538 2.1E5 81.0694 1.2E6 81.0777 7.5E3 81.9822 2.8E3 82.3718 2.1E3 82.4684 2.3E3 82.7163 2.6E3 83.0487 3.3E4 83.0850 5.9E5 84.0152 2.4E3 85.0644 4.8E4 85.1007 2.0E4 89.3541 2.6E3 91.0537 1.4E5 91.4391 2.5E3 91.7054 2.4E3 93.0369 2.5E3 93.0694 3.2E5 93.0916 2.6E3 94.3183 2.3E3 95.0487 3.0E3 95.0850 1.1E6 95.0923 2.2E3 97.0643 1.1E5 97.0944 3.4E3 97.1007 3.8E5 99.0800 5.2E4 100.5850 2.4E3 101.0588 3.0E3 101.2867 2.6E3 101.9137 2.8E3 105.0693 1.2E5 107.0850 2.5E5 109.1006 5.9E5 109.3216 2.3E3 109.8656 2.2E3 110.9107 2.7E3 111.0800 6.9E4 111.1163 7.8E4 112.0131 2.5E3 112.3049 2.6E3 113.0960 3.6E3 115.0750 2.4E3 116.7431 2.5E3 119.0768 2.7E3 119.0850 1.7E5 120.4991 2.4E3 121.1006 2.8E5 123.0799 3.1E4 123.1163 3.2E5 124.0153 9.9E3 125.0957 5.1E4 125.1318 3.3E3 126.2999 2.4E3 133.1006 2.4E5 135.1163 1.8E5 137.0955 3.1E4 137.1319 1.3E5 138.8425 2.3E3 139.1115 3.2E4 141.9279 2.6E3 144.6020 2.3E3 147.1163 2.0E5 148.8249 2.9E3 149.1319 1.1E5 150.2199 2.4E3 151.1117 2.6E4 151.1478 4.9E4 153.1271 3.5E4 159.1170 2.0E3 161.1319 1.5E5 163.1339 3.5E3 163.1476 1.0E5 163.1624 3.0E3 165.1276 1.1E4 165.1632 8.7E3 167.1419 5.7E3 173.1083 2.4E3 173.5213 9.1E3 173.5312 1.8E5 173.5408 2.9E4 175.1478 1.2E5 177.1638 1.3E4 177.8848 2.3E3 179.1425 9.2E3 181.1583 6.0E3 184.5241 2.6E3 184.9177 3.0E3 189.1634 4.7E4 193.1579 3.9E3 202.8766 2.2E3 203.1787 8.9E3 207.1744 2.5E3 211.2844 2.4E3 217.1954 2.6E3 219.2101 3.0E3 220.8081 2.6E3 226.0426 2.4E3 232.6250 2.3E3 239.2134 2.3E3 240.7424 2.5E3 244.7039 2.2E3 245.2257 6.8E4 247.0499 2.4E3 249.1059 2.3E3 252.1446 2.8E3 259.3815 2.3E3 263.2365 1.4E5 264.9617 2.6E3 270.4901 2.8E3 278.1976 2.7E3 284.2870 2.6E3 285.6924 2.6E3 294.2894 2.3E3 299.1428 3.0E3 306.2788 1.9E5 314.9211 2.8E3 337.2259 1.7E4 337.2735 3.4E6 402.4049 2.5E3 426.7874 2.4E3 434.6256 2.7E3 437.3109 2.3E3 459.1958 2.3E3 END IONS BEGIN IONS FEATURE_ID=605 PEPMASS=324.1237 SCANS=605 RTINSECONDS=722.771 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 55.8350 2.3E3 64.5713 2.4E3 66.2173 2.2E3 71.8427 2.6E3 83.7063 2.5E3 87.9174 2.3E3 91.9972 2.3E3 97.6574 2.5E3 98.1350 2.3E3 98.7689 2.6E3 110.1236 2.4E3 112.8294 2.5E3 136.5787 2.2E3 147.9435 2.2E3 158.7475 2.4E3 173.5233 5.4E3 173.5342 4.0E4 175.2205 2.5E3 207.1033 4.8E3 217.0872 2.9E3 224.0701 7.8E3 233.0824 2.4E3 234.0922 2.0E4 235.0992 7.2E4 245.0833 3.4E3 246.0923 2.7E3 247.0981 3.1E3 248.0708 3.1E4 249.0782 6.6E3 250.0865 1.0E4 262.0619 2.2E3 262.0861 1.1E5 263.0939 1.4E5 264.1019 1.0E5 265.0746 4.0E3 266.0810 1.2E5 272.0717 4.8E3 273.0790 7.4E3 274.0874 1.1E4 276.0655 1.3E5 276.1009 3.5E3 278.0817 2.8E4 279.0889 5.9E3 280.0969 7.4E4 290.0812 8.5E4 291.0518 4.3E3 291.0893 6.2E5 291.1270 8.3E3 292.0969 1.7E4 293.1048 5.9E4 293.8121 2.3E3 294.0370 5.3E3 294.0764 7.0E5 294.1144 2.9E3 298.9684 2.2E3 308.0561 2.8E3 308.0920 5.2E4 309.0652 2.4E3 309.0999 2.7E5 324.0833 7.3E3 324.1233 4.2E5 END IONS BEGIN IONS FEATURE_ID=606 PEPMASS=520.3404 SCANS=606 RTINSECONDS=723.6 CHARGE=1+ MSLEVEL=2 MERGED_STATS=10 / 10 (0 removed due to low quality, 0 removed due to low cosine). 60.0805 3.3E5 61.6608 2.5E3 62.1588 2.4E3 62.7141 2.2E3 63.1088 2.1E3 63.1551 2.5E3 64.2047 2.2E3 67.0540 6.6E3 69.0695 3.0E3 69.7964 2.3E3 69.8523 2.5E3 71.0727 6.6E4 72.6761 2.8E3 74.8506 2.6E3 77.5292 2.6E3 77.7695 2.4E3 81.0696 8.9E3 81.4843 2.1E3 83.0854 3.2E3 84.6038 2.2E3 85.8478 2.6E3 86.0961 1.8E6 86.1020 3.1E3 86.3648 2.8E3 86.4796 2.5E3 88.0226 2.7E3 89.6200 2.6E3 90.0411 2.5E3 95.0853 1.8E4 97.1004 2.9E3 97.5675 2.6E3 98.9841 5.6E4 99.5157 2.2E3 100.6013 2.8E3 104.0996 3.0E3 104.1066 2.9E5 107.9108 2.7E3 109.1010 4.7E3 122.8841 3.0E3 124.9903 4.1E3 124.9995 7.4E5 125.0104 7.1E3 132.2594 2.7E3 133.7630 2.5E3 150.2355 2.4E3 151.8318 2.2E3 152.8458 2.6E3 157.9262 2.9E3 163.0155 2.9E3 168.2201 2.3E3 173.5251 4.0E4 173.5365 1.7E5 184.0136 3.1E3 184.0350 1.6E5 184.0426 2.2E4 184.0733 1.9E7 184.1030 7.2E4 184.1122 1.3E5 184.1230 2.5E4 184.1551 2.6E3 184.7521 2.7E3 214.4616 2.5E3 228.7249 2.6E3 231.4336 2.8E3 240.4646 2.3E3 257.3974 2.3E3 258.1089 2.2E4 285.8800 2.6E3 299.2882 2.5E3 299.2972 2.5E3 321.3591 2.7E3 321.3924 2.5E3 332.4608 2.7E3 333.3051 2.8E3 337.1044 2.6E3 337.2745 8.3E4 340.1161 3.5E3 342.8085 2.5E3 353.1288 2.5E3 368.5145 2.4E3 404.0117 2.3E3 412.1293 2.4E3 415.3155 2.3E3 429.7845 2.5E3 434.5681 2.7E3 441.7077 2.5E3 443.2565 1.1E4 476.1152 2.8E3 502.3303 4.8E4 END IONS BEGIN IONS FEATURE_ID=607 PEPMASS=537.3039 SCANS=607 RTINSECONDS=728.432 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 80.4730 2.3E3 83.1179 2.6E3 85.1133 2.7E3 113.1415 2.1E3 119.6868 2.6E3 129.4218 2.2E3 134.3197 2.3E3 149.6844 4.6E3 149.6946 4.1E3 168.7814 2.2E3 173.5281 2.1E4 173.5448 5.0E3 185.0416 1.8E4 194.5290 2.3E3 203.0523 4.2E4 220.8679 2.7E3 259.0782 2.6E4 262.6661 2.7E3 281.2952 9.4E3 282.2790 5.9E4 375.2505 1.2E4 467.0404 2.5E3 537.3030 1.6E6 END IONS BEGIN IONS FEATURE_ID=608 PEPMASS=353.2689 SCANS=608 RTINSECONDS=728.512 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 5 (2 removed due to low quality, 0 removed due to low cosine). 53.0018 2.6E3 55.0177 1.0E4 55.0540 1.2E5 57.0332 8.5E4 57.0696 6.6E4 65.0384 7.7E3 66.8818 2.2E3 67.0539 8.7E5 67.0581 6.2E3 67.0604 8.7E3 69.0695 1.5E5 70.7061 2.5E3 71.0488 2.6E4 71.0852 2.2E4 73.6766 2.1E3 75.0436 1.8E4 75.0479 2.5E3 75.8221 2.4E3 77.0387 3.9E3 79.0538 3.3E5 81.0696 1.1E6 81.0763 1.8E4 81.0781 8.3E3 83.0488 9.5E3 83.0851 1.0E5 85.0644 3.4E4 91.0483 3.7E3 91.0537 1.5E5 93.0695 5.9E5 93.0766 3.6E3 95.0490 1.5E4 95.0852 9.7E5 95.0924 4.0E3 95.0960 6.7E3 97.0644 4.4E4 97.1008 5.9E4 99.0802 2.3E4 105.0448 3.1E3 105.0695 1.7E5 107.0851 4.9E5 109.0645 1.7E4 109.1008 5.7E5 111.0801 2.3E4 111.1165 2.7E3 117.0695 8.9E4 119.0851 1.8E5 121.0911 1.0E4 121.1008 4.8E5 121.1097 3.0E3 123.0800 2.1E4 123.1069 5.4E3 123.1165 2.7E5 125.0958 1.6E4 127.6163 2.5E3 131.0748 8.4E3 131.0852 2.4E5 133.0905 3.6E3 133.1008 1.9E5 135.0436 2.4E4 135.0805 5.8E3 135.1165 4.1E5 135.1271 5.4E3 137.0959 1.4E4 137.1322 7.4E4 139.1118 1.0E4 145.1009 1.9E5 147.1165 1.5E5 149.0961 1.2E4 149.1322 2.9E5 149.1463 3.9E3 151.0749 5.8E3 151.1118 9.7E3 151.1477 2.2E4 152.8029 2.5E3 153.1277 7.2E3 159.1166 1.7E5 159.5160 2.4E3 161.1182 7.4E3 161.1323 1.4E5 163.1119 1.3E4 163.1479 1.4E5 165.1270 1.4E4 167.1434 2.2E3 167.7243 2.3E3 173.1325 1.9E5 173.5180 3.8E3 173.5269 1.1E4 173.5338 4.0E4 173.5450 5.0E3 175.1481 4.3E4 177.1280 1.0E4 177.1639 4.6E4 179.1430 1.0E4 187.1480 1.0E5 189.1647 3.4E3 191.1436 1.2E4 199.9703 2.5E3 201.0911 8.0E3 201.1638 3.1E4 205.1590 9.7E3 215.1800 6.6E3 219.1741 1.0E4 222.7480 2.6E3 223.1692 3.2E3 233.1900 5.4E3 233.2263 1.5E4 243.2108 1.1E5 244.4250 2.5E3 252.0784 2.6E3 261.1898 5.3E3 261.2213 2.9E5 261.2467 2.6E3 279.2309 1.2E4 282.0886 1.1E4 283.0968 3.4E3 292.8852 2.7E3 304.1112 9.4E3 320.1033 2.3E3 END IONS BEGIN IONS FEATURE_ID=609 PEPMASS=327.2323 SCANS=609 RTINSECONDS=728.622 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 50.6640 2.4E3 53.0384 2.5E3 55.0176 4.7E3 55.0540 3.5E4 56.3900 2.5E3 57.0333 6.4E3 57.0697 1.9E4 59.0489 3.1E3 67.0539 5.1E4 69.0332 6.0E3 69.0695 3.3E4 70.6212 2.2E3 71.0489 5.7E3 77.0383 6.7E3 79.0539 4.2E4 81.0333 6.9E3 81.0646 2.3E3 81.0695 8.1E4 83.0488 3.6E3 83.0852 7.6E3 85.0643 5.6E3 85.1005 2.2E3 91.0539 5.3E4 93.0695 1.8E5 95.0425 3.4E3 95.0488 1.4E5 95.0794 3.5E3 95.0852 1.1E5 95.9870 2.3E3 97.0645 3.4E4 103.0087 2.4E3 103.0539 2.7E3 105.0695 1.3E5 107.0851 8.3E4 108.2363 2.4E3 109.0643 2.6E4 109.1009 4.9E4 115.0539 2.8E3 117.0694 3.7E4 119.0851 1.3E5 121.0644 3.7E4 121.1008 7.3E4 123.0802 1.4E4 123.1166 9.4E3 128.0621 5.3E3 129.0694 1.3E4 130.0768 2.4E3 131.0852 7.4E4 132.7653 2.6E3 133.0826 2.8E3 133.1008 1.0E5 135.0798 1.7E4 135.1166 2.4E4 137.0956 2.7E3 142.0775 2.1E4 143.0851 4.1E4 144.0932 1.3E4 145.1009 1.1E5 147.1165 3.6E4 149.0956 1.1E4 149.1324 3.5E3 152.0615 6.2E3 153.0699 6.3E3 155.0850 1.1E4 156.0929 1.3E4 157.1009 6.3E4 158.1082 1.5E4 159.0808 6.0E3 159.1166 8.0E4 160.1235 2.5E3 161.0959 3.1E4 161.1322 8.2E3 163.1351 2.7E3 167.0846 3.2E3 169.1010 2.7E4 170.1081 6.5E3 171.1168 3.6E4 172.1238 4.1E3 173.0962 7.4E3 173.1323 3.6E4 173.5323 4.1E4 175.1472 1.2E4 179.0850 3.1E3 181.1011 6.9E3 182.1088 7.3E3 183.1167 2.2E4 184.1248 7.3E3 185.1324 2.0E4 187.1476 1.8E4 189.1629 2.8E3 194.1084 2.6E3 195.1168 9.6E3 197.1325 2.5E4 199.1479 1.1E4 201.1637 3.5E3 207.1180 2.8E3 209.1324 1.8E4 210.1391 2.9E3 211.1474 1.0E4 216.4739 2.5E3 217.1556 2.8E3 225.1638 8.1E3 229.1015 2.8E3 233.0363 1.2E4 233.8989 2.8E3 235.1497 3.3E3 239.1789 3.2E3 251.0479 6.3E3 317.5234 2.5E3 327.0786 1.5E4 END IONS BEGIN IONS FEATURE_ID=610 PEPMASS=497.3114 SCANS=610 RTINSECONDS=728.622 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 58.0192 2.4E3 61.0281 1.2E5 63.8308 2.3E3 67.0539 1.3E5 69.0332 7.0E4 69.0696 3.8E4 71.0488 1.7E4 73.0281 6.7E4 79.0539 7.4E4 81.0331 4.2E4 81.0647 4.6E3 81.0695 1.8E5 83.0488 1.1E4 83.0852 2.1E4 85.0226 3.6E3 85.0280 1.5E5 85.0646 3.0E3 87.0436 9.8E3 91.0386 9.9E4 91.0538 3.8E4 91.1067 2.5E3 93.0695 1.0E5 95.0488 1.2E4 95.0852 1.5E5 97.0281 1.2E5 97.0645 5.2E3 97.1010 1.2E4 99.0438 2.8E4 101.0229 3.2E4 103.0386 1.8E4 104.8191 2.3E3 105.0695 4.5E4 107.0852 7.5E4 109.0280 2.9E4 109.0643 4.6E3 109.1008 7.4E4 111.0437 3.2E3 115.0388 1.2E4 117.0698 2.0E4 119.0852 4.8E4 119.0936 2.5E3 120.8223 2.8E3 121.1008 8.3E4 123.0797 3.2E3 123.1166 2.8E4 127.0386 5.9E4 129.0541 8.1E3 129.5511 2.4E3 131.0853 3.5E4 133.1009 4.0E4 133.1362 2.2E3 135.1166 5.5E4 145.0493 7.4E3 145.1009 2.8E4 147.1167 2.8E4 149.1321 3.0E4 154.2341 2.5E3 159.1164 2.5E4 161.1324 2.4E4 163.1479 1.1E4 168.5292 2.8E3 171.1184 2.8E3 173.1323 2.7E4 173.5205 1.0E4 173.5301 2.4E4 173.5382 3.8E4 175.1489 8.2E3 179.1445 2.4E3 185.1326 5.6E3 186.6005 2.5E3 187.1477 1.3E4 199.1445 2.4E3 199.6676 2.4E3 201.1633 3.3E3 211.4397 2.3E3 243.2113 4.1E3 261.2213 2.0E4 295.6550 2.6E3 317.2446 2.2E3 332.6198 2.4E3 333.7273 2.5E3 335.2584 5.1E4 345.5007 2.7E3 361.9443 2.3E3 365.1668 2.5E3 385.2988 2.6E3 489.5982 2.5E3 END IONS BEGIN IONS FEATURE_ID=611 PEPMASS=618.4285 SCANS=611 RTINSECONDS=728.622 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 64.9321 2.5E3 65.0389 3.9E3 65.8521 2.4E3 67.0541 3.3E4 67.3225 2.4E3 69.0333 2.9E4 69.0697 4.5E4 70.9379 2.7E3 71.0489 2.3E4 71.1845 2.0E3 74.4376 2.5E3 76.3459 2.6E3 77.9004 2.6E3 78.8235 2.4E3 79.0541 4.7E4 80.0173 2.7E3 80.0622 6.2E3 81.0697 1.5E5 83.0490 5.3E4 83.0852 2.5E5 84.6206 2.4E3 85.0282 7.3E3 85.0646 2.5E4 87.0439 8.5E3 87.4970 2.2E3 90.7984 2.2E3 91.0541 5.3E4 93.0696 1.8E5 95.0490 9.1E4 95.0793 4.3E3 95.0853 1.3E5 97.0646 1.1E5 97.1013 3.3E3 99.0439 2.7E4 99.0804 7.8E3 102.5750 3.2E3 103.0539 2.5E3 105.0697 1.9E5 107.0492 1.3E4 107.0853 2.7E5 108.0935 3.5E3 109.0646 5.8E4 109.1010 1.3E5 111.0803 2.9E4 113.0597 1.2E4 113.0960 6.5E4 115.0546 4.8E3 117.0697 3.3E4 118.0775 3.4E3 119.0763 7.2E3 119.0853 2.6E5 120.0934 1.4E4 121.0647 3.3E4 121.0909 4.5E3 121.1010 2.6E5 123.0803 8.0E4 123.1167 3.5E4 125.0960 1.2E5 126.1039 3.2E3 127.1117 3.9E3 129.0697 2.2E4 130.0776 6.5E3 131.0854 1.3E5 132.0933 2.4E4 132.6838 2.3E3 133.0647 1.1E4 133.1011 2.2E5 133.1125 3.5E3 134.1088 8.4E3 135.0803 6.0E4 135.1168 5.2E4 136.0881 2.5E3 137.0959 4.1E4 139.1116 9.5E4 141.0696 9.5E3 142.0774 2.1E4 143.0854 1.4E5 144.0932 3.1E4 145.0649 1.2E4 145.1011 3.1E5 145.1142 6.3E3 146.1085 1.7E4 147.0804 5.6E4 147.1167 1.2E5 149.0960 7.0E4 149.1324 1.9E4 151.0747 1.4E4 151.1119 1.7E4 153.0906 8.7E3 153.1273 1.0E4 155.0855 4.0E4 155.1065 5.0E4 156.0933 3.9E4 157.0869 5.6E3 157.1011 2.6E5 157.1144 5.2E3 158.1089 2.5E4 159.0805 6.0E4 159.1167 1.7E5 160.0882 7.5E4 161.0961 8.0E4 161.1325 3.3E4 163.1118 3.6E4 165.0694 2.8E3 165.0912 1.4E4 165.1278 1.3E4 167.0846 4.6E3 167.0870 1.5E4 167.1067 1.3E5 167.1429 1.8E4 168.0932 7.3E3 169.1013 1.0E5 169.1193 4.1E3 170.1090 2.7E4 171.0810 1.0E4 171.1006 9.0E3 171.1169 1.9E5 172.0883 3.2E3 172.1247 2.0E4 173.0963 5.4E4 173.1326 1.1E5 173.5240 8.1E3 173.5293 4.0E4 173.5424 6.3E3 174.1039 6.9E3 175.1118 6.4E4 175.1482 2.4E4 176.1194 3.4E3 177.0913 3.2E3 177.1276 1.5E4 179.0864 1.1E4 179.1065 2.3E3 179.1431 4.1E4 181.1015 5.3E4 181.1224 9.8E4 182.1091 3.4E4 183.1169 1.3E5 183.1377 2.3E4 184.1247 2.0E4 185.0963 2.6E4 185.1326 1.2E5 186.1047 3.7E3 186.1405 1.4E4 187.1118 3.9E4 187.1482 5.4E4 188.1199 6.8E3 189.1275 3.3E4 190.1350 8.9E3 191.1431 5.4E4 192.0921 3.2E3 193.1013 3.0E4 193.1208 6.6E3 193.1573 2.9E3 194.1090 2.4E4 195.1169 1.2E5 195.1367 1.6E4 196.1247 3.8E4 197.0984 1.3E4 197.1127 5.7E3 197.1326 2.2E5 198.1400 1.9E4 199.1121 3.7E4 199.1482 8.5E4 200.1193 4.0E3 200.1565 7.9E3 201.1276 2.9E4 201.1634 1.5E4 203.1432 3.9E4 205.1230 3.3E3 205.1584 8.0E3 206.1084 3.8E3 207.1172 6.1E4 207.1378 1.6E4 207.7421 3.1E3 208.1245 2.6E4 208.1455 1.5E4 209.1326 1.3E5 209.1535 1.4E4 210.1403 2.8E4 211.1119 2.0E4 211.1484 1.2E5 212.1201 7.4E3 212.1564 1.9E4 213.1278 5.1E4 213.1640 3.6E4 214.1345 2.7E3 215.1433 7.4E4 217.1586 1.5E4 218.1660 6.4E3 219.1168 1.9E4 219.1385 9.0E3 220.1255 1.1E4 221.1323 6.9E4 221.1542 6.8E4 222.1401 2.2E4 223.1115 9.6E3 223.1215 3.0E3 223.1483 1.1E5 224.1555 1.1E4 225.1271 3.5E4 225.1642 4.3E4 226.1364 3.7E3 226.1711 3.7E3 227.1434 4.0E4 227.1809 7.5E3 228.1513 4.5E3 229.1590 1.4E4 231.1160 8.6E3 231.1388 2.7E3 231.1749 1.1E4 232.1248 7.5E3 233.1318 2.9E4 233.1540 2.2E5 234.1389 1.4E4 234.1635 3.1E3 235.1480 7.4E4 235.1707 4.4E3 236.1557 1.1E4 237.1266 4.3E3 237.1641 6.9E4 239.1435 2.1E4 239.1797 2.3E4 240.1483 3.4E3 241.1591 2.3E4 243.1736 1.0E4 245.1310 1.7E4 245.1558 8.1E3 246.1373 7.3E3 246.1620 2.8E4 246.3886 2.4E3 247.1477 4.2E4 247.1709 1.6E4 248.1567 1.3E4 249.1638 6.4E4 250.1712 1.0E4 251.1451 8.7E3 251.1794 4.1E4 252.1868 3.6E3 253.1586 2.9E4 253.1939 1.1E4 255.1743 1.8E5 257.1903 7.5E3 258.1394 3.6E3 259.1472 2.0E4 259.1734 3.4E3 260.1544 1.3E4 261.1640 6.0E4 262.1721 8.9E3 263.1494 3.9E3 263.1793 4.6E4 265.1616 1.2E4 265.1954 2.9E4 267.1745 2.5E4 268.1833 5.3E3 269.1901 2.4E4 270.1988 1.3E4 271.1715 1.4E4 271.2045 3.1E3 273.1602 1.2E4 273.1855 2.9E4 274.1716 9.6E3 275.1800 4.1E4 276.1883 7.5E3 277.1613 3.9E3 277.1956 2.9E4 279.1759 1.3E4 281.1907 3.1E4 282.1986 1.1E4 283.2061 1.5E4 285.1853 2.0E4 286.1941 1.3E4 287.1765 6.4E3 287.2046 5.2E3 288.1915 2.5E3 289.1956 2.6E4 291.1761 7.6E3 291.2120 1.5E4 293.1906 1.2E4 294.1980 2.5E3 295.2060 3.1E4 297.1865 9.4E3 297.2212 3.2E3 298.1945 5.0E3 299.2012 2.7E4 301.1961 2.1E4 303.2107 7.5E3 305.1912 3.3E3 307.2063 1.3E4 309.2211 9.9E3 311.2018 1.5E4 313.1977 3.5E3 315.2110 9.1E3 316.2218 2.6E3 317.1892 3.2E3 317.2266 1.3E4 319.2046 8.2E3 321.2228 3.2E3 325.2133 3.7E3 327.2118 7.2E3 329.2262 8.7E3 331.2432 3.4E3 333.2209 1.0E4 335.2380 7.2E3 337.2538 8.6E3 345.2218 1.2E4 347.2374 9.8E3 349.2522 1.2E4 359.2366 8.9E3 365.2463 1.5E4 367.2652 2.9E3 381.2611 3.1E3 383.2632 6.4E3 399.2673 1.5E4 417.2723 3.3E3 439.3021 2.9E3 457.3129 3.7E3 523.3633 3.2E3 626.5610 2.5E3 END IONS BEGIN IONS FEATURE_ID=612 PEPMASS=532.3486 SCANS=612 RTINSECONDS=728.653 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 11 (7 removed due to low quality, 0 removed due to low cosine). 61.0284 3.4E4 65.0387 8.1E3 67.0541 6.8E5 67.0577 2.4E3 67.0586 4.4E3 69.0335 8.8E3 69.0698 1.3E5 71.0490 2.7E4 71.0854 2.6E4 73.0283 8.1E3 73.7359 2.7E3 75.0440 2.2E4 77.0388 3.6E3 78.1166 2.7E3 79.0541 2.7E5 81.0698 1.1E6 81.0747 5.7E3 83.0490 1.4E4 83.0854 1.3E5 85.0283 6.7E4 85.0647 5.1E4 85.1012 8.5E3 91.0388 4.4E4 91.0484 3.9E3 91.0541 1.4E5 93.0698 5.2E5 93.0755 3.4E3 93.0767 5.6E3 93.3737 2.6E3 95.0491 2.2E4 95.0853 1.0E6 95.0914 6.2E3 97.0283 3.7E4 97.0647 5.2E4 97.1011 9.3E4 99.0439 5.3E3 99.0804 5.1E4 102.4465 2.7E3 105.0697 1.8E5 107.0155 2.8E3 107.0854 5.1E5 109.0285 3.2E3 109.0647 1.8E4 109.1011 7.4E5 109.1111 2.5E3 109.1134 4.2E3 111.0803 4.1E4 111.1167 2.3E4 113.0960 2.5E4 113.8008 2.7E3 115.3321 2.5E3 117.0697 1.0E5 118.6022 2.8E3 119.0854 2.6E5 121.0912 5.3E3 121.1010 7.4E5 121.1104 8.7E3 121.2994 2.4E3 123.0803 2.9E4 123.1167 4.3E5 125.0960 3.2E4 127.0386 1.2E4 127.1119 4.9E3 128.0730 2.6E3 130.8184 2.8E3 131.0854 3.0E5 133.1011 3.1E5 133.1127 9.6E3 135.0801 6.6E3 135.1043 3.1E3 135.1167 7.3E5 136.7298 2.9E3 137.0959 3.4E4 137.1324 1.6E5 137.9966 2.5E3 139.1117 3.7E4 141.4841 2.8E3 145.0499 3.7E3 145.1011 3.0E5 145.1143 4.4E3 147.1167 2.9E5 149.0961 1.8E4 149.1185 3.9E3 149.1324 6.0E5 149.1464 1.7E4 149.5822 2.6E3 151.1118 3.6E4 151.1480 4.4E4 153.1272 3.5E4 154.9643 2.5E3 159.1167 3.6E5 159.1318 6.0E3 161.1163 3.8E3 161.1324 3.3E5 161.1479 4.9E3 163.1120 2.3E4 163.1337 8.4E3 163.1481 3.7E5 165.1274 4.4E4 165.1636 1.3E4 167.1431 6.9E3 173.1182 3.1E3 173.1326 4.3E5 173.1499 9.3E3 173.5004 2.6E3 173.5326 8.5E4 173.5470 4.1E3 175.1482 1.1E5 177.1275 3.1E4 177.1639 1.2E5 179.1434 5.1E4 181.1231 4.8E3 181.1585 6.0E3 187.1481 2.7E5 189.1639 1.9E4 191.1433 3.5E4 191.1799 2.7E3 193.1581 1.1E4 195.1374 3.4E3 199.1333 3.0E3 201.1639 9.5E4 203.1792 1.2E4 205.1589 4.6E4 209.1536 1.4E4 215.1800 3.1E4 217.1947 8.3E3 219.1743 3.5E4 223.1690 1.1E4 233.1894 7.4E3 233.1994 3.1E3 233.2266 8.3E4 236.9581 2.8E3 237.1847 3.2E3 243.1880 2.0E3 243.2105 5.0E5 243.2333 2.1E3 261.2211 1.6E6 261.2456 8.1E3 261.2546 5.9E3 263.2367 3.5E3 264.4438 2.4E3 279.1974 4.5E3 279.2320 8.1E4 317.2476 6.3E3 335.2127 6.1E3 335.2582 3.3E5 350.6324 2.9E3 353.2683 4.0E4 370.2182 2.7E3 383.1051 2.9E3 408.9656 3.5E3 486.5912 2.9E3 533.6800 2.8E3 END IONS BEGIN IONS FEATURE_ID=613 PEPMASS=599.4103 SCANS=613 RTINSECONDS=734.571 CHARGE=1+ MSLEVEL=2 MERGED_STATS=8 / 9 (1 removed due to low quality, 0 removed due to low cosine). 65.0101 2.3E3 67.0541 4.7E4 67.1496 2.3E3 69.0334 6.4E4 69.0697 5.3E4 71.1023 2.3E3 71.8244 2.3E3 73.7149 2.8E3 73.8102 3.2E3 73.8999 2.4E3 74.0395 2.7E3 77.0390 3.0E3 79.0541 6.2E4 80.6242 2.2E3 81.0697 2.2E5 83.0490 7.0E4 83.0855 2.2E4 85.0647 6.3E4 87.8945 2.4E3 90.1450 2.7E3 91.0542 7.0E4 92.4260 2.3E3 93.0698 3.9E5 95.0490 8.3E4 95.0853 2.8E5 97.0646 6.8E4 105.0617 2.9E3 105.0697 2.8E5 105.9164 2.5E3 107.0854 2.5E5 109.0647 1.0E5 109.1010 1.2E5 110.6757 2.7E3 111.0432 2.3E3 111.0803 5.9E4 115.0545 3.1E3 117.0698 2.9E4 119.0494 4.5E3 119.0854 5.2E5 119.0954 3.4E3 120.1712 3.1E3 121.0647 7.4E4 121.0911 1.4E4 121.1010 5.4E5 121.5713 2.2E3 123.0803 2.4E5 123.1167 4.2E4 123.8676 2.6E3 124.4711 2.3E3 125.0596 1.8E5 125.0956 9.8E3 128.0623 7.6E3 129.0697 3.0E4 130.3080 2.3E3 131.0854 1.6E5 132.4285 2.3E3 133.0646 3.4E4 133.0904 5.2E3 133.1011 3.6E5 133.1125 3.3E3 135.0803 3.0E5 135.0912 2.2E3 135.1167 2.0E5 137.0598 3.2E4 137.0960 4.0E5 137.1077 4.7E3 139.0753 1.2E5 139.1116 1.1E4 141.0703 6.2E3 142.0777 3.2E4 143.0854 1.9E5 144.0927 4.6E3 145.1011 4.7E5 145.1143 4.5E3 147.0672 5.2E3 147.0803 8.1E5 147.1167 1.2E5 149.0960 1.1E5 149.1324 3.1E3 151.0753 4.2E5 151.0891 3.8E3 151.1117 2.4E4 153.0909 3.1E4 155.0856 7.7E4 156.0932 3.9E4 157.0863 6.3E3 157.1010 5.8E5 157.1124 5.3E3 158.1090 1.1E4 159.0674 2.6E3 159.0805 6.2E4 159.1167 3.6E5 159.1315 4.4E3 160.1256 2.6E3 161.0961 2.1E5 161.1325 3.2E5 163.0767 3.1E3 163.1117 4.7E5 163.1962 2.9E3 165.0784 8.2E3 165.0910 4.0E6 165.1235 5.1E3 167.0860 1.1E4 167.1065 3.8E3 168.0936 2.3E4 169.0470 2.6E3 169.1013 2.0E5 170.1092 4.7E4 171.0809 1.6E4 171.1169 4.8E5 171.1301 2.3E3 173.0962 1.6E5 173.1325 1.3E5 173.5213 2.1E4 173.5347 1.4E5 174.1037 3.5E3 175.1118 7.0E4 175.1482 1.2E5 177.0912 1.0E5 177.1278 7.6E4 179.0871 3.7E3 179.1070 4.5E4 179.1431 4.8E4 179.2600 2.6E3 179.4199 2.7E3 181.0641 2.7E3 181.1018 5.5E4 181.1224 2.2E5 182.1086 1.5E4 183.1169 4.9E5 184.1255 9.9E3 185.0963 3.4E4 185.1326 4.3E5 185.1513 7.1E3 187.1117 8.4E4 187.1297 2.6E3 187.1482 1.4E5 188.1196 7.0E3 189.1274 2.2E5 190.1356 3.5E3 191.1067 2.7E5 191.1428 7.0E4 193.1020 2.2E4 193.1221 1.9E4 193.5077 3.2E3 193.9230 2.6E3 194.1090 1.2E4 195.1169 1.2E5 195.1379 8.0E4 196.1248 4.5E4 197.0982 7.3E3 197.1326 1.9E5 199.1118 7.9E4 199.1482 5.9E4 201.1274 6.8E4 201.1640 2.5E4 203.1096 2.6E3 203.1255 3.8E3 203.1431 1.6E6 205.1223 2.3E4 205.1588 3.1E3 207.1170 5.8E4 207.1383 2.9E5 208.1252 1.5E4 209.0978 3.7E3 209.1326 1.8E5 209.1532 2.6E4 210.1403 1.2E4 211.1119 6.3E4 211.1483 3.1E5 211.1710 3.1E3 212.1575 6.3E3 213.1277 9.2E4 213.1632 1.4E4 214.1353 3.0E3 215.1073 1.1E4 215.1431 6.7E4 217.1227 1.5E4 217.1591 2.3E4 219.1173 9.5E3 219.1389 2.2E4 221.1040 3.5E3 221.1103 3.0E3 221.1342 8.5E4 221.1537 4.3E6 221.2036 3.8E3 221.2511 2.9E3 222.1404 3.7E3 223.1115 1.1E4 223.1485 8.4E4 225.1273 7.2E4 225.1639 7.1E4 227.1433 6.3E4 227.1797 5.4E4 227.2027 2.7E3 229.1220 3.3E4 229.1591 1.6E5 230.1310 4.0E3 231.1383 1.2E5 232.1229 2.9E3 233.1317 2.8E4 233.1542 7.3E4 234.1618 1.8E4 235.1478 5.9E4 235.1711 1.3E4 236.1563 2.8E3 237.1274 4.7E4 237.1641 5.1E4 239.1428 4.7E4 239.1792 5.7E4 240.1526 6.9E3 240.1853 2.7E3 241.1231 6.2E3 241.1579 2.8E4 241.6242 3.5E3 243.1382 5.1E4 243.1745 1.4E4 245.1302 4.0E3 245.1551 2.1E4 247.1432 9.2E3 247.1693 9.0E5 247.1991 2.2E4 249.1288 5.7E3 249.1645 3.6E4 250.1691 3.1E3 251.1429 3.5E4 251.1791 5.2E4 252.1898 2.6E3 253.1587 3.1E4 253.1937 1.4E4 255.1383 2.6E4 255.1738 1.7E4 257.1541 3.9E4 257.1879 6.4E3 260.1565 3.5E3 261.1604 1.4E4 261.1862 4.4E4 263.1431 6.7E3 263.1790 4.7E4 265.1593 3.7E4 265.1931 2.1E4 267.1412 6.8E3 267.1750 2.2E4 268.1829 3.0E3 269.1575 1.9E4 269.1900 9.2E4 271.1694 4.8E4 272.1778 2.7E3 273.1624 1.4E4 273.1879 4.0E3 274.1947 2.2E4 275.1786 2.2E4 277.1595 5.3E3 277.1951 4.7E3 279.1744 1.8E4 281.1906 8.7E4 283.1715 1.3E4 283.2059 1.6E4 285.1851 8.1E4 286.1931 1.2E5 287.2009 6.8E5 287.2378 1.4E4 289.1955 2.5E4 291.1747 2.9E4 291.2090 3.3E3 293.1901 5.1E4 295.2065 2.5E4 298.1936 1.8E4 299.2008 2.2E5 301.2173 2.1E4 303.2116 3.0E3 305.1899 3.3E3 307.2061 2.8E4 309.1847 5.0E4 309.2221 1.2E4 310.1930 1.2E4 311.2009 1.4E5 312.2092 3.8E4 313.2165 2.2E5 317.1913 9.1E3 321.1833 3.6E3 321.2230 6.6E3 324.2089 2.0E4 325.2169 1.2E5 327.2321 3.1E5 329.2280 4.6E3 333.2227 3.6E3 335.2005 2.7E4 339.2327 2.2E4 347.2370 3.0E4 351.2346 7.4E3 363.2312 1.7E4 364.2397 1.7E4 365.2475 2.0E5 373.2515 3.3E4 376.2385 6.1E3 377.2487 3.1E3 387.2537 6.8E3 390.4112 3.0E3 391.2633 1.9E5 401.2857 9.4E3 409.2664 3.1E3 412.2595 2.7E3 413.2686 2.1E5 413.3221 2.8E3 419.2948 2.6E5 427.2344 2.2E3 427.2846 4.6E5 427.3505 7.3E3 445.2908 3.3E3 453.3000 1.1E5 472.3805 2.4E3 472.7334 2.6E3 479.3137 1.2E4 486.8534 2.9E3 492.3272 3.1E3 504.3177 2.9E3 507.3471 5.8E4 519.3462 1.7E5 526.6768 2.6E3 535.8820 2.5E3 543.3500 4.0E3 581.3991 1.9E4 589.5659 2.6E3 599.4093 1.4E5 END IONS BEGIN IONS FEATURE_ID=614 PEPMASS=478.2935 SCANS=614 RTINSECONDS=736.362 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 61.4223 2.4E3 61.5965 2.3E3 62.0597 8.3E4 67.0540 6.0E4 69.0696 3.2E4 70.1157 2.2E3 75.2550 2.6E3 79.0540 1.4E4 80.2580 2.4E3 81.0695 8.3E4 82.4632 2.5E3 83.0851 2.9E4 87.8222 2.3E3 88.2200 2.4E3 91.0537 5.2E3 93.0697 2.9E4 93.2830 2.5E3 95.0851 7.3E4 97.1007 1.7E4 98.9842 1.9E4 99.0794 2.8E3 105.0696 8.9E3 107.0853 2.5E4 109.1009 3.5E4 112.4038 2.4E3 119.0852 8.5E3 121.1009 3.0E4 123.1165 2.1E4 132.6251 2.2E3 133.1007 1.5E4 134.4756 2.3E3 135.1167 1.9E4 135.1944 2.8E3 136.4146 2.8E3 137.1322 1.0E4 140.3049 2.6E3 147.1162 1.2E4 149.1317 4.7E3 155.0100 2.1E4 161.1322 4.7E3 161.9262 2.4E3 163.1485 5.1E3 173.0216 3.0E3 173.5240 1.9E4 173.5374 4.3E4 173.5443 6.2E3 175.1478 5.8E3 189.9952 2.6E3 191.0805 2.9E3 196.8277 2.4E3 198.0532 3.4E3 217.1736 2.7E3 238.4011 2.5E3 263.2362 1.7E4 306.2791 7.6E4 319.2696 2.5E3 325.2352 2.7E3 337.2740 3.4E5 337.3182 8.7E3 338.8386 2.6E3 343.7589 2.3E3 344.4452 2.5E3 362.0969 2.5E3 END IONS BEGIN IONS FEATURE_ID=615 PEPMASS=520.3405 SCANS=615 RTINSECONDS=739.435 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 60.0805 1.0E5 63.0050 2.3E3 64.2339 2.3E3 65.4240 2.5E3 66.9473 2.1E3 67.0539 9.1E3 67.4082 2.6E3 69.0695 9.8E3 70.9422 2.3E3 71.0727 2.2E4 78.6208 2.4E3 81.0695 1.9E4 82.9006 2.5E3 84.1556 2.8E3 86.0961 3.9E5 93.0695 2.9E3 94.7939 2.6E3 95.0852 1.2E4 98.9841 4.7E3 104.0975 2.6E3 104.1067 1.7E6 104.1154 1.8E4 104.1192 7.6E3 104.1228 7.6E3 107.0848 3.4E3 109.1011 2.7E3 123.1171 2.4E3 124.9995 1.3E5 163.0151 1.2E4 163.3160 2.3E3 166.1078 2.7E3 173.5236 1.8E4 173.5334 2.5E4 173.5417 1.1E4 181.0265 6.5E3 184.0352 5.8E3 184.0733 2.5E6 184.0928 5.2E3 207.2448 2.4E3 223.8870 2.4E3 236.1429 2.8E3 258.1104 3.6E4 332.4041 2.5E3 337.2745 4.5E4 368.6182 2.5E3 378.6516 2.6E3 387.3564 2.5E3 443.2575 1.9E4 502.3307 7.8E4 520.3419 2.5E4 END IONS BEGIN IONS FEATURE_ID=616 PEPMASS=532.3486 SCANS=616 RTINSECONDS=743.693 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 2 (0 removed due to low quality, 0 removed due to low cosine). 60.4057 2.3E3 67.0538 6.9E4 68.0166 2.5E3 69.0694 1.3E4 71.0852 2.3E3 78.3158 2.7E3 79.0537 3.1E4 81.0694 1.1E5 83.0852 1.4E4 85.0279 9.3E3 85.0645 3.1E3 85.9385 2.7E3 88.2772 2.2E3 91.0389 2.7E3 91.0539 1.5E4 93.0694 5.4E4 95.0849 9.6E4 97.0288 2.6E3 97.1008 7.1E3 99.0798 6.2E3 105.0693 2.0E4 107.0850 5.7E4 109.1007 7.9E4 111.0802 6.1E3 113.0955 2.7E3 117.0695 7.2E3 119.0850 2.6E4 121.1007 8.1E4 123.1163 4.3E4 125.0957 3.2E3 131.0851 3.5E4 133.1007 3.2E4 135.1164 8.2E4 137.0959 2.4E3 137.1322 1.8E4 139.1112 3.0E3 145.1005 3.5E4 147.1163 3.3E4 149.0967 2.8E3 149.1320 7.0E4 151.1113 2.9E3 159.1165 4.0E4 161.1319 3.2E4 163.1478 4.3E4 173.1324 4.4E4 173.5326 4.6E4 175.1481 1.4E4 177.1635 1.6E4 179.1425 2.6E3 187.1477 3.2E4 201.1647 8.9E3 205.1586 7.0E3 208.9367 2.5E3 233.2266 1.0E4 243.2103 6.1E4 261.1896 5.2E3 261.2209 2.0E5 299.0627 2.6E3 325.1267 2.7E3 335.2581 2.1E4 353.2700 3.2E3 372.1102 2.7E3 END IONS BEGIN IONS FEATURE_ID=617 PEPMASS=353.2690 SCANS=617 RTINSECONDS=743.779 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 3 (1 removed due to low quality, 0 removed due to low cosine). 52.7254 2.5E3 55.0540 1.4E4 57.0334 8.9E3 57.0696 9.8E3 63.4802 2.3E3 65.9637 2.6E3 67.0538 9.8E4 69.0696 2.1E4 69.6680 2.5E3 71.0856 2.6E3 73.0279 2.1E3 74.1776 2.2E3 76.0004 2.4E3 79.0538 4.5E4 81.0646 3.1E3 81.0694 1.3E5 83.0852 1.2E4 84.0152 3.2E3 91.0539 2.1E4 93.0695 8.1E4 95.0795 4.7E3 95.0852 1.1E5 95.1805 3.0E3 97.0648 3.2E3 97.1008 8.9E3 105.0696 2.3E4 107.0852 6.9E4 109.1008 5.9E4 117.0695 1.1E4 119.0767 2.6E3 119.0852 2.6E4 121.1008 6.9E4 121.5334 2.6E3 122.0282 2.5E3 123.1165 2.9E4 131.0851 3.6E4 133.1009 2.7E4 135.0437 1.4E4 135.1165 6.5E4 137.1322 8.2E3 145.1010 2.9E4 147.1165 2.5E4 149.1322 4.4E4 151.0757 3.2E3 159.1165 2.5E4 161.1323 2.2E4 163.1475 2.0E4 173.1324 2.7E4 173.5289 4.2E4 173.5447 6.6E3 175.1482 7.8E3 177.1633 5.8E3 183.2465 2.5E3 186.4872 2.2E3 187.1479 1.3E4 194.1080 2.2E3 201.0916 6.1E3 201.1647 4.1E3 243.2101 1.5E4 252.0780 2.7E3 261.2210 4.1E4 268.0739 2.7E3 270.6366 2.6E3 282.0886 5.8E3 304.1107 3.7E3 305.1159 2.6E3 END IONS BEGIN IONS FEATURE_ID=618 PEPMASS=203.1796 SCANS=618 RTINSECONDS=745.137 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 3 (1 removed due to low quality, 0 removed due to low cosine). 41.0385 8.2E3 46.1439 2.3E3 53.0564 2.2E3 55.0540 7.4E4 56.8106 2.5E3 57.0696 1.4E4 58.7427 2.3E3 59.9475 2.3E3 65.0384 2.3E3 65.7031 2.4E3 67.0507 2.8E3 67.0539 7.4E4 69.0695 7.2E4 70.1654 2.2E3 70.9419 3.6E3 72.3656 2.6E3 79.0539 3.7E4 81.0646 3.3E3 81.0694 1.4E5 83.0851 2.4E4 87.9873 2.5E3 91.0538 6.6E4 93.0693 8.4E4 95.0488 7.2E3 95.0785 3.3E3 95.0850 2.0E5 97.1010 3.6E3 99.5357 2.5E3 103.0540 3.0E3 105.0617 4.5E3 105.0694 2.4E5 105.0781 2.2E3 105.1320 2.4E3 107.0852 9.8E4 109.1008 1.3E5 111.9681 1.0E4 117.0695 8.2E3 119.0755 3.3E3 119.0851 2.5E5 119.0939 4.7E3 119.2638 2.4E3 121.1008 7.1E4 123.0801 2.5E3 123.1165 1.4E4 131.0853 1.6E4 133.1008 3.0E5 133.1111 2.5E3 133.9746 2.6E3 135.1164 3.0E4 145.1008 2.1E4 146.1086 2.5E3 147.1165 2.0E5 148.1912 2.3E3 157.2505 2.5E3 159.1167 1.1E4 160.1244 1.4E4 161.1322 4.9E4 173.5219 1.1E4 173.5302 1.4E4 173.5420 2.1E4 174.1390 3.8E3 175.1482 2.4E4 196.6796 2.6E3 202.0792 3.4E3 203.0849 1.6E4 203.1792 3.7E4 210.4130 2.4E3 END IONS BEGIN IONS FEATURE_ID=619 PEPMASS=355.2270 SCANS=619 RTINSECONDS=751.22 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 6 (0 removed due to low quality, 0 removed due to low cosine). 55.0540 7.3E4 57.0697 2.7E4 59.2094 2.6E3 59.9083 2.7E3 62.0677 2.0E3 63.1562 2.4E3 63.9635 2.5E3 65.2465 2.5E3 65.7387 2.7E3 66.8441 2.0E3 67.0539 7.6E4 69.0140 2.3E3 69.0695 1.2E5 73.8899 2.3E3 77.0386 2.4E3 79.0540 4.1E4 80.0498 2.3E3 80.4357 2.2E3 81.0655 3.2E3 81.0696 1.7E5 83.0852 4.6E4 85.6626 2.6E3 89.1931 2.3E3 90.3146 2.4E3 91.0539 4.4E4 92.7661 2.9E3 93.0631 2.8E3 93.0695 2.8E5 95.0488 4.4E3 95.0792 3.4E3 95.0852 2.0E5 97.1009 5.8E4 101.0001 2.7E3 101.4445 2.2E3 103.6177 2.3E3 103.6253 2.6E3 105.0696 6.8E4 106.0628 2.4E3 107.0488 7.9E3 107.0852 3.0E5 109.0648 8.3E3 109.0928 7.4E3 109.1009 2.8E5 119.0852 6.2E4 121.0642 1.5E4 121.0913 2.4E3 121.1009 1.8E5 123.1165 9.3E4 126.0346 2.5E3 131.0839 2.1E3 133.1010 5.2E4 135.0438 3.6E4 135.1055 8.9E3 135.1166 2.8E5 137.0595 2.9E3 137.1324 1.1E4 139.0252 2.3E3 147.0438 1.6E4 147.0801 2.1E4 147.1166 8.5E4 149.1324 9.0E4 151.0388 3.2E3 159.0440 2.8E4 159.0805 1.5E4 160.5295 2.4E3 161.0593 5.6E3 161.1324 1.3E4 163.1482 2.5E4 165.0546 1.7E6 173.0596 4.4E4 173.0963 3.4E3 173.5211 1.3E4 173.5359 7.6E4 175.0758 3.1E3 175.1484 3.2E4 177.0550 1.9E4 177.1633 2.9E4 179.0704 1.2E5 179.0857 2.4E3 185.0596 4.6E3 187.0756 4.9E4 189.0550 5.6E4 189.1641 5.0E4 190.1712 2.3E4 191.0703 5.3E4 191.1794 5.8E4 193.0857 2.0E4 199.0756 2.2E4 199.1131 3.3E3 201.0911 3.4E4 203.0704 9.0E4 204.8890 3.4E3 205.0867 3.6E4 211.0754 3.7E3 213.0913 1.1E4 214.8737 3.4E4 215.1070 2.4E3 217.0863 3.6E4 218.8690 2.9E4 225.0914 4.8E3 227.1068 2.5E4 229.0869 1.0E4 230.8681 3.3E3 231.1023 5.2E4 239.1057 3.9E3 241.1229 6.7E3 243.1015 5.6E4 245.1172 2.3E4 253.1254 2.8E3 253.2798 2.5E3 257.1172 1.4E4 257.2468 2.2E3 259.1337 1.4E4 267.1381 1.6E4 271.1340 1.2E4 273.1480 7.0E3 280.9055 2.9E3 283.5749 2.5E3 285.1480 1.5E4 290.8903 1.1E4 299.1638 9.8E3 308.9010 8.2E4 312.7235 2.6E3 313.1820 2.9E3 323.2057 4.1E3 332.0762 2.5E3 355.2280 3.2E4 END IONS BEGIN IONS FEATURE_ID=620 PEPMASS=313.1802 SCANS=620 RTINSECONDS=751.428 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 48.1499 2.5E3 48.3484 2.3E3 54.3094 2.4E3 55.0540 3.1E3 55.2046 2.4E3 55.5430 2.3E3 57.0332 3.2E3 57.0697 1.2E4 65.7946 2.2E3 67.0540 1.6E4 69.0696 1.1E4 71.0847 2.2E3 79.0539 3.4E4 81.0695 6.2E4 84.7902 2.4E3 91.0539 2.1E4 93.0695 9.2E4 95.0852 4.3E4 102.8612 2.4E3 105.0336 7.2E3 105.0696 5.9E4 107.0852 9.4E4 109.0646 1.3E4 109.1009 1.1E4 114.9654 2.4E3 119.0852 2.7E4 121.0645 6.2E3 121.1008 3.5E4 133.0289 2.4E3 133.1014 1.1E4 135.0438 2.9E4 135.1166 4.8E4 137.0595 9.3E3 145.1013 2.8E3 145.7627 2.4E3 147.0799 2.7E3 147.1166 6.4E4 148.1246 1.0E4 149.1202 3.0E3 149.1323 1.4E5 153.9475 2.8E3 159.0432 6.3E3 159.0804 1.0E4 159.7330 2.4E3 160.0860 2.6E3 161.0962 2.5E3 161.1324 2.0E4 162.0955 2.5E3 165.0546 1.0E6 173.0593 6.5E3 173.5221 1.5E4 173.5408 3.0E4 177.0546 3.4E3 179.0704 2.2E4 185.0606 2.9E3 187.0754 1.5E4 189.0547 1.7E4 191.0696 3.3E3 196.1299 2.2E3 197.0968 2.7E3 197.1980 2.4E3 199.0760 8.3E3 201.0917 9.9E3 203.0703 1.3E4 205.0864 7.1E3 217.0857 1.3E4 219.1002 3.0E3 221.0938 3.0E3 225.0907 1.2E4 231.1022 7.0E3 247.6853 2.3E3 253.1560 6.2E3 281.1538 1.4E4 313.1795 8.5E3 END IONS BEGIN IONS FEATURE_ID=621 PEPMASS=299.1646 SCANS=621 RTINSECONDS=751.617 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 48.7386 2.5E3 51.4422 2.9E3 52.5752 2.5E3 54.9181 2.3E3 55.0177 5.6E3 55.0540 1.8E4 56.9561 2.1E3 57.0697 5.0E3 58.0972 2.4E3 61.4520 2.4E3 62.4179 2.6E3 62.7028 2.3E3 62.9728 2.5E3 65.0850 2.4E3 67.0540 1.8E4 69.0696 1.3E4 73.0284 2.4E3 77.0384 1.3E4 79.0539 3.4E4 81.0653 2.7E3 81.0696 8.0E4 86.6735 2.3E3 87.2447 2.2E3 91.0539 3.4E4 93.0695 7.5E4 95.0489 1.5E4 95.0852 3.8E4 97.0645 1.6E4 105.0334 3.1E3 105.0696 4.2E4 107.0488 7.9E4 107.0852 7.5E4 109.0645 3.2E4 109.1009 1.4E4 111.0801 3.5E4 112.0757 2.4E3 117.0696 1.4E4 119.0487 2.6E3 119.0854 1.9E4 121.0645 3.1E4 121.1008 1.2E4 123.0800 6.4E4 123.1161 9.5E3 127.0752 1.8E4 128.3705 3.0E3 131.0475 2.6E3 131.0856 2.0E4 133.0179 3.3E3 133.0281 1.8E5 133.0646 3.6E4 133.1008 1.8E4 134.0361 5.7E3 135.0437 2.8E5 135.0557 2.9E3 135.1165 9.0E3 137.0953 4.7E3 142.1488 2.7E3 145.0644 2.4E4 145.1007 1.6E4 146.1091 2.6E3 147.0437 3.1E4 147.0557 2.8E3 147.0804 2.4E4 147.1165 6.5E4 149.0593 3.3E4 149.1322 3.1E3 151.0387 1.1E5 151.1117 1.4E4 155.0852 3.3E3 158.0722 9.7E3 159.0436 2.6E3 159.0803 2.1E4 159.1165 2.1E4 161.0600 7.4E3 161.0960 2.4E4 165.0549 1.9E4 165.1272 7.9E4 171.0802 1.1E4 173.0596 2.7E3 173.0962 7.0E3 173.5248 1.4E4 173.5391 2.8E4 175.0759 1.4E4 175.1138 2.7E3 177.0543 6.5E3 177.1271 2.9E3 183.0802 8.0E3 185.0963 1.1E4 187.0752 1.5E4 188.4965 2.6E3 189.0911 5.5E4 197.0967 8.2E3 199.0758 3.6E3 201.0910 4.8E4 203.1054 2.7E3 211.1128 2.4E3 213.0915 2.9E3 226.6842 2.5E3 231.1035 3.6E3 239.1054 3.7E3 251.2261 2.8E3 267.2425 2.3E3 281.1534 6.8E3 282.2795 7.3E3 284.0670 2.6E3 299.0914 4.1E4 299.1278 2.5E3 299.1649 2.4E4 END IONS BEGIN IONS FEATURE_ID=622 PEPMASS=618.4283 SCANS=622 RTINSECONDS=752.373 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 64.5696 2.2E3 67.0540 2.8E4 67.8054 2.3E3 69.0333 2.0E4 69.0695 3.3E4 71.0489 1.6E4 72.0486 2.2E3 72.4963 2.5E3 73.7034 2.4E3 74.2434 2.3E3 79.0538 3.7E4 79.2854 2.6E3 81.0694 1.3E5 82.8644 2.5E3 83.0488 4.1E4 83.0851 1.8E5 84.0725 2.5E3 85.0645 2.2E4 87.0440 7.9E3 87.5466 2.4E3 91.0538 3.8E4 93.0695 1.3E5 93.6514 2.3E3 95.0488 6.8E4 95.0794 2.4E3 95.0852 9.3E4 95.9599 2.3E3 97.0644 8.1E4 97.1010 3.1E3 99.0441 1.3E4 99.0804 5.9E3 105.0695 1.3E5 107.0489 1.2E4 107.0851 2.0E5 109.0644 4.2E4 109.1008 1.0E5 111.0802 2.0E4 111.1167 3.2E3 113.0596 3.1E3 113.0958 4.4E4 115.0546 2.7E3 117.0696 1.9E4 119.0757 2.7E3 119.0851 2.1E5 120.0929 4.0E3 121.0642 2.3E4 121.1008 2.0E5 123.0801 6.6E4 123.1165 2.4E4 124.0885 2.7E3 125.0957 8.2E4 128.0623 6.4E3 129.0696 1.7E4 130.0779 2.7E3 131.0852 1.0E5 132.0930 1.9E4 132.1489 2.3E3 133.0646 6.9E3 133.1008 1.7E5 135.0800 4.1E4 135.1164 3.8E4 136.0888 3.2E3 137.0957 2.6E4 139.1114 6.8E4 139.1216 2.7E3 141.0911 2.5E3 142.0778 1.8E4 142.8144 2.7E3 143.0852 1.1E5 144.0929 2.7E4 145.0649 7.3E3 145.1008 2.4E5 146.1084 6.5E3 147.0801 3.8E4 147.1164 8.7E4 149.0958 5.3E4 149.1319 1.0E4 151.0752 8.7E3 151.1112 1.3E4 153.0903 4.2E3 153.1273 7.0E3 153.1829 2.4E3 155.0851 3.6E4 155.1063 3.4E4 156.0928 3.2E4 157.0865 2.9E3 157.1008 2.1E5 158.1082 1.9E4 159.0801 4.4E4 159.1025 2.8E3 159.1166 1.4E5 160.0879 5.5E4 161.0958 6.0E4 161.1320 2.1E4 163.1114 2.3E4 165.0915 8.5E3 165.1268 1.0E4 167.0843 2.4E3 167.0877 1.2E4 167.1064 1.2E5 167.1423 6.4E3 168.0924 2.9E3 169.1011 8.5E4 169.1191 3.6E3 170.1087 2.2E4 171.0812 2.6E3 171.1004 8.2E3 171.1167 1.5E5 172.1247 6.8E3 173.0960 4.2E4 173.1324 7.7E4 173.5268 3.2E4 173.5388 4.5E4 174.1035 2.9E3 175.1116 4.8E4 175.1482 1.6E4 177.1270 8.8E3 179.0855 1.0E4 179.1068 2.8E3 179.1428 3.4E4 181.1010 4.1E4 181.1221 7.4E4 182.1093 3.1E4 183.1166 1.1E5 183.1365 1.5E4 184.1241 1.7E4 185.0959 1.8E4 185.1325 1.0E5 186.1031 2.7E3 186.1398 1.6E4 187.1115 3.1E4 187.1478 4.9E4 188.0203 2.9E3 189.1269 3.0E4 190.1343 3.7E3 191.1430 4.8E4 193.1011 2.0E4 194.1091 1.6E4 195.1166 8.2E4 195.1365 3.7E3 196.1243 2.7E4 197.0987 8.2E3 197.1323 1.8E5 198.1400 1.5E4 199.1120 2.9E4 199.1480 7.5E4 200.1191 2.7E3 201.1275 1.8E4 201.1635 1.4E4 203.1428 2.7E4 205.1574 3.5E3 206.1093 4.8E3 207.1164 4.3E4 207.1380 2.3E4 208.1244 2.1E4 208.1457 6.9E3 209.1323 1.1E5 209.1535 1.3E4 210.1403 2.0E4 211.1122 1.4E4 211.1481 9.9E4 212.1195 3.0E3 212.1556 1.7E4 213.1272 3.6E4 213.1638 2.8E4 215.1430 6.7E4 217.1591 1.1E4 219.1170 7.6E3 220.1244 1.2E4 221.1319 5.1E4 221.1538 5.6E4 222.1407 1.6E4 223.1480 7.4E4 224.1554 8.2E3 225.1264 1.9E4 225.1639 3.4E4 227.1432 2.7E4 227.1796 5.9E3 229.1586 9.8E3 231.1731 6.7E3 233.1325 1.7E4 233.1538 1.8E5 234.1392 8.8E3 235.1481 5.2E4 236.1563 1.1E4 237.1267 4.4E3 237.1639 5.4E4 239.1433 1.1E4 239.1791 1.5E4 241.1588 1.6E4 245.1313 8.0E3 245.1557 4.8E3 246.1376 7.8E3 246.1625 1.6E4 247.1471 2.4E4 247.1711 1.4E4 248.1554 3.3E3 249.1635 5.3E4 250.1708 4.3E3 251.1442 6.8E3 251.1790 3.0E4 253.1591 2.0E4 253.1948 6.4E3 255.1740 1.2E5 257.1885 5.5E3 259.1478 1.6E4 260.1546 9.6E3 261.1637 3.9E4 263.1488 2.4E3 263.1793 3.1E4 264.1871 2.9E3 265.1583 1.4E4 265.1953 2.2E4 267.1746 1.9E4 268.1811 7.7E3 269.1899 1.7E4 270.1961 5.3E3 271.2029 6.4E3 273.1606 4.5E3 273.1871 1.8E4 275.1795 2.7E4 277.1955 1.8E4 279.1746 1.7E4 279.2095 5.8E3 281.1901 2.4E4 282.1979 4.2E3 283.2066 8.8E3 285.1862 1.5E4 286.1935 1.5E4 287.1755 3.7E3 287.2033 5.4E3 288.0089 2.4E3 289.1955 2.1E4 291.1739 3.2E3 291.2104 4.7E3 293.1900 1.4E4 294.1957 3.5E3 295.2061 1.9E4 298.1935 5.8E3 299.2027 1.8E4 301.1944 1.4E4 301.5850 3.1E3 303.2099 3.9E3 307.2067 4.2E3 311.2005 8.7E3 313.1946 2.9E3 315.2114 3.3E3 317.2249 4.4E3 321.2193 5.9E3 331.2458 3.1E3 333.2240 3.0E3 337.2539 7.3E3 345.2203 3.0E3 347.2355 3.4E3 349.2507 3.1E3 353.2481 2.5E3 354.2500 2.9E3 359.2389 2.6E3 361.2523 2.8E3 365.2469 1.2E4 373.2567 4.1E3 399.2673 7.8E3 450.2859 2.6E3 457.3063 3.3E3 575.4084 2.5E3 600.1047 2.3E3 END IONS BEGIN IONS FEATURE_ID=623 PEPMASS=599.4102 SCANS=623 RTINSECONDS=753.423 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 5 (0 removed due to low quality, 0 removed due to low cosine). 67.0538 6.8E3 67.9201 2.9E3 69.0334 3.0E3 69.0697 1.2E4 73.9858 2.2E3 79.0537 2.6E3 79.1844 2.3E3 81.0696 4.2E4 83.0487 7.9E3 83.0849 6.2E3 83.1191 2.1E3 85.0643 1.1E4 87.9212 2.3E3 89.8027 3.1E3 91.0533 2.8E3 93.0696 4.9E4 95.0490 9.9E3 95.0853 3.7E4 95.5816 2.2E3 97.0643 8.2E3 97.0756 2.6E3 105.0695 4.5E4 107.0700 2.2E3 107.0852 5.2E4 108.6838 2.1E3 109.0646 1.5E4 109.1007 2.5E4 111.0803 2.7E3 111.2212 2.8E3 119.0852 7.3E4 121.0645 6.1E3 121.1007 7.7E4 121.5321 2.3E3 123.0801 3.7E4 123.1165 3.6E3 125.0591 2.3E4 131.0852 2.6E4 133.1008 6.3E4 135.0800 3.4E4 135.1165 2.3E4 137.0957 4.7E4 139.0752 6.2E3 141.9198 2.6E3 143.0850 3.1E4 145.1008 7.9E4 147.0800 9.2E4 147.1167 2.4E4 149.0956 1.4E4 151.0749 5.0E4 155.0856 6.9E3 156.0924 2.7E3 157.1007 7.5E4 159.1166 5.4E4 161.0960 2.6E4 161.1318 3.6E4 163.1115 5.4E4 165.0756 4.5E3 165.0908 4.3E5 165.1065 5.4E3 167.1064 6.2E3 169.1010 3.2E4 171.1166 7.3E4 173.0963 1.4E4 173.1324 2.1E4 173.5289 4.4E4 173.5423 1.8E4 175.1105 3.0E3 175.1476 1.4E4 177.0910 8.7E3 177.1277 3.3E3 179.1436 3.3E3 181.1009 6.8E3 181.1220 2.1E4 183.1166 6.0E4 184.1239 3.0E3 185.1324 5.1E4 187.1116 7.3E3 187.1480 1.3E4 189.1269 2.7E4 191.1060 2.9E4 191.1422 6.8E3 193.1016 2.8E3 193.1201 2.8E3 195.1166 2.0E4 195.1364 9.7E3 196.1265 2.9E3 197.1320 3.1E4 199.1121 3.0E3 199.1479 4.1E3 201.1269 7.9E3 203.1430 1.7E5 207.1163 1.1E4 207.1376 3.5E4 207.4949 2.6E3 209.1322 3.4E4 211.1124 6.0E3 211.1479 4.1E4 213.1284 3.2E3 215.1409 2.7E3 221.1327 1.9E4 221.1536 4.2E5 223.1480 1.2E4 225.1269 3.4E3 225.1632 7.6E3 229.1584 1.6E4 231.1369 1.5E4 233.1538 1.4E4 235.1472 3.5E3 239.1405 6.8E3 247.1693 7.2E4 261.2152 2.6E3 263.1769 3.1E3 269.1892 8.6E3 281.1908 6.5E3 285.1867 1.1E4 286.1937 9.6E3 287.2008 7.9E4 289.2037 2.5E3 299.2009 2.3E4 311.1999 9.1E3 313.2160 4.8E4 320.1853 2.8E3 325.2148 1.2E4 327.2315 2.3E4 364.2386 3.4E3 365.2460 1.4E4 374.9988 2.3E3 377.4676 2.5E3 386.5625 2.3E3 391.2622 1.3E4 413.2686 6.7E3 419.2931 1.8E4 427.2850 3.6E4 427.3552 2.5E3 453.2978 9.2E3 464.7291 2.6E3 466.3105 3.4E3 507.3470 2.8E4 509.2549 2.9E3 519.3446 8.1E3 527.2557 3.5E3 527.2679 7.3E3 537.2509 2.6E3 599.4079 9.8E3 END IONS BEGIN IONS FEATURE_ID=624 PEPMASS=205.1954 SCANS=624 RTINSECONDS=757.347 CHARGE=1+ MSLEVEL=2 MERGED_STATS=11 / 11 (0 removed due to low quality, 0 removed due to low cosine). 41.0385 6.1E4 43.0177 2.8E4 43.0542 2.5E4 46.1079 2.1E3 47.8792 2.4E3 49.8750 2.7E3 50.3413 2.5E3 50.5538 2.4E3 50.8304 2.2E3 51.1156 2.1E3 51.5774 2.5E3 51.9709 2.8E3 52.7485 2.5E3 53.0384 1.5E4 53.0635 2.2E3 53.6527 2.5E3 55.0540 5.7E5 55.1469 2.3E3 55.9342 7.4E4 56.1964 2.4E3 56.6116 2.3E3 57.0672 2.3E3 57.0696 1.5E5 57.5966 2.6E3 58.1321 2.4E3 58.9156 2.7E3 59.8811 2.6E3 60.8642 2.3E3 61.9183 2.0E3 64.7901 2.2E3 64.9464 3.1E3 67.0539 3.7E5 67.1369 2.3E3 69.0695 6.9E5 71.0853 1.3E4 71.5004 2.1E3 71.9402 2.1E3 72.9368 5.1E5 73.0165 2.4E3 73.0282 5.0E3 75.2977 2.4E3 77.0386 5.7E3 77.3427 2.3E3 78.3343 2.3E3 79.0539 3.8E5 79.7625 2.3E3 81.0695 1.3E6 81.0778 3.0E3 83.0852 1.8E5 83.4278 2.5E3 87.4355 2.5E3 88.4507 2.5E3 88.9448 2.5E3 90.9473 3.8E5 91.0539 1.5E5 93.0695 1.6E6 93.0759 3.6E3 93.8354 2.3E3 95.0490 3.6E4 95.0851 7.5E5 97.1008 9.2E4 99.5551 2.3E3 99.9476 9.6E4 101.0368 2.2E3 101.0510 2.7E3 101.4075 2.4E3 105.0695 1.4E5 107.0851 1.0E6 107.0930 2.4E3 107.8701 2.3E3 107.9505 2.3E3 108.9580 1.9E4 109.0642 8.1E3 109.0927 9.2E3 109.1008 5.4E5 111.1165 8.2E3 113.4175 2.9E3 113.9549 2.3E4 113.9634 1.0E6 115.9426 1.7E4 116.6696 2.2E3 119.0854 3.8E4 119.5101 2.3E3 121.0911 1.5E4 121.1008 1.7E6 121.1096 3.8E3 121.1112 1.8E4 123.0801 6.8E5 123.1165 2.2E5 125.1416 2.3E3 126.7327 2.5E3 128.9506 8.5E3 130.7547 2.2E3 131.0065 2.2E3 131.9740 1.5E5 133.0752 2.6E3 133.1010 4.2E3 133.9534 1.7E4 134.2393 2.4E3 135.1057 5.1E3 135.1165 3.9E5 135.7225 2.2E3 137.1324 1.6E4 141.6990 2.3E3 143.3799 2.4E3 147.1165 2.7E3 149.1203 3.2E3 149.1322 4.7E5 152.2987 2.7E3 154.9891 8.1E3 163.1109 3.1E3 163.1479 5.0E4 173.0385 2.4E3 173.5207 8.8E3 173.5344 9.7E4 174.3778 2.5E3 175.4950 2.2E3 181.4495 2.5E3 182.2106 2.3E3 185.2526 2.3E3 186.5117 2.6E3 198.4708 2.4E3 202.1170 2.7E3 205.1946 1.7E4 210.4762 2.4E3 215.5585 2.9E3 END IONS BEGIN IONS FEATURE_ID=625 PEPMASS=299.1647 SCANS=625 RTINSECONDS=758.258 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 52.3720 2.3E3 52.8867 2.4E3 54.1142 2.5E3 55.0176 5.0E3 55.0541 1.2E4 55.5438 2.2E3 59.1508 2.4E3 64.6611 2.2E3 67.0539 2.2E4 69.0695 1.4E4 75.8948 2.8E3 77.0382 6.9E3 79.0538 2.6E4 81.0654 2.3E3 81.0695 7.2E4 82.3015 2.4E3 83.6490 2.6E3 91.0539 2.8E4 93.0695 6.0E4 95.0488 1.1E4 95.0852 3.8E4 97.0646 1.1E4 100.8276 2.2E3 101.3878 2.4E3 105.0695 3.4E4 107.0487 4.9E4 107.0851 4.5E4 109.0646 1.8E4 109.1007 1.8E4 111.0802 1.0E4 117.0697 6.6E3 119.0484 2.5E3 119.0853 1.6E4 121.0643 1.7E4 121.1005 9.5E3 122.9245 2.5E3 123.0799 2.9E4 123.1163 1.3E4 127.0752 6.1E3 131.0849 1.5E4 133.0279 1.5E5 133.0644 3.5E4 133.1011 1.4E4 134.0360 2.6E3 135.0436 2.3E5 145.0645 2.1E4 145.1003 1.3E4 146.1089 3.2E3 147.0436 2.3E4 147.0799 3.0E4 147.1163 3.0E4 149.0592 2.8E4 149.0714 3.2E3 151.0385 8.8E4 154.1045 2.7E3 157.0642 7.9E3 158.0718 7.1E3 159.0802 2.0E4 159.1166 8.5E3 161.0594 1.2E4 161.0958 2.1E4 165.1272 3.3E4 171.0807 6.5E3 173.0603 4.4E3 173.0962 7.8E3 173.5249 1.7E4 173.5382 2.3E4 173.5441 6.1E3 175.0750 1.3E4 175.1113 5.2E3 177.0542 1.3E4 183.0809 7.5E3 185.0957 8.1E3 187.0751 1.6E4 189.0904 2.9E4 196.3156 2.4E3 197.0960 7.2E3 197.3538 2.8E3 199.0755 1.0E4 201.0909 2.6E4 205.0871 2.4E3 211.1113 6.3E3 213.0906 7.6E3 231.1017 2.4E3 235.6292 2.6E3 243.1379 3.2E3 246.8831 2.3E3 269.1507 3.0E3 281.1544 8.4E3 282.2785 7.9E3 284.0670 7.1E3 299.0913 4.2E4 299.1642 2.6E4 302.5746 2.6E3 END IONS BEGIN IONS FEATURE_ID=626 PEPMASS=264.2325 SCANS=626 RTINSECONDS=758.824 CHARGE=1+ MSLEVEL=2 MERGED_STATS=15 / 15 (0 removed due to low quality, 0 removed due to low cosine). 46.0813 2.5E3 47.5349 2.3E3 47.6225 2.3E3 48.4984 2.2E3 48.9112 2.1E3 49.4122 2.3E3 51.9094 2.6E3 52.1928 2.8E3 52.5126 3.0E3 53.7081 2.5E3 54.3473 2.1E3 55.0541 1.2E5 55.8488 2.4E3 57.0697 9.2E4 57.0790 2.3E3 57.7449 2.5E3 57.8516 2.9E3 59.2143 2.3E3 59.2435 2.4E3 59.5029 2.2E3 60.0403 3.9E3 60.0442 3.6E6 60.0477 1.4E4 60.0495 1.3E4 61.5290 2.5E3 62.0965 2.1E3 62.1637 2.0E3 62.5531 3.0E3 62.6107 2.2E3 63.2561 2.7E3 66.7856 2.3E3 67.0539 1.2E5 67.4702 2.2E3 67.5841 2.4E3 67.6054 2.4E3 68.5949 2.3E3 68.7177 2.2E3 69.0695 3.6E5 69.9401 2.2E3 71.0852 1.9E4 73.3998 2.3E3 75.3221 5.3E3 75.7030 2.7E3 76.1899 2.4E3 78.8609 2.3E3 79.0539 1.4E5 79.1690 2.4E3 81.0695 1.6E6 81.0779 6.3E3 81.7978 2.2E3 82.6939 2.1E3 83.0852 1.2E5 83.2827 2.2E3 84.9842 2.3E3 85.4463 2.5E3 85.7013 2.4E3 89.2271 2.9E3 90.7113 2.2E3 91.0540 3.4E4 91.0696 2.6E3 91.1984 2.3E3 93.0695 8.6E5 93.0800 2.4E3 93.4600 2.1E3 93.7408 2.3E3 94.7366 2.8E3 95.0490 2.6E3 95.0852 7.5E5 97.1009 1.2E5 97.8524 2.5E3 99.6230 2.8E3 99.7354 2.3E3 100.7656 2.4E3 101.1238 2.4E3 104.7359 2.4E3 105.0697 3.9E4 105.1368 2.9E3 106.6647 2.4E3 107.0852 6.5E5 107.7607 2.5E3 109.0927 8.0E3 109.1008 6.8E5 111.1166 3.5E4 112.9835 2.8E3 119.0853 8.4E3 121.0911 1.0E4 121.1008 4.1E6 121.1108 8.1E4 123.1165 3.1E5 125.9048 3.1E3 133.0754 2.5E3 134.9902 2.5E3 135.1056 3.1E3 135.1166 5.1E5 136.5186 2.1E3 137.1325 4.0E4 137.6593 2.3E3 139.3848 2.3E3 141.0242 2.2E3 143.0687 2.5E3 143.1009 2.9E3 146.2566 2.6E3 147.1165 2.3E3 147.3808 2.5E3 149.1187 1.2E4 149.1322 1.4E6 149.1462 3.5E4 154.0448 2.3E3 159.6176 2.5E3 160.4654 2.6E3 160.9837 2.3E3 163.1480 8.6E4 163.1921 2.3E3 167.9282 2.4E3 172.8156 2.3E3 173.5251 1.0E5 173.5405 8.8E4 174.7906 2.4E3 176.6153 2.4E3 177.1633 2.6E3 180.0822 3.0E3 188.2152 2.4E3 189.1636 1.1E4 201.6203 2.3E3 201.6333 2.6E3 202.9428 2.3E3 205.1735 4.2E3 205.1952 6.3E5 206.1892 6.1E3 206.9037 2.5E3 208.1902 2.3E3 209.2717 2.4E3 211.1234 2.3E3 218.3739 2.9E3 218.5443 2.3E3 219.4278 2.4E3 223.3028 2.8E3 223.4959 2.4E3 236.0699 2.7E3 248.5489 2.4E3 258.8523 2.4E3 263.3905 2.5E3 264.2323 1.7E5 266.6282 2.3E3 END IONS BEGIN IONS FEATURE_ID=627 PEPMASS=355.2270 SCANS=627 RTINSECONDS=761.207 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 55.0540 2.9E4 57.0696 9.3E3 57.1806 2.2E3 64.0727 2.4E3 66.6923 2.3E3 66.9409 2.3E3 67.0539 2.5E4 69.0695 4.0E4 69.5082 2.3E3 70.0274 2.4E3 70.5678 2.4E3 74.2722 2.3E3 78.5520 2.7E3 79.0539 3.5E4 81.0695 2.2E5 83.0851 3.7E4 84.4419 2.6E3 89.2665 2.1E3 91.0539 3.1E4 93.0639 3.2E3 93.0695 1.3E5 95.0793 2.8E3 95.0852 1.5E5 97.0566 2.6E3 97.1010 2.3E4 97.2841 2.5E3 99.6631 2.5E3 104.9527 2.2E3 105.0337 5.8E3 105.0696 4.3E4 107.0852 2.0E5 109.0648 4.1E3 109.1009 1.7E5 111.5654 2.4E3 111.8433 2.7E3 116.0650 2.4E3 117.2371 2.4E3 119.0852 5.1E4 121.0647 1.3E4 121.1009 1.8E5 123.1165 4.4E4 123.6467 2.4E3 129.9955 2.2E3 133.1010 5.6E4 135.0437 2.7E4 135.1166 2.8E5 137.0599 9.1E3 137.1320 2.9E3 142.4939 2.6E3 145.1002 3.2E3 147.0440 1.7E4 147.0803 1.3E4 147.1166 2.9E4 149.0594 3.4E3 149.1323 9.2E4 159.0441 2.8E4 159.0809 1.2E4 160.0859 2.5E3 161.0593 6.0E3 161.1318 1.2E4 163.1480 7.8E4 165.0546 1.5E6 173.0600 2.5E4 173.0958 1.1E4 173.5231 7.0E3 173.5383 4.4E4 174.1901 2.5E3 175.0745 3.7E3 175.1488 1.7E4 177.0549 1.4E4 177.1641 4.0E4 179.0704 9.1E4 185.0598 3.5E3 185.1289 2.5E3 187.0755 3.7E4 189.0544 2.0E4 189.1637 4.7E4 190.1716 1.6E4 191.0700 3.6E4 191.1795 5.5E4 191.9630 2.3E3 193.0862 1.5E4 201.0913 5.9E4 203.0706 2.0E4 204.8893 6.8E3 205.0865 2.1E4 207.1023 1.0E4 213.0912 2.9E3 214.8733 1.9E4 215.1068 2.4E4 217.0863 2.0E4 218.8677 2.3E4 219.1025 1.3E4 220.8834 2.4E3 227.1073 1.3E4 231.1025 1.8E4 233.1164 6.1E3 239.1072 1.2E4 241.1237 3.8E3 243.1021 3.0E3 245.1178 6.7E3 251.9489 2.4E3 253.1228 6.3E3 257.1182 2.4E3 258.8619 2.4E3 259.1335 2.8E3 267.1375 9.7E3 273.1499 7.3E3 275.1660 2.7E3 285.1494 4.1E3 290.8906 1.0E4 299.1628 3.7E3 308.9008 5.0E4 323.2004 1.1E4 326.3130 3.0E3 355.2271 2.8E4 END IONS BEGIN IONS FEATURE_ID=628 PEPMASS=411.2148 SCANS=628 RTINSECONDS=761.555 CHARGE=1+ MSLEVEL=2 MERGED_STATS=7 / 7 (0 removed due to low quality, 0 removed due to low cosine). 60.2982 2.3E3 62.0041 2.5E3 62.1468 2.3E3 63.0519 2.3E3 63.2006 2.8E3 63.3833 2.3E3 63.6888 2.4E3 64.1256 2.6E3 67.6932 2.5E3 69.6908 2.4E3 71.2496 2.3E3 74.2731 2.7E3 74.9062 2.3E3 77.7409 2.3E3 78.7723 2.5E3 80.1531 2.2E3 83.7461 2.5E3 94.4819 2.7E3 96.5711 2.4E3 100.6726 2.4E3 101.6628 2.5E3 103.6640 2.1E3 104.8407 2.3E3 106.0202 2.3E3 109.7803 2.5E3 110.3562 2.3E3 119.2353 2.4E3 120.6856 2.2E3 123.2734 2.5E3 124.9073 2.2E3 127.9316 2.5E3 129.9811 2.1E3 135.6397 2.1E3 138.2154 2.2E3 149.6700 3.0E3 149.6907 5.3E3 151.8860 2.5E3 162.0596 2.5E3 173.5258 3.7E4 173.5394 6.2E4 175.9232 2.3E3 176.2673 2.8E3 179.0222 4.7E3 188.1241 2.4E3 199.5736 3.1E3 213.1121 2.8E3 233.8964 2.8E3 253.5022 2.8E3 290.8211 2.5E3 309.0342 2.8E3 309.1110 2.9E3 311.0836 4.1E3 311.1252 5.5E5 311.1688 3.1E3 324.8521 2.4E3 351.8542 2.2E3 360.2663 2.4E3 379.1890 2.2E4 411.2142 2.7E5 413.1755 2.7E3 END IONS BEGIN IONS FEATURE_ID=629 PEPMASS=689.2459 SCANS=629 RTINSECONDS=763.686 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 68.0769 2.3E3 71.4699 1.5E4 71.4731 4.9E3 72.2681 2.2E3 73.8571 2.5E3 80.8306 2.1E3 83.0075 2.5E3 83.6949 2.2E3 86.7325 2.2E3 94.2346 2.0E3 95.2003 2.3E3 99.5501 2.3E3 104.1689 2.2E3 104.2565 2.5E3 109.8703 2.4E3 123.4786 2.3E3 123.4914 2.4E3 125.1067 2.4E3 128.9392 2.3E3 158.0413 2.1E3 159.3585 2.5E3 173.5260 7.7E4 173.5431 3.7E4 181.4966 2.4E3 182.6078 2.6E3 234.5079 2.6E3 258.9836 2.7E3 262.0491 2.7E3 282.0371 2.5E3 399.1399 3.3E3 400.1533 6.8E4 401.1614 3.1E3 414.1684 2.6E4 415.1736 7.6E3 427.1771 8.6E3 428.1845 4.1E4 429.1922 3.5E5 429.2436 3.5E3 441.1939 3.8E3 442.1636 2.0E4 443.1723 2.5E3 444.1419 1.6E4 447.2023 1.4E4 450.3050 2.6E3 455.1707 7.0E4 456.1796 3.7E4 457.1867 1.4E5 458.1941 2.9E4 459.1663 1.3E4 469.1875 4.3E3 472.1720 2.3E4 473.1018 3.7E3 473.1818 3.6E5 473.2601 5.1E3 474.1888 1.1E4 475.1976 5.0E3 480.1904 2.5E3 482.1621 3.0E3 483.1663 9.5E4 484.2088 3.4E4 485.1810 9.0E3 486.2274 4.2E3 487.1620 3.9E4 491.1925 1.9E4 497.1797 1.6E4 499.1602 2.9E4 500.1692 4.3E4 501.0540 3.2E3 501.1765 6.5E5 501.2424 2.1E3 502.1847 1.7E5 509.1842 1.0E4 510.1581 3.8E3 511.1952 5.8E4 512.2038 3.7E4 513.1389 2.9E3 514.1867 1.8E4 519.1835 2.0E4 525.1765 2.4E3 527.1558 1.2E5 528.1587 2.6E3 528.1754 4.4E3 529.2138 1.8E4 530.2517 2.5E5 537.1762 2.0E4 538.1816 4.6E3 539.1924 2.7E5 540.1948 1.5E5 541.2421 3.6E3 542.1850 1.2E4 543.2237 2.5E4 555.2228 1.4E4 556.2326 8.4E3 557.2383 3.8E5 558.2470 5.9E5 558.3915 3.7E3 560.2278 1.4E4 569.2031 4.0E4 571.2151 1.1E4 573.2261 2.4E4 574.2408 2.7E5 583.2162 3.4E4 584.2240 3.1E4 585.1248 5.5E3 585.2346 9.3E5 586.2372 2.2E5 587.2143 3.1E4 597.2009 8.1E3 599.2509 9.3E3 600.2197 2.0E4 601.2273 1.2E5 602.2373 1.9E6 602.4639 1.1E4 604.2172 3.6E3 611.2107 1.1E4 612.2208 9.5E3 615.2421 1.5E5 622.9518 3.1E3 627.2485 4.1E3 628.2154 2.7E4 629.2235 6.5E4 630.2290 3.4E3 643.1159 5.3E3 643.2391 4.5E5 671.2346 7.1E4 END IONS BEGIN IONS FEATURE_ID=630 PEPMASS=583.4154 SCANS=630 RTINSECONDS=764.461 CHARGE=1+ MSLEVEL=2 MERGED_STATS=11 / 11 (0 removed due to low quality, 0 removed due to low cosine). 65.9705 2.3E3 67.0539 7.1E4 67.1798 2.2E3 69.0334 1.1E4 69.0696 1.0E5 69.9117 2.5E3 71.5991 2.5E3 71.6639 2.5E3 72.1339 2.3E3 74.6614 3.0E3 78.4427 2.8E3 78.8343 2.9E3 79.0539 7.2E4 81.0695 2.6E5 82.1101 2.3E3 82.6625 2.6E3 83.0488 4.4E4 83.0852 6.4E4 85.0645 4.5E4 86.0062 2.2E3 86.1595 2.2E3 86.6415 2.3E3 87.1407 2.6E3 88.0523 2.3E3 88.7092 2.5E3 89.9858 2.2E3 90.8684 2.8E3 91.0539 7.4E4 93.0695 3.4E5 93.1850 2.3E3 95.0489 4.5E4 95.0852 3.0E5 95.9116 2.3E3 97.0646 3.8E4 105.0500 2.2E3 105.0695 2.7E5 107.0851 4.1E5 107.8337 2.3E3 109.0646 6.0E4 109.1008 2.6E5 111.0799 2.1E4 117.0695 3.3E4 119.0765 9.7E3 119.0851 7.0E5 120.8886 2.8E3 121.0641 1.7E4 121.0923 3.8E3 121.1008 4.5E5 123.0800 9.8E4 123.1164 8.5E4 125.0594 4.9E4 129.0696 1.8E4 131.0851 1.9E5 133.0643 1.3E4 133.0903 1.5E4 133.1009 4.4E5 135.0801 1.1E5 135.0915 2.5E3 135.1075 2.8E3 135.1165 3.0E5 135.2499 2.4E3 135.3316 2.3E3 137.0590 3.5E3 137.0958 1.3E5 139.0750 7.5E4 139.1118 8.2E3 142.0768 5.6E3 143.0852 1.7E5 144.0933 5.3E3 145.0888 8.8E3 145.1009 5.4E5 147.0801 1.6E5 147.1165 2.0E5 149.0957 1.2E5 149.1081 2.4E3 149.1321 4.6E4 151.0750 2.2E5 151.1113 1.0E4 151.1477 6.2E3 153.0907 3.2E4 155.0850 4.3E4 156.0930 3.0E4 157.1008 3.8E5 158.1084 8.5E3 159.0804 3.2E4 159.1166 3.8E5 160.1252 5.1E3 161.0958 8.8E4 161.1323 1.4E5 163.1115 1.4E5 163.1474 2.5E3 165.0908 6.3E5 165.1262 2.8E3 167.0852 2.9E3 169.1011 1.8E5 170.1091 1.6E4 171.1166 3.0E5 172.1248 2.7E3 172.9016 2.5E3 173.0961 4.9E4 173.1324 3.1E5 173.5251 4.5E3 173.5283 1.2E5 173.5424 3.4E4 175.1118 5.3E4 175.1312 2.4E3 175.1480 2.6E5 177.0910 5.1E4 177.1095 3.0E3 177.1272 3.9E4 179.0863 3.9E3 179.1054 7.3E3 181.1013 5.7E4 181.1214 5.0E4 182.1080 1.4E4 183.1167 2.5E5 184.1243 2.2E4 185.0735 2.6E3 185.0949 5.2E3 185.1324 2.1E5 187.1115 3.9E4 187.1479 1.7E5 189.1273 1.0E5 191.1064 2.9E4 191.1428 5.7E4 193.1016 3.1E4 193.1220 1.2E4 193.8848 2.1E3 194.1083 1.4E4 195.1166 1.6E5 195.1361 3.4E4 196.1245 3.4E4 196.5226 2.6E3 197.1323 2.3E5 198.1395 3.0E3 199.1119 3.7E4 199.1482 1.1E5 201.1275 3.5E4 201.1637 1.3E5 201.2344 2.5E3 203.1074 2.9E3 203.1429 2.7E5 205.1223 1.7E4 205.1588 3.6E3 207.1168 7.3E4 207.1380 1.8E5 208.1244 1.1E4 209.1323 2.5E5 209.1535 1.6E4 210.1396 6.7E3 211.1115 4.3E4 211.1481 1.5E5 212.1572 2.7E3 213.1275 4.2E4 213.1639 3.4E4 215.1431 3.0E4 217.1225 1.1E4 217.1589 3.1E4 219.1168 9.8E3 219.1745 2.8E3 220.1238 6.1E3 221.1322 7.0E4 221.1537 4.6E5 222.1395 6.1E3 223.1102 3.8E3 223.1481 1.2E5 224.1542 3.4E3 225.1271 1.9E4 225.1639 9.0E4 227.1430 5.9E4 227.1795 2.2E4 229.1221 3.9E4 229.1589 1.5E4 230.1663 2.9E3 231.1380 8.1E3 233.1315 3.0E4 233.1547 3.5E4 235.1479 9.3E4 237.1269 6.4E3 237.1638 8.0E4 238.1335 2.6E3 239.1408 7.9E3 239.1795 3.9E4 241.1585 1.6E4 241.1951 1.6E4 243.1361 5.8E3 243.1740 1.4E4 245.1306 2.8E3 247.1463 3.1E4 247.1708 3.2E4 249.1638 5.8E4 250.1715 1.2E4 251.1435 6.5E3 251.1794 3.6E4 253.1581 3.1E3 253.1951 1.1E4 255.1377 7.6E3 255.1734 6.3E3 257.1902 6.3E3 259.1470 9.6E3 259.2063 5.8E3 259.2546 2.6E3 261.1607 1.4E4 261.1868 3.1E4 263.1791 3.6E4 265.1616 7.6E3 265.1950 7.5E4 267.1385 2.8E3 267.1739 2.0E4 267.2094 9.7E3 269.1512 2.8E3 269.1894 2.7E4 271.1697 4.1E3 273.1640 6.7E3 275.1794 3.5E4 277.1595 5.7E3 277.1964 2.7E3 279.1750 2.9E3 279.2112 3.5E3 281.1902 1.1E4 282.2785 6.6E3 283.2055 7.6E4 283.2826 2.3E4 285.1851 8.6E4 285.2162 2.6E3 286.1930 4.0E4 287.2014 6.9E4 289.1947 7.2E3 291.1781 2.8E3 291.2108 3.4E3 293.1909 2.1E4 293.2278 3.2E3 295.2072 3.3E3 296.0434 2.7E3 297.2219 6.8E3 299.2006 3.8E4 303.1765 3.9E3 303.2129 3.1E3 305.1906 3.1E3 311.1990 2.8E4 311.2377 7.5E3 312.2094 3.2E3 315.2115 2.5E3 323.2055 2.6E3 325.2166 7.6E3 337.2184 2.8E3 338.2240 1.3E4 349.2156 2.4E4 352.6146 2.4E3 353.2481 4.5E4 357.2618 3.0E3 357.8337 2.7E3 364.2399 6.8E4 375.2694 1.0E4 377.2466 1.0E4 385.2743 5.3E4 399.2893 6.2E4 425.3048 4.4E4 438.3067 3.3E3 451.3181 2.9E3 451.4883 2.3E3 473.3389 1.5E4 477.3412 2.9E3 491.2689 5.2E3 491.3521 6.5E5 491.4294 9.5E3 504.3595 1.8E4 556.9847 2.8E3 574.2989 2.8E3 583.4153 9.5E4 END IONS BEGIN IONS FEATURE_ID=631 PEPMASS=205.1954 SCANS=631 RTINSECONDS=765.365 CHARGE=1+ MSLEVEL=2 MERGED_STATS=7 / 8 (1 removed due to low quality, 0 removed due to low cosine). 41.0385 1.7E5 43.0177 4.1E3 43.0541 9.1E4 49.6685 2.5E3 53.0384 7.6E4 53.0980 2.2E3 55.0540 1.1E6 55.0572 9.8E3 55.9343 3.6E4 57.0696 2.9E5 57.4638 2.5E3 58.8791 2.2E3 62.0598 2.3E3 63.0874 2.2E3 63.9278 2.1E3 65.0383 1.9E4 66.2479 2.3E3 66.7066 2.3E3 67.0539 7.9E5 67.0581 4.8E3 67.7337 3.0E3 67.9223 2.1E3 68.7379 2.6E3 69.0697 1.7E6 69.0739 1.5E4 69.0760 1.0E4 71.0852 6.2E4 71.5748 2.8E3 72.5341 2.6E3 72.9368 2.8E5 73.4464 2.2E3 74.9056 2.3E3 75.9974 2.5E3 76.5752 2.3E3 77.0384 5.5E4 79.0540 1.2E6 79.0594 7.2E3 81.0697 4.5E6 81.0781 2.5E4 81.0782 7.1E4 81.0806 1.3E4 83.0852 3.0E5 83.6063 2.6E3 88.8478 2.2E3 89.7196 2.7E3 90.9420 3.0E3 90.9474 2.1E5 91.0539 5.1E5 92.2724 2.4E3 93.0697 5.4E6 93.0765 2.7E4 93.0801 6.7E4 93.0831 1.6E4 93.0873 7.9E3 95.0489 1.4E5 95.0853 1.6E6 95.0924 6.7E3 95.2994 2.6E3 96.6001 2.4E3 97.0943 2.8E3 97.1009 1.8E5 99.0199 2.1E3 99.9477 5.7E4 103.0539 1.5E4 105.0443 5.3E4 105.0617 4.7E3 105.0695 4.4E5 106.0776 2.6E4 107.0853 2.2E6 107.0929 9.4E3 107.0969 1.8E4 107.5879 2.6E3 109.0645 6.0E4 109.0928 1.6E4 109.1009 9.5E5 111.1166 3.1E4 112.8035 2.3E3 113.9634 5.7E5 114.6771 2.5E3 115.9429 3.6E3 119.0600 1.6E4 119.0852 1.0E5 121.1009 6.5E6 121.1096 9.6E4 121.1185 4.1E4 121.1209 1.7E4 121.1275 8.0E3 123.0801 3.8E5 123.1165 4.3E5 125.9606 2.5E3 126.3159 2.6E3 127.3089 2.7E3 128.9514 2.7E3 129.2522 2.4E3 130.8366 2.8E3 131.9740 7.1E4 133.0758 1.3E4 133.1014 1.1E4 133.9534 3.0E3 135.1166 6.2E5 135.1273 3.2E3 137.1323 5.2E4 137.2617 2.6E3 141.9244 2.8E3 145.5622 2.3E3 147.1163 1.7E4 149.1183 6.2E3 149.1323 1.2E6 149.1447 2.2E4 154.2625 2.4E3 163.1480 1.0E5 173.5312 5.4E4 173.5405 4.6E3 176.4065 2.5E3 177.9719 3.3E3 205.1948 3.7E4 END IONS BEGIN IONS FEATURE_ID=632 PEPMASS=264.2325 SCANS=632 RTINSECONDS=765.365 CHARGE=1+ MSLEVEL=2 MERGED_STATS=7 / 11 (4 removed due to low quality, 0 removed due to low cosine). 45.9140 2.3E3 47.3077 2.7E3 51.0142 2.2E3 51.0232 2.4E3 51.3412 2.3E3 53.0385 3.8E4 54.4206 2.0E3 54.4498 2.3E3 55.0540 4.9E5 56.1255 2.1E3 57.0697 2.6E5 57.4590 2.7E3 58.5787 2.1E3 60.0443 1.6E7 60.0479 9.3E4 60.0513 5.5E4 60.0533 2.5E4 60.0537 1.5E5 60.0556 1.0E4 60.5062 2.4E3 61.4431 2.3E3 62.5160 2.4E3 65.0386 1.4E4 66.4452 2.7E3 67.0539 4.4E5 67.7319 2.8E3 68.5072 2.4E3 69.0696 1.3E6 69.0738 9.5E3 69.0760 8.0E3 70.1427 2.9E3 71.0853 1.1E5 72.6987 5.0E3 74.4697 2.8E3 77.0387 3.5E4 79.0539 6.8E5 81.0696 6.3E6 81.0782 3.8E4 81.0786 1.1E5 81.0805 2.1E4 81.8747 2.3E3 83.0805 8.6E3 83.0852 3.9E5 86.6375 3.1E3 86.8393 2.6E3 89.3142 2.2E3 89.5651 2.5E3 91.0481 8.1E3 91.0540 2.1E5 93.0696 4.0E6 93.0800 2.0E4 93.0800 4.0E4 95.0490 5.6E4 95.0852 2.2E6 95.0925 1.5E4 97.0943 6.8E3 97.1009 3.6E5 105.0444 1.8E4 105.0696 2.1E5 106.0780 5.2E3 107.0852 2.3E6 107.0945 4.0E3 109.0644 4.0E3 109.0928 5.2E3 109.1009 1.8E6 109.1102 3.8E3 111.1165 1.5E5 111.6880 2.1E3 114.8274 5.3E3 116.8216 5.0E3 119.0853 5.1E4 120.5478 2.6E3 121.0898 6.3E3 121.1009 1.7E7 121.1116 3.5E5 121.1215 5.1E4 121.1221 1.5E5 121.1282 2.5E4 121.1327 7.9E3 122.1117 2.8E3 123.0803 3.7E4 123.1165 8.8E5 124.3120 2.4E3 125.1321 7.7E3 126.0303 2.8E3 129.5037 2.5E3 133.0758 4.4E3 133.1009 7.6E3 135.1055 5.1E3 135.1166 1.4E6 135.1267 9.7E3 137.1323 1.1E5 147.1172 9.4E3 149.1323 3.9E6 149.1450 2.2E4 149.1606 3.9E3 159.0632 5.8E3 160.8675 2.9E3 161.1333 2.9E3 163.1480 3.0E5 165.0365 2.2E3 169.9498 2.4E3 171.8872 2.8E3 173.5288 6.6E4 173.5414 2.4E4 177.1634 1.8E4 189.1646 3.0E3 205.1952 5.6E5 255.9059 2.4E3 258.9587 3.2E3 259.6519 2.5E3 264.2322 6.8E4 END IONS BEGIN IONS FEATURE_ID=633 PEPMASS=371.2220 SCANS=633 RTINSECONDS=769.109 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 5 (0 removed due to low quality, 0 removed due to low cosine). 53.9955 2.2E3 55.0541 2.3E4 57.0569 2.2E3 57.0697 1.7E4 59.0490 1.1E4 59.5685 2.1E3 60.1286 2.3E3 65.4121 2.4E3 67.0541 1.8E4 68.2456 2.8E3 68.4622 2.3E3 69.0695 6.6E4 69.2180 2.2E3 70.5805 2.1E3 79.0539 5.3E3 81.0696 5.4E4 82.8822 2.3E3 83.0493 2.4E3 83.0853 1.3E4 93.0696 4.9E4 95.0851 7.3E4 97.0644 2.5E4 99.0804 2.3E3 101.0593 3.5E4 105.0696 3.5E4 107.0489 3.1E4 107.0852 5.9E4 107.5494 2.5E3 109.0645 4.2E3 109.1008 6.0E4 111.0436 2.7E4 111.0802 3.3E3 111.1165 4.8E4 118.6872 2.7E3 119.0852 2.3E4 121.0647 9.6E3 121.1008 3.9E4 123.1164 2.0E4 129.0544 1.7E4 131.0856 3.5E3 131.5626 2.4E3 133.0281 3.7E4 133.0647 1.4E4 133.1009 3.3E4 135.0437 8.9E4 135.0800 3.9E4 135.1164 2.2E4 136.4912 2.8E3 137.1321 6.3E3 143.0848 2.6E3 145.0644 4.1E3 145.1008 3.5E4 145.9708 2.6E3 147.0439 7.2E3 147.0800 1.9E4 147.1164 2.8E4 149.0595 5.1E4 149.0961 5.8E3 149.1322 3.4E4 149.6721 2.5E3 151.0386 2.1E4 151.1114 6.5E3 157.0645 9.8E3 157.0994 3.5E3 159.0434 2.7E3 159.0799 1.1E4 159.1176 4.0E3 161.0962 4.1E3 161.1328 2.8E3 163.0756 3.2E3 165.0544 3.1E5 167.1426 6.7E3 171.0802 2.5E3 173.0596 2.2E4 173.0969 2.7E3 173.1328 6.2E3 173.5284 6.1E4 173.5420 1.6E4 175.0753 1.6E4 175.1111 6.2E3 175.1477 4.0E3 179.0699 7.3E3 182.6445 2.3E3 185.0595 3.4E4 185.0959 1.2E4 186.2966 2.3E3 187.0752 1.4E4 187.1488 2.8E3 188.1564 5.8E3 189.0551 2.9E4 189.0906 1.6E4 189.1642 8.7E3 191.0700 9.0E3 193.9335 2.5E3 197.0972 2.3E3 197.2578 2.4E3 199.0763 2.7E3 201.0905 3.3E4 203.0702 3.5E4 203.1066 5.9E3 205.0862 3.1E4 209.0972 3.1E3 211.0757 3.0E3 213.0911 6.3E4 215.1077 8.7E3 217.0861 7.8E4 227.0698 3.3E3 227.1057 3.0E3 228.6764 2.6E3 229.0859 2.4E4 231.1018 2.8E4 239.1051 3.0E3 240.3225 2.7E3 241.1225 2.8E3 243.1016 1.1E4 243.1386 3.7E3 244.0469 3.0E3 245.1179 4.2E3 255.1371 3.3E3 257.1172 6.0E4 269.1198 3.0E3 269.1519 3.3E3 271.1326 4.0E3 279.9292 2.7E3 280.3512 2.7E3 281.1552 6.0E3 296.8279 2.8E3 297.1509 2.7E3 321.1848 2.2E4 339.1956 8.9E4 357.2061 3.5E4 END IONS BEGIN IONS FEATURE_ID=634 PEPMASS=599.4102 SCANS=634 RTINSECONDS=770.023 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 5 (0 removed due to low quality, 0 removed due to low cosine). 63.4366 2.7E3 67.0540 1.3E4 69.0332 1.3E4 69.0696 6.0E3 78.2520 2.5E3 79.0540 5.4E3 79.7924 2.3E3 81.0695 5.6E4 83.0489 1.3E4 83.0854 1.1E4 83.6373 2.2E3 85.0648 6.7E3 91.0542 1.9E4 93.0695 8.1E4 94.7863 2.2E3 95.0490 1.9E4 95.0852 7.0E4 97.0645 1.3E4 97.1005 2.9E3 104.0937 2.3E3 104.7893 2.3E3 105.0696 6.1E4 106.9868 2.4E3 107.0851 5.7E4 109.0646 2.1E4 109.1009 2.4E4 111.0799 5.2E3 114.8844 2.6E3 115.3301 2.1E3 115.7408 2.4E3 117.0702 3.0E3 119.0851 1.0E5 121.0648 1.2E4 121.1007 1.1E5 121.6661 2.7E3 123.0799 5.4E4 123.1161 6.3E3 123.1550 2.4E3 125.0594 3.7E4 129.0697 5.5E3 131.0852 2.9E4 131.5155 2.4E3 133.1008 7.2E4 135.0801 6.4E4 135.1165 4.1E4 137.0957 7.9E4 139.0751 2.8E4 141.0707 2.9E3 141.6040 2.6E3 143.0852 3.4E4 143.1776 2.4E3 145.1009 8.9E4 147.0801 1.5E5 147.1166 2.6E4 149.0958 2.4E4 149.8395 2.4E3 151.0750 8.4E4 153.0913 5.0E3 155.0845 1.2E4 157.1009 1.0E5 159.0801 3.1E3 159.1165 7.4E4 161.0959 3.7E4 161.1321 6.2E4 163.1115 9.4E4 165.0907 7.3E5 167.1076 5.8E3 169.1010 3.5E4 170.1099 6.3E3 171.1166 9.1E4 173.0961 2.6E4 173.1321 2.3E4 173.5215 8.5E3 173.5275 3.9E4 173.5403 4.8E4 175.1118 7.6E3 175.1483 2.4E4 177.0912 2.0E4 177.1270 8.0E3 179.1063 5.4E3 179.1430 9.6E3 179.8180 2.4E3 181.1024 8.4E3 181.1222 4.4E4 183.1168 8.8E4 185.1322 7.5E4 187.1118 2.0E4 187.1478 2.5E4 189.1271 4.2E4 190.8349 2.5E3 191.1066 4.2E4 191.1429 1.3E4 195.1172 2.5E4 195.1364 3.0E3 196.1241 3.4E3 197.1321 4.1E4 199.1126 7.3E3 199.1481 3.7E3 201.1278 1.0E4 203.1429 2.9E5 203.1640 2.5E3 205.1221 3.5E3 207.1180 2.8E3 207.1380 5.3E4 209.1325 3.5E4 209.1550 2.5E3 211.1124 2.9E3 211.1482 5.4E4 213.1277 1.2E4 215.1431 1.2E4 217.1573 2.7E3 221.1341 1.8E4 221.1536 7.2E5 223.1491 1.4E4 225.1267 8.6E3 225.1637 1.5E4 227.1440 8.5E3 227.1788 1.0E4 229.1590 2.8E4 231.1378 2.4E4 233.1539 1.7E4 237.1658 8.8E3 239.1427 3.2E3 240.7392 2.3E3 243.1386 6.5E3 247.1437 3.5E3 247.1692 1.5E5 257.1544 3.5E3 263.1780 3.7E3 267.8703 2.6E3 268.1785 2.8E3 268.4777 2.9E3 269.1904 1.6E4 271.1694 9.7E3 273.1823 2.4E3 281.1898 1.1E4 283.7058 2.8E3 285.1852 1.5E4 286.1929 1.3E4 287.2006 1.1E5 289.1942 2.8E3 291.1754 5.8E3 293.1883 2.5E3 297.4912 2.3E3 298.1924 2.4E3 299.2008 3.7E4 309.1840 2.8E3 311.2005 2.7E4 312.2089 3.7E3 313.2164 3.5E4 325.2162 1.4E4 327.2321 5.1E4 339.2896 1.2E4 365.2464 2.9E4 391.2628 2.3E4 413.2697 3.2E4 419.2948 3.9E4 427.2848 7.0E4 453.2999 1.1E4 505.9670 2.8E3 507.3449 2.8E3 519.3450 2.3E4 557.8373 2.8E3 599.4114 1.9E4 END IONS BEGIN IONS FEATURE_ID=635 PEPMASS=311.2585 SCANS=635 RTINSECONDS=772.653 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 49.1419 2.5E3 53.0384 2.8E3 55.0176 3.5E3 55.0539 2.6E5 57.0332 1.0E5 57.0696 1.3E5 58.8871 2.4E3 67.0539 2.7E4 69.0695 2.6E5 69.0739 4.8E3 71.0851 4.8E4 71.6861 2.2E3 78.7076 2.3E3 79.0539 1.7E4 80.9298 2.3E3 81.0695 4.2E4 83.0851 1.9E5 85.1008 1.7E4 93.0695 2.7E4 95.0851 2.5E4 96.2531 3.1E3 97.0644 2.0E4 97.0944 3.5E3 97.1008 1.2E5 107.0852 1.9E4 109.1008 4.6E3 111.0803 4.5E3 111.1165 1.9E4 113.5171 2.6E3 121.1010 2.1E4 135.1167 1.4E4 136.2436 2.5E3 144.8543 3.1E3 173.5273 5.1E4 173.5440 7.2E3 175.5305 2.5E3 209.1168 1.4E4 215.7284 2.6E3 225.9283 2.8E3 246.9500 8.4E3 311.2598 2.6E3 END IONS BEGIN IONS FEATURE_ID=636 PEPMASS=298.2382 SCANS=636 RTINSECONDS=774.337 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 55.0539 2.6E4 57.0696 6.8E4 59.7654 2.3E3 60.7347 2.3E3 62.3796 2.1E3 63.0147 2.6E3 64.6018 2.3E3 68.4547 2.2E3 71.0852 8.9E3 76.8542 2.8E3 79.0537 2.6E3 83.0109 2.2E3 83.0853 1.2E4 83.1576 2.2E3 85.1011 3.0E3 89.0593 7.0E4 91.0539 2.8E5 93.6808 2.8E3 95.6319 2.3E3 101.0959 1.3E4 106.1509 2.4E3 107.0699 3.3E4 108.2099 2.8E3 119.0851 1.1E6 119.0936 1.7E4 123.7454 2.1E3 137.5153 2.9E3 143.1003 2.3E3 145.3641 2.4E3 147.8305 2.4E3 155.4461 2.7E3 158.1902 2.7E3 163.1327 1.3E4 168.8308 2.0E3 173.5196 7.7E3 173.5298 3.8E4 173.5428 1.3E4 174.2766 2.4E3 181.4631 2.2E3 192.5168 2.6E3 196.9294 3.2E3 271.2422 2.7E3 298.3472 6.1E4 END IONS BEGIN IONS FEATURE_ID=637 PEPMASS=205.1954 SCANS=637 RTINSECONDS=775.436 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 10 (4 removed due to low quality, 0 removed due to low cosine). 41.0385 1.5E5 43.0178 3.6E3 43.0541 6.7E4 53.0384 5.4E4 55.0176 3.8E3 55.0541 1.6E6 55.0572 1.4E4 55.0587 1.2E4 55.9342 2.5E4 57.0696 4.3E5 61.7686 3.0E3 65.0383 1.4E4 66.7253 2.6E3 67.0539 9.0E5 67.0582 4.8E3 67.0603 4.7E3 69.0697 2.0E6 69.0739 1.8E4 69.0762 1.1E4 69.0786 4.0E3 71.0852 5.5E4 72.0766 2.8E3 72.9368 2.4E5 73.0281 3.1E3 73.3043 2.5E3 75.9009 2.3E3 77.0385 3.5E4 79.0539 8.6E5 79.0592 4.9E3 79.0620 5.1E3 81.0696 2.7E6 81.0781 4.9E4 81.0782 1.4E4 81.0805 9.1E3 83.0852 5.9E5 83.0913 6.4E3 85.7955 2.4E3 90.9473 1.8E5 91.0539 3.9E5 91.0608 4.8E3 91.3120 2.6E3 93.0696 3.6E6 93.0800 5.8E4 93.0801 1.7E4 93.0832 1.2E4 93.0875 3.8E3 94.0380 2.2E3 95.0434 2.9E3 95.0489 9.8E4 95.0852 2.0E6 95.0919 1.0E4 95.0960 9.6E3 97.0944 5.0E3 97.1009 3.0E5 99.9477 4.2E4 103.0541 3.4E3 105.0444 3.0E4 105.0617 3.2E3 105.0696 3.4E5 106.0775 1.1E4 107.0852 2.8E6 107.0927 1.3E4 107.1018 1.7E4 109.0645 5.2E4 109.0928 5.2E3 109.1009 1.4E6 109.1087 7.8E3 110.2721 2.4E3 111.1165 5.1E4 113.9634 4.3E5 113.9770 3.1E3 114.8024 2.3E3 117.9584 2.6E3 119.0602 2.1E4 119.0852 1.1E5 120.0934 8.5E3 121.0747 6.8E3 121.0908 8.6E3 121.1009 3.7E6 121.1097 5.4E4 121.1166 1.3E4 121.1215 1.1E4 121.1274 4.6E3 123.0801 3.1E5 123.1165 6.4E5 123.1254 3.0E3 123.1318 4.2E3 130.9164 2.3E3 131.9739 6.2E4 133.0766 6.0E3 133.1008 3.3E4 133.9532 5.9E3 134.1088 7.2E3 135.1166 1.2E6 135.1266 1.5E4 137.1323 7.7E4 147.1164 3.3E4 148.1238 2.2E3 149.1322 1.3E6 149.1466 4.9E3 161.1321 3.6E3 162.1401 1.4E4 163.1480 1.7E5 167.2892 2.2E3 173.5244 2.1E4 173.5376 5.6E4 174.2564 2.3E3 177.1641 2.5E3 177.3878 2.7E3 191.1288 2.6E3 193.9711 2.3E3 205.1597 2.8E3 205.1951 8.9E4 206.5422 2.5E3 212.9419 2.3E3 END IONS BEGIN IONS FEATURE_ID=638 PEPMASS=454.2935 SCANS=638 RTINSECONDS=776.548 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 57.0327 2.6E3 57.0695 2.7E4 58.1618 2.1E3 58.7261 2.3E3 62.0596 3.9E4 67.0538 2.5E3 69.0696 3.7E3 69.0736 2.3E3 71.0851 2.7E4 75.2730 2.1E3 76.8734 2.2E3 81.0694 7.3E3 81.3667 2.3E3 83.0852 7.5E3 85.1008 1.5E4 85.7517 2.3E3 86.1827 2.7E3 89.0593 1.2E4 95.0850 2.1E4 97.1009 2.4E3 109.1003 1.1E4 116.1345 2.2E3 116.3494 2.4E3 117.5980 2.4E3 123.1161 3.7E3 123.5684 2.5E3 127.8846 2.5E3 133.0855 2.5E3 140.3272 2.6E3 155.0098 2.2E4 169.9215 2.3E3 173.5220 8.6E3 173.5367 4.1E4 175.4950 2.4E3 177.6100 2.8E3 191.6413 2.4E3 192.2493 2.4E3 199.7321 2.4E3 239.2397 2.7E3 257.0957 2.3E3 265.1398 3.0E3 282.2788 3.6E4 313.2325 5.4E3 313.2736 2.8E5 394.9464 2.5E3 414.7589 2.9E3 421.0404 2.9E3 462.2420 2.5E3 END IONS BEGIN IONS FEATURE_ID=639 PEPMASS=496.3405 SCANS=639 RTINSECONDS=780.01 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 60.0805 5.4E4 60.6424 2.3E3 61.8448 2.5E3 63.1827 2.4E3 65.9526 2.5E3 66.1196 2.2E3 68.3096 2.8E3 71.0727 3.6E3 72.7749 2.0E3 83.0319 2.4E3 86.0959 2.0E5 89.0593 1.8E4 91.1219 2.6E3 93.7508 2.5E3 103.6114 2.8E3 104.1067 8.6E5 104.1143 4.1E3 105.8624 2.8E3 112.0107 2.5E3 121.0647 2.9E3 122.7173 2.3E3 124.9995 5.8E4 128.8625 2.4E3 133.0858 6.3E3 136.4417 2.5E3 141.4096 2.3E3 146.8278 2.4E3 152.7500 2.8E3 163.0149 7.8E3 173.5250 2.8E4 173.5352 3.5E4 173.5441 1.2E4 174.2514 2.5E3 179.1815 2.7E3 184.0733 1.2E6 209.2447 2.7E3 215.6861 2.4E3 228.3575 2.5E3 232.1491 2.2E3 248.9954 2.5E3 250.3371 2.3E3 258.1100 1.9E4 288.6191 2.3E3 313.2748 4.3E4 315.6200 2.4E3 319.4391 2.6E3 339.9919 3.0E3 380.9170 2.5E3 390.6830 2.4E3 398.7138 2.4E3 401.1197 2.6E3 419.2509 2.6E3 419.2572 7.6E3 437.5553 3.2E3 478.3307 3.3E4 496.3450 1.6E4 END IONS BEGIN IONS FEATURE_ID=640 PEPMASS=205.1954 SCANS=640 RTINSECONDS=780.243 CHARGE=1+ MSLEVEL=2 MERGED_STATS=1 / 1 (0 removed due to low quality, 0 removed due to low cosine). 41.0385 1.2E4 43.0541 4.1E3 51.0110 2.3E3 53.0384 5.6E3 55.0540 9.1E4 55.4183 2.3E3 55.9342 7.0E3 57.0696 2.4E4 60.8898 2.7E3 67.0501 3.0E3 67.0539 5.6E4 69.0695 1.3E5 71.0852 4.3E3 72.9368 4.9E4 77.0382 3.2E3 79.0539 8.6E4 81.0695 3.2E5 81.0778 3.9E3 81.6814 2.3E3 83.0852 2.5E4 90.9473 3.8E4 91.0539 4.1E4 93.0695 3.9E5 93.0759 3.4E3 95.0489 1.2E4 95.0851 1.2E5 95.7239 2.4E3 97.1009 1.5E4 99.9477 1.0E4 103.0543 3.0E3 105.0445 4.4E3 105.0695 3.3E4 107.0851 1.7E5 107.9504 3.2E3 109.0645 2.9E3 109.1008 7.0E4 110.3221 2.5E3 113.9633 9.4E4 119.0597 3.1E3 119.0855 4.8E3 121.1008 4.9E5 121.1096 5.4E3 123.0801 5.7E4 123.1164 3.2E4 131.9740 1.4E4 135.1166 5.2E4 137.1324 3.1E3 149.1322 8.4E4 163.1481 6.2E3 173.5348 2.4E4 191.5532 2.8E3 205.1944 3.0E3 END IONS BEGIN IONS FEATURE_ID=641 PEPMASS=264.2324 SCANS=641 RTINSECONDS=780.28 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 8 (4 removed due to low quality, 0 removed due to low cosine). 46.4840 2.3E3 51.7484 2.2E3 52.4258 2.2E3 53.0385 9.7E3 53.5267 2.7E3 55.0540 1.4E5 55.5194 2.3E3 57.0697 8.4E4 60.0403 9.5E3 60.0442 3.8E6 60.0478 2.9E4 60.0500 4.1E4 60.0512 1.9E4 60.0533 9.6E3 60.0579 2.1E3 60.0592 2.1E3 65.0387 3.1E3 65.1872 2.3E3 67.0501 3.0E3 67.0539 1.3E5 67.4591 2.6E3 69.0696 3.9E5 71.0852 3.7E4 74.2827 2.4E3 77.0387 3.2E3 78.9599 2.3E3 79.0539 2.1E5 81.0696 1.9E6 81.0748 1.8E4 81.0782 1.5E4 81.0808 8.2E3 83.0798 2.5E3 83.0853 1.2E5 91.0494 3.0E3 91.0540 6.3E4 93.0698 1.2E6 93.0762 6.6E3 95.0490 1.7E4 95.0853 7.1E5 95.0918 3.5E3 97.1009 1.1E5 101.5664 2.2E3 105.0697 6.0E4 107.0852 7.3E5 109.0642 2.7E3 109.1008 6.0E5 109.1086 4.0E3 111.1166 5.1E4 119.0851 1.5E4 121.0750 3.6E3 121.0916 1.7E4 121.1009 5.5E6 121.1100 8.3E4 121.1181 4.0E4 121.1212 2.1E4 121.1273 9.7E3 121.1332 4.4E3 123.0802 6.0E3 123.1069 5.4E3 123.1165 3.0E5 124.2985 2.4E3 135.1165 4.7E5 135.1273 9.4E3 136.9854 2.7E3 137.1322 3.6E4 147.1161 1.2E4 149.1322 1.3E6 149.1464 3.8E3 156.1375 2.9E3 163.1479 9.9E4 173.5326 6.1E4 173.5430 1.2E4 177.1635 4.7E3 178.2092 2.6E3 187.7316 2.5E3 189.1648 4.8E3 205.1950 2.7E5 207.7400 2.5E3 233.9204 2.5E3 264.2320 5.2E4 END IONS BEGIN IONS FEATURE_ID=642 PEPMASS=534.3642 SCANS=642 RTINSECONDS=782.029 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 5 (0 removed due to low quality, 0 removed due to low cosine). 61.0282 2.9E3 61.3015 2.7E3 63.5341 2.2E3 65.8887 2.4E3 67.0539 1.2E5 68.3357 2.5E3 69.0695 6.3E4 70.5729 2.2E3 71.0853 2.3E4 74.7368 2.9E3 75.0438 2.6E3 75.8114 2.2E3 76.5018 2.6E3 79.0538 2.6E4 80.8312 3.0E3 81.0695 2.4E5 83.0852 7.6E4 85.0280 1.1E4 85.0646 3.0E3 85.1011 8.6E3 87.0002 2.3E3 91.0541 1.2E4 93.0695 4.6E4 93.9710 2.3E3 94.7954 2.2E3 95.0850 2.5E5 97.0281 5.7E3 97.0645 2.2E4 97.1008 6.3E4 99.0802 1.2E4 104.4057 2.5E3 105.0696 2.3E4 106.4337 2.3E3 107.0852 5.3E4 107.4921 2.3E3 109.1008 1.7E5 111.0802 1.4E4 111.1164 2.0E4 112.3304 2.4E3 113.0960 3.7E3 117.5086 2.7E3 119.0851 3.4E4 121.1008 9.5E4 123.1164 1.2E5 125.0960 3.8E3 127.1114 3.3E3 128.8275 2.7E3 133.1009 6.0E4 135.1165 6.2E4 135.7448 2.6E3 135.8124 2.4E3 137.0961 2.8E3 137.1321 4.1E4 139.1108 6.4E3 147.1164 5.0E4 149.1322 6.3E4 151.1478 3.5E4 155.1432 3.1E3 161.1321 8.2E4 162.0531 2.3E3 163.1479 6.7E4 165.1274 7.1E3 165.1634 2.9E4 165.7660 2.6E3 172.8276 2.5E3 173.5269 4.7E4 173.5420 3.6E4 175.1480 7.2E4 177.1634 4.9E3 178.4820 2.5E3 179.1445 2.3E3 179.1793 2.2E4 179.2581 2.4E3 181.1586 2.5E3 189.1633 2.7E4 193.1597 2.4E3 199.2201 2.3E3 203.1789 6.6E3 207.1744 2.8E3 223.5892 2.6E3 245.2262 2.2E5 263.2366 2.2E5 263.2662 4.1E3 264.5550 2.8E3 280.4286 2.3E3 281.6517 2.3E3 337.2739 1.9E5 348.3953 2.4E3 371.0299 2.7E3 389.6155 2.4E3 408.0903 2.7E3 418.8559 2.8E3 443.7118 2.3E3 505.7065 2.7E3 END IONS BEGIN IONS FEATURE_ID=643 PEPMASS=205.1954 SCANS=643 RTINSECONDS=785.995 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 5 (0 removed due to low quality, 0 removed due to low cosine). 41.0384 3.0E4 43.0177 5.4E3 43.0542 1.3E4 43.4779 2.3E3 49.7954 2.0E3 52.3749 2.2E3 52.9298 2.2E3 52.9505 2.2E3 53.0384 2.9E3 55.0539 2.0E5 55.9341 3.0E4 57.0697 4.6E4 58.0487 2.4E3 60.2850 2.4E3 61.4152 2.0E3 64.2743 2.4E3 67.0505 2.8E3 67.0539 1.2E5 68.3777 2.3E3 69.0658 3.1E3 69.0695 2.3E5 72.9368 2.3E5 73.1620 2.3E3 74.0317 2.4E3 77.0386 5.2E3 79.0539 1.5E5 79.2653 2.7E3 81.0695 5.4E5 83.0852 4.3E4 90.9422 2.7E3 90.9473 1.7E5 91.0539 6.9E4 93.0630 5.6E3 93.0695 7.6E5 95.0488 1.8E4 95.0646 3.2E3 95.0851 2.6E5 95.4204 2.2E3 97.1008 3.2E4 97.4964 2.5E3 98.0877 2.6E3 99.9476 4.3E4 105.0696 6.7E4 107.0773 4.1E3 107.0851 3.6E5 108.9582 6.0E3 109.0638 3.2E3 109.1008 1.7E5 109.4220 2.2E3 113.9549 9.3E3 113.9633 4.4E5 115.9425 7.9E3 119.0853 1.7E4 121.1008 8.8E5 121.1097 2.4E3 121.1111 1.1E4 123.0800 2.7E5 123.1071 2.3E3 123.1165 6.5E4 127.4308 2.5E3 128.9505 2.4E3 129.4223 3.0E3 131.9739 5.7E4 133.1021 2.9E3 133.9529 5.0E3 134.0124 2.4E3 135.1166 1.0E5 137.1322 5.3E3 138.1201 2.2E3 139.9736 3.3E3 141.9275 2.2E3 149.1322 1.6E5 149.6933 4.6E3 154.9903 3.2E3 158.2384 2.6E3 163.1478 6.6E3 164.8165 2.4E3 168.1474 2.3E3 169.9210 2.5E3 172.8520 2.8E3 173.5244 3.1E4 173.5404 4.1E4 182.4958 2.4E3 185.9899 2.6E3 END IONS BEGIN IONS FEATURE_ID=644 PEPMASS=371.2220 SCANS=644 RTINSECONDS=786.75 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 52.7320 2.0E3 54.8118 2.3E3 55.0176 7.0E3 55.0541 1.6E4 55.1359 2.0E3 56.2092 2.1E3 58.7084 2.2E3 59.5547 2.1E3 65.1612 2.2E3 67.0539 1.7E4 69.0332 7.7E4 69.0696 1.4E4 70.0413 2.1E3 77.0384 2.5E3 79.0539 1.2E4 79.2202 2.6E3 80.5218 2.2E3 81.0696 6.2E4 82.2674 2.4E3 83.0491 2.4E3 91.0539 1.5E4 93.0697 3.5E4 95.0491 1.2E4 95.0851 4.6E4 97.0645 3.1E4 97.1010 2.8E3 101.0594 2.4E4 105.0696 3.8E4 105.9268 2.5E3 106.5450 2.5E3 107.0487 7.0E4 107.0851 6.2E4 109.0645 3.8E4 109.1009 6.0E4 111.0436 4.4E4 113.5785 2.4E3 119.0854 2.4E4 120.2268 2.9E3 121.0645 2.3E4 121.1007 3.7E4 121.7830 2.2E3 123.0801 2.0E4 123.1165 2.9E4 125.0595 3.9E4 125.0955 2.7E3 126.6882 2.5E3 129.0542 1.1E4 131.0503 3.1E3 131.0854 1.1E4 133.0281 4.4E4 133.0645 2.7E4 133.1009 4.3E4 135.0437 9.6E4 135.0803 3.3E4 135.1164 4.9E3 137.0598 2.7E3 137.0958 1.3E4 143.0855 3.2E3 145.0647 2.1E4 145.1011 1.8E4 147.0442 1.5E4 147.0801 6.4E4 147.1172 1.3E4 147.1586 2.4E3 149.0594 3.8E4 149.0958 2.8E4 151.0392 4.0E4 151.1115 1.9E4 157.0645 7.7E3 158.0726 3.7E3 159.0452 2.5E3 159.0802 3.3E4 159.1168 5.2E3 161.0595 1.3E4 161.0959 2.5E4 163.0748 5.2E3 163.1120 5.8E3 165.0544 3.0E5 165.0698 3.2E3 169.0615 2.4E3 171.0809 1.7E4 173.0600 1.6E4 173.0963 2.9E4 173.1325 8.9E3 173.5271 1.5E4 173.5346 5.2E4 173.5452 3.8E3 175.0755 2.8E4 175.1109 2.5E3 175.1484 3.6E3 177.0553 6.9E3 177.0916 5.9E3 179.0700 6.9E3 183.0811 6.9E3 183.1484 2.2E3 185.0968 1.1E4 187.0752 3.2E4 187.1496 3.5E3 189.0911 5.0E4 191.0707 1.2E4 196.8950 2.6E3 197.0971 5.9E3 199.0750 6.7E3 199.1114 6.0E3 201.0910 1.1E5 203.0709 5.4E3 205.0861 2.0E4 209.0963 3.0E3 211.1116 1.0E4 213.0910 6.9E3 213.1275 7.3E3 215.1072 8.3E3 215.1436 4.6E3 217.0862 3.5E4 220.1478 2.3E3 223.1120 3.5E3 224.5470 2.1E3 225.0927 2.5E3 225.1277 2.0E4 227.1066 3.1E3 227.1433 1.4E4 231.1022 1.2E4 231.1992 2.5E3 235.1133 2.6E3 237.1264 1.1E4 239.1078 3.0E3 241.1223 3.2E3 243.1382 2.1E4 253.1223 2.8E4 255.1382 2.6E4 257.1189 2.7E3 268.1828 3.1E3 271.1333 1.7E4 293.1893 3.6E3 321.1853 1.0E4 339.1960 6.2E4 351.7754 2.8E3 357.2063 2.4E4 371.2759 2.9E3 END IONS BEGIN IONS FEATURE_ID=645 PEPMASS=618.4283 SCANS=645 RTINSECONDS=787.673 CHARGE=1+ MSLEVEL=2 MERGED_STATS=8 / 8 (0 removed due to low quality, 0 removed due to low cosine). 64.0975 2.3E3 64.5323 2.1E3 64.6615 2.2E3 65.9802 2.3E3 66.1844 2.4E3 67.0540 2.2E4 67.1781 2.4E3 69.0333 3.0E3 69.0695 2.1E4 71.0490 4.2E3 72.1583 2.3E3 77.6461 2.3E3 78.0102 2.2E3 78.6238 2.6E3 79.0540 2.4E4 79.3505 2.2E3 81.0695 8.8E4 81.6060 2.2E3 83.0489 2.5E4 83.0852 8.7E4 83.4442 2.7E3 83.6794 2.4E3 86.2843 2.3E3 88.3788 2.3E3 91.0541 2.4E4 91.4050 2.9E3 92.5759 2.4E3 93.0695 1.0E5 95.0488 6.5E4 95.0852 8.7E4 97.0645 4.9E4 101.3362 2.3E3 105.0695 9.9E4 107.0852 1.4E5 109.0644 3.3E4 109.1008 6.6E4 110.9466 2.4E3 111.0802 2.8E3 111.5791 2.4E3 113.0959 1.4E4 113.7236 2.6E3 114.5524 2.4E3 117.0697 1.2E4 119.0851 1.8E5 120.0930 2.8E3 121.0645 2.3E4 121.1009 1.2E5 121.7845 2.5E3 123.0802 2.8E4 123.1165 1.7E4 125.0958 3.8E4 131.0852 6.3E4 133.1008 1.3E5 133.2895 2.8E3 135.0803 2.3E4 135.1165 4.5E4 135.1816 2.7E3 137.0962 4.1E3 139.1113 4.2E4 142.0773 4.3E3 143.0852 6.0E4 144.0931 1.3E4 145.1008 1.8E5 147.0802 1.9E4 147.1165 7.3E4 149.0958 3.4E4 149.1312 3.4E3 151.7178 3.1E3 155.0856 8.9E3 155.1061 7.0E3 156.0932 8.3E3 157.1009 1.5E5 158.1084 2.9E3 159.0803 1.9E4 159.1165 1.2E5 160.0875 1.7E4 161.0957 4.3E4 161.1316 1.1E4 163.1113 2.5E4 167.0872 2.7E3 167.1065 4.6E4 167.1425 3.4E3 169.1010 5.5E4 171.1166 9.5E4 172.1250 2.4E3 173.0962 2.2E4 173.1325 6.9E4 173.5258 3.5E4 173.5355 1.2E5 173.5450 4.4E3 175.1115 4.0E4 175.1480 3.3E4 179.1429 4.2E3 181.1013 1.4E4 181.1219 5.6E4 182.1083 1.1E4 183.1168 6.2E4 183.1364 2.7E3 184.1246 3.0E3 185.0955 6.5E3 185.1323 6.7E4 187.1122 1.7E4 187.1481 3.6E4 189.1272 1.0E4 191.1431 1.4E4 193.1004 3.3E3 194.1100 2.8E3 195.1163 4.6E4 196.1245 3.7E3 197.1325 9.9E4 197.5085 2.6E3 199.1120 5.9E3 199.1478 4.7E4 201.1265 2.4E3 201.1632 1.5E4 202.3785 2.3E3 203.1437 1.1E4 207.1167 2.7E4 208.6033 2.5E3 209.1324 6.2E4 210.1392 7.1E3 211.1124 2.7E3 211.1480 5.0E4 213.1274 8.5E3 213.1633 1.3E4 215.1432 2.3E4 217.1557 2.8E3 219.1742 4.4E3 221.1323 2.1E4 221.1539 1.9E4 223.1479 4.6E4 225.1259 4.2E3 225.1651 7.9E3 227.1431 2.8E3 227.5966 2.4E3 228.1517 3.0E3 230.4583 2.3E3 233.1310 4.6E3 233.1538 7.2E4 235.1475 3.5E4 235.6129 2.4E3 237.1637 2.4E4 239.1784 3.0E3 241.1581 3.2E3 247.1467 6.9E3 249.1634 1.7E4 251.1055 2.4E3 251.1794 5.9E3 253.1582 7.6E3 255.1742 5.2E4 255.2378 2.6E3 257.1927 2.8E3 259.1460 3.2E3 261.1640 7.5E3 263.1791 8.3E3 265.1947 3.2E3 279.1741 2.9E3 281.1910 2.4E3 291.1585 3.1E3 295.2050 6.5E3 304.1313 2.8E3 307.2086 2.4E3 330.8963 2.7E3 331.2404 3.0E3 399.2722 2.9E3 416.8901 2.3E3 420.3867 2.9E3 429.6388 2.6E3 477.0559 2.4E3 506.8117 2.6E3 564.0316 3.0E3 591.4614 2.4E3 599.5714 2.5E3 END IONS BEGIN IONS FEATURE_ID=646 PEPMASS=205.1954 SCANS=646 RTINSECONDS=792.054 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 15 (9 removed due to low quality, 0 removed due to low cosine). 41.0385 1.8E5 42.0337 4.4E4 43.0541 7.7E4 44.0494 3.2E3 51.0230 1.2E4 53.0018 2.9E3 53.0132 6.5E3 53.0384 1.9E5 55.0541 2.4E6 55.0572 2.7E4 55.0587 2.0E4 55.9342 1.5E4 57.0697 5.8E5 65.0384 6.9E4 66.0149 2.9E3 66.0460 9.3E3 66.0499 3.8E3 66.5929 2.4E3 67.0540 1.7E6 67.0582 1.2E4 67.0604 1.5E4 67.4900 4.2E3 69.0698 3.6E6 69.0739 3.8E4 69.0761 2.6E4 71.0853 1.3E5 72.9368 2.4E5 73.0284 6.1E3 73.0456 2.6E3 74.3088 2.4E3 77.0384 1.0E5 78.0468 5.6E3 79.0540 2.6E6 79.0620 1.6E4 79.0620 4.4E4 80.0620 1.6E4 81.0698 1.0E7 81.0781 6.4E4 81.0795 2.4E5 81.0806 3.4E4 81.0840 1.5E4 83.0852 6.5E5 83.0912 8.1E3 85.1005 4.6E3 87.0967 2.4E3 90.2655 2.5E3 90.9474 1.5E5 91.0540 1.1E6 91.0604 6.8E3 91.0639 8.3E3 93.0697 1.2E7 93.0807 8.2E4 93.0818 2.5E5 93.0831 4.2E4 93.0874 1.9E4 94.0774 3.1E3 95.0489 3.1E5 95.0853 3.6E6 95.0924 1.8E4 95.0960 4.1E4 97.0944 6.8E3 97.1008 4.1E5 97.1988 2.2E3 99.9477 3.7E4 103.0543 3.7E4 105.0444 1.1E5 105.0617 9.2E3 105.0696 9.5E5 105.0783 2.2E4 106.0774 6.2E4 107.0686 3.4E3 107.0853 4.7E6 107.0934 3.5E4 107.1020 1.1E4 107.3674 2.6E3 109.0645 1.1E5 109.1009 2.2E6 109.1089 1.1E4 109.1671 2.2E3 111.1166 7.8E4 112.8187 2.5E3 113.6498 5.3E3 113.9634 4.2E5 115.9432 3.0E3 119.0604 3.6E4 119.0765 4.0E3 119.0853 2.2E5 119.1277 2.4E3 121.0636 2.9E3 121.0805 1.0E4 121.0899 7.3E3 121.1009 1.6E7 121.1101 6.7E4 121.1141 3.6E5 121.1275 2.1E4 121.1275 8.3E4 123.0801 4.0E5 123.1165 9.1E5 125.9346 2.6E3 131.9741 5.8E4 133.0758 5.4E4 133.1010 3.1E4 133.9529 2.4E3 135.1166 1.3E6 135.1269 1.7E4 137.1322 1.0E5 141.1374 2.4E3 147.1168 4.7E4 149.0233 1.8E4 149.1185 9.5E3 149.1323 2.4E6 149.1448 2.0E4 150.0717 2.5E3 151.6654 2.3E3 154.9903 3.5E3 157.0564 2.2E3 161.1326 1.3E4 162.1411 6.0E3 163.1479 2.0E5 173.5255 2.9E4 173.5400 5.0E4 180.5688 2.3E3 186.4362 2.5E3 189.1844 4.6E3 197.1696 2.6E3 200.3753 4.4E3 203.0006 2.3E3 205.1954 9.0E4 213.8651 2.9E3 215.2242 2.4E3 END IONS BEGIN IONS FEATURE_ID=647 PEPMASS=279.1597 SCANS=647 RTINSECONDS=795.21 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 6 (0 removed due to low quality, 0 removed due to low cosine). 46.9243 2.1E3 46.9701 2.1E3 47.0515 2.3E3 48.2298 2.3E3 48.6262 2.1E3 48.9704 2.3E3 49.8732 2.0E3 52.1143 2.1E3 53.5237 2.8E3 55.5750 2.2E3 55.8110 2.3E3 57.0696 5.6E5 59.7606 2.2E3 61.6090 2.5E3 62.0557 2.2E3 63.4829 2.3E3 65.0384 1.7E4 66.2519 2.2E3 67.2992 2.3E3 67.5513 2.8E3 71.6030 2.4E3 72.9438 2.5E3 73.0280 2.5E3 73.9887 2.2E3 75.2715 2.4E3 76.1122 2.2E3 77.4042 2.3E3 78.4245 2.2E3 79.4744 2.7E3 80.7365 2.7E3 81.0693 5.6E3 83.0481 2.7E3 83.6999 2.4E3 85.7148 2.5E3 88.4863 2.4E3 89.5918 2.8E3 91.3941 2.1E3 92.1503 2.5E3 95.0853 3.0E3 101.9398 2.3E3 109.1010 3.0E3 111.0433 3.1E3 113.1413 2.4E3 114.8319 2.5E3 121.0281 5.3E4 121.0379 7.0E3 132.6889 2.3E3 137.0963 2.5E3 139.9500 2.5E3 145.7292 2.9E3 149.0230 2.5E6 149.0347 1.4E4 149.0512 3.4E3 150.7982 2.5E3 151.0750 1.1E4 167.0345 2.8E3 173.3210 2.3E3 173.5254 3.8E4 173.5389 4.3E4 182.2212 2.3E3 198.8824 2.3E3 201.0465 8.9E4 207.9839 2.2E3 219.0571 5.1E5 219.0813 9.8E3 231.6882 2.4E3 237.3184 2.5E3 241.9252 2.1E3 251.1423 2.6E3 252.2191 2.2E3 256.4821 2.4E3 259.6272 2.3E3 279.0937 3.7E5 279.1246 7.1E3 END IONS BEGIN IONS FEATURE_ID=648 PEPMASS=404.3529 SCANS=648 RTINSECONDS=799.086 CHARGE=1+ MSLEVEL=2 MERGED_STATS=8 / 8 (0 removed due to low quality, 0 removed due to low cosine). 55.0021 2.5E3 55.0543 1.2E4 55.1785 2.3E3 55.2363 2.1E3 56.9069 2.3E3 57.0698 7.1E4 59.5419 2.4E3 59.7823 2.2E3 60.5184 2.2E3 60.7785 2.1E3 61.4088 2.4E3 64.6239 2.5E3 65.1121 2.3E3 65.2772 2.3E3 65.9928 2.1E3 67.0541 1.9E4 67.7233 2.4E3 69.0697 2.9E4 69.2150 2.5E3 70.7397 2.5E3 71.0853 4.8E4 74.9328 2.5E3 79.0735 2.6E3 81.0697 4.0E4 81.3981 2.5E3 83.0853 3.4E4 85.1010 2.5E4 86.3315 2.4E3 89.0892 2.3E3 89.2906 2.5E3 89.3312 2.6E3 90.3656 2.2E3 95.0854 3.6E4 95.5617 2.5E3 97.1010 2.6E4 103.0541 4.6E4 103.7543 2.9E3 105.0698 2.5E4 108.4759 2.3E3 109.1009 1.3E4 111.1161 2.7E3 111.5424 2.7E3 114.5677 2.6E3 117.0696 3.8E4 118.0334 2.6E3 123.0438 1.7E5 128.7167 2.5E3 131.0379 3.0E3 131.0489 2.9E5 131.0854 5.1E4 133.0648 4.2E4 135.0803 2.6E3 136.3392 2.2E3 137.0595 2.4E5 142.9068 2.8E3 145.0646 2.7E5 145.0768 2.5E3 145.1008 3.3E3 146.0958 2.2E3 147.0801 5.2E3 149.0318 3.7E3 149.0458 3.4E3 149.0595 3.2E6 149.0699 3.6E4 149.3131 2.5E3 150.6722 2.5E3 151.0752 1.9E6 151.0955 7.2E3 159.0803 4.3E5 161.0959 5.8E4 163.0592 2.9E4 163.0752 1.6E6 163.0912 1.7E4 164.7045 2.2E3 165.0912 1.0E4 166.0858 3.0E4 173.0961 6.1E4 173.3371 2.3E3 173.5188 2.8E3 173.5287 8.4E4 173.5417 3.9E4 177.0733 5.5E3 177.0910 5.8E5 184.0240 2.6E3 187.1117 3.5E4 191.1065 1.0E5 201.1274 1.3E4 205.1212 6.4E3 215.1404 2.7E3 215.3985 2.4E3 222.1417 2.6E3 228.2260 2.6E3 251.9616 2.4E3 268.2995 2.3E4 270.1350 2.6E3 278.8470 2.4E3 287.6671 2.4E3 330.8197 3.3E4 368.1120 2.6E3 369.3148 1.2E4 387.3255 3.1E5 404.2930 4.5E3 404.3520 3.3E5 END IONS BEGIN IONS FEATURE_ID=649 PEPMASS=205.1954 SCANS=649 RTINSECONDS=799.775 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 4 (2 removed due to low quality, 0 removed due to low cosine). 41.0385 4.0E4 43.0541 2.2E4 51.7318 2.4E3 53.0385 1.3E4 55.0541 4.1E5 55.0572 5.8E3 55.0586 4.8E3 55.9342 9.0E3 57.0697 1.1E5 65.0383 2.8E4 66.9363 2.6E3 67.0539 2.1E5 68.6091 2.8E3 69.0696 4.1E5 69.0761 4.2E3 71.0854 9.9E3 71.7727 2.7E3 72.0914 2.4E3 72.9332 3.7E3 72.9367 9.0E4 77.0384 7.0E3 79.0540 2.4E5 79.0595 5.2E3 81.0696 4.9E5 83.0853 3.1E5 90.9474 6.0E4 91.0539 1.2E5 93.0333 8.1E3 93.0696 1.1E6 93.0762 8.2E3 93.0800 8.9E3 95.0488 3.0E4 95.0852 3.6E5 95.0928 4.7E3 97.1009 5.0E4 97.7204 2.2E3 99.9477 1.7E4 100.2458 2.4E3 101.1276 2.2E3 105.0445 1.1E4 105.0694 9.6E4 106.0771 2.8E3 107.0852 1.1E6 107.0927 4.6E3 107.0944 5.1E3 108.0937 2.3E3 108.9580 2.9E3 109.0645 2.9E4 109.1009 3.1E5 111.0438 6.5E3 111.1166 5.2E3 113.9548 8.3E3 113.9634 1.7E5 115.9426 2.7E3 119.0605 3.8E3 119.0853 2.2E4 121.0281 4.7E4 121.0389 1.4E4 121.1009 7.6E5 121.1102 1.5E4 123.0802 1.1E5 123.1068 5.0E3 123.1165 1.7E5 131.9739 2.3E4 133.0759 3.8E3 133.1012 3.5E3 133.9533 2.6E3 135.1166 2.0E5 136.7866 2.7E3 137.1321 1.3E4 147.1166 1.4E4 149.0105 4.9E3 149.0231 1.5E5 149.1184 3.6E3 149.1323 6.0E5 154.9901 3.9E3 162.1403 7.4E3 163.1480 3.5E4 173.5360 2.0E4 182.5305 2.2E3 205.1957 1.4E4 END IONS BEGIN IONS FEATURE_ID=650 PEPMASS=393.2042 SCANS=650 RTINSECONDS=801.562 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 6 (0 removed due to low quality, 0 removed due to low cosine). 57.8902 2.1E3 60.9098 2.4E3 67.4581 2.7E3 67.8310 2.4E3 71.1889 2.3E3 71.2820 2.3E3 75.4654 2.1E3 81.0695 7.0E3 81.6425 2.1E3 83.7285 2.4E3 90.5955 2.3E3 93.0696 1.6E4 93.4142 2.4E3 95.0489 7.5E3 95.0851 1.1E4 102.5165 2.9E3 105.0695 1.6E4 106.1025 2.4E3 106.2590 2.5E3 107.0852 1.0E4 108.0196 2.4E3 109.1012 2.7E3 114.7648 2.5E3 119.0854 2.5E4 119.1438 2.2E3 121.1004 3.7E3 121.1673 2.5E3 122.6325 2.4E3 131.0853 4.0E3 133.1008 1.3E4 143.0852 2.5E3 143.1042 2.4E3 145.1007 2.0E4 147.1169 3.1E3 149.0230 1.5E4 150.0266 1.6E4 151.0275 2.7E3 155.5091 2.5E3 155.8644 2.4E3 157.1009 7.0E3 159.1163 8.5E3 161.0959 2.6E3 167.7121 2.8E3 170.1121 2.3E3 173.1329 3.4E3 173.5245 3.5E4 173.5366 7.7E4 173.6607 2.4E3 189.1980 2.5E3 197.1321 5.9E3 198.7778 2.4E3 261.5462 2.6E3 322.2546 2.9E3 341.0164 2.5E3 352.4061 2.4E3 385.5151 2.7E3 393.2044 1.8E5 END IONS BEGIN IONS FEATURE_ID=651 PEPMASS=371.2220 SCANS=651 RTINSECONDS=801.563 CHARGE=1+ MSLEVEL=2 MERGED_STATS=1 / 3 (2 removed due to low quality, 0 removed due to low cosine). 55.0541 2.7E3 67.0541 1.6E4 69.0696 7.7E3 79.0542 5.5E3 81.0697 2.3E4 85.0647 2.6E3 90.0399 2.4E3 91.0540 5.5E3 93.0333 5.9E3 93.0696 1.4E4 95.0489 4.2E3 95.0853 1.1E4 97.0646 1.4E5 97.0721 3.2E3 101.0596 4.6E3 105.0696 1.2E4 107.0489 4.2E4 107.0853 3.3E4 109.0646 1.5E4 109.1010 6.0E4 111.0437 7.8E3 115.0328 2.0E3 119.0493 5.0E3 119.0854 1.2E4 121.0646 1.0E4 121.1009 1.2E4 123.0437 3.1E4 123.0803 4.5E3 123.1168 3.4E3 127.0751 1.1E4 129.0547 4.4E3 131.0853 1.2E4 133.0281 8.3E3 133.0647 3.1E4 133.1009 1.5E4 135.0439 1.3E5 135.0558 4.0E3 135.0802 1.2E5 135.1165 6.7E3 137.0958 1.8E4 143.0855 3.2E3 145.0648 6.8E3 145.1013 1.3E4 147.0437 1.1E4 147.0802 1.6E4 147.1166 9.5E3 149.0594 3.3E4 149.0959 1.2E4 149.1321 4.7E3 149.9537 2.6E3 151.0387 1.4E4 151.1117 7.6E3 157.1007 5.3E3 159.0446 3.5E3 159.0803 9.4E3 159.1167 6.7E3 161.0593 6.5E3 161.0957 1.9E4 161.1316 4.3E3 163.1118 4.6E3 163.1481 3.5E3 165.0545 8.8E4 171.0801 4.4E3 171.1171 2.9E3 173.0598 1.0E4 173.0961 3.5E3 173.1322 1.3E4 173.5224 4.8E3 173.5409 1.0E4 175.0753 1.8E4 175.1117 5.9E4 175.1480 6.2E3 179.0699 7.8E3 185.0960 2.0E4 186.1402 9.2E3 187.0753 1.1E4 187.1481 6.9E3 189.0911 7.2E3 191.1428 4.6E3 199.1114 3.4E3 199.1485 3.1E3 201.0907 1.3E4 203.1067 7.1E4 204.1509 4.9E3 205.0857 3.7E3 205.1586 4.9E4 207.1751 4.2E3 213.0913 1.1E4 215.1061 7.7E3 225.1268 1.2E4 231.1016 5.8E4 233.1164 3.6E3 237.1269 5.2E3 241.1230 4.3E3 243.1375 1.7E4 265.1205 2.7E3 269.1184 3.7E3 271.1318 3.0E3 279.1388 4.0E3 293.1904 3.2E3 321.1852 2.2E4 339.1949 1.0E5 357.2064 3.8E3 END IONS BEGIN IONS FEATURE_ID=652 PEPMASS=313.2741 SCANS=652 RTINSECONDS=802.936 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 6 (0 removed due to low quality, 0 removed due to low cosine). 48.2490 2.3E3 54.9998 2.7E3 55.0540 9.8E4 55.4295 2.4E3 56.2621 2.3E3 57.0332 2.8E5 57.0696 8.0E5 57.0729 8.1E3 57.0745 4.1E3 57.8394 2.2E3 63.7190 2.4E3 66.6876 2.5E3 67.0506 2.6E3 67.0539 1.1E5 69.0695 1.1E5 71.0852 4.3E5 71.2221 2.4E3 72.9142 2.4E3 76.0987 2.3E3 76.3944 2.5E3 78.7745 2.6E3 79.0542 5.3E3 81.0696 1.4E5 82.3117 2.4E3 83.0852 1.1E5 83.3012 2.4E3 83.6132 2.4E3 85.0644 5.4E3 85.1008 2.1E5 88.4928 2.1E3 89.0594 3.3E4 91.0538 7.5E3 91.1879 2.2E3 93.0699 7.5E3 94.8297 2.4E3 95.0852 2.4E5 95.1472 2.2E3 97.1009 4.7E4 103.0750 2.7E4 109.1008 8.0E4 114.1531 2.4E3 115.5045 2.1E3 116.8633 2.4E3 121.1004 2.9E3 123.1166 1.2E4 137.1316 3.1E3 138.7547 2.1E3 141.1986 2.3E3 150.4338 2.3E3 152.3737 2.5E3 159.9322 2.4E3 161.2824 2.7E3 161.6917 2.4E3 165.0544 2.1E4 167.0062 3.0E3 173.5276 9.1E4 173.5426 1.5E4 194.9843 2.3E3 206.6461 2.6E3 214.7508 2.5E3 241.5170 2.4E3 243.8504 2.4E3 248.5272 2.4E3 248.5964 2.5E3 295.1705 2.4E3 295.2573 2.4E3 304.7907 2.5E3 305.2124 2.5E3 310.3064 2.4E3 313.2724 8.4E3 313.4336 2.4E3 END IONS BEGIN IONS FEATURE_ID=653 PEPMASS=212.1437 SCANS=653 RTINSECONDS=803.176 CHARGE=1+ MSLEVEL=2 MERGED_STATS=9 / 9 (0 removed due to low quality, 0 removed due to low cosine). 41.0386 3.5E4 42.0339 2.5E3 42.8977 2.6E3 43.0178 2.1E4 43.0543 2.6E4 44.9061 2.1E3 44.9309 2.5E3 44.9748 2.0E3 47.4562 2.6E3 47.5018 2.4E3 49.2420 2.3E3 54.6814 2.2E3 57.9082 2.2E3 61.1685 2.4E3 63.6920 2.3E3 65.0385 3.8E4 65.5103 2.5E3 68.4529 2.2E3 71.0870 2.8E3 71.4887 2.5E3 73.4350 2.2E3 73.5139 2.2E3 74.2002 2.4E3 76.3073 3.1E3 77.0002 2.3E3 79.0539 2.9E3 80.6405 2.2E3 82.6640 2.2E3 83.2669 2.6E3 83.3726 2.5E3 83.6367 2.5E3 87.0731 2.4E3 89.0126 2.2E3 89.4717 2.5E3 89.6591 2.3E3 90.4827 2.4E3 91.0541 6.0E4 92.0493 1.0E6 92.0551 2.4E3 92.5608 2.4E3 93.0571 5.6E5 93.0693 3.3E4 94.0651 5.6E3 95.3896 2.3E3 98.7499 2.4E3 100.7898 2.3E3 104.9263 2.2E3 106.0649 4.8E3 107.0854 9.4E4 108.6703 2.2E3 115.0544 2.8E3 117.0697 3.4E4 119.0729 6.3E4 119.0821 2.1E3 119.9571 6.3E3 120.0807 4.2E6 120.0889 1.0E4 120.1011 2.8E3 121.0251 2.6E3 124.0839 1.4E4 128.0619 2.4E3 131.5398 2.4E3 132.1019 2.5E3 134.0861 4.2E3 134.0963 3.0E5 135.0800 2.7E3 135.0921 1.8E4 135.1041 1.2E6 135.1164 1.9E4 135.3704 2.5E3 143.0854 3.6E4 148.0247 2.3E3 153.0565 2.5E3 153.0698 7.6E4 154.0653 2.7E3 154.0939 5.8E3 155.0730 1.1E4 155.1383 2.2E3 155.9168 2.4E3 161.5937 2.9E3 168.0809 4.0E4 169.0720 3.3E3 169.0886 7.3E5 169.1040 4.6E3 170.0791 1.1E4 170.0964 2.4E6 170.1137 9.6E3 173.5236 2.3E4 173.5338 1.1E5 178.1956 2.6E3 196.1125 3.5E3 197.1184 6.4E4 205.2800 2.4E3 207.1585 2.4E3 210.1908 2.4E3 212.0969 4.6E3 212.1434 4.6E6 212.1902 3.5E3 END IONS BEGIN IONS FEATURE_ID=654 PEPMASS=252.2324 SCANS=654 RTINSECONDS=806.253 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 10 (8 removed due to low quality, 0 removed due to low cosine). 44.0132 3.3E4 44.0495 1.1E4 53.0386 6.4E5 55.0179 3.5E5 55.0543 2.0E6 55.0568 1.8E4 56.0495 6.7E4 57.0336 3.0E4 57.0699 3.0E6 57.0726 3.4E4 58.0652 5.8E4 59.0492 1.4E4 60.0444 2.1E4 61.7988 7.4E3 65.0387 1.7E4 67.0543 9.4E5 68.0621 4.4E4 69.0335 6.4E4 69.0699 1.4E6 69.0734 1.1E4 69.0745 1.2E4 70.0651 1.3E5 71.0491 3.0E4 71.0855 8.6E4 72.0444 2.6E5 72.0807 1.4E5 73.0648 7.3E4 74.0964 1.7E5 79.0543 3.9E5 80.0495 2.8E4 81.0335 1.9E6 81.0699 1.4E6 81.0743 1.7E4 82.0651 4.7E4 83.0437 1.1E4 83.0491 2.4E5 83.0856 6.2E5 84.0444 3.7E5 84.0809 9.2E4 85.0525 2.1E4 85.0647 1.6E4 85.1012 2.0E4 86.0600 8.7E4 86.0968 2.7E4 86.6925 2.5E3 91.0543 1.4E5 93.0700 2.5E5 94.0651 4.5E4 95.0492 7.1E5 95.0856 1.5E6 95.9669 2.6E3 96.0447 2.1E4 96.0809 2.1E4 97.0649 1.1E5 97.1012 7.2E5 98.0601 8.2E5 98.0965 3.7E4 99.0676 7.1E3 99.0804 4.7E3 100.0757 5.7E4 100.1121 2.1E4 105.0700 1.8E5 107.0856 1.4E5 107.0936 4.0E3 108.0808 3.8E4 109.0649 2.9E5 109.1013 4.1E5 111.0677 1.1E4 111.0805 4.2E4 111.1170 4.3E4 112.0669 3.9E3 112.0758 2.7E5 112.1120 3.1E4 114.0915 3.0E4 114.1279 3.1E4 119.0765 1.3E4 119.0857 2.2E5 120.0810 7.5E3 121.1011 5.6E4 122.0965 2.7E4 123.0805 1.5E5 123.1170 2.3E4 125.0969 1.0E4 126.0915 2.4E5 126.1279 1.7E4 128.1071 6.5E4 128.1435 2.1E5 133.1015 6.8E4 135.1170 7.4E4 136.1120 9.6E3 137.0962 5.4E4 137.1326 1.2E5 140.1072 1.2E5 140.1435 1.1E4 141.1151 1.5E4 142.1230 2.3E4 151.1483 5.3E4 152.1070 3.7E4 154.1228 2.5E5 154.1592 3.1E4 155.1306 1.3E4 156.1386 1.1E4 161.1327 1.1E5 167.1306 3.3E4 168.1386 8.8E4 168.1749 1.5E4 173.5314 1.0E5 176.6467 7.1E3 178.1595 5.1E4 179.1435 1.3E5 182.1544 4.3E4 184.2061 3.6E4 184.9030 2.6E3 196.1700 6.7E5 196.1909 5.5E3 210.1863 9.2E3 210.2217 1.8E4 224.2378 3.0E4 252.2326 1.1E6 END IONS BEGIN IONS FEATURE_ID=655 PEPMASS=409.2742 SCANS=655 RTINSECONDS=806.331 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 55.0177 1.3E4 55.0539 1.5E5 57.0697 6.2E4 59.0489 2.3E4 65.0387 3.2E3 67.0540 8.3E4 68.8136 2.2E3 69.0333 5.5E4 69.0696 6.0E4 69.5275 2.2E3 71.0491 1.7E4 71.1509 2.4E3 71.8763 2.4E3 77.0385 2.2E3 79.0539 1.2E5 81.0336 6.4E3 81.0696 2.9E5 82.8530 3.0E3 83.0489 4.8E4 83.0854 1.8E4 85.0646 2.9E4 89.6016 2.3E3 90.5395 2.7E3 91.0482 4.1E3 91.0538 1.7E5 93.0631 3.7E3 93.0697 4.0E5 93.0769 3.9E3 95.0489 4.7E5 95.0548 2.2E3 95.0853 2.6E5 97.0646 8.5E4 103.0542 2.8E3 105.0447 6.0E3 105.0697 8.5E5 105.0774 1.5E4 106.0780 2.8E3 107.0492 1.2E4 107.0773 3.8E3 107.0853 2.4E5 109.0646 1.2E5 109.1010 8.1E4 111.0436 3.4E3 111.0803 2.2E4 112.1594 2.2E3 113.0960 5.9E3 115.0544 7.2E3 117.0697 6.9E4 119.0489 2.3E4 119.0755 1.6E4 119.0853 6.2E5 119.0950 2.0E4 120.0934 2.3E4 121.0553 4.3E3 121.0646 1.7E5 121.1010 1.8E5 123.0802 1.2E5 123.1167 1.7E4 125.0593 1.6E4 125.0960 9.1E3 128.0625 1.6E4 129.0697 5.2E4 130.0776 2.0E4 131.0854 1.9E5 131.0966 3.5E3 132.0932 2.0E4 133.0646 6.1E4 133.0745 3.4E3 133.1010 2.1E5 135.0802 1.2E5 135.1166 4.2E4 135.1795 2.7E3 137.0595 1.9E4 137.0959 8.8E4 139.1120 3.1E3 141.0698 1.5E4 142.0776 8.1E4 143.0854 1.5E5 144.0932 4.3E4 145.0648 1.6E4 145.0873 2.5E3 145.0909 2.2E3 145.1011 4.3E5 145.1143 9.5E3 146.0729 3.5E3 146.1086 2.9E4 147.0803 2.1E5 147.1167 5.8E5 148.0882 1.2E4 149.0960 1.3E5 150.1039 1.6E4 151.0623 5.1E3 151.0752 2.1E5 151.0891 3.6E3 153.0905 2.1E4 155.0854 6.4E4 155.1074 2.8E3 156.0932 3.8E4 157.0862 3.3E3 157.1011 2.6E5 158.0732 3.0E3 158.1088 1.8E4 159.0803 5.2E4 159.1168 1.7E5 160.0887 1.6E4 161.0960 9.7E4 161.1325 5.4E4 162.1022 3.2E3 163.0752 6.6E3 163.1117 5.8E4 165.0910 4.3E5 167.0857 1.6E4 167.1067 1.7E4 168.0935 3.0E4 169.1013 1.1E5 170.1090 3.5E4 171.0800 8.7E3 171.1169 1.1E5 171.1306 3.4E3 172.0877 6.5E3 172.1238 1.3E4 173.0961 6.3E4 173.1326 8.4E4 173.5227 2.5E4 173.5396 3.6E4 174.1033 1.5E4 175.1119 1.1E5 175.1484 2.0E4 177.0911 6.7E4 177.1284 3.4E3 178.0990 5.0E4 179.0859 1.1E4 179.1065 2.4E3 179.1443 2.8E3 180.0935 1.1E4 181.1013 3.8E4 181.1182 9.1E3 182.1091 2.8E4 183.1169 1.1E5 184.1246 1.2E4 185.0959 1.8E4 185.1325 6.8E4 186.1049 4.4E3 187.1117 4.7E4 187.1482 3.0E4 188.1185 3.9E3 189.1274 6.5E4 190.1324 2.6E3 191.1064 8.5E3 191.1425 1.5E4 193.1011 2.4E4 194.1091 2.2E4 195.1169 5.4E4 196.1246 3.2E4 197.0971 6.6E3 197.1327 5.4E4 198.1391 3.8E3 199.1121 3.1E4 199.1482 2.5E4 200.1193 1.2E4 201.1276 7.2E4 201.1631 1.8E4 202.1318 2.5E3 203.1432 1.6E5 206.1104 6.7E3 207.1167 2.5E4 207.1384 7.0E4 208.1247 9.7E3 209.1328 5.0E4 210.1402 1.1E4 211.1120 1.3E4 211.1485 5.3E4 213.1277 3.6E4 213.1643 6.1E3 215.1435 3.0E4 216.1508 3.2E4 219.1166 8.0E3 219.1383 7.6E4 220.1250 1.0E4 221.1322 2.3E4 221.1540 1.4E5 223.1490 2.7E4 224.1555 3.9E3 225.1279 1.2E4 225.1641 2.8E4 227.1431 1.8E4 227.1795 4.4E3 229.1593 2.4E4 230.1287 2.9E3 231.1163 2.9E3 231.1385 2.4E4 233.1306 1.3E4 233.1540 2.4E4 234.1377 1.2E4 234.1617 1.3E5 235.1474 1.2E4 236.1579 3.1E3 237.1277 3.6E3 237.1647 1.1E4 239.1436 1.6E4 239.1795 1.0E4 241.1586 3.8E3 243.1383 4.1E3 247.1468 9.2E3 248.1554 2.7E3 249.1644 2.5E4 251.1808 1.2E4 253.1601 9.7E3 254.1675 2.9E3 255.1386 3.4E3 255.1721 3.2E3 261.1624 3.2E3 263.1782 4.3E3 267.1746 1.8E4 268.1829 6.0E3 269.1889 1.0E4 271.1700 8.6E3 275.1833 3.1E3 281.1930 3.8E3 285.1857 1.0E4 286.1928 2.8E4 287.2018 2.6E4 300.2072 6.5E3 312.2084 6.0E3 319.6655 2.5E3 329.2159 3.3E3 345.8697 2.4E3 347.2402 3.4E3 369.8227 2.4E3 409.2738 4.6E3 END IONS BEGIN IONS FEATURE_ID=656 PEPMASS=657.2566 SCANS=656 RTINSECONDS=810.934 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 2 (0 removed due to low quality, 0 removed due to low cosine). 66.3582 1.8E4 66.3611 5.1E3 66.7102 2.4E3 112.6137 2.2E3 168.5534 2.5E3 173.5216 1.1E4 173.5372 4.6E4 192.1230 2.7E3 220.6640 2.2E3 237.8922 2.3E3 291.0912 2.7E3 365.4330 2.6E3 396.9400 2.8E3 439.1406 8.2E3 441.1921 4.7E4 453.1600 4.5E3 467.1723 2.1E4 468.1788 2.3E4 469.1868 3.2E4 481.1493 3.8E3 495.1693 1.2E4 496.1702 1.1E5 497.1810 2.0E4 507.4714 2.5E3 509.1837 2.0E4 510.1921 2.7E3 523.1977 9.2E3 528.2371 1.0E4 537.1681 2.9E3 541.2416 1.3E4 556.2298 1.0E4 559.6758 3.1E3 569.2372 1.6E5 597.2340 6.4E5 598.2372 1.6E4 599.3745 3.6E3 601.2659 1.3E4 625.2297 3.7E3 628.2529 7.2E3 629.2577 1.4E4 657.2609 3.6E4 657.3969 4.6E3 END IONS BEGIN IONS FEATURE_ID=657 PEPMASS=391.2638 SCANS=657 RTINSECONDS=813.952 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 55.0540 1.2E4 57.0696 1.0E5 58.6912 2.6E3 60.5847 2.2E3 61.2717 2.2E3 61.8165 2.4E3 62.8221 2.4E3 65.0382 3.7E3 67.0540 1.5E4 69.0696 1.5E4 71.0852 8.8E4 71.9915 2.8E3 79.0539 3.8E4 81.0696 6.0E4 83.0490 3.2E3 83.0851 9.2E3 83.8936 2.6E3 85.0645 2.7E3 91.0540 3.0E4 92.6343 2.1E3 92.8909 2.7E3 93.0695 9.3E4 95.0437 2.2E3 95.0488 8.8E4 95.0851 3.7E4 97.0646 9.7E3 97.1031 2.3E3 105.0695 7.5E4 107.0852 6.5E4 107.1981 2.6E3 109.0646 1.4E4 109.1009 2.4E4 114.9388 2.2E3 117.0696 1.6E4 119.0852 7.8E4 121.0284 2.8E3 121.0643 2.2E4 121.0881 2.2E3 121.1008 5.1E4 123.0800 2.4E3 129.0699 4.4E3 131.0852 4.0E4 133.0643 2.8E3 133.1009 4.9E4 133.9595 2.3E3 135.0798 2.9E3 135.1167 1.4E4 142.0775 1.3E4 143.0852 4.8E4 144.0934 2.6E3 145.1009 7.6E4 147.0801 5.4E3 147.1166 1.5E4 149.0230 9.3E5 149.0957 2.4E3 155.0852 1.5E4 156.0403 2.3E3 156.0925 1.8E4 157.1008 7.6E4 158.1091 5.8E3 159.0803 2.7E3 159.1167 5.7E4 161.0959 1.8E4 161.1322 1.0E4 165.0712 2.8E3 167.0339 9.7E3 167.0846 3.5E3 168.0941 3.9E3 169.1010 4.9E4 170.1088 1.2E4 171.1165 6.5E4 172.1239 7.3E3 173.0970 9.9E3 173.1322 2.4E4 173.5340 5.5E4 179.0852 3.7E3 181.1012 2.8E4 182.1086 1.6E4 183.1169 4.0E4 185.1326 6.1E4 187.1480 3.8E4 193.1015 1.7E4 194.1087 7.5E3 195.1169 6.0E4 196.1246 1.7E4 197.1324 5.4E4 199.1112 1.2E4 199.1478 1.2E4 203.1443 3.3E3 206.1092 9.5E3 207.1168 3.4E4 208.1250 1.8E4 209.1324 6.2E4 210.1405 8.7E3 211.1486 3.4E4 213.1277 1.5E4 213.1633 2.7E3 217.1563 3.3E3 219.1175 7.9E3 220.1242 1.1E4 221.1327 4.3E4 222.1403 1.8E4 223.1484 4.0E4 224.1565 5.1E3 225.1296 2.5E3 225.1633 1.6E4 231.1174 2.7E3 232.1231 2.8E3 233.1330 1.6E4 234.1402 7.4E3 235.1481 2.9E4 236.1555 1.2E4 237.1632 2.0E4 238.1709 9.2E3 239.1426 3.6E3 245.1321 6.4E3 247.1482 1.6E4 248.1582 3.1E3 249.1638 7.3E4 250.1717 3.0E3 251.1445 2.8E3 251.1788 1.9E4 252.7919 2.7E3 253.1949 4.0E3 255.1736 3.6E3 259.1479 7.6E3 260.1540 3.0E3 261.1636 1.5E4 262.1731 3.0E3 263.1781 1.3E4 264.1871 7.8E3 265.1954 7.8E3 267.1746 4.3E4 273.1647 5.6E3 275.1795 1.9E4 277.1952 7.6E3 278.4675 2.3E3 282.1980 1.9E4 289.1954 1.0E4 317.1888 2.8E3 347.2362 3.5E3 373.6614 2.5E3 384.4745 2.5E3 391.2098 1.4E4 391.2630 4.6E3 394.8677 2.4E3 END IONS BEGIN IONS FEATURE_ID=658 PEPMASS=409.2741 SCANS=658 RTINSECONDS=813.952 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 5 (0 removed due to low quality, 0 removed due to low cosine). 55.0177 1.9E4 55.0540 2.6E5 56.3140 2.4E3 57.0333 1.6E4 57.0696 1.1E5 57.6606 2.5E3 58.6529 2.1E3 59.0489 5.0E4 63.0009 2.3E3 65.0385 8.8E3 66.2301 2.1E3 67.0507 3.2E3 67.0539 1.8E5 69.0332 1.0E5 69.0696 1.1E5 70.3190 2.3E3 71.0489 3.3E4 73.1512 2.7E3 77.0213 2.3E3 77.0387 1.5E4 78.6540 2.3E3 79.0494 3.3E3 79.0538 2.4E5 81.0332 2.5E4 81.0696 5.8E5 81.7877 2.3E3 83.0488 8.9E4 83.0853 3.3E4 84.7642 2.5E3 85.0645 6.4E4 91.0539 3.1E5 93.0696 8.1E5 93.0768 6.2E3 95.0489 9.3E5 95.0572 7.0E3 95.0852 5.2E5 95.0927 4.4E3 96.0567 2.3E3 97.0644 1.9E5 100.2472 2.7E3 103.0541 1.4E4 105.0441 7.7E3 105.0696 1.7E6 105.0776 1.9E4 105.1908 2.5E3 106.0774 5.5E3 107.0489 2.5E4 107.0773 4.8E3 107.0850 5.1E5 108.0568 5.5E3 109.0573 4.0E3 109.0645 2.3E5 109.1008 2.8E5 111.0433 5.2E3 111.0802 4.3E4 111.9836 2.6E3 113.0598 2.8E3 113.0959 1.1E4 115.0541 1.7E4 116.4338 2.3E3 117.0609 2.4E3 117.0696 1.4E5 119.0489 4.1E4 119.0582 2.7E3 119.0755 1.0E4 119.0852 1.2E6 119.0946 3.1E4 120.0930 4.5E4 121.0553 1.2E4 121.0645 3.4E5 121.0911 7.0E3 121.1009 3.7E5 121.7202 2.6E3 122.0722 6.3E3 123.0801 2.6E5 123.1167 2.7E4 125.0594 3.1E4 125.0956 1.1E4 128.0618 2.5E4 129.0696 9.0E4 130.0774 3.8E4 130.5589 2.3E3 131.0748 1.2E4 131.0853 3.7E5 132.0930 3.9E4 133.0645 1.0E5 133.1009 4.2E5 133.1127 4.3E3 134.0723 2.4E3 134.1090 2.8E3 135.0801 2.4E5 135.1166 8.5E4 137.0594 3.5E4 137.0958 1.7E5 139.0740 6.6E3 139.1110 5.8E3 141.0698 3.1E4 142.0775 1.6E5 143.0853 3.0E5 144.0569 2.6E3 144.0929 7.9E4 145.0649 3.4E4 145.1009 8.9E5 145.1161 1.4E4 146.0729 1.2E4 146.1084 4.7E4 147.0802 3.8E5 147.0942 4.9E3 147.1165 1.1E6 147.1275 8.9E3 148.0877 2.3E4 149.0958 2.4E5 149.1320 1.0E4 150.1034 3.5E4 151.0621 4.4E3 151.0751 4.4E5 151.0892 1.0E4 151.1111 3.9E3 153.0907 3.8E4 154.0775 5.4E3 155.0852 1.2E5 156.0930 8.7E4 157.0862 7.7E3 157.1009 5.0E5 157.1165 3.4E3 158.0725 6.4E3 158.1086 3.6E4 159.0803 1.1E5 159.1024 4.7E3 159.1166 3.4E5 160.0878 3.7E4 161.0959 1.9E5 161.1322 1.1E5 163.0756 9.9E3 163.1116 1.1E5 165.0705 6.6E3 165.0909 8.2E5 165.1037 2.3E3 166.0784 3.0E3 166.0953 2.5E3 167.0854 3.3E4 167.1065 3.5E4 168.0931 6.6E4 169.1012 2.2E5 170.1091 6.6E4 171.0810 2.1E4 171.1167 2.4E5 172.0882 1.2E4 172.1242 3.3E4 173.0961 1.2E5 173.1324 1.8E5 173.5278 7.6E4 173.5348 1.8E4 173.5452 1.8E4 174.1037 3.2E4 175.1117 2.1E5 175.1481 4.6E4 176.1177 6.8E3 177.0910 1.2E5 177.1271 1.4E4 178.0987 1.0E5 179.0855 2.8E4 179.1047 3.6E3 180.0933 1.5E4 181.1012 8.7E4 181.1206 1.2E4 182.1089 5.1E4 183.1168 2.3E5 184.1242 1.4E4 185.0959 3.4E4 185.1325 1.4E5 186.1028 9.5E3 186.1398 2.8E3 187.1117 1.0E5 187.1272 3.1E3 187.1480 5.3E4 188.1191 2.4E3 189.0925 2.4E3 189.1273 1.4E5 189.7785 2.7E3 190.1345 1.5E4 191.1066 1.4E4 191.1424 4.2E4 193.1012 4.6E4 193.1206 8.0E3 194.1088 3.3E4 195.1168 1.2E5 196.1246 6.1E4 197.0966 1.5E4 197.1325 1.1E5 198.1395 2.3E4 199.1117 6.8E4 199.1482 4.3E4 200.1192 2.3E4 201.1273 1.5E5 201.1636 3.2E4 202.1346 2.6E3 203.1226 3.9E3 203.1431 2.9E5 205.1011 3.8E3 206.1091 2.6E4 207.1167 5.8E4 207.1382 1.4E5 208.1246 2.6E4 209.1324 1.0E5 209.1536 3.8E3 210.1407 8.3E3 211.1120 3.3E4 211.1482 1.1E5 213.1274 6.2E4 213.1641 1.8E4 213.4037 2.6E3 214.1348 1.3E4 215.1084 3.0E3 215.1431 6.0E4 216.1508 7.7E4 217.1229 3.8E3 217.1590 4.8E3 219.1173 1.4E4 219.1382 1.4E5 220.1249 2.8E4 221.1322 5.1E4 221.1538 2.7E5 222.1391 1.0E4 223.1122 6.6E3 223.1482 5.9E4 224.1547 3.3E3 225.1269 2.6E4 225.1639 5.4E4 226.1351 3.5E3 227.1430 3.1E4 227.1794 7.3E3 229.1234 2.7E3 229.1588 5.0E4 230.1280 2.8E3 231.1152 3.3E3 231.1382 5.6E4 233.1309 2.0E4 233.1542 4.6E4 234.1391 1.7E4 234.1615 2.6E5 234.1888 2.4E3 235.1480 3.4E4 236.1545 1.0E4 237.1272 8.5E3 237.1644 1.8E4 239.1433 2.3E4 239.1795 2.4E4 241.1595 1.8E4 243.1381 1.5E4 246.1401 2.7E3 247.1463 1.4E4 248.1548 3.3E3 249.1637 5.1E4 251.1434 2.6E3 251.1790 2.3E4 253.1589 2.7E4 254.1649 3.1E3 255.1387 8.5E3 255.1744 6.8E3 259.1473 4.9E3 260.1569 4.1E3 261.1630 1.3E4 263.1794 1.4E4 267.1743 3.4E4 268.1809 1.1E4 269.1900 2.6E4 271.1697 2.4E4 273.1631 3.0E3 275.1799 3.7E3 277.1964 2.9E3 279.2132 2.8E3 281.1903 9.2E3 282.1977 7.4E3 285.1860 1.1E4 286.1930 5.8E4 287.2008 6.2E4 291.1758 2.8E3 293.1916 3.3E3 299.2014 2.8E3 300.2081 1.5E4 311.9152 2.6E3 312.2083 6.9E3 356.5939 2.6E3 377.5165 2.7E3 391.2625 2.6E3 409.2755 1.5E4 END IONS BEGIN IONS FEATURE_ID=659 PEPMASS=343.2272 SCANS=659 RTINSECONDS=816.114 CHARGE=1+ MSLEVEL=2 MERGED_STATS=10 / 10 (0 removed due to low quality, 0 removed due to low cosine). 51.3460 2.6E3 51.8490 2.2E3 54.2027 2.1E3 55.0540 9.8E4 56.0654 2.5E3 57.0697 6.6E4 57.8658 2.2E3 58.7780 2.6E3 59.0468 2.7E3 60.5007 2.1E3 61.4334 2.8E3 61.7903 2.4E3 62.5177 2.5E3 62.7038 2.6E3 63.4700 2.2E3 65.9623 2.8E3 67.0539 1.1E5 69.0695 4.4E5 70.5625 2.3E3 70.5920 2.3E3 71.5594 2.2E3 71.9377 2.4E3 72.5346 2.5E3 74.0904 2.5E3 76.9514 2.5E3 79.0541 2.2E4 79.3208 2.2E3 81.0695 5.4E5 83.0852 1.1E5 84.0757 2.5E3 84.1117 2.5E3 91.0540 2.1E4 91.1628 2.1E3 91.4401 2.2E3 91.5177 2.9E3 93.0696 4.7E4 94.3016 2.2E3 95.0489 7.5E3 95.0852 5.5E5 95.6367 2.2E3 97.0949 3.1E3 97.1009 1.3E5 105.0696 1.7E4 105.3809 2.5E3 107.0489 1.1E5 107.0851 4.2E4 108.6148 2.6E3 109.0927 1.2E4 109.1009 4.9E5 111.1166 1.8E4 117.8008 2.7E3 119.0491 1.6E4 119.0849 2.5E3 121.0648 2.9E4 121.1010 5.0E4 121.3639 2.5E3 123.1166 4.1E5 124.0236 2.3E3 131.1565 2.4E3 132.1843 2.6E3 133.0537 3.4E3 133.0647 1.6E5 135.1167 5.8E4 137.1323 2.0E5 138.3834 2.5E3 138.6245 2.2E3 145.0274 2.5E3 145.0647 6.3E3 147.0429 2.8E3 147.0803 6.6E4 149.1324 6.4E4 151.0244 1.1E4 151.0389 2.4E6 151.0515 1.7E4 151.0594 3.5E3 151.1484 4.5E3 153.0544 2.8E3 158.9876 2.6E3 159.0443 2.6E3 159.0802 2.0E4 161.0608 2.2E3 161.0961 1.5E5 163.0393 4.6E4 163.1481 2.8E3 164.2899 2.8E3 165.0547 4.6E5 165.0700 4.3E3 171.4464 2.4E3 173.0610 3.2E3 173.5243 1.1E4 173.5334 1.4E5 173.5447 1.7E4 175.0392 2.4E4 175.1119 5.6E4 177.0397 2.3E3 177.0548 1.2E5 177.7501 2.1E3 179.0704 9.2E4 179.1792 3.4E3 180.0440 2.4E3 183.2570 2.6E3 187.0753 2.7E4 189.0546 6.8E4 191.0703 6.6E4 191.1791 1.9E4 193.0861 5.7E4 193.1943 5.6E3 199.3375 2.3E3 201.0911 3.5E4 203.0705 2.7E4 205.0861 4.3E4 205.1959 6.3E3 207.1010 5.8E3 217.0866 4.4E4 219.1020 3.9E4 227.1057 5.8E3 229.7833 2.7E3 231.1021 3.5E4 233.1161 9.6E3 240.3496 2.5E3 245.1174 2.1E4 247.1336 3.8E4 259.1335 3.8E4 259.4660 2.3E3 261.1476 7.4E3 273.1491 1.4E4 287.1638 5.4E3 289.1454 2.5E3 290.0236 2.5E3 290.5768 2.9E3 299.4648 2.7E3 301.8461 2.4E3 325.2153 4.5E3 336.8799 2.8E3 342.9721 2.3E3 343.2279 3.1E5 343.2719 4.2E3 END IONS BEGIN IONS FEATURE_ID=660 PEPMASS=205.1954 SCANS=660 RTINSECONDS=817.221 CHARGE=1+ MSLEVEL=2 MERGED_STATS=8 / 23 (15 removed due to low quality, 0 removed due to low cosine). 41.0386 2.9E5 42.0337 1.4E5 43.0541 1.3E5 44.9044 1.2E4 47.9970 1.0E4 50.9443 2.9E3 51.0231 4.9E4 51.1902 2.4E3 53.0020 1.9E4 53.0384 5.1E5 54.2647 4.2E3 55.0543 6.2E6 55.0572 5.5E4 55.0587 5.0E4 55.9342 1.2E4 57.0697 1.4E6 57.7618 3.0E3 61.2577 1.1E4 64.0657 2.2E3 65.0385 1.6E5 65.6367 2.4E3 66.0461 1.7E4 66.2322 2.8E3 67.0540 4.2E6 67.0582 2.2E4 69.0700 9.3E6 69.0750 9.7E4 69.0760 5.4E4 69.0786 2.5E4 71.0852 3.0E5 71.9291 4.1E3 72.9368 3.0E5 77.0384 3.1E5 77.3592 1.1E4 79.0543 7.4E6 79.0593 3.9E4 79.0620 5.6E4 79.4773 4.1E3 80.0619 5.0E4 80.3590 2.3E3 81.0697 3.0E7 81.0784 1.9E5 81.0792 6.5E5 81.0806 1.1E5 81.0908 1.4E4 82.1477 2.9E3 82.4796 1.3E4 83.0852 1.6E6 90.9474 1.4E5 91.0540 3.2E6 92.0618 3.8E3 93.0621 5.3E4 93.0696 3.5E7 93.0763 1.7E5 93.0814 8.6E5 93.0832 1.1E5 93.0878 5.5E4 94.0773 5.1E3 95.0489 9.0E5 95.0853 9.0E6 95.0921 4.2E4 95.0969 1.0E5 95.8800 3.0E3 97.1009 1.0E6 98.3311 2.8E3 99.9477 2.7E4 100.7374 3.1E3 102.8030 4.5E3 103.0541 1.5E5 105.0445 3.0E5 105.0617 2.7E4 105.0696 2.9E6 105.0782 4.4E4 106.0774 2.0E5 107.0488 3.3E3 107.0853 1.2E7 107.0927 4.3E4 108.0933 2.1E4 108.3866 2.4E3 108.9582 2.8E3 109.0646 3.2E5 109.1010 5.2E6 109.1102 1.1E4 111.1166 1.9E5 113.9548 4.7E3 113.9634 4.7E5 114.2856 2.4E3 115.9430 3.3E3 116.5102 1.4E4 116.8067 3.5E3 118.8396 2.3E3 119.0604 1.2E5 119.0853 6.4E5 120.0036 3.1E3 120.0945 8.3E3 121.0899 6.0E4 121.1009 4.6E7 121.1121 9.8E5 121.1221 1.6E5 121.1231 4.7E5 121.1273 6.6E4 121.1390 1.2E4 122.3941 4.4E3 123.0713 4.0E3 123.0802 8.0E5 123.1166 2.4E6 123.1259 2.3E3 131.9742 5.4E4 133.0759 2.1E5 133.1012 7.5E4 133.9524 3.4E3 135.1166 3.4E6 135.1271 5.0E4 135.9436 2.3E3 137.1323 3.0E5 140.2865 2.9E3 147.1167 1.3E5 149.0232 3.9E4 149.1185 9.7E3 149.1323 5.9E6 152.2046 3.2E3 154.9905 5.6E3 156.0025 2.3E3 161.1333 1.6E4 163.1480 5.0E5 165.3370 2.3E3 165.6118 1.0E4 173.5253 1.8E4 173.5374 1.2E5 174.8727 2.2E3 184.0488 2.5E3 187.1268 2.7E3 205.1953 2.2E5 205.4780 2.5E3 212.3860 2.7E3 END IONS BEGIN IONS FEATURE_ID=661 PEPMASS=623.2508 SCANS=661 RTINSECONDS=818.242 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 5 (0 removed due to low quality, 0 removed due to low cosine). 65.6929 2.2E3 66.8949 2.5E3 67.2479 6.8E3 67.2504 4.6E3 69.9394 2.4E3 70.3521 2.4E3 70.7910 2.3E3 70.8498 2.5E3 80.6857 2.3E3 82.9107 2.2E3 83.3349 2.6E3 85.2948 2.3E3 85.5301 2.2E3 87.1205 2.4E3 94.9985 2.5E3 103.1302 2.5E3 106.1228 2.7E3 112.6563 2.4E3 116.0325 2.2E3 118.7059 2.3E3 123.2550 2.9E3 133.6258 2.2E3 148.6610 2.2E3 152.0089 3.0E3 153.3601 2.4E3 160.2935 2.2E3 161.3647 2.8E3 164.2809 2.5E3 173.5280 8.6E4 173.5407 2.0E4 225.2952 2.6E3 251.6780 2.5E3 308.7775 2.7E3 376.3563 2.7E3 421.3740 2.7E3 434.2132 2.8E3 435.2146 4.8E3 436.2227 3.7E3 444.1948 1.0E4 445.2048 3.4E3 461.1955 7.3E3 462.2043 6.6E3 462.2151 3.1E3 463.2069 7.7E3 471.2174 5.9E4 472.1877 6.4E3 473.1982 7.1E4 474.2049 5.8E3 475.2131 9.6E3 483.2234 4.2E3 485.1964 1.9E4 486.2060 2.0E4 487.2129 1.2E4 489.2248 5.8E4 490.2050 3.1E4 490.2225 6.0E3 491.2092 3.0E4 492.2147 2.8E3 499.2125 3.1E5 500.1862 5.8E4 501.2251 8.8E4 502.1994 3.0E3 503.2066 4.1E4 505.2248 2.7E3 507.2362 2.7E4 508.2457 2.3E4 511.2116 2.5E4 513.1916 1.0E5 514.2027 1.5E4 516.2135 1.1E4 517.2226 4.5E5 517.2942 2.2E3 518.2148 2.6E4 518.2266 2.7E3 519.2042 3.0E4 521.2103 3.0E3 527.2067 8.8E4 528.2139 3.6E3 529.2227 3.6E5 531.2028 1.0E5 532.2070 4.9E3 535.2330 1.8E5 536.2412 3.6E4 545.2176 1.4E6 545.3179 7.5E3 546.2201 5.8E3 547.2340 2.3E4 549.2351 6.7E3 555.2028 1.1E5 562.2224 1.5E4 563.2292 7.9E4 564.2367 1.4E5 573.2129 4.9E5 577.2440 2.1E5 591.2239 1.1E5 595.2554 5.3E4 605.2391 4.2E5 605.3260 2.2E3 623.2494 2.2E5 END IONS BEGIN IONS FEATURE_ID=662 PEPMASS=600.4176 SCANS=662 RTINSECONDS=820.477 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 65.0390 2.5E3 67.0540 1.0E4 69.0333 3.7E3 69.0696 2.4E4 69.6796 2.2E3 70.5545 2.3E3 70.7738 2.1E3 79.0539 1.2E4 81.0695 4.3E4 83.0489 9.9E3 83.0853 2.1E4 85.0648 3.2E3 89.0595 8.5E3 91.0541 1.5E4 92.1283 2.5E3 93.0695 6.4E4 95.0491 2.6E3 95.0851 5.0E4 97.0644 1.3E4 97.1015 3.5E3 98.5855 2.6E3 100.7801 2.4E3 105.0695 4.6E4 105.0769 3.3E3 107.0851 7.8E4 109.0646 7.8E3 109.1008 4.5E4 111.0797 2.8E3 111.1163 2.5E3 117.0692 8.3E3 119.0851 1.0E5 121.0644 1.0E4 121.1008 1.1E5 123.0808 3.5E3 123.1164 1.8E4 125.0597 2.8E3 125.0955 1.4E4 127.1432 2.5E3 131.0852 4.1E4 133.1008 7.1E4 135.0802 1.3E4 135.1165 4.4E4 137.0957 5.5E3 139.1114 1.5E4 142.0772 3.2E3 143.0852 3.1E4 144.0939 3.2E3 145.0646 5.6E3 145.1008 9.3E4 147.1164 2.8E4 148.5116 2.3E3 149.0958 2.5E4 149.1321 1.2E4 155.0848 6.5E3 156.0932 3.0E3 157.1009 5.5E4 159.0803 1.3E4 159.1165 6.4E4 161.0964 1.2E4 161.1322 1.6E4 163.1117 1.3E4 166.5688 2.6E3 167.1064 8.5E4 169.1008 2.3E4 171.1165 4.0E4 171.1310 2.4E3 173.1323 3.8E4 173.5180 2.8E3 173.5315 8.6E4 175.1119 1.2E4 175.1479 3.6E4 177.1270 1.2E4 178.9315 2.4E3 181.1012 1.7E4 182.1070 2.8E3 183.0079 2.3E3 183.1168 3.2E4 185.0958 3.0E3 185.1323 2.4E4 187.1478 2.1E4 193.1024 4.3E3 194.2463 2.8E3 195.1165 2.5E4 196.1241 5.7E3 197.1137 3.4E3 197.1322 3.3E4 199.1103 2.9E3 199.1480 1.9E4 201.1637 1.6E4 203.1425 4.1E3 207.1165 1.3E4 209.1323 2.9E4 211.1117 3.8E3 211.1481 2.0E4 213.1269 5.3E3 213.1637 6.5E3 217.1577 2.8E3 219.1375 3.5E3 221.1323 1.6E4 221.1548 2.5E3 223.1483 2.3E4 225.1644 6.0E3 227.1437 2.4E3 233.1549 7.7E3 235.1480 8.1E3 237.1639 1.0E4 239.1796 8.0E3 241.1594 2.3E3 247.1471 1.2E4 247.2422 6.3E3 249.1625 6.2E3 251.1795 3.1E3 261.1633 3.9E3 261.5549 2.3E3 263.1797 5.3E3 265.1953 6.5E3 265.2522 1.2E4 275.1788 3.2E3 285.2184 3.1E3 306.8998 2.6E3 337.6905 2.6E3 339.2906 1.2E4 356.1843 2.4E3 379.5291 2.4E3 402.5135 3.0E3 407.3105 2.4E3 459.5454 2.2E3 593.4709 2.4E3 END IONS BEGIN IONS FEATURE_ID=663 PEPMASS=349.2528 SCANS=663 RTINSECONDS=821.882 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 54.8208 2.5E3 55.0540 2.5E4 57.0697 1.0E4 57.7284 2.2E3 65.4916 2.2E3 67.0539 3.9E4 68.8048 2.6E3 69.0695 3.2E4 70.5837 2.4E3 71.0488 4.5E3 72.0827 2.3E3 72.4475 2.5E3 74.2379 2.4E3 77.0383 2.6E3 78.5753 2.2E3 79.0538 3.4E4 80.2069 2.2E3 81.0696 6.3E4 81.9051 2.2E3 82.1880 2.6E3 83.0852 1.2E4 86.1364 2.4E3 91.0539 4.5E4 93.0639 2.7E3 93.0695 1.2E5 95.0489 4.6E4 95.0852 9.1E4 97.0644 2.1E4 105.0695 1.2E5 105.4472 2.4E3 107.0852 1.0E5 109.0648 1.2E4 109.1008 7.6E4 117.0696 2.1E4 119.0851 1.4E5 121.0643 5.4E3 121.1008 1.3E5 123.0801 1.2E4 123.1166 1.4E4 129.0694 1.2E4 131.0852 8.0E4 132.0923 2.5E3 133.1009 7.4E4 135.0801 1.4E4 135.1165 3.3E4 142.0778 1.6E4 143.0852 5.6E4 144.0931 2.1E4 145.1009 1.1E5 146.1077 2.6E3 147.0802 9.4E3 147.1165 3.3E4 149.0958 5.4E3 155.0854 1.9E4 156.0932 1.5E4 157.1009 8.4E4 158.1093 8.5E3 159.1166 4.9E4 160.8317 2.8E3 161.0957 2.5E4 161.1323 1.7E4 167.0852 5.4E3 168.0931 3.0E3 169.1011 2.8E4 170.1090 1.5E4 171.1167 4.5E4 172.1245 1.1E4 172.2857 2.3E3 173.0962 4.4E3 173.1323 3.4E4 173.5286 3.2E4 173.5383 1.6E4 175.1113 3.0E3 175.1479 1.0E4 175.5508 2.9E3 179.0853 8.6E3 179.1426 3.0E3 180.0933 2.6E3 181.1009 1.4E4 182.1084 4.6E3 183.1168 2.8E4 184.1248 3.2E3 185.0957 2.6E3 185.1325 3.3E4 187.1110 3.5E3 187.1480 2.4E4 189.1288 2.5E3 194.1086 1.4E4 195.1168 2.4E4 196.1245 4.9E3 197.1322 2.8E4 199.1486 1.1E4 201.1633 2.7E3 207.1156 5.9E3 209.1328 2.5E4 210.1407 6.1E3 211.1486 1.4E4 221.1308 3.4E3 223.1482 9.5E3 225.1642 1.4E4 227.1427 3.0E3 233.1322 2.7E3 251.1797 9.1E3 309.5614 2.8E3 338.7448 2.7E3 347.6337 2.7E3 349.2532 1.2E4 END IONS BEGIN IONS FEATURE_ID=664 PEPMASS=367.2632 SCANS=664 RTINSECONDS=822.262 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 55.0540 4.1E4 57.0696 2.9E4 59.0489 9.8E3 59.4118 2.5E3 64.2837 2.3E3 67.0539 6.2E4 69.0332 2.1E4 69.0695 4.9E4 70.4559 2.0E3 71.0489 1.8E4 75.1246 2.3E3 76.4010 2.1E3 79.0539 5.7E4 80.6749 2.3E3 80.9009 2.2E3 81.0695 1.2E5 83.0489 1.0E4 83.0853 2.2E4 85.0645 6.8E3 88.7974 2.2E3 90.2100 2.4E3 91.0484 3.0E3 91.0539 6.6E4 93.0693 1.8E5 95.0488 7.3E4 95.0849 1.7E5 97.0645 4.0E4 102.0475 2.4E3 105.0695 1.6E5 107.0494 2.6E3 107.0773 3.3E3 107.0851 1.5E5 109.0643 3.3E4 109.1008 1.1E5 111.0802 8.4E3 115.0545 2.5E3 116.0618 2.6E3 117.0694 3.5E4 119.0852 2.3E5 120.5757 2.8E3 121.0645 2.6E4 121.0921 7.3E3 121.1008 1.4E5 123.0803 1.6E4 123.1167 2.4E4 128.0619 1.2E4 129.0697 2.5E4 130.0776 5.2E3 131.0852 1.6E5 132.0939 2.8E3 133.0651 2.7E3 133.0904 3.5E3 133.1009 1.6E5 135.0801 3.9E4 135.1166 4.4E4 137.0957 1.1E4 142.0774 2.8E4 143.0852 9.5E4 144.0928 2.7E4 145.1009 1.8E5 145.1138 3.2E3 146.0722 9.1E3 146.1073 9.3E3 147.0802 2.8E4 147.1165 5.8E4 149.0959 2.4E4 149.1321 3.7E3 154.0771 2.6E3 155.0854 2.5E4 156.0926 2.7E4 157.1008 1.4E5 158.1084 2.0E4 159.0806 1.6E4 159.1165 1.1E5 160.0891 3.3E3 160.1241 2.7E3 161.0959 1.2E5 161.1320 2.2E4 163.1117 2.6E3 167.0859 9.8E3 168.0926 6.3E3 169.1010 4.9E4 170.1087 2.1E4 171.1166 7.6E4 172.1237 1.5E4 172.7208 2.2E3 173.0961 1.8E4 173.1323 7.7E4 173.5210 5.3E3 173.5354 3.2E4 175.1116 1.6E4 175.1482 3.0E4 179.0854 1.9E4 180.0937 2.7E3 181.1009 2.2E4 182.1087 1.5E4 183.1167 5.4E4 184.1238 1.6E4 185.0956 4.3E3 185.1324 4.9E4 186.1392 6.3E3 187.1479 2.6E4 192.9927 2.4E3 193.1016 9.0E3 194.1088 2.6E4 195.1168 3.0E4 196.1238 1.6E4 197.1322 3.9E4 199.1480 2.4E4 200.1556 3.3E3 201.1270 7.3E3 201.1635 1.1E4 203.8040 2.7E3 206.1899 2.7E3 207.1172 7.3E3 209.1324 3.6E4 210.1381 5.7E3 211.1481 2.3E4 212.1571 2.4E3 213.1284 7.5E3 221.1317 4.3E3 223.1480 6.7E3 225.1634 1.3E4 227.1430 3.5E3 236.1552 3.2E3 237.1631 8.5E3 238.9835 2.3E3 239.1807 4.8E3 251.1788 4.1E3 255.1734 2.4E3 279.1737 3.7E3 291.8649 3.0E3 302.4102 2.5E3 307.1965 2.3E3 316.4720 2.6E3 END IONS BEGIN IONS FEATURE_ID=665 PEPMASS=618.4280 SCANS=665 RTINSECONDS=824.418 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 67.0538 2.4E4 69.0330 1.4E4 69.0694 2.0E4 71.0487 8.9E3 77.4071 2.1E3 79.0539 2.9E4 80.0616 5.4E3 80.8521 2.6E3 81.0694 1.1E5 83.0486 3.4E4 83.0850 1.9E5 85.0642 1.7E4 85.3169 2.6E3 86.7603 2.4E3 89.7197 2.5E3 91.0538 2.4E4 93.0693 1.0E5 95.0434 2.5E3 95.0486 6.9E4 95.0850 8.9E4 95.4610 2.8E3 97.0643 6.9E4 99.0437 2.1E4 105.0694 1.0E5 106.0776 3.3E3 107.0850 1.5E5 109.0643 4.3E4 109.1006 6.6E4 111.0800 2.1E4 113.0955 3.7E4 117.0694 1.8E4 119.0850 1.8E5 120.0927 2.2E4 121.0643 2.3E4 121.1007 1.4E5 123.0800 7.1E4 123.1160 1.8E4 125.0592 2.2E4 125.0956 6.1E4 128.0619 2.8E3 129.0695 1.5E4 131.0851 8.7E4 132.0928 1.8E4 133.0645 3.3E3 133.0905 6.4E3 133.1007 1.3E5 134.1083 1.2E4 135.0800 5.4E4 135.1165 4.6E4 136.0882 2.3E3 137.0590 4.2E3 137.0957 3.5E4 139.0748 1.2E4 139.1112 5.5E4 141.0909 2.5E3 142.0775 1.3E4 143.0850 8.0E4 144.0928 4.7E4 145.1007 2.2E5 145.1140 3.3E3 146.1077 1.3E4 147.0800 6.7E4 147.1163 6.9E4 149.0957 4.7E4 149.1325 3.4E3 150.1041 3.5E3 151.0750 4.7E4 151.1112 9.9E3 153.0905 1.7E4 155.0850 2.7E4 155.1061 3.8E4 156.0932 1.9E4 157.1007 2.0E5 158.1084 3.7E4 159.0800 2.7E4 159.1164 1.4E5 160.0878 7.7E4 160.1239 3.5E3 161.0957 5.4E4 161.1320 3.4E4 162.1023 2.6E3 163.1114 8.2E4 165.0907 2.0E5 165.1263 1.4E4 166.0941 3.6E3 167.0858 3.4E3 167.1063 4.7E4 168.1140 3.3E3 169.1010 6.9E4 169.1170 2.7E3 169.1226 2.5E3 170.1088 2.4E4 171.0807 3.5E3 171.1013 9.8E3 171.1166 1.4E5 172.1240 4.9E4 173.0960 3.6E4 173.1324 7.8E4 173.5234 2.0E4 173.5389 4.1E4 174.1028 3.1E3 175.1115 5.4E4 175.1478 1.9E4 176.1189 8.4E3 177.0904 1.2E4 177.1269 1.6E4 178.0982 1.1E4 179.1060 9.5E3 179.1428 2.7E4 180.1142 1.3E4 181.1012 2.8E4 181.1220 1.2E5 182.1089 1.3E4 182.1259 3.0E3 183.1165 8.1E4 183.1375 2.5E4 184.1236 1.8E4 185.0961 1.4E4 185.1322 9.5E4 186.1396 1.0E4 187.1114 4.6E4 187.1271 2.6E3 187.1302 2.5E3 187.1480 5.3E4 189.1271 4.7E4 190.1348 6.7E4 191.1064 1.6E4 191.1426 4.4E4 193.1027 1.4E4 193.1221 4.3E4 194.1094 9.0E3 194.1297 5.9E3 195.1164 5.4E4 195.1368 1.8E4 196.1243 1.5E4 197.1322 1.1E5 198.1045 2.8E3 198.1387 1.4E4 199.1116 2.4E4 199.1481 4.6E4 200.1193 2.6E3 201.1271 3.8E4 201.1628 4.1E3 202.1351 2.4E3 203.1429 1.3E5 204.1477 3.1E3 205.1223 5.2E3 206.1095 2.9E3 207.1165 3.0E4 207.1380 5.6E4 208.1248 9.8E3 208.1456 5.1E4 209.1323 8.7E4 209.1533 1.4E4 210.1395 1.3E4 211.1116 2.0E4 211.1482 6.8E4 212.1194 4.4E3 212.1550 1.0E4 213.1270 3.2E4 213.1636 2.3E4 215.1432 2.8E4 216.1509 1.3E4 217.1233 8.6E3 217.1584 5.7E3 219.1162 7.4E3 219.1382 3.0E4 221.1324 2.9E4 221.1536 3.4E5 222.1392 4.7E3 222.1594 3.4E3 223.1483 5.2E4 224.1557 1.0E4 225.1262 1.7E4 225.1484 4.4E4 225.1669 1.3E4 227.1429 2.0E4 227.1798 1.7E4 228.1513 3.1E3 229.1587 2.1E4 231.1381 3.6E4 231.1735 3.8E3 233.1310 1.2E4 233.1537 1.2E5 234.1388 7.7E3 234.1613 6.6E4 235.1479 2.7E4 237.1270 1.7E4 237.1638 4.0E4 238.1695 3.5E3 239.1429 1.2E4 239.1794 1.8E4 241.1588 1.6E4 243.1376 3.0E3 243.1740 5.2E3 245.1543 1.4E4 246.1616 1.5E4 247.1461 8.0E3 247.1694 7.3E4 249.1302 2.4E3 249.1635 2.4E4 251.1441 1.0E4 251.1790 2.5E4 253.1585 2.3E4 253.1918 6.3E3 255.1740 4.2E4 257.1894 9.8E3 259.1708 1.4E4 260.1777 3.1E3 261.1613 1.0E4 261.1866 1.1E4 263.1796 1.7E4 265.1597 1.2E4 265.1951 1.4E4 267.1741 2.2E4 269.1577 3.4E3 269.1899 2.6E4 271.1695 1.7E4 273.1852 3.8E4 274.1934 2.3E4 275.1793 8.4E3 277.1943 7.0E3 279.1752 1.6E4 281.1560 2.7E3 281.1898 2.4E4 283.1711 1.4E4 285.1857 2.0E4 286.1929 6.1E4 287.2009 4.1E5 291.2113 9.9E3 293.1899 8.4E3 294.1990 2.9E3 295.1718 3.7E3 295.2061 1.4E4 297.1853 2.3E4 298.1946 1.3E4 299.2007 7.0E4 300.2073 1.7E4 303.1976 1.0E4 307.2059 1.3E4 308.5944 2.5E3 309.1847 1.1E4 309.2226 3.0E3 310.1932 1.0E4 311.2009 2.0E4 312.2083 2.4E4 313.2159 4.6E4 315.2109 2.8E3 319.2054 2.4E4 321.2203 3.3E3 323.1995 7.1E3 325.2162 3.7E4 326.2242 2.9E3 329.2134 1.4E4 333.2196 3.8E3 334.2269 2.7E3 337.2164 6.8E4 339.2323 4.9E4 352.2399 2.0E5 353.2480 4.7E4 363.2291 3.7E3 365.2478 9.2E4 367.2640 1.8E4 377.2483 6.9E3 379.2651 3.0E3 391.2663 3.9E3 395.2588 7.5E4 404.8769 2.6E3 438.3198 2.8E3 440.2897 3.8E3 480.3233 2.3E4 523.3452 2.9E3 525.3589 2.7E4 526.3604 1.1E4 538.3661 9.1E4 603.4066 3.3E3 END IONS BEGIN IONS FEATURE_ID=666 PEPMASS=655.3128 SCANS=666 RTINSECONDS=825.99 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 68.8082 2.7E3 68.8119 2.5E3 69.0398 2.1E3 74.7924 2.3E3 78.0213 2.2E3 78.4348 2.3E3 82.3461 2.4E3 82.8247 2.5E3 87.7992 2.1E3 88.6985 2.6E3 89.6270 2.1E3 100.2424 2.3E3 101.4958 2.9E3 101.9628 2.3E3 107.9520 2.5E3 112.0262 2.4E3 120.6302 2.4E3 131.7962 2.8E3 131.8931 2.3E3 138.3925 2.3E3 163.9611 2.5E3 173.5251 5.7E4 173.5334 2.9E4 173.5440 3.2E4 178.4724 2.7E3 187.3214 2.5E3 227.1182 3.2E3 239.1528 5.3E3 246.8627 2.4E3 269.1276 2.7E3 275.8958 2.7E3 327.1736 7.8E3 334.1938 2.5E3 351.6282 2.4E3 355.2712 2.6E3 384.1714 2.2E4 389.2112 4.0E3 390.2169 1.6E4 402.2176 1.4E4 406.2123 8.4E3 407.2223 1.1E4 412.1655 4.0E4 419.2231 3.3E3 420.2285 2.1E4 421.2360 2.6E4 426.1820 2.2E4 427.1894 1.2E4 433.2366 2.8E4 434.2425 7.1E3 435.2522 4.8E4 436.2599 9.2E4 444.1927 2.7E4 447.2477 2.7E3 448.2602 6.9E4 449.2330 2.8E3 450.6787 2.5E3 454.5166 3.0E3 460.2275 8.3E3 463.2128 4.6E4 473.2350 1.5E4 474.2415 3.5E3 475.2138 1.2E4 477.2289 4.5E4 487.2508 1.1E4 488.2576 3.7E3 491.2438 1.9E4 492.2558 5.4E3 505.2605 3.8E3 509.2889 7.2E3 515.2439 1.6E4 517.2260 1.0E4 519.2790 9.2E3 520.2826 3.8E4 531.2402 1.4E4 532.2517 3.4E3 532.2648 2.6E3 533.2590 3.5E4 535.2343 1.9E4 536.2439 1.6E4 537.2840 1.2E4 546.2677 2.8E3 547.2707 9.3E3 549.2583 2.1E4 553.2659 4.1E3 559.2694 1.2E5 561.2867 3.2E5 561.3864 8.8E3 563.2662 1.7E5 564.2736 3.9E5 565.2788 2.1E4 577.2739 6.6E4 578.2885 8.3E4 580.2638 4.0E4 581.2726 2.9E3 587.2675 1.1E4 591.2746 6.0E4 593.3132 1.5E5 594.2515 2.9E3 595.2900 4.6E4 600.5212 2.8E3 605.2755 1.0E5 608.2603 4.2E4 609.2805 3.5E3 619.2915 3.0E5 623.2855 2.9E4 637.3023 1.6E5 640.2848 5.8E4 655.3082 3.4E4 END IONS BEGIN IONS FEATURE_ID=667 PEPMASS=205.1954 SCANS=667 RTINSECONDS=827.393 CHARGE=1+ MSLEVEL=2 MERGED_STATS=13 / 15 (2 removed due to low quality, 0 removed due to low cosine). 41.0385 4.0E5 42.0337 9.2E4 43.0541 1.7E5 48.8218 5.6E3 51.0230 2.5E4 53.0021 3.4E3 53.0205 5.7E3 53.0384 3.7E5 53.6504 2.6E3 54.0048 5.5E3 55.0178 2.7E3 55.0541 5.3E6 55.0572 2.2E4 55.0587 1.6E4 55.5709 2.6E3 55.9343 3.7E4 57.0697 1.3E6 57.2270 2.7E3 57.6255 2.2E3 58.8167 2.5E3 60.7317 6.1E3 65.0384 1.4E5 66.0463 1.1E4 66.0671 6.2E3 67.0540 3.7E6 67.0584 9.1E3 68.9186 2.1E3 69.0698 7.6E6 69.0738 2.7E4 69.0764 2.3E4 69.0786 8.2E3 69.2675 2.2E3 70.9566 2.5E3 71.0853 2.5E5 71.4352 2.3E3 71.6189 6.0E3 71.9403 2.5E3 72.9368 4.3E5 73.0283 9.9E3 73.6000 2.5E3 74.7370 2.3E3 77.0385 2.2E5 77.7352 2.6E3 78.0463 2.3E3 78.9524 2.8E3 79.0541 5.5E6 79.0604 3.2E4 79.0621 1.4E4 79.0650 7.5E3 80.0619 2.1E4 81.0697 2.2E7 81.0783 7.5E4 81.0794 5.9E5 81.0807 4.5E4 81.0909 5.7E3 81.7249 2.4E3 82.8927 2.4E3 83.0852 1.5E6 83.0924 1.3E4 85.4615 2.2E3 90.9474 2.6E5 91.0540 2.4E6 91.0602 5.3E3 93.0621 2.8E4 93.0696 2.6E7 93.0802 6.9E4 93.0815 6.8E5 93.0832 5.2E4 93.0873 2.0E4 93.0915 7.8E3 95.0489 6.8E5 95.0853 7.5E6 95.0937 7.6E4 95.0992 1.2E4 95.1147 2.6E3 96.2912 2.4E3 97.1009 9.2E5 97.1729 2.4E3 99.9479 5.3E4 100.0731 2.3E3 103.0541 8.7E4 105.0444 2.3E5 105.0696 2.0E6 105.0783 2.1E4 106.0774 1.4E5 107.0495 5.8E3 107.0853 1.0E7 107.0930 3.9E4 107.0994 2.2E4 107.1020 1.6E4 107.9504 2.5E3 108.1808 2.3E3 108.6825 2.3E3 108.9576 8.8E3 109.0645 2.5E5 109.1009 4.6E6 109.1119 1.9E4 111.1166 1.8E5 113.9549 3.5E3 113.9634 7.4E5 114.4055 2.5E3 114.5308 2.6E3 115.9426 5.6E3 117.0700 2.7E3 119.0603 9.0E4 119.0768 4.1E3 119.0853 4.8E5 120.0933 2.7E3 120.2495 2.1E3 121.0794 1.9E4 121.0898 3.5E4 121.1009 3.3E7 121.1097 6.0E5 121.1219 4.0E5 121.1230 7.9E4 121.1274 2.5E4 122.3808 2.7E3 123.0802 7.8E5 123.1069 1.2E4 123.1166 2.0E6 126.6530 2.8E3 131.9742 1.0E5 133.0758 1.3E5 133.1012 8.2E4 133.3061 2.3E3 135.1166 2.9E6 135.1268 2.3E4 137.1323 2.6E5 138.4553 7.2E3 141.3396 2.2E3 146.6120 2.7E3 147.1167 1.1E5 148.1241 3.2E3 149.0232 4.7E4 149.1184 3.0E3 149.1324 4.9E6 149.1451 1.3E4 150.3009 2.4E3 151.3814 2.4E3 158.9671 2.3E3 161.1328 2.5E4 162.1402 7.3E3 163.1480 4.4E5 173.5267 2.4E5 173.5416 1.3E5 177.1649 3.1E3 178.9452 2.4E3 179.0601 6.7E3 187.5770 6.7E3 197.7856 5.3E3 205.1953 1.7E5 210.8115 2.8E3 211.2287 2.2E3 215.9342 2.7E3 END IONS BEGIN IONS FEATURE_ID=668 PEPMASS=303.1959 SCANS=668 RTINSECONDS=828.443 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 49.8252 2.0E3 53.6163 2.2E3 53.7083 2.3E3 55.0542 3.8E3 55.2184 2.5E3 55.7458 2.5E3 57.8988 2.6E3 58.5690 2.5E3 60.8717 2.1E3 67.0540 7.5E3 69.0696 2.3E4 71.4463 2.2E3 73.9734 2.5E3 79.0539 5.4E4 79.5252 2.4E3 81.0695 1.7E4 84.0238 2.4E3 91.0538 7.1E3 91.4456 2.3E3 93.0695 3.4E4 95.0852 3.1E3 96.3791 2.2E3 107.0851 2.6E4 109.1010 2.4E3 121.2626 2.3E3 121.9395 2.4E3 123.0800 3.8E3 131.8271 2.7E3 133.1012 2.9E3 135.1162 7.2E3 136.0513 1.8E4 139.0145 2.8E3 149.6886 5.4E3 151.0751 3.4E4 153.0916 2.8E3 154.0624 1.0E4 159.0808 4.3E3 166.0624 1.5E5 166.0768 4.6E3 167.0700 7.3E3 173.5337 4.4E4 176.0842 5.8E3 181.0858 2.4E5 185.0958 2.6E3 188.0833 2.5E3 189.0907 9.7E3 190.0979 1.6E4 190.6902 2.3E3 192.5791 2.3E3 195.1010 3.2E3 198.1044 2.7E3 201.0913 1.0E4 202.0984 1.2E4 203.1079 3.6E3 206.0945 2.6E3 208.2061 2.4E3 213.0909 2.4E4 216.1150 1.2E4 217.0015 2.7E3 219.1015 2.3E4 228.1151 2.7E3 229.1222 7.9E4 232.1087 2.6E3 232.6509 2.7E3 245.1172 2.2E4 247.1318 3.0E3 251.0959 2.2E3 272.1788 7.3E3 293.7867 2.6E3 END IONS BEGIN IONS FEATURE_ID=669 PEPMASS=454.2592 SCANS=669 RTINSECONDS=828.531 CHARGE=1+ MSLEVEL=2 MERGED_STATS=14 / 14 (0 removed due to low quality, 0 removed due to low cosine). 56.0657 2.2E3 56.1472 2.3E3 56.3366 2.4E3 57.0697 1.0E4 57.2867 2.3E3 60.5512 2.1E3 61.1324 2.2E3 61.2158 2.1E3 61.2460 2.3E3 61.4394 2.2E3 61.9093 2.4E3 62.1086 2.2E3 62.1922 2.6E3 62.8145 2.1E3 65.2272 2.5E3 67.0542 3.3E4 69.0334 3.0E3 69.0698 3.8E4 69.4490 2.6E3 69.7527 3.5E3 70.1088 2.4E3 70.1977 2.1E3 70.3878 2.4E3 70.8350 2.2E3 71.0853 3.0E3 71.1505 2.2E3 71.3729 2.5E3 71.6233 2.3E3 72.0584 2.1E3 72.4030 2.3E3 73.8094 2.3E3 74.8329 2.3E3 79.0541 1.7E4 81.0334 1.4E4 81.0698 1.3E5 81.4355 2.4E3 82.4956 2.3E3 83.0492 5.4E3 83.0852 1.7E4 84.3149 2.6E3 88.0404 2.4E3 88.2192 2.4E3 89.0595 1.1E5 89.3888 2.3E3 90.9761 2.5E3 91.0542 1.9E4 93.0698 1.8E5 95.0489 5.6E3 95.0854 5.8E4 95.5431 2.7E3 96.1967 2.5E3 96.2645 2.5E3 97.4564 2.5E3 97.8501 2.2E3 98.0599 2.4E6 98.0685 1.4E4 99.3756 3.1E3 102.4937 2.5E3 105.0698 6.5E4 106.6552 2.4E3 107.0856 4.4E4 109.0647 6.5E3 109.1011 6.2E4 109.3457 5.0E3 110.0518 5.5E3 110.0599 2.8E5 110.9240 2.2E3 115.3266 2.5E3 117.3061 2.7E3 119.0493 8.0E3 119.0855 7.2E4 120.0206 2.5E3 121.0646 5.7E3 121.1010 7.6E4 121.8160 2.5E3 123.0803 3.2E3 123.1167 7.6E4 124.6803 2.3E3 125.0965 3.5E3 128.3499 2.6E3 129.0699 1.8E4 129.7222 2.3E3 133.0291 2.4E3 133.0646 1.2E5 133.0858 3.5E4 133.1011 2.5E4 133.3139 2.4E3 133.4350 2.3E3 134.9674 2.5E3 135.0793 3.0E3 135.1168 1.0E5 136.0756 2.4E4 137.0961 5.6E3 137.1330 7.6E3 139.3391 2.4E3 141.6975 2.3E3 147.0802 8.7E4 147.1168 1.7E5 148.0515 2.1E4 149.6874 5.5E3 149.7175 2.6E3 151.0753 6.1E3 152.0595 3.2E3 152.0705 5.9E5 152.0847 9.0E3 160.9470 2.4E3 161.1324 1.3E5 162.0669 3.0E3 163.1116 7.4E4 164.0826 2.4E3 165.0553 9.0E3 166.0625 6.7E4 167.0712 2.2E3 168.2604 2.3E3 169.0856 1.7E4 171.1170 2.4E4 173.5265 1.6E5 173.5404 1.3E5 174.6414 2.6E3 175.0758 2.6E4 175.1121 1.1E4 176.0830 5.1E4 178.1766 2.4E3 179.0698 9.4E3 180.0782 1.1E5 181.0691 8.4E3 181.0859 2.5E6 181.1019 1.1E4 183.5512 2.5E3 188.0838 5.1E3 189.1274 1.9E5 190.0624 9.9E4 190.0987 9.6E3 191.0705 3.1E4 192.0799 2.9E3 193.0488 5.4E3 193.0858 4.6E4 194.4542 2.5E3 195.0450 3.3E3 195.0654 2.6E5 195.1015 7.1E5 202.0985 1.3E4 203.0704 3.5E4 204.0783 8.0E4 204.1150 2.9E3 205.0860 3.5E4 206.0576 2.2E4 206.0952 2.9E3 207.1017 2.5E5 208.0731 1.6E5 209.1175 2.5E4 215.1069 3.2E3 216.1138 7.3E3 216.3014 2.6E3 218.1303 2.1E4 219.1016 1.7E5 220.0733 2.9E4 221.0564 1.1E4 221.0809 9.3E5 221.1058 3.7E3 221.1180 8.0E4 222.0853 2.7E3 223.0708 3.3E3 223.0965 5.0E5 224.4139 2.6E3 227.3242 2.3E3 228.1143 7.9E3 228.6059 2.2E3 230.0944 1.5E4 231.1018 1.1E5 231.1372 2.8E3 232.1102 1.7E4 233.0805 1.7E4 233.0925 2.9E3 233.1172 1.2E5 233.7751 2.6E3 234.3289 2.2E3 235.0963 4.8E5 235.1324 2.2E4 236.1023 5.4E3 238.0409 2.7E3 239.1076 3.0E3 240.1151 1.1E4 241.1225 4.9E4 242.1307 1.4E4 244.1094 1.7E4 245.1172 1.7E5 246.1238 8.6E3 247.0964 1.7E4 247.1327 8.4E4 249.1482 3.8E4 250.9823 2.8E3 251.6561 2.4E3 252.1122 2.5E3 255.1022 2.1E4 255.1407 5.5E3 256.1091 3.9E4 257.1168 4.8E4 257.2513 3.2E3 258.1253 2.9E4 259.1021 3.0E3 259.1327 1.8E5 261.1120 3.9E4 261.1473 3.5E4 265.6670 2.6E3 266.1301 1.9E4 269.1175 1.6E4 269.1523 9.5E3 270.1253 6.1E3 271.1329 5.9E4 272.1405 2.8E4 272.1748 3.6E3 273.1127 8.5E4 273.1481 1.3E5 275.1280 3.6E4 282.1247 4.9E3 282.1609 1.4E4 283.1329 5.5E4 283.1675 2.7E4 284.1431 3.9E3 284.1773 9.3E4 285.1458 3.4E3 287.1279 1.0E5 287.1620 3.2E4 289.1446 1.4E4 293.1546 2.8E3 296.1403 4.4E3 297.1489 4.0E4 298.1562 3.4E4 298.1927 5.3E4 299.1279 7.9E4 299.1643 1.2E4 300.1724 2.8E4 301.1432 1.3E5 301.1779 1.1E4 303.1960 1.7E4 308.1771 6.2E4 311.1669 7.7E3 313.1426 2.4E3 313.1798 1.3E5 314.1515 1.2E4 314.1884 3.5E3 315.1587 5.6E4 315.1958 5.1E5 315.2277 2.2E3 324.1713 8.8E3 325.1794 6.0E3 326.1873 7.2E4 329.1733 1.9E4 329.2115 1.8E5 339.1951 1.8E5 342.1836 3.5E4 352.8063 2.9E3 357.1533 5.6E3 357.1676 3.5E3 357.2057 1.8E6 357.2568 5.8E3 370.8690 2.6E3 374.9507 2.6E3 395.1149 2.4E3 402.4371 2.8E3 405.3531 2.4E3 405.4181 2.4E3 454.0652 2.6E3 END IONS BEGIN IONS FEATURE_ID=670 PEPMASS=476.2412 SCANS=670 RTINSECONDS=828.63 CHARGE=1+ MSLEVEL=2 MERGED_STATS=9 / 9 (0 removed due to low quality, 0 removed due to low cosine). 61.1937 2.3E3 61.2233 2.7E3 61.4986 2.3E3 61.6540 2.3E3 61.9528 2.2E3 62.4891 2.2E3 62.7953 2.2E3 63.3480 2.2E3 65.7027 2.5E3 67.5399 2.1E3 69.1717 2.1E3 73.6781 2.2E3 75.4976 3.6E3 75.7288 2.3E3 78.6686 2.5E3 79.7005 2.2E3 83.2816 2.4E3 85.7509 2.4E3 90.8153 2.7E3 92.1664 2.3E3 92.4047 2.9E3 95.0701 2.3E3 96.6090 2.2E3 98.2492 2.2E3 103.1000 2.7E3 106.1821 2.4E3 108.2093 2.8E3 108.5357 2.4E3 115.8050 2.7E3 119.0340 1.4E4 120.0417 2.1E4 120.2225 2.3E3 128.1103 2.2E3 136.3583 2.3E3 139.4753 2.4E3 142.9607 2.5E3 145.7175 2.5E3 145.9775 2.2E3 147.0287 1.5E4 149.5355 2.5E3 149.6232 2.9E3 149.6879 5.5E3 153.5843 2.4E3 156.2146 2.3E3 168.0230 2.8E3 173.5260 5.3E4 173.5376 9.9E4 174.0523 5.2E4 183.0795 2.2E3 186.4025 2.2E3 193.2947 2.2E3 203.7849 2.4E3 217.0835 2.2E4 217.3623 2.3E3 227.1924 3.1E3 229.1105 3.4E3 235.0079 2.5E3 248.1877 2.1E3 260.2031 2.6E3 261.6698 2.4E3 274.4370 2.6E3 274.6358 2.6E3 282.1128 2.6E3 292.5614 3.1E3 304.3403 2.8E3 309.2411 2.2E3 309.9062 2.5E3 317.8886 2.5E3 321.4301 2.4E3 325.0915 3.1E3 336.7242 2.7E3 338.0360 2.3E3 338.8126 2.5E3 340.0679 4.2E3 340.1153 9.6E5 341.1230 2.6E4 369.4641 2.6E3 379.1844 6.8E3 386.3129 2.9E3 431.9655 3.1E3 441.3488 2.9E3 460.6343 2.8E3 476.2408 1.7E5 485.7976 2.5E3 END IONS BEGIN IONS FEATURE_ID=671 PEPMASS=653.2971 SCANS=671 RTINSECONDS=828.908 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 68.2613 2.3E3 68.5340 2.7E3 71.2530 2.3E3 73.0213 2.2E3 78.9558 2.5E3 81.8545 2.5E3 84.3404 2.2E3 84.6446 2.1E3 87.7833 2.3E3 92.0637 2.7E3 98.5276 2.7E3 99.6962 2.2E3 105.0981 2.9E3 108.7482 2.4E3 119.3360 2.4E3 147.4258 2.2E3 149.3115 2.7E3 163.1966 2.4E3 173.5240 3.0E4 173.5374 6.1E4 173.5442 7.1E3 182.8053 2.6E3 183.7831 2.6E3 222.0773 3.0E3 235.7735 2.6E3 358.1080 2.9E3 436.2259 1.2E4 446.2403 2.8E3 449.1953 9.5E3 450.2029 2.6E3 463.2097 1.1E4 464.2198 5.4E4 465.2242 5.3E3 467.1206 2.6E3 475.2110 7.4E3 477.1931 1.1E4 478.1996 7.4E3 491.2098 6.8E3 492.2119 3.4E4 493.2222 3.3E3 503.2467 3.9E3 505.2255 3.8E3 519.2375 2.9E3 523.2369 1.2E4 536.2911 2.8E3 537.2079 3.4E3 547.2340 1.9E4 549.2536 8.2E3 550.2551 1.4E4 551.2657 1.0E4 552.2335 1.5E4 564.2728 3.9E4 565.2541 5.4E4 565.2713 3.2E4 575.2642 6.1E4 577.8436 3.1E3 578.2518 9.2E4 579.2591 1.8E4 583.2944 8.8E3 592.2614 4.0E3 593.1675 8.4E3 593.2753 3.1E5 596.2927 2.6E3 606.2471 1.6E4 607.2544 6.8E3 609.2708 1.6E4 610.2747 2.2E4 611.2835 3.4E3 621.2690 2.6E4 622.8051 2.8E3 624.2905 4.6E4 625.2943 2.1E4 635.2856 5.7E4 636.2742 5.8E3 638.2728 1.7E5 653.2964 2.7E5 653.4194 4.5E3 END IONS BEGIN IONS FEATURE_ID=672 PEPMASS=499.3170 SCANS=672 RTINSECONDS=830.209 CHARGE=1+ MSLEVEL=2 MERGED_STATS=12 / 12 (0 removed due to low quality, 0 removed due to low cosine). 60.1743 3.0E3 60.5104 2.3E3 63.3701 2.4E3 64.5935 2.2E3 66.8810 2.4E3 68.8315 2.2E3 70.3837 2.3E3 71.2578 2.5E3 72.2708 2.3E3 72.7143 2.7E3 73.8189 2.5E3 74.3825 2.4E3 78.3202 2.3E3 78.7530 2.9E3 79.0540 3.0E3 81.0335 6.5E3 81.0696 1.3E5 81.9855 2.2E3 83.1097 2.5E3 83.3523 2.5E3 86.9976 2.5E3 89.0596 2.8E4 90.7660 2.3E3 93.0697 3.6E4 94.5831 2.3E3 95.0853 2.1E4 95.9367 4.2E3 98.0598 1.0E6 98.0708 3.2E3 100.1302 2.4E3 100.3244 2.4E3 100.4444 2.6E3 100.9299 2.1E3 101.3329 2.6E3 105.0700 3.0E3 107.0851 2.5E3 109.1011 5.6E3 110.0517 4.2E3 110.0598 2.4E5 110.8328 2.4E3 112.9297 2.4E3 114.5402 2.2E3 115.1402 2.3E3 116.8598 2.4E3 118.6929 2.6E3 119.0856 3.4E3 121.1012 3.4E3 122.6940 2.3E3 123.1182 2.3E3 125.0063 2.2E3 125.2962 2.7E3 128.4143 2.5E3 131.5265 2.7E3 133.0649 1.5E4 133.0851 3.1E3 133.4518 2.1E3 135.1167 2.0E4 135.7414 2.3E3 137.1321 2.2E4 139.9643 2.3E3 140.0680 3.1E3 141.4136 2.3E3 145.9058 2.4E3 147.0806 7.0E3 147.1165 2.5E4 149.1682 2.4E3 149.6694 3.8E3 149.6899 1.2E4 151.4373 2.4E3 152.0561 4.9E3 152.0704 1.2E6 152.0849 4.6E3 153.7952 2.2E3 161.1322 1.7E4 169.7935 2.7E3 172.6144 2.6E3 173.5246 4.3E4 173.5351 2.0E5 173.5475 3.9E3 178.6976 2.5E3 180.0783 1.2E4 181.0859 5.3E5 181.1020 2.2E3 182.3216 2.5E3 189.1277 4.3E4 190.0625 3.0E4 191.0699 3.7E3 193.0856 3.5E3 195.0653 4.7E4 195.1013 1.5E5 195.3857 2.4E3 202.5456 2.4E3 203.8448 2.4E3 204.0787 3.2E3 206.0576 3.0E3 207.1018 2.5E4 208.0731 3.4E4 209.4381 2.7E3 214.2229 2.6E3 216.1152 2.6E3 219.1020 3.1E4 221.0809 1.1E6 221.1185 9.1E3 223.0967 2.1E5 228.2795 2.5E3 231.9298 2.5E3 233.1164 1.9E4 235.0965 1.1E5 237.4999 2.6E3 245.1168 2.1E4 247.0969 2.8E3 247.1326 1.8E4 247.8385 2.8E3 249.1483 2.8E3 249.3075 2.4E3 251.5509 2.5E3 255.8833 2.5E3 257.1178 2.4E3 259.1322 2.3E4 263.2768 2.6E3 269.1828 2.5E3 272.1777 2.8E3 273.1131 1.1E4 273.1476 1.7E4 283.1297 2.5E3 284.1768 6.0E3 287.1281 1.2E4 292.2190 2.5E3 301.1438 1.4E4 303.1957 7.4E4 304.9669 2.4E3 308.1812 2.5E3 308.2462 2.6E3 313.1803 1.4E4 315.1590 7.8E3 315.1960 1.3E5 326.1188 2.4E3 326.1860 3.7E3 329.2117 5.6E4 339.1956 3.7E4 357.1673 3.1E3 357.2061 7.3E5 357.2566 1.1E4 364.3046 2.7E3 395.5104 2.4E3 410.3533 2.5E3 412.7327 2.8E3 425.8279 2.7E3 435.5302 2.3E3 438.3363 2.4E3 442.8694 2.8E3 448.1729 3.1E3 451.7095 3.0E3 465.3929 2.5E3 469.4545 2.9E3 476.9292 2.6E3 479.8723 2.6E3 480.9402 2.2E3 END IONS BEGIN IONS FEATURE_ID=673 PEPMASS=639.2455 SCANS=673 RTINSECONDS=830.822 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 73.9169 2.2E3 75.4803 2.2E3 82.7010 2.5E3 91.2412 2.5E3 123.0671 2.5E3 129.4031 2.7E3 133.3520 2.9E3 173.5166 9.2E3 173.5311 7.6E4 173.5465 1.3E4 189.3448 2.8E3 253.0379 2.5E3 284.1444 2.9E3 321.6617 3.0E3 330.1601 3.2E3 342.1210 2.5E3 370.1547 1.0E4 396.1716 2.7E3 409.1412 2.5E3 414.1439 3.7E4 421.2024 1.0E4 426.1421 8.2E3 434.2092 3.9E4 435.2171 2.0E4 436.2249 1.4E4 445.2408 3.6E3 451.2121 4.2E3 458.3523 2.4E3 461.2335 2.7E3 462.2405 5.1E3 463.2465 3.0E4 465.1918 1.0E5 466.2001 1.1E4 474.2033 8.9E3 475.2133 3.7E3 477.1917 2.7E3 479.2079 1.3E5 480.2154 1.2E5 489.2254 4.0E4 489.2979 6.8E3 490.2355 1.5E4 491.2412 3.3E4 493.2216 1.0E4 501.1909 1.0E4 502.1991 1.2E4 505.1875 2.9E4 506.1970 9.9E4 507.2379 1.2E5 508.2464 8.7E4 515.2074 1.7E4 516.2152 1.8E4 517.1340 9.3E3 517.2226 4.3E5 518.2291 3.8E4 519.2029 3.3E4 523.2292 4.6E4 524.2413 2.9E4 533.2171 2.2E4 534.2263 1.3E4 535.1384 3.4E3 535.2328 3.3E5 535.3290 3.5E3 536.2424 8.8E3 537.2130 7.6E4 540.2363 1.8E4 548.2063 6.3E3 549.2425 3.3E3 551.2283 9.5E4 552.2361 5.7E5 561.2130 2.2E5 561.3150 4.5E3 562.2206 3.0E4 563.2281 1.2E4 563.3489 2.3E4 567.2621 2.8E3 577.2479 5.0E3 579.2236 2.9E5 580.2313 3.0E4 581.3604 4.3E4 589.2072 3.6E3 593.2382 5.9E4 595.2548 3.6E4 611.2503 1.6E4 621.2332 1.2E5 621.3671 4.6E3 621.3945 8.7E3 639.2450 6.8E4 639.4003 2.8E4 END IONS BEGIN IONS FEATURE_ID=674 PEPMASS=409.2741 SCANS=674 RTINSECONDS=835.957 CHARGE=1+ MSLEVEL=2 MERGED_STATS=8 / 8 (0 removed due to low quality, 0 removed due to low cosine). 54.4861 2.2E3 55.0540 7.2E4 55.7374 2.1E3 57.0697 2.9E4 57.9898 2.1E3 58.8384 2.1E3 59.0489 8.2E3 60.9451 2.3E3 65.7816 2.3E3 67.0540 5.3E4 69.0332 3.0E4 69.0696 2.4E4 71.7570 2.7E3 71.9232 2.8E3 73.1581 2.1E3 73.1761 2.3E3 73.9560 2.4E3 74.2958 2.4E3 79.0539 5.4E4 80.5536 2.2E3 81.0653 2.7E3 81.0695 1.6E5 81.2753 2.5E3 83.0488 3.5E4 83.0856 1.1E4 83.1809 2.2E3 84.9453 2.7E3 85.0646 1.2E4 85.1687 2.0E3 86.5714 2.4E3 86.6067 2.1E3 88.1675 2.3E3 89.7465 2.3E3 90.4855 2.3E3 91.0539 8.0E4 91.7768 2.5E3 93.0695 2.4E5 94.4858 2.3E3 95.0425 3.2E3 95.0488 2.4E5 95.0852 1.5E5 95.4343 2.2E3 97.0498 2.3E3 97.0645 7.0E4 97.3896 3.2E3 98.0772 2.3E3 103.0530 2.3E3 104.7370 2.4E3 105.0695 4.1E5 107.0483 2.8E3 107.0851 1.4E5 107.4667 2.4E3 109.0645 6.5E4 109.1008 5.7E4 111.0801 7.0E3 114.9215 2.5E3 117.0696 3.1E4 119.0485 7.0E3 119.0768 4.0E3 119.0852 3.0E5 121.0645 9.2E4 121.1009 1.0E5 121.1865 2.1E3 121.3457 2.4E3 123.0800 7.1E4 123.2880 2.7E3 125.0966 2.8E3 129.0695 1.9E4 131.0852 1.0E5 131.8313 2.5E3 133.0647 2.6E4 133.1008 1.2E5 135.0802 6.3E4 135.1166 2.7E4 137.0957 4.6E4 139.1131 2.4E3 141.0700 3.0E3 142.0777 3.2E4 143.0851 7.8E4 144.0928 1.4E4 144.6481 2.5E3 145.0648 2.9E3 145.1008 2.3E5 146.1082 6.6E3 147.0801 1.1E5 147.1165 2.4E5 149.0958 7.0E4 151.0751 1.4E5 153.0900 6.9E3 155.0854 3.2E4 156.0932 1.7E4 157.1009 1.4E5 159.0804 2.9E4 159.1166 1.1E5 160.6299 2.6E3 161.0959 5.0E4 161.1322 1.9E4 162.1302 2.7E3 163.1115 2.6E4 164.2085 2.7E3 165.0907 2.4E5 168.0934 1.0E4 169.1012 6.8E4 170.1078 1.2E4 171.1167 7.0E4 173.0958 2.9E4 173.1323 4.2E4 173.5165 5.6E3 173.5273 5.5E4 173.5364 1.1E5 173.5465 7.3E3 174.1023 2.8E3 174.3999 2.4E3 175.1115 4.8E4 177.0910 2.1E4 178.0985 3.2E3 181.1009 1.3E4 183.1168 6.1E4 185.1328 2.7E4 187.1117 1.8E4 187.1488 9.2E3 188.4400 2.8E3 189.1273 4.2E4 191.1443 2.7E3 193.1015 6.8E3 195.1169 2.4E4 195.2719 2.3E3 196.1236 1.3E4 196.2505 2.4E3 197.1325 3.5E4 199.1115 9.6E3 199.1479 6.2E3 201.1273 3.0E4 201.1632 2.5E3 203.1430 8.8E4 207.1177 4.4E3 207.1381 3.8E4 209.1327 2.3E4 211.1484 3.0E4 213.1267 1.0E4 215.1425 3.9E3 216.1510 7.0E3 216.6012 2.5E3 219.1380 2.7E4 221.1326 9.3E3 221.1536 8.3E4 223.1475 4.4E3 225.1629 6.7E3 229.1582 4.3E3 233.1535 3.0E3 234.1613 4.6E4 239.1412 2.5E3 249.1633 8.7E3 253.1590 2.5E3 258.1942 3.0E3 280.5752 2.5E3 283.3543 2.6E3 286.1931 1.8E4 287.2015 3.3E3 309.5574 2.3E3 312.2101 2.7E3 317.6024 2.6E3 376.3655 2.5E3 382.3468 2.5E3 409.2739 6.1E3 416.8551 2.5E3 END IONS BEGIN IONS FEATURE_ID=675 PEPMASS=476.2411 SCANS=675 RTINSECONDS=839.148 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 58.8772 2.3E3 62.2956 2.9E3 64.9130 2.3E3 70.9703 2.4E3 78.2107 2.6E3 79.4157 2.4E3 89.0595 3.4E3 109.5614 2.3E3 110.7448 2.4E3 120.0413 3.6E3 120.2090 2.7E3 120.6057 2.5E3 128.1149 2.2E3 128.5551 2.4E3 134.4938 2.5E3 136.4486 2.2E3 137.4824 2.6E3 149.6837 4.2E3 149.7039 4.1E3 172.9034 3.2E3 173.5247 4.0E4 173.5428 2.8E4 182.3263 2.3E3 190.9757 2.4E3 220.9132 2.6E3 226.9604 2.4E3 288.9120 2.5E3 325.0929 3.0E3 340.0685 3.3E3 340.1153 2.4E5 373.5704 2.4E3 379.1854 2.9E3 395.2322 2.4E3 422.1228 2.7E3 476.2410 1.4E5 476.3157 4.1E3 END IONS BEGIN IONS FEATURE_ID=676 PEPMASS=454.2592 SCANS=676 RTINSECONDS=839.159 CHARGE=1+ MSLEVEL=2 MERGED_STATS=7 / 7 (0 removed due to low quality, 0 removed due to low cosine). 57.0697 2.5E3 57.9523 2.1E3 58.1927 2.2E3 58.4837 2.3E3 59.1849 2.6E3 62.0840 2.1E3 62.5802 2.7E3 63.9064 2.6E3 67.0542 1.3E4 68.1705 2.4E3 69.0697 7.6E4 70.4490 2.6E3 71.5248 2.1E3 72.9689 2.7E3 73.5785 2.5E3 74.7569 2.1E3 77.0624 2.3E3 78.0218 2.3E3 79.0541 2.4E4 81.0696 1.8E5 83.0852 1.6E4 88.0625 2.7E3 88.5230 2.4E3 89.0595 4.1E4 90.4961 2.7E3 91.0539 3.2E4 91.3325 2.8E3 93.0696 2.0E5 94.1422 2.3E3 95.0488 6.8E3 95.0853 6.6E4 96.7122 2.3E3 97.1009 7.9E3 98.0597 7.8E5 98.0651 3.3E3 99.8562 2.6E3 104.1290 2.3E3 104.9531 2.2E3 105.0696 6.9E4 105.3011 2.1E3 107.0853 4.5E4 107.6178 2.1E3 109.0644 2.5E3 109.1009 6.2E4 110.0600 1.1E4 119.0852 6.7E4 121.0650 8.6E3 121.1010 6.7E4 122.5804 2.5E3 123.0803 6.6E3 123.1166 4.4E4 128.4172 2.6E3 133.0644 1.7E4 133.0856 1.1E4 133.1011 3.0E4 135.1166 1.4E5 135.8992 2.3E3 137.0959 7.9E3 137.1322 2.2E4 140.0699 2.8E3 143.9669 2.7E3 144.7174 2.5E3 145.1015 2.9E3 147.0801 1.2E4 147.1165 1.6E5 148.0517 1.8E4 149.0605 2.7E3 149.6801 4.7E3 149.6917 6.5E3 150.0675 6.7E3 151.0748 3.1E3 151.6978 2.5E3 152.0703 3.2E4 154.0621 1.0E4 158.0431 2.5E3 161.1323 1.4E5 162.0673 1.0E4 163.0749 5.7E3 163.1121 2.0E4 164.0834 1.4E4 164.2655 2.5E3 165.0542 8.7E3 165.0911 2.6E3 166.0627 2.3E4 167.0712 2.9E3 169.0861 4.3E3 171.1167 8.6E3 173.5204 1.1E4 173.5337 1.4E5 173.5446 1.0E4 174.6382 2.8E3 175.0390 2.4E3 175.6407 2.5E3 176.0833 2.6E4 178.0613 3.4E3 180.0780 2.6E5 181.0858 1.2E6 181.1001 9.6E3 188.0828 3.8E3 189.0919 5.5E3 189.1275 1.2E5 190.0623 8.0E4 190.0990 1.6E4 191.0340 5.4E3 191.0698 8.7E3 192.0788 2.9E3 193.0860 5.0E4 194.0946 3.8E3 195.0655 9.3E4 195.1014 1.0E6 195.1310 3.6E3 202.0991 3.2E4 204.0780 4.4E4 204.1142 5.5E3 205.0858 3.1E4 206.0571 4.7E4 206.0934 2.7E4 206.4363 2.5E3 207.1017 1.1E5 208.0731 6.2E4 209.1170 2.8E4 215.1043 3.3E3 216.1153 6.9E3 218.0933 2.2E4 219.1016 2.1E5 219.1240 4.9E3 220.1085 3.9E3 221.0808 1.2E6 221.1180 1.1E5 223.0966 8.2E4 226.0978 2.6E3 226.2116 2.9E3 227.1077 3.3E3 228.1146 2.8E4 230.0925 8.0E3 231.1016 5.0E4 232.1094 1.8E4 233.0808 2.5E4 233.1171 1.1E5 235.0963 5.4E4 235.1321 1.7E4 239.1067 2.6E3 240.1133 1.8E4 241.1224 4.4E4 241.1503 2.0E3 242.0927 3.3E3 242.1303 2.2E4 244.1089 2.7E4 245.1170 1.4E5 246.1250 2.2E4 247.0980 1.5E4 247.1328 5.9E4 249.1482 5.9E3 255.1013 2.4E4 255.1371 1.3E4 256.1093 1.2E4 257.1172 1.8E4 258.0868 2.8E3 258.1246 2.9E4 259.1326 1.9E5 261.1132 9.6E3 261.1479 2.5E4 269.1167 5.9E3 269.1499 2.7E3 270.1256 7.1E3 271.1325 4.4E4 272.1406 2.6E4 273.1135 2.6E4 273.1486 1.4E5 275.1276 6.5E3 282.1606 6.3E3 283.1336 1.2E4 283.1688 8.7E3 284.1771 1.1E5 285.1496 3.7E3 285.1841 3.8E3 286.1556 4.3E3 287.1281 1.5E4 287.1638 1.6E4 289.1441 2.3E4 289.1797 2.1E4 297.1471 3.3E3 297.1844 4.0E3 298.1933 8.1E4 299.1653 3.9E3 300.1740 2.2E4 301.1428 3.3E4 308.1771 1.7E4 310.1534 3.1E3 313.1804 2.3E4 314.1875 1.1E4 315.1632 8.3E3 315.1958 4.1E5 315.2273 2.5E3 315.2379 4.5E3 326.1874 1.3E4 329.2115 1.5E5 339.1953 4.0E4 339.3181 2.5E3 357.2062 3.7E5 378.9836 2.4E3 409.9447 2.3E3 462.7778 2.4E3 END IONS BEGIN IONS FEATURE_ID=677 PEPMASS=499.3169 SCANS=677 RTINSECONDS=839.266 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 67.5651 2.6E3 69.0697 5.0E3 72.3859 2.8E3 74.8158 2.5E3 77.5068 2.5E3 80.3277 2.9E3 81.0697 4.5E4 83.0956 2.3E3 89.0593 2.2E3 89.4852 2.5E3 93.0697 2.6E4 95.0852 1.1E4 96.2289 2.5E3 98.0598 1.5E5 98.0673 2.9E3 98.3934 2.4E3 105.0699 5.7E3 106.7030 2.4E3 106.9640 2.4E3 109.1009 1.0E4 115.4995 2.6E3 119.0853 9.7E3 119.4889 2.4E3 121.1008 1.3E4 122.0416 2.2E3 123.1167 6.7E3 135.1165 2.3E4 137.1322 1.5E4 142.8746 3.0E3 143.2898 2.4E3 143.4144 2.3E3 147.1165 3.5E4 152.0701 1.6E4 161.1321 2.5E4 163.1120 6.0E3 173.5227 1.8E4 173.5399 3.7E4 180.0780 3.3E4 181.0859 2.1E5 189.1273 2.9E4 190.0631 4.1E3 193.0868 2.5E3 195.0673 9.3E3 195.1015 2.5E5 203.2995 2.2E3 204.0797 2.5E3 205.0853 3.3E3 207.1013 1.6E4 208.0731 1.3E4 209.1172 4.1E3 219.1016 4.5E4 221.0562 4.8E3 221.0809 4.0E5 221.1186 2.5E4 223.0967 2.4E4 226.5018 2.7E3 231.1006 5.9E3 233.1167 1.8E4 235.0969 6.8E3 235.1320 2.7E3 241.1228 3.7E3 243.6982 2.6E3 245.1170 2.2E4 247.0957 2.4E3 247.1324 8.0E3 257.1190 2.7E3 258.1270 3.2E3 259.1330 3.2E4 271.1339 7.3E3 273.1170 2.8E3 273.1490 2.5E4 282.1660 2.5E3 284.1776 1.3E4 289.1451 3.3E3 289.1803 5.2E3 298.1927 1.2E4 301.1425 6.4E3 313.1778 2.8E3 315.1958 1.2E5 326.1873 3.9E3 329.2111 5.3E4 339.1953 1.2E4 341.5254 2.8E3 357.2062 1.3E5 412.7347 6.6E3 419.2330 5.1E3 432.1989 2.7E3 458.9088 2.5E3 461.9738 2.3E3 END IONS BEGIN IONS FEATURE_ID=678 PEPMASS=623.2505 SCANS=678 RTINSECONDS=843.244 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 67.2463 3.6E3 67.2503 1.7E4 69.2515 2.5E3 88.4972 2.9E3 93.6152 2.3E3 120.9999 3.0E3 130.4391 2.3E3 131.2564 2.2E3 136.2994 3.1E3 136.3097 4.7E3 146.7394 3.0E3 148.9809 2.1E3 168.3394 2.2E3 173.5276 5.4E4 173.5428 1.7E4 188.6655 2.3E3 231.5667 2.6E3 273.1430 2.4E3 311.8321 2.3E3 315.7685 2.5E3 378.1457 2.4E3 407.2213 3.1E3 415.1869 2.7E3 421.2021 1.5E4 428.1999 3.5E3 430.2163 4.5E3 434.2115 4.4E3 435.2176 1.7E4 436.2254 1.0E4 437.5781 2.5E3 438.2099 2.5E3 443.2225 1.9E4 444.1953 3.4E4 445.2028 1.3E4 447.2223 3.9E3 457.1967 4.0E3 458.2102 1.7E4 461.2014 2.1E3 461.2362 3.6E3 462.2061 1.7E4 463.2124 1.9E4 471.2173 1.2E5 472.1833 5.7E3 472.1931 2.4E4 473.1981 1.6E5 474.2060 1.5E4 475.2116 2.4E4 480.2550 1.2E4 481.2056 2.9E3 483.2178 1.3E4 484.1855 3.1E3 485.1962 2.5E4 486.2049 4.5E4 487.2127 2.2E4 488.2181 8.7E3 489.2264 1.0E5 490.2062 3.2E4 490.2322 3.0E4 491.2107 4.6E4 492.2107 7.6E3 493.2239 3.0E3 499.1255 4.4E3 499.2129 7.7E5 500.1860 1.0E5 501.2265 1.4E5 502.1984 7.6E3 503.2081 4.8E4 504.2104 3.6E3 505.2203 6.5E3 507.2360 3.6E4 508.2461 5.2E4 511.2126 4.3E4 513.1923 7.0E4 514.2003 3.7E4 516.2142 2.9E4 517.2230 4.7E5 517.2904 2.1E3 518.2181 3.9E4 519.2332 1.3E4 521.2202 2.6E3 527.2079 1.7E5 528.2167 1.1E4 529.1301 4.2E3 529.2233 6.9E5 530.1936 7.4E3 531.2038 3.8E4 532.2139 1.4E4 533.2168 1.1E4 535.2332 1.4E5 536.2400 4.1E4 545.0241 1.6E4 545.2183 3.0E6 546.2245 9.2E3 547.2330 2.7E4 549.2432 4.4E3 555.2031 2.6E5 555.5806 2.6E3 562.2220 2.7E4 563.2296 8.0E4 564.2375 1.7E5 567.2612 3.5E3 573.2136 9.6E5 577.2448 9.3E4 591.2249 9.1E4 595.2558 6.6E4 605.2400 6.1E5 623.2504 1.8E5 END IONS BEGIN IONS FEATURE_ID=679 PEPMASS=375.2685 SCANS=679 RTINSECONDS=843.679 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 52.1644 2.2E3 52.2568 2.3E3 53.0021 1.7E4 53.0386 3.2E4 53.1471 2.2E3 55.0178 3.2E4 55.0514 3.7E3 55.0541 2.4E5 55.3683 2.3E3 57.0335 1.3E4 57.0698 5.9E4 57.3840 2.3E3 59.5976 3.1E3 62.6924 2.4E3 65.0386 2.5E4 66.0069 2.5E3 67.0541 4.0E5 67.0585 3.2E3 69.0334 3.3E4 69.0657 3.9E3 69.0698 2.5E5 69.4237 2.8E3 71.0490 3.3E4 74.3425 2.1E3 77.0387 3.2E4 79.0541 4.9E5 79.0596 5.8E3 80.0618 7.8E3 81.0335 1.4E4 81.0698 1.0E6 81.0746 4.2E3 83.0490 5.5E4 83.0854 7.3E4 85.0651 2.2E3 89.9632 2.5E3 90.4231 2.7E3 91.0541 5.3E5 91.0597 2.8E3 91.0608 6.1E3 92.1124 2.6E3 93.0698 1.5E6 93.0753 8.0E3 94.3963 2.6E3 95.0490 6.5E5 95.0548 2.8E3 95.0854 8.8E5 95.0914 4.5E3 96.3435 2.2E3 97.0582 3.8E3 97.0647 1.7E5 103.0541 3.4E4 104.1323 2.2E3 105.0446 3.0E4 105.0551 6.3E3 105.0698 1.5E6 105.0767 1.2E4 105.0867 2.8E3 106.0777 1.8E4 107.0491 2.2E4 107.0772 4.4E3 107.0855 9.6E5 107.0922 4.2E3 109.0647 2.0E5 109.1011 5.2E5 111.0804 3.2E3 115.0543 2.5E4 116.0621 1.8E4 117.0606 4.8E3 117.0698 2.5E5 117.0792 3.7E3 118.0778 1.1E4 119.0496 2.0E4 119.0597 7.6E3 119.0854 1.5E6 119.0937 2.2E3 119.0956 4.1E3 120.0934 1.2E4 121.0647 3.3E5 121.0747 4.9E3 121.0909 5.4E3 121.1011 1.3E6 123.0803 9.3E4 123.1167 1.0E5 127.4376 2.3E3 128.0621 7.3E4 129.0698 1.6E5 130.0777 8.5E4 131.0755 7.9E3 131.0855 8.2E5 132.0935 4.6E4 133.0646 3.5E4 133.0765 2.3E4 133.0891 8.4E3 133.1011 8.6E5 134.1096 6.2E3 135.0804 5.7E4 135.1168 2.7E5 136.3406 2.2E3 137.0962 6.9E3 141.0700 5.9E4 141.7601 2.5E3 142.0777 2.4E5 142.0903 3.4E3 143.0751 2.0E3 143.0855 5.3E5 144.0934 1.8E5 145.0649 3.3E4 145.0875 4.2E3 145.1011 1.3E6 145.1141 5.2E3 146.0730 2.2E4 146.1089 3.9E4 147.0805 6.8E4 147.1059 2.4E3 147.1168 4.0E5 149.0962 1.5E4 149.1327 2.6E4 153.0213 2.5E3 153.0702 1.5E4 154.0780 3.0E4 155.0855 1.7E5 156.0934 1.6E5 157.1012 8.3E5 157.1164 1.0E4 158.0727 1.5E4 158.1091 1.1E5 159.0806 7.0E4 159.1169 6.4E5 160.0881 1.7E4 160.1244 1.1E4 161.0962 1.9E5 161.1325 1.1E5 163.1121 6.6E3 165.0702 3.0E4 166.0777 1.8E4 167.0857 6.9E4 168.0935 5.7E4 169.1014 3.2E5 169.1178 8.4E3 170.1091 1.0E5 171.0814 9.7E3 171.1169 3.7E5 172.0885 1.6E4 172.1248 6.9E4 173.0962 5.2E4 173.1328 3.0E5 173.1500 8.6E3 173.5263 6.3E4 173.5426 1.7E4 174.1043 6.2E3 175.1119 3.2E4 175.1484 1.1E5 175.3797 2.8E3 178.0786 3.0E3 179.0858 8.4E4 180.0936 4.1E4 181.1014 1.6E5 182.1094 9.1E4 183.1171 2.6E5 184.1249 5.1E4 185.0960 2.1E4 185.1328 1.8E5 186.1404 3.3E4 187.1119 4.6E4 187.1485 1.6E5 191.0858 2.9E3 192.0937 3.2E4 193.1014 9.1E4 194.1093 8.6E4 195.1171 2.2E5 196.0900 2.6E3 196.1249 8.2E4 197.0981 1.3E4 197.1327 2.4E5 198.1404 3.6E4 199.1125 2.5E4 199.1484 1.1E5 200.1194 9.8E3 200.1558 1.2E4 201.1280 1.2E4 201.1638 3.4E4 205.1013 2.8E4 206.1094 4.7E4 207.1173 8.8E4 208.1248 4.5E4 208.1444 2.9E3 209.0988 6.0E3 209.1329 1.9E5 210.1407 6.8E4 211.1127 1.5E4 211.1485 1.3E5 212.1561 1.2E4 213.1280 1.3E4 213.1640 4.6E4 217.1004 3.0E3 218.1102 4.7E3 219.1169 2.8E4 220.1253 4.8E4 221.1329 7.8E4 222.1404 2.1E4 223.1487 1.0E5 224.1561 3.1E4 225.1267 5.7E3 225.1641 6.9E4 226.1710 3.3E3 227.1423 1.0E4 227.1804 1.1E4 231.1172 4.6E3 232.1245 5.0E3 233.1328 2.8E4 234.1402 1.4E4 235.1483 5.9E4 236.1556 1.3E4 237.1643 4.9E4 238.1726 9.7E3 239.1435 1.0E4 239.1802 3.4E4 240.1870 8.1E3 241.1952 6.4E3 245.1329 1.3E4 246.1406 1.3E4 247.1482 2.0E4 248.1545 3.0E3 249.1293 2.5E3 249.1637 2.9E4 250.1735 2.9E3 251.1798 7.7E4 252.1872 6.4E3 253.1592 1.8E4 253.1958 3.2E4 259.1478 6.9E3 261.1648 1.3E4 262.1711 6.2E3 263.1471 3.2E3 263.1792 2.1E4 264.1891 3.4E3 265.1952 2.0E4 266.2030 3.3E4 267.2089 3.2E3 271.1486 3.2E3 275.1784 4.2E3 277.1952 1.9E4 279.2100 1.5E4 281.1894 3.5E3 287.1807 5.9E3 291.2111 1.2E4 292.2181 3.0E3 301.1949 8.4E3 319.2070 1.2E4 347.2721 1.3E4 357.2583 1.4E4 375.2680 5.5E4 END IONS BEGIN IONS FEATURE_ID=680 PEPMASS=205.1954 SCANS=680 RTINSECONDS=843.782 CHARGE=1+ MSLEVEL=2 MERGED_STATS=8 / 14 (6 removed due to low quality, 0 removed due to low cosine). 41.0385 2.1E5 42.0337 3.7E4 43.0541 1.1E5 50.1853 2.3E3 50.8873 2.4E3 51.0231 1.3E4 51.2637 2.5E3 53.0021 2.4E3 53.0384 1.6E5 53.7908 2.7E3 54.0101 3.0E3 55.0541 2.2E6 55.0572 1.5E4 55.0587 1.3E4 55.0606 6.3E3 55.9343 2.3E4 57.0697 5.3E5 58.7343 3.1E3 60.1948 2.4E3 61.0484 2.3E3 65.0385 4.4E4 65.6119 2.1E3 67.0540 1.5E6 67.0585 6.2E3 67.3587 2.5E3 67.5395 2.4E3 67.7339 2.3E3 69.0697 3.3E6 69.0739 2.3E4 69.0764 1.9E4 69.2414 2.2E3 69.4580 2.6E3 70.5212 4.0E3 71.0853 1.1E5 71.3022 2.3E3 72.9369 2.4E5 73.0284 7.0E3 74.0317 2.7E3 75.0152 2.6E3 76.2644 2.4E3 77.0385 1.1E5 78.6846 2.6E3 79.0540 2.4E6 79.0620 1.1E4 79.0620 2.9E4 79.0651 5.0E3 80.0619 6.3E3 81.0696 9.8E6 81.0783 5.2E4 81.0787 2.4E5 81.0806 3.1E4 81.0840 1.3E4 82.8183 2.3E3 83.0852 6.2E5 83.7595 2.2E3 88.9574 2.5E3 88.9987 2.7E3 90.2377 4.6E3 90.9474 1.6E5 91.0540 1.1E6 91.0603 5.2E3 92.0615 4.6E3 93.0620 1.5E4 93.0696 1.2E7 93.0801 5.2E4 93.0812 2.5E5 93.0832 3.9E4 93.0914 6.9E3 95.0425 6.5E3 95.0489 3.1E5 95.0853 3.1E6 95.0919 1.4E4 96.3598 4.5E3 97.1009 3.3E5 99.9476 2.7E4 103.0540 3.6E4 103.6269 2.6E3 105.0445 9.7E4 105.0615 8.2E3 105.0696 9.4E5 105.0768 4.0E3 105.0783 1.0E4 106.0774 5.7E4 107.0853 4.5E6 107.0932 2.3E4 107.1019 7.8E3 108.0648 2.7E3 108.9585 2.8E3 109.0646 1.1E5 109.0927 9.7E3 109.1009 1.8E6 109.1086 5.2E3 111.1166 6.2E4 113.9548 6.7E3 113.9634 4.6E5 117.6129 2.5E3 119.0603 4.2E4 119.0768 6.1E3 119.0853 2.1E5 120.0940 2.7E3 121.0280 3.2E3 121.0899 4.0E4 121.1009 1.5E7 121.1097 2.5E5 121.1190 1.3E5 121.1213 4.1E4 121.1333 1.5E4 123.0802 4.0E5 123.1069 8.6E3 123.1166 8.1E5 128.3780 2.5E3 131.9741 6.0E4 133.0759 5.5E4 133.1014 2.2E4 135.1056 9.5E3 135.1166 1.2E6 135.1267 1.3E4 135.6358 2.4E3 136.4553 4.3E3 137.1323 8.7E4 139.0779 2.3E3 143.6599 4.9E3 147.1168 3.9E4 149.0230 1.8E4 149.1185 3.2E3 149.1323 2.2E6 149.1451 2.1E4 154.9891 3.3E3 161.1330 8.6E3 162.1409 3.1E3 163.1480 1.8E5 168.1870 2.3E3 173.5260 3.5E4 173.5382 7.0E4 192.3981 2.5E3 205.1417 2.6E3 205.1609 2.6E3 205.1954 6.5E4 211.3511 2.5E3 END IONS BEGIN IONS FEATURE_ID=681 PEPMASS=618.4278 SCANS=681 RTINSECONDS=843.848 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 3 (1 removed due to low quality, 0 removed due to low cosine). 67.0539 3.6E3 67.5871 2.5E3 69.0696 4.6E3 69.4075 2.3E3 79.0539 3.9E3 81.0696 2.5E4 83.0490 4.3E3 83.0805 3.7E3 83.0852 5.5E4 85.0646 4.8E3 93.0695 2.4E4 94.0012 2.4E3 95.0489 1.3E4 95.0852 2.1E4 97.0645 1.0E4 105.0695 2.1E4 107.0851 3.4E4 109.0644 7.1E3 109.1009 1.4E4 111.0802 6.4E3 113.0958 4.6E3 117.0689 3.0E3 119.0852 4.1E4 119.3217 2.8E3 120.0934 3.3E3 121.1008 3.1E4 123.0801 1.7E4 125.0595 5.9E3 125.0958 1.4E4 129.0699 3.4E3 131.0853 1.7E4 132.0928 4.3E3 133.1010 3.2E4 135.0802 1.1E4 135.1164 9.2E3 137.0958 8.2E3 139.0752 2.7E3 139.1108 1.1E4 143.0853 1.9E4 144.0928 1.4E4 145.1009 5.0E4 146.1069 3.7E3 147.0804 1.7E4 147.1166 1.8E4 149.0958 1.2E4 149.1328 2.7E3 151.0751 1.3E4 153.0910 3.0E3 155.1063 5.9E3 156.0934 4.9E3 157.1008 4.5E4 158.1085 7.9E3 159.1168 4.1E4 160.0879 1.8E4 160.1238 3.2E3 161.0959 1.5E4 161.1326 6.4E3 163.1114 2.6E4 165.0909 6.5E4 167.1073 4.9E3 169.1011 1.6E4 170.1085 5.1E3 171.1167 3.5E4 172.1241 1.4E4 173.0961 6.9E3 173.1323 1.4E4 173.5327 4.3E4 175.1118 9.4E3 175.1485 3.1E3 176.1183 2.9E3 177.0910 4.3E3 177.1275 3.4E3 178.0980 3.8E3 179.1065 3.9E3 180.1150 3.1E3 181.1055 4.0E3 181.1222 3.3E4 183.1167 1.6E4 183.1357 2.7E3 185.1325 2.3E4 187.1119 8.4E3 187.1481 1.6E4 189.1269 1.4E4 190.1349 1.7E4 191.1070 5.6E3 191.1429 5.6E3 193.1221 1.2E4 195.0984 2.5E3 195.1166 1.6E4 195.1369 5.5E3 196.1248 4.7E3 197.1325 2.3E4 198.1377 2.4E3 199.1117 7.5E3 199.1476 7.4E3 201.1271 6.8E3 203.1432 3.7E4 207.1173 4.6E3 207.1386 2.2E4 208.1253 2.5E3 208.1457 1.5E4 209.1326 2.1E4 209.1525 3.5E3 211.1115 4.2E3 211.1482 1.7E4 213.1270 7.6E3 213.1642 4.5E3 215.1433 6.4E3 219.1381 1.2E4 221.1325 7.9E3 221.1538 1.1E5 223.1481 8.2E3 225.1271 4.3E3 225.1475 1.1E4 227.1433 3.4E3 227.1798 6.4E3 229.1593 4.7E3 231.1382 8.2E3 233.1537 2.2E4 234.1616 1.6E4 235.1466 4.9E3 237.1290 2.8E3 237.1634 9.2E3 239.1438 4.1E3 239.1804 4.3E3 241.1604 2.7E3 245.1553 4.1E3 246.1624 6.1E3 247.1696 1.9E4 249.1631 3.0E3 251.1791 3.6E3 253.1589 5.1E3 255.1732 3.9E3 259.1702 6.5E3 261.1869 4.4E3 269.1558 4.3E3 269.1899 5.3E3 271.1705 7.4E3 273.1849 1.1E4 274.1933 6.6E3 281.1896 3.6E3 283.1690 4.0E3 285.1862 5.2E3 286.1931 1.9E4 287.2011 1.3E5 299.2014 1.7E4 300.2081 3.6E3 303.1952 3.0E3 305.1916 3.7E3 310.1918 4.1E3 311.2007 3.2E3 312.2082 9.4E3 313.2170 1.4E4 319.2075 7.9E3 325.2173 1.4E4 329.2123 2.4E3 337.2162 1.5E4 339.2321 1.1E4 347.2383 2.6E3 352.2402 6.1E4 353.2479 1.2E4 365.2479 2.7E4 367.2616 5.8E3 395.2589 1.9E4 435.5926 2.9E3 438.3163 2.6E3 480.3242 6.7E3 525.3581 7.6E3 526.3642 4.7E3 531.4224 2.8E3 538.3661 3.1E4 618.4241 2.8E3 END IONS BEGIN IONS FEATURE_ID=682 PEPMASS=392.2715 SCANS=682 RTINSECONDS=844.036 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 2 (0 removed due to low quality, 0 removed due to low cosine). 55.0540 1.4E4 57.0696 2.2E4 67.0539 1.9E4 69.0333 6.6E3 69.0696 2.0E4 71.0853 1.1E4 79.0543 3.9E4 80.0617 2.0E4 81.0332 4.9E3 81.0654 2.9E3 81.0696 6.9E4 82.0409 7.9E3 83.0489 1.2E4 83.0853 6.8E3 85.0645 7.4E3 89.0594 2.9E3 91.0539 4.4E4 92.0620 1.1E4 93.0638 2.9E3 93.0693 1.0E5 95.0488 7.7E4 95.0853 4.6E4 96.0563 3.1E3 97.0649 7.2E3 105.0695 1.6E5 106.0774 2.5E4 107.0491 6.9E3 107.0852 8.3E4 108.0567 1.6E4 109.0644 2.7E4 109.1008 2.6E4 117.0695 4.0E4 118.0772 2.9E3 119.0489 6.6E3 119.0852 1.8E5 120.0561 2.9E3 120.0930 4.0E4 121.0565 2.4E3 121.0646 3.1E4 121.1009 4.9E4 123.0802 2.7E4 123.1165 5.9E3 125.8053 2.4E3 128.0620 9.9E3 129.0696 3.1E4 130.0773 1.0E4 131.0748 4.0E3 131.0852 1.1E5 132.0930 3.4E4 133.0646 1.6E4 133.1009 1.2E5 134.1090 1.1E4 134.2730 2.4E3 135.0803 2.0E4 135.1164 2.1E4 135.9602 2.8E3 137.0961 3.8E3 141.0697 7.7E3 142.0774 1.8E4 143.0852 1.1E5 144.0931 3.4E4 145.0645 1.1E4 145.1009 2.2E5 145.1143 9.8E3 146.1089 9.1E3 147.0803 2.8E4 147.1165 4.2E4 149.0230 7.2E4 149.0959 4.2E3 149.1328 2.3E3 150.0265 3.6E4 154.8947 2.7E3 155.0852 2.8E4 156.0931 2.4E4 157.1009 1.2E5 158.1088 2.6E4 159.0803 2.6E4 159.1165 1.0E5 160.0865 2.6E3 160.1239 6.7E3 161.0959 2.3E4 161.1322 1.5E4 163.1123 5.1E3 164.9571 2.5E3 167.0855 1.1E4 168.0928 3.4E3 169.1010 4.9E4 170.1088 1.4E4 171.0807 1.1E4 171.1167 8.9E4 172.1241 1.1E4 173.0961 2.4E4 173.1325 5.9E4 173.5268 2.9E4 173.5454 4.3E3 175.1117 1.1E4 175.1481 2.4E4 177.1272 1.2E4 179.0853 6.8E3 181.1009 2.6E4 182.1087 1.2E4 183.1167 5.2E4 184.1243 6.3E3 185.0960 6.7E3 185.1324 3.5E4 186.1038 7.5E3 187.1118 4.1E3 187.1482 1.6E4 189.1275 1.0E4 191.1428 9.6E3 193.1012 1.2E4 194.1092 1.0E4 195.1166 3.7E4 196.1244 9.1E3 197.0969 3.3E3 197.1325 5.3E4 198.1399 3.4E3 199.1126 1.0E4 199.1483 1.8E4 201.1277 9.4E3 201.1634 3.8E3 203.1442 2.8E3 206.1083 3.0E3 207.1166 1.5E4 208.1241 7.9E3 209.1328 2.5E4 210.1402 7.6E3 211.1483 2.7E4 211.1681 2.7E3 213.1284 6.5E3 213.1651 3.4E3 215.1423 6.0E3 217.1583 3.0E3 221.1324 1.7E4 223.1483 1.6E4 224.1569 2.6E3 225.1266 5.8E3 225.1637 1.6E4 233.1327 5.8E3 235.1489 9.5E3 237.1641 1.0E4 239.1427 4.1E3 239.1789 1.2E4 249.1650 8.6E3 251.1787 8.1E3 255.1740 2.8E3 257.1894 3.9E3 261.1649 2.3E3 263.1780 4.9E3 296.3436 2.7E3 END IONS BEGIN IONS FEATURE_ID=683 PEPMASS=393.2789 SCANS=683 RTINSECONDS=844.342 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 53.0020 8.1E3 53.0384 6.6E3 55.0177 9.7E3 55.0540 9.9E4 55.9365 2.2E3 57.0333 3.8E3 57.0696 5.3E4 59.0488 7.7E3 62.5571 2.1E3 62.5987 2.4E3 63.6694 2.3E3 65.0383 5.3E3 66.6364 2.1E3 67.0539 1.4E5 67.6552 2.5E3 69.0332 2.1E4 69.0695 1.3E5 71.0488 1.5E4 71.0853 3.5E3 74.4209 2.2E3 75.3958 2.2E3 77.0384 1.5E4 77.5103 2.4E3 77.7746 2.3E3 79.0539 1.7E5 80.0619 3.1E3 81.0336 5.0E3 81.0695 4.4E5 81.0777 3.4E3 83.0489 3.3E4 83.0851 5.4E4 84.9962 2.2E3 85.0645 2.9E4 85.1005 2.3E3 91.0539 1.8E5 93.0695 5.5E5 93.0764 6.3E3 95.0487 3.4E5 95.0555 3.7E3 95.0852 4.1E5 95.0921 4.0E3 96.0522 4.5E3 96.0885 3.0E3 97.0583 4.5E3 97.0644 7.6E4 97.1011 4.8E3 99.0806 4.2E3 103.0540 4.4E3 104.9334 2.4E3 105.0442 8.5E3 105.0695 4.9E5 105.0783 6.3E3 106.0780 4.5E3 107.0487 1.2E4 107.0851 4.0E5 108.0560 3.2E3 109.0644 1.2E5 109.1008 2.0E5 109.7637 2.9E3 111.0803 1.5E4 113.0956 2.7E3 115.0542 7.1E3 117.0609 3.0E3 117.0695 1.0E5 119.0488 1.1E4 119.0591 3.2E3 119.0755 2.7E3 119.0852 6.1E5 119.0946 6.8E3 120.0925 1.4E4 121.0645 1.6E5 121.1008 3.1E5 123.0801 3.8E4 123.1069 3.0E3 123.1165 7.0E4 123.5477 2.4E3 125.0960 2.7E3 128.0618 2.8E4 129.0696 6.3E4 130.0773 2.6E4 131.0852 2.8E5 132.0919 1.6E4 133.0643 1.8E4 133.1009 4.1E5 133.1109 4.3E3 134.1047 5.2E3 135.0802 4.1E4 135.1165 1.4E5 137.0960 1.6E4 139.1117 5.4E3 141.0696 2.3E4 142.0774 9.6E4 143.0852 2.3E5 144.0927 6.3E4 145.0645 1.4E4 145.1009 5.2E5 145.1134 1.2E4 146.0721 9.6E3 146.1060 2.5E4 147.0801 3.2E4 147.1165 1.8E5 148.1201 3.1E3 149.0227 4.8E3 149.0958 3.1E4 149.1322 1.4E4 150.0261 3.1E3 151.0286 2.7E3 151.1111 3.7E3 153.0692 4.0E3 154.0774 1.1E4 155.0852 7.1E4 155.4413 2.4E3 156.0930 6.6E4 157.1009 4.0E5 157.1133 2.9E3 157.1168 4.6E3 158.0718 3.3E3 158.1080 5.0E4 159.0801 3.6E4 159.1024 4.1E3 159.1166 3.6E5 159.1295 3.4E3 160.0879 5.3E3 160.1223 1.6E4 161.0959 1.3E5 161.1322 6.0E4 163.1116 2.2E4 163.1474 1.0E4 165.0696 7.9E3 166.0769 3.2E3 167.0851 2.8E4 168.0931 2.7E4 169.1011 1.6E5 170.1085 5.1E4 171.0810 6.1E3 171.1167 1.9E5 172.0879 4.8E3 172.1238 4.6E4 173.0959 2.7E4 173.1324 1.9E5 173.1499 3.8E3 173.5223 1.1E4 173.5365 7.0E4 174.1025 3.7E3 174.1376 1.1E4 175.1117 3.0E4 175.1309 4.8E3 175.1481 9.5E4 177.1274 6.3E3 179.0857 3.4E4 180.0932 1.4E4 181.1011 6.6E4 182.1087 3.8E4 183.1167 1.3E5 184.1237 2.8E4 185.0959 9.2E3 185.1324 1.0E5 186.1398 2.6E4 187.1115 3.7E4 187.1480 6.7E4 189.1273 5.0E3 191.1431 6.9E3 192.0938 1.2E4 193.1009 3.6E4 194.1089 4.2E4 195.1167 8.6E4 196.1241 4.2E4 197.0962 5.4E3 197.1324 1.1E5 198.1392 2.2E4 199.1120 8.2E3 199.1478 5.6E4 200.1194 3.5E3 200.1562 6.2E3 201.1273 1.0E4 201.1638 3.7E4 203.1424 4.7E3 205.1012 7.8E3 205.1576 3.9E3 206.1092 1.7E4 207.1169 4.4E4 208.1239 2.0E4 209.1324 9.4E4 210.1396 3.1E4 211.1125 6.6E3 211.1482 7.2E4 212.1199 2.9E3 212.1550 7.6E3 213.1278 4.7E3 213.1636 3.1E4 215.1427 5.4E3 219.1170 6.1E3 220.1246 2.1E4 221.1325 3.1E4 222.1397 1.4E4 223.1119 2.8E3 223.1482 4.5E4 224.1552 1.6E4 225.1285 4.7E3 225.1639 2.9E4 226.1708 7.4E3 227.1430 7.3E3 227.1794 4.7E3 229.1593 3.2E3 233.1328 9.6E3 234.1389 4.6E3 235.1481 2.7E4 236.1554 6.5E3 237.1640 2.1E4 239.1440 3.9E3 239.1791 1.3E4 240.1850 5.0E3 241.1599 6.7E3 241.1944 8.2E3 245.1313 2.8E3 247.1482 8.2E3 248.1540 2.9E3 249.1651 6.4E3 251.1797 1.9E4 253.1586 6.9E3 253.1950 6.4E3 255.1749 5.1E3 257.1895 5.4E3 261.1632 3.0E3 263.1801 6.3E3 265.1946 9.6E3 266.2035 3.4E3 267.2117 3.4E3 269.1893 3.4E3 273.1638 3.1E3 275.1808 4.2E3 277.1954 3.9E3 281.1901 4.1E3 283.2058 3.1E3 293.1881 2.8E3 383.8691 2.4E3 END IONS BEGIN IONS FEATURE_ID=684 PEPMASS=476.2411 SCANS=684 RTINSECONDS=845.313 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 66.8970 2.3E3 67.1135 2.5E3 69.9864 2.2E3 89.0596 2.7E3 106.6238 2.3E3 109.6747 2.5E3 109.8250 2.1E3 117.0588 2.3E3 120.0415 2.8E3 134.0706 2.5E3 139.1069 2.4E3 149.6842 2.6E3 149.6950 3.0E3 162.7295 2.6E3 170.9719 2.8E3 173.3020 2.2E3 173.5252 2.9E4 173.5404 2.2E4 174.0522 2.8E4 190.3351 2.5E3 214.0840 5.4E3 218.2737 2.2E3 229.1069 8.3E3 251.0470 2.9E3 307.6172 2.6E3 315.8574 2.8E3 325.0912 4.3E3 340.0684 4.1E3 340.1152 6.3E5 346.3194 2.8E3 376.7904 2.8E3 377.3887 2.2E3 379.1877 2.6E3 431.1347 2.3E3 438.8030 3.5E3 476.2409 4.6E4 484.0560 2.5E3 END IONS BEGIN IONS FEATURE_ID=685 PEPMASS=303.1959 SCANS=685 RTINSECONDS=845.5 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 50.9828 2.2E3 58.7907 2.6E3 61.9734 2.6E3 62.0917 3.0E3 62.9631 2.3E3 67.0538 3.7E3 68.3881 2.2E3 69.0695 1.6E4 70.9396 2.4E3 71.0125 1.1E4 79.0538 4.5E4 81.0695 1.3E4 83.0852 2.6E3 89.1977 2.2E3 90.8246 2.5E3 91.0541 4.5E3 92.3051 2.4E3 92.5402 2.6E3 93.0696 2.2E4 95.0493 3.5E3 95.0850 2.3E3 97.0652 2.2E3 97.3964 2.2E3 100.6582 2.4E3 107.0852 2.0E4 109.1011 6.9E3 115.9222 3.0E3 121.1007 9.1E3 133.1015 5.0E3 135.1167 8.0E3 136.0515 9.9E3 143.0861 2.8E3 148.0510 2.8E3 151.0752 2.3E4 154.0613 4.4E3 159.0798 3.2E3 166.0476 2.6E3 166.0623 9.9E4 167.0707 4.4E3 173.5207 6.2E3 173.5370 4.9E4 175.0752 2.9E3 177.1634 2.8E3 181.0858 1.7E5 182.8212 2.5E3 188.0857 2.2E3 189.0925 4.0E3 190.0992 9.4E3 197.2125 2.6E3 202.0987 1.4E4 205.0867 2.7E3 206.0942 3.0E3 207.0994 3.0E3 212.1828 2.5E3 213.0912 1.9E4 215.1077 2.6E3 216.1138 2.7E3 219.1013 2.1E4 229.1221 6.0E4 232.1089 3.0E3 233.1171 2.5E3 245.1170 1.1E4 260.0374 2.6E3 272.1773 6.7E3 287.1759 2.4E3 END IONS BEGIN IONS FEATURE_ID=686 PEPMASS=454.2591 SCANS=686 RTINSECONDS=845.5 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 59.9096 2.3E3 67.0542 7.6E3 67.2911 2.6E3 69.0699 6.7E3 71.6314 2.6E3 74.9586 2.8E3 75.3826 2.4E3 77.4459 3.0E3 79.0543 2.3E3 79.6846 2.2E3 81.0333 6.5E3 81.0696 1.1E4 86.2267 2.3E3 89.0595 1.4E4 91.0537 2.5E3 93.0699 4.7E3 98.0598 6.2E5 98.0663 5.6E3 105.0697 3.6E3 109.1012 8.5E3 110.0519 3.3E3 110.0598 1.4E5 119.0855 5.5E3 119.7897 2.7E3 121.1010 5.6E3 122.0172 2.4E3 123.1163 9.5E3 129.0694 6.9E3 133.0646 3.1E4 133.0854 4.1E3 133.1005 7.0E3 135.1167 6.8E3 136.0764 3.1E3 141.8498 2.5E3 146.8319 2.3E3 147.0801 1.4E4 147.1165 2.0E4 152.0704 2.9E5 152.0846 7.0E3 161.1319 5.8E3 166.0626 1.5E4 173.5291 6.3E4 173.5458 8.7E3 175.0746 4.4E3 176.0835 8.9E3 180.0775 2.9E3 181.0859 3.2E5 189.1273 2.0E4 190.0631 4.1E3 193.0849 3.9E3 195.0647 1.1E4 195.1018 7.4E3 203.0706 8.2E3 204.0781 1.7E4 205.0854 3.8E3 207.1018 4.6E4 219.1021 2.6E4 220.0732 8.1E3 221.0809 1.0E5 221.1174 3.4E3 221.3599 2.5E3 231.1016 2.1E4 233.1171 1.9E4 235.0966 1.1E5 237.4292 2.5E3 245.1173 1.7E4 247.1320 7.1E3 255.1020 2.5E3 257.1175 7.2E3 259.1324 1.3E4 261.1128 8.0E3 265.1205 2.6E3 270.1263 2.8E3 272.1756 2.8E3 273.1122 1.8E4 273.1452 5.2E3 275.1284 7.5E3 282.1239 2.4E3 283.1346 8.0E3 283.1690 3.0E3 284.1420 3.2E3 284.1762 1.5E4 297.1501 1.1E4 299.1280 2.6E4 299.1619 2.5E3 301.1432 2.4E4 301.1779 3.2E3 303.1965 4.6E3 308.1790 1.1E4 313.1803 3.0E4 315.1958 4.1E4 324.1762 3.9E3 326.1864 4.9E3 329.1730 4.2E3 329.2126 1.4E4 339.1959 3.3E4 342.1802 6.4E3 357.2062 1.7E5 357.2566 3.5E3 395.5511 2.7E3 398.1632 2.7E3 430.4445 2.4E3 END IONS BEGIN IONS FEATURE_ID=687 PEPMASS=499.3170 SCANS=687 RTINSECONDS=845.54 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 61.5523 2.3E3 65.9348 2.2E3 76.8855 2.3E3 78.0602 2.9E3 79.0542 4.7E3 81.0691 2.7E3 89.0595 2.8E3 90.9769 2.9E3 93.2521 2.6E3 95.0852 2.8E3 98.0598 6.0E5 98.0663 3.5E3 110.0598 1.9E5 110.0686 3.4E3 112.5304 2.1E3 114.5759 2.1E3 118.9954 2.3E3 123.3609 2.5E3 126.4658 2.8E3 130.5458 2.3E3 133.0649 5.4E3 135.1164 5.8E3 147.0809 2.5E3 152.0411 3.0E3 152.0560 7.8E3 152.0705 9.2E5 152.0870 9.6E3 153.8664 2.3E3 160.4927 2.7E3 163.1115 2.7E3 166.0635 2.5E3 173.5286 7.9E4 173.5450 8.4E3 181.0860 1.4E5 189.1279 4.8E3 193.8790 2.3E3 195.1021 3.0E3 207.1017 1.2E4 219.1018 6.0E3 221.0813 1.3E5 235.0970 6.2E4 236.2125 2.6E3 247.1326 1.1E4 248.2304 2.5E3 266.1290 2.3E3 272.1772 3.4E3 273.0318 2.1E3 273.1454 2.7E3 276.6520 2.7E3 299.1703 3.4E3 301.1443 7.9E3 303.1967 6.2E4 315.1956 1.5E4 338.6264 2.4E3 339.1964 7.4E3 340.2403 2.5E3 342.1862 3.1E3 357.2072 9.9E4 391.3955 2.5E3 392.9274 2.7E3 400.8572 2.5E3 474.1994 2.8E3 499.3887 2.6E3 END IONS BEGIN IONS FEATURE_ID=688 PEPMASS=842.5624 SCANS=688 RTINSECONDS=847.268 CHARGE=1+ MSLEVEL=2 MERGED_STATS=13 / 13 (0 removed due to low quality, 0 removed due to low cosine). 73.4439 2.7E3 73.7584 2.4E3 75.1002 2.6E3 75.7542 2.1E3 79.0538 1.6E5 79.3764 2.5E3 81.0127 2.7E3 81.0695 4.3E5 83.0488 1.2E4 83.0852 1.1E5 83.1182 2.6E3 83.5694 2.3E3 85.0646 1.6E4 85.0820 2.7E3 87.2620 2.4E3 88.8049 2.5E3 91.0538 1.1E5 91.1574 2.4E3 93.0695 2.7E5 95.0490 8.8E3 95.0793 3.7E3 95.0851 3.5E5 96.3873 2.4E3 97.0403 3.3E3 97.0644 5.5E4 97.1009 4.7E4 99.0800 1.7E4 99.9275 2.4E3 101.1829 2.2E3 104.9112 2.6E3 105.0695 1.2E5 106.9382 2.8E3 107.0488 4.7E3 107.0851 2.5E5 107.5882 2.6E3 109.0644 2.6E4 109.0930 3.0E3 109.1007 3.7E5 109.8559 2.1E3 110.1334 2.4E3 111.0801 4.4E4 112.9736 2.7E3 117.0695 5.5E4 117.6403 2.5E3 119.0851 1.5E5 119.0934 2.5E3 121.0644 2.9E3 121.0924 2.9E3 121.1007 2.5E5 123.0800 8.6E3 123.1163 9.3E4 125.0957 6.0E4 127.1646 2.9E3 128.6585 2.5E3 129.0699 3.5E3 130.7999 2.4E3 131.0851 1.2E5 133.1007 2.0E5 135.0802 1.4E4 135.1164 2.0E5 135.1274 2.9E3 136.2472 2.4E3 137.0958 2.8E4 137.1324 7.0E3 139.1114 3.2E3 145.1007 1.3E5 147.1164 1.6E5 149.0958 5.7E4 149.1321 2.1E5 151.1113 1.2E4 155.1062 8.2E4 157.1008 1.4E4 159.1164 1.6E5 161.0965 2.4E3 161.1321 9.0E4 163.1116 3.7E4 163.1478 4.2E4 165.1271 1.6E4 166.9180 2.4E3 169.1009 2.5E3 171.1010 4.3E3 171.1164 1.9E4 173.1168 5.9E4 173.1325 9.2E4 173.5195 6.2E3 173.5279 2.4E5 173.5316 1.1E4 173.5420 9.4E4 174.1595 2.5E3 175.1112 2.4E3 175.1479 2.4E4 176.2081 2.5E3 177.1273 3.8E4 177.1644 2.7E3 179.1443 2.8E3 179.9915 2.5E3 183.1161 3.7E3 184.0741 3.2E3 184.2144 2.4E3 185.1330 3.3E3 187.1128 2.6E3 187.1482 3.7E4 188.0118 2.7E3 189.1115 8.1E3 190.1911 2.3E3 191.6558 2.9E3 194.9013 2.7E3 195.1376 5.7E4 197.1316 7.9E3 198.4792 2.3E3 201.1265 3.0E3 201.1633 5.9E3 204.3204 2.5E3 204.3584 2.6E3 211.0924 2.8E3 215.1399 3.0E3 219.1746 3.2E3 220.0951 2.4E3 223.2844 2.5E3 227.1279 5.7E4 229.1433 2.5E5 229.1949 1.3E4 239.1791 2.0E4 242.5318 2.3E3 243.2105 3.9E4 247.2054 7.1E3 248.1956 2.5E3 257.1895 6.8E4 257.4979 2.5E3 258.8700 3.0E3 259.2054 9.6E3 261.2209 1.8E5 269.1746 1.9E5 272.6107 2.3E3 273.1416 2.7E3 275.2005 3.3E5 293.2100 1.5E4 297.4712 2.6E3 302.4374 2.3E3 308.7344 2.4E3 313.2705 2.8E3 317.2467 7.0E3 335.2581 1.1E6 335.3028 5.6E3 349.2369 6.4E4 352.1903 3.0E3 360.9992 2.5E3 367.2483 3.3E4 380.9159 2.3E3 383.7863 2.9E3 394.5757 2.6E3 401.2682 3.0E3 412.5858 2.4E3 419.7035 2.8E3 419.7638 2.7E3 427.0540 2.6E3 429.2946 2.8E3 466.7544 2.4E3 469.2999 2.5E3 475.6265 2.4E3 489.3578 9.5E4 505.9389 2.6E3 511.2623 2.7E3 512.5786 2.4E3 513.2507 2.6E3 514.8116 2.9E3 526.9104 2.5E3 529.3886 2.0E5 533.2722 8.0E3 534.2753 1.9E4 546.7482 2.4E3 549.2696 6.4E3 550.2693 1.3E4 569.4140 2.8E3 592.9767 2.7E3 600.2050 3.2E3 609.1868 2.3E3 609.4536 2.2E4 614.2218 2.3E3 627.4531 2.4E3 640.5194 3.1E3 678.1052 2.4E3 695.6945 3.1E3 734.5626 2.5E3 737.4755 2.7E3 746.8295 2.7E3 827.1888 3.2E3 842.4719 4.7E4 846.9481 3.0E3 END IONS BEGIN IONS FEATURE_ID=689 PEPMASS=618.4279 SCANS=689 RTINSECONDS=850.103 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 64.7701 2.4E3 66.0561 2.3E3 67.0542 1.5E4 69.0332 3.1E3 69.0696 1.1E4 71.0490 3.5E3 71.8984 2.3E3 71.9202 2.9E3 76.3193 2.3E3 79.0540 1.7E4 79.4593 2.4E3 81.0696 6.3E4 83.0489 1.3E4 83.0805 3.5E3 83.0853 1.2E5 85.0646 6.3E3 86.9993 2.2E3 91.0542 1.2E4 93.0696 5.0E4 95.0488 3.2E4 95.0852 5.1E4 97.0645 3.4E4 99.0441 5.9E3 101.6014 2.5E3 105.0695 5.4E4 106.0779 2.9E3 107.0852 7.7E4 109.0645 2.7E4 109.1009 3.4E4 111.0801 4.5E3 112.5788 2.4E3 113.0591 2.7E3 113.0958 2.5E4 117.0697 5.9E3 119.0852 1.0E5 120.0929 1.2E4 121.0649 7.4E3 121.0767 2.6E3 121.1009 7.4E4 123.0801 4.6E4 123.1162 6.4E3 125.0593 1.5E4 125.0958 3.1E4 129.0694 4.1E3 131.0853 4.6E4 132.0931 5.7E3 133.1010 7.1E4 133.6221 2.8E3 135.0802 2.6E4 135.1166 3.2E4 137.0961 2.3E4 139.0753 9.0E3 139.1113 2.9E4 142.0779 2.6E3 143.0853 3.7E4 144.0931 2.8E4 145.1009 1.3E5 146.1087 1.1E4 147.0801 4.1E4 147.1166 3.6E4 149.0960 2.9E4 151.0750 3.5E4 153.0909 5.7E3 155.0852 8.0E3 155.1064 1.9E4 156.0935 6.3E3 157.1010 1.0E5 158.1085 2.7E4 159.0805 1.3E4 159.1166 7.1E4 160.0881 4.9E4 161.0960 2.7E4 161.1325 2.1E4 163.1116 5.1E4 165.0909 1.5E5 165.1269 1.0E4 167.1068 1.4E4 169.1009 3.3E4 170.1086 1.2E4 171.1021 7.4E3 171.1169 7.7E4 172.1243 3.0E4 173.0964 1.7E4 173.1325 4.3E4 173.5310 9.3E4 173.5442 9.9E3 175.1117 3.1E4 175.1477 7.7E3 177.0916 9.6E3 177.1272 7.3E3 178.0988 3.2E3 179.1054 2.8E3 179.1432 1.2E4 180.1153 2.7E3 181.1035 1.2E4 181.1222 7.3E4 182.1098 2.6E3 182.1267 3.0E3 183.1166 4.4E4 183.1351 1.1E4 184.1244 1.0E4 185.0955 6.7E3 185.1323 5.5E4 187.1117 2.5E4 187.1481 3.3E4 189.1273 3.5E4 190.1351 4.6E4 191.1069 8.2E3 191.1428 2.0E4 193.1037 3.5E3 193.1222 3.0E4 195.1167 3.3E4 195.1364 1.5E4 196.1234 5.7E3 197.0963 3.6E3 197.1325 5.6E4 198.1387 4.0E3 199.1114 1.5E4 199.1483 2.3E4 201.1272 1.7E4 203.1431 8.3E4 207.1178 9.9E3 207.1380 4.5E4 208.1263 3.0E3 208.1459 3.5E4 209.1324 4.5E4 209.1524 1.2E4 210.1387 6.1E3 211.1126 9.2E3 211.1483 3.5E4 213.1272 1.4E4 213.1637 1.2E4 215.1433 1.5E4 216.1504 8.4E3 217.1587 2.7E3 219.1382 2.4E4 221.1322 1.6E4 221.1537 2.4E5 222.1561 3.6E3 223.1479 2.8E4 224.1551 3.1E3 225.1269 8.0E3 225.1485 3.4E4 227.1431 8.4E3 227.1798 1.6E4 229.1591 1.3E4 231.1380 2.6E4 233.1537 6.2E4 234.1613 5.4E4 235.1476 1.3E4 235.1712 2.8E3 237.1275 4.7E3 237.1642 1.5E4 239.1431 6.8E3 239.1796 8.3E3 241.1582 5.9E3 241.1943 2.8E3 243.1374 7.9E3 245.1535 1.3E4 246.1610 9.6E3 247.1467 2.6E3 247.1692 5.4E4 249.1647 1.2E4 251.1415 2.9E3 251.1784 1.1E4 253.1594 3.3E3 255.1750 6.2E3 256.1799 2.6E3 256.4473 2.9E3 257.1880 2.5E3 259.1707 9.3E3 261.1596 4.0E3 261.1869 9.6E3 263.1792 2.3E3 265.1594 7.0E3 265.1937 2.4E3 267.1756 3.7E3 269.1535 2.6E3 269.1900 2.2E4 271.1696 6.9E3 273.1853 2.5E4 274.1935 1.5E4 281.1897 1.5E4 283.1694 7.7E3 285.1849 1.5E4 286.1930 3.7E4 287.1714 2.2E3 287.2009 3.1E5 287.2373 7.3E3 293.1893 3.0E3 297.1850 1.1E4 299.2009 5.1E4 300.2083 8.6E3 301.3450 2.5E3 303.1979 2.7E3 309.1851 3.3E3 309.2230 3.2E3 310.1936 6.0E3 311.2015 1.2E4 312.2084 1.5E4 313.2164 3.1E4 319.2054 1.4E4 321.2212 6.3E3 325.2169 3.2E4 329.2125 1.1E4 337.2165 5.5E4 339.2320 4.1E4 340.2409 2.8E3 347.2325 2.4E3 352.2396 1.5E5 353.2474 3.5E4 365.2474 5.9E4 367.2619 1.4E4 377.2490 3.1E3 395.2587 5.2E4 480.3242 1.9E4 503.7378 2.4E3 511.3464 2.5E3 525.3562 1.5E4 538.3642 7.6E4 618.5182 7.1E3 END IONS BEGIN IONS FEATURE_ID=690 PEPMASS=600.4175 SCANS=690 RTINSECONDS=850.859 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 64.9442 2.3E3 66.9586 2.5E3 67.0539 7.3E3 69.0331 2.6E3 69.0696 6.4E3 73.0645 1.1E4 79.0543 3.9E3 81.0696 1.9E4 82.0368 2.5E3 83.0488 3.4E3 83.0851 7.8E3 85.0648 2.9E3 87.0436 4.7E4 87.7684 2.4E3 89.0593 7.4E5 89.0663 5.4E3 91.0538 6.0E3 93.0695 3.5E4 95.0487 1.2E4 95.0852 2.4E4 97.0645 1.4E4 105.0694 2.6E4 107.0693 2.8E3 107.0852 4.1E4 109.0647 7.4E3 109.1008 2.7E4 113.0954 3.2E3 116.0094 2.7E3 116.0323 2.5E3 117.0906 2.9E3 119.0852 4.2E4 121.1008 4.3E4 123.0803 2.1E4 125.0960 6.8E3 129.0698 3.0E3 131.0697 1.2E4 131.0854 2.4E4 133.0742 2.9E3 133.0855 3.7E5 133.1004 3.4E4 134.8037 2.5E3 135.0803 1.2E4 135.1165 1.4E4 137.0959 7.2E3 139.1123 2.9E3 139.8655 2.4E3 143.0853 2.6E4 144.0930 3.1E3 145.1008 4.5E4 147.0801 8.8E3 147.1166 1.7E4 149.0959 1.5E4 151.0761 3.8E3 155.0849 4.8E3 155.1070 2.6E3 157.1008 4.7E4 158.1085 6.2E3 159.0806 1.2E4 159.1166 3.7E4 161.0961 1.1E4 161.1320 3.0E3 165.0906 7.1E3 167.1065 1.8E4 169.1010 1.8E4 170.1088 3.0E3 171.1167 4.0E4 173.0961 5.3E3 173.1325 2.1E4 173.5240 4.1E4 173.5427 2.8E4 175.0961 2.8E3 175.1118 8.3E3 175.1481 8.5E3 177.0969 3.1E3 177.1120 5.4E4 181.1009 1.2E4 183.1165 2.6E4 185.1320 2.1E4 187.1119 3.6E3 187.1479 8.3E3 189.1267 3.7E3 190.1351 2.5E3 195.1172 2.0E4 197.1321 2.6E4 199.1111 3.2E3 199.1478 1.0E4 203.1442 4.5E3 204.4840 2.7E3 207.1173 1.2E4 209.1324 2.5E4 211.1481 1.8E4 213.1272 3.9E3 213.1632 3.7E3 215.1441 2.6E3 220.8920 3.4E3 221.1328 1.5E4 221.1546 1.0E4 223.1477 1.7E4 227.1418 3.0E3 233.1538 2.1E4 235.1474 6.4E3 237.1645 7.3E3 239.1481 3.1E3 247.1447 2.9E3 249.1650 4.3E3 251.1462 2.8E3 251.1790 3.2E3 255.1741 2.1E4 261.0247 2.7E3 261.1628 2.9E3 263.1774 6.2E3 275.1809 3.5E3 277.1932 2.9E3 334.1079 2.4E3 368.7173 2.8E3 411.1591 2.4E3 442.5897 2.6E3 448.5576 2.2E3 455.7804 2.7E3 553.2837 2.6E3 END IONS BEGIN IONS FEATURE_ID=691 PEPMASS=371.2585 SCANS=691 RTINSECONDS=851.454 CHARGE=1+ MSLEVEL=2 MERGED_STATS=7 / 8 (1 removed due to low quality, 0 removed due to low cosine). 52.2486 2.2E3 52.9818 2.2E3 54.1414 2.2E3 55.2853 2.2E3 57.0328 2.2E3 57.0698 4.6E3 57.4346 2.6E3 58.3431 2.2E3 60.5608 2.4E3 63.3193 2.3E3 67.8941 2.3E3 68.9362 2.3E3 71.0489 2.2E4 71.0852 2.6E3 71.9253 2.2E3 72.2784 2.5E3 75.2614 2.5E3 75.3000 2.7E3 75.8995 2.0E3 80.7283 2.2E3 83.0491 2.4E3 83.2926 2.2E3 83.8151 2.4E3 87.8462 2.6E3 99.0797 2.3E3 99.0879 2.3E3 99.0962 2.4E3 99.9349 2.5E3 101.0593 3.4E4 102.9056 2.2E3 110.5229 2.5E3 111.0439 3.3E4 114.5784 2.3E3 115.0858 2.4E3 119.0854 1.8E4 121.0644 2.8E3 124.2805 2.2E3 125.0960 1.5E4 127.1799 2.2E3 129.0546 1.3E4 133.1008 1.5E6 133.1113 1.5E4 133.1246 2.5E3 135.0444 5.5E3 143.9195 2.2E3 147.0799 3.4E4 147.1166 1.8E4 149.0833 2.9E3 149.0992 2.9E3 149.6851 4.5E3 149.6954 3.9E3 151.1114 1.2E5 152.7281 2.7E3 153.0906 2.7E5 155.8857 2.3E3 157.1008 2.5E4 159.7577 2.5E3 160.0885 1.1E4 160.2406 2.7E3 161.1340 3.2E3 164.5474 2.5E3 164.6483 2.3E3 166.2075 2.2E3 168.2814 2.5E3 171.1168 1.7E4 173.1324 2.3E5 173.5289 4.8E4 173.5374 7.6E4 174.4736 2.1E3 175.1116 2.1E5 175.1480 2.4E5 183.1172 7.0E3 185.1323 2.6E4 188.3085 2.3E3 190.4418 2.3E3 191.1061 1.1E4 201.1274 6.1E4 203.6897 2.6E3 207.9777 2.2E3 211.1118 1.1E4 213.1639 6.1E3 223.1480 1.0E4 229.1224 1.7E5 241.1586 4.8E5 241.1864 4.7E3 276.2017 2.5E3 279.8232 2.3E3 283.2062 6.1E4 290.4381 2.6E3 295.5952 2.2E3 305.7859 2.4E3 306.6315 2.3E3 308.2912 2.8E3 310.4415 2.2E3 311.2006 2.8E4 329.2115 2.7E5 329.8504 2.5E3 332.5141 2.4E3 363.7288 2.9E3 374.9906 2.5E3 END IONS BEGIN IONS FEATURE_ID=692 PEPMASS=794.5783 SCANS=692 RTINSECONDS=852.578 CHARGE=1+ MSLEVEL=2 MERGED_STATS=11 / 37 (26 removed due to low quality, 0 removed due to low cosine). 71.0489 6.7E4 71.0854 7.6E4 72.3542 2.3E3 73.0282 3.4E3 73.4288 2.1E3 73.5527 2.6E3 77.0387 6.3E3 79.0541 9.3E5 79.0586 2.4E3 79.0595 4.5E3 81.0334 3.6E3 81.0697 3.4E6 81.0745 4.5E3 82.4126 3.1E3 83.0490 9.4E4 83.0852 9.3E5 83.0913 4.5E3 85.0282 1.2E5 85.0645 1.3E5 85.1010 6.1E4 85.5590 2.5E3 87.7153 2.1E3 91.0388 5.9E4 91.0482 5.5E3 91.0539 5.6E5 91.4343 2.5E3 93.0697 1.5E6 93.0754 3.4E3 93.0768 6.4E3 95.0490 8.6E4 95.0853 3.4E6 95.0910 6.4E3 95.5837 2.6E3 95.6903 2.7E3 97.0282 7.1E4 97.0646 2.5E5 97.1009 6.3E5 99.0439 3.6E3 99.0802 1.5E5 99.3127 2.4E3 101.0598 6.5E3 103.2221 2.4E3 105.0444 9.3E3 105.0618 3.6E3 105.0696 6.6E5 107.0772 1.4E4 107.0853 1.3E6 109.0646 6.7E4 109.0930 9.3E3 109.1010 2.0E6 109.1084 2.8E3 111.0445 2.7E3 111.0801 1.8E5 111.1166 1.6E5 113.0959 6.8E4 115.0755 5.5E3 117.0696 2.0E5 118.2744 2.2E3 119.0769 6.5E3 119.0853 8.5E5 121.0910 3.7E4 121.1009 1.6E6 121.1108 2.0E4 121.1580 2.3E3 122.7947 3.8E3 123.0802 9.8E4 123.1070 1.1E4 123.1166 1.0E6 123.1267 8.3E3 125.0959 1.3E5 125.1319 1.2E4 125.7495 3.2E3 127.0391 9.7E3 127.0755 1.2E4 127.1116 2.7E4 129.0546 1.6E4 129.0694 3.4E4 130.1848 3.0E3 130.8350 2.0E3 131.0750 2.9E3 131.0853 5.1E5 133.0906 6.7E3 133.1009 1.0E6 133.1127 1.0E4 135.0804 1.9E4 135.1057 3.8E3 135.1166 1.3E6 135.1273 2.6E3 135.4208 2.4E3 137.0959 1.2E5 137.1322 4.3E5 139.0963 2.6E3 139.1115 1.1E5 141.1272 6.2E3 142.9508 2.9E3 143.0853 6.1E4 145.0892 8.8E3 145.1010 5.1E5 145.1137 6.3E3 147.0801 2.8E3 147.1037 9.7E3 147.1165 9.0E5 149.0960 4.8E4 149.1200 3.3E3 149.1323 9.3E5 149.1462 7.9E3 151.1116 1.0E5 151.1479 1.8E5 153.1271 9.2E4 155.0854 9.8E3 157.1011 9.0E4 159.0698 2.4E3 159.1024 4.6E3 159.1167 5.3E5 159.1292 2.2E3 160.8336 3.3E3 161.0974 4.4E3 161.1323 8.0E5 161.1480 7.7E3 163.1120 5.3E4 163.1479 6.0E5 165.1273 7.0E4 165.1635 6.6E4 166.0494 2.8E3 167.1430 4.0E4 169.0782 3.5E3 169.1012 1.4E4 170.3357 2.4E3 171.1166 1.2E5 173.1168 6.5E3 173.1325 5.7E5 173.5243 1.0E5 173.5385 2.2E5 174.9077 2.5E3 175.1122 8.8E3 175.1481 4.5E5 177.1272 5.0E4 177.1638 2.3E5 179.1428 5.2E4 179.1794 3.2E4 181.1013 2.6E3 181.1588 2.3E4 183.1169 3.3E4 185.1325 1.2E5 185.3685 3.2E3 187.1480 3.2E5 189.1637 1.7E5 190.8213 2.4E3 191.1425 3.8E4 191.1794 6.0E4 193.1587 4.5E4 193.5516 2.8E3 195.1725 3.3E3 197.1323 1.8E4 197.8990 2.2E3 199.1482 8.7E4 201.1636 1.4E5 203.1438 6.8E3 203.1795 8.4E4 205.1590 4.9E4 205.1950 3.4E4 207.1746 3.3E4 209.1537 6.0E3 211.1491 9.1E3 213.1646 4.3E4 215.1794 7.9E4 216.0381 3.6E3 217.1588 7.2E3 217.1954 5.9E4 218.3177 3.0E3 219.1742 4.3E4 219.2107 3.1E4 221.1498 3.1E3 221.1904 9.9E3 225.1662 3.8E3 229.1953 2.5E4 231.1767 3.8E3 231.2110 2.2E4 233.1906 1.7E4 233.2263 8.7E4 235.1703 3.6E3 239.1792 6.8E3 241.1950 8.8E4 243.2105 4.2E5 245.2262 2.4E5 247.2416 6.2E3 257.1894 6.5E3 257.2246 9.3E3 259.2053 2.1E5 261.1912 2.3E4 261.2210 1.3E6 261.2469 2.4E3 262.4126 3.4E3 263.2365 4.1E5 263.2666 5.2E3 267.2079 2.8E3 269.2247 2.9E3 271.2047 3.0E3 271.2393 3.5E3 273.2224 2.7E4 275.2015 3.8E3 275.2358 1.2E4 277.2167 2.5E4 279.2323 5.0E4 282.2003 2.6E3 285.2231 8.7E3 285.2579 2.9E3 287.2377 3.1E4 289.2184 3.1E3 289.2521 1.4E4 291.2325 1.9E4 295.2401 2.9E3 297.2161 3.5E3 299.2365 3.1E4 301.2533 3.0E4 301.2878 3.2E3 303.2332 8.1E3 305.2482 1.5E4 313.2506 6.9E3 315.2707 3.2E3 317.2474 1.5E5 317.2856 4.3E3 319.2624 2.8E4 323.2581 3.6E3 329.2841 6.5E3 333.2421 3.7E4 335.2216 2.7E3 335.2580 3.6E6 335.3257 4.0E3 337.2263 1.4E4 337.2737 4.5E6 337.3213 1.4E4 339.2893 1.3E5 343.2585 3.5E3 343.3028 2.8E3 345.7156 2.4E3 349.2298 2.5E3 351.2968 2.7E3 354.7741 3.7E3 357.3160 8.5E3 357.5555 2.5E3 371.3323 3.3E3 379.1732 3.9E3 415.3568 3.5E3 420.4590 3.5E3 426.0496 2.5E3 445.8975 3.0E3 453.0999 2.3E3 459.6405 4.4E3 472.3727 2.6E3 505.4401 3.2E3 510.7032 2.4E3 514.0461 3.1E3 523.4509 8.0E4 530.4066 2.6E3 537.4794 3.0E3 541.4616 3.7E4 571.4711 2.7E3 583.3350 4.6E3 597.4869 4.4E5 597.7538 2.7E3 615.4962 6.9E4 646.0274 2.6E3 656.8094 2.6E3 END IONS BEGIN IONS FEATURE_ID=693 PEPMASS=609.2711 SCANS=693 RTINSECONDS=853.277 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 67.6959 2.6E4 67.6989 7.2E3 80.8461 2.3E3 81.0692 5.5E3 95.0849 2.6E3 108.5687 2.4E3 120.6935 2.6E3 155.3164 2.6E3 173.5249 4.1E4 173.5413 3.5E4 183.8149 2.5E3 202.9509 2.5E3 253.3758 2.1E3 421.3088 2.5E3 461.2317 5.3E3 475.2110 2.8E3 477.2266 3.3E3 477.7841 2.3E3 485.2354 2.5E3 487.2502 1.2E4 503.2401 9.0E3 519.2361 2.8E4 521.2188 1.4E4 531.1472 3.6E3 531.2387 1.7E5 532.2498 5.4E3 549.2499 3.1E5 563.2665 1.9E4 577.2435 7.9E3 580.2346 3.4E3 581.2646 3.3E3 581.2751 1.5E4 591.2605 8.1E4 609.2709 9.0E5 END IONS BEGIN IONS FEATURE_ID=694 PEPMASS=602.4332 SCANS=694 RTINSECONDS=855.922 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 3 (1 removed due to low quality, 0 removed due to low cosine). 63.8949 2.3E3 67.0539 2.2E4 69.0330 2.8E3 69.0696 2.4E4 71.0492 6.5E3 79.0539 2.5E4 80.0617 4.1E3 81.0694 9.2E4 83.0488 1.6E4 83.0852 1.3E5 85.0644 1.2E4 87.0437 4.3E3 89.0593 4.0E4 90.0627 5.1E3 91.0539 2.2E4 93.0695 1.1E5 95.0488 3.4E4 95.0852 7.7E4 96.8253 2.4E3 97.0591 2.5E3 97.0644 4.4E4 97.1011 3.1E3 99.0437 1.5E4 99.0803 3.0E3 105.0696 1.1E5 106.0774 4.1E3 107.0851 1.4E5 108.0928 3.5E3 109.0644 2.2E4 109.1008 7.1E4 111.0801 1.1E4 113.0958 2.5E4 117.0694 1.9E4 117.5330 2.8E3 119.0755 4.1E3 119.0852 2.3E5 119.0936 2.3E3 120.0930 2.1E4 121.0643 2.9E3 121.1008 1.1E5 123.0800 5.1E4 123.1164 2.2E4 125.0957 3.9E4 129.0696 1.1E4 130.0773 3.9E3 131.0764 2.8E3 131.0852 7.8E4 132.0930 2.0E4 133.0861 1.6E4 133.1009 1.6E5 133.1126 5.1E3 134.0895 6.7E3 134.1085 1.2E4 135.0802 1.4E4 135.1165 5.3E4 137.0958 1.7E4 138.1045 3.6E3 139.1116 4.4E4 142.0773 7.9E3 143.0853 7.2E4 144.0931 2.7E4 145.0645 3.0E3 145.1009 2.2E5 145.1123 2.4E3 146.1086 1.1E4 147.0802 8.3E3 147.1165 8.6E4 149.0958 2.2E4 149.1323 1.2E4 150.1052 2.9E3 151.0755 2.3E3 151.1112 1.2E4 151.1476 2.2E3 153.0908 3.1E3 153.1267 3.0E3 153.7868 2.2E3 155.0851 1.7E4 155.1065 1.8E4 156.0931 1.4E4 156.4023 2.7E3 157.1009 1.5E5 158.1087 3.3E4 159.0804 3.5E3 159.1166 1.2E5 159.1314 3.7E3 160.0881 7.0E4 160.1231 7.2E3 161.0959 2.0E4 161.1324 3.0E4 163.1113 1.5E4 163.1487 3.8E3 165.1268 1.1E4 167.0853 6.9E3 167.1067 2.0E4 168.1141 2.7E3 169.1011 6.4E4 170.1089 1.2E4 171.1013 7.0E3 171.1168 1.2E5 172.1246 1.2E4 173.0961 7.3E3 173.1324 7.5E4 173.5216 6.9E3 173.5365 3.4E4 175.1114 1.2E4 175.1482 6.0E4 177.1278 1.1E4 179.0851 5.9E3 179.1429 1.7E4 181.1014 2.1E4 181.1223 5.9E4 182.1089 1.0E4 183.1168 6.8E4 183.1375 2.0E4 184.1242 1.5E4 185.1324 6.0E4 186.1397 1.4E4 187.1117 9.6E3 187.1481 4.0E4 189.1274 1.4E4 189.1627 5.4E3 191.1429 3.2E4 193.1012 1.3E4 193.1585 3.1E3 194.1096 7.9E3 195.1168 5.9E4 195.1366 4.0E3 196.1245 2.0E4 197.1325 1.1E5 198.1397 1.2E4 199.1115 4.2E3 199.1480 4.6E4 201.1264 6.6E3 201.1638 2.3E4 203.1432 1.3E4 205.1580 3.4E3 207.1171 2.7E4 207.1371 8.4E3 208.1251 8.3E3 208.1461 4.3E3 209.1326 7.4E4 209.1536 3.2E3 210.1402 1.6E4 211.1482 6.6E4 212.1560 9.3E3 213.1279 3.4E3 213.1638 4.3E4 215.1429 6.4E3 217.1589 1.4E4 219.1175 3.4E3 219.1747 3.5E3 220.1250 4.1E3 221.1323 2.6E4 221.1545 2.9E4 222.1410 6.0E3 223.1484 4.8E4 224.1564 6.3E3 225.1484 2.3E4 225.1668 8.8E3 227.1420 7.9E3 233.1313 6.6E3 233.1541 4.6E4 235.1481 2.0E4 237.1639 2.4E4 238.1722 3.0E3 238.3025 2.6E3 239.1419 3.3E3 239.1794 1.3E4 241.1954 1.0E4 243.1732 2.7E3 246.1614 7.2E3 247.1466 1.1E4 247.1720 3.9E3 249.1637 1.9E4 250.1734 3.3E3 251.1791 1.5E4 253.1622 3.0E3 253.1945 9.0E3 255.1751 4.3E3 257.1897 1.0E4 259.1710 3.2E3 259.2060 5.6E3 261.1620 9.1E3 263.1796 2.5E4 265.1949 1.8E4 267.2100 7.8E3 273.1854 7.4E3 275.1793 3.2E3 276.1872 5.2E3 277.1956 8.9E3 279.2114 3.8E3 281.1934 3.6E3 283.2075 6.5E3 285.1842 6.3E3 286.1931 1.5E4 289.1964 4.1E3 291.2116 8.7E3 295.2083 2.9E3 297.2208 2.9E3 299.2012 1.3E4 309.2221 3.8E3 311.2368 3.0E3 351.2699 8.5E3 410.8864 3.2E3 438.2458 2.4E3 END IONS BEGIN IONS FEATURE_ID=695 PEPMASS=401.2842 SCANS=695 RTINSECONDS=856.85 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 53.6083 2.1E3 55.0540 1.8E4 57.9585 2.4E3 60.0811 2.5E3 65.6311 2.6E3 67.0539 2.3E4 69.0696 2.8E4 71.0487 2.4E4 74.5045 2.3E3 77.9733 2.6E3 79.0538 2.7E4 80.2950 2.2E3 81.0695 4.9E4 83.0419 2.6E3 83.0855 7.5E3 91.0539 3.5E4 93.0695 8.8E4 95.0488 1.4E4 95.0852 4.1E4 98.8649 2.3E3 101.8935 2.1E3 105.0627 3.7E3 105.0695 1.3E5 107.0851 8.0E4 109.0644 8.9E4 109.1008 3.0E4 111.0800 1.3E4 111.2225 2.7E3 117.0696 3.4E4 119.0851 1.6E5 121.1008 4.1E4 123.0803 6.8E3 123.5976 2.3E3 128.0616 4.5E3 129.0694 2.4E4 130.0774 7.1E3 130.1350 2.7E3 131.0749 7.4E3 131.0852 1.3E5 133.1008 1.6E5 135.0801 3.2E4 135.1164 4.3E4 137.0955 5.3E3 137.5152 3.0E3 139.3353 2.2E3 140.6406 2.3E3 141.0693 5.3E3 142.0772 3.0E4 143.0852 7.4E4 144.0931 1.3E4 145.1009 2.1E5 147.0801 1.6E4 147.1165 3.6E4 153.2724 2.4E3 155.0852 2.5E4 156.0929 2.9E4 157.1009 1.3E5 158.1087 2.3E4 159.1165 8.2E4 161.0959 5.9E3 161.1321 3.0E3 165.0711 3.8E3 166.3428 3.1E3 167.0856 1.7E4 168.0928 1.1E4 169.1011 4.2E4 170.1087 1.8E4 171.1166 6.7E4 172.1248 1.3E4 173.1323 9.5E4 173.5299 6.2E4 173.5460 1.0E4 175.1478 2.0E4 177.1489 2.2E3 179.0852 1.4E4 180.0935 6.2E3 181.1015 2.3E4 182.1091 1.5E4 183.1167 4.9E4 184.1252 1.1E4 185.1325 3.4E4 187.1483 3.4E4 190.5661 2.3E3 192.0914 3.0E3 193.1013 1.6E4 194.1085 1.8E4 195.1166 4.4E4 196.1241 9.4E3 196.8769 2.3E3 197.1324 3.8E4 199.1478 3.0E4 206.1089 1.8E4 207.1165 2.1E4 208.1244 6.1E3 209.1324 4.7E4 210.1386 3.2E3 211.1486 1.6E4 221.1328 2.5E4 222.1404 5.1E3 223.1485 1.4E4 233.1334 4.1E3 235.1484 1.1E4 237.1638 1.7E4 245.1327 3.2E3 246.1396 6.6E3 247.1476 3.2E3 249.1647 2.7E3 251.1796 6.5E3 262.6397 2.5E3 263.1790 3.2E3 273.1608 2.7E3 287.1771 2.5E3 291.0583 3.1E3 356.5268 2.6E3 378.1990 2.5E3 401.2817 3.5E3 403.2453 2.5E3 END IONS BEGIN IONS FEATURE_ID=696 PEPMASS=794.5782 SCANS=696 RTINSECONDS=857.804 CHARGE=1+ MSLEVEL=2 MERGED_STATS=31 / 31 (0 removed due to low quality, 0 removed due to low cosine). 71.0489 1.8E4 71.0852 3.6E4 71.3109 2.4E3 71.4625 2.2E3 72.2051 2.0E3 72.2608 2.6E3 72.3508 2.3E3 72.3705 2.7E3 72.8490 2.2E3 73.0641 2.4E3 74.0128 2.6E3 74.1477 2.7E3 74.6336 2.3E3 75.6255 2.8E3 75.6883 2.2E3 75.7661 2.1E3 75.8230 2.5E3 76.4325 2.2E3 76.5265 2.2E3 76.9569 2.8E3 77.0821 2.1E3 77.4760 2.2E3 77.7275 2.2E3 79.0538 5.9E5 79.9785 2.4E3 80.2810 2.4E3 80.3981 2.4E3 81.0694 2.2E6 81.5648 2.2E3 81.6305 2.2E3 82.1208 2.7E3 83.0488 2.9E4 83.0850 5.9E5 85.0281 4.6E4 85.0644 4.4E4 85.1006 9.5E3 85.2084 2.4E3 86.1707 2.6E3 87.7883 2.3E3 88.8317 2.5E3 91.0384 6.8E3 91.0538 3.5E5 91.0631 2.4E3 91.5999 2.2E3 92.0041 2.7E3 92.7693 2.6E3 93.0694 1.0E6 93.7722 2.2E3 94.0850 2.4E3 94.1913 2.7E3 95.0490 2.6E4 95.0785 3.8E3 95.0850 2.2E6 96.1772 2.2E3 96.5030 2.3E3 97.0282 8.0E3 97.0643 1.4E5 97.1007 4.0E5 98.1134 2.3E3 99.0800 6.2E4 101.5717 2.4E3 101.9320 2.3E3 103.5136 2.4E3 104.7913 2.6E3 104.9320 2.2E3 105.0440 2.6E3 105.0694 4.3E5 106.0450 2.3E3 107.0850 8.3E5 109.0644 1.5E4 109.1007 1.3E6 109.9536 2.4E3 111.0801 1.0E5 111.1164 8.7E4 111.6523 2.3E3 112.4883 2.7E3 113.0956 2.1E4 114.2975 2.2E3 117.0693 1.2E5 119.0850 5.5E5 121.0924 6.2E3 121.1006 1.1E6 121.6410 2.5E3 123.0801 3.6E4 123.1075 5.3E3 123.1163 6.6E5 123.3128 2.6E3 125.0957 6.2E4 127.0748 8.3E3 128.8734 2.6E3 129.0691 2.6E3 131.0851 3.1E5 132.7713 2.8E3 133.0904 6.3E3 133.1007 6.6E5 133.5315 2.4E3 133.8965 2.3E3 134.7731 2.3E3 135.1063 1.2E4 135.1163 8.6E5 136.4232 2.3E3 136.5466 2.6E3 137.0956 3.7E4 137.1319 2.5E5 137.4456 3.0E3 137.8773 2.9E3 138.7090 2.6E3 139.1112 4.3E4 141.2081 2.4E3 141.5291 2.4E3 142.6127 2.3E3 143.0589 2.8E3 143.0857 1.6E4 145.0495 2.3E3 145.1007 3.1E5 145.2669 2.4E3 147.0214 2.5E3 147.1163 5.9E5 147.2033 2.3E3 148.4093 2.7E3 149.0951 8.5E3 149.1220 4.8E3 149.1320 5.8E5 150.0056 2.5E3 151.1114 3.4E4 151.1477 9.1E4 151.9703 2.3E3 152.9881 2.6E3 153.1269 3.1E4 157.1008 3.1E4 158.2239 2.5E3 158.9622 2.2E3 159.1164 3.5E5 160.9474 2.7E3 161.1320 5.1E5 163.1119 7.6E3 163.1476 3.9E5 164.7384 2.6E3 165.1272 2.4E4 165.1637 1.8E4 167.1428 2.9E3 169.7381 3.2E3 171.1167 4.0E4 173.1321 3.4E5 173.5229 1.2E5 173.5335 6.8E5 173.5446 4.7E4 174.0114 2.4E3 175.1323 2.4E3 175.1479 2.9E5 175.1637 2.5E3 177.1634 1.1E5 179.1424 1.2E4 181.1592 2.7E3 182.0717 2.9E3 183.1161 5.1E3 183.3118 2.7E3 183.8271 2.8E3 184.0357 2.4E3 185.1325 4.5E4 185.2661 2.6E3 185.3519 2.3E3 187.1476 1.9E5 188.1486 2.8E3 189.1635 1.1E5 189.8297 2.7E3 190.3514 2.4E3 191.1421 2.8E3 191.1781 1.4E4 191.6887 2.7E3 192.5244 2.4E3 197.1292 2.6E3 199.0783 2.2E3 199.1479 1.9E4 200.9812 2.7E3 201.1634 5.9E4 202.3730 2.8E3 203.1799 2.5E4 205.1590 3.3E3 205.1947 2.4E3 206.1346 2.8E3 210.1416 2.3E3 210.2835 2.9E3 212.4282 2.9E3 213.1634 3.1E3 215.1798 1.7E4 215.4295 2.5E3 216.3405 2.5E3 217.1949 3.1E3 219.1745 1.5E4 219.2110 5.8E3 222.7521 2.7E3 226.5930 2.9E3 229.3464 2.4E3 229.7086 2.2E3 230.5556 2.3E3 231.2748 2.3E3 233.2262 2.8E4 241.1954 2.5E4 243.2104 2.7E5 245.1958 2.8E3 245.2258 1.3E5 257.9481 2.3E3 258.1442 2.4E3 259.2050 1.1E5 260.9350 2.9E3 261.2207 8.3E5 263.2363 2.5E5 263.6428 2.3E3 265.0424 2.4E3 266.7254 2.3E3 270.8586 3.0E3 271.1158 2.7E3 275.2372 2.8E3 279.6724 2.3E3 280.1559 2.4E3 280.9750 3.6E3 284.4410 2.4E3 291.2309 2.7E3 294.7843 2.5E3 297.5847 2.4E3 299.2334 2.4E3 300.5858 2.9E3 301.7259 3.0E3 303.0037 2.5E3 311.6534 2.6E3 313.2114 2.9E3 316.6765 2.6E3 317.2472 7.6E4 317.5537 2.3E3 319.2638 2.9E3 327.2709 2.9E3 333.2413 3.1E3 335.2580 2.3E6 335.3022 3.9E3 336.0087 2.7E3 337.2258 2.5E4 337.2737 2.8E6 337.3210 2.9E4 339.2894 5.1E4 340.3498 2.6E3 340.4294 2.3E3 347.9833 2.3E3 363.7084 2.5E3 366.6687 2.4E3 368.3079 2.5E3 368.5358 2.6E3 371.3341 3.3E3 378.5182 2.5E3 388.5228 2.4E3 394.1907 2.7E3 405.0237 2.4E3 406.2985 2.5E3 423.5477 2.7E3 426.2451 2.5E3 426.9329 3.1E3 427.0110 2.8E3 429.3247 2.4E3 442.0508 2.8E3 445.7660 2.5E3 452.9023 2.6E3 460.2450 2.5E3 475.1053 2.6E3 503.0587 2.4E3 520.0181 2.4E3 521.9130 2.7E3 523.4500 1.6E4 530.7250 2.4E3 534.9630 2.7E3 541.3246 3.0E3 560.1764 2.8E3 560.3926 3.0E3 560.5637 3.0E3 565.2043 2.8E3 570.4970 2.8E3 572.1389 2.8E3 580.6742 2.6E3 584.9413 2.7E3 587.3882 2.4E3 597.4877 2.6E5 604.2090 2.8E3 611.7630 2.2E3 615.5015 2.8E3 616.5096 2.7E3 620.1661 2.5E3 627.8587 2.5E3 633.5615 2.7E3 651.4050 2.8E3 652.0803 2.3E3 663.0712 2.6E3 664.5915 2.6E3 700.5663 2.7E3 722.5486 2.4E3 732.5524 2.8E3 761.8511 2.7E3 765.2330 2.4E3 799.0058 3.2E3 END IONS BEGIN IONS FEATURE_ID=697 PEPMASS=799.5333 SCANS=697 RTINSECONDS=858.772 CHARGE=1+ MSLEVEL=2 MERGED_STATS=15 / 27 (12 removed due to low quality, 0 removed due to low cosine). 71.0122 8.6E3 71.0486 1.5E4 71.2792 2.4E3 71.5860 2.5E3 73.0278 3.2E5 73.2663 2.7E3 73.3129 2.4E3 73.5767 2.7E3 74.2654 2.6E3 74.9649 2.1E3 76.2434 2.3E3 78.5617 2.7E3 78.9272 2.2E3 78.9672 2.2E3 79.0536 1.5E5 80.3295 3.1E3 80.3452 2.1E3 81.0329 1.3E5 81.0692 5.4E5 83.0487 1.7E4 83.0848 1.3E5 85.0277 6.5E5 85.0641 9.0E3 87.0435 5.5E4 88.8362 4.1E5 88.8404 2.4E4 90.9279 2.6E3 91.0382 5.8E5 91.0535 8.3E4 91.2974 2.4E3 93.0692 2.2E5 93.2815 2.4E3 94.6074 2.5E3 95.0848 5.2E5 96.0618 2.4E3 97.0276 5.6E5 97.0642 3.4E4 97.1005 8.3E4 98.7131 2.6E3 99.0434 1.2E5 99.0800 1.2E4 101.0225 2.4E5 102.4211 2.5E3 103.0382 1.1E5 105.0692 8.1E4 105.6989 2.3E3 107.0847 1.9E5 107.7436 2.4E3 108.6523 2.3E3 109.0276 1.2E5 109.0645 2.7E3 109.0939 3.4E3 109.1004 3.0E5 109.8518 2.9E3 110.2193 2.4E3 111.0799 1.3E4 115.0383 5.8E4 117.0539 5.7E3 117.0701 3.3E3 119.0849 1.0E5 119.3521 2.4E3 121.1004 2.4E5 123.1160 1.6E5 123.1248 3.8E3 124.0281 2.3E3 124.4157 2.7E3 125.7496 2.4E3 126.4000 2.6E3 127.0298 3.1E3 127.0381 3.8E5 129.0540 5.4E4 129.8283 3.7E3 131.0848 4.5E4 133.1004 1.4E5 133.8811 2.5E3 134.6053 2.8E3 135.1059 2.7E3 135.1159 1.8E5 136.8923 2.7E3 137.1318 6.8E4 139.1115 2.5E3 145.0487 1.2E5 145.1006 4.0E4 147.1161 1.1E5 147.7220 2.4E3 149.1316 1.3E5 151.1110 3.7E3 151.1471 1.3E4 153.1263 9.2E3 159.0659 2.7E3 159.1163 3.2E4 161.1317 1.1E5 162.2940 2.5E3 163.1473 7.4E4 166.9769 2.8E3 173.1321 4.4E4 173.5223 1.1E4 173.5313 4.1E5 173.5422 3.1E4 175.1479 6.6E4 177.1285 2.3E3 177.1638 1.2E4 177.2883 2.4E3 180.5889 2.3E3 183.0649 6.3E4 184.0731 1.7E4 185.0258 6.5E3 185.0413 4.2E5 187.1476 1.2E4 189.1629 1.3E4 196.2687 2.6E3 196.5939 2.9E3 199.8741 5.2E3 199.8939 5.2E3 200.8174 2.5E3 201.0747 4.1E4 203.0360 2.4E3 203.0519 2.4E5 220.7479 2.7E3 224.9763 3.2E3 227.3175 2.3E3 237.9338 2.8E3 241.0679 6.4E4 243.0570 3.7E3 243.0831 6.1E5 243.2104 2.0E4 245.2256 7.8E4 246.5556 2.2E3 247.6646 2.8E3 251.1510 2.5E3 259.0773 7.0E3 261.2202 1.5E5 263.2359 1.8E5 301.2136 3.8E4 303.2308 1.4E4 327.7754 2.3E3 332.1042 2.3E3 335.2134 3.5E3 335.2573 5.2E5 335.2978 3.7E3 337.2311 3.9E3 337.2729 7.0E5 337.3162 8.8E3 344.8253 2.8E3 351.3094 2.3E3 353.1550 2.5E3 358.1671 2.5E3 363.2529 2.6E4 365.2673 3.6E4 366.7649 2.6E3 373.3680 2.3E3 381.8770 2.8E3 397.2874 3.0E3 422.6605 2.3E3 448.7220 2.3E3 477.3928 2.5E3 479.2992 3.5E3 481.3211 2.9E3 484.0883 2.6E3 497.3103 7.1E4 498.4056 2.9E3 499.3250 7.2E4 519.1998 3.4E3 519.2924 7.8E6 519.4728 1.8E4 520.7500 2.6E3 521.1276 4.1E3 521.3077 8.1E6 521.4885 1.9E4 530.5924 2.6E3 564.5056 3.0E3 566.7251 2.1E3 594.2481 2.5E3 619.4658 2.6E3 637.4804 1.6E5 653.2510 2.9E3 656.5039 3.1E3 710.8896 2.4E3 718.9642 3.1E3 731.6379 2.7E3 778.3073 2.5E3 786.5027 2.9E3 799.1846 1.3E4 799.3593 6.0E3 799.5321 9.8E6 799.8790 2.1E4 800.5216 3.4E3 800.5409 5.4E3 END IONS BEGIN IONS FEATURE_ID=698 PEPMASS=663.1750 SCANS=698 RTINSECONDS=860.468 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 67.0143 4.9E3 67.0174 2.4E4 69.9163 2.2E3 72.7560 2.4E3 79.0712 2.2E3 79.3229 2.2E3 81.0692 3.5E3 83.0848 3.0E3 101.3065 2.3E3 103.0806 2.3E3 111.2462 2.5E3 121.2725 2.8E3 149.6898 5.8E3 153.2352 2.3E3 171.5305 2.3E3 173.5227 1.1E4 173.5402 2.5E4 197.0994 2.5E3 325.2027 2.3E3 337.5636 3.0E3 378.4624 2.7E3 458.8271 2.5E3 473.0899 2.2E4 475.0635 7.6E3 475.1419 3.1E5 487.1049 3.5E3 490.1280 1.1E4 494.8284 2.4E3 501.1220 4.5E4 502.1297 3.5E4 503.1367 1.9E5 515.1131 6.9E3 518.1573 1.6E4 519.1667 1.9E4 522.4246 7.1E3 529.1197 1.8E4 530.1229 7.9E4 531.1316 5.3E4 532.1434 3.3E3 534.1507 7.1E3 534.1619 4.4E3 543.1318 2.1E4 546.1548 8.7E4 547.1628 3.6E4 557.1472 1.9E4 562.1525 4.4E3 569.1611 2.8E3 575.1582 1.2E5 588.1198 3.2E3 603.1532 6.3E5 603.2693 3.5E3 606.1420 1.9E4 634.1736 8.9E3 635.1716 4.1E3 END IONS BEGIN IONS FEATURE_ID=699 PEPMASS=629.2374 SCANS=699 RTINSECONDS=860.684 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 65.8226 2.3E3 77.9030 2.3E3 78.4572 2.2E3 78.6833 2.6E3 85.8531 2.6E3 89.0970 3.1E3 97.6583 2.3E3 108.7301 2.7E3 114.2924 2.3E3 122.0920 2.3E3 130.2538 2.3E3 133.0133 2.6E3 136.7987 2.5E3 138.2989 2.0E4 138.3110 1.4E4 138.9553 2.4E3 145.1950 2.2E3 156.2554 2.8E3 165.0070 2.4E3 173.5247 1.6E4 173.5334 7.6E4 173.5438 1.0E4 174.7195 2.3E3 184.8928 2.5E3 192.7482 2.4E3 209.8539 2.5E3 214.4248 2.4E3 216.8685 2.4E3 226.6230 2.8E3 238.7980 2.6E3 256.8432 2.6E3 268.6707 2.3E3 357.8442 2.6E3 435.1615 2.5E3 496.1177 3.6E3 496.1867 1.3E5 509.1942 3.0E3 510.2024 5.9E4 524.2171 5.0E5 525.2254 2.7E6 525.4087 5.4E3 526.2238 2.2E3 535.2111 3.0E4 537.2034 2.8E3 538.1965 6.8E4 551.2064 2.5E4 552.2178 7.7E3 552.9612 1.2E4 553.0202 5.9E4 553.0596 4.5E4 553.2205 9.6E6 553.3807 4.9E4 553.4217 7.1E4 553.4771 1.6E4 554.2225 1.4E4 565.0822 3.0E3 585.2458 2.1E4 597.2111 3.8E3 611.7481 3.0E3 END IONS BEGIN IONS FEATURE_ID=700 PEPMASS=606.2480 SCANS=700 RTINSECONDS=860.686 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 67.3599 1.4E4 67.3623 3.4E3 75.2042 2.3E3 77.0597 2.3E3 87.2750 2.3E3 93.5047 2.4E3 109.0568 2.7E3 110.5199 2.5E3 131.2033 2.5E3 133.0696 2.4E3 136.8017 2.7E3 173.5221 8.6E3 173.5356 6.9E4 204.0650 1.1E4 237.1022 1.1E4 245.4669 2.6E3 250.1102 2.8E3 263.1164 2.5E3 264.5667 2.5E3 360.5120 2.5E3 381.1411 2.7E3 382.1548 4.2E3 384.1716 6.1E3 387.1584 2.5E3 393.1468 7.2E3 402.1817 1.3E4 406.1213 3.2E3 409.1501 2.8E3 410.1504 3.7E3 412.1298 3.4E3 417.2093 3.9E3 419.2243 7.7E3 424.1299 1.4E4 426.1476 1.0E4 431.1826 3.5E3 438.1448 3.9E4 441.1677 7.5E4 444.1923 2.8E3 445.2027 5.9E4 446.2090 2.6E4 447.2173 5.0E4 448.2302 3.6E3 453.1670 6.6E3 454.1760 4.5E4 459.1813 2.5E3 459.2211 2.1E3 463.2500 8.0E3 472.2274 2.4E3 473.1350 3.4E3 473.1968 9.1E5 474.2043 2.6E5 475.2124 1.6E5 477.2283 7.8E3 487.2117 5.4E4 488.2199 5.8E3 490.2349 1.6E4 491.2425 1.6E4 491.2527 4.8E3 499.2166 2.7E3 500.2184 3.1E4 501.2265 7.4E4 502.2208 7.5E3 502.2326 4.8E3 503.2061 1.9E4 504.2163 7.0E3 505.2233 9.3E4 506.2310 5.7E4 514.2065 3.4E3 515.2063 1.7E4 517.2186 1.3E4 517.2297 3.5E3 518.2282 5.6E4 519.2337 1.0E5 520.2479 1.2E4 528.2103 2.8E3 529.2204 1.5E4 530.2262 1.9E4 531.2027 8.1E4 532.2089 9.8E3 533.2180 2.7E5 534.2244 1.9E4 535.2329 1.4E4 545.2172 2.5E4 546.2250 1.9E5 547.2336 2.2E6 547.4331 9.4E3 559.1921 3.2E3 560.2026 3.6E3 561.2509 2.9E3 563.2291 1.1E5 563.3221 4.4E3 565.6106 2.6E3 573.2114 9.5E3 574.2198 7.7E4 577.2351 3.3E4 578.2524 2.2E4 579.2593 6.0E4 588.2359 1.1E4 589.2438 2.0E4 591.2239 9.7E4 605.2317 3.1E3 606.1363 4.5E3 606.2473 3.3E5 606.4207 1.3E4 607.2552 1.2E5 END IONS BEGIN IONS FEATURE_ID=701 PEPMASS=607.2556 SCANS=701 RTINSECONDS=860.756 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 7 (4 removed due to low quality, 0 removed due to low cosine). 64.3612 4.9E5 64.3642 9.9E4 67.4716 1.1E6 67.4750 1.9E5 70.2899 1.7E4 70.4406 1.2E4 75.5162 1.3E4 89.4585 1.4E4 89.5828 2.1E4 98.5837 1.9E4 105.9980 1.8E4 125.6782 1.3E4 136.8148 1.7E4 149.7121 1.8E4 151.8077 7.9E4 151.8202 5.3E4 167.5624 2.2E4 173.5198 2.1E4 173.5338 6.3E5 181.1953 1.2E4 184.7210 2.2E4 187.2105 1.9E4 200.1373 1.8E4 200.9558 1.5E4 269.7246 1.7E4 290.1036 1.8E4 340.5361 2.0E4 368.6559 1.3E4 385.0736 1.9E4 385.1823 1.7E4 403.1896 4.4E4 406.9666 1.2E4 417.1693 1.1E5 419.2223 2.6E5 420.2278 4.7E4 431.1859 1.2E5 432.1947 1.3E5 433.2035 3.8E5 442.1753 7.3E4 445.2032 4.3E5 446.2106 1.1E6 447.2183 1.1E6 448.2252 1.3E5 458.2127 2.1E4 459.2173 2.9E5 460.1927 2.8E4 460.2292 3.0E4 461.1987 2.6E5 462.2402 1.3E5 463.2482 9.4E4 473.2003 4.0E5 474.2046 1.5E6 475.2133 1.3E6 476.2211 1.7E5 477.2300 8.3E4 478.2358 3.0E5 479.2416 3.9E4 487.2131 9.5E5 488.2231 8.1E4 489.2296 2.1E4 490.2343 2.0E5 491.2119 5.1E5 501.2286 7.1E5 502.2349 2.7E4 503.2427 8.6E4 504.2171 1.1E5 505.2243 2.4E5 505.4063 1.5E4 506.2317 4.1E5 507.2393 3.8E4 517.2206 7.2E4 517.2327 3.2E4 518.2284 8.7E4 519.2391 1.1E7 520.2493 7.2E4 529.2239 4.2E5 531.2385 4.7E4 532.2104 1.5E5 532.7880 2.1E4 533.2481 2.1E5 534.2265 1.8E5 536.2408 2.0E4 537.2482 2.3E4 539.1992 1.9E4 547.0380 1.0E5 547.2343 1.8E7 548.2379 7.2E5 550.2226 2.1E5 551.2656 4.5E5 557.2213 5.1E4 561.2498 6.8E5 563.2372 1.7E4 564.2356 9.5E4 575.2293 4.2E5 578.2516 1.6E5 579.2609 1.5E7 589.2454 6.4E5 592.2352 3.5E4 607.0236 1.9E5 607.1352 3.7E4 607.2555 3.1E7 608.2554 4.4E4 END IONS BEGIN IONS FEATURE_ID=702 PEPMASS=655.3124 SCANS=702 RTINSECONDS=861.121 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 67.2540 1.2E4 68.8075 5.8E3 68.8102 2.8E4 69.7802 2.3E3 70.8089 2.7E3 70.8128 3.5E3 76.3179 2.4E3 79.9342 2.4E3 81.6575 2.1E3 81.8701 2.2E3 89.9038 2.5E3 89.9786 2.5E3 95.5837 2.3E3 96.7263 2.1E3 102.2553 2.6E3 139.5618 2.4E3 142.0859 2.5E3 168.8846 2.5E3 171.8081 2.6E3 173.5223 2.1E4 173.5402 3.1E4 186.8887 3.0E3 253.1336 7.0E3 292.1797 9.2E3 384.1662 3.2E3 385.8633 2.4E3 389.2097 2.5E3 400.2045 2.6E3 407.2224 2.8E3 420.2268 8.6E3 421.2388 1.3E4 424.1629 9.5E3 427.1851 2.7E3 432.2338 3.0E3 433.2377 4.6E4 434.2499 3.5E3 435.2537 4.1E3 436.2616 7.8E3 445.2395 1.4E4 446.2448 6.5E3 447.2542 1.5E4 448.2616 2.7E4 449.2331 1.5E4 459.2558 7.3E3 460.2256 3.9E4 461.2290 5.6E3 462.2079 6.1E3 463.2126 1.4E5 472.2266 1.1E4 473.2330 7.2E4 474.2401 3.1E4 475.2127 4.7E4 476.2063 2.9E4 477.2277 1.7E5 478.2343 1.2E4 485.2320 1.6E4 487.2488 5.4E4 488.2552 2.7E4 489.2269 1.8E4 490.2359 1.3E4 491.2437 8.9E4 492.2510 4.9E4 493.2552 3.3E3 494.2309 2.9E3 503.2403 3.8E4 504.2126 3.8E3 505.2585 2.8E4 506.2678 3.1E3 507.2130 2.8E3 508.2127 3.2E3 508.2864 1.6E4 509.2907 3.2E4 513.2276 4.8E3 515.2433 7.4E4 517.2238 4.7E4 517.3035 3.0E3 518.2314 1.6E4 519.2731 4.3E4 520.2829 1.1E5 521.2222 7.0E3 522.2166 2.9E3 524.2717 2.9E3 531.2400 5.6E4 532.2491 2.4E4 533.2592 1.0E5 534.2227 1.9E4 535.2374 3.3E4 536.2433 5.3E4 537.2848 4.8E4 538.2531 3.1E3 540.2692 6.3E3 546.2616 2.4E4 547.2684 2.3E4 549.2587 5.3E4 550.2605 3.7E3 550.2725 3.1E3 552.2386 9.4E3 553.2686 1.6E4 559.2687 3.6E5 560.2768 3.8E4 561.2098 4.9E3 561.2859 9.1E5 562.2535 8.3E3 563.2650 5.0E5 564.2728 1.1E6 565.2804 6.5E4 567.2544 3.7E3 575.2264 7.7E3 577.2795 1.7E5 578.2882 2.2E5 579.2637 1.3E4 580.2629 1.3E5 587.2651 3.7E4 588.2473 3.0E3 590.2518 2.7E4 591.2721 1.8E5 593.3123 3.8E5 593.4225 5.7E3 594.2499 2.8E3 595.2740 3.0E3 595.2902 3.2E3 598.2644 3.1E3 605.2752 2.3E5 607.2546 1.2E4 608.2580 1.1E5 609.2905 2.5E4 619.2909 7.9E5 619.3784 1.1E4 620.2855 7.2E3 622.2772 1.2E4 637.2048 2.0E3 637.3018 3.3E5 637.4216 8.7E3 640.2837 1.0E5 655.2741 3.4E3 END IONS BEGIN IONS FEATURE_ID=703 PEPMASS=618.4278 SCANS=703 RTINSECONDS=863.079 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 67.0540 2.4E4 67.8558 2.3E3 68.2037 3.1E3 69.0334 1.2E4 69.0697 1.9E4 71.0489 1.3E4 72.7386 2.4E3 75.0234 2.3E3 76.1461 2.5E3 79.0540 2.9E4 80.0617 2.6E3 81.0696 1.2E5 82.9136 2.1E3 83.0490 3.1E4 83.0853 2.3E5 84.0889 2.8E3 85.0646 1.8E4 86.7814 2.5E3 88.2439 2.7E3 88.6415 2.3E3 89.0479 2.7E3 91.0541 2.9E4 93.0696 9.2E4 95.0490 7.5E4 95.0853 8.8E4 97.0645 6.9E4 99.0439 1.5E4 99.0804 5.9E3 105.0696 1.0E5 106.0776 4.6E3 107.0853 1.5E5 108.0940 5.1E3 109.0646 5.0E4 109.1009 7.0E4 111.0803 2.3E4 113.0597 3.6E3 113.0958 4.2E4 117.0698 1.9E4 118.1133 2.7E3 119.0853 2.1E5 119.0953 2.8E3 120.0929 2.3E4 121.0647 1.8E4 121.1009 1.4E5 121.1107 4.8E3 123.0802 8.7E4 123.1167 1.6E4 123.2940 2.6E3 124.0868 2.5E3 125.0595 3.0E4 125.0959 5.6E4 127.1117 5.5E3 129.0697 2.0E4 130.0767 2.3E3 131.0853 8.6E4 132.0931 2.2E4 133.0647 6.9E3 133.0904 3.2E3 133.1010 1.3E5 134.1089 7.4E3 135.0802 5.7E4 135.1166 6.1E4 137.0601 3.6E3 137.0959 5.0E4 139.0750 2.2E4 139.1115 5.0E4 140.0623 2.6E3 142.0778 1.1E4 143.0853 7.7E4 144.0931 5.6E4 145.0461 2.6E3 145.0651 7.9E3 145.0888 4.4E3 145.1010 2.5E5 145.1142 5.2E3 146.1084 1.9E4 147.0802 7.4E4 147.1166 6.8E4 148.0883 2.6E3 149.0959 5.2E4 149.1325 5.5E3 150.1038 4.3E3 151.0752 6.9E4 151.1115 8.9E3 152.0814 2.7E3 153.0906 2.3E4 153.1269 5.9E3 155.0852 1.9E4 155.1064 3.7E4 156.0935 2.1E4 156.2754 2.4E3 157.0862 3.8E3 157.1010 2.3E5 158.1085 4.9E4 159.0802 2.2E4 159.1166 1.6E5 160.0880 8.7E4 160.1229 1.2E4 161.0959 5.9E4 161.1323 3.9E4 162.1031 3.4E3 163.1116 1.1E5 165.0754 4.7E3 165.0909 3.1E5 165.1267 1.6E4 166.0942 1.2E4 167.1064 3.2E4 167.1425 3.0E3 169.1012 5.5E4 169.1169 3.9E3 170.1087 2.7E4 171.0799 2.8E3 171.1011 1.5E4 171.1167 1.6E5 171.1329 3.7E3 172.0886 2.8E3 172.1244 6.7E4 173.0963 3.0E4 173.1324 8.8E4 173.5281 4.9E4 173.5441 1.4E4 174.1365 2.8E3 175.1117 6.8E4 175.1483 2.0E4 176.1197 1.4E4 177.0910 2.3E4 177.1277 2.7E4 178.0990 1.4E4 179.1061 1.9E4 179.1430 3.2E4 180.1144 2.1E4 181.1017 3.1E4 181.1222 1.4E5 182.1084 1.3E4 182.1261 5.9E3 183.1167 8.3E4 183.1380 2.5E4 184.1243 2.3E4 185.0960 1.3E4 185.1325 9.3E4 186.1389 1.4E4 187.1116 4.7E4 187.1481 6.0E4 189.1272 6.2E4 190.1350 9.2E4 191.0876 2.8E3 191.1064 2.2E4 191.1429 4.4E4 193.1030 1.3E4 193.1221 6.5E4 194.1097 7.8E3 194.1283 2.7E3 195.1166 5.6E4 195.1377 2.8E4 196.1241 1.7E4 197.0972 6.2E3 197.1324 9.8E4 198.1035 1.3E4 198.1396 1.6E4 199.1116 3.1E4 199.1480 4.2E4 200.1187 2.6E3 200.1551 6.8E3 201.1271 3.5E4 201.1658 2.5E3 202.1345 3.1E3 203.1431 1.7E5 204.1460 3.1E3 205.1223 6.0E3 205.1587 5.9E3 207.1167 2.5E4 207.1381 9.2E4 208.1254 1.2E4 208.1456 7.1E4 209.1324 9.1E4 209.1540 1.7E4 210.1391 1.5E4 211.1119 1.9E4 211.1482 7.0E4 212.1543 7.7E3 213.1274 4.2E4 213.1638 2.1E4 214.1354 2.6E3 215.1426 2.6E4 216.1514 1.3E4 217.1228 1.3E4 217.1583 7.5E3 219.1380 5.1E4 220.1451 8.5E3 221.1330 2.9E4 221.1537 4.8E5 222.1582 1.7E4 223.1482 5.0E4 224.1543 1.8E4 225.1262 1.9E4 225.1486 6.3E4 225.1688 6.4E3 227.1425 2.0E4 227.1796 2.8E4 229.1213 6.9E3 229.1586 2.6E4 231.1378 4.3E4 231.1747 2.9E3 233.1317 9.8E3 233.1538 1.1E5 234.1377 4.2E3 234.1612 9.9E4 235.1477 2.3E4 235.1707 4.9E3 236.1541 4.6E3 237.1272 2.4E4 237.1637 4.1E4 239.1428 1.9E4 239.1791 2.1E4 241.1586 2.0E4 243.1379 1.8E4 243.1738 8.3E3 245.1542 2.1E4 246.1617 1.8E4 247.1463 9.7E3 247.1693 1.1E5 248.1770 3.8E3 249.1292 2.5E3 249.1635 2.8E4 250.1712 3.0E3 251.1437 1.3E4 251.1786 2.9E4 252.1863 7.5E3 253.1582 2.4E4 253.1919 5.5E3 255.1739 9.3E3 257.1546 4.1E3 257.1910 3.8E3 259.1692 2.7E4 260.1768 8.5E3 261.1851 2.5E4 263.1428 6.5E3 263.1793 8.0E3 265.1587 1.4E4 265.1951 8.2E3 267.1741 2.2E4 268.1824 6.0E3 269.1554 1.3E4 269.1898 3.9E4 271.1694 2.4E4 272.1770 7.0E3 273.1850 4.9E4 274.1926 3.3E4 275.1762 3.0E3 275.2038 3.4E3 277.1610 7.9E3 277.1956 4.9E3 279.1741 1.9E4 281.1569 3.0E3 281.1906 2.1E4 283.1693 1.6E4 283.2034 3.6E3 285.1850 3.6E4 286.1927 8.4E4 287.2007 5.9E5 287.2379 4.6E3 288.2054 2.9E3 291.2099 1.0E4 293.1883 7.1E3 295.1694 4.3E3 295.2067 8.7E3 297.1847 3.7E4 298.1932 9.2E3 299.2006 1.1E5 300.2078 2.2E4 303.1963 1.6E4 307.2060 1.3E4 309.1850 1.7E4 309.2211 9.4E3 310.1931 1.3E4 311.2003 2.4E4 312.2080 3.4E4 313.2157 6.4E4 319.2058 3.0E4 321.2222 4.9E3 323.2003 1.1E4 325.2160 6.1E4 327.2339 3.3E3 329.2122 2.7E4 337.2160 1.1E5 339.2318 7.6E4 340.2387 1.2E4 347.2380 8.3E3 351.2372 3.2E3 352.1904 4.2E3 352.2394 2.8E5 353.2472 6.7E4 363.2331 3.2E3 365.2469 1.2E5 366.2548 2.5E3 367.2626 2.8E4 377.2478 1.2E4 378.2513 3.8E3 391.2608 1.2E4 395.2582 1.1E5 401.2702 3.1E3 404.7182 2.8E3 426.2755 2.7E3 438.3141 6.5E3 440.2891 5.5E3 467.3163 4.3E3 475.3174 8.3E3 480.3227 3.7E4 505.3308 2.9E3 507.3416 3.2E3 523.3445 3.7E3 523.9589 2.8E3 525.3571 3.7E4 526.3591 1.7E4 538.3645 1.4E5 542.2230 3.2E3 568.6686 2.5E3 603.4036 6.6E3 618.4187 3.7E3 END IONS BEGIN IONS FEATURE_ID=704 PEPMASS=662.4396 SCANS=704 RTINSECONDS=866.775 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 67.0539 1.6E5 68.7063 2.3E3 69.0695 1.5E5 71.0488 2.1E4 71.0852 2.2E4 73.0644 6.8E3 74.7076 2.3E3 79.0538 4.6E4 81.0645 4.4E3 81.0695 2.7E5 83.0490 1.5E4 83.0851 2.2E5 85.0645 2.0E4 85.1013 1.0E4 91.0539 2.4E4 93.0694 1.1E5 94.2652 2.4E3 95.0849 2.1E5 97.0644 6.2E4 97.1008 7.7E4 98.1096 2.3E3 98.9838 2.7E3 99.0800 1.6E4 101.0594 1.4E4 101.1919 2.3E3 105.0694 2.1E4 107.0850 1.1E5 109.1007 1.3E5 111.0800 6.4E4 111.1163 9.0E3 111.8207 3.0E3 112.2287 2.3E3 113.0951 2.2E3 115.0749 2.0E4 119.0851 2.2E4 120.1241 2.4E3 121.1007 9.1E4 123.1165 8.9E4 125.0957 4.1E4 125.1323 1.1E4 129.0908 1.2E4 129.1013 2.3E3 133.1007 3.9E4 135.1164 3.8E4 137.1321 2.7E4 144.3913 2.4E3 147.1166 3.0E4 149.1320 3.5E5 149.1456 8.8E3 151.1480 1.2E4 153.1274 8.1E3 155.0099 2.2E4 157.0074 2.2E3 161.1323 2.9E4 163.1479 2.7E4 167.1427 1.9E5 170.4805 3.0E3 173.1326 2.5E3 173.5292 2.4E4 173.5389 1.5E4 175.1478 2.7E4 177.1633 5.9E3 185.1532 3.0E4 189.1639 7.8E3 194.4064 2.6E3 200.3086 2.7E3 203.1783 3.6E3 207.2292 2.3E3 228.1956 8.0E4 236.1136 2.6E3 241.1794 1.8E5 245.2262 2.6E4 259.1897 5.4E4 263.2362 6.4E4 306.2784 2.0E4 315.9813 2.5E3 319.2638 3.2E3 337.2734 6.2E4 338.0286 2.7E3 371.5030 3.1E3 429.3712 8.4E3 438.1466 2.4E3 447.3820 1.2E4 521.3519 2.5E3 521.4195 3.9E5 521.5096 1.1E4 END IONS BEGIN IONS FEATURE_ID=705 PEPMASS=450.3194 SCANS=705 RTINSECONDS=870.437 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 56.6456 2.3E3 59.9764 2.2E3 67.2533 2.3E3 67.3698 2.2E3 67.9109 2.2E3 68.6333 2.2E3 69.0698 2.9E3 69.4121 3.2E3 69.6518 2.7E3 69.9910 2.5E3 72.1374 2.7E3 73.4958 2.3E3 78.4473 2.7E3 80.2023 2.8E3 111.3227 2.3E3 129.5705 2.4E3 152.8022 2.4E3 155.3170 2.8E3 163.6223 2.6E3 173.5219 5.4E4 173.5412 4.7E4 225.4874 2.5E3 232.4184 2.3E3 252.1475 2.8E3 265.4109 2.5E3 358.3079 4.3E4 360.3238 1.2E5 376.3151 3.8E3 404.3168 4.9E3 450.3204 5.1E4 END IONS BEGIN IONS FEATURE_ID=706 PEPMASS=375.2686 SCANS=706 RTINSECONDS=870.521 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 53.0384 1.0E4 53.6649 2.3E3 54.2354 2.4E3 55.0177 1.1E4 55.0540 6.6E4 57.0697 1.2E4 57.2498 2.3E3 58.8221 2.1E3 59.8986 2.2E3 60.2064 2.4E3 60.4260 2.2E3 65.0385 7.4E3 67.0539 1.1E5 69.0333 6.2E3 69.0695 7.2E4 71.0490 5.4E3 77.0384 5.3E3 77.3006 2.2E3 77.3195 2.2E3 79.0539 1.3E5 81.0696 2.6E5 83.0487 1.6E4 83.0852 2.1E4 90.9762 6.2E3 91.0483 4.2E3 91.0539 1.5E5 93.0631 4.4E3 93.0696 4.5E5 93.0767 5.6E3 95.0488 1.7E5 95.0784 3.4E3 95.0852 2.3E5 97.0645 4.5E4 99.9282 2.5E3 102.1068 2.3E3 103.0539 7.3E3 103.2764 2.2E3 105.0445 1.1E4 105.0616 5.4E3 105.0696 4.2E5 105.0783 8.0E3 107.0488 4.5E3 107.0772 4.9E3 107.0852 2.6E5 109.0645 5.5E4 109.1009 1.2E5 115.0540 8.3E3 117.0696 7.8E4 119.0755 7.5E3 119.0852 4.0E5 119.0932 2.8E3 119.1264 2.5E3 121.0553 3.2E3 121.0646 9.7E4 121.0910 4.7E3 121.1009 3.4E5 121.1105 4.9E3 123.0804 2.9E4 123.1165 1.5E4 128.0618 2.0E4 129.0697 4.8E4 130.0775 2.3E4 131.0853 2.4E5 132.0934 6.5E3 133.0648 8.9E3 133.0763 3.3E3 133.1010 2.2E5 133.1126 7.8E3 133.6161 2.3E3 133.9843 2.4E3 134.5590 2.2E3 135.0803 1.3E4 135.1166 6.6E4 141.0696 1.7E4 142.0776 7.2E4 143.0853 1.4E5 144.0931 4.5E4 145.1010 3.4E5 145.1144 5.1E3 146.1086 1.2E4 147.0802 1.6E4 147.1166 9.3E4 149.0956 2.9E3 153.0691 3.1E3 154.0761 3.8E3 155.0854 4.4E4 156.0931 4.3E4 157.0863 8.0E3 157.1010 2.2E5 157.1981 2.5E3 158.1089 3.0E4 159.0803 2.0E4 159.1167 1.7E5 161.0961 6.8E4 161.1326 2.2E4 161.9151 2.4E3 164.9541 3.0E3 165.0706 3.1E3 167.0857 1.5E4 168.0937 1.4E4 169.1012 7.4E4 170.0919 3.0E3 170.1090 2.2E4 171.0807 2.7E3 171.1169 8.4E4 172.0886 3.0E3 172.1245 1.4E4 173.0961 8.6E3 173.1327 8.2E4 173.5200 3.3E3 173.5348 5.6E4 175.1117 1.3E4 175.1486 2.6E4 179.0856 2.2E4 180.0935 1.2E4 181.1013 3.8E4 182.1094 2.1E4 183.1171 6.4E4 184.1253 9.2E3 185.0953 3.5E3 185.1327 3.8E4 187.1112 1.2E4 187.1482 3.1E4 189.1641 2.5E3 193.1013 2.3E4 194.1090 2.2E4 195.0998 2.8E3 195.1170 4.9E4 196.1250 2.5E4 197.0979 2.6E3 197.1326 5.4E4 198.1412 3.1E3 199.1485 3.7E4 201.1638 9.7E3 206.1089 1.1E4 207.1177 2.1E4 208.1243 1.2E4 209.1121 2.4E3 209.1327 4.5E4 210.1412 6.9E3 210.4746 2.4E3 211.1485 2.8E4 213.1641 6.8E3 217.5684 2.6E3 220.1249 1.5E4 221.1328 2.0E4 223.1484 2.6E4 225.1641 5.0E3 230.1528 2.5E3 233.1319 3.4E3 235.1486 1.1E4 237.1640 1.1E4 239.1792 2.8E3 247.1487 3.0E3 249.1647 5.8E3 251.1800 6.4E3 253.1962 3.3E3 265.1946 5.4E3 273.1641 5.7E3 275.1795 6.9E3 277.1934 3.4E3 375.2707 1.7E4 END IONS BEGIN IONS FEATURE_ID=707 PEPMASS=556.4427 SCANS=707 RTINSECONDS=872.923 CHARGE=1+ MSLEVEL=2 MERGED_STATS=11 / 11 (0 removed due to low quality, 0 removed due to low cosine). 63.6348 2.2E3 63.9463 2.4E3 64.5945 2.2E3 66.7860 2.4E3 67.0322 2.3E3 69.0698 7.9E3 69.0899 2.6E3 69.1444 2.5E3 71.0852 1.6E5 71.3000 2.2E3 71.3450 2.4E3 72.3587 2.1E3 72.7277 2.6E3 73.0645 4.9E4 73.4220 2.6E3 76.0934 2.3E3 79.1692 2.3E3 80.2882 2.5E3 85.1009 1.2E5 87.0437 8.1E4 88.0928 2.6E3 88.3301 2.5E3 88.3511 2.3E3 89.0593 1.4E6 89.9783 2.5E3 97.1010 6.0E3 97.8307 2.5E3 101.4848 2.5E3 103.6006 2.9E3 107.5557 2.3E3 108.0143 2.4E3 109.0457 2.3E3 109.6088 2.5E3 114.6372 2.7E3 115.7412 2.6E3 116.5263 2.4E3 116.5791 2.5E3 117.0905 1.9E4 120.4111 2.5E3 122.5455 2.3E3 123.2110 2.8E3 125.8813 2.2E3 126.7182 2.5E3 128.0425 2.7E3 133.0856 6.1E5 133.0974 2.9E3 141.2420 2.4E3 143.6237 2.1E3 144.9481 2.2E3 154.5387 2.7E3 156.8410 2.2E3 157.3581 2.7E3 158.1411 2.4E3 158.8014 2.5E3 163.9922 2.4E3 166.5834 2.3E3 166.6770 2.6E3 173.5217 4.3E3 173.5311 1.8E5 173.5413 3.2E4 173.6781 2.5E3 176.5156 2.3E3 177.1122 1.1E5 180.6423 3.1E3 181.4204 2.8E3 186.3326 2.5E3 187.1971 2.3E3 188.0613 2.3E3 197.7936 2.2E3 204.8513 2.2E3 206.3274 2.8E3 207.1715 2.5E3 220.3831 2.2E3 221.1389 2.8E3 222.0249 2.7E3 239.2774 2.6E3 242.1600 2.5E3 252.9249 2.5E3 267.7156 2.8E3 269.0202 2.6E3 278.3387 3.3E3 289.8536 2.3E3 295.1055 2.3E3 295.2356 2.2E3 300.8463 2.2E3 314.4137 2.4E3 329.3949 2.7E3 353.7488 2.6E3 362.3131 2.7E3 369.4335 2.3E3 371.0482 2.3E3 384.9138 2.3E3 411.4056 3.1E3 459.6488 2.6E3 493.6261 2.8E3 516.4650 2.4E3 533.5670 2.5E3 END IONS BEGIN IONS FEATURE_ID=708 PEPMASS=583.4153 SCANS=708 RTINSECONDS=875.973 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 4 (1 removed due to low quality, 0 removed due to low cosine). 65.0384 2.5E3 67.0539 2.1E4 69.0333 3.0E3 69.0695 2.5E4 74.4058 2.6E3 79.0538 1.8E4 81.0695 6.0E4 83.0489 1.5E4 83.0853 1.6E4 83.3739 2.5E3 85.0644 1.5E4 91.0538 2.7E4 93.0640 2.6E3 93.0694 9.1E4 94.2230 2.7E3 95.0489 7.7E3 95.0794 3.4E3 95.0851 9.5E4 97.0647 7.4E3 105.0695 7.9E4 107.0785 3.6E3 107.0851 9.6E4 109.0646 1.4E4 109.1008 5.5E4 111.0800 6.2E3 113.0966 2.5E3 117.0696 1.4E4 119.0768 4.1E3 119.0851 1.4E5 121.0644 3.1E3 121.1008 1.2E5 123.0800 3.0E4 123.1164 1.8E4 125.0594 1.0E4 129.0698 1.4E4 130.0767 2.5E3 131.0852 6.4E4 133.0643 2.9E3 133.1007 8.8E4 133.5215 2.4E3 135.0802 2.3E4 135.1165 3.1E4 137.0957 3.1E4 137.6161 2.2E3 139.0750 2.9E3 142.0773 1.4E4 143.0852 6.5E4 144.0930 1.0E4 145.0907 2.7E3 145.1008 1.2E5 147.0801 4.9E4 147.1165 4.7E4 149.0960 1.4E4 149.1324 1.2E4 151.0749 5.7E4 153.0911 3.6E3 155.0853 1.7E4 156.0933 1.8E4 157.1008 1.3E5 158.1087 1.6E4 159.0808 9.2E3 159.1166 7.2E4 161.0960 1.5E4 161.1323 2.7E4 163.0749 4.3E3 163.1114 2.6E4 165.0908 1.8E5 167.0856 1.0E4 167.1064 2.6E4 168.0937 3.4E3 169.1011 5.6E4 170.1094 1.1E4 171.1167 9.1E4 173.0961 7.8E3 173.1324 7.3E4 173.5268 6.7E4 173.5449 1.4E4 175.1120 9.0E3 175.1479 2.1E4 177.0913 7.4E3 179.0857 1.1E4 180.0928 2.4E3 181.1011 2.9E4 181.1203 1.2E4 182.1086 1.4E4 183.1167 6.5E4 184.1247 1.1E4 185.1323 6.7E4 187.1112 6.3E3 187.1479 1.8E4 189.1273 2.4E4 190.0534 2.2E3 191.1425 1.9E4 193.1009 1.4E4 194.1086 2.2E4 195.1166 4.6E4 195.1347 2.7E3 196.1244 1.3E4 196.6345 2.4E3 197.1323 6.6E4 199.1480 4.6E4 201.1289 3.3E3 201.1634 6.5E3 201.4132 3.2E3 203.1430 9.0E4 205.1007 5.6E3 205.1604 3.3E3 206.1088 6.1E3 207.1166 4.3E4 207.1381 2.6E4 208.1244 1.6E4 209.1324 8.0E4 210.1404 3.7E3 211.1482 4.0E4 212.1542 2.4E3 213.1273 5.9E3 213.1642 1.8E4 215.1429 7.1E3 217.1584 7.6E3 219.1174 1.2E4 220.1241 6.8E3 221.0810 3.3E3 221.1322 3.4E4 221.1537 2.0E5 222.1409 4.9E3 223.1481 4.9E4 224.1562 7.6E3 225.1644 1.3E4 227.1423 5.7E3 229.1584 8.4E3 231.1751 8.3E3 232.1248 3.3E3 232.6207 2.5E3 233.1321 2.2E4 233.1555 1.0E4 234.1403 8.6E3 235.1482 3.7E4 236.1559 5.6E3 237.1639 2.7E4 239.1798 1.0E4 241.4748 2.7E3 245.1324 1.1E4 246.1405 1.0E4 247.1481 2.5E4 248.1553 8.7E3 249.1635 3.0E4 251.1797 1.9E4 253.1956 1.4E4 255.1740 4.2E3 257.1898 6.6E3 259.1468 1.4E4 260.1552 1.1E4 261.1634 2.8E4 262.1719 7.0E3 263.1796 2.1E4 265.1949 2.0E4 269.1897 8.3E3 271.2059 9.2E3 273.1633 1.2E4 274.1710 3.6E3 275.1796 3.1E4 277.1956 1.4E4 279.1743 3.5E3 279.2102 8.3E3 281.1897 7.5E3 281.2956 9.3E4 282.2796 3.5E5 283.2067 2.0E4 283.2827 3.8E5 286.1954 6.9E3 287.2024 1.6E4 289.1946 1.4E4 291.1762 3.2E3 295.2059 1.8E4 297.2222 1.8E4 299.1774 2.9E3 299.3060 1.0E5 300.3093 1.1E5 301.1954 1.1E4 303.3488 2.5E3 305.6135 2.5E3 306.3665 2.4E3 307.2039 3.2E3 309.2233 2.8E3 311.1786 2.9E3 313.1968 2.9E3 315.2105 4.1E3 316.3167 2.8E3 327.5506 2.6E3 329.2270 6.6E3 347.2370 4.1E3 349.2539 5.9E3 357.2608 2.9E3 365.2451 1.0E4 375.2680 1.6E4 403.3002 3.2E4 491.3516 3.0E3 503.3516 1.9E4 520.0040 2.7E3 538.5380 2.9E3 565.4040 2.2E4 583.4148 2.2E4 END IONS BEGIN IONS FEATURE_ID=709 PEPMASS=600.4179 SCANS=709 RTINSECONDS=876.069 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 7 (4 removed due to low quality, 0 removed due to low cosine). 63.6405 5.1E3 66.5057 5.3E3 67.0542 9.4E4 69.0334 1.0E5 69.0698 8.6E4 71.0491 2.3E4 74.1419 4.4E3 79.0542 1.1E5 80.0619 6.8E3 81.0698 3.1E5 82.8982 5.2E3 83.0491 1.6E5 83.0855 8.1E4 85.0647 5.5E4 87.0440 1.7E4 89.0597 1.0E5 91.0543 1.4E5 92.6938 5.1E3 93.0699 5.6E5 95.0491 2.1E5 95.0855 3.9E5 95.8176 5.4E3 96.9698 5.6E3 97.0647 1.2E5 97.1014 5.1E3 99.0444 1.1E4 103.0551 8.1E3 105.0698 4.9E5 105.0766 3.9E3 106.0777 2.9E4 107.0490 3.3E4 107.0855 6.1E5 107.0923 4.2E3 108.0568 5.9E3 108.0930 1.3E4 109.0648 1.8E5 109.1012 2.5E5 111.0438 2.0E4 111.0804 1.0E5 113.0962 3.3E4 117.0698 7.6E4 118.7400 4.4E3 119.0491 1.4E4 119.0855 7.3E5 119.0970 1.8E4 120.0933 5.3E4 120.1032 5.4E3 121.0648 1.2E5 121.0909 8.7E3 121.1011 7.4E5 122.0727 2.4E4 122.1048 1.7E4 123.0804 3.8E5 123.1169 8.4E4 124.0886 7.2E3 125.0596 1.2E5 125.0961 1.4E5 128.0626 1.9E4 129.0699 8.3E4 130.0774 1.8E4 130.5652 5.6E3 131.0855 3.1E5 132.0930 4.8E4 133.0647 9.6E4 133.0862 5.9E4 133.1012 5.5E5 134.0727 6.7E3 134.1083 2.6E4 135.0688 7.3E3 135.0804 3.3E5 135.1168 2.7E5 136.0876 6.9E3 137.0598 5.0E4 137.0961 2.0E5 139.0751 8.5E4 139.1117 5.5E4 141.0703 2.3E4 142.0777 5.6E4 143.0856 4.4E5 144.0932 1.7E5 145.0651 1.7E4 145.1012 7.7E5 145.1143 1.1E4 146.0732 1.4E4 146.1082 5.0E4 147.0673 1.1E4 147.0805 4.4E5 147.1168 2.3E5 148.0881 3.6E4 149.0961 2.6E5 149.1326 4.6E4 150.1036 2.7E4 151.0754 4.0E5 151.1119 5.9E4 152.0824 3.2E4 153.0911 6.6E4 155.0855 8.3E4 155.1070 2.9E4 156.0932 1.0E5 157.0860 1.9E4 157.1012 9.3E5 157.1166 5.8E3 158.1088 1.8E5 159.0806 1.6E5 159.1169 6.0E5 160.0884 6.4E4 160.1224 2.5E4 161.0962 4.1E5 161.1326 1.9E5 162.1032 4.7E4 163.0757 3.2E4 163.1118 4.2E5 164.1187 5.9E3 165.0776 6.9E3 165.0912 1.2E6 165.1258 1.3E4 166.0946 3.1E4 167.0705 9.3E3 167.0863 2.1E4 167.1068 2.7E5 167.1422 6.5E3 168.0936 5.9E3 168.1101 1.2E4 169.1014 2.6E5 170.1089 1.2E5 171.0810 4.4E4 171.1170 6.1E5 171.1300 3.9E3 172.0881 1.6E4 172.1245 2.2E5 173.0963 1.9E5 173.1125 5.7E3 173.1149 2.4E4 173.1328 3.3E5 173.5290 1.0E5 173.5423 1.0E4 174.1036 3.5E4 174.1391 3.4E4 175.1120 3.8E5 175.1483 1.3E5 176.1193 3.1E4 177.0912 9.1E4 177.1277 1.2E5 178.0987 4.5E4 179.0870 3.4E4 179.1069 1.3E5 179.1433 1.7E4 180.0949 1.3E4 180.1149 7.1E4 181.0855 3.9E4 181.1016 1.2E5 181.1226 1.7E5 182.1088 4.5E4 183.1170 3.5E5 184.1240 8.4E4 185.0959 7.4E4 185.1326 4.8E5 186.1038 3.2E4 186.1399 6.7E4 187.1119 1.6E5 187.1483 1.3E5 188.1192 3.3E4 189.0939 7.2E3 189.1276 3.1E5 190.1352 2.7E5 191.1069 9.6E4 191.1430 1.2E5 193.1012 9.4E4 193.1225 2.2E5 194.1088 5.3E4 195.1169 3.0E5 195.1379 5.1E4 196.1243 7.3E4 197.0963 7.1E4 197.1135 1.8E4 197.1326 4.1E5 198.1039 4.6E4 198.1396 5.8E4 199.1119 1.7E5 199.1483 1.9E5 200.1191 3.0E4 200.1550 1.7E4 201.0913 1.1E4 201.1276 1.8E5 201.1635 2.7E4 202.1354 2.5E4 203.1082 3.8E4 203.1432 8.3E5 203.1648 1.1E4 204.1468 8.4E3 205.1024 1.3E4 205.1229 6.3E4 205.1594 6.6E3 206.1091 2.7E4 207.1168 1.9E5 207.1384 3.7E5 208.1242 7.8E4 208.1459 8.7E4 209.0976 1.6E4 209.1326 3.3E5 209.1540 6.1E4 210.1036 7.8E3 210.1399 7.6E4 211.1120 1.1E5 211.1484 2.5E5 212.1188 5.0E4 212.1554 2.8E4 213.1063 7.5E3 213.1276 2.1E5 213.1639 7.9E4 214.1354 2.9E4 215.1065 6.5E4 215.1435 1.2E5 216.1507 5.3E4 217.1225 5.4E4 217.1593 4.8E4 218.1666 1.3E4 219.1169 4.4E4 219.1383 1.9E5 220.1239 4.0E4 220.1458 8.5E3 221.1324 1.7E5 221.1539 1.3E6 222.1390 4.7E4 222.1593 2.6E4 223.1116 6.1E4 223.1484 2.3E5 224.1192 6.9E3 224.1551 3.9E4 225.1275 1.5E5 225.1640 1.7E5 226.1334 1.8E4 226.1701 6.7E3 227.1070 5.6E3 227.1432 1.1E5 227.1798 3.9E4 228.1511 2.1E4 229.1224 5.6E4 229.1590 9.3E4 230.1293 3.5E4 231.1383 6.1E4 231.1737 1.1E4 232.1237 2.6E4 232.1463 1.3E4 233.1319 6.4E4 233.1540 4.9E5 234.1395 2.9E4 234.1606 1.6E5 235.1482 2.0E5 235.1715 2.8E4 236.1557 4.5E4 237.1257 6.5E4 237.1491 3.2E5 238.1716 2.5E4 239.1433 1.0E5 239.1795 8.0E4 240.1501 2.8E4 241.1257 1.3E4 241.1589 9.7E4 242.1633 5.4E3 243.1381 6.6E4 243.1731 3.5E4 245.1315 4.0E4 245.1548 4.0E4 246.1390 4.8E4 246.1632 2.8E4 247.1460 7.6E4 247.1701 1.7E5 248.1397 7.7E3 248.1552 2.2E4 249.1300 2.9E4 249.1637 1.7E5 250.1615 5.5E3 251.1432 6.8E4 251.1795 9.0E4 252.1513 1.3E4 252.1875 1.4E4 253.1587 1.7E5 253.1899 2.6E4 254.1672 7.1E3 255.1431 2.9E4 255.1743 4.2E5 255.2036 3.7E3 256.1818 9.2E3 257.1539 4.4E4 257.1892 3.8E4 258.1647 6.0E3 259.1459 5.0E4 259.1697 8.8E4 260.1532 1.7E4 261.1633 2.1E5 261.1874 1.9E4 262.1706 2.8E4 263.1418 3.6E4 263.1790 1.2E5 264.1510 6.0E3 264.1857 1.3E4 265.1586 7.2E4 265.1950 6.0E4 266.1668 1.4E4 267.1420 7.6E3 267.1743 9.9E4 268.1814 6.2E4 269.1545 4.1E4 269.1900 1.0E5 270.1966 2.5E4 271.1695 1.7E5 272.1801 1.7E4 273.1586 1.1E4 273.1855 8.9E4 274.1928 1.2E5 275.1447 1.3E4 275.1796 6.2E4 276.1514 5.4E3 276.1856 3.1E4 277.1592 3.9E4 277.1950 8.0E4 279.1747 1.9E5 279.2074 8.9E3 281.1560 3.1E4 281.1905 1.5E5 282.1970 2.7E4 283.1710 2.7E4 283.2050 2.2E4 284.1806 5.9E3 285.1850 1.6E5 286.1929 2.6E5 287.2010 1.9E5 289.1944 6.4E4 291.1741 4.9E4 291.2106 3.9E4 293.1909 5.1E4 294.1979 7.6E4 295.1710 3.2E4 295.2062 1.5E5 296.1763 9.1E3 297.1851 1.5E5 298.1937 3.2E4 299.2008 2.3E5 300.2105 2.5E4 301.1946 4.6E4 303.1961 6.2E5 305.1900 3.2E4 305.2264 1.8E4 307.2064 5.5E4 309.1847 5.8E4 309.2218 3.9E4 310.1934 6.4E4 311.2002 7.2E4 312.2085 7.4E4 313.2160 1.5E5 315.2106 2.6E4 317.1899 2.1E4 317.2274 6.9E3 319.2059 1.1E5 320.2122 6.5E3 321.2219 3.2E4 322.2293 4.0E4 323.2004 2.7E4 325.2164 1.9E5 329.1885 6.4E3 329.2275 2.5E4 331.2047 2.3E4 332.2133 6.2E3 333.2221 3.2E4 334.2317 1.3E4 335.2009 1.4E4 335.2392 6.3E3 337.2163 3.5E5 339.2324 2.7E4 341.2260 2.8E4 345.2204 2.0E4 347.2373 5.5E4 349.2163 3.1E4 350.2239 7.3E3 351.2311 3.9E4 352.1898 2.3E4 352.2396 8.1E5 352.2787 6.2E3 353.2475 1.7E4 359.2365 3.5E4 362.2248 5.8E3 363.2317 4.0E4 365.2472 3.5E5 369.2590 6.3E3 373.2585 6.0E3 375.1802 6.0E3 377.2470 6.8E4 378.2533 9.3E3 379.2638 1.0E4 381.2444 2.3E4 383.2573 9.0E3 387.2700 2.6E4 391.2610 1.5E4 399.2536 1.6E4 401.2793 6.0E3 405.2769 2.8E4 419.2941 2.9E4 420.3005 1.9E4 421.2749 1.6E4 437.3053 2.8E4 439.2842 1.9E4 469.3087 4.4E4 487.3196 1.9E5 493.3284 1.4E4 502.3434 4.5E4 503.3509 2.3E5 505.3302 1.3E5 507.3446 5.6E4 508.3493 3.2E4 520.3526 8.5E4 567.3779 2.3E4 583.4082 6.7E3 585.3911 3.4E4 600.4090 1.7E4 END IONS BEGIN IONS FEATURE_ID=710 PEPMASS=468.3901 SCANS=710 RTINSECONDS=876.87 CHARGE=1+ MSLEVEL=2 MERGED_STATS=14 / 14 (0 removed due to low quality, 0 removed due to low cosine). 57.0696 2.6E5 58.0328 2.5E3 59.0522 2.1E3 62.0598 3.7E4 62.3853 2.1E3 62.4616 2.2E3 64.7231 2.4E3 65.7747 2.4E3 65.8992 2.3E3 69.0696 6.8E3 69.2175 2.6E3 70.2588 2.2E3 70.4875 2.5E3 70.6423 2.5E3 71.0816 2.7E3 71.0852 2.4E5 71.6913 2.4E3 72.7068 2.5E3 72.9276 2.3E3 73.0285 3.1E3 73.0645 5.3E4 74.1790 2.5E3 74.2247 2.6E3 74.4437 2.3E3 75.4227 2.5E3 75.5181 2.5E3 75.7171 2.6E3 76.8783 3.0E3 78.8190 2.3E3 81.0693 3.0E3 81.8885 2.2E3 82.4723 2.1E3 83.0853 1.1E4 84.0803 2.7E3 85.0736 2.2E3 85.1009 1.6E5 85.5361 2.4E3 87.0437 4.9E4 89.0593 2.2E6 89.0652 3.0E3 89.6243 2.5E3 89.9627 2.6E3 92.2390 2.6E3 93.7001 2.3E3 95.0998 2.5E3 97.1010 1.4E4 102.0912 4.6E4 102.6038 2.4E3 103.0772 2.3E3 108.9409 2.3E3 109.3227 2.3E3 109.8004 2.1E3 110.5479 2.2E3 114.6219 2.5E3 117.0906 6.6E3 123.1158 2.5E3 127.5020 2.3E3 130.0225 2.4E3 131.0564 2.8E3 133.0757 2.3E3 133.0856 8.4E5 133.3194 2.5E3 140.3823 2.5E3 153.6902 2.4E3 154.6106 2.2E3 165.8545 2.3E3 166.8971 2.8E3 167.4249 3.4E3 173.5264 1.7E5 173.5407 1.3E5 174.0763 2.1E3 177.1120 1.2E5 180.9183 2.3E3 181.9723 2.9E3 194.9673 2.6E3 195.1227 2.0E4 198.1596 2.3E3 198.6374 2.7E3 201.6724 2.5E3 204.2524 2.3E3 209.4137 2.6E3 214.0156 2.8E3 215.0929 2.7E3 219.3402 2.6E3 223.6161 3.0E3 224.8169 2.2E3 224.9581 2.6E3 235.7531 2.5E3 236.9223 2.4E3 238.6338 2.4E3 239.1490 1.7E4 252.2968 2.3E3 263.0527 2.5E3 273.8805 2.3E3 278.0719 2.8E3 283.1753 3.0E4 293.5317 2.3E3 301.5775 3.0E3 303.2363 2.6E3 309.9779 2.3E3 311.2947 1.1E5 324.8710 2.5E3 328.3196 7.9E3 345.5169 2.6E3 348.2979 2.5E3 358.9326 2.4E3 368.3524 2.3E5 370.1462 3.0E3 398.6151 2.6E3 451.2588 2.7E3 454.3332 2.4E3 468.4413 2.6E4 END IONS BEGIN IONS FEATURE_ID=711 PEPMASS=607.2559 SCANS=711 RTINSECONDS=877.955 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 64.3611 2.6E4 64.3641 7.5E3 67.4716 4.3E4 67.4750 1.3E4 71.9271 2.2E3 74.4160 2.2E3 75.2569 2.0E3 77.4665 2.2E3 80.1174 2.4E3 84.2249 3.6E3 92.4907 2.4E3 103.2732 2.8E3 114.8313 2.4E3 125.1089 4.2E3 136.8027 1.7E4 136.8143 1.6E4 149.0430 2.4E3 154.4131 2.8E3 156.8804 3.9E3 162.5833 2.3E3 173.5259 5.6E4 173.5358 4.9E4 173.5439 1.6E4 184.8444 3.7E3 195.0664 2.6E3 208.4838 2.6E3 228.4022 2.2E3 230.9463 2.3E3 246.6128 2.6E3 273.1955 2.6E3 309.7601 3.1E3 327.6839 2.7E3 364.6800 2.5E3 395.6231 2.9E3 417.1686 9.0E3 418.2251 4.3E3 419.2244 3.8E4 420.4280 2.4E3 431.1875 2.0E4 432.1933 1.4E4 433.2027 2.7E4 445.2023 4.3E4 446.2102 9.9E4 446.2711 5.0E3 447.2183 1.8E5 448.2288 9.8E3 454.0830 2.5E3 459.2186 2.4E4 460.1895 3.5E3 461.1962 2.3E4 462.2416 1.2E4 463.2486 3.5E4 473.1988 4.6E4 473.2387 3.7E3 474.2055 2.8E5 475.2132 4.4E5 476.2163 1.1E4 477.2351 4.0E3 478.2340 1.8E4 487.2126 1.1E5 488.2208 2.2E4 489.2231 4.3E3 490.2366 5.9E4 491.2409 5.5E4 501.2286 1.2E5 502.2319 9.2E3 503.2428 3.8E4 504.2177 9.6E3 505.2243 3.4E4 506.2316 6.0E4 517.2245 2.7E4 518.2309 2.3E4 519.1447 5.0E3 519.2391 1.1E6 529.2236 5.7E4 532.2124 3.2E4 533.2550 1.9E4 534.2234 9.1E3 545.2162 4.7E3 546.2419 2.7E3 546.9254 6.6E3 546.9811 1.1E4 547.0379 6.0E4 547.0774 5.1E4 547.2341 8.4E6 547.4331 5.5E4 548.2369 3.8E4 550.2233 9.3E3 551.2647 4.2E4 561.2501 1.9E5 564.2317 7.8E3 575.2308 3.3E4 576.4371 2.9E3 578.2514 8.0E3 579.1527 3.3E3 579.2608 9.1E5 579.3668 9.3E3 589.2459 1.2E5 607.1672 4.2E3 607.2555 1.4E6 END IONS BEGIN IONS FEATURE_ID=712 PEPMASS=653.2975 SCANS=712 RTINSECONDS=877.955 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 5 (0 removed due to low quality, 0 removed due to low cosine). 76.0693 2.2E3 77.0893 2.2E3 82.1199 2.3E3 82.3096 2.6E3 83.0421 2.2E3 83.2445 2.8E3 84.0867 2.3E3 84.2879 2.5E3 87.4587 2.6E3 89.3597 2.4E3 91.2201 2.2E3 95.0870 2.5E3 102.7197 2.4E3 102.9787 2.4E3 109.2208 2.8E3 111.1118 2.7E3 121.4560 2.9E3 129.0442 2.4E3 134.0598 2.4E4 150.3756 2.8E3 159.4981 2.9E3 161.9900 2.2E3 166.0853 2.8E3 173.5228 2.1E4 173.5354 1.1E5 181.2847 2.7E3 184.3219 2.4E3 195.4821 2.6E3 201.8114 2.7E3 204.0649 1.7E4 210.9771 2.7E3 226.1472 3.2E3 237.1384 8.5E3 238.1463 1.3E4 239.1542 9.2E3 240.1625 3.7E3 251.1544 9.5E3 252.1627 3.3E3 253.1700 8.3E3 263.7910 3.1E3 279.1497 4.8E4 287.9718 2.4E3 307.1068 5.9E3 313.1177 8.6E3 337.1091 2.4E3 338.5232 2.6E3 339.1328 1.9E4 351.1330 3.4E3 361.7596 2.6E3 375.1013 2.4E3 410.2119 6.1E3 414.9865 2.4E3 430.1740 2.9E3 440.1616 3.2E3 446.2050 3.4E3 450.2060 2.9E3 451.2150 1.5E4 457.2404 2.6E3 458.2235 2.8E3 460.1919 2.6E3 468.2149 6.9E3 477.1971 3.6E3 478.1962 8.6E3 478.2097 2.8E3 479.2068 1.2E4 482.2308 2.6E4 483.2392 4.2E4 486.2019 6.7E4 487.2121 1.3E4 488.2179 2.0E4 505.2253 1.1E4 508.2613 1.2E4 509.2437 3.4E3 509.2564 3.9E3 510.2569 1.9E4 515.2073 6.1E3 516.0100 2.7E3 519.2381 4.3E3 520.2420 2.8E3 523.2698 2.5E5 529.2233 1.7E4 533.2327 4.0E3 533.2519 2.0E4 534.2294 1.2E4 535.2696 1.9E4 536.2502 1.7E4 537.2373 6.6E3 540.2843 8.8E3 547.2394 1.2E4 549.2853 8.2E3 550.2595 8.1E3 551.2651 4.8E5 552.2522 6.0E3 555.2913 7.2E3 561.2493 3.4E4 564.2381 3.2E3 565.2801 1.5E5 568.2692 8.0E3 575.2653 3.0E5 577.2837 2.7E3 578.2528 1.2E4 579.2605 3.7E5 580.2690 1.4E4 582.2803 9.1E3 583.1832 5.3E3 583.2915 5.4E5 583.4000 5.1E3 593.2749 1.2E5 594.2662 3.9E3 603.2619 3.0E4 607.2861 1.0E4 609.3076 8.6E3 610.2779 4.8E4 611.2868 3.0E5 621.2706 5.0E4 625.3009 4.0E4 635.2859 3.9E4 638.2725 9.4E3 649.6039 2.6E3 653.2960 2.5E4 END IONS BEGIN IONS FEATURE_ID=713 PEPMASS=424.3640 SCANS=713 RTINSECONDS=878.197 CHARGE=1+ MSLEVEL=2 MERGED_STATS=12 / 12 (0 removed due to low quality, 0 removed due to low cosine). 55.7953 2.5E3 57.0696 3.1E5 59.0486 3.2E3 59.8956 2.4E3 60.4035 2.4E3 60.7397 2.4E3 61.3202 2.4E3 62.9360 2.2E3 65.0957 2.4E3 65.4826 2.3E3 69.0697 1.8E4 69.2620 2.2E3 71.0852 2.5E5 71.9534 2.1E3 73.0645 3.7E4 73.4462 4.7E3 74.0010 2.3E3 75.5493 2.2E3 76.2727 2.2E3 78.9262 2.1E3 80.2393 2.1E3 82.3638 2.6E3 82.7455 2.4E3 83.0849 2.9E3 83.2562 2.6E3 83.8940 2.2E3 84.0670 2.1E3 85.0055 2.4E3 85.1008 1.6E5 87.0439 2.5E4 87.5275 2.3E3 87.7186 2.2E3 89.0593 1.9E6 89.0652 2.3E3 89.7566 2.2E3 91.4911 2.6E3 92.0531 2.4E3 92.2726 2.2E3 93.8517 2.6E3 97.1010 1.0E4 100.0339 2.5E3 100.8004 2.4E3 101.3494 2.4E3 104.3380 2.3E3 105.2651 2.1E3 107.0697 5.6E3 107.2876 2.4E3 108.6317 2.7E3 109.5739 2.9E3 113.3729 2.5E3 113.5195 2.3E3 114.6738 2.3E3 116.9388 2.6E3 117.0906 2.5E3 128.0866 2.6E3 129.2242 2.3E3 129.8001 3.0E3 131.4767 2.3E3 133.0747 1.1E4 133.0856 7.5E5 134.2226 2.6E3 134.4502 2.4E3 134.5662 2.6E3 139.4966 2.4E3 148.5542 2.7E3 149.2584 2.2E3 149.6876 5.3E3 151.0964 3.4E4 162.7305 2.4E3 173.5296 1.6E5 173.5432 1.8E4 177.1121 6.6E4 185.1848 2.4E3 187.6159 2.4E3 193.9125 2.7E3 195.1225 3.9E4 215.4473 2.7E3 222.3839 2.5E3 224.7673 2.2E3 239.1490 6.4E4 240.0478 2.8E3 273.3854 2.2E3 283.7198 2.5E3 284.5000 2.4E3 288.2279 3.0E3 306.1639 2.6E3 331.0921 2.4E3 339.8968 2.2E3 343.9305 2.2E3 347.4132 2.4E3 348.3145 3.0E3 356.5352 2.3E3 367.9304 2.3E3 432.3266 2.7E3 END IONS BEGIN IONS FEATURE_ID=714 PEPMASS=319.2849 SCANS=714 RTINSECONDS=879.156 CHARGE=1+ MSLEVEL=2 MERGED_STATS=8 / 8 (0 removed due to low quality, 0 removed due to low cosine). 54.1069 2.4E3 55.0540 2.9E3 57.0697 3.0E5 62.0360 2.3E3 63.0374 2.3E3 65.1104 2.2E3 67.6831 2.4E3 67.9010 2.4E3 68.1747 2.3E3 69.0697 5.1E3 69.8797 2.3E3 71.0853 1.6E5 75.4571 2.3E3 79.4103 2.3E3 79.4347 2.4E3 80.0895 2.6E3 80.8406 2.3E3 81.6891 2.4E3 85.1008 7.6E4 87.8677 2.6E3 88.0759 2.2E3 89.0594 3.4E5 90.8797 2.2E3 92.7440 2.9E3 94.9806 3.1E3 100.7297 2.6E3 103.2767 2.4E3 108.2675 2.4E3 115.3032 2.6E3 116.8409 2.4E3 122.3748 2.3E3 123.4285 2.9E3 131.5413 2.2E3 133.5394 2.2E3 136.0749 2.5E3 139.6272 2.3E3 172.8231 2.2E3 173.5255 1.0E5 173.5425 4.2E4 174.6275 2.6E3 180.2696 2.4E3 190.0627 8.5E3 191.0660 2.2E4 194.0894 1.0E4 194.4836 2.4E3 205.8562 2.2E3 207.0612 8.6E3 208.2703 2.4E3 216.5015 2.4E3 220.7884 2.3E3 221.0814 2.4E4 222.0842 6.7E4 244.8355 2.4E3 255.5582 2.3E3 260.2122 2.5E3 270.0915 2.5E3 274.8164 2.6E3 278.0770 2.5E3 290.5421 3.1E3 308.5375 2.4E3 END IONS BEGIN IONS FEATURE_ID=715 PEPMASS=625.2663 SCANS=715 RTINSECONDS=879.654 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 66.5039 3.0E3 66.6730 2.3E3 67.3116 2.2E3 72.1695 2.3E3 73.0652 2.9E3 73.7209 2.3E3 73.7611 2.6E3 87.3468 2.2E3 89.9528 2.1E3 95.3693 2.3E3 111.7332 2.2E3 121.6679 2.2E3 127.2373 2.7E3 129.8671 2.3E3 148.0946 2.2E3 149.6843 5.1E3 149.7054 3.3E3 161.0788 2.5E3 173.5226 9.7E3 173.5323 6.8E3 173.5412 1.7E4 237.4437 2.3E3 298.7013 2.4E3 405.2082 8.9E3 420.1664 5.6E3 420.2314 3.4E5 421.2391 5.1E3 424.2231 1.0E4 430.4540 2.2E3 433.2404 1.8E4 434.2475 3.6E4 448.2265 4.7E4 449.2339 8.8E4 451.2110 7.3E3 452.2213 1.2E5 459.2190 5.4E4 460.2261 1.5E5 460.2951 4.1E3 461.2374 3.3E3 462.2058 4.2E4 463.2123 2.1E4 465.2289 7.2E4 475.2138 1.4E5 476.2214 6.4E4 477.2291 4.3E5 478.2379 3.8E3 479.2445 9.0E3 487.2146 7.3E3 488.2180 5.1E3 489.2290 7.8E3 491.2117 8.7E3 491.2407 8.8E3 492.2522 1.6E5 493.2562 3.6E4 499.5382 2.9E3 501.2288 5.3E3 502.2329 8.5E3 503.2434 8.2E4 504.2476 1.0E4 509.2175 1.1E4 518.2319 5.2E4 520.2147 3.2E3 521.2213 2.3E5 523.2339 3.4E4 524.2351 2.5E3 533.2183 2.9E4 534.2268 7.9E3 535.2344 1.1E5 536.2421 1.5E5 537.2497 1.7E4 538.2569 1.8E4 547.2343 3.7E4 548.2416 1.1E4 549.2505 7.1E4 563.2659 2.0E4 565.2460 4.3E4 579.2510 3.2E3 593.2402 2.4E4 607.2534 3.4E3 608.2639 4.5E4 END IONS BEGIN IONS FEATURE_ID=716 PEPMASS=393.2790 SCANS=716 RTINSECONDS=882.164 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 5 (0 removed due to low quality, 0 removed due to low cosine). 53.0269 2.2E3 55.0540 3.5E4 55.0569 2.1E3 56.8319 2.2E3 57.0697 2.6E4 61.4269 2.2E3 61.7956 2.3E3 62.2221 2.5E3 65.3934 2.3E3 66.1760 2.4E3 66.3937 2.6E3 67.0539 4.9E4 67.0575 2.2E3 67.4876 2.2E3 68.5703 2.3E3 69.0695 5.3E4 69.4584 2.5E3 70.6887 2.1E3 71.0354 2.3E3 74.8810 2.4E3 78.0494 2.2E3 78.7835 2.6E3 79.0497 2.3E3 79.0539 6.1E4 80.0894 2.2E3 81.0696 1.3E5 83.0488 1.0E4 83.0853 1.9E4 84.6558 2.3E3 85.0645 5.7E3 86.8607 2.3E3 88.6689 2.4E3 89.0592 3.0E3 91.0539 5.9E4 93.0639 4.1E3 93.0693 2.0E5 95.0488 1.2E5 95.0852 1.3E5 96.1417 2.3E3 97.0644 2.1E4 103.2822 2.2E3 105.0630 2.5E3 105.0695 1.6E5 105.9700 2.2E3 107.0784 2.9E3 107.0851 1.4E5 109.0644 3.4E4 109.1008 7.1E4 115.0544 2.9E3 117.0695 3.5E4 117.9651 2.4E3 119.0769 3.5E3 119.0852 2.2E5 121.0645 6.1E4 121.1008 9.8E4 123.0802 6.7E3 123.1165 2.5E4 128.0620 5.1E3 129.0694 1.5E4 130.0777 7.1E3 131.0852 9.4E4 131.3699 2.3E3 133.1008 1.4E5 135.0805 1.5E4 135.1164 4.5E4 137.0961 2.5E3 141.0698 2.5E3 142.0773 3.3E4 143.0852 7.6E4 144.0929 1.6E4 145.0656 2.7E3 145.1008 1.9E5 146.1056 1.0E4 147.0802 7.5E3 147.1164 5.6E4 149.0228 1.1E4 149.0951 3.6E3 149.1327 2.7E3 149.6879 5.7E3 150.0262 3.4E3 151.0276 4.1E3 155.0853 2.2E4 156.0927 2.0E4 157.1008 1.2E5 158.1079 1.5E4 159.0805 6.9E3 159.1165 1.3E5 160.1213 6.0E3 161.0957 4.6E4 161.1323 1.9E4 164.9934 2.4E3 167.0854 5.5E3 168.0929 6.0E3 169.1011 4.8E4 170.1080 1.4E4 171.1167 6.4E4 172.1239 1.1E4 173.0964 2.7E3 173.1325 6.4E4 173.5266 2.7E4 173.5364 2.9E4 175.1479 3.0E4 175.4601 2.4E3 179.0854 5.4E3 181.1010 1.8E4 182.1084 2.8E3 183.1167 4.3E4 184.1236 6.8E3 185.1325 3.0E4 187.1483 1.6E4 188.5358 2.6E3 193.1012 7.3E3 194.1084 3.2E3 195.1168 2.6E4 196.1239 9.4E3 197.1323 4.3E4 198.1385 3.0E3 199.1475 1.7E4 200.1540 2.7E3 201.1636 3.9E3 207.1158 6.3E3 209.1324 2.9E4 210.1406 3.3E3 211.1479 2.2E4 213.1635 2.9E3 221.1336 3.1E3 223.0665 2.6E3 223.1473 9.8E3 225.1625 2.9E3 235.1498 3.1E3 237.1640 3.8E3 240.3939 2.4E3 251.1804 2.9E3 253.9305 2.1E3 290.3325 3.1E3 293.6641 2.4E3 299.9688 2.4E3 322.2513 2.5E3 357.6625 2.5E3 373.1754 2.4E3 389.9727 2.5E3 END IONS BEGIN IONS FEATURE_ID=717 PEPMASS=669.2923 SCANS=717 RTINSECONDS=887.993 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 66.5852 2.0E4 67.6957 5.0E4 67.6989 1.0E4 69.3308 2.3E3 69.6960 1.3E4 69.6995 2.7E3 70.6499 2.4E3 73.9054 2.4E3 96.4643 2.1E3 101.8061 2.1E3 103.5361 2.2E3 105.0739 2.4E3 118.0549 2.3E3 135.9486 2.4E3 147.5027 2.7E3 150.1962 2.3E3 162.7768 2.4E3 169.0732 2.4E3 173.5258 5.6E4 173.5421 3.9E4 181.7703 2.6E3 183.2104 2.5E3 201.5503 2.3E3 225.1379 1.2E4 237.1375 2.8E3 238.1462 1.6E4 239.1543 1.1E4 251.1539 1.8E4 252.1640 2.7E3 253.1694 8.8E4 261.1386 2.6E4 266.7027 2.4E3 267.1497 1.2E4 275.8778 2.9E3 279.1494 4.8E4 280.1565 1.5E4 287.0628 2.7E3 333.1451 3.6E3 375.1179 2.5E3 411.2188 6.0E3 420.1939 3.0E3 421.2035 2.6E3 422.2038 2.4E3 422.2099 6.2E3 435.1824 5.0E3 438.2087 1.1E4 439.2137 8.9E3 440.2218 1.2E4 442.2416 2.8E3 446.1725 2.6E3 448.1924 1.6E4 449.1966 1.9E4 450.2048 2.4E4 452.2191 2.9E3 458.2415 1.2E4 465.1933 3.6E4 466.1979 5.4E3 475.2009 2.5E3 476.1858 3.8E4 479.2034 5.9E3 480.2170 2.3E4 481.2228 4.5E3 482.2555 2.5E3 483.2015 1.0E4 483.2774 1.7E4 490.2014 3.6E3 493.2243 2.0E4 494.1882 3.2E3 494.2474 3.3E3 496.2503 1.8E4 497.2215 3.1E3 497.2589 2.8E3 498.2238 3.2E4 503.2074 3.2E3 507.2357 2.7E3 508.2109 1.6E5 509.2209 2.9E3 511.2014 6.9E3 511.2691 1.2E5 512.2829 3.0E3 521.2518 5.9E4 522.2488 1.5E4 523.2666 3.1E4 524.2441 3.3E4 525.2485 1.4E4 526.2223 3.4E4 528.2739 4.4E4 534.2309 5.7E3 535.2327 1.7E4 538.2618 1.1E4 539.1285 3.1E3 539.2651 4.4E5 540.2692 7.9E3 543.2963 3.8E5 549.2493 1.1E5 550.2443 2.7E4 551.2647 2.0E4 552.2358 1.1E4 553.2586 3.1E4 554.2656 4.1E3 555.2967 6.1E4 556.2710 4.4E4 566.2527 2.7E4 567.2602 3.2E5 571.2901 2.4E5 577.2449 1.1E5 578.2316 4.9E3 580.2258 6.4E3 580.2383 9.4E3 581.2660 2.7E5 582.2625 2.6E4 583.2898 2.9E4 584.2635 6.8E4 591.2626 3.5E3 594.2414 9.1E3 595.2559 1.2E5 599.2865 5.8E5 600.6401 2.9E3 609.2711 1.5E6 610.2740 3.8E3 612.2597 2.4E4 627.2820 3.3E5 636.2854 3.6E3 END IONS BEGIN IONS FEATURE_ID=718 PEPMASS=691.2741 SCANS=718 RTINSECONDS=887.993 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 67.6961 2.6E4 67.6985 7.5E3 70.1381 3.8E4 70.1414 9.4E3 71.8753 2.7E3 86.5764 2.4E3 100.5314 2.3E3 100.9432 2.4E3 104.5292 2.3E3 109.6252 2.1E3 111.4333 2.5E3 114.6796 2.9E3 117.4379 2.2E3 123.9184 2.4E3 124.2613 2.5E3 124.2836 2.3E3 141.2001 2.2E3 173.5337 9.3E4 197.7307 2.9E3 207.4918 2.3E3 273.6088 2.3E3 278.8765 2.4E3 344.0521 2.8E3 382.9576 2.4E3 397.6734 2.5E3 410.5779 2.5E3 423.9503 2.6E3 439.6412 2.7E3 449.1934 5.2E3 465.1905 9.9E3 472.1856 2.1E4 476.1845 1.1E4 498.1662 2.6E3 499.1750 1.9E4 508.2103 7.1E4 512.1799 2.5E3 527.2053 4.8E4 530.1928 2.1E4 531.2001 3.1E4 548.2773 2.7E3 549.2491 2.9E4 550.2568 4.4E3 559.2305 3.3E3 572.2218 6.5E3 577.2442 2.5E4 581.2611 9.0E4 599.2265 1.8E4 609.2706 8.7E5 631.2524 1.2E6 690.1907 2.7E3 691.3876 1.2E4 END IONS BEGIN IONS FEATURE_ID=719 PEPMASS=583.4151 SCANS=719 RTINSECONDS=889.46 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 63.3567 2.4E3 67.0540 3.2E4 69.0333 9.7E3 69.0695 3.4E4 69.4991 2.4E3 72.1431 2.6E3 73.1348 2.2E3 79.0010 2.2E3 79.0539 3.3E4 81.0696 7.2E4 83.0489 1.8E4 83.0854 2.1E4 85.0646 1.6E4 91.0540 3.4E4 93.0697 1.2E5 95.0489 2.1E4 95.0850 1.1E5 96.1733 2.4E3 97.0648 1.2E4 103.0544 4.1E3 105.0694 1.2E5 105.0771 3.2E3 106.9910 2.5E3 107.0853 1.2E5 109.0644 2.1E4 109.1009 6.7E4 111.0803 9.1E3 117.0696 2.2E4 119.0854 2.0E5 121.0642 1.0E4 121.0913 2.7E3 121.1010 1.6E5 121.7801 2.4E3 123.0803 4.2E4 123.1164 2.1E4 125.0595 1.5E4 125.0957 1.1E4 128.0618 7.7E3 129.0699 2.1E4 131.0854 8.0E4 133.1010 1.2E5 135.0804 2.6E4 135.1167 4.3E4 135.4908 2.4E3 137.0959 3.6E4 139.0752 3.0E3 139.1114 7.9E3 141.0712 4.5E3 142.0777 2.4E4 143.0854 8.3E4 144.0936 5.9E3 145.0889 4.2E3 145.1011 1.6E5 145.1139 2.6E3 147.0802 5.2E4 147.1168 5.6E4 149.0958 2.4E4 149.1326 1.4E4 151.0752 7.8E4 155.0857 2.3E4 156.0934 2.2E4 157.0880 3.8E3 157.1011 1.8E5 158.1088 2.4E4 159.1169 9.8E4 161.0960 1.9E4 161.1324 3.4E4 163.1118 3.3E4 165.0756 3.1E3 165.0910 2.3E5 165.1062 5.1E3 167.0865 1.0E4 167.1067 4.6E4 168.0937 8.7E3 169.1012 7.1E4 170.1092 1.7E4 171.1168 1.2E5 172.1251 2.8E3 173.0966 1.1E4 173.1184 3.1E3 173.1326 1.0E5 173.5257 5.4E4 173.5433 2.3E4 175.1114 9.9E3 175.1481 3.1E4 175.8504 2.4E3 177.0907 2.6E3 177.1273 1.0E4 179.0856 1.6E4 180.0941 3.6E3 181.1013 3.7E4 181.1208 1.4E4 182.1085 1.3E4 183.1170 9.1E4 184.1246 1.7E4 185.1326 9.1E4 185.6671 2.4E3 186.1388 2.6E3 187.1115 8.1E3 187.1485 3.2E4 189.1278 3.2E4 189.1646 2.6E3 191.1082 3.6E3 191.1431 3.1E4 193.1012 2.5E4 194.1093 2.7E4 195.1170 7.6E4 196.1245 2.1E4 197.1326 8.5E4 198.1413 4.1E3 199.1113 7.9E3 199.1482 7.0E4 200.8510 2.4E3 201.1280 6.5E3 201.1642 5.0E3 203.1433 1.1E5 205.1026 2.6E3 206.1088 9.3E3 207.1168 5.5E4 207.1382 3.4E4 208.1243 2.0E4 209.1327 1.1E5 209.1542 4.8E3 210.1404 1.8E4 211.1124 2.6E3 211.1484 5.2E4 213.1282 5.0E3 213.1646 2.1E4 215.1427 1.3E4 217.1592 1.6E4 218.1090 3.3E3 219.1175 1.7E4 220.1250 1.2E4 221.1321 4.7E4 221.1541 2.6E5 222.1402 1.6E4 223.1483 5.9E4 224.1572 4.7E3 225.1274 6.7E3 225.1639 2.2E4 227.1424 4.0E3 227.1804 7.4E3 229.1594 5.0E3 231.1166 6.1E3 231.1750 1.3E4 232.1250 4.8E3 233.1325 2.7E4 233.1550 1.4E4 234.1409 8.1E3 235.1481 4.8E4 235.1707 2.4E3 236.1559 9.3E3 237.1641 3.3E4 239.1445 6.9E3 239.1797 2.0E4 241.1595 3.7E3 243.1158 2.7E3 243.1750 6.1E3 244.1240 2.8E3 245.1324 2.1E4 246.1399 1.7E4 247.1481 3.3E4 248.1559 1.3E4 249.1641 3.4E4 250.1709 1.3E4 251.1437 2.9E3 251.1796 2.5E4 253.1599 3.3E3 253.1950 1.4E4 257.1903 1.6E4 258.1400 3.2E3 259.1481 2.0E4 260.1559 1.9E4 261.1636 4.2E4 263.1799 2.4E4 265.1658 2.8E3 265.1953 2.8E4 267.1749 7.3E3 268.7911 2.6E3 269.1897 1.7E4 271.2058 1.3E4 273.1635 1.6E4 274.1717 6.7E3 275.1800 3.9E4 277.1949 2.0E4 279.1739 2.7E3 279.2108 1.1E4 281.1916 1.5E4 281.2955 1.1E5 282.2798 3.6E5 283.2061 2.7E4 283.2829 3.8E5 286.1951 7.1E3 287.1752 6.6E3 287.2065 4.5E3 289.1957 1.9E4 290.2045 3.8E3 291.2111 1.0E4 293.1906 3.3E3 295.2060 2.5E4 297.2234 1.8E4 297.6292 2.6E3 299.2014 3.1E3 299.3062 1.0E5 300.3095 1.2E5 301.1959 1.1E4 303.2130 3.4E3 307.2065 9.0E3 314.2045 2.6E3 315.2121 8.3E3 316.2202 3.9E3 317.2284 3.4E3 329.2269 6.7E3 331.2457 3.5E3 333.2256 3.5E3 341.2290 2.8E3 347.2380 3.6E3 348.2452 3.9E3 349.2556 4.8E3 352.2390 5.3E3 357.2585 3.8E3 361.2498 4.1E3 365.2448 5.3E3 375.2689 1.9E4 403.3004 3.6E4 403.6674 2.9E3 470.0737 2.6E3 501.7298 2.5E3 503.3526 2.3E4 509.3402 6.8E3 565.4055 2.2E4 583.4171 3.3E4 END IONS BEGIN IONS FEATURE_ID=720 PEPMASS=600.4178 SCANS=720 RTINSECONDS=889.557 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 7 (3 removed due to low quality, 0 removed due to low cosine). 65.0190 4.3E3 67.0541 1.2E5 69.0334 1.3E5 69.0698 1.1E5 69.8760 3.2E3 70.6781 4.6E3 71.0492 3.0E4 71.1022 7.4E3 72.4972 3.6E3 77.0388 4.4E3 77.6639 5.2E3 79.0542 1.6E5 81.0698 3.7E5 83.0490 1.9E5 83.0854 1.3E5 85.0646 8.1E4 87.0440 2.6E4 89.0596 1.3E5 91.0542 1.6E5 92.0623 4.4E3 93.0630 8.1E3 93.0698 6.4E5 94.0777 6.1E3 95.0491 2.4E5 95.0854 4.9E5 97.0647 1.5E5 97.1011 1.1E4 98.0677 5.4E3 99.0804 1.1E4 100.1700 5.7E3 103.0535 3.5E3 103.3443 6.5E3 105.0455 6.6E3 105.0698 5.8E5 106.0777 1.9E4 107.0492 3.9E4 107.0772 2.1E4 107.0854 7.5E5 107.0922 4.8E3 108.0890 7.7E3 109.0647 2.4E5 109.1011 3.2E5 111.0438 2.5E4 111.0804 1.1E5 113.0962 4.6E4 115.0542 4.6E3 117.0697 8.5E4 118.0767 6.6E3 119.0490 6.3E3 119.0757 8.5E3 119.0854 8.7E5 120.0931 6.8E4 120.7783 5.3E3 121.0647 1.4E5 121.0910 1.6E4 121.1010 8.6E5 121.1085 5.8E3 122.0722 1.9E4 122.1042 1.6E4 123.0432 5.8E3 123.0803 4.8E5 123.1166 1.1E5 123.1254 3.7E3 125.0595 1.4E5 125.0960 1.9E5 128.0623 4.0E4 129.0697 1.1E5 130.0777 2.5E4 131.0854 3.7E5 132.0930 7.4E4 133.0648 1.2E5 133.0854 1.2E4 133.0865 6.1E4 133.1011 7.0E5 133.1126 5.9E3 134.1089 3.8E4 134.6141 6.0E3 135.0700 1.1E4 135.0803 3.8E5 135.1167 3.3E5 136.0885 2.1E4 137.0596 6.2E4 137.0960 2.5E5 138.1014 8.2E3 139.0752 9.0E4 139.1116 6.6E4 141.0702 1.4E4 142.0778 7.9E4 143.0854 5.1E5 144.0931 2.0E5 145.0649 3.6E4 145.1011 9.1E5 145.1143 9.5E3 146.0722 7.4E3 146.1082 7.2E4 147.0803 5.2E5 147.1167 2.8E5 148.0879 4.0E4 149.0960 3.1E5 149.1322 5.4E4 150.1036 2.9E4 151.0753 4.8E5 151.0890 9.2E3 151.1117 6.6E4 152.0817 3.2E4 153.0700 7.7E3 153.0910 6.9E4 155.0853 1.1E5 155.1065 2.3E4 156.0931 1.2E5 157.0647 5.8E3 157.0861 2.6E4 157.1011 1.2E6 157.1147 1.6E4 158.1086 2.0E5 159.0803 2.2E5 159.1168 7.5E5 160.0878 1.2E5 160.1232 4.4E4 161.0961 5.1E5 161.1325 2.1E5 162.1034 5.5E4 163.0756 3.3E4 163.1117 5.3E5 163.1471 9.3E3 164.1182 2.0E4 165.0911 1.4E6 165.1248 7.4E3 166.0950 3.7E4 167.0709 7.1E3 167.0864 6.1E3 167.0865 3.6E4 167.1067 3.4E5 168.0933 1.2E4 168.1095 1.6E4 169.1013 3.1E5 170.1087 1.4E5 171.0809 6.2E4 171.1001 1.3E4 171.1169 7.2E5 171.1305 6.4E3 172.0886 2.7E4 172.1243 2.3E5 173.0963 2.3E5 173.1326 4.0E5 173.5211 1.4E4 173.5308 1.7E5 173.5417 5.1E4 174.1035 3.5E4 174.1386 2.8E4 175.1119 4.6E5 175.1483 1.5E5 176.1194 2.6E4 177.0909 9.7E4 177.1276 1.5E5 178.0986 4.4E4 179.0865 4.7E4 179.1066 1.6E5 179.1228 8.6E3 179.1430 1.9E4 180.0951 2.3E4 180.1142 9.3E4 181.0851 4.6E4 181.1014 1.5E5 181.1223 1.9E5 182.1090 7.0E4 183.1168 4.3E5 184.1239 1.1E5 185.0959 8.9E4 185.1326 6.1E5 185.1515 8.4E3 186.1038 3.9E4 186.1401 8.6E4 187.1117 2.1E5 187.1483 1.6E5 188.1197 4.2E4 189.0915 7.1E3 189.1275 3.5E5 190.1351 3.0E5 191.1066 1.1E5 191.1431 1.4E5 193.1011 9.6E4 193.1223 2.8E5 194.1091 5.5E4 195.1168 3.7E5 195.1378 6.5E4 196.1242 9.3E4 197.0965 7.2E4 197.1154 1.8E4 197.1326 4.6E5 198.1040 4.3E4 198.1392 8.1E4 199.1119 1.8E5 199.1482 2.3E5 200.1193 3.4E4 200.1546 3.9E4 201.1275 2.1E5 201.1637 4.7E4 202.1337 1.5E4 203.1094 2.0E4 203.1261 6.4E3 203.1431 9.3E5 204.1483 2.3E4 205.1022 1.9E4 205.1224 7.2E4 205.1599 3.9E3 206.1094 4.1E4 207.1167 2.2E5 207.1382 4.2E5 208.1239 9.5E4 208.1454 1.1E5 209.0969 2.7E4 209.1325 4.1E5 209.1540 7.4E4 210.1040 1.3E4 210.1395 1.1E5 211.1120 1.3E5 211.1484 3.4E5 212.1196 6.1E4 212.1547 4.3E4 213.1275 2.4E5 213.1638 9.6E4 214.1352 4.1E4 215.1068 7.0E4 215.1431 1.4E5 216.1505 5.9E4 217.1224 6.3E4 217.1590 5.9E4 218.1297 1.4E4 219.1164 5.3E4 219.1382 2.0E5 220.1244 4.5E4 220.1468 1.0E4 221.1322 1.9E5 221.1537 1.5E6 222.1394 6.2E4 222.1597 4.1E4 223.1116 5.9E4 223.1483 2.9E5 224.1192 2.0E4 224.1551 5.2E4 225.1274 1.7E5 225.1640 2.3E5 226.1338 2.2E4 226.1695 1.9E4 227.1434 1.3E5 227.1793 5.5E4 228.1497 9.8E3 229.1221 7.4E4 229.1589 1.2E5 230.1307 4.1E4 231.1161 9.5E3 231.1383 7.7E4 231.1746 2.2E4 232.1235 7.8E3 232.1469 1.8E4 233.1318 8.2E4 233.1539 6.0E5 234.1394 2.5E4 234.1604 2.0E5 235.1480 2.4E5 235.1712 2.1E4 236.1558 5.3E4 237.1256 6.9E4 237.1489 3.5E5 237.1649 2.0E4 238.1347 2.1E4 238.1708 3.0E4 239.1431 1.1E5 239.1790 9.9E4 240.1498 2.2E4 241.1241 2.5E4 241.1588 1.3E5 241.1902 5.8E3 242.1654 7.2E3 243.1384 6.4E4 243.1744 4.2E4 245.1307 4.3E4 245.1558 4.3E4 246.1388 5.1E4 246.1631 3.5E4 247.1461 8.8E4 247.1699 2.0E5 248.1393 2.3E4 248.1541 1.4E4 249.1309 3.4E4 249.1635 1.9E5 250.1576 1.4E4 251.1435 8.3E4 251.1788 1.1E5 252.1502 1.5E4 253.1588 1.8E5 253.1938 4.0E4 254.1642 9.9E3 255.1437 1.1E4 255.1740 5.0E5 255.2029 5.4E3 256.1825 1.5E4 257.1542 4.7E4 257.1887 3.9E4 259.1437 4.4E4 259.1695 1.1E5 260.1541 3.1E4 261.1632 2.3E5 261.1876 2.3E4 262.1686 1.8E4 263.1435 3.5E4 263.1789 1.3E5 264.1842 2.2E4 265.1587 7.9E4 265.1957 6.8E4 266.1643 8.1E3 266.1995 5.3E3 266.7908 7.8E3 267.1410 1.0E4 267.1745 9.8E4 268.1823 6.0E4 269.1559 4.1E4 269.1899 1.2E5 270.1973 4.5E4 271.1692 2.1E5 271.2014 1.0E4 272.1770 8.6E3 273.1581 4.0E4 273.1849 1.0E5 274.1927 1.4E5 275.1445 3.6E3 275.1795 6.6E4 276.1872 3.3E4 277.1594 4.5E4 277.1951 8.8E4 277.2260 9.5E3 279.1745 2.1E5 279.2079 9.3E3 281.1568 3.2E4 281.1905 1.8E5 282.1952 2.8E4 283.1710 3.5E4 283.2051 4.0E4 285.1851 1.9E5 286.1927 3.2E5 287.2005 2.4E5 289.1591 6.2E3 289.1945 8.6E4 290.2007 1.3E4 291.1749 5.7E4 291.2109 6.4E4 293.1541 7.3E3 293.1911 5.0E4 294.1972 8.0E4 295.1707 3.6E4 295.2059 1.9E5 296.1765 7.8E3 297.1847 1.9E5 298.1927 2.9E4 299.2004 2.4E5 300.2094 2.1E4 301.1927 4.1E4 303.1957 7.2E5 305.1884 2.5E4 305.2252 4.9E3 307.2057 7.9E4 309.1847 8.1E4 309.2211 5.2E4 310.1934 6.8E4 311.2005 9.2E4 312.2081 9.7E4 313.2156 1.7E5 315.2095 1.8E4 317.2257 1.6E4 319.2060 1.2E5 321.2220 2.1E4 322.2288 3.9E4 323.2003 2.8E4 325.2157 1.8E5 327.2091 1.0E4 329.2252 1.1E4 331.2052 2.7E4 333.2216 3.9E4 334.2284 1.1E4 335.1994 7.0E3 335.2398 9.7E3 337.2160 3.6E5 339.2305 1.8E4 341.2277 3.3E4 345.2212 2.6E4 347.2374 6.7E4 349.2147 2.0E4 350.2200 1.2E4 351.2311 4.8E4 352.1899 1.6E4 352.2393 9.5E5 353.2412 1.7E4 353.2484 3.8E3 359.2365 4.4E4 361.2547 1.3E4 363.2307 3.4E4 364.2393 8.1E3 365.2467 4.4E5 369.2591 7.1E3 373.2536 2.0E4 377.2473 8.9E4 378.2545 1.7E4 379.2667 7.9E3 381.2418 1.8E4 383.2612 9.1E3 387.2673 2.4E4 389.2424 6.9E3 391.2631 2.8E4 397.2732 5.0E3 401.2707 8.8E3 403.2595 7.0E3 405.2782 3.3E4 417.2824 6.5E3 419.2931 3.6E4 420.3021 1.5E4 421.2768 6.0E3 437.3038 1.7E4 439.2830 7.5E3 469.3082 4.2E4 487.3192 2.1E5 489.3374 1.6E4 493.3241 7.0E3 502.3440 2.5E4 503.3510 2.5E5 505.3299 1.6E5 507.3478 5.1E4 508.3491 3.5E4 520.3536 8.2E4 522.8188 5.8E3 562.3765 5.5E3 567.3828 1.3E4 585.3920 3.9E4 598.6126 3.6E3 600.4110 2.2E4 END IONS BEGIN IONS FEATURE_ID=721 PEPMASS=280.2641 SCANS=721 RTINSECONDS=891.831 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 3 (1 removed due to low quality, 0 removed due to low cosine). 49.0739 2.2E3 50.7193 2.2E3 51.8721 2.3E3 53.0386 1.1E5 55.0179 6.8E4 55.0542 2.6E5 56.0495 6.9E3 57.0337 3.3E3 57.0634 2.9E3 57.0699 5.9E5 57.0724 8.3E3 58.0652 9.0E3 60.0444 2.7E3 66.8537 2.6E3 67.0541 1.9E5 67.0585 5.1E3 68.0620 7.6E3 69.0336 7.5E3 69.0698 3.9E5 69.0733 3.8E3 69.0745 2.5E3 70.0651 1.7E4 71.0855 2.9E4 72.0444 3.7E4 72.0807 2.4E4 73.0649 3.3E3 74.0964 4.2E4 79.0542 6.0E4 81.0334 3.2E5 81.0380 4.0E3 81.0698 2.6E5 81.0743 2.9E3 81.0756 3.2E3 82.0651 7.1E3 83.0491 4.4E4 83.0854 1.9E5 83.0903 3.1E3 84.0444 6.0E4 84.0807 1.5E4 85.1012 8.1E3 86.0600 1.2E4 86.0967 3.9E3 87.7143 2.2E3 91.0541 3.0E4 93.0699 4.6E4 94.0653 6.2E3 95.0492 1.3E5 95.0854 2.3E5 95.6156 2.4E3 96.0809 3.5E3 96.5904 2.5E3 97.0646 1.8E4 97.0942 2.9E3 97.1012 7.9E4 98.0600 1.4E5 98.0961 3.4E3 100.0757 9.3E3 100.1122 3.0E3 101.0961 4.6E3 105.0700 2.8E4 107.0855 3.6E4 108.0806 5.6E3 109.0648 5.0E4 109.1012 1.2E5 111.0806 4.9E3 111.1171 9.1E3 112.0757 6.1E4 112.1119 6.2E3 114.0918 3.4E3 119.0856 3.3E4 121.1011 1.5E4 123.0804 2.4E4 123.1168 4.0E4 125.0961 5.6E3 126.0914 4.8E4 128.1070 1.8E4 128.1162 2.3E3 133.1013 2.9E4 135.1167 4.9E3 136.7315 2.3E3 137.0962 1.5E4 137.1327 4.9E3 139.1117 3.6E3 140.1071 3.0E4 140.1439 3.1E3 142.1229 6.7E3 142.1584 2.6E3 147.1169 1.1E4 149.0237 9.4E3 149.8577 2.7E3 150.0270 8.6E3 151.1121 4.9E3 152.1078 3.2E3 154.1228 6.0E4 156.1378 3.9E3 156.1747 2.7E4 161.1768 2.3E3 163.1478 3.7E3 165.1277 3.9E3 165.1643 8.8E3 167.1303 5.9E3 168.1385 2.7E4 173.5283 5.4E4 173.5459 9.4E3 179.1800 4.9E3 182.1543 1.5E4 189.1635 7.1E3 196.1700 6.3E3 206.1906 9.2E3 207.1754 1.9E4 212.2376 7.5E3 219.0575 2.0E4 220.0606 3.8E4 224.2012 1.3E5 238.2545 4.2E3 252.2710 2.6E3 280.0972 4.2E4 280.2639 3.4E5 280.3002 5.7E3 END IONS BEGIN IONS FEATURE_ID=722 PEPMASS=772.4765 SCANS=722 RTINSECONDS=892.926 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 7 (1 removed due to low quality, 0 removed due to low cosine). 73.6295 2.4E3 78.5708 2.6E3 79.0539 2.0E4 81.0696 1.5E5 82.4153 2.4E3 83.0488 1.0E4 83.0852 3.4E4 83.0898 2.6E3 83.1949 2.0E3 85.0645 2.4E3 85.2318 2.5E3 86.0962 4.2E4 89.5505 2.4E3 91.0539 3.6E3 92.4673 2.8E3 93.0696 3.7E4 95.0793 3.3E3 95.0852 1.2E5 97.0646 1.0E4 97.1009 1.5E4 98.7095 2.9E3 101.0957 3.6E3 105.0699 1.0E4 107.0853 3.8E4 108.1426 2.8E3 109.0645 8.3E3 109.1008 7.4E4 111.0437 2.0E5 111.0800 6.8E3 111.1168 2.7E3 113.0594 4.2E3 119.0852 2.7E4 121.1008 6.2E4 123.0806 8.2E3 123.1165 5.8E4 124.9997 1.1E4 125.0595 4.5E4 131.0856 7.2E3 133.1009 5.3E4 135.0805 1.6E4 135.1166 8.8E4 136.8667 2.4E3 137.0594 1.0E6 137.0734 1.6E4 137.0960 3.1E3 137.1321 6.5E4 139.0750 3.3E3 143.0854 2.4E3 145.1008 5.4E3 147.1165 9.4E4 149.0958 6.1E4 149.1321 4.0E4 151.0749 1.9E4 151.1118 8.3E3 151.1480 2.5E3 157.1015 5.1E3 157.3416 2.4E3 159.1166 7.1E3 160.3781 2.8E3 161.0959 6.6E4 161.1323 4.7E4 163.1115 4.9E4 163.1480 2.4E4 165.0909 4.5E4 165.1273 3.6E3 167.1070 1.9E4 171.1168 6.3E3 173.1329 3.2E3 173.5209 2.9E4 173.5369 1.6E5 175.1116 7.2E4 175.1482 3.1E4 177.0903 7.1E3 177.1276 1.0E4 179.1065 6.3E4 181.1222 1.9E4 184.0544 5.2E3 184.0732 5.2E5 184.0881 2.8E3 185.1335 2.3E3 189.1273 2.1E4 189.1633 6.8E3 193.1223 4.9E4 195.1400 2.8E3 197.1320 2.8E3 203.1462 3.4E3 203.1794 2.0E5 205.1952 3.4E4 207.1377 6.7E3 213.1299 5.6E3 213.1637 7.5E4 221.1902 7.4E4 223.1479 2.2E4 231.1743 3.9E5 231.1942 2.8E3 234.5591 3.0E3 238.3631 3.3E3 241.1590 4.8E4 245.2235 3.2E3 249.1848 4.2E5 259.1677 4.7E3 263.2373 2.5E4 277.1802 1.6E6 280.2178 2.5E3 282.3394 2.5E3 288.8931 2.6E3 295.1907 1.8E5 302.2141 3.5E3 306.2796 3.7E4 320.1806 2.5E3 320.2225 1.5E5 337.2740 2.1E5 338.2307 6.2E3 346.9124 2.4E3 351.2167 1.0E5 395.4741 2.6E3 401.5396 2.6E3 402.6352 2.8E3 470.1282 2.6E3 508.1571 2.5E3 520.8134 2.8E3 527.7170 2.2E3 593.2844 2.5E3 612.5421 2.5E3 613.4466 2.1E5 629.6804 3.4E3 656.4883 4.1E3 753.8434 2.7E3 767.0106 2.6E3 END IONS BEGIN IONS FEATURE_ID=723 PEPMASS=613.2663 SCANS=723 RTINSECONDS=895.54 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 67.0541 9.1E3 81.0697 1.6E4 83.0853 3.0E3 93.0699 7.4E3 95.0852 1.3E4 105.0700 2.7E3 107.0852 7.3E3 109.1010 1.1E4 111.2536 2.4E3 119.0857 5.7E3 121.1010 9.3E3 121.5874 2.5E3 123.1167 2.4E3 126.2126 2.3E3 126.2297 2.7E3 131.0855 3.1E3 133.1012 8.9E3 135.1168 8.1E3 161.1324 7.2E3 164.0391 2.6E3 173.5231 2.7E4 173.5373 6.1E4 175.1488 2.9E3 187.1487 3.0E3 187.8981 2.7E3 189.1643 3.3E3 210.3876 2.6E3 218.0825 3.2E3 219.6296 2.9E3 237.4446 2.5E3 261.2219 2.9E3 289.3985 2.2E3 304.7243 2.6E3 305.2454 2.5E3 318.1600 1.5E4 326.3276 2.4E3 330.3634 3.2E3 335.2598 3.2E3 353.3979 2.3E3 384.8760 2.8E3 404.0742 2.7E3 409.2026 9.1E3 411.2197 9.9E3 412.2282 1.1E4 423.2187 2.3E4 424.2261 4.0E4 425.1981 4.6E4 437.2339 2.4E4 439.2138 5.4E4 440.2214 1.0E5 449.2266 3.1E3 451.2513 2.5E3 453.2289 2.6E4 454.2358 1.7E4 456.2124 8.0E3 467.2462 1.3E4 469.2240 1.9E4 481.2234 2.4E4 482.2337 1.3E4 483.2377 1.0E5 484.2469 8.2E4 494.2275 4.5E3 495.2387 4.1E4 496.2464 4.8E4 497.2212 5.6E4 498.2293 2.5E4 509.2532 2.5E4 510.2446 1.6E4 511.2333 4.0E4 512.2424 8.9E4 526.2531 1.5E4 527.2651 3.1E5 527.3356 2.3E3 537.2491 4.8E4 542.2169 1.5E4 543.2596 2.0E4 554.2533 3.5E3 555.2237 2.9E3 569.2760 1.4E5 570.2478 2.7E5 571.1747 5.2E3 571.2554 1.3E6 572.2610 3.9E3 585.2696 1.7E4 613.2662 2.7E4 613.4761 5.0E3 END IONS BEGIN IONS FEATURE_ID=724 PEPMASS=429.3732 SCANS=724 RTINSECONDS=897.622 CHARGE=1+ MSLEVEL=2 MERGED_STATS=11 / 11 (0 removed due to low quality, 0 removed due to low cosine). 55.0540 1.8E4 56.9776 2.7E3 57.0696 2.8E5 57.7199 2.5E3 57.9822 2.3E3 58.2166 2.1E3 59.1660 2.7E3 60.0086 2.2E3 61.7031 2.5E3 63.0868 2.3E3 63.7733 2.1E3 64.5739 2.2E3 66.1890 2.2E3 66.9556 2.3E3 67.0541 2.4E4 68.5734 2.4E3 69.0244 2.3E3 69.0695 7.0E4 69.4740 2.5E3 69.6397 2.3E3 71.0852 2.2E5 72.7274 2.1E3 73.5622 2.2E3 73.8500 2.5E3 75.8860 2.5E3 76.2575 2.9E3 77.4349 2.3E3 78.5784 2.5E3 80.7051 2.1E3 80.7339 2.5E3 81.0696 1.0E5 81.3096 2.5E3 81.8294 2.3E3 83.0853 5.7E4 84.3015 2.5E3 84.6298 2.3E3 84.9105 2.1E3 85.1009 1.2E5 91.3622 2.1E3 93.0694 2.3E3 94.2575 2.1E3 95.0851 1.1E5 97.1009 3.9E4 99.7175 2.2E3 100.3920 2.3E3 102.6119 2.5E3 104.2407 2.5E3 104.8397 2.3E3 106.1606 2.7E3 107.5243 2.3E3 108.9211 2.4E3 109.1010 6.4E4 111.0042 2.4E3 111.1165 8.5E3 119.2663 2.4E3 121.0649 2.7E3 121.1006 3.1E3 123.1167 1.6E4 125.6844 2.6E3 126.7167 2.7E3 131.5797 2.5E3 131.7530 2.7E3 133.5743 2.4E3 135.0801 2.2E4 135.1165 1.1E4 137.0599 2.5E3 137.0958 4.6E4 137.1323 7.1E3 137.8811 2.8E3 137.9741 2.4E3 139.0751 4.2E4 145.1015 3.3E3 148.1783 2.4E3 148.3443 2.4E3 149.0959 1.9E5 149.6812 3.6E3 149.6919 4.9E3 151.0753 2.5E3 152.1655 2.4E3 152.9917 2.4E3 159.1168 2.9E4 161.0964 3.5E3 163.0748 5.6E3 163.1117 3.3E5 165.0910 1.9E6 171.1159 2.4E3 173.0961 1.3E4 173.1329 3.8E4 173.5210 4.5E3 173.5297 1.3E5 173.5417 7.4E4 175.1118 1.2E5 177.0910 2.5E5 177.1072 7.2E3 177.1276 4.7E4 179.1066 3.6E4 181.4649 2.9E3 184.1444 2.8E3 187.1117 5.9E4 187.1487 5.5E3 189.1274 5.6E4 190.0984 3.0E3 191.1067 2.7E5 191.1449 2.7E3 193.1755 2.6E3 195.5267 2.3E3 195.7909 2.3E3 201.1277 7.2E4 201.6438 2.5E3 203.1071 2.8E3 203.1433 1.5E4 205.1226 2.5E5 205.4408 2.4E3 207.8233 2.4E3 215.1435 3.7E4 217.7231 2.7E3 219.1383 1.3E5 229.1597 5.4E3 232.3619 2.2E3 233.1539 5.9E4 247.1697 2.7E4 253.7988 2.8E3 255.0557 2.4E3 258.1124 2.2E3 261.1851 1.0E4 264.1908 2.4E3 275.2007 1.1E4 283.4357 2.4E3 288.1050 2.8E3 289.2185 2.5E3 297.0427 2.6E3 297.9540 2.7E3 303.2324 3.4E3 308.8483 2.8E3 315.1501 2.3E3 346.5037 2.3E3 350.9571 2.3E3 353.3543 2.5E3 353.4807 3.0E3 359.2973 2.5E3 376.7278 2.4E3 390.7038 3.2E3 394.1142 2.7E3 394.8616 2.5E3 401.0728 2.4E3 401.3410 4.0E3 426.6850 2.7E3 429.3204 1.9E5 429.3769 3.2E4 433.1470 2.6E3 END IONS BEGIN IONS FEATURE_ID=725 PEPMASS=600.4179 SCANS=725 RTINSECONDS=900.568 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 5 (1 removed due to low quality, 0 removed due to low cosine). 65.0516 2.6E3 67.0541 2.7E4 68.0335 2.4E3 69.0334 2.4E4 69.0697 3.0E4 69.9050 2.4E3 71.0488 2.6E3 73.0285 2.7E3 73.7771 3.1E3 74.7737 2.8E3 76.4162 2.2E3 78.1500 2.3E3 79.0542 3.7E4 81.0698 8.8E4 82.3630 2.2E3 83.0490 4.9E4 83.0854 2.2E4 84.8273 2.3E3 85.0646 1.7E4 87.0437 8.9E3 89.0596 1.3E5 90.5192 2.4E3 91.0541 3.6E4 92.0628 2.4E3 93.0697 1.5E5 95.0490 6.3E4 95.0854 1.1E5 96.1084 2.2E3 97.0649 4.1E4 100.9550 2.3E3 102.9296 2.3E3 105.0698 1.3E5 106.0780 7.4E3 107.0491 2.7E3 107.0773 3.5E3 107.0854 1.7E5 107.0934 4.7E3 109.0647 5.9E4 109.1011 7.4E4 111.0804 1.9E4 113.0962 7.7E3 117.0700 2.7E4 117.0915 2.3E3 119.0497 2.9E3 119.0854 2.1E5 120.0935 7.7E3 121.0648 2.9E4 121.1011 2.2E5 121.1104 6.1E3 123.0804 1.0E5 123.1166 2.4E4 125.0597 6.0E4 125.0959 3.5E4 129.0698 2.1E4 129.0967 2.3E3 130.0774 5.0E3 130.8648 2.2E3 131.0854 9.1E4 132.0931 1.2E4 133.0648 2.1E4 133.0859 6.4E4 133.1011 1.6E5 134.0730 3.7E3 134.1085 6.2E3 135.0804 8.3E4 135.1168 7.0E4 136.0864 3.2E3 137.0596 1.5E4 137.0960 6.0E4 139.0754 3.5E4 139.1114 2.2E4 141.0706 2.8E3 142.0777 1.8E4 143.0854 1.2E5 144.0931 4.9E4 145.0654 7.0E3 145.1011 2.5E5 146.1089 1.1E4 146.2811 2.6E3 147.0803 1.2E5 147.1167 7.3E4 148.0876 8.4E3 149.0960 7.1E4 149.1318 5.3E3 150.1037 3.1E3 151.0753 1.1E5 151.1113 1.3E4 153.0910 1.9E4 153.1286 4.0E3 155.0853 2.3E4 155.1061 3.7E3 156.0933 2.0E4 157.1011 2.9E5 157.1127 2.3E3 158.1084 4.0E4 159.0806 5.3E4 159.1167 1.7E5 160.0882 2.2E4 160.1247 3.4E3 161.0960 1.2E5 161.1325 5.6E4 162.1036 5.7E3 163.0753 3.7E3 163.1117 1.4E5 165.0910 3.8E5 165.1255 2.7E3 166.0944 5.8E3 167.0886 8.4E3 167.1067 7.3E4 168.0930 4.3E3 169.1013 7.4E4 170.1092 3.2E4 171.0808 1.4E4 171.1169 1.7E5 172.0882 3.4E3 172.1244 4.3E4 173.0961 5.6E4 173.1168 2.3E3 173.1326 9.5E4 173.5241 3.4E4 173.5331 5.0E4 173.5439 2.3E4 174.1042 3.6E3 175.1118 1.1E5 175.1482 3.6E4 176.1203 3.0E4 177.0908 1.6E4 177.1114 4.3E3 177.1276 3.2E4 178.0994 1.5E4 179.0876 6.1E3 179.1066 3.8E4 180.1145 1.8E4 181.0854 9.1E3 181.1017 4.0E4 181.1225 6.2E4 182.1090 6.8E3 183.1170 9.9E4 184.1240 2.5E4 185.0961 2.0E4 185.1327 1.4E5 186.1044 8.8E3 186.1402 1.5E4 187.1118 4.7E4 187.1481 3.5E4 188.1205 7.4E3 189.1276 8.3E4 190.1352 7.1E4 191.1064 3.0E4 191.1431 3.9E4 193.1015 2.3E4 193.1225 5.7E4 194.1087 1.3E4 195.1169 1.0E5 195.1375 2.1E4 196.1246 2.2E4 197.0967 1.3E4 197.1152 6.2E3 197.1326 1.1E5 198.1034 9.1E3 198.1394 1.5E4 199.1118 4.5E4 199.1485 5.8E4 200.1177 5.0E3 200.1533 3.7E3 201.1273 5.0E4 203.1094 4.0E3 203.1432 2.2E5 203.1646 1.0E4 205.1225 1.5E4 205.1569 2.7E3 207.1167 5.5E4 207.1383 1.2E5 207.8170 2.8E3 208.1249 1.8E4 208.1453 1.5E4 209.1325 9.6E4 209.1538 1.8E4 210.1400 2.0E4 211.1119 3.2E4 211.1482 6.4E4 212.1200 1.0E4 212.1568 4.2E3 213.1279 6.1E4 213.1645 2.2E4 214.1358 4.5E3 215.1064 9.4E3 215.1434 3.7E4 216.1515 1.0E4 217.1229 1.2E4 217.1588 1.3E4 218.1316 3.6E3 218.1674 3.3E3 219.1169 1.6E4 219.1381 5.1E4 221.1322 5.0E4 221.1539 3.7E5 222.1382 4.1E3 222.1599 3.0E3 223.1115 1.0E4 223.1483 7.2E4 225.1273 4.7E4 225.1639 5.1E4 226.1351 3.6E3 227.1439 3.6E4 227.1795 4.6E3 229.1228 1.1E4 229.1589 2.1E4 230.1302 1.1E4 231.1386 1.5E4 232.1227 4.0E3 233.1318 2.8E4 233.1539 1.3E5 234.1375 5.2E3 234.1614 4.9E4 235.1479 4.8E4 235.1702 1.0E4 236.1556 9.6E3 237.1256 1.5E4 237.1491 9.1E4 239.1429 2.6E4 239.1798 1.4E4 241.1588 2.6E4 243.1373 8.5E3 243.1754 5.5E3 245.1311 8.1E3 245.1552 5.2E3 246.1384 8.9E3 247.1464 2.4E4 247.1697 5.3E4 248.1547 5.0E3 249.1637 5.0E4 251.1431 2.9E4 251.1791 2.7E4 253.1586 5.0E4 253.1871 3.7E3 255.1420 1.0E4 255.1742 1.1E5 257.1537 1.6E4 257.1891 1.2E4 259.1441 1.1E4 259.1701 2.4E4 261.1631 5.1E4 262.1695 8.5E3 263.1422 5.8E3 263.1785 3.2E4 264.1865 2.5E3 264.5416 2.5E3 265.1584 1.4E4 265.1933 1.6E4 267.1743 2.5E4 268.1829 9.5E3 268.3292 2.7E3 269.1563 1.0E4 269.1895 2.8E4 270.1946 3.8E3 271.1698 5.5E4 273.1583 7.9E3 273.1868 2.4E4 274.1931 2.6E4 275.1781 1.3E4 277.1609 2.7E3 277.1955 1.7E4 279.1746 5.3E4 279.2675 2.5E3 281.1902 5.0E4 282.1963 7.2E3 283.1709 7.0E3 283.2053 4.2E3 285.1853 4.0E4 286.1927 9.9E4 287.2004 4.0E4 289.1948 1.8E4 291.1761 1.2E4 291.2091 1.1E4 293.1897 9.7E3 294.1984 1.3E4 295.1716 4.2E3 295.2060 3.4E4 297.1850 4.2E4 298.1933 4.9E3 299.2006 5.0E4 301.1922 5.5E3 303.1958 1.2E5 305.1906 3.7E3 307.2057 1.7E4 309.1846 2.6E4 309.2205 1.0E4 310.1925 1.9E4 311.2003 3.0E4 312.2083 2.3E4 313.2169 3.9E4 314.1985 2.8E3 315.2099 4.0E3 319.2050 2.2E4 322.2294 4.9E3 323.1996 8.0E3 325.2162 1.0E5 333.2214 9.8E3 337.2162 7.3E4 339.2339 4.5E3 341.2296 4.4E3 347.2366 1.8E4 349.2188 3.0E3 351.2308 1.0E4 352.2395 1.7E5 353.2460 5.7E3 359.2358 1.1E4 363.2317 4.5E3 365.2473 1.8E5 373.2520 2.5E3 377.2481 1.7E4 378.2537 3.3E3 387.2702 1.1E4 391.2659 4.6E3 391.4650 3.6E3 401.2816 3.2E3 405.2813 3.3E3 419.2953 3.8E3 421.2725 3.6E3 437.2997 3.5E3 487.3197 3.6E4 489.3350 3.6E3 502.3433 4.0E3 503.3517 4.9E4 505.3310 2.7E4 507.3461 3.8E4 520.3536 1.5E4 524.4359 2.8E3 524.5599 2.7E3 567.3817 5.4E3 585.3911 7.8E3 600.2161 2.5E3 602.9130 2.8E3 END IONS BEGIN IONS FEATURE_ID=726 PEPMASS=669.2923 SCANS=726 RTINSECONDS=904.207 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 66.5855 3.7E3 66.5888 3.0E3 67.0326 2.4E3 75.6804 2.5E3 79.0838 2.2E3 82.3261 2.5E3 84.0345 2.2E3 85.5446 2.1E3 88.5288 2.2E3 103.5557 2.5E3 134.8097 3.4E3 173.5243 5.3E4 173.5432 3.3E4 220.7018 2.7E3 222.1268 3.4E3 223.1370 3.1E3 224.1314 4.1E3 226.1467 5.9E3 237.1388 3.2E3 239.1539 3.2E4 240.1622 5.9E3 253.1320 5.0E3 265.1333 1.3E4 267.1497 2.1E4 313.1194 9.6E3 356.8283 2.8E3 378.1671 2.5E3 403.1657 2.8E3 405.2858 2.6E3 406.1788 8.8E3 418.2455 3.0E3 420.1956 1.9E4 421.2008 1.8E4 438.2039 4.8E3 439.2117 1.3E4 444.2286 3.7E4 445.2357 4.8E3 446.2442 2.9E3 463.1884 1.7E4 475.2139 1.7E4 479.2079 8.2E3 493.2248 2.9E4 503.2046 5.3E3 504.2275 8.5E3 511.2670 3.3E4 521.2531 1.3E5 522.2400 2.3E4 524.2443 2.9E4 532.2221 1.7E4 535.2336 3.3E4 538.2638 3.3E3 539.0739 4.0E3 539.2655 2.0E6 546.5566 2.5E3 549.2501 1.6E5 550.2355 2.8E4 552.2366 1.6E4 563.2627 4.3E3 564.2499 8.2E4 566.2506 1.3E4 567.2607 5.4E5 574.2343 1.2E4 576.2745 5.6E3 581.2762 3.0E5 584.2617 9.5E3 591.2604 2.1E4 592.2480 3.1E3 599.2868 2.6E5 606.2630 2.8E3 609.2704 2.6E4 623.2871 2.0E4 626.2729 1.9E4 636.2927 1.3E4 641.2983 1.2E4 651.2816 6.1E3 END IONS BEGIN IONS FEATURE_ID=727 PEPMASS=600.4172 SCANS=727 RTINSECONDS=907.424 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 5 (0 removed due to low quality, 0 removed due to low cosine). 63.7358 2.3E3 64.0582 2.4E3 67.0540 4.0E4 67.3874 2.4E3 69.0334 3.7E4 69.0697 4.5E4 71.0491 6.3E3 73.0897 2.3E3 76.0396 2.6E3 78.9513 2.1E3 79.0541 5.5E4 80.1129 2.2E3 81.0697 1.4E5 83.0489 5.9E4 83.0853 3.7E4 85.0647 2.7E4 87.0438 1.9E4 88.9352 2.1E3 89.0594 1.7E5 89.6751 2.1E3 91.0541 5.9E4 93.0697 2.3E5 95.0490 8.3E4 95.0853 1.7E5 97.0646 6.3E4 105.0697 2.1E5 106.0779 2.4E3 107.0495 5.1E3 107.0853 2.5E5 109.0646 7.8E4 109.1009 1.2E5 111.0440 6.0E3 111.0803 4.5E4 113.0959 1.3E4 117.0699 3.0E4 117.0906 2.5E3 119.0489 3.0E3 119.0853 3.1E5 119.7189 2.5E3 120.0932 1.4E4 121.0646 4.2E4 121.1009 3.1E5 121.2566 2.2E3 122.1044 6.2E3 123.0802 1.4E5 123.1165 3.1E4 125.0595 4.2E4 125.0959 5.8E4 129.0697 2.9E4 131.0854 1.3E5 132.0932 1.3E4 132.7888 2.4E3 133.0645 3.7E4 133.0858 8.5E4 133.1010 2.5E5 134.1076 6.3E3 134.3022 2.7E3 134.8381 2.6E3 135.0803 1.2E5 135.1167 1.0E5 137.0597 1.6E4 137.0958 8.6E4 139.0751 3.3E4 139.1112 2.0E4 141.0703 7.1E3 142.0779 1.9E4 143.0853 1.7E5 144.0931 5.9E4 145.0640 3.1E3 145.1010 3.1E5 145.8097 2.2E3 146.1072 1.3E4 147.0802 1.6E5 147.1165 1.0E5 148.0873 1.3E4 149.0959 1.0E5 149.1328 1.3E4 150.1037 3.6E3 151.0751 1.3E5 151.1112 1.7E4 152.0811 2.6E3 153.0908 2.1E4 155.0853 3.7E4 155.1068 1.1E4 156.0931 3.8E4 157.1009 3.7E5 157.1163 2.8E3 158.1085 5.1E4 159.0803 6.6E4 159.1167 2.3E5 160.0878 4.5E4 160.1224 5.0E3 161.0959 1.4E5 161.1324 7.3E4 162.1036 7.6E3 163.0752 7.0E3 163.1115 1.4E5 165.0909 4.4E5 166.0943 2.7E4 167.0853 2.8E3 167.0890 9.2E3 167.1066 1.1E5 168.0940 5.6E3 168.1099 2.4E3 169.1012 1.1E5 170.1081 3.6E4 171.0798 1.2E4 171.1168 2.4E5 172.0881 7.1E3 172.1243 7.2E4 173.0962 6.9E4 173.1324 1.4E5 173.5238 6.4E4 173.5424 7.3E4 174.1032 3.5E3 174.1382 7.8E3 175.1118 1.3E5 175.1480 5.2E4 176.1192 3.1E3 177.0910 2.5E4 177.1111 1.1E4 177.1274 4.1E4 178.0992 1.3E4 179.0882 5.5E3 179.1066 4.8E4 179.1429 6.6E3 180.0946 3.0E3 180.1146 2.4E4 181.0857 1.4E4 181.1014 5.5E4 181.1222 6.0E4 182.1088 1.9E4 183.1167 1.5E5 184.1240 3.8E4 185.0960 2.6E4 185.1324 1.9E5 186.1051 2.5E3 186.1394 2.3E4 187.1115 6.9E4 187.1480 5.5E4 188.1191 1.1E4 189.1273 1.0E5 190.1348 8.5E4 191.1062 2.8E4 191.1427 5.0E4 193.1011 3.3E4 193.1222 7.5E4 194.1088 1.9E4 195.1166 1.3E5 195.1366 1.8E4 195.5387 2.6E3 195.6942 2.8E3 196.1238 3.2E4 197.0964 1.8E4 197.1161 7.8E3 197.1325 1.5E5 198.1041 1.2E4 198.1392 2.3E4 199.1115 5.8E4 199.1481 8.1E4 200.1201 4.0E3 201.1272 5.8E4 201.1631 1.6E4 202.1331 2.9E3 203.1088 8.0E3 203.1430 2.7E5 204.1468 7.7E3 205.1226 1.6E4 206.1097 3.1E3 206.1296 3.2E3 207.1166 6.1E4 207.1380 1.2E5 208.1241 2.8E4 208.1453 2.7E4 209.1323 1.3E5 209.1533 2.3E4 210.1392 3.4E4 211.1117 4.3E4 211.1482 1.1E5 212.1194 1.6E4 212.1552 1.2E4 213.1273 7.7E4 213.1639 3.4E4 214.1329 1.1E4 215.1070 1.6E4 215.1430 4.4E4 216.1506 1.3E4 217.1225 1.6E4 217.1586 2.5E4 219.1165 1.6E4 219.1382 6.3E4 220.1246 1.7E4 221.1323 6.9E4 221.1537 4.5E5 222.1378 1.5E4 222.1588 1.6E4 223.1108 1.6E4 223.1481 1.0E5 224.1536 1.1E4 225.1273 5.9E4 225.1637 7.4E4 226.1336 6.6E3 227.1428 4.0E4 227.1801 1.1E4 227.2801 2.5E3 228.1503 5.8E3 229.1223 2.1E4 229.1584 2.5E4 230.1296 3.5E3 231.1156 3.5E3 231.1382 1.8E4 231.1747 3.7E3 233.1318 2.6E4 233.1539 1.6E5 234.1370 8.5E3 234.1604 5.5E4 235.1480 7.8E4 235.1710 3.3E3 236.1554 1.4E4 237.1254 2.2E4 237.1487 9.8E4 237.1662 8.4E3 238.1677 3.1E3 239.1432 3.2E4 239.1790 2.7E4 240.1522 5.4E3 241.1587 3.2E4 243.1379 1.2E4 243.1738 1.1E4 245.1301 1.0E4 245.1547 9.4E3 246.1396 9.8E3 247.1462 2.4E4 247.1699 5.4E4 249.1309 6.8E3 249.1635 6.4E4 250.1713 5.5E3 251.1424 2.2E4 251.1794 4.1E4 252.1497 3.4E3 253.1309 6.3E3 253.1582 6.1E4 253.1919 1.3E4 255.1738 1.5E5 255.2948 2.5E3 256.1811 3.0E3 257.1551 1.7E4 257.1894 1.3E4 259.1442 5.0E3 259.1693 3.5E4 260.1558 3.8E3 261.1630 7.2E4 263.1428 1.3E4 263.1788 4.4E4 264.1843 5.3E3 265.1590 1.7E4 265.1946 2.4E4 267.1742 2.8E4 268.1819 1.1E4 269.1554 1.6E4 269.1898 3.4E4 270.1975 1.3E4 271.1690 5.2E4 273.1592 4.9E3 273.1863 2.3E4 274.1928 5.5E4 275.1791 8.0E3 277.1609 1.1E4 277.1949 2.9E4 279.1745 5.3E4 279.2054 3.4E3 280.1824 3.2E3 281.1899 5.9E4 282.1954 5.6E3 283.1719 4.6E3 283.2053 1.5E4 285.1852 5.4E4 286.1925 8.5E4 287.2008 6.5E4 289.1579 3.1E3 289.1953 2.4E4 291.1750 1.6E4 291.2104 1.2E4 293.1902 1.8E4 294.1979 2.1E4 295.1714 2.9E3 295.2056 5.4E4 297.1844 4.3E4 298.1926 1.1E4 299.2004 6.3E4 300.2084 8.5E3 301.1941 1.3E4 303.1957 1.8E5 305.1893 7.1E3 305.2241 3.0E3 307.2054 2.2E4 309.1832 1.8E4 309.2203 1.5E4 310.1912 1.2E4 311.2005 2.9E4 312.2074 2.5E4 313.2157 6.7E4 315.2115 3.9E3 319.2054 2.8E4 321.2204 4.0E3 322.2273 9.5E3 323.1990 5.6E3 325.2157 5.3E4 333.2216 9.2E3 337.2158 9.7E4 345.2221 6.1E3 347.2371 1.4E4 349.2143 6.5E3 349.2568 3.4E3 351.2315 3.4E3 352.2391 2.6E5 359.2344 1.1E4 363.2320 6.6E3 365.2465 1.2E5 366.2518 2.7E3 368.7940 2.6E3 377.2472 2.2E4 387.2681 1.2E4 391.2624 2.9E3 397.2561 2.6E3 405.2770 4.2E3 419.2912 3.8E3 437.3058 6.2E3 463.2672 2.5E3 469.3103 4.2E3 487.3191 4.6E4 487.3287 2.8E3 490.3365 2.7E3 502.3422 1.1E4 503.3505 6.9E4 505.3299 3.1E4 507.3468 1.1E4 508.3534 6.6E3 520.3530 2.3E4 567.3788 5.5E3 569.0071 2.7E3 585.3939 4.8E3 594.4513 2.6E3 600.4103 3.4E3 END IONS BEGIN IONS FEATURE_ID=728 PEPMASS=583.4150 SCANS=728 RTINSECONDS=911.427 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 63.8847 2.1E3 67.0539 1.2E4 69.0331 3.9E3 69.0694 1.6E4 74.1413 2.4E3 79.0539 9.4E3 81.0694 3.0E4 83.0487 7.8E3 83.0853 9.2E3 85.0646 3.0E3 88.9646 2.4E3 91.0541 1.1E4 93.0694 5.2E4 94.0966 2.2E3 95.0487 7.9E3 95.0850 4.7E4 97.0645 5.1E3 105.0694 4.1E4 106.0719 2.6E3 107.0850 5.4E4 109.0641 7.9E3 109.1007 2.9E4 117.0693 3.2E3 117.6647 2.3E3 119.0850 7.7E4 121.1006 9.3E4 123.0801 1.3E4 123.1164 1.0E4 125.0962 6.8E3 129.0690 2.5E3 131.0849 2.9E4 132.3567 2.5E3 132.5556 2.5E3 133.1006 5.7E4 135.0798 4.4E3 135.1163 2.7E4 137.0957 1.9E4 139.1113 6.0E3 143.0852 3.0E4 145.1006 6.8E4 147.0798 1.9E4 147.1164 2.2E4 149.0957 1.6E4 149.6811 4.0E3 149.6917 5.0E3 151.0752 2.5E4 151.9601 2.6E3 155.0851 4.3E3 157.1007 6.0E4 159.0800 4.5E3 159.1164 4.4E4 161.0957 1.4E4 161.1323 1.3E4 163.1109 3.7E3 165.0906 5.8E4 167.0849 2.5E3 167.0912 2.5E3 167.1062 5.1E4 169.1007 1.8E4 170.1075 2.9E3 171.1163 3.4E4 171.1307 2.6E3 173.0960 3.3E3 173.1320 3.2E4 173.5263 4.2E3 173.5346 5.4E4 175.1478 1.9E4 180.3471 2.5E3 181.1013 7.0E3 183.1164 2.5E4 185.1321 3.5E4 187.1108 3.0E3 187.1478 1.9E4 189.1272 7.1E3 191.1427 6.5E3 195.1163 2.2E4 196.1225 3.9E3 197.1321 2.9E4 199.1109 2.7E3 199.1481 1.7E4 200.1551 2.6E3 203.1431 3.2E4 207.1166 1.5E4 207.1375 1.1E4 208.1243 3.2E3 209.1320 3.3E4 211.1476 2.0E4 213.1632 2.8E3 215.1438 6.7E3 219.1163 2.6E3 221.1319 1.5E4 221.1536 7.9E4 223.1475 2.1E4 223.9696 2.5E3 225.1632 7.3E3 231.1720 2.6E3 233.1311 6.8E3 233.1539 2.9E4 235.1467 9.5E3 237.1632 1.1E4 247.1455 2.9E3 249.1634 3.1E3 253.6053 2.2E3 261.1618 4.1E3 263.1803 3.1E3 273.1591 2.7E3 275.1803 2.2E3 281.2951 7.5E4 282.2793 2.8E5 283.2825 2.9E5 285.1859 3.1E3 286.1924 3.0E3 287.2033 3.1E3 295.2077 6.5E3 297.2198 6.8E3 299.3057 8.8E4 300.3092 7.9E4 327.8639 2.5E3 349.2509 2.7E3 375.2693 5.1E3 403.3006 1.2E4 503.3529 6.5E3 520.5292 2.3E3 538.5456 3.5E3 565.4035 6.2E3 583.4090 1.9E4 END IONS BEGIN IONS FEATURE_ID=729 PEPMASS=584.4225 SCANS=729 RTINSECONDS=911.427 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 64.1565 5.0E3 67.0541 8.6E4 69.0334 3.1E4 69.0698 1.3E5 71.0491 1.9E4 72.6569 2.9E3 77.0393 3.3E3 79.0541 1.2E5 80.3637 2.6E3 81.0698 3.0E5 83.0491 6.6E4 83.0854 9.2E4 85.0647 4.9E4 87.0439 1.4E4 88.3451 5.5E3 89.0596 3.2E4 91.0542 1.3E5 91.7761 3.0E3 93.0698 4.3E5 93.0768 7.9E3 95.0491 9.0E4 95.0854 3.5E5 97.0647 6.7E4 97.1012 1.6E4 97.4181 2.9E3 99.0804 3.6E3 103.0392 3.6E3 105.0698 3.9E5 106.0774 1.0E4 107.0491 9.9E3 107.0772 1.1E4 107.0855 5.6E5 108.0936 4.0E3 109.0647 7.5E4 109.1011 3.1E5 111.0803 3.4E4 113.0960 1.6E4 115.0534 3.3E3 117.0698 8.0E4 119.0755 2.3E4 119.0855 8.0E5 119.0955 1.8E4 120.0932 5.3E4 121.0648 5.3E4 121.0910 1.6E4 121.1011 5.3E5 121.1114 5.0E3 122.1055 4.2E3 123.0803 5.8E4 123.1167 1.2E5 125.0960 5.7E4 128.0622 1.2E4 129.0698 5.3E4 130.0780 2.5E4 131.0855 3.4E5 132.0931 3.8E4 133.0646 2.6E4 133.0877 1.5E4 133.1011 6.0E5 133.1128 1.7E4 134.0731 3.3E3 134.1085 2.6E4 135.0805 1.5E5 135.1168 2.6E5 135.1283 4.3E3 137.0961 6.3E4 137.1325 3.9E3 139.1117 4.2E4 141.0699 1.0E4 142.0776 4.5E4 143.0855 3.2E5 144.0933 8.6E4 144.1981 2.9E3 145.0652 1.0E4 145.0899 1.4E4 145.1012 7.5E5 146.1084 3.7E4 147.0804 7.5E4 147.1168 2.7E5 148.0877 1.7E4 148.1237 3.0E3 149.0961 1.5E5 149.1325 6.6E4 151.1118 2.8E4 151.1482 1.3E4 153.0691 3.5E3 155.0855 7.9E4 155.1067 1.6E4 156.0933 6.8E4 157.0863 6.0E3 157.1012 5.7E5 158.1088 6.9E4 159.0805 2.0E5 159.1168 5.2E5 160.0882 3.2E4 160.1242 3.2E4 161.0962 2.1E5 161.1325 1.3E5 162.1039 7.3E3 163.1118 7.0E4 163.1481 3.0E4 165.0900 3.6E3 165.1271 6.8E3 165.6156 3.1E3 167.0860 3.6E4 167.1067 1.1E5 168.0932 2.1E4 168.1090 8.1E3 169.1014 2.3E5 170.1090 7.1E4 171.0811 2.4E4 171.1170 4.1E5 172.0888 7.8E3 172.1245 5.9E4 173.0962 8.5E4 173.1148 2.8E3 173.1327 4.7E5 173.5241 3.7E4 173.5379 6.9E4 174.1035 8.2E3 174.1399 2.8E4 175.1119 1.2E5 175.1483 2.8E5 177.1276 5.5E4 179.0858 3.1E4 179.1442 3.2E3 180.0935 1.1E4 181.1014 1.2E5 182.1090 5.3E4 183.1170 3.5E5 184.1246 5.4E4 185.0962 3.4E4 185.1326 3.0E5 185.1515 4.1E3 186.1041 1.8E4 186.1404 5.5E4 187.1119 6.6E4 187.1483 2.4E5 188.1189 1.5E4 189.1276 6.6E4 189.1639 2.1E4 190.1353 2.4E4 191.1433 7.7E4 192.0944 5.8E3 193.1014 8.3E4 193.1203 1.9E4 193.1592 5.8E3 194.1091 6.8E4 195.1169 2.8E5 196.1245 7.6E4 197.0966 3.5E4 197.1326 4.2E5 198.1401 4.2E4 199.1122 7.4E4 199.1482 2.4E5 200.1551 1.5E4 201.1277 7.7E4 201.1639 1.3E5 203.1433 8.2E4 205.1010 4.9E3 205.1592 2.7E4 206.1093 2.0E4 207.1171 1.5E5 208.1249 5.9E4 209.0974 2.4E4 209.1327 3.1E5 210.1404 5.4E4 211.1120 4.8E4 211.1484 2.6E5 211.1712 4.3E3 212.1195 2.3E4 212.1559 2.8E4 213.1277 1.0E5 213.1642 9.9E4 214.1349 7.8E3 215.1435 5.3E4 215.1796 4.5E3 217.1230 1.2E4 217.1592 6.4E4 218.1088 3.5E3 218.1663 1.7E4 219.1172 4.6E4 219.1752 5.7E3 220.1248 3.7E4 221.1329 1.4E5 221.1547 1.7E4 222.1407 4.1E4 223.1114 3.1E4 223.1485 2.3E5 224.1564 4.9E4 225.1276 8.4E4 225.1641 1.4E5 226.1360 4.1E3 226.1714 9.9E3 227.1432 6.4E4 227.1797 3.2E4 228.1473 6.2E3 229.1591 3.3E4 231.1169 1.1E4 231.1748 1.7E4 232.1247 1.1E4 233.1317 5.6E4 233.1541 3.2E5 234.1396 2.9E4 235.1484 1.5E5 236.1560 3.4E4 237.1280 2.7E4 237.1324 9.8E3 237.1639 1.6E5 238.1729 1.0E4 239.1436 4.1E4 239.1796 1.0E5 240.1860 2.9E3 241.1588 4.6E4 241.1948 3.5E4 243.1746 2.6E4 245.1320 4.0E4 246.1401 3.3E4 246.1641 1.1E4 247.1482 7.8E4 248.1556 2.7E4 249.1298 1.2E4 249.1638 1.2E5 250.1715 2.7E4 251.1454 2.1E4 251.1793 8.5E4 252.1868 2.0E4 253.1587 7.9E4 253.1954 5.3E4 255.1445 5.6E3 255.1743 5.0E5 257.1901 5.2E4 258.1404 1.1E4 258.1964 3.6E3 259.1474 3.9E4 259.2051 4.5E3 260.1553 3.2E4 261.1638 1.2E5 262.1714 1.6E4 263.1462 1.0E4 263.1795 8.7E4 264.1875 1.7E4 265.1614 2.3E4 265.1951 6.1E4 267.1746 3.8E4 267.2092 2.8E4 268.1828 2.3E4 269.1907 4.4E4 270.1984 2.1E4 271.1457 5.6E3 271.1720 1.9E4 271.2036 2.1E4 273.1634 5.0E4 273.1890 1.9E4 274.1715 1.5E4 275.1797 6.9E4 276.1873 1.6E4 277.1613 1.7E4 277.1955 4.3E4 278.1994 3.4E3 279.1751 4.9E4 279.2099 2.4E4 281.1904 4.9E4 282.1965 3.7E3 282.2778 1.1E4 283.2057 4.1E4 283.2828 2.9E4 284.2141 8.4E3 284.2867 1.4E4 285.1598 4.7E3 285.1890 1.8E4 285.2211 2.7E4 287.1794 4.2E4 289.1592 8.8E3 289.1955 3.8E4 291.1756 1.2E4 291.2114 2.9E4 293.1911 2.6E4 293.2265 7.0E3 295.2062 4.3E4 297.1871 1.9E4 297.2215 2.7E4 299.2054 5.7E3 299.3055 7.5E3 300.3081 9.1E3 301.1956 4.2E4 301.3135 3.4E3 303.1740 3.3E3 303.2111 2.3E4 305.1907 1.1E4 307.2055 2.4E4 308.2159 3.7E3 309.2222 4.1E3 311.2382 3.9E3 313.1941 1.1E4 315.2106 1.9E4 317.1917 8.2E3 319.2058 2.3E4 321.2222 7.7E3 323.2392 8.8E3 327.2111 2.1E4 329.2266 2.2E4 330.7422 3.1E3 331.2423 7.9E3 333.2214 1.2E4 334.2319 7.1E3 335.2367 9.0E3 337.2537 4.2E3 341.2276 3.4E3 345.2213 5.5E4 347.2365 2.3E4 349.2522 2.3E4 357.2198 4.1E3 359.2383 3.1E3 360.2452 2.1E4 365.2462 1.4E4 373.2532 4.5E3 385.2541 6.4E3 387.2714 3.7E3 398.2594 6.2E3 400.1882 5.7E3 413.2867 1.1E4 441.3078 3.2E3 459.3242 1.4E4 551.3879 8.5E3 END IONS BEGIN IONS FEATURE_ID=730 PEPMASS=415.3000 SCANS=730 RTINSECONDS=911.645 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 55.0540 4.7E4 55.0825 2.3E3 55.1355 2.4E3 57.0332 3.1E3 57.0697 1.4E4 65.0387 2.5E3 66.9246 2.5E3 67.0506 2.9E3 67.0539 1.1E5 69.0332 1.7E4 69.0696 7.4E4 71.0488 1.5E4 76.1315 2.3E3 77.0384 7.3E3 79.0539 1.0E5 81.0647 3.4E3 81.0696 1.8E5 83.0853 1.9E4 86.3626 2.7E3 91.0483 3.9E3 91.0539 1.4E5 91.0604 2.2E3 93.0696 3.7E5 93.0767 5.0E3 95.0489 6.1E4 95.0852 2.4E5 97.0645 1.8E4 99.9946 2.4E3 103.0540 8.8E3 104.9436 2.5E3 105.0449 2.3E3 105.0616 8.7E3 105.0696 3.5E5 105.0781 5.0E3 107.0488 3.5E3 107.0852 3.2E5 109.0646 3.4E4 109.1009 1.9E5 111.0798 3.4E3 115.0544 5.3E3 116.0617 9.0E3 117.0697 5.9E4 119.0756 1.0E4 119.0853 4.3E5 119.0935 3.1E3 119.0955 8.6E3 119.2118 2.7E3 120.0931 4.0E3 121.0646 2.0E4 121.0910 8.4E3 121.1010 4.0E5 121.1095 2.7E3 123.0803 4.1E4 123.1166 3.2E4 128.0617 1.7E4 129.0698 3.9E4 130.0775 2.3E4 131.0748 4.3E3 131.0854 3.2E5 131.0968 5.7E3 132.0933 1.3E4 133.1010 2.8E5 133.1127 4.6E3 135.0803 5.3E4 135.1167 1.0E5 141.0696 8.0E3 142.0775 4.1E4 143.0854 1.6E5 144.0932 3.7E4 145.0655 2.9E3 145.1011 3.9E5 145.1144 5.3E3 146.0726 6.2E3 146.1089 7.9E3 147.0803 2.3E4 147.1167 9.1E4 149.0961 5.2E4 149.1315 3.0E3 154.0791 3.4E3 155.0854 4.6E4 156.0933 4.1E4 157.0865 3.1E3 157.1011 2.3E5 158.1089 3.1E4 159.0806 2.0E4 159.1168 1.5E5 161.0961 9.1E4 161.1325 3.3E4 163.1122 6.0E3 165.0701 6.9E3 167.0855 1.9E4 168.0941 1.1E4 168.4669 2.6E3 169.1014 9.3E4 170.1091 3.1E4 171.1169 1.1E5 172.1247 1.9E4 173.0965 2.0E4 173.1327 1.1E5 173.5244 4.2E4 173.5420 3.2E4 175.1120 8.9E3 175.1483 5.1E4 179.0855 3.0E4 180.0938 1.5E4 181.1012 4.7E4 182.1091 3.6E4 183.1171 9.0E4 184.1248 1.8E4 185.0955 1.3E4 185.1327 5.7E4 186.1406 2.8E3 187.1119 3.7E3 187.1483 5.3E4 189.1277 3.0E3 193.1013 2.5E4 194.1091 4.5E4 195.1170 7.1E4 196.1249 2.2E4 197.1327 9.1E4 197.1653 2.4E3 198.1403 9.1E3 199.1125 8.6E3 199.1483 4.8E4 201.1273 8.7E3 201.1639 1.4E4 206.1097 8.7E3 207.1171 2.5E4 208.1250 1.6E4 209.1329 7.2E4 210.1405 1.3E4 211.1486 4.1E4 213.1269 8.8E3 213.1641 1.5E4 213.8824 2.4E3 215.1432 8.2E3 219.1170 7.1E3 220.1252 1.0E4 221.1328 2.4E4 222.1403 7.0E3 223.1486 3.9E4 224.1255 2.4E3 225.1641 1.3E4 231.1171 5.7E3 233.1326 9.9E3 234.1410 3.6E3 235.1487 1.4E4 237.1295 2.6E3 237.1639 8.2E3 239.1802 3.6E3 245.1304 2.5E3 247.1488 4.4E3 249.1637 3.6E3 251.1797 1.8E4 253.1944 3.4E3 261.1629 7.0E3 263.1815 2.8E3 266.2031 3.8E3 266.5362 2.8E3 267.2093 5.6E3 295.5512 2.5E3 306.2795 7.2E3 347.9008 2.6E3 383.5614 3.0E3 415.3050 7.5E3 END IONS BEGIN IONS FEATURE_ID=731 PEPMASS=783.5729 SCANS=731 RTINSECONDS=912.705 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 6 (0 removed due to low quality, 0 removed due to low cosine). 71.0728 1.1E4 71.6283 2.3E3 72.2661 2.7E3 72.5206 2.7E3 72.5560 2.6E3 76.2420 2.3E3 78.0604 2.2E3 86.0960 2.9E5 87.0994 3.3E4 94.6484 2.8E3 98.9841 1.7E4 101.4443 2.3E3 101.9942 2.3E3 102.3007 2.4E3 104.1066 3.0E4 105.6145 2.3E3 108.0719 2.3E3 111.4163 2.4E3 117.8776 2.7E3 118.4527 2.4E3 121.8189 2.3E3 124.9995 1.5E5 152.3177 2.5E3 153.5339 2.7E3 173.5198 8.2E3 173.5284 1.2E5 173.5392 3.9E4 173.5470 1.0E4 174.5632 2.4E3 184.0351 7.9E3 184.0733 2.9E6 185.0766 3.7E5 195.0612 2.7E3 231.5514 2.7E3 255.9224 2.4E3 288.7493 2.3E3 293.8051 2.7E3 296.8878 2.4E3 312.0170 2.8E3 362.6276 3.0E3 397.1547 2.4E3 410.4938 2.7E3 418.3673 2.7E3 448.5591 2.6E3 533.2141 2.6E3 726.6108 2.8E3 728.2039 2.7E3 757.7662 2.6E3 END IONS BEGIN IONS FEATURE_ID=732 PEPMASS=932.6307 SCANS=732 RTINSECONDS=913.491 CHARGE=1+ MSLEVEL=2 MERGED_STATS=12 / 22 (10 removed due to low quality, 0 removed due to low cosine). 77.0387 2.5E4 78.2512 2.2E3 78.3160 1.6E4 78.5889 2.3E3 79.0540 7.5E5 79.7012 2.2E3 80.2603 2.3E3 81.0333 4.9E4 81.0697 3.0E6 81.0778 3.5E3 81.4995 2.5E3 82.1719 3.7E3 83.0489 5.5E4 83.0853 1.1E6 83.0941 2.8E3 83.8118 2.5E3 85.0225 5.2E3 85.0281 1.3E6 85.0646 1.2E5 85.1010 9.1E5 85.8777 4.4E3 87.0435 6.0E3 88.7723 3.3E3 89.0595 1.0E5 91.0326 4.0E3 91.0388 9.0E5 91.0540 4.4E5 92.9571 4.6E3 93.0697 1.2E6 94.8754 2.4E3 95.0490 8.2E4 95.0854 3.6E6 95.0923 4.4E3 96.0443 3.5E4 96.0963 4.3E3 97.0214 4.3E3 97.0282 7.1E5 97.0646 1.3E5 97.1010 6.8E5 99.0439 8.1E4 99.0802 1.2E5 99.1169 1.5E4 100.2664 3.1E3 101.0232 5.6E3 101.0594 3.0E4 102.9653 2.2E3 103.0751 1.1E5 105.0446 8.0E3 105.0696 5.2E5 107.0772 1.7E4 107.0853 1.1E6 109.0281 5.2E4 109.0646 4.4E4 109.0927 4.4E3 109.1010 2.3E6 109.1094 8.4E3 111.0803 9.4E4 111.1166 1.9E5 113.0959 5.3E4 115.0388 5.3E4 115.0544 2.7E3 116.3553 4.0E3 117.0546 3.9E3 117.0697 2.1E5 117.0907 4.8E4 119.0756 3.6E3 119.0853 6.8E5 121.0910 4.5E4 121.1009 1.5E6 121.1099 2.5E3 121.1107 6.4E3 121.2039 2.6E3 123.0802 6.8E4 123.1069 5.0E3 123.1166 1.2E6 125.0959 8.1E4 125.1322 7.6E4 127.0388 4.0E5 127.0751 3.0E3 129.0545 1.1E4 129.3946 2.3E3 131.0747 1.4E4 131.0853 6.0E5 131.1064 3.9E3 133.1010 7.9E5 135.0803 1.1E4 135.1056 8.4E3 135.1166 1.5E6 135.1277 1.7E4 137.0957 7.8E4 137.1323 5.1E5 139.1115 8.5E4 139.1482 1.2E4 141.0698 2.9E3 143.0864 6.0E3 144.0653 3.8E4 145.0493 4.2E5 145.1010 6.2E5 145.1214 7.9E3 147.1038 5.0E3 147.1166 7.2E5 147.1297 5.0E3 149.0957 4.2E4 149.1183 1.4E4 149.1323 1.1E6 149.1463 1.6E4 151.1117 6.3E4 151.1479 1.8E5 153.1272 7.0E4 156.8404 2.3E3 157.1012 1.2E4 157.4860 4.2E3 159.1024 2.1E4 159.1167 7.0E5 159.1325 5.7E3 159.1382 5.1E3 161.1183 6.5E3 161.1323 7.1E5 161.2345 2.5E3 161.4302 2.2E3 162.0766 3.1E3 162.5862 2.7E3 163.0599 1.1E5 163.1121 4.8E4 163.1480 6.8E5 164.4245 2.6E3 165.1271 5.4E4 165.1638 8.6E4 167.1430 1.7E4 169.1017 6.8E3 170.1716 3.4E3 171.1169 4.1E4 173.1325 8.1E5 173.1498 1.1E4 173.5203 7.2E3 173.5330 4.3E5 173.5459 2.0E4 175.1481 3.0E5 175.1635 2.5E3 177.1272 5.8E4 177.1636 2.4E5 178.1757 2.4E3 179.1431 6.4E4 179.1788 3.1E3 181.1593 3.4E3 183.1162 2.5E3 185.1325 2.5E4 186.8375 2.4E3 187.1480 4.7E5 187.1665 9.5E3 189.1637 5.8E4 191.1430 4.8E4 191.1798 3.1E3 193.1587 7.3E3 193.8677 3.0E3 195.1371 9.9E3 199.1486 2.8E4 201.1637 1.7E5 201.1821 3.7E3 203.1798 9.7E3 205.1588 5.8E4 206.1452 3.6E3 206.8744 3.8E3 209.1540 6.9E3 211.1479 3.2E3 215.1794 6.0E4 215.2000 3.5E3 217.1942 1.6E4 219.1749 7.3E4 219.2105 3.0E3 221.2265 1.1E5 223.1683 1.3E4 225.5071 2.5E3 233.2263 2.0E5 235.1708 2.4E3 237.1852 3.4E3 237.2217 3.1E3 239.2368 5.7E5 239.9236 2.4E3 241.1955 7.7E3 243.2105 1.1E6 245.2258 4.7E3 247.1716 4.0E3 249.9734 2.4E3 257.2472 7.1E5 259.2055 4.4E4 261.2209 4.0E6 261.2456 5.4E3 261.2546 4.4E3 272.2914 2.4E3 275.2021 1.3E4 277.2163 6.2E4 279.1989 1.8E4 279.2320 1.1E5 287.6415 2.8E3 290.1893 2.6E3 291.2316 7.0E4 299.2372 5.7E4 299.4754 2.9E3 301.2176 2.4E3 303.0300 2.4E3 305.2490 3.1E3 311.2550 3.2E3 313.1896 1.3E4 313.2737 1.1E7 313.3571 6.3E3 314.2876 2.7E3 317.0869 2.4E3 317.2476 5.1E5 333.2417 1.7E4 335.2214 9.4E3 335.2579 6.8E6 336.2603 3.2E3 345.9736 2.4E3 353.2651 4.7E3 374.1974 2.4E3 383.0246 2.7E3 383.5640 2.5E3 394.8692 2.2E3 403.5456 2.7E3 412.2527 3.0E3 452.7477 2.7E3 453.9497 2.4E3 459.3342 3.3E3 474.7510 4.5E3 477.9419 2.5E3 481.4437 1.0E4 490.2188 2.6E3 499.4494 9.0E4 519.4103 2.3E3 558.6247 2.7E3 572.8602 2.6E3 573.4871 1.4E6 573.5901 4.9E3 574.1130 2.5E3 591.5016 2.5E3 607.3811 4.5E3 624.3607 2.5E3 626.3514 2.9E3 641.8248 5.3E3 697.0721 2.6E3 699.7314 2.9E3 753.0384 2.6E3 776.2699 3.1E3 803.2523 3.1E3 817.1208 2.9E3 860.8926 3.7E3 895.9207 2.4E3 END IONS BEGIN IONS FEATURE_ID=733 PEPMASS=583.4150 SCANS=733 RTINSECONDS=915.929 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 2 (0 removed due to low quality, 0 removed due to low cosine). 67.0542 3.2E3 68.2352 2.3E3 69.0695 2.8E3 69.8261 2.4E3 73.3630 2.4E3 81.0695 1.2E4 83.0852 1.2E4 84.2525 2.3E3 88.8651 2.4E3 93.0695 1.7E4 95.0486 2.8E3 95.0850 1.7E4 96.7823 2.2E3 96.9053 2.2E3 97.0644 9.2E3 103.6424 2.4E3 105.0437 2.7E3 105.0693 1.8E4 107.0850 2.4E4 109.1007 9.9E3 112.3704 2.4E3 113.0958 4.7E3 119.0851 2.6E4 121.1008 2.8E4 123.0799 6.8E3 131.0851 9.9E3 133.1008 1.7E4 135.1165 1.0E4 137.0948 3.2E3 139.1111 5.1E3 143.0851 4.8E3 145.1007 2.3E4 147.0802 4.2E3 147.1164 1.3E4 151.0747 8.7E3 157.1009 1.8E4 159.1166 1.3E4 161.1326 4.2E3 163.1126 3.1E3 165.0909 2.9E4 169.1018 7.9E3 171.1169 1.5E4 173.1323 1.1E4 173.5201 1.2E4 173.5381 4.9E4 175.1481 3.5E3 181.1013 2.9E3 183.1163 1.1E4 185.1323 1.1E4 187.1477 3.3E3 189.1270 3.0E3 195.1165 4.7E3 197.1319 1.1E4 199.1484 3.8E3 203.1428 1.2E4 207.1372 3.1E3 209.1325 1.4E4 211.1468 6.9E3 221.1536 3.4E4 223.1494 3.7E3 237.1632 2.7E3 249.1635 3.9E3 250.4106 2.8E3 265.1948 2.7E3 267.1139 2.4E3 275.1811 2.8E3 281.2954 3.9E4 282.2796 1.2E5 283.2826 1.5E5 295.2022 2.6E3 299.3058 3.6E4 300.3092 4.3E4 403.2992 2.6E3 454.4863 2.8E3 503.3521 3.9E3 583.4110 6.7E3 END IONS BEGIN IONS FEATURE_ID=734 PEPMASS=600.4171 SCANS=734 RTINSECONDS=915.929 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 67.0541 3.9E4 69.0334 3.1E4 69.0698 3.8E4 71.0492 9.2E3 74.2891 2.6E3 76.5739 2.4E3 77.0386 5.5E3 78.2688 2.3E3 79.0542 3.7E4 80.0623 2.4E3 81.0698 1.1E5 83.0491 5.1E4 83.0854 3.7E4 85.0647 2.2E4 87.0439 1.4E4 87.3015 2.6E3 89.0595 1.4E5 91.0542 4.7E4 93.0697 1.9E5 93.0768 4.4E3 95.0491 7.1E4 95.0855 1.6E5 96.0889 8.1E3 96.5307 2.4E3 97.0647 6.1E4 97.1010 3.8E3 102.3664 2.4E3 105.0619 3.6E3 105.0698 1.6E5 106.0781 4.0E3 106.9701 2.4E3 107.0498 3.4E3 107.0853 2.1E5 107.0934 5.2E3 109.0647 6.2E4 109.1011 8.9E4 111.0441 6.7E3 111.0805 3.4E4 113.0958 2.2E4 113.3097 2.4E3 115.0543 3.0E3 117.0699 3.0E4 119.0497 4.9E3 119.0854 2.5E5 119.0956 3.3E3 120.0928 1.3E4 121.0648 3.9E4 121.0910 3.4E3 121.1011 2.6E5 121.1105 5.0E3 122.0721 2.9E3 122.1043 1.2E4 123.0436 4.2E3 123.0803 1.2E5 123.1168 2.6E4 125.0596 3.8E4 125.0961 5.3E4 128.0626 6.9E3 129.0697 2.4E4 130.0781 5.4E3 131.0854 1.1E5 132.0932 1.4E4 133.0291 2.6E3 133.0646 2.9E4 133.0858 7.7E4 133.1011 2.0E5 133.1127 3.9E3 134.1079 4.5E3 134.3132 2.7E3 135.0803 1.0E5 135.1167 8.9E4 135.1459 2.3E3 136.0842 2.5E3 137.0598 1.6E4 137.0960 7.5E4 139.0755 2.3E4 139.1118 3.5E4 141.0703 3.1E3 142.0778 2.1E4 143.0854 1.4E5 144.0930 5.2E4 145.0650 8.2E3 145.0893 2.7E3 145.1011 2.7E5 145.1142 4.6E3 146.1080 1.6E4 147.0804 1.4E5 147.1168 8.3E4 148.0878 7.5E3 149.0960 7.3E4 149.1324 6.0E3 150.1031 6.4E3 151.0753 1.3E5 151.1117 2.1E4 152.0812 4.3E3 153.0911 1.6E4 155.0856 3.0E4 155.1070 1.2E4 156.0932 2.7E4 157.0860 5.4E3 157.1011 3.2E5 158.1080 4.7E4 159.0805 5.1E4 159.1167 1.9E5 160.0882 5.3E4 160.1225 1.1E4 161.0961 1.3E5 161.1324 6.1E4 162.1027 6.8E3 163.0755 5.0E3 163.1116 1.2E5 164.1173 8.1E3 165.0681 3.7E3 165.0911 3.9E5 165.1258 3.5E3 166.0946 2.7E4 167.0883 1.2E4 167.1068 8.3E4 169.1012 9.2E4 170.1088 3.8E4 171.0809 1.2E4 171.1169 2.0E5 172.0885 5.9E3 172.1238 5.7E4 173.0963 6.3E4 173.1325 1.1E5 173.5103 3.0E3 173.5310 9.9E4 173.5395 2.6E4 174.1038 5.2E3 174.1400 3.6E3 175.1119 1.1E5 175.1483 5.0E4 176.1186 6.1E3 177.0909 2.4E4 177.1115 7.4E3 177.1275 3.6E4 178.0993 1.3E4 179.0874 7.2E3 179.1071 4.0E4 179.1431 1.3E4 180.0970 4.1E3 180.1148 2.1E4 180.1476 2.3E3 181.0853 8.3E3 181.1016 4.3E4 181.1222 5.6E4 182.1088 1.7E4 182.1264 3.4E3 183.0804 2.8E3 183.1169 1.2E5 184.1233 2.7E4 185.0963 2.4E4 185.1326 1.5E5 186.1037 7.0E3 186.1401 2.5E4 187.1120 4.9E4 187.1478 4.1E4 188.1194 7.1E3 189.0912 3.6E3 189.1274 9.3E4 190.1350 6.7E4 191.1069 2.5E4 191.1429 4.5E4 193.1017 3.4E4 193.1224 6.6E4 194.1088 9.9E3 195.1168 1.1E5 195.1385 1.6E4 196.1237 2.9E4 197.0967 1.6E4 197.1152 3.5E3 197.1326 1.4E5 198.1044 1.2E4 198.1383 2.0E4 199.1118 5.1E4 199.1482 5.9E4 200.1191 5.8E3 201.1277 5.1E4 201.1631 4.2E3 202.1339 2.8E3 203.1089 2.9E3 203.1432 2.4E5 203.1650 5.1E3 204.1470 2.2E4 205.1020 3.4E3 205.1226 1.3E4 205.1604 3.1E3 206.1095 3.2E3 206.1301 3.7E3 207.1169 5.3E4 207.1384 1.0E5 208.1244 2.8E4 208.1454 2.9E4 209.0972 4.6E3 209.1325 1.0E5 209.1538 1.4E4 210.1045 3.2E3 210.1393 2.9E4 211.1118 3.7E4 211.1482 8.4E4 212.1193 1.0E4 212.1543 7.6E3 213.1274 6.7E4 213.1641 2.8E4 214.1332 1.1E4 215.1067 1.5E4 215.1432 3.6E4 216.1508 1.0E4 217.1222 1.6E4 217.1593 1.7E4 218.1300 6.7E3 218.1659 4.2E3 219.1169 1.3E4 219.1385 5.4E4 220.1242 8.8E3 220.1463 5.8E3 221.1324 5.7E4 221.1539 4.3E5 222.1371 5.2E3 222.1575 3.1E4 223.1121 1.3E4 223.1483 8.8E4 224.1546 1.2E4 225.1276 4.4E4 225.1641 5.4E4 227.1433 3.7E4 227.1808 6.8E3 228.1501 3.4E3 229.1226 1.5E4 229.1591 2.5E4 230.1313 5.5E3 230.1650 2.6E3 231.1387 1.2E4 231.1746 6.5E3 232.1238 6.2E3 233.1315 2.4E4 233.1541 1.4E5 234.1375 2.9E3 234.1607 5.6E4 235.1480 5.5E4 235.1708 3.8E3 236.1549 9.6E3 237.1257 1.3E4 237.1492 7.2E4 237.1661 3.4E3 238.1348 3.5E3 238.1709 9.7E3 239.1432 2.4E4 239.1791 2.2E4 240.1509 4.1E3 241.1588 2.4E4 243.1385 1.2E4 243.1752 5.3E3 245.1304 1.0E4 245.1546 1.2E4 246.1383 6.0E3 246.1618 7.8E3 247.1313 2.7E3 247.1454 1.9E4 247.1700 5.8E4 248.1529 3.9E3 249.1294 4.8E3 249.1638 5.3E4 250.1601 7.3E3 251.1437 1.3E4 251.1795 2.9E4 252.1848 6.8E3 253.1585 4.3E4 253.1923 9.6E3 254.1671 3.1E3 255.1432 4.8E3 255.1744 1.2E5 256.1827 4.4E3 257.1539 1.0E4 257.1914 1.0E4 259.1449 1.1E4 259.1697 2.9E4 261.1632 6.7E4 262.1703 5.5E3 263.1422 7.6E3 263.1793 3.0E4 265.1585 1.6E4 265.1942 2.1E4 267.1431 3.7E3 267.1749 3.0E4 267.2029 2.7E3 268.1813 1.5E4 269.1544 7.9E3 269.1901 3.0E4 270.1969 1.0E4 271.1695 4.6E4 272.1795 5.1E3 273.1863 1.8E4 274.1657 2.9E3 274.1934 4.7E4 275.1498 2.9E3 275.1792 1.6E4 276.1864 3.9E3 277.1603 9.5E3 277.1949 2.8E4 278.1714 3.1E3 279.1746 5.5E4 279.2087 8.2E3 280.1823 3.4E3 281.1571 9.7E3 281.1904 4.6E4 282.1986 4.1E3 283.1717 9.8E3 283.2070 4.9E3 285.1856 5.1E4 286.1930 8.3E4 287.2011 6.4E4 289.0227 2.6E3 289.1950 1.7E4 290.1997 2.6E3 291.1740 1.1E4 291.2091 1.1E4 293.1898 1.5E4 294.1982 1.5E4 295.1702 5.8E3 295.2066 3.9E4 296.1732 3.0E3 297.1856 4.4E4 298.1939 3.8E3 299.2012 6.3E4 300.2087 5.3E3 301.1948 1.1E4 303.1961 1.5E5 305.1907 8.9E3 306.2350 2.8E3 307.2065 1.5E4 309.1845 2.0E4 309.2229 1.1E4 309.3401 2.5E3 310.1926 1.5E4 311.2022 1.5E4 312.2089 1.9E4 313.1857 2.8E3 313.2165 5.9E4 315.2105 7.2E3 317.2269 4.0E3 319.2056 3.0E4 321.2221 3.6E3 322.2299 6.9E3 323.2003 8.7E3 325.2167 4.3E4 329.2301 3.7E3 331.2062 3.4E3 332.2139 2.9E3 333.2217 7.5E3 334.2313 2.7E3 336.5795 2.7E3 337.2166 9.2E4 338.2222 3.3E3 339.2321 6.6E3 341.2288 3.0E3 347.2369 1.6E4 349.2158 8.0E3 350.2186 3.7E3 351.2331 1.3E4 352.2394 2.1E5 359.2372 7.8E3 363.2323 1.1E4 364.2377 3.4E3 365.2477 1.1E5 373.2551 3.3E3 375.2738 3.4E3 377.2482 1.9E4 379.2622 3.8E3 381.2429 3.8E3 383.2619 3.0E3 387.2682 6.0E3 391.2627 4.9E3 397.2725 3.3E3 403.2595 4.0E3 405.2825 6.2E3 419.2962 4.5E3 421.2733 5.4E3 428.7787 2.6E3 437.3062 4.5E3 469.3078 6.9E3 487.3200 4.3E4 502.3429 6.0E3 503.3516 5.5E4 505.3311 3.2E4 507.3471 1.8E4 508.3454 7.2E3 520.3546 2.5E4 567.3810 3.9E3 585.3961 6.4E3 589.3093 3.0E3 600.4176 3.3E3 END IONS BEGIN IONS FEATURE_ID=735 PEPMASS=599.4101 SCANS=735 RTINSECONDS=916.149 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 2 (0 removed due to low quality, 0 removed due to low cosine). 64.2178 2.5E3 65.2061 2.5E3 67.0540 1.7E4 69.0334 1.0E4 69.0698 1.1E4 71.0492 2.9E3 76.7699 2.7E3 79.0540 1.2E4 81.0697 3.5E4 83.0490 1.7E4 83.0854 2.0E4 85.0646 1.0E4 87.0436 2.6E3 91.0541 8.2E3 93.0697 5.5E4 93.0762 4.1E3 94.5737 2.3E3 95.0489 2.0E4 95.0853 4.2E4 97.0646 3.6E4 97.1010 3.3E3 105.0697 3.5E4 107.0853 6.1E4 109.0650 1.3E4 109.1011 2.4E4 111.0801 1.0E4 113.0959 2.3E4 117.0696 2.8E3 119.0853 6.1E4 121.0649 1.3E4 121.0921 3.5E3 121.1010 8.4E4 123.0803 2.9E4 123.1162 8.4E3 125.0597 1.1E4 125.0959 1.8E4 129.0695 2.6E3 131.0854 2.9E4 133.0648 6.9E3 133.1011 4.5E4 135.0804 2.5E4 135.1167 2.4E4 137.0960 3.1E4 139.1116 2.4E4 143.0855 3.7E4 144.0930 8.8E3 145.1011 6.9E4 147.0802 5.2E4 147.1167 1.8E4 149.0960 1.8E4 149.6863 5.1E3 149.7075 2.9E3 151.0751 4.6E4 151.1111 2.5E3 153.0909 3.6E3 153.1275 8.1E3 155.0857 9.1E3 155.1062 9.6E3 156.0931 3.6E3 157.1010 6.4E4 158.1091 2.5E3 159.0801 1.3E4 159.1167 3.8E4 159.2739 2.4E3 161.0961 2.3E4 161.1325 2.3E4 162.6475 2.4E3 163.1117 3.0E4 165.0910 1.9E5 167.1066 3.0E4 169.1012 2.7E4 170.1092 3.4E3 171.1169 4.3E4 173.0958 1.1E4 173.1328 2.6E4 173.5287 3.5E4 173.5370 4.1E3 173.5469 4.3E3 175.1119 1.4E4 175.1475 9.8E3 177.0904 2.9E3 177.1267 3.2E3 179.1430 1.2E4 181.1023 1.1E4 181.1224 3.0E4 183.1169 3.2E4 185.0960 8.1E3 185.1327 2.6E4 187.1113 1.2E4 187.1488 1.1E4 189.1275 2.1E4 190.1347 2.8E3 191.1071 6.7E3 191.1432 1.2E4 193.1014 9.5E3 193.1222 3.3E3 194.1087 3.3E3 195.1168 2.4E4 195.1365 8.7E3 197.1325 3.7E4 199.1114 9.5E3 199.1478 1.2E4 201.1271 1.2E4 201.1641 3.7E3 203.1432 8.4E4 205.1579 3.1E3 207.1168 1.2E4 207.1383 2.9E4 208.1248 3.9E3 209.1327 3.0E4 211.1113 5.7E3 211.1486 2.3E4 213.1282 9.4E3 213.1643 3.2E3 215.1432 1.1E4 219.1171 3.5E3 221.1322 1.8E4 221.1539 1.5E5 222.1401 3.6E3 223.1482 2.7E4 224.5936 2.4E3 225.1271 4.6E3 225.1634 9.8E3 227.1433 8.6E3 227.5593 2.6E3 229.1210 3.4E3 229.1591 8.9E3 231.1390 6.5E3 233.1306 9.0E3 233.1540 6.2E4 235.1481 1.5E4 237.1665 3.8E3 239.1434 5.1E3 239.1804 4.6E3 241.1566 2.6E3 247.1447 5.1E3 247.1696 2.0E4 249.1640 4.8E3 251.1795 1.1E4 253.1587 3.0E3 255.1748 5.8E3 257.1890 2.5E3 259.1482 3.3E3 259.1721 4.1E3 261.1636 5.2E3 263.1801 1.3E4 265.1946 6.8E3 269.1899 1.2E4 273.1869 6.2E3 275.1797 4.1E3 281.1904 1.5E4 285.1865 9.1E3 286.1925 1.1E4 287.2012 2.4E4 289.0461 2.6E3 289.1984 2.5E3 291.1743 4.8E3 293.1890 2.9E3 295.2069 4.7E3 298.1947 4.8E3 299.2006 2.0E4 311.2016 5.3E3 312.2077 8.6E3 313.2179 4.9E3 349.2158 2.8E3 364.2397 5.8E3 365.2463 5.5E3 378.6661 2.5E3 391.2626 3.0E3 413.2724 8.4E3 439.9656 2.4E3 507.3440 1.4E4 597.8586 2.5E3 599.4095 1.0E4 END IONS BEGIN IONS FEATURE_ID=736 PEPMASS=638.4397 SCANS=736 RTINSECONDS=916.149 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 5 (0 removed due to low quality, 0 removed due to low cosine). 65.6192 2.2E3 65.8431 2.5E3 67.0538 8.0E4 68.3273 2.1E3 69.0694 1.9E5 69.9961 2.9E3 71.0488 2.0E4 71.0851 1.4E5 73.0817 2.3E3 75.2534 2.4E3 76.6423 2.6E3 79.0539 2.1E4 81.0694 1.8E5 83.0488 1.7E4 83.0850 3.1E5 85.0645 2.0E4 85.1007 1.2E5 88.7498 2.6E3 92.5293 2.2E3 93.0693 8.1E4 95.0850 2.3E5 97.0643 6.9E4 97.1006 1.2E5 97.2648 2.4E3 99.0801 4.2E3 99.1171 2.6E3 99.2286 2.4E3 99.9862 2.6E3 100.5685 2.4E3 101.0592 1.7E4 104.7981 2.3E3 107.0849 8.4E4 109.1006 1.6E5 111.0799 7.8E4 111.1165 1.6E4 115.0748 2.4E4 121.1006 5.4E4 123.1163 8.3E4 125.0954 3.9E4 125.1319 3.0E4 125.6453 2.5E3 127.3475 2.8E3 129.0907 8.3E3 134.4819 2.4E3 137.1321 2.8E4 143.1432 2.5E3 146.9069 2.6E3 148.4062 2.6E3 149.1183 2.7E3 149.1319 4.4E5 149.1462 7.0E3 149.6798 3.4E3 149.6903 4.7E3 149.9888 2.4E3 151.1477 6.1E3 153.8578 2.4E3 154.5159 2.1E3 155.0096 3.9E4 167.1277 9.7E3 167.1426 2.6E5 173.5271 8.6E4 173.5401 4.4E4 185.1531 4.5E4 185.2496 2.5E3 186.0203 2.9E3 195.5706 2.1E3 196.8069 2.5E3 202.9450 2.4E3 218.7561 2.8E3 221.2257 2.0E4 222.9452 2.8E3 224.6627 2.4E3 228.1955 8.6E4 239.2365 9.5E4 241.1794 2.3E5 245.8730 2.5E3 257.2466 1.1E4 259.1899 6.2E4 282.2794 1.9E4 284.8126 2.7E3 309.8790 2.4E3 310.3130 3.0E3 313.2737 1.1E5 393.2403 2.6E3 496.4989 2.7E3 497.3347 3.4E3 497.4196 5.4E5 497.5051 6.4E3 578.2835 6.7E3 END IONS BEGIN IONS FEATURE_ID=737 PEPMASS=721.4524 SCANS=737 RTINSECONDS=917.653 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 69.0696 1.5E4 77.0384 2.5E3 78.0284 2.7E3 79.0539 9.7E4 81.0331 2.5E3 81.0696 9.0E4 83.0489 9.9E3 83.0851 1.9E4 84.7962 2.6E3 91.0539 5.3E4 93.0695 1.3E5 95.0488 1.8E4 95.0852 7.6E4 97.0280 2.4E3 97.0646 8.0E3 97.1006 6.1E3 105.0696 6.1E4 107.0852 5.2E4 109.0642 2.5E3 109.1008 3.1E4 109.1088 2.4E3 117.0694 7.6E3 119.0852 4.1E4 121.1009 4.2E4 123.0804 1.5E4 123.1165 7.5E3 129.0695 2.3E4 131.0853 1.7E4 133.1009 3.0E4 135.1165 2.9E4 143.0855 1.6E4 145.0141 2.7E3 145.1008 2.8E4 147.1165 1.1E5 148.9977 3.2E3 149.1320 1.9E4 159.1164 5.5E3 161.0960 9.5E3 161.1326 3.8E4 167.2289 2.2E3 169.1271 2.8E3 171.1167 6.6E4 173.1327 6.9E3 173.5289 6.2E4 173.5452 4.8E3 177.7426 2.4E3 189.1274 3.0E4 199.1476 2.5E3 207.1382 3.8E4 224.6724 2.4E3 243.2096 3.8E3 261.2215 2.1E4 281.1752 7.4E4 292.1660 2.6E3 293.1803 3.0E3 313.6723 2.4E3 320.7377 2.5E3 335.2586 5.2E4 336.4150 2.6E3 389.2046 2.4E3 441.2132 3.3E3 478.3005 2.6E3 521.3103 5.0E3 541.3895 3.3E4 574.2256 2.8E3 585.7450 2.9E3 721.4508 1.4E4 END IONS BEGIN IONS FEATURE_ID=738 PEPMASS=743.4345 SCANS=738 RTINSECONDS=918.717 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 6 (0 removed due to low quality, 0 removed due to low cosine). 69.0330 3.0E4 69.0369 4.1E3 69.0695 1.0E4 71.0489 3.2E3 71.9037 2.2E3 72.4671 2.2E3 72.7540 2.2E3 73.0279 4.8E4 73.7785 2.2E3 79.0536 5.2E4 80.2464 2.2E3 80.5758 2.5E3 81.0330 2.2E4 81.0692 1.0E5 82.0726 2.2E3 82.6033 8.2E4 82.6066 1.7E4 83.0851 1.6E4 85.0278 9.2E4 87.0436 2.4E3 89.4949 2.7E3 89.6259 2.2E3 90.6660 2.2E3 91.0384 8.7E4 91.0536 3.0E4 93.0692 8.4E4 95.0485 2.6E3 95.0848 9.3E4 97.0226 2.5E3 97.0277 8.0E4 97.1005 6.5E3 99.0433 1.3E4 101.0227 3.1E4 102.3812 2.5E3 103.0384 8.9E3 105.0692 3.0E4 107.0849 4.6E4 109.0278 1.5E4 109.1005 5.2E4 111.0420 2.4E3 111.0800 3.0E3 115.0379 2.5E3 116.6971 4.7E3 117.4516 2.5E3 119.0847 2.2E4 119.0960 5.0E3 120.7380 2.8E3 121.1005 5.3E4 123.1161 2.7E4 124.7129 2.3E3 127.0383 5.6E4 129.0700 3.3E3 131.0850 1.1E4 133.1005 2.7E4 135.1163 4.0E4 137.1325 2.6E3 140.1479 2.6E3 141.4803 2.3E3 142.0370 2.9E3 143.1348 2.2E3 145.0488 1.6E4 145.1004 1.4E4 147.1162 5.3E4 147.9259 2.7E3 149.1314 1.8E4 154.3751 3.3E3 159.1165 6.7E3 159.2330 2.5E3 161.0963 2.3E3 161.1321 3.2E4 163.1480 2.3E3 171.1004 2.5E3 171.1161 4.2E4 173.1318 8.5E3 173.5176 3.0E3 173.5322 1.8E5 173.5455 9.4E3 175.1475 3.4E3 183.0646 3.1E3 184.0726 6.3E3 185.0415 4.8E4 187.1489 3.7E3 189.1268 8.3E3 195.8407 2.4E3 201.0751 2.9E3 203.0523 2.1E4 207.1376 3.4E4 209.0569 2.4E3 211.7025 2.8E3 241.0692 3.4E3 243.0831 9.5E4 247.1296 1.3E5 260.6000 2.4E3 261.2204 2.4E4 275.6565 2.4E3 278.9564 2.5E3 281.1744 4.6E4 301.2136 5.9E3 303.1563 3.0E4 309.1696 3.4E3 325.1340 2.5E3 335.2575 1.3E5 363.2511 4.6E3 371.0277 2.6E3 403.6929 3.0E3 439.9418 3.0E3 465.1302 2.3E3 465.2091 1.4E6 465.2853 5.1E3 467.3095 2.8E3 497.3100 1.0E4 503.0266 3.3E3 519.1995 3.7E3 519.2924 1.5E6 519.3819 5.7E3 524.1138 2.5E3 563.3735 6.4E3 581.3812 8.4E4 602.5196 8.4E3 602.5319 3.1E3 606.1254 2.9E3 730.8585 2.5E3 743.2748 9.1E3 743.4335 2.3E6 743.7440 5.6E3 END IONS BEGIN IONS FEATURE_ID=739 PEPMASS=631.2529 SCANS=739 RTINSECONDS=918.748 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 67.8340 2.2E3 67.8388 2.0E3 70.6416 2.1E3 74.2991 2.2E3 80.6717 2.2E3 85.6791 2.8E3 90.5069 2.1E3 93.3465 2.3E3 99.0351 2.9E3 100.0689 2.3E3 107.2915 2.5E3 111.5953 2.3E3 149.1330 2.3E3 173.5207 5.7E3 173.5316 5.4E4 173.5393 1.8E4 193.0870 2.5E3 194.7345 2.5E3 204.9403 2.6E3 215.0070 2.5E3 268.2389 2.8E3 274.4606 2.4E3 352.5226 2.5E3 360.5081 2.4E3 455.2159 2.9E3 460.2223 2.4E3 477.6374 2.5E3 482.2106 4.7E3 491.2413 1.1E4 498.2014 2.9E3 499.2101 1.3E4 509.2301 1.5E4 511.2472 1.7E4 513.2242 3.4E3 514.2364 3.8E3 522.1988 8.1E3 526.1990 2.5E3 531.2372 3.0E3 533.2544 3.1E4 537.2258 2.0E5 540.2130 1.9E4 543.2714 2.0E4 553.2202 7.7E3 555.2364 1.0E5 557.2152 3.7E3 558.2238 1.2E4 565.0618 2.9E3 569.2532 7.6E3 571.2327 1.6E4 572.2382 4.6E4 581.2158 3.2E5 581.3212 5.3E3 585.5312 3.2E3 587.2634 5.9E4 599.2249 7.9E3 613.2423 1.7E4 631.2520 6.1E4 END IONS BEGIN IONS FEATURE_ID=740 PEPMASS=738.4788 SCANS=740 RTINSECONDS=918.936 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 69.0695 5.4E4 71.0491 3.6E3 73.0647 3.0E3 79.0538 3.1E5 80.1794 2.5E3 80.9479 2.5E3 81.0332 1.0E4 81.0694 3.0E5 83.0488 3.6E4 83.0850 6.1E4 84.8164 2.1E3 85.0645 1.4E4 90.1346 2.2E3 91.0483 4.3E3 91.0536 1.7E5 92.9095 2.4E3 93.0630 3.2E3 93.0694 4.2E5 93.0766 4.8E3 95.0488 6.1E4 95.0784 2.7E3 95.0850 2.7E5 95.0926 3.6E3 96.8559 2.2E3 96.9044 2.2E3 97.0645 2.9E4 97.1007 3.8E4 98.1589 2.5E3 99.0802 1.2E4 105.0445 7.2E3 105.0693 1.7E5 107.0489 2.0E4 107.0773 2.7E3 107.0850 1.8E5 109.0644 3.6E4 109.1007 1.1E5 109.7612 3.0E3 111.0799 1.9E4 111.1162 2.5E3 113.0956 3.0E3 114.4468 2.4E3 117.0696 3.6E4 119.0766 2.8E3 119.0850 1.3E5 120.9656 3.4E4 121.0643 1.3E4 121.0924 6.1E3 121.1007 1.7E5 121.4601 3.1E3 123.0799 4.8E4 123.1163 4.6E4 125.0958 6.2E3 127.0753 1.3E4 129.0694 7.4E4 129.5272 2.3E3 131.0850 4.7E4 131.6505 2.6E3 133.0919 2.2E3 133.1007 1.1E5 135.0799 2.4E3 135.1163 1.1E5 137.0956 6.3E3 137.1322 1.8E4 141.0908 7.1E3 143.0852 3.9E4 145.1008 1.0E5 147.0802 1.6E4 147.1039 4.5E3 147.1163 3.5E5 149.1321 6.3E4 151.1477 2.5E3 156.8594 2.8E3 157.1001 2.9E3 159.1164 5.3E4 161.0959 3.5E4 161.1321 1.6E5 162.9525 2.8E3 163.1111 1.3E4 163.1475 2.4E4 164.0078 2.9E4 169.1008 3.5E3 171.1033 2.4E3 171.1164 2.6E5 172.0172 2.7E3 173.1322 3.4E4 173.5234 4.7E4 173.5384 6.3E4 173.5439 1.1E4 175.1479 2.1E4 177.1278 2.9E3 177.1628 3.6E3 179.1429 1.2E4 187.1138 3.7E3 187.1478 1.7E4 189.1269 1.2E5 207.1377 1.9E5 220.7003 2.2E3 225.1484 5.4E3 242.7141 2.2E3 243.2102 3.1E4 261.2210 8.9E4 263.2374 3.3E3 281.1749 4.0E5 281.2101 4.3E3 304.2643 7.7E3 306.2785 9.7E3 317.2473 6.0E3 335.2581 3.5E5 337.2708 2.3E3 348.1010 2.5E3 352.7203 2.3E3 366.1250 2.4E3 420.7449 2.3E3 446.1389 2.8E3 467.8197 2.3E3 527.5475 2.5E3 541.3886 2.0E5 541.4742 4.4E3 575.5016 1.6E4 597.4875 5.6E4 END IONS BEGIN IONS FEATURE_ID=741 PEPMASS=609.2712 SCANS=741 RTINSECONDS=919.153 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 64.1375 3.4E4 64.1395 1.2E4 65.6931 2.4E4 65.6959 8.7E4 67.6941 4.2E4 67.6976 1.5E5 68.2793 7.2E3 74.9322 6.6E3 101.8527 4.8E3 115.2147 5.1E3 141.4365 7.6E3 144.9567 5.3E3 173.5210 4.9E4 173.5373 1.8E5 200.2934 4.1E3 237.1387 6.6E3 238.1454 4.9E3 239.1540 4.7E4 251.1521 9.7E3 257.5132 6.2E3 263.5922 4.9E3 353.7094 8.4E3 407.2232 5.0E4 420.2294 5.6E4 421.2370 8.2E4 422.2464 4.4E4 428.6642 8.2E3 434.2459 9.4E3 444.2311 8.9E3 447.1762 4.9E3 448.2207 5.1E3 449.2306 7.9E3 457.2356 5.1E4 459.2174 2.8E5 460.2259 6.5E4 461.1885 1.9E4 461.1985 3.6E4 462.2048 1.8E4 463.2124 6.1E4 472.2261 4.1E4 473.2324 2.7E4 474.2428 7.6E3 475.2137 2.8E5 476.2215 3.8E5 477.2299 2.3E5 478.2352 6.4E4 485.2329 9.6E5 486.2052 3.2E5 487.2178 2.6E4 487.2449 6.7E4 488.2197 2.3E4 489.2275 1.5E5 490.2362 6.1E3 493.2224 4.8E4 494.2665 1.5E5 497.2336 7.9E4 499.2127 5.1E5 499.2962 5.9E3 500.2188 1.2E5 502.2370 3.7E4 503.1584 8.8E3 503.2434 1.0E6 504.2270 1.1E5 504.2428 1.2E5 505.2275 1.4E5 507.2245 5.8E3 507.2361 1.4E4 513.2280 2.4E5 514.2393 2.7E4 515.2437 1.4E6 517.2228 4.3E5 518.2307 1.3E5 519.2405 3.3E4 521.2516 6.4E5 522.2563 5.2E4 531.2383 3.9E6 532.2434 3.6E4 533.2534 1.5E5 534.2266 6.0E3 535.2337 9.7E4 536.2400 4.0E4 541.1302 5.8E3 541.2228 3.9E5 544.2084 8.0E3 545.2532 2.4E4 548.2415 1.1E5 549.2493 9.9E5 549.3468 8.9E3 550.1584 4.1E4 550.2571 1.6E6 550.3557 9.5E3 559.0248 7.1E3 559.2338 2.6E6 560.2489 5.8E3 563.2649 6.4E5 573.2518 1.5E4 577.1387 7.4E3 577.2442 8.8E5 577.3497 4.8E3 578.2533 5.3E3 581.2743 1.2E5 591.2601 3.0E6 594.2460 4.9E4 609.2704 4.6E6 END IONS BEGIN IONS FEATURE_ID=742 PEPMASS=625.2662 SCANS=742 RTINSECONDS=920.034 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 64.5764 2.4E3 78.2475 2.4E3 80.7709 2.8E3 96.9383 2.7E3 120.0803 2.2E3 138.1702 2.6E3 138.6883 2.1E3 141.1236 2.5E3 173.5290 9.8E4 173.5444 1.4E4 221.7414 2.2E3 241.9817 2.3E3 244.5065 2.5E3 280.5939 2.6E3 283.4216 2.3E3 310.9354 2.7E3 364.8816 2.8E3 371.4784 2.3E3 405.2091 3.0E4 406.2193 6.6E3 419.2247 1.7E4 420.2313 7.4E5 421.2393 3.0E4 424.2260 3.1E4 433.2395 4.0E4 434.2472 9.1E4 445.2022 4.3E3 447.2154 9.2E3 448.2262 1.1E5 449.1281 3.0E3 449.2339 2.1E5 449.2999 3.1E3 451.2127 3.6E4 452.2212 2.5E5 459.2188 1.2E5 460.2261 3.4E5 461.1978 3.6E3 461.2386 8.9E3 462.2057 9.7E4 463.2131 5.2E4 464.2231 3.5E3 465.2290 1.9E5 466.2365 1.4E4 475.2135 3.3E5 476.2209 1.5E5 477.2289 1.0E6 477.3095 9.1E3 478.2355 1.9E4 479.2451 3.2E4 480.2547 1.0E4 487.2134 1.6E4 488.2191 1.5E4 489.2274 2.5E4 490.2355 4.4E3 491.2127 4.0E4 491.2398 1.2E4 492.2520 3.6E5 493.2572 1.1E5 501.2289 3.0E4 502.2355 2.8E4 503.1116 3.0E3 503.2438 2.3E5 503.3077 2.5E3 504.2503 2.3E4 505.2249 4.1E3 505.2379 2.7E3 507.2376 2.7E4 508.2528 4.9E3 509.2196 4.6E4 518.2314 1.2E5 519.2372 2.0E4 520.2148 6.6E3 521.2213 5.2E5 523.1509 2.1E3 523.2342 1.1E5 531.2386 4.7E3 533.2192 6.2E4 534.2261 2.2E4 535.2345 2.6E5 536.2419 3.0E5 536.3171 2.5E3 537.2497 5.4E4 538.2583 4.6E4 547.2342 1.0E5 548.2416 4.1E4 549.2502 1.8E5 563.2658 5.0E4 565.2457 9.9E4 567.3711 1.6E4 579.2527 1.9E4 580.2641 3.3E3 593.2410 6.0E4 595.2632 3.2E3 598.6135 3.0E3 607.2543 7.1E3 608.2635 1.1E5 625.4158 6.7E3 END IONS BEGIN IONS FEATURE_ID=743 PEPMASS=829.5075 SCANS=743 RTINSECONDS=920.471 CHARGE=1+ MSLEVEL=2 MERGED_STATS=1 / 1 (0 removed due to low quality, 0 removed due to low cosine). 107.0848 2.7E3 126.0614 2.7E3 141.0222 2.5E3 173.5285 3.5E4 180.6210 2.4E3 184.8832 2.7E3 258.7150 2.7E3 333.2035 1.7E4 387.0541 2.7E3 519.2922 2.7E4 551.2819 4.8E4 551.3734 2.5E3 605.9703 2.5E3 667.4565 4.6E3 829.5056 8.1E4 END IONS BEGIN IONS FEATURE_ID=744 PEPMASS=236.1678 SCANS=744 RTINSECONDS=920.634 CHARGE=1+ MSLEVEL=2 MERGED_STATS=31 / 31 (0 removed due to low quality, 0 removed due to low cosine). 43.7559 2.3E3 43.8184 2.1E3 43.8465 2.0E3 44.1413 2.4E3 44.1554 2.1E3 44.8830 2.2E3 44.9133 2.5E3 45.0333 3.0E3 45.0644 2.8E3 45.8128 2.3E3 45.8823 2.2E3 46.1469 2.2E3 46.3958 2.2E3 46.4975 2.3E3 46.5933 2.4E3 46.8924 2.1E3 47.1646 2.8E3 47.1931 2.0E3 47.2422 2.3E3 47.5324 2.6E3 47.9140 2.2E3 48.9568 2.4E3 49.0071 2.7E3 49.6248 2.6E3 49.6697 2.7E3 49.9838 2.3E3 50.1420 2.1E3 50.2411 2.2E3 50.4009 2.2E3 51.3215 2.3E3 51.7844 2.3E3 52.1679 2.5E3 52.2473 2.2E3 52.2863 2.5E3 53.0126 2.2E3 53.1093 2.7E3 54.2976 2.3E3 54.5844 2.6E3 54.6606 2.2E3 54.8618 2.4E3 55.0956 2.2E3 55.5568 2.1E3 56.0492 1.7E6 56.3058 2.4E3 56.6249 2.2E3 56.8806 2.2E3 57.0002 2.6E3 57.0333 2.0E5 57.0697 1.1E5 57.5890 2.1E3 57.7790 2.4E3 57.9107 4.6E3 58.0649 2.2E3 58.0730 2.2E4 58.2979 2.5E3 59.0308 1.1E4 60.7266 2.2E3 61.1255 2.7E3 61.3539 2.6E3 61.5829 2.3E3 61.7035 2.3E3 61.7351 2.3E3 61.7935 2.2E3 62.3781 2.4E3 62.9895 7.2E3 63.6625 2.4E3 64.2031 2.1E3 64.3768 2.4E3 64.9039 2.1E3 65.1275 2.3E3 65.7358 2.2E3 66.5251 2.9E3 67.0570 2.7E3 67.3467 2.2E3 67.4466 2.5E3 67.9337 4.4E3 67.9891 2.3E3 68.1699 2.4E3 68.8938 2.4E3 69.0329 3.6E3 69.7334 2.5E3 69.8905 2.1E3 70.2058 2.3E3 70.5696 2.2E3 72.6497 2.3E3 73.0281 1.2E5 73.1923 2.5E3 73.9087 2.3E3 74.0598 6.7E4 75.0303 9.7E3 75.2997 2.6E3 75.5218 2.1E3 75.7677 2.3E3 75.9329 2.7E3 76.3485 2.2E3 76.5846 2.2E3 77.0414 7.3E4 77.1791 2.5E3 77.3816 2.3E3 77.9948 2.3E3 78.6272 2.4E3 78.7815 2.4E3 78.9022 2.1E3 80.1515 2.3E3 80.3838 2.2E3 80.3971 2.5E3 81.5548 2.8E3 81.7058 2.0E3 81.9578 2.2E3 82.1035 2.2E3 82.2444 2.3E3 84.8037 2.3E3 84.8305 2.1E3 86.0599 5.3E3 86.3300 2.6E3 87.0622 1.7E5 88.1862 2.2E3 89.1212 2.6E3 89.3785 2.2E3 89.7009 2.4E3 90.4253 2.2E3 91.0548 2.2E3 91.0715 2.7E3 91.1676 2.2E3 91.2284 2.4E3 92.4028 2.5E3 92.5876 2.1E3 92.9481 2.1E3 93.0363 6.4E4 94.8568 2.3E3 95.0153 6.6E3 95.0867 2.3E3 95.2698 2.5E3 96.8446 2.6E3 97.4091 2.6E3 97.7099 2.2E3 98.7703 2.8E3 98.8604 2.4E3 99.4347 2.2E3 99.9525 2.9E3 101.7115 2.5E3 101.8020 2.4E3 103.0572 5.4E3 103.8251 2.1E3 104.0703 5.2E5 105.0726 8.5E5 105.3623 2.3E3 105.6791 2.3E3 106.6215 2.6E3 106.8669 2.7E3 107.0519 3.1E5 107.2930 2.5E3 109.0312 3.8E4 111.0096 2.6E3 112.0843 2.6E3 112.2990 2.8E3 113.8172 2.7E3 113.8994 2.8E3 114.2594 2.7E3 114.3470 2.2E3 114.3659 2.4E3 114.8552 2.5E3 115.0935 2.2E5 115.1061 2.4E3 115.2253 2.2E3 115.2914 2.9E3 115.9107 2.2E3 117.0728 1.5E4 118.1821 2.3E3 118.7693 2.8E3 120.0708 2.7E3 120.7010 2.5E3 120.9904 2.5E3 121.0677 1.4E4 124.4113 2.4E3 124.7383 4.9E3 129.8420 2.2E3 130.9582 2.7E3 130.9844 2.4E3 133.1040 4.9E5 133.1927 2.4E3 134.2042 2.8E3 135.0832 2.9E5 136.2301 2.2E3 136.3107 2.5E3 137.2013 2.3E3 137.6454 2.3E3 139.2100 2.8E3 141.2943 2.1E3 142.9583 2.6E3 143.0884 3.0E4 143.3672 2.5E3 144.5070 2.2E3 145.3680 2.5E3 145.9099 2.5E3 146.4943 3.0E3 147.9745 2.4E3 148.4533 2.5E3 149.6810 1.3E4 149.6909 2.5E4 150.6639 2.3E3 154.3653 2.6E3 157.1808 2.3E3 157.6281 2.4E3 164.1862 2.2E3 164.3328 2.2E3 166.4925 2.6E3 166.6615 2.7E3 167.1690 2.6E3 167.4660 2.3E3 168.8895 2.3E3 168.9681 2.7E3 169.4993 2.3E3 170.2310 2.5E3 171.1205 1.1E4 171.6895 2.3E3 172.8082 2.7E3 173.1716 2.5E3 173.5236 1.2E5 173.5362 4.1E5 173.5490 5.0E3 174.4364 2.3E3 175.9072 2.3E3 178.1217 2.8E3 179.0715 3.0E3 179.7948 2.3E3 180.1102 3.9E3 181.9027 3.0E3 184.0347 2.5E3 184.1105 2.3E3 188.5522 2.3E3 190.2840 2.1E3 193.9139 2.5E3 194.2210 2.6E3 194.8533 2.5E3 199.6916 2.4E3 201.3898 2.8E3 202.4043 2.9E3 204.4026 2.5E3 213.0787 2.5E3 228.4653 2.3E3 230.7708 2.6E3 233.0910 3.2E3 235.8972 2.4E3 240.7742 2.4E3 241.3473 2.6E3 245.4602 2.6E3 246.8131 2.8E3 END IONS BEGIN IONS FEATURE_ID=745 PEPMASS=357.2427 SCANS=745 RTINSECONDS=920.883 CHARGE=1+ MSLEVEL=2 MERGED_STATS=11 / 13 (2 removed due to low quality, 0 removed due to low cosine). 51.0310 2.5E3 51.1941 5.4E3 52.8802 2.6E3 53.0022 4.7E4 53.0387 5.8E4 54.3602 5.3E3 54.9852 2.4E3 55.0542 1.4E6 57.0698 7.2E5 57.4306 4.3E3 59.0137 1.2E4 62.1392 2.3E3 63.2204 3.0E3 64.4374 5.7E3 65.0387 2.1E4 67.0501 4.8E3 67.0542 1.5E6 68.9757 2.2E3 69.0699 5.8E6 69.0733 7.8E3 69.4984 4.5E3 69.9149 4.6E3 70.2272 2.1E3 70.6614 8.9E3 70.7663 2.6E3 70.8153 3.8E3 71.0855 1.2E5 72.8109 3.0E3 74.8509 4.3E3 77.0393 5.0E4 78.0481 3.0E3 79.0542 5.0E5 81.0699 7.4E6 81.0742 1.4E4 82.6882 2.0E3 83.0855 1.5E6 83.0913 4.7E3 83.5111 5.9E3 85.1012 7.0E4 85.2330 2.3E3 86.3657 2.4E3 91.0543 2.4E5 93.0698 9.3E5 94.0425 2.6E3 95.0495 7.9E4 95.0855 7.7E6 95.0999 1.6E4 97.1011 2.5E6 102.4464 5.4E3 103.0546 2.6E3 105.0255 3.5E3 105.0336 1.7E5 105.0448 5.5E3 105.0698 5.4E5 106.0421 3.4E4 106.8665 4.4E3 107.0492 2.9E5 107.0855 1.2E6 107.2070 2.4E3 108.3635 4.0E3 109.0648 2.2E5 109.0898 1.3E4 109.1012 7.2E6 109.1103 2.4E4 111.1167 3.7E5 113.3724 3.8E3 114.3012 5.0E3 115.0548 2.6E4 115.9640 2.4E3 117.0697 5.5E4 119.0492 1.7E4 119.0770 4.7E3 119.0855 4.9E5 119.9757 5.5E3 121.0283 2.8E4 121.0647 5.9E5 121.0912 1.1E4 121.1011 1.2E6 121.1112 1.0E4 123.0809 1.7E4 123.1168 7.2E6 123.1248 5.7E3 123.1251 2.4E4 125.1324 8.2E4 129.0697 3.0E4 131.0494 3.9E4 131.0856 1.1E5 132.0571 2.6E4 133.0284 1.2E5 133.0648 3.1E5 133.1011 8.6E4 135.0441 6.0E5 135.0802 1.2E5 135.1055 9.3E3 135.1168 1.8E6 137.0597 2.9E5 137.1204 2.6E4 137.1324 2.2E6 137.2200 2.7E3 141.0708 2.9E3 142.5900 5.2E3 143.0857 2.4E4 143.5019 3.4E3 144.0578 4.1E3 145.0282 3.7E4 145.0649 1.7E5 145.1013 4.0E4 146.0727 5.5E4 147.0441 4.0E5 147.0804 4.8E5 147.1166 6.4E4 149.0598 1.2E5 149.1183 2.9E3 149.1325 2.3E6 149.1464 4.4E4 151.0389 1.5E5 151.0756 4.0E3 151.1480 1.9E5 153.0546 4.0E5 157.0648 5.9E4 157.1022 1.1E4 158.0718 1.4E4 159.0293 4.6E3 159.0441 6.8E5 159.0805 6.4E5 160.0882 1.1E5 160.5372 3.2E3 161.0597 3.1E5 161.0961 2.0E5 162.2944 5.9E3 163.0758 6.5E4 163.1482 2.7E5 165.0132 6.3E3 165.0220 2.4E5 165.0547 5.2E7 165.0672 1.0E5 165.0802 2.4E4 165.0876 4.2E5 165.0970 4.9E4 165.1634 7.8E4 167.0704 1.6E5 168.2142 3.4E3 171.0445 3.2E4 171.0804 1.0E5 173.0598 8.1E5 173.0962 3.5E5 173.5235 1.0E5 173.5372 2.5E5 174.9222 3.0E3 175.0756 3.1E5 175.1119 2.3E5 176.6786 9.0E3 177.0378 6.0E3 177.0548 8.8E5 177.0912 3.1E3 177.1638 4.4E4 179.0525 4.2E3 179.0704 6.3E6 179.0844 2.8E4 179.1796 1.4E5 182.0273 4.5E3 183.0808 2.3E4 183.3181 5.0E3 184.2500 7.0E3 185.0599 1.2E5 185.0962 1.2E5 185.1737 5.9E3 187.0558 2.5E4 187.0755 2.1E6 187.0951 3.2E4 187.1097 6.9E4 189.0363 4.4E3 189.0548 4.9E5 189.0912 1.8E5 189.1276 1.8E4 191.0506 2.3E4 191.0703 1.8E6 191.0893 1.1E4 191.1795 7.2E5 193.0861 1.8E6 193.1065 1.9E4 193.1954 2.1E5 194.8678 3.5E3 195.0797 1.2E4 197.0957 2.6E4 199.0756 2.7E5 199.1118 1.5E5 201.0694 1.2E4 201.0911 1.6E6 201.1116 1.1E4 201.1244 4.2E4 203.0489 3.1E3 203.0704 1.0E6 203.1069 1.2E5 205.0861 1.3E6 205.1953 5.1E5 206.0814 5.5E4 207.1017 1.0E6 209.0963 4.4E4 211.1120 1.5E4 213.0912 4.3E5 213.1276 1.9E5 215.1068 3.9E5 215.1429 3.5E4 215.3645 5.7E3 217.0860 4.9E5 217.1223 6.6E4 219.0769 9.2E3 219.1017 1.0E6 221.1176 4.5E5 223.1124 2.4E4 225.1274 8.4E3 227.1067 4.4E5 227.1433 1.6E5 229.1224 3.2E5 231.1018 5.7E5 231.1290 4.5E3 231.1375 3.4E3 233.1175 9.3E5 235.1330 4.1E5 237.1290 4.5E3 241.1224 4.5E5 241.1583 1.1E5 243.1381 4.2E5 245.1174 4.7E5 247.1329 4.0E5 249.1479 7.9E4 249.1767 3.2E3 251.1433 1.8E4 255.1380 2.6E5 257.1535 1.1E5 259.1329 3.6E5 261.1484 8.8E5 269.1539 2.4E5 273.1486 4.1E5 275.1357 3.0E3 275.1644 3.8E5 281.7283 5.9E3 283.1691 5.7E4 287.1645 1.7E5 289.1804 1.4E5 297.2217 4.5E4 301.1800 1.4E5 307.2060 3.3E4 315.1964 3.9E4 325.1812 3.2E3 325.2164 1.7E6 325.2594 1.3E4 357.1888 5.4E3 357.2423 7.9E6 357.3155 8.6E3 357.3453 5.0E3 END IONS BEGIN IONS FEATURE_ID=746 PEPMASS=625.2662 SCANS=746 RTINSECONDS=924.4 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 5 (0 removed due to low quality, 0 removed due to low cosine). 64.5847 6.9E3 66.4383 2.6E3 67.4709 5.5E3 69.4722 7.9E3 69.4758 5.7E3 73.2122 4.1E3 77.2787 4.0E3 79.6861 6.2E3 82.8434 2.3E3 85.3998 2.6E3 90.5770 2.3E3 90.5889 2.4E3 129.9458 2.4E3 166.4727 2.3E3 168.1945 2.3E3 173.5265 2.8E4 173.5354 1.4E5 173.5454 1.0E4 174.3545 2.4E3 177.7279 2.4E3 179.1002 3.1E3 188.9941 5.2E3 197.7994 5.4E3 200.1777 2.8E3 203.7645 4.4E3 232.1306 3.8E3 237.1391 3.3E3 239.1555 6.9E3 244.0315 2.5E3 248.0787 2.7E3 268.1217 6.1E3 269.1278 5.5E3 281.1277 1.7E4 287.2703 2.8E3 293.6461 4.4E3 302.5005 3.7E3 357.1435 8.9E3 364.1578 2.6E3 368.1746 7.9E3 370.1964 4.4E3 375.1948 7.0E3 386.1895 5.7E3 388.2031 4.8E4 400.2055 3.6E4 405.2108 4.5E3 407.2228 8.4E4 412.1645 5.4E3 419.2244 7.7E3 420.2309 2.4E5 421.2389 1.5E5 422.2472 1.1E5 433.2392 1.4E4 434.2483 3.0E4 435.2543 1.4E4 447.2332 5.4E3 448.2289 2.6E3 448.2623 4.9E4 449.2694 1.1E5 451.2128 7.0E5 451.2679 3.1E3 451.2810 4.9E3 452.2203 5.4E4 459.2542 1.8E4 460.2248 1.6E4 461.2326 5.3E4 462.2398 7.1E3 463.2446 1.1E4 464.2185 3.0E4 465.1522 1.6E4 465.2284 9.2E5 465.3054 1.4E4 466.1704 2.5E3 466.2359 7.4E5 474.2036 1.8E4 475.2052 5.0E3 475.2187 1.1E4 475.2467 9.8E4 476.2545 5.8E4 476.2628 6.6E3 477.1940 1.6E4 477.2367 1.8E4 477.2640 2.2E5 478.2363 2.0E4 479.2442 1.3E5 487.2097 1.3E4 488.2190 5.0E4 491.2100 1.1E5 492.2179 5.6E5 493.2594 1.3E6 494.2671 5.1E5 501.2272 4.0E4 502.2353 4.3E4 502.7620 3.2E3 503.1591 4.0E3 503.2436 9.1E5 503.3076 8.9E3 504.2477 2.2E5 505.2250 5.2E4 506.2312 3.4E4 507.2367 3.5E3 509.2183 2.9E5 509.2924 7.2E3 511.2314 1.0E4 519.2375 6.3E4 520.2454 3.6E4 521.1603 1.5E4 521.2544 1.5E6 521.3285 2.1E3 522.2609 1.2E5 523.1448 1.6E4 523.2336 6.4E5 523.3026 3.5E3 524.2352 7.1E3 526.2574 1.1E5 529.2219 4.3E3 531.2412 1.1E4 534.2270 5.6E4 535.2319 7.9E3 535.2738 1.4E4 536.2413 1.9E4 537.2493 6.6E5 538.2573 4.2E6 547.1361 4.3E3 547.2338 6.1E5 548.2411 1.1E5 549.2501 8.1E4 550.2209 2.3E4 551.2279 1.4E4 563.2653 2.9E4 565.1399 1.4E4 565.2450 2.2E6 566.2522 3.1E5 566.3439 5.9E3 567.3702 1.5E4 575.2331 1.1E4 579.2598 1.2E5 581.2763 5.1E5 589.2447 1.0E4 593.2383 7.6E3 597.2568 6.5E3 607.2551 3.9E5 610.2321 7.8E3 625.2657 7.4E5 625.3906 1.1E4 END IONS BEGIN IONS FEATURE_ID=747 PEPMASS=667.2765 SCANS=747 RTINSECONDS=926.114 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 67.4708 1.6E4 67.4744 5.4E3 68.3508 5.5E3 69.0289 4.0E4 69.0320 1.3E4 72.1383 1.2E4 72.1420 3.6E4 74.1392 3.0E3 74.6780 5.2E3 75.5810 5.5E3 92.2523 2.7E3 93.8141 2.4E3 95.1510 6.8E3 96.2240 2.4E3 102.7370 2.4E3 113.8490 2.9E3 124.3280 2.6E3 125.1165 6.4E3 129.0708 5.9E3 138.6369 5.4E3 144.4602 2.5E3 173.5221 2.4E4 173.5328 6.5E4 173.5414 3.0E4 174.3476 5.2E3 192.1009 2.9E3 193.7881 2.4E3 197.7945 5.2E3 212.0979 5.4E3 242.0622 2.7E3 242.2051 6.4E3 289.0856 3.1E3 330.1600 4.4E3 344.9021 6.6E3 358.7556 2.7E3 370.1552 5.2E4 374.1551 7.5E3 382.1545 1.2E4 407.2227 3.8E4 414.1459 9.1E4 420.1933 1.4E4 420.5626 6.0E3 421.2027 7.8E4 424.2021 9.6E3 426.1458 1.5E4 434.2112 9.3E4 435.2187 2.8E5 435.2846 8.5E3 436.2262 1.8E5 442.2179 7.2E3 446.2137 5.8E3 447.2182 6.8E4 448.2201 5.2E3 449.2351 7.7E3 451.2126 4.2E4 460.2277 1.8E4 461.2368 3.2E4 462.2417 2.6E5 463.2493 3.2E4 464.2569 4.5E4 465.1932 9.0E4 466.2004 7.6E3 471.2152 9.3E3 474.1599 1.1E4 475.2117 3.4E4 477.1928 6.2E3 479.1471 8.7E3 479.2082 8.2E5 479.2858 5.8E3 480.2161 8.9E4 487.2128 3.8E4 488.2211 2.4E4 489.1990 6.5E4 489.2241 9.3E4 490.2324 5.9E4 491.2452 2.5E4 492.2132 2.0E4 493.2233 4.0E4 497.1970 1.0E4 498.1997 6.9E3 499.2143 3.1E4 501.1927 1.5E5 502.2013 4.4E4 503.2091 2.0E4 505.1881 1.8E5 506.1977 1.5E5 507.2741 3.4E4 508.2808 1.8E4 515.1312 4.4E3 515.2080 5.4E5 516.2157 2.2E5 516.2966 5.7E3 517.2237 1.7E6 517.3152 1.7E4 518.2291 1.2E5 519.2067 4.7E4 521.2543 2.8E4 523.2346 7.3E3 525.1950 2.9E4 527.2079 5.8E3 529.1923 3.0E3 531.2366 1.3E4 533.2308 4.3E4 534.2558 2.7E4 535.2684 2.7E5 536.2783 2.7E5 543.2049 2.2E4 544.2110 8.6E4 545.2507 3.1E4 547.2326 4.1E4 548.2094 1.2E5 549.2432 1.2E4 551.2576 1.1E5 552.2695 6.2E4 557.2184 1.5E4 561.2421 3.1E5 562.2538 7.7E4 562.3737 2.9E3 563.2660 2.0E6 564.2707 2.9E4 565.2458 2.7E5 571.2314 3.4E4 573.2495 3.8E4 575.2298 2.4E4 578.2499 3.6E4 579.2594 2.1E5 580.1568 2.0E4 580.1882 4.3E3 580.2688 1.5E6 581.2744 6.3E3 585.2081 3.3E3 588.2386 5.5E3 589.2452 1.8E6 590.1406 3.3E3 590.1676 2.4E3 590.2533 5.1E5 590.3602 1.4E4 591.2605 2.2E4 593.2659 7.0E4 595.2927 2.2E4 603.2270 4.1E4 605.2763 4.1E4 606.2495 1.2E4 607.2557 4.8E5 608.2563 4.2E3 611.2726 7.3E3 617.2405 6.2E4 621.2710 1.3E6 623.2880 7.7E4 631.2550 7.2E4 634.2438 6.8E3 639.2819 4.7E4 649.1652 6.7E3 649.2660 1.2E6 667.2765 5.1E4 END IONS BEGIN IONS FEATURE_ID=748 PEPMASS=689.2584 SCANS=748 RTINSECONDS=926.114 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 2 (0 removed due to low quality, 0 removed due to low cosine). 83.2148 2.9E3 84.0708 2.5E3 86.2770 2.6E3 88.4959 2.9E3 89.0592 7.9E3 95.0850 3.0E3 114.1186 2.8E3 126.3895 2.6E3 133.0853 3.4E3 157.4471 2.6E3 173.5294 5.6E4 173.5457 5.0E3 201.1456 3.1E3 274.9046 2.8E3 280.0904 2.3E3 369.9138 2.3E3 407.2233 1.4E4 420.1949 6.6E3 434.2082 2.5E4 435.2171 5.2E4 448.2209 2.2E3 456.1863 2.6E3 463.2490 1.6E4 489.2284 1.0E4 491.2398 4.7E3 495.2156 4.3E3 501.1870 9.5E3 511.2098 1.2E4 512.1806 2.5E4 517.2224 3.2E5 517.3140 3.6E3 535.2366 2.5E4 539.2046 9.1E3 557.2513 1.9E4 558.2569 3.5E3 563.2645 1.4E6 567.2303 3.2E3 581.2755 1.2E4 585.2461 1.4E5 601.2412 5.6E3 602.2479 2.4E4 612.2363 5.9E3 613.2427 3.3E4 615.2222 6.0E3 629.2372 8.1E3 630.2449 4.5E4 645.2666 1.4E4 END IONS BEGIN IONS FEATURE_ID=749 PEPMASS=448.3639 SCANS=749 RTINSECONDS=927.735 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 6 (0 removed due to low quality, 0 removed due to low cosine). 56.1302 2.3E3 56.1387 2.5E3 57.9214 2.3E3 58.6192 2.2E3 58.8512 2.4E3 59.7031 2.3E3 60.0278 2.2E3 63.8521 2.2E3 65.6000 2.5E3 66.3655 2.0E3 66.7877 2.2E3 70.7099 2.4E3 76.0010 2.3E3 76.8103 2.2E3 80.8778 2.6E3 81.7383 2.3E3 88.1315 2.7E3 95.1567 2.1E3 96.0153 2.2E3 99.7379 2.2E3 102.1790 2.1E3 105.9304 2.4E3 106.3966 2.4E3 107.7024 2.5E3 118.4405 2.6E3 149.8973 2.6E3 151.3147 2.4E3 151.5465 2.5E3 155.9779 2.6E3 169.0854 2.5E3 171.1378 6.3E4 171.1824 2.5E3 173.5236 4.6E4 173.5403 5.6E4 173.9365 2.4E3 180.1935 2.4E3 188.0222 2.2E3 196.7169 2.5E3 197.0462 2.9E3 198.7172 2.2E3 216.3722 2.3E3 234.7831 2.5E3 258.3748 2.5E3 269.4903 2.5E3 435.8618 3.0E3 458.4554 2.5E3 END IONS BEGIN IONS FEATURE_ID=750 PEPMASS=600.4173 SCANS=750 RTINSECONDS=927.934 CHARGE=1+ MSLEVEL=2 MERGED_STATS=9 / 9 (0 removed due to low quality, 0 removed due to low cosine). 63.8156 2.2E3 64.6578 2.8E3 65.7149 2.5E3 65.9186 2.3E3 67.0540 6.0E4 67.1023 2.3E3 69.0333 6.2E4 69.0697 6.5E4 71.0491 1.1E4 71.8718 2.3E3 72.4525 2.3E3 74.0550 2.5E3 74.8355 2.4E3 76.2235 2.3E3 78.0466 2.5E3 79.0540 7.5E4 80.0553 2.2E3 81.0696 2.1E5 82.3870 2.3E3 83.0488 1.0E5 83.0852 8.0E4 84.6463 2.2E3 85.0646 4.5E4 86.8268 3.0E3 87.0438 3.2E4 87.4927 2.3E3 89.0593 3.2E5 91.0540 8.7E4 93.0695 3.6E5 93.6496 2.3E3 95.0488 1.4E5 95.0852 2.7E5 95.3265 2.2E3 96.0888 3.0E3 97.0645 1.0E5 97.1011 6.3E3 98.8688 2.3E3 99.4596 2.7E3 105.0695 3.3E5 106.0777 7.3E3 107.0490 6.3E3 107.0773 3.6E3 107.0852 4.2E5 108.0913 5.6E3 109.0645 1.4E5 109.1009 1.9E5 111.0802 7.2E4 113.0959 3.4E4 117.0696 5.5E4 119.0488 5.5E3 119.0771 2.4E3 119.0852 5.0E5 120.0933 2.9E4 121.0645 7.4E4 121.1008 5.0E5 121.1115 2.4E3 122.0721 8.6E3 122.1049 9.9E3 122.1444 2.2E3 123.0801 2.6E5 123.1166 6.2E4 125.0595 7.4E4 125.0957 1.0E5 128.0622 9.9E3 129.0697 4.9E4 129.6196 2.4E3 131.0853 2.1E5 131.0958 2.3E3 132.0929 3.4E4 133.0644 5.8E4 133.0762 2.4E3 133.0857 1.5E5 133.1009 3.9E5 133.1114 4.7E3 134.1079 1.0E4 135.0327 2.3E3 135.0801 2.1E5 135.1166 1.8E5 136.0880 2.7E3 137.0595 2.0E4 137.0957 1.4E5 139.0752 4.2E4 139.1115 5.4E4 140.2246 2.5E3 142.0776 2.8E4 142.4596 2.9E3 143.0852 2.8E5 144.0928 1.1E5 145.0646 9.0E3 145.1009 5.3E5 146.1078 3.6E4 147.0801 2.8E5 147.1165 1.7E5 148.0871 1.4E4 148.1216 2.4E3 149.0957 1.8E5 149.1324 1.4E4 150.1036 5.9E3 150.4227 2.6E3 151.0751 2.3E5 151.1116 2.1E4 152.0812 7.4E3 153.0908 3.4E4 155.0850 6.2E4 155.1065 8.0E3 156.0929 6.5E4 157.0650 2.8E3 157.0862 8.3E3 157.1009 6.5E5 158.1082 1.1E5 159.0802 1.2E5 159.1026 3.8E3 159.1166 4.0E5 160.0880 7.8E4 160.1220 1.1E4 161.0959 2.5E5 161.1322 1.1E5 162.0041 2.2E3 162.1028 1.6E4 162.9748 2.8E3 163.0752 5.7E3 163.1115 2.5E5 164.1157 2.7E3 165.0189 2.7E3 165.0908 7.9E5 165.1272 2.4E3 166.0943 3.6E4 167.0874 2.4E4 167.1066 1.9E5 168.1091 2.8E3 169.1011 1.7E5 170.1082 7.6E4 171.0806 2.7E4 171.1167 4.0E5 172.0881 2.6E3 172.1239 1.3E5 173.0961 1.1E5 173.1324 2.1E5 173.5248 7.6E4 173.5368 1.4E5 173.5428 1.3E4 174.1028 1.4E4 174.1381 9.2E3 175.1117 2.2E5 175.1480 1.0E5 176.1194 6.1E3 177.0909 5.6E4 177.1111 9.9E3 177.1273 6.8E4 178.0984 2.2E4 179.0866 1.3E4 179.1064 8.3E4 179.1427 4.0E3 180.0958 2.8E3 180.1144 4.8E4 181.0853 1.8E4 181.1014 7.6E4 181.1220 1.2E5 182.1084 3.2E4 183.0799 2.8E3 183.1168 2.4E5 184.1233 6.3E4 185.0960 4.3E4 185.1325 3.1E5 186.1040 1.3E4 186.1394 4.2E4 187.1115 1.1E5 187.1482 8.6E4 188.1190 1.6E4 189.1272 1.9E5 189.1626 2.8E3 190.1349 1.7E5 191.1068 4.6E4 191.1428 7.8E4 193.1020 4.8E4 193.1222 1.4E5 194.1088 3.0E4 195.1166 2.0E5 195.1366 4.4E4 196.1239 6.2E4 197.0964 2.6E4 197.1159 7.4E3 197.1323 2.5E5 198.1042 2.3E4 198.1386 3.1E4 199.1116 9.9E4 199.1480 1.3E5 200.1179 1.0E4 200.1530 6.5E3 201.1273 1.1E5 201.1635 1.4E4 202.1354 3.2E3 203.1084 1.5E4 203.1430 5.2E5 204.1475 1.9E4 205.1221 3.9E4 206.1089 1.1E4 207.1166 1.2E5 207.1381 2.2E5 208.1238 4.8E4 208.1454 6.7E4 209.0968 7.2E3 209.1323 2.2E5 209.1532 4.3E4 210.1388 6.6E4 211.1117 6.7E4 211.1481 1.8E5 212.1186 2.3E4 212.1538 1.9E4 213.1274 1.2E5 213.1635 4.3E4 214.1333 1.2E4 215.1068 2.9E4 215.1430 7.6E4 216.1500 1.9E4 217.1229 2.9E4 217.1588 2.9E4 218.1664 5.9E3 219.1169 2.0E4 219.1380 1.1E5 220.1241 1.3E4 220.1467 4.2E3 221.1323 1.1E5 221.1537 8.7E5 222.1371 1.8E4 222.1579 3.7E4 223.1113 3.8E4 223.1482 1.5E5 224.1544 2.8E4 225.1273 9.8E4 225.1639 1.1E5 226.1322 7.1E3 226.1683 3.3E3 227.1429 7.2E4 227.1799 1.9E4 228.1489 4.0E3 229.1223 2.9E4 229.1588 5.5E4 230.1310 1.0E4 230.1661 2.9E3 231.1151 3.7E3 231.1384 2.7E4 231.1730 1.4E4 232.1246 3.4E3 233.1317 4.6E4 233.1537 3.2E5 234.1373 9.7E3 234.1604 1.3E5 235.1478 1.1E5 235.1707 1.0E4 236.1544 2.4E4 237.1256 3.7E4 237.1490 1.6E5 237.1668 4.6E3 238.1696 7.3E3 239.1432 6.8E4 239.1790 4.4E4 240.1500 1.1E4 241.1254 5.3E3 241.1584 5.6E4 241.1934 3.0E3 243.1382 2.8E4 243.1743 2.0E4 243.3534 2.4E3 245.1308 1.2E4 245.1552 1.6E4 246.1379 9.8E3 246.1623 1.0E4 247.1468 4.1E4 247.1698 1.1E5 248.1381 3.4E3 249.1259 5.3E3 249.1635 9.4E4 250.1571 3.4E3 250.1685 3.1E3 251.1431 3.7E4 251.1785 5.9E4 252.1497 1.0E4 252.1837 7.6E3 253.1585 1.0E5 253.1916 1.9E4 255.1443 2.9E3 255.1739 2.4E5 256.1802 6.4E3 257.1544 2.2E4 257.1888 2.0E4 258.1385 3.8E3 258.1620 4.2E3 259.1442 1.3E4 259.1697 6.0E4 260.1545 4.3E3 261.1629 1.3E5 262.1705 4.0E3 263.1430 1.5E4 263.1790 7.0E4 264.1839 1.0E4 265.1588 3.2E4 265.1940 3.1E4 267.1745 5.5E4 268.1821 3.2E4 269.1555 1.3E4 269.1897 5.6E4 270.1964 2.0E4 271.1694 9.2E4 271.2000 2.8E3 272.1780 3.4E3 273.1583 7.7E3 273.1872 4.7E4 274.1927 6.6E4 275.1447 2.8E3 275.1790 3.6E4 277.1602 1.8E4 277.1947 5.0E4 278.1681 3.6E3 279.1746 1.0E5 279.2061 3.2E3 280.1788 4.0E3 281.1568 6.8E3 281.1899 9.7E4 282.1950 8.5E3 283.1698 1.5E4 283.2059 1.1E4 285.1851 9.4E4 286.1677 2.4E3 286.1927 1.7E5 287.2008 1.3E5 289.1943 2.8E4 290.1982 2.6E3 291.1759 1.4E4 291.2108 2.2E4 293.1899 2.0E4 294.1982 3.2E4 295.1703 9.1E3 295.2061 8.2E4 297.1849 9.1E4 298.1938 1.2E4 299.2004 1.3E5 300.2054 1.5E4 301.1935 1.8E4 303.1961 3.4E5 305.1897 6.5E3 305.2273 4.1E3 307.1685 2.8E3 307.2056 3.5E4 309.1843 3.9E4 309.2215 9.0E3 310.1921 2.5E4 311.2004 4.2E4 312.2080 4.5E4 313.2161 1.0E5 315.2109 8.3E3 319.2059 5.8E4 321.2223 3.9E3 322.2293 2.3E4 323.2001 8.9E3 325.2162 1.0E5 331.2060 8.5E3 333.2213 3.3E3 334.2271 4.4E3 335.1976 3.5E3 337.2161 1.8E5 339.2314 3.8E3 341.2252 2.9E3 347.2368 2.9E4 349.2146 3.3E3 351.2320 1.0E4 352.2395 4.8E5 353.2454 1.2E4 359.2370 9.6E3 363.2302 1.4E4 365.2471 2.2E5 366.2537 3.2E3 373.2519 2.5E3 377.2473 4.2E4 378.2531 4.2E3 379.2666 2.8E3 383.2581 2.8E3 387.2710 1.2E4 397.2743 3.0E3 399.2548 3.9E3 403.2650 2.7E3 408.4413 2.4E3 415.2754 3.4E3 419.2928 3.3E3 425.0023 2.4E3 425.2719 3.8E3 426.1522 2.4E3 437.3026 5.8E3 441.6528 2.8E3 469.3129 1.0E4 487.3216 8.8E4 502.3433 7.7E3 503.3516 1.2E5 505.3314 6.7E4 507.3469 4.2E4 508.3508 3.0E4 520.3548 5.9E4 521.3512 2.7E3 550.6197 2.6E3 573.2586 2.7E3 585.3969 1.1E4 600.4128 1.3E4 END IONS BEGIN IONS FEATURE_ID=751 PEPMASS=583.4151 SCANS=751 RTINSECONDS=928.372 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 66.3625 2.7E3 67.0539 1.9E4 69.0696 1.6E4 74.6697 2.1E3 75.8200 2.2E3 77.6879 2.4E3 78.9904 2.1E3 79.0539 2.3E4 81.0696 5.5E4 81.6367 2.4E3 83.0490 1.7E4 83.0851 4.5E4 85.0641 2.6E3 88.3500 2.1E3 90.5245 2.2E3 90.8449 2.6E3 91.0539 2.7E4 93.0695 7.0E4 95.0488 1.5E4 95.0852 6.1E4 97.0644 3.7E4 104.9213 2.8E3 105.0695 7.1E4 107.0852 9.3E4 109.0647 5.1E3 109.1008 4.5E4 111.0801 2.6E3 113.0960 1.9E4 117.0697 3.3E3 119.0768 2.7E3 119.0851 1.3E5 121.1008 9.7E4 123.0801 2.2E4 123.1165 8.6E3 125.0960 1.2E4 129.0691 7.9E3 131.0852 4.8E4 133.1008 7.6E4 135.0802 5.7E3 135.1166 3.1E4 137.0956 1.4E4 139.1113 3.5E4 142.0766 2.8E3 143.0853 3.8E4 144.0925 2.8E3 145.1009 1.0E5 147.0803 1.7E4 147.1166 5.6E4 149.0966 7.1E3 149.1328 5.2E3 149.6845 5.3E3 149.6945 3.4E3 149.7704 2.3E3 151.0749 3.0E3 153.1262 5.9E3 155.0851 1.8E4 156.0935 4.1E3 157.1008 9.6E4 158.1083 6.5E3 158.6223 2.5E3 159.1165 5.3E4 161.1318 1.7E4 163.1113 9.8E3 165.0911 3.4E4 167.0858 2.8E3 167.1064 1.0E4 169.1011 3.3E4 171.1166 5.5E4 173.1325 4.7E4 173.5339 6.6E4 175.1480 2.2E4 179.0857 2.7E3 179.1410 2.8E3 180.0937 2.6E3 181.1015 1.8E4 181.1214 1.8E4 183.1169 4.4E4 184.1248 3.3E3 184.7695 2.5E3 185.1323 3.4E4 187.1477 1.7E4 189.1287 2.3E3 191.1436 9.7E3 193.1014 3.4E3 194.1090 7.1E3 195.1166 2.8E4 196.1240 7.9E3 197.1321 4.4E4 199.1481 2.8E4 201.1262 2.6E3 201.1632 6.6E3 203.1430 1.5E4 205.1574 2.6E3 207.1167 2.2E4 207.1378 4.3E3 208.1241 3.3E3 209.1324 5.3E4 210.1400 3.1E3 211.1128 2.7E3 211.1485 2.4E4 219.1168 2.9E3 221.1320 2.2E4 221.1539 3.3E4 223.1475 2.6E4 225.1638 1.1E4 233.1321 1.2E4 233.1564 3.0E3 235.1485 1.7E4 237.1637 6.5E3 245.1321 4.2E3 246.1409 3.2E3 247.1466 8.7E3 249.1637 1.3E4 251.1785 3.6E3 259.1465 2.9E3 261.1632 1.2E4 263.1787 7.7E3 265.1944 7.1E3 267.0296 2.7E3 267.1751 2.7E3 269.1894 3.1E3 273.1609 2.5E3 275.1795 1.6E4 281.1895 2.8E3 281.2956 6.6E4 282.2796 2.4E5 283.2829 2.5E5 285.1859 9.0E3 291.7259 2.5E3 299.2008 2.7E3 299.3059 7.5E4 300.3088 7.8E4 385.7383 2.6E3 394.7108 2.5E3 435.7137 2.6E3 449.8352 2.2E3 491.3491 2.7E3 494.7494 2.7E3 532.9865 2.5E3 540.6093 2.8E3 583.4113 3.0E3 END IONS BEGIN IONS FEATURE_ID=752 PEPMASS=279.0938 SCANS=752 RTINSECONDS=930.093 CHARGE=1+ MSLEVEL=2 MERGED_STATS=11 / 11 (0 removed due to low quality, 0 removed due to low cosine). 46.0109 2.1E3 47.8154 2.2E3 49.6179 2.7E3 50.6342 2.3E3 50.8740 2.4E3 55.0541 2.8E3 56.6318 2.3E3 57.0697 4.4E4 57.8113 2.7E3 59.5411 2.3E3 61.9027 2.1E3 61.9630 2.1E3 62.5264 2.4E3 62.7185 2.3E3 62.7435 2.1E3 64.3886 2.4E3 65.4462 2.2E3 65.8514 2.2E3 67.0080 2.2E3 67.0541 1.5E4 69.5827 2.1E3 70.2664 2.2E3 70.9935 2.0E3 73.0648 2.4E3 75.0596 2.2E3 75.8577 2.5E3 78.4090 2.4E3 79.4665 2.2E3 81.0698 2.2E4 81.9555 2.3E3 87.2893 2.3E3 91.5051 2.7E3 93.0691 2.5E3 93.1294 3.5E3 95.0495 2.8E3 95.0854 1.2E4 102.8576 2.3E3 103.4901 2.5E3 104.4013 2.6E3 105.9643 2.8E3 107.0857 3.8E3 107.7931 2.4E3 109.1013 6.8E3 118.5942 2.4E3 118.6064 2.3E3 121.1005 3.6E3 123.7465 2.4E3 126.1238 2.4E3 132.4790 2.2E3 137.6475 2.5E3 141.5025 2.9E3 143.6990 2.4E3 146.6905 2.7E3 149.0232 4.9E5 149.6899 5.4E3 149.8190 3.0E3 151.0753 7.9E4 156.5567 2.5E3 157.8894 2.5E3 159.8458 2.5E3 164.1842 3.0E3 167.6663 2.5E3 169.4897 2.2E3 173.0514 3.8E4 173.5249 3.4E4 173.5346 1.6E5 173.5458 1.0E4 182.8965 2.6E3 184.1688 2.3E3 187.0472 2.4E3 191.0308 2.5E3 201.0464 3.4E5 203.6826 2.3E3 206.0535 7.6E3 219.0319 6.3E3 219.0571 1.9E6 219.0819 4.0E4 219.3651 2.4E3 220.2932 2.7E3 231.2909 2.6E3 239.6154 3.0E3 255.4837 2.3E3 262.7467 2.6E3 279.0579 2.2E4 279.0935 1.4E6 279.1270 1.3E4 279.1710 3.3E3 279.2296 3.1E3 279.6489 2.9E3 END IONS BEGIN IONS FEATURE_ID=753 PEPMASS=282.2796 SCANS=753 RTINSECONDS=931.462 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 6 (0 removed due to low quality, 0 removed due to low cosine). 46.7356 2.1E3 49.5396 2.2E3 53.0386 5.7E3 53.5536 2.2E3 55.0176 4.2E4 55.0540 6.0E5 55.0571 4.8E3 57.0333 2.4E4 57.0697 6.2E5 58.0649 2.1E4 60.0444 3.6E3 64.1141 2.3E3 67.0539 1.8E5 67.5900 2.1E3 69.0331 1.2E4 69.0696 9.6E5 69.0738 6.5E3 69.0761 4.6E3 69.7969 2.5E3 70.0649 9.3E3 71.0489 2.0E4 71.0852 2.7E5 72.0441 3.6E4 72.0805 7.8E4 72.2822 2.9E3 73.1104 2.1E3 79.0539 9.2E4 79.6614 2.2E3 81.0695 3.1E5 83.0488 4.7E4 83.0852 6.7E5 83.0909 3.5E3 84.0805 1.5E4 85.0644 1.2E4 85.1008 9.7E4 86.0597 1.3E5 86.0961 3.9E4 89.5764 3.0E3 91.0538 5.3E3 91.6289 2.6E3 92.0749 2.4E3 93.0696 2.0E5 95.0852 3.0E5 96.0809 2.7E3 97.0582 3.5E3 97.0644 1.8E5 97.0901 3.0E3 97.1008 4.7E5 97.3978 2.3E3 99.0801 4.5E3 100.0601 2.5E3 100.0753 2.1E5 100.1117 7.9E3 101.9611 2.3E3 104.1128 2.2E3 107.0852 1.7E5 109.1009 1.5E5 110.0960 2.3E3 111.0801 1.4E5 111.1165 1.2E5 111.1251 4.7E3 113.3624 2.3E3 114.0910 1.4E5 114.1275 3.4E3 121.1009 1.9E5 121.2168 2.4E3 123.1165 3.7E4 125.0959 7.7E4 125.1322 9.8E3 125.2704 2.6E3 128.1067 5.4E4 134.0960 7.8E4 135.1055 3.9E3 135.1166 1.6E5 137.1324 5.7E3 139.1114 4.1E4 142.1229 1.5E4 149.1322 8.4E4 151.1492 4.9E3 153.1269 1.9E4 155.0221 2.4E3 156.1384 7.0E3 158.1068 2.4E3 163.1480 3.3E4 164.6706 2.3E3 167.1421 6.0E3 170.1550 3.4E3 173.5281 1.1E5 173.5383 1.7E4 173.5466 1.3E4 177.1636 1.1E4 191.1788 4.3E3 195.1559 2.9E3 205.1954 3.1E3 207.8865 3.9E3 210.1294 3.7E3 211.1350 2.1E4 214.3465 2.4E3 217.8709 3.1E3 234.0793 2.5E3 240.2689 3.1E4 247.2430 1.4E4 265.2528 1.2E4 278.9111 3.0E3 282.1877 4.0E3 282.2218 2.0E5 282.2770 1.3E4 285.0625 2.4E3 END IONS BEGIN IONS FEATURE_ID=754 PEPMASS=651.2819 SCANS=754 RTINSECONDS=934.943 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 66.8044 2.1E5 66.8066 3.7E4 67.2507 3.6E3 70.3627 7.4E4 74.1198 1.6E4 100.9083 2.1E4 104.5612 3.3E3 110.9619 1.6E4 131.2165 2.3E4 137.3996 3.1E3 138.2153 9.1E3 143.3065 6.5E4 143.3182 6.3E4 146.6814 1.1E4 173.5301 6.4E5 173.5409 2.3E4 228.9932 3.4E3 289.8691 3.6E3 359.1573 1.0E4 393.2050 4.5E3 407.2247 4.9E3 415.1892 4.2E4 421.2027 1.2E4 429.2113 7.8E4 430.2167 4.2E3 431.2180 1.2E4 435.2159 6.8E4 436.2266 3.6E4 443.2254 7.7E4 444.1954 2.6E5 445.1998 6.8E4 455.2275 3.5E3 456.2026 1.8E4 457.2027 1.4E5 458.2100 2.4E5 459.2173 1.5E5 461.2266 1.3E4 462.2443 9.1E3 471.2175 3.6E5 472.2240 2.9E5 473.1978 1.3E6 474.2067 6.6E3 475.2109 2.0E4 483.2166 4.2E3 485.1979 1.8E5 486.2051 5.5E5 487.1495 4.9E3 487.2125 5.5E6 488.2199 1.8E4 489.2254 1.8E5 490.1902 1.2E4 490.2078 1.6E4 491.2067 6.2E3 498.2063 5.5E3 499.2127 1.9E6 499.2954 4.8E3 500.2147 3.6E5 501.2274 5.2E5 502.2075 4.9E3 502.2270 1.7E4 503.2078 5.0E4 505.2286 1.6E4 511.2145 2.2E4 513.1916 3.3E5 514.2010 1.1E5 515.2001 4.0E3 516.2166 1.2E5 517.2252 9.8E5 518.2230 9.4E4 519.2045 2.4E4 527.2075 9.8E5 528.1360 2.1E4 528.2162 2.6E5 529.2232 8.0E5 529.3157 4.0E3 530.2272 4.3E3 531.2065 5.4E4 531.2347 1.3E5 532.2131 6.6E3 533.2240 5.6E4 535.2725 6.1E3 536.2776 8.1E3 544.2333 3.0E4 544.2452 1.0E4 545.2371 2.1E6 549.2480 7.2E3 555.2068 1.1E5 557.2549 3.8E5 558.2267 7.0E4 559.2354 5.6E4 563.2646 3.9E5 564.2707 6.7E4 573.0379 1.7E5 573.0818 1.3E5 573.2497 4.1E7 573.4197 7.2E4 573.4628 2.8E5 574.2536 1.2E5 575.2604 7.9E4 577.2509 4.2E3 587.2390 5.4E3 589.2445 2.2E4 590.2523 1.1E4 591.2580 1.8E4 592.2717 2.9E4 601.2445 6.4E6 605.2624 3.1E5 619.2546 6.0E4 623.2847 9.8E3 633.1503 1.7E4 633.2704 1.9E6 633.3628 1.7E4 651.2838 1.1E5 END IONS BEGIN IONS FEATURE_ID=755 PEPMASS=673.2638 SCANS=755 RTINSECONDS=934.943 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 6 (0 removed due to low quality, 0 removed due to low cosine). 67.9408 5.8E3 68.1375 2.3E5 68.1402 3.0E4 68.2513 2.8E3 69.5572 1.1E4 71.2462 1.8E4 71.2492 1.4E5 72.8036 2.6E3 72.8059 4.3E4 74.8067 4.2E5 74.8095 3.4E4 76.3529 9.8E3 76.9671 3.8E3 78.2675 6.8E3 80.6373 1.0E4 80.8087 7.1E3 80.8940 9.7E3 81.7671 6.0E3 87.0434 1.2E4 87.7444 2.1E3 89.0350 6.4E3 89.0591 2.9E5 89.1145 2.3E3 90.0623 2.4E4 91.1724 9.2E3 92.8570 1.3E4 102.9216 5.9E3 103.8786 6.2E3 114.3276 2.4E3 122.7554 8.9E3 123.7045 1.2E4 125.5530 1.0E4 130.8816 1.0E4 133.0852 1.3E5 134.0873 6.3E3 141.7520 3.6E3 145.0731 6.9E3 158.4293 6.1E3 160.2413 1.2E4 168.3094 2.4E3 168.3235 2.6E3 173.5324 5.0E5 173.5458 2.6E4 175.1846 1.1E4 175.5126 2.4E3 178.1142 6.0E3 180.3284 1.1E4 189.5905 2.4E3 189.9128 1.3E4 196.4660 1.0E4 204.5210 2.4E3 211.7305 6.2E3 213.3717 6.6E3 225.0673 5.4E3 261.0767 6.5E3 294.8493 5.8E3 336.0174 6.6E3 359.3191 1.2E4 372.2763 1.1E4 393.7952 3.8E3 403.5590 6.8E3 434.0812 6.9E3 443.1840 3.5E3 444.8248 7.6E3 457.1998 8.9E4 458.2080 5.7E4 484.2207 4.2E3 486.2354 4.3E3 496.1853 4.7E4 497.1928 4.0E4 510.2056 9.8E3 512.1821 3.1E4 513.1894 9.5E4 514.1975 9.7E4 522.1642 3.8E4 523.0624 9.9E3 523.1871 3.1E4 523.2037 3.0E4 524.2211 1.1E4 525.2223 1.0E4 527.2123 2.7E3 529.2208 1.4E4 529.5708 3.6E3 531.2025 9.1E4 535.1733 2.0E5 536.1795 8.0E3 538.0699 6.0E3 540.1767 2.2E5 541.1827 1.0E4 549.1786 5.9E3 550.2000 6.6E4 551.2050 1.8E6 551.3012 8.1E3 552.2126 1.3E5 552.9803 4.1E3 553.1850 3.9E5 554.1917 1.7E5 555.2041 9.6E4 557.1741 3.1E4 557.2594 1.9E4 565.2191 1.1E4 567.1946 1.5E4 567.2121 2.9E3 569.2484 1.9E5 572.2006 2.3E4 573.2501 1.0E5 575.2652 1.5E5 577.1849 4.9E4 579.2367 8.8E3 583.2303 2.0E4 585.2124 2.2E4 585.2222 1.2E5 595.2162 2.6E5 597.2471 8.2E5 597.3530 1.2E4 597.6241 1.2E4 599.2213 3.0E4 601.2452 6.9E4 609.2091 1.1E4 613.2415 6.6E6 614.2498 9.9E5 614.3651 4.2E3 615.2544 1.9E4 623.2259 3.5E5 627.2224 3.1E3 627.2369 7.5E3 629.2725 4.4E5 633.2718 9.5E4 641.1119 4.1E4 641.2366 4.2E6 642.2427 1.0E4 645.2415 1.4E4 645.2475 9.0E4 655.1347 1.9E4 655.1534 5.2E3 655.2523 1.3E6 655.3785 6.4E3 656.2614 5.5E4 658.2443 2.9E3 673.2623 1.1E7 673.5272 8.3E3 674.2676 5.4E3 END IONS BEGIN IONS FEATURE_ID=756 PEPMASS=689.2377 SCANS=756 RTINSECONDS=935.137 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 71.0714 2.4E3 76.0237 2.5E3 78.8226 2.3E3 79.6567 2.5E3 79.7287 2.4E3 87.3416 2.3E3 89.0595 2.1E4 91.5760 2.8E3 98.7787 2.4E3 104.7122 2.5E3 108.5038 2.3E3 111.7977 2.5E3 114.3449 2.6E3 115.9974 2.3E3 133.0859 5.1E3 163.1384 2.4E3 169.9640 2.7E3 173.5247 1.7E4 173.5339 9.2E4 173.5434 1.0E4 224.2589 2.4E3 228.9642 2.7E3 307.8921 2.8E3 353.6892 2.5E3 370.4028 2.7E3 388.2347 2.3E3 391.3879 2.6E3 428.3987 2.2E3 436.0749 2.5E3 462.2109 2.4E3 485.2538 3.0E3 537.2310 3.2E3 543.1336 1.0E4 559.2087 7.1E3 563.2621 3.2E3 577.2197 2.8E3 585.2506 3.6E3 593.2100 5.7E3 602.2531 4.9E3 603.1989 7.5E3 629.1693 8.3E3 641.3270 2.8E3 END IONS BEGIN IONS FEATURE_ID=757 PEPMASS=780.5538 SCANS=757 RTINSECONDS=936.754 CHARGE=1+ MSLEVEL=2 MERGED_STATS=37 / 37 (0 removed due to low quality, 0 removed due to low cosine). 71.0726 4.4E5 71.0851 2.3E3 71.5701 2.5E3 71.7148 2.2E3 72.7426 2.3E3 72.9249 2.2E3 73.1433 2.2E3 73.5445 2.2E3 73.8747 2.2E3 74.2036 2.4E3 74.2267 2.6E3 74.3147 2.3E3 74.6091 2.4E3 74.9647 2.3E3 75.1532 2.1E3 75.3095 2.0E3 75.5149 2.3E3 75.6185 2.3E3 75.7214 2.7E3 75.9267 2.6E3 77.1270 2.2E3 77.1620 2.2E3 78.4512 2.3E3 79.0541 8.4E3 79.8164 2.9E3 79.8259 2.5E3 79.9815 2.3E3 80.1931 2.2E3 80.2896 2.5E3 81.0696 1.0E5 81.2599 2.3E3 81.2737 2.5E3 81.4142 2.6E3 81.4349 4.4E3 82.9514 2.6E3 83.0852 2.1E4 83.2934 2.3E3 85.0636 2.4E3 85.1384 2.2E3 85.6095 2.5E3 85.9015 2.8E3 86.0961 8.4E6 86.1026 2.8E3 86.1054 1.9E4 86.2365 2.5E3 87.4156 2.6E3 87.7816 2.4E3 87.9103 2.2E3 88.2597 2.4E3 88.4587 2.4E3 88.6506 2.4E3 88.8262 2.9E3 89.9163 2.5E3 90.1289 2.1E3 91.0536 2.3E3 91.1835 2.3E3 91.6846 2.3E3 92.4683 4.9E3 93.0696 4.2E3 93.2092 2.4E3 94.0160 2.7E3 95.0852 1.1E5 97.1003 3.2E3 97.2269 2.9E3 97.5967 2.5E3 97.7432 2.4E3 98.3811 2.3E3 98.9840 4.0E5 99.1481 2.3E3 99.3609 2.8E3 99.6853 2.5E3 100.1603 2.2E3 100.9039 2.3E3 102.5282 2.3E3 103.3370 2.5E3 104.1066 8.1E5 106.2002 2.6E3 106.5286 2.4E3 109.1007 3.6E4 109.2579 2.3E3 109.5214 2.4E3 109.6053 2.3E3 110.6206 2.8E3 111.0348 2.3E3 112.3962 2.7E3 112.5352 2.4E3 113.1076 2.3E3 114.1952 2.2E3 115.2667 2.8E3 115.5789 2.4E3 116.1428 2.5E3 116.4873 2.3E3 116.5616 2.2E3 116.7467 2.7E3 117.8876 2.3E3 118.9957 2.4E3 119.4474 2.4E3 119.5002 2.2E3 120.4218 2.6E3 120.7081 2.4E3 120.7650 2.4E3 120.9820 2.1E3 121.1011 2.8E3 121.4043 2.3E3 121.8362 3.1E3 122.8148 2.7E3 122.8884 2.2E3 123.1168 1.2E4 124.2564 2.7E3 124.6040 2.3E3 124.9891 4.8E4 124.9995 3.8E6 125.0085 2.3E3 125.0104 8.9E4 126.7994 2.6E3 128.3675 2.4E3 130.8104 3.0E3 132.6889 2.7E3 133.1002 2.3E3 135.2206 2.9E3 137.1628 2.6E3 137.2582 2.5E3 139.6038 2.3E3 140.7153 2.6E3 141.8128 2.3E3 146.9682 3.1E3 146.9814 1.1E6 146.9952 2.6E3 147.5930 2.6E3 149.6817 8.0E3 149.6921 9.0E3 151.0000 2.5E3 153.6080 2.6E3 154.0107 2.6E3 154.9455 2.5E3 155.2151 2.2E3 155.2831 2.6E3 155.6732 2.3E3 155.8708 2.5E3 158.2048 2.9E3 161.4382 2.7E3 161.9464 2.9E3 164.5089 2.4E3 166.4808 3.3E3 166.7547 2.5E3 169.6320 2.3E3 170.0101 2.5E3 170.6151 2.6E3 171.1719 2.4E3 173.5220 7.1E4 173.5294 6.0E5 173.5420 2.7E5 177.1327 2.5E3 180.0826 2.5E3 184.0135 1.1E4 184.0241 9.7E3 184.0353 6.9E5 184.0426 1.6E4 184.0733 7.9E7 184.1031 3.3E5 184.1121 5.1E5 184.1231 8.2E4 184.1333 1.1E4 184.1449 3.5E3 185.0763 2.2E4 185.9554 2.3E3 186.7558 2.6E3 188.7190 2.6E3 191.2939 2.3E3 191.5991 2.7E3 193.3527 2.5E3 193.9225 2.7E3 200.3390 3.1E3 201.3547 3.1E3 201.9808 2.6E3 202.3483 3.1E3 202.6726 2.7E3 205.6044 2.7E3 206.7336 2.4E3 216.3665 3.3E3 217.6905 2.3E3 221.3276 2.5E3 222.2679 2.5E3 222.2916 2.8E3 226.6596 2.7E3 226.9906 2.6E3 234.7103 2.4E3 238.5956 2.6E3 240.4817 2.4E3 241.1828 2.2E3 244.9577 2.3E3 248.1368 2.7E3 248.7583 2.9E3 251.5211 2.7E3 253.9510 2.9E3 256.0269 2.7E3 256.4026 2.8E3 256.9247 2.4E3 263.2366 3.0E3 266.0683 2.8E3 267.4118 2.6E3 267.9314 3.1E3 275.6110 2.4E3 278.1642 2.1E3 287.7996 2.6E3 291.7987 2.6E3 294.9874 2.7E3 295.8250 2.4E3 302.4054 2.5E3 305.8598 2.4E3 305.8795 3.3E3 314.3692 3.0E3 319.2086 2.7E3 320.9272 2.3E3 340.6665 2.6E3 346.5170 2.5E3 346.5389 2.4E3 348.6740 2.4E3 352.0481 2.7E3 367.6254 2.9E3 370.3127 2.6E3 376.3138 2.4E3 382.4130 3.0E3 382.4683 2.5E3 384.5884 2.4E3 405.1566 2.8E3 408.5906 2.7E3 413.4410 2.3E3 416.2304 2.6E3 424.3359 2.4E3 433.1103 2.5E3 438.8775 2.7E3 441.2372 2.4E3 441.2464 2.8E3 442.7159 2.6E3 443.2568 6.0E3 465.2400 2.6E4 466.4083 2.4E3 483.8034 2.8E3 490.8473 2.4E3 500.3166 1.3E4 502.3284 3.3E4 507.2908 2.5E3 508.9120 2.8E3 528.9943 2.5E3 532.3139 2.5E3 550.2344 2.6E3 550.9420 2.3E3 573.2486 3.2E3 575.5048 1.7E5 584.5860 2.4E3 586.7496 2.8E3 592.3725 2.7E3 592.4824 2.6E3 594.1590 2.8E3 595.3376 2.4E3 597.4878 2.4E5 604.0056 2.8E3 615.0386 2.5E3 652.2268 1.1E4 657.2272 2.8E3 669.6068 2.7E3 670.9802 2.6E3 673.0823 2.8E3 715.2656 3.2E3 727.9750 2.7E3 754.9731 2.5E3 758.1958 2.9E3 761.2000 2.5E3 779.7233 2.5E3 780.8590 2.6E3 END IONS BEGIN IONS FEATURE_ID=758 PEPMASS=840.5465 SCANS=758 RTINSECONDS=937.017 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 6 (0 removed due to low quality, 0 removed due to low cosine). 78.4662 2.3E3 78.8519 2.3E3 79.0539 7.6E4 80.0423 2.1E3 80.1137 2.2E3 81.0333 3.4E3 81.0695 1.4E5 81.2331 2.5E3 81.7258 2.2E3 83.0490 4.4E3 83.0852 3.3E4 85.0645 3.2E3 86.0961 1.8E4 89.4776 2.2E3 91.0539 5.9E4 93.0695 1.1E5 95.0489 1.3E4 95.0852 1.3E5 95.3056 2.4E3 97.0645 3.5E4 97.1009 2.0E4 98.0979 2.5E3 98.6686 2.4E3 99.0804 2.6E3 100.7639 2.3E3 104.1062 6.2E3 104.2612 2.4E3 105.0695 6.3E4 107.0851 7.8E4 109.0646 5.0E3 109.1008 9.5E4 111.0803 5.8E3 117.0694 1.6E4 119.0851 6.6E4 120.7673 2.7E3 121.0647 3.7E3 121.1008 7.5E4 122.2951 2.5E3 123.0797 3.1E3 123.1167 1.7E4 124.9995 8.8E3 125.0957 9.0E3 126.4547 2.2E3 131.0852 3.3E4 133.1009 6.2E4 135.0802 3.1E3 135.1166 4.7E4 137.0958 1.3E4 137.1324 5.4E3 143.8062 2.5E3 145.1008 4.4E4 147.1164 5.4E4 149.0958 3.5E4 149.1321 2.3E4 149.6703 2.8E3 149.6820 4.2E3 149.6918 1.9E4 149.7122 3.6E3 157.1014 5.9E3 159.1164 4.1E4 161.1323 2.8E4 163.1113 1.2E4 163.1482 3.6E3 170.8729 2.8E3 171.1160 6.2E3 173.1321 2.7E4 173.5193 6.3E3 173.5337 1.2E5 175.1486 7.1E3 179.1431 8.5E3 184.0731 2.4E5 185.1324 5.7E3 193.4155 2.4E3 193.7545 2.2E3 203.1810 2.8E3 203.8941 2.3E3 209.5186 2.3E3 219.3247 3.0E3 227.1284 7.2E3 240.3658 2.4E3 247.2064 7.4E3 257.1900 1.9E4 261.2216 7.3E3 275.2004 7.4E4 291.1974 5.3E3 298.0662 2.7E3 335.2586 1.1E5 344.2574 2.6E3 349.2381 1.7E4 353.2691 2.9E3 364.2545 2.4E3 400.3654 2.7E3 456.8634 3.0E3 471.2944 2.7E3 525.6053 2.8E3 565.1072 2.5E3 584.2589 3.1E3 590.3790 2.6E3 635.4553 2.9E3 691.1631 2.8E3 759.2472 2.5E3 806.5645 2.9E3 821.4110 2.7E3 840.4965 3.2E3 END IONS BEGIN IONS FEATURE_ID=759 PEPMASS=609.2714 SCANS=759 RTINSECONDS=937.683 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 6 (3 removed due to low quality, 0 removed due to low cosine). 64.1371 5.6E4 64.1399 2.8E4 65.6941 2.6E5 65.6977 6.9E4 66.2399 1.0E4 67.6953 2.6E5 67.6989 6.5E4 68.9546 1.2E4 87.2943 5.0E3 89.7408 5.0E3 107.8170 5.1E3 108.2459 1.7E4 118.3361 1.3E4 132.8152 2.5E4 134.7775 5.5E3 137.6390 1.0E4 147.2798 1.5E4 173.5286 3.3E5 173.5422 1.1E5 189.0253 1.6E4 192.2954 1.8E4 219.3464 1.6E4 224.1310 7.8E3 237.1384 8.4E3 238.1463 1.1E4 239.1548 9.0E4 243.3606 1.1E4 251.1542 4.2E4 263.5247 5.7E3 266.8346 5.1E3 404.2147 6.9E3 405.2068 6.9E3 407.2234 1.6E5 420.2310 1.5E5 421.2382 2.3E5 422.2462 1.2E5 429.2086 8.0E3 430.2187 5.1E4 433.2420 2.1E4 434.2467 1.1E4 444.2317 8.3E4 446.2449 5.7E3 447.1825 5.8E4 448.2192 2.5E4 448.2668 1.1E4 449.2346 9.7E4 456.1937 6.1E3 457.2392 2.0E5 458.2056 5.5E3 458.2490 6.6E3 459.2186 1.0E6 460.2260 1.8E5 461.2002 1.4E5 462.2045 4.4E4 463.2143 1.4E5 470.2127 3.2E4 472.2250 1.6E5 473.2334 9.7E4 474.2392 3.1E4 475.2149 5.8E5 476.2226 9.7E5 477.2299 5.8E5 478.2363 1.8E5 479.2419 5.6E4 485.2335 3.3E6 485.3498 2.4E4 486.2055 9.6E5 487.2449 2.4E5 488.2230 5.8E4 489.2282 3.8E5 490.2330 8.4E3 491.2435 5.4E4 492.2535 4.0E4 493.2278 2.6E4 493.2409 3.3E4 493.2557 3.9E4 494.2679 4.4E5 497.2335 2.2E5 499.2136 6.6E5 500.2211 3.5E5 501.2270 8.4E4 502.2367 1.8E5 503.2437 1.5E6 504.2440 5.9E5 505.2542 1.4E5 507.2165 1.2E4 507.2344 7.4E4 513.2286 8.1E5 514.2353 7.4E4 515.2442 4.6E6 516.2148 4.5E4 517.2234 3.1E5 518.2308 2.5E5 519.2392 1.2E5 520.2101 3.1E4 521.2521 1.3E6 522.2519 1.9E5 526.2598 2.7E4 530.1953 2.5E4 531.0509 1.0E5 531.2389 1.4E7 532.2434 9.9E4 533.2548 3.4E5 534.2245 6.1E4 535.2351 1.8E5 536.2402 9.6E4 541.1286 3.6E4 541.2233 1.3E6 544.2104 6.0E4 545.2538 4.4E4 547.2727 1.0E4 548.2423 4.3E5 549.1774 1.4E4 549.2501 2.0E6 549.3469 2.0E4 550.1569 3.6E4 550.2577 3.4E6 550.3564 3.3E4 553.2834 5.9E3 559.2345 8.7E6 563.2653 3.1E5 573.2531 2.8E4 576.2412 2.4E4 577.0902 1.6E4 577.1381 3.5E4 577.2451 1.8E6 577.3521 1.1E4 579.2269 7.4E3 580.2322 4.2E4 581.2766 2.1E5 591.2606 8.1E6 594.2471 1.7E5 609.2710 8.2E6 END IONS BEGIN IONS FEATURE_ID=760 PEPMASS=608.2634 SCANS=760 RTINSECONDS=937.857 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 87.2365 2.7E3 89.0593 7.4E3 102.9268 2.3E3 103.1100 2.6E3 103.9615 2.2E3 117.0904 3.1E3 134.3581 2.3E3 138.7508 2.4E3 154.0553 2.3E3 173.5191 2.9E3 173.5346 7.1E4 185.4912 2.2E3 200.8907 2.2E3 267.6403 2.4E3 367.5969 2.6E3 419.2170 2.8E3 420.2308 1.2E5 421.2366 6.3E3 433.2403 3.8E3 434.2440 1.0E4 445.2425 3.5E3 446.2461 5.7E3 447.2175 2.2E4 448.2201 9.3E3 448.2294 3.1E3 449.2335 3.0E4 452.2215 3.1E4 459.2106 4.5E3 459.2209 1.5E4 460.2254 4.8E4 462.2055 1.4E4 465.2275 1.1E4 473.2004 2.8E3 474.2409 3.7E4 475.2128 4.6E5 476.2203 1.0E5 477.2300 1.4E5 478.2301 3.7E3 484.2272 2.7E3 485.2346 1.5E4 487.2188 1.5E4 488.2202 2.4E4 489.2275 3.2E4 491.2371 3.3E3 492.2501 4.8E4 493.2195 2.3E3 499.2128 7.7E3 501.2280 1.8E4 502.2355 9.8E4 503.2438 9.6E5 504.2476 6.5E4 515.2429 2.1E4 516.2125 2.7E3 517.2234 2.6E4 518.2296 1.9E4 519.2347 6.2E3 520.2397 8.7E3 520.2473 4.6E3 521.2526 4.0E5 530.2281 1.4E4 531.2380 6.3E4 533.2190 1.7E4 534.2273 3.1E3 535.2333 5.5E4 536.2420 3.1E4 547.2356 1.6E4 548.2398 1.3E5 549.2497 3.7E5 549.3469 1.0E4 550.2578 1.8E4 558.2274 4.6E3 559.2344 4.1E4 563.2679 5.3E3 565.2470 1.5E4 577.2451 6.3E3 580.2632 1.4E4 591.2614 4.1E4 593.2407 1.7E4 608.2608 3.3E4 609.2719 3.4E4 END IONS BEGIN IONS FEATURE_ID=761 PEPMASS=631.2532 SCANS=761 RTINSECONDS=937.857 CHARGE=1+ MSLEVEL=2 MERGED_STATS=1 / 1 (0 removed due to low quality, 0 removed due to low cosine). 73.1387 2.4E3 75.8011 2.3E3 84.9650 2.5E3 89.0594 4.6E3 107.4227 2.3E3 133.0852 2.8E3 134.3011 2.7E3 134.3112 2.5E3 173.5298 2.7E4 205.1536 2.4E3 217.1681 2.7E3 249.1118 4.4E3 447.2525 3.9E3 455.2191 5.0E3 461.2782 2.9E3 469.2348 1.3E4 470.2445 8.6E3 482.2096 4.8E3 483.2503 1.2E4 491.2424 6.8E3 496.2206 6.8E3 497.2323 5.2E3 499.2052 5.9E3 507.1881 2.5E3 508.1871 8.4E3 509.2289 1.1E4 511.2464 7.6E4 513.2250 5.5E3 514.2371 8.1E3 515.2424 1.3E4 522.2017 2.3E4 527.2410 1.3E4 531.2452 3.0E3 533.2545 3.8E4 536.2134 3.8E3 537.2256 9.6E5 540.2140 1.2E4 541.2496 4.4E3 543.2706 1.2E4 553.2189 9.1E3 555.2365 1.1E5 557.2115 4.5E3 558.2202 5.5E3 569.2523 1.8E4 570.2297 2.8E3 571.2322 1.3E4 572.2399 2.1E4 581.1339 4.6E3 581.2159 2.3E5 585.5349 4.8E3 587.2628 5.6E4 591.2631 5.7E3 599.2313 3.5E3 613.2398 1.7E4 631.2530 2.7E4 END IONS BEGIN IONS FEATURE_ID=762 PEPMASS=986.6051 SCANS=762 RTINSECONDS=937.857 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 6 (0 removed due to low quality, 0 removed due to low cosine). 79.0539 1.0E5 79.8474 2.1E3 81.0332 1.4E4 81.0696 1.8E5 83.0488 2.0E4 83.0852 2.2E4 85.0280 4.1E4 85.0645 3.0E3 85.1428 2.3E3 91.0386 2.0E4 91.0539 8.8E4 92.2631 2.6E3 93.0639 3.2E3 93.0695 1.5E5 95.0488 1.6E4 95.0793 3.7E3 95.0852 1.5E5 97.0280 2.5E4 97.0646 1.6E4 97.1009 1.3E4 100.3437 2.4E3 102.2173 2.4E3 105.0695 9.3E4 107.0851 1.1E5 108.0725 2.4E3 109.0641 3.3E3 109.1008 1.1E5 111.0801 7.1E3 111.1169 3.4E3 117.0695 4.3E4 118.3768 2.6E3 119.0851 9.8E4 121.0644 5.0E3 121.1008 1.2E5 123.0797 9.3E3 123.1164 2.3E4 125.0960 2.8E3 127.0386 1.5E4 129.0543 5.2E3 129.0695 1.4E4 129.5932 2.7E3 131.0852 8.5E4 133.1008 1.3E5 135.0801 2.4E3 135.1073 2.4E3 135.1165 9.3E4 137.0960 6.9E3 141.9649 2.5E3 142.1985 2.4E3 143.0852 1.5E4 143.4181 2.5E3 145.0493 8.5E3 145.0620 2.4E3 145.1008 7.6E4 147.1165 1.0E5 149.0958 8.0E3 149.1321 4.8E4 157.1009 2.0E4 159.1166 8.3E4 161.1322 6.7E4 163.1108 5.3E3 163.1482 1.4E4 169.1023 2.6E3 171.1164 3.4E4 173.1325 5.5E4 173.5256 7.1E4 173.5360 1.0E5 173.5452 2.0E4 175.1312 2.3E3 175.1479 2.3E4 177.1268 2.9E3 183.1166 7.3E3 185.1324 2.2E4 187.1477 1.6E4 189.1649 2.9E3 197.1318 5.9E3 197.7470 2.4E3 199.1482 2.1E4 201.1077 2.5E3 201.1643 2.8E3 203.1429 3.1E3 211.8674 3.0E3 231.2098 4.5E3 239.1788 9.1E3 241.1952 4.1E4 243.2098 6.3E3 253.6027 2.8E3 257.1895 9.5E3 259.2054 1.3E5 261.2205 2.7E4 275.2007 1.7E4 276.2472 3.0E3 277.2173 3.3E3 293.2112 1.3E4 315.2326 1.0E4 333.2429 6.3E4 335.2584 1.6E5 336.2530 2.8E3 396.2238 2.6E3 411.3658 2.6E3 425.1259 2.3E3 435.8500 2.5E3 490.1713 2.8E3 559.7965 2.3E3 597.0234 2.5E3 612.9799 2.5E3 618.2137 2.5E3 640.1785 2.9E3 703.8450 2.9E3 782.0909 2.4E3 794.0930 2.9E3 813.8112 2.7E3 826.7396 2.6E3 833.9926 3.0E3 839.7541 2.8E3 873.6842 2.4E3 937.8972 2.6E3 954.3060 2.7E3 985.3211 2.5E3 END IONS BEGIN IONS FEATURE_ID=763 PEPMASS=748.4763 SCANS=763 RTINSECONDS=937.997 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 69.0696 1.5E4 71.0851 2.2E4 71.3412 2.5E3 75.7024 2.4E3 79.0538 2.8E3 81.0694 4.6E4 83.0849 2.8E4 85.1008 1.8E4 87.9954 2.5E3 95.0850 4.7E4 97.1007 9.1E3 104.5097 2.2E3 107.0849 1.0E4 109.1006 3.5E4 111.0436 9.3E4 111.0801 2.9E3 111.1160 3.0E3 119.0845 4.9E3 121.1007 2.4E4 123.1164 2.5E4 125.0593 2.3E4 133.1009 1.7E4 135.0803 3.2E3 135.1162 3.3E4 137.0592 4.7E5 137.0700 2.1E3 137.0772 3.2E3 137.1320 2.8E4 139.4205 2.7E3 140.0677 5.1E4 147.1163 3.6E4 149.0957 2.8E4 149.1321 1.4E4 149.6881 5.1E3 149.7083 3.5E3 151.1118 9.4E3 159.4804 2.6E3 160.7429 2.2E3 161.0959 3.6E4 161.1320 1.8E4 162.9172 2.3E3 163.1113 2.6E4 163.1467 3.9E3 165.0906 1.9E4 165.1266 2.9E3 167.1060 7.0E3 173.5282 7.8E4 173.5414 3.0E4 175.1113 2.8E4 175.1477 7.9E3 177.1271 6.5E3 179.1063 3.3E4 181.1214 7.1E3 189.1265 3.0E3 191.8291 2.3E3 193.1218 2.9E4 193.8934 2.1E3 203.1791 9.9E4 205.1945 9.8E3 207.1373 2.9E3 213.0795 2.7E3 213.1635 3.6E4 221.1897 4.0E4 231.1741 2.0E5 239.2363 3.1E3 241.1585 2.1E4 249.1567 4.1E3 249.1845 2.3E5 259.1655 2.4E3 259.9731 2.6E3 269.4054 2.6E3 273.0797 2.4E3 277.1798 8.2E5 282.2791 2.1E4 295.1907 9.2E4 313.2737 1.5E5 320.2217 7.2E4 340.1655 3.1E3 351.2165 5.7E4 423.4271 2.4E3 507.1234 3.0E3 589.4470 1.3E5 593.5206 2.7E3 670.1998 2.4E3 742.7817 2.9E3 END IONS BEGIN IONS FEATURE_ID=764 PEPMASS=657.2921 SCANS=764 RTINSECONDS=938.073 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 81.9826 2.3E3 98.1400 2.9E3 99.3093 2.4E3 109.0493 2.4E3 114.4907 2.4E3 129.6068 2.4E3 136.9167 2.6E3 151.3469 2.2E3 152.5498 2.6E3 173.5267 6.0E4 173.5416 2.6E4 203.1183 5.2E3 225.8352 2.5E3 253.1685 6.1E3 295.1784 3.1E3 300.7368 2.9E3 309.5676 2.5E3 311.1748 4.3E3 318.1596 1.0E4 320.1746 3.2E3 332.1762 8.7E3 351.1698 2.2E4 390.1829 1.6E4 409.1947 2.8E3 409.2030 5.6E3 410.2075 9.0E3 411.1940 9.2E3 418.1729 3.0E3 422.2165 5.1E3 424.2253 1.4E4 425.2341 2.2E4 430.2532 3.2E3 437.2354 1.4E4 450.2033 2.6E4 451.2134 7.1E3 452.2116 5.9E3 452.2213 1.0E4 453.2277 5.9E3 455.2556 3.4E3 457.2362 1.0E5 464.2220 1.3E4 465.2302 1.2E4 466.2478 6.1E3 469.2259 1.2E4 470.2509 2.8E3 479.2441 1.6E4 480.2386 2.1E4 481.2580 3.8E3 482.2720 1.8E4 483.2726 3.0E4 484.2791 2.4E4 493.2539 2.3E4 494.2422 4.9E3 495.2391 1.7E4 497.2558 2.6E4 498.2676 1.3E4 507.2275 3.2E3 507.2379 1.2E4 508.2586 2.4E4 509.2877 1.9E4 510.2623 1.3E5 511.2703 8.4E4 517.2570 5.9E4 521.2523 4.3E3 522.2643 1.1E4 523.2403 1.2E4 524.2614 3.8E3 524.2771 1.3E4 525.2833 1.7E5 526.2903 1.0E5 527.2630 4.2E4 528.2567 1.5E4 529.2486 2.8E3 535.2689 2.1E4 536.2541 3.2E4 537.2531 4.3E3 538.2566 4.1E4 539.2666 1.4E4 541.2807 5.5E4 551.2646 2.7E4 552.2749 3.3E3 553.2805 2.2E5 554.2548 1.3E4 555.2581 2.8E4 563.2690 3.7E3 565.2520 8.7E3 567.2599 1.5E4 568.2517 7.2E3 569.2754 6.0E3 570.2832 1.3E4 571.2912 2.6E4 581.2755 2.7E4 585.2719 1.8E4 589.2844 3.1E3 595.2907 1.5E4 596.2750 1.3E4 597.2602 3.2E3 598.2768 8.6E3 613.3033 4.7E4 614.2747 3.0E3 615.2829 2.2E4 651.3504 2.5E3 657.2747 3.2E3 END IONS BEGIN IONS FEATURE_ID=765 PEPMASS=584.4224 SCANS=765 RTINSECONDS=946.157 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 63.4052 2.4E3 66.5135 2.8E3 67.0540 1.6E4 68.5751 2.2E3 69.0334 6.3E3 69.0696 3.6E4 71.0854 1.9E4 73.0283 2.3E4 73.0645 2.2E4 73.9862 2.6E3 76.5861 2.3E3 79.0539 2.7E4 81.0695 8.4E4 83.0487 6.5E3 83.0852 3.1E4 85.0645 7.9E3 85.1009 1.3E4 85.9083 2.3E3 87.0438 8.0E4 89.0594 1.8E6 89.0682 1.8E4 90.4320 2.2E3 91.0539 3.3E4 93.0695 1.1E5 95.0489 2.7E4 95.0852 9.9E4 95.2474 2.1E3 96.0883 3.2E3 96.2310 2.6E3 97.0644 2.1E4 98.8385 2.5E3 105.0696 1.0E5 107.0702 7.8E3 107.0852 1.4E5 109.0646 1.6E4 109.1008 7.2E4 111.0804 3.7E3 117.0695 1.6E4 117.0908 5.8E3 119.0768 7.7E3 119.0852 2.1E5 120.0924 1.3E4 121.0646 1.5E4 121.1008 1.4E5 123.0799 2.7E4 123.1164 2.8E4 125.0960 1.9E4 129.0697 1.0E4 129.2428 2.7E3 131.0699 2.1E4 131.0852 9.2E4 132.0926 6.8E3 133.0741 1.5E4 133.0856 9.6E5 133.1005 1.4E5 134.1078 3.0E3 134.4802 2.3E3 135.0801 3.4E4 135.1164 7.1E4 137.0956 1.7E4 139.1113 1.0E4 142.0773 1.2E4 143.0851 8.4E4 144.0929 2.2E4 145.1009 2.0E5 146.1072 1.0E4 147.0800 2.0E4 147.1164 7.3E4 149.0957 3.4E4 149.1322 8.1E3 155.0852 2.3E4 156.0928 1.1E4 156.9140 2.6E3 157.1008 1.5E5 158.1079 2.4E4 159.0801 4.1E4 159.1166 1.4E5 160.0886 5.7E3 160.1232 3.8E3 161.0958 4.9E4 161.1324 3.3E4 163.1114 1.5E4 165.0908 2.0E4 167.1068 2.1E4 169.1010 5.6E4 170.1082 1.3E4 171.1167 1.0E5 172.1243 1.6E4 173.0958 1.5E4 173.1324 1.1E5 173.5285 9.1E4 173.5424 2.5E4 174.1375 3.1E3 175.1117 3.0E4 175.1480 6.7E4 177.1119 1.4E5 177.1278 1.8E4 179.0852 2.4E3 180.1148 2.8E3 181.1008 3.3E4 181.1183 2.5E3 182.1093 9.0E3 183.1167 8.4E4 184.1239 1.7E4 185.0958 4.0E3 185.1323 7.3E4 186.1400 1.1E4 187.1119 1.3E4 187.1288 2.4E3 187.1480 5.1E4 189.1269 1.5E4 190.1355 5.9E3 191.1429 1.5E4 191.9968 2.6E3 193.1010 1.6E4 193.1206 4.0E3 194.1088 9.9E3 195.1171 6.4E4 196.1241 1.4E4 197.0976 8.0E3 197.1323 1.0E5 198.1380 1.3E4 199.1118 1.8E4 199.1478 5.5E4 200.1551 2.9E3 201.1279 1.4E4 201.1632 2.5E4 203.1429 3.6E4 207.1169 2.9E4 207.1373 4.1E3 208.1238 1.3E4 208.1454 3.1E3 209.1325 7.4E4 210.1382 6.2E3 211.1117 8.6E3 211.1482 5.8E4 212.1544 2.6E3 213.1259 1.5E4 213.1641 2.7E4 215.1425 1.8E4 216.1503 2.5E3 217.1584 9.8E3 219.1167 3.5E3 221.1328 4.2E4 221.1540 2.7E4 222.1399 1.3E4 222.3696 2.9E3 223.1113 3.4E3 223.1481 5.5E4 224.1536 6.3E3 225.1274 1.9E4 225.1639 3.2E4 227.1430 8.9E3 227.5597 3.1E3 229.1593 2.7E3 231.4148 2.4E3 233.1312 1.0E4 233.1538 6.3E4 234.1396 3.2E3 234.1637 3.0E3 235.1480 3.8E4 236.1537 2.8E3 237.1295 2.9E3 237.1635 3.7E4 239.1463 1.6E4 239.1790 2.3E4 241.1586 5.2E3 241.1957 4.7E3 247.1473 1.6E4 247.1703 3.8E3 248.1557 1.2E4 249.1635 2.9E4 250.1718 5.8E3 251.1451 3.0E3 251.1785 1.5E4 253.1587 1.6E4 253.1943 9.4E3 255.1744 9.3E4 257.1888 9.1E3 259.1462 6.7E3 259.1700 3.7E3 261.1632 2.0E4 263.1792 2.2E4 265.1620 3.3E3 265.1946 1.3E4 266.2052 3.2E3 267.1758 9.4E3 267.2109 3.6E3 267.6358 2.3E3 269.1909 8.0E3 271.2068 2.9E3 273.1890 3.7E3 274.1921 4.2E3 275.1790 1.2E4 277.1946 7.7E3 279.1753 6.9E3 279.2101 3.3E3 281.1913 7.2E3 282.2776 1.2E4 283.1760 3.5E3 283.2062 6.7E3 283.2828 3.0E4 284.2862 1.3E4 287.0411 2.3E3 287.1764 2.6E3 287.2023 5.6E3 289.1980 3.2E3 297.1854 3.3E3 299.2018 7.6E3 299.3098 3.1E3 300.3089 9.4E3 327.2029 1.2E4 337.2168 5.6E3 339.2278 2.6E3 345.2184 3.9E3 350.0861 2.7E3 351.2332 3.5E3 352.2401 1.0E4 353.2462 5.5E3 360.2413 2.7E3 365.2474 8.3E3 366.2545 4.5E3 367.2565 2.3E3 371.2264 1.1E4 442.8611 2.5E3 450.9619 2.8E3 502.3092 2.5E3 504.3631 8.4E3 551.3864 2.7E3 END IONS BEGIN IONS FEATURE_ID=766 PEPMASS=591.2607 SCANS=766 RTINSECONDS=946.157 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 65.6949 2.5E5 65.6976 6.8E4 71.0851 2.4E3 74.3811 2.5E3 76.6178 2.2E3 77.6136 2.7E3 77.9612 2.8E3 80.3847 2.4E3 95.9042 2.5E3 103.2774 2.2E3 106.5952 2.7E3 112.7473 2.3E3 116.7795 2.6E3 126.8429 2.3E3 147.8080 1.3E4 147.8220 1.2E4 154.3024 2.8E3 173.5222 2.7E4 173.5324 3.8E4 173.5413 3.8E4 208.7007 2.4E3 226.9857 2.8E3 240.0339 2.8E3 249.5225 2.5E3 296.1861 2.9E3 301.0438 2.6E3 313.2737 4.6E3 412.9143 3.1E3 415.1892 3.5E3 429.2062 9.7E3 431.2235 2.6E3 444.2306 1.9E4 445.2391 2.2E4 446.2452 1.0E4 448.2617 3.5E4 457.2351 3.1E3 458.2456 1.3E4 459.2178 3.4E4 459.2565 2.3E4 460.2191 2.8E3 461.2383 3.6E3 472.2254 4.9E4 472.6832 3.1E3 473.2330 1.3E5 474.2406 7.8E4 475.2481 2.9E4 476.2451 2.9E3 485.2330 5.1E4 486.2379 1.1E4 486.2536 4.7E3 487.2487 5.1E5 488.2543 1.5E4 489.2273 4.4E4 490.2360 1.7E4 496.4072 3.5E3 500.2202 9.7E3 501.2315 3.8E3 502.2406 3.0E3 503.2414 7.3E4 504.2487 1.6E4 505.2568 2.9E3 513.2279 8.8E3 515.2433 9.1E4 517.2239 1.7E4 518.2308 6.5E4 519.2712 1.9E4 531.0496 3.9E3 531.2382 1.5E6 532.2462 5.9E5 547.2700 2.2E4 548.2471 3.3E3 549.2505 1.1E4 559.2337 4.2E4 563.2642 4.5E4 576.2376 3.2E4 590.2579 7.0E3 591.0352 4.0E4 591.2596 7.7E6 591.4326 1.8E4 591.4833 3.7E4 591.6028 4.0E3 592.2572 9.8E3 END IONS BEGIN IONS FEATURE_ID=767 PEPMASS=589.2453 SCANS=767 RTINSECONDS=947.217 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 65.4690 2.3E4 65.4721 1.2E5 65.4905 2.2E3 75.8430 2.6E3 82.1746 2.3E3 90.8842 2.1E3 91.6451 2.0E3 95.5011 2.6E3 98.8700 2.4E3 118.4966 3.1E3 119.4494 2.4E3 127.9686 2.3E3 137.2718 2.2E3 140.5991 2.5E3 147.3057 9.1E3 159.7553 2.5E3 163.1587 2.3E3 173.5311 7.5E4 173.5447 5.7E3 187.4626 2.4E3 192.5410 2.3E3 214.1005 2.5E3 222.2911 2.8E3 236.1759 2.6E3 272.3448 2.3E3 325.3731 3.6E3 331.9691 2.5E3 442.2161 1.9E4 443.2219 1.9E4 444.2277 3.2E3 446.2449 1.8E4 456.2312 1.2E4 457.1973 2.0E4 457.2456 9.3E3 469.1999 3.4E3 470.2097 3.3E4 471.2170 7.9E4 472.2252 4.3E4 473.2327 2.6E4 483.2170 4.4E4 484.2278 1.2E4 485.2329 3.2E5 486.2416 1.2E4 487.2128 3.8E4 488.2176 1.4E4 498.2070 3.0E3 501.2271 5.3E4 502.2327 1.8E4 513.2282 5.2E4 515.2077 7.0E3 516.2135 3.4E4 517.2635 1.1E4 529.2225 9.6E5 530.1394 5.2E3 530.2305 3.3E5 530.3247 6.0E3 539.2117 3.7E3 545.2551 1.4E4 547.2278 2.8E3 557.2169 2.5E4 561.2490 3.0E4 589.2442 3.6E6 589.4250 2.0E5 END IONS BEGIN IONS FEATURE_ID=768 PEPMASS=824.5519 SCANS=768 RTINSECONDS=947.217 CHARGE=1+ MSLEVEL=2 MERGED_STATS=8 / 8 (0 removed due to low quality, 0 removed due to low cosine). 72.5281 2.1E3 73.0281 2.9E3 75.1590 2.2E3 77.0384 1.3E4 79.0537 4.0E5 81.0331 8.9E4 81.0694 8.2E5 81.0964 2.3E3 81.6560 2.2E3 83.0487 9.6E4 83.0804 2.6E3 83.0850 1.6E5 83.1632 2.2E3 85.0279 5.3E4 85.0644 4.7E4 91.0377 2.4E3 91.0537 2.7E5 93.0630 3.6E3 93.0693 6.3E5 95.0486 7.3E4 95.0850 6.4E5 97.0279 4.0E4 97.0643 1.4E5 97.1006 8.4E4 97.4990 2.5E3 99.0437 1.2E4 99.0799 4.6E4 99.0869 2.3E3 99.6097 2.3E3 102.0857 2.7E3 105.0444 3.0E3 105.0693 2.5E5 107.0488 2.8E4 107.0850 4.7E5 107.3413 2.6E3 109.0282 2.2E4 109.0643 5.8E4 109.1006 3.8E5 111.0437 7.2E3 111.0799 8.1E4 113.0959 1.6E4 114.0343 2.5E3 114.7527 2.3E3 116.2247 2.3E3 117.0694 1.4E5 119.0766 1.7E4 119.0850 3.2E5 121.0643 3.5E4 121.0913 2.5E3 121.1006 4.7E5 123.0801 5.0E4 123.1163 1.5E5 125.0955 5.8E4 127.0387 4.1E4 129.0543 9.6E3 129.0694 3.6E4 131.0748 3.0E3 131.0850 2.4E5 133.0642 3.2E3 133.0905 3.8E3 133.1006 3.9E5 135.0800 4.7E4 135.1057 1.1E4 135.1163 4.2E5 137.0956 5.5E4 137.1319 2.9E4 139.1110 2.5E4 141.0692 7.6E3 143.0851 4.9E4 145.0493 2.4E3 145.0889 3.6E3 145.1006 2.5E5 147.0803 1.3E4 147.1163 2.5E5 149.0956 1.3E5 149.1200 3.1E3 149.1319 3.4E5 151.1113 4.6E4 151.1477 6.3E3 153.1260 2.9E3 155.0847 1.3E4 155.1059 1.3E4 157.0646 2.3E3 157.1007 7.1E4 159.0816 3.0E3 159.1026 3.0E3 159.1164 3.0E5 160.7279 2.3E3 161.0959 6.5E3 161.1320 1.3E5 162.4591 2.3E3 163.1112 9.9E4 163.1475 6.0E4 165.1271 3.3E4 169.1006 2.0E4 171.1012 8.1E3 171.1164 6.4E4 173.0450 6.9E3 173.1167 7.1E3 173.1320 1.6E5 173.5198 5.0E3 173.5291 1.8E5 173.5414 7.0E4 174.7771 2.7E3 175.1105 1.1E4 175.1479 6.0E4 177.1267 7.9E4 177.1438 2.5E3 177.1638 8.6E3 179.1426 3.0E4 181.1219 2.0E4 183.1163 3.8E4 184.0727 2.3E3 185.1320 5.3E4 187.1120 9.1E3 187.1475 6.6E4 187.9499 2.5E3 189.1122 3.1E3 189.1637 1.6E4 190.6790 2.4E3 191.1430 1.0E4 193.1567 2.6E3 195.1191 5.6E3 195.1374 9.1E4 197.1322 3.1E4 199.1482 3.0E4 201.1258 2.9E3 201.1637 3.2E4 203.1426 1.1E4 205.3760 2.6E3 208.5806 2.4E3 209.1318 2.7E3 211.1479 9.3E3 213.1643 7.7E3 215.1786 5.3E3 215.7406 2.5E3 217.1228 2.6E3 217.1594 4.0E3 219.1380 3.2E3 219.1740 1.7E4 227.1272 2.2E4 228.7699 2.3E3 229.1425 1.5E4 229.1949 2.7E4 235.1694 6.6E3 239.1792 4.5E4 241.1950 4.7E3 243.2101 5.0E4 247.2050 3.0E4 255.1586 7.7E4 257.1894 9.9E4 259.2052 1.1E4 261.2207 1.6E5 267.1587 8.8E3 269.1743 1.7E5 275.2003 2.7E5 277.1497 2.6E3 278.2367 2.5E3 291.1958 8.2E3 292.1987 3.9E3 304.4644 2.4E3 309.2055 1.3E4 314.2397 2.3E3 317.2476 1.4E4 331.2237 3.7E3 335.2579 9.3E5 337.2738 1.7E4 349.2372 6.8E4 360.6524 2.4E3 363.5677 2.3E3 365.3052 1.6E4 367.2501 2.8E3 379.9044 2.3E3 398.6815 2.6E3 433.6630 2.4E3 434.9537 2.4E3 455.0991 2.8E3 489.3567 3.0E3 515.3719 6.1E4 529.3887 2.1E5 550.7359 2.7E3 569.4207 6.2E3 597.1699 2.6E3 609.4522 1.1E4 645.6032 2.7E3 669.8094 2.7E3 END IONS BEGIN IONS FEATURE_ID=769 PEPMASS=829.5073 SCANS=769 RTINSECONDS=947.217 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 6 (0 removed due to low quality, 0 removed due to low cosine). 73.0280 6.0E4 73.7480 2.3E3 79.0538 5.3E4 80.2586 2.6E3 81.0331 3.1E4 81.0694 1.2E5 83.0489 3.8E3 83.0852 1.2E4 85.0279 1.3E5 85.4293 2.2E3 87.0437 6.7E3 91.0385 1.1E5 91.0538 3.2E4 92.1666 1.6E5 92.1711 2.4E4 93.0694 7.3E4 94.1514 2.4E3 95.0485 6.5E3 95.0850 1.2E5 95.8113 2.7E3 97.0279 1.2E5 97.0646 8.9E3 97.1007 2.9E3 98.7878 2.6E3 99.0435 1.8E4 99.0803 2.2E3 101.0228 5.4E4 103.0385 1.9E4 103.7241 2.2E3 105.0695 2.2E4 107.0849 6.1E4 109.0281 3.2E4 109.0643 3.0E3 109.1006 5.7E4 110.8192 2.4E3 111.0802 2.6E3 115.0383 1.3E4 117.0691 1.3E4 119.0850 4.2E4 121.0634 2.3E3 121.1006 7.1E4 123.0804 3.7E3 123.1161 2.1E4 127.0386 6.9E4 129.0537 3.9E3 131.0850 2.1E4 133.1005 4.5E4 135.1164 6.1E4 135.3026 2.3E3 137.0955 4.1E3 145.0493 2.0E4 145.1006 2.8E4 145.8727 2.8E3 147.0811 3.4E3 147.1163 3.3E4 149.1319 3.3E4 149.6718 3.2E3 149.6823 4.8E3 149.6932 5.4E3 157.1008 2.9E3 159.1165 2.9E4 161.1324 1.4E4 163.1476 1.1E4 173.1320 2.3E4 173.5280 1.2E5 173.5455 1.5E4 183.0647 9.6E3 184.0722 2.4E3 184.6671 2.3E3 185.0417 7.8E4 187.1476 5.9E3 203.0524 2.5E4 219.5743 2.3E3 223.3848 2.3E3 224.3772 2.3E3 227.0916 2.6E3 234.0645 2.5E3 234.8920 2.3E3 235.1296 3.2E3 241.0684 8.0E3 243.0835 1.5E5 251.1241 3.5E3 259.0775 5.7E3 261.2208 4.3E4 275.2000 5.7E3 298.0102 3.2E3 301.2160 2.5E3 303.1941 9.8E3 307.5274 2.5E3 333.2035 7.9E5 333.2488 8.2E3 335.2580 1.7E5 336.8306 2.3E3 341.7664 2.5E3 359.5538 2.7E3 363.2519 4.1E3 389.2293 5.7E4 392.5123 2.5E3 413.1755 3.4E3 428.0931 2.5E3 439.1942 1.0E5 453.2095 1.8E5 465.2072 2.8E3 466.9966 2.4E3 469.2030 2.1E4 479.2252 4.3E3 493.2399 1.1E4 497.3110 2.4E4 519.2002 5.0E3 519.2253 1.6E4 519.2928 3.0E6 519.4749 4.9E3 521.3076 2.5E4 549.3397 1.4E4 551.1851 8.0E3 551.2826 1.8E6 551.3812 3.0E3 551.4780 3.7E3 552.2816 3.7E3 552.2941 2.6E3 568.5945 2.7E3 569.3848 3.4E3 591.3207 2.7E3 607.1890 2.6E3 641.5445 2.8E3 649.4444 4.3E4 657.6707 2.8E3 667.4538 1.6E5 717.4179 1.5E5 731.4334 2.1E5 747.4286 3.7E4 757.4444 3.2E3 763.1093 2.9E3 771.4635 1.7E4 829.5065 4.1E6 830.5122 3.4E3 END IONS BEGIN IONS FEATURE_ID=770 PEPMASS=685.2867 SCANS=770 RTINSECONDS=949.836 CHARGE=1+ MSLEVEL=2 MERGED_STATS=7 / 7 (0 removed due to low quality, 0 removed due to low cosine). 68.2426 2.2E3 76.8089 2.4E3 79.3565 2.2E3 81.4219 2.5E3 82.1998 2.3E3 85.1594 2.3E3 85.7182 2.3E3 85.8657 2.5E3 97.8785 2.9E3 101.5865 2.8E3 101.6324 2.3E3 105.4419 2.4E3 106.9284 2.3E3 108.8175 2.5E3 109.6264 2.3E3 115.4255 2.9E3 121.3259 2.6E3 129.0810 2.5E3 130.1757 2.2E3 133.1284 2.5E3 134.3678 2.5E3 135.1511 2.3E3 146.7283 2.4E3 149.0545 2.7E3 149.6785 2.9E3 149.6893 6.5E3 149.6998 2.7E3 150.5961 2.7E3 153.0339 2.5E3 156.9906 2.1E3 158.7510 2.5E3 166.8512 2.3E3 173.5280 9.4E4 173.5395 3.9E4 181.2508 2.4E3 201.0292 3.0E3 203.0307 2.5E3 210.2559 2.6E3 211.6935 2.6E3 214.6929 2.4E3 220.3445 2.3E3 223.4283 2.5E3 224.4972 2.8E3 240.6496 2.2E3 243.9904 2.2E3 245.2283 2.7E3 257.6508 2.8E3 261.2387 2.5E3 267.0532 2.6E3 284.5462 2.4E3 305.4597 2.5E3 306.9187 2.4E3 307.2252 2.4E3 321.2508 2.5E3 333.3622 2.4E3 362.1930 2.6E3 375.1714 2.4E3 410.2089 1.6E4 411.2181 3.3E4 423.2192 3.1E3 424.2237 5.0E3 425.2305 1.4E4 437.2344 7.1E3 452.2103 2.6E3 453.2302 5.5E3 465.2251 7.9E3 466.2349 1.6E4 479.3913 2.7E3 494.2674 2.0E4 495.2748 3.5E3 497.2194 9.3E3 498.2186 3.8E3 507.2365 3.5E3 509.2568 5.7E3 510.2625 9.5E4 511.2695 1.2E5 512.2780 4.3E5 517.2567 6.5E3 521.2531 1.9E4 522.2527 2.7E3 525.2821 3.4E4 526.2912 8.5E4 536.2576 3.1E3 537.2647 4.6E3 537.2801 1.2E4 538.2565 6.6E4 539.2655 1.0E5 540.2400 2.9E3 542.2833 7.5E3 544.2702 2.7E3 553.2807 1.2E5 554.2882 1.5E5 564.2581 3.3E3 567.2554 7.1E3 580.2737 4.3E3 581.2762 1.1E5 582.2819 3.8E3 583.2486 2.7E3 595.2610 2.7E3 598.2785 2.7E4 599.2863 3.0E3 605.2779 7.1E3 613.2996 3.9E4 623.2852 1.1E4 641.2973 3.1E4 642.0474 2.6E3 647.7911 2.7E3 685.4411 1.2E4 END IONS BEGIN IONS FEATURE_ID=771 PEPMASS=234.0974 SCANS=771 RTINSECONDS=950.705 CHARGE=1+ MSLEVEL=2 MERGED_STATS=43 / 43 (0 removed due to low quality, 0 removed due to low cosine). 43.5936 2.1E3 43.6072 2.0E3 43.8978 2.8E3 44.0840 2.3E3 44.3361 2.5E3 44.4058 2.3E3 44.4673 2.2E3 44.9024 2.3E3 45.0333 1.4E6 45.0769 2.5E3 45.3837 2.3E3 46.0234 2.0E3 46.4489 2.4E3 46.4703 2.2E3 46.7762 2.3E3 46.9275 2.6E3 47.3347 2.4E3 47.4555 2.3E3 47.5159 5.2E3 48.0617 2.1E3 49.0390 2.6E3 49.0919 2.3E3 49.2304 4.7E3 49.4819 2.3E3 49.6818 2.5E3 50.0620 2.1E3 50.2725 2.3E3 50.5716 2.2E3 50.6500 2.2E3 50.7952 2.5E3 51.2143 2.3E3 51.5802 2.5E3 51.6271 2.4E3 52.1293 2.1E3 52.1919 2.1E3 53.1111 2.3E3 53.6295 2.1E3 54.0537 2.4E3 54.4973 4.9E3 54.7008 2.4E3 54.7886 2.5E3 56.0380 2.5E3 56.3851 2.2E3 56.7047 2.3E3 56.7137 2.3E3 56.8773 2.4E3 56.9165 2.1E3 56.9289 2.2E3 57.6172 2.3E3 57.6205 2.4E3 58.0645 2.9E3 58.3743 2.1E3 58.7998 2.3E3 59.1142 2.2E3 59.5004 2.4E3 59.7065 2.7E3 60.1683 2.3E3 60.2233 2.1E3 60.3937 2.3E3 61.4006 2.3E3 61.7300 2.2E3 61.7992 2.5E3 61.9618 2.1E3 62.1722 2.1E3 62.4272 2.3E3 62.9868 2.1E3 63.1159 2.2E3 63.4183 2.4E3 63.5365 2.6E3 63.8494 2.4E3 63.9014 2.5E3 64.1286 2.4E3 64.1831 2.3E3 64.3351 2.2E3 64.5350 2.3E3 67.2241 2.5E3 67.6951 2.2E3 68.1597 2.6E3 68.3623 2.1E3 68.7391 2.6E3 68.7484 2.5E3 69.6677 2.3E3 69.7895 3.0E3 69.8049 2.7E3 70.0549 2.4E3 70.0649 1.2E5 70.8422 2.4E3 71.2983 2.2E3 71.3402 2.3E3 71.3757 2.2E3 72.4317 2.9E3 73.0283 1.6E7 73.0343 1.1E4 73.0354 7.7E3 73.1412 2.7E3 74.9049 2.4E3 76.4384 2.3E3 76.9463 2.8E3 77.1401 2.2E3 77.3640 2.1E3 77.4463 2.7E3 77.7208 2.3E3 77.7850 4.7E3 79.5253 2.3E3 79.9870 2.2E3 80.1954 2.2E3 80.7752 2.4E3 80.7893 2.2E3 80.8836 2.6E3 80.9946 2.4E3 81.0693 2.5E3 82.4810 2.4E3 82.7640 2.3E3 83.3239 2.5E3 84.0801 2.8E3 84.7135 2.3E3 85.3845 2.3E3 85.6970 2.3E3 86.2865 2.4E3 88.0759 7.8E3 88.4927 2.2E3 88.9848 2.4E3 89.3371 2.4E3 89.4861 2.1E3 90.4790 2.3E3 91.4344 2.4E3 92.1919 2.4E3 92.6261 2.6E3 93.1286 4.8E3 94.0193 2.4E3 94.4711 2.4E3 94.6436 2.8E3 94.7761 2.2E3 95.4823 2.9E3 96.1026 2.6E3 96.1197 2.5E3 98.1782 2.1E3 98.3090 2.5E3 98.5227 3.6E3 100.6722 3.0E3 101.1248 2.7E3 102.2490 2.7E3 102.6037 2.4E3 102.8788 2.6E3 104.1955 2.6E3 104.4001 2.6E3 104.9883 2.5E3 105.7106 2.2E3 108.1014 2.7E3 108.8741 2.2E3 109.4752 2.5E3 109.7382 2.8E3 109.9128 2.3E3 110.9897 2.8E3 111.9806 2.7E3 113.4673 2.5E3 113.5403 2.4E3 114.0809 2.3E3 114.0912 3.8E4 114.8296 2.6E3 115.4455 2.6E3 116.0620 2.4E3 116.0703 4.8E5 116.1975 2.3E3 116.7623 2.4E3 118.0398 2.4E3 118.5110 2.4E3 119.0279 2.4E3 119.3727 2.2E3 121.0096 2.4E3 122.0748 2.2E3 123.8987 2.6E3 127.1631 2.4E3 128.3111 2.3E3 129.1656 2.3E3 129.4817 2.5E3 130.0755 2.6E3 130.0937 2.7E3 131.8623 2.8E3 131.9176 2.3E3 133.7717 2.5E3 135.2661 2.8E3 135.8010 2.4E3 136.1495 2.5E3 138.8815 2.5E3 139.5480 2.6E3 146.9102 2.3E3 148.0106 3.0E3 149.6695 3.7E3 149.6865 4.4E4 149.6968 7.5E3 150.9615 2.8E3 151.0751 6.4E4 152.0784 1.5E5 153.3762 2.4E3 153.4403 3.3E3 155.8490 2.8E3 155.9152 2.5E3 157.4310 2.4E3 158.0484 3.0E3 160.1083 2.4E3 161.0288 2.9E3 163.1299 2.5E3 163.9007 2.5E3 166.9277 2.8E3 167.0139 2.6E3 169.3932 2.3E3 171.5632 2.9E3 173.5212 6.1E3 173.5232 2.3E5 173.5365 5.8E5 173.5594 5.4E3 174.6743 2.4E3 177.2602 2.2E3 178.5467 2.2E3 180.0951 2.6E3 181.1352 2.9E3 181.7435 2.6E3 181.8094 2.4E3 182.2763 2.2E3 182.5031 3.0E3 186.2472 3.2E3 186.2903 2.5E3 186.4216 2.3E3 187.8069 2.3E3 187.8833 3.0E3 188.0915 3.9E5 188.4407 3.2E3 191.0748 2.4E3 191.1470 2.4E3 191.3901 2.4E3 195.6563 2.3E3 197.6120 2.3E3 198.4651 2.3E3 200.0633 2.7E3 203.8323 2.4E3 205.3594 2.6E3 209.7142 2.3E3 210.4689 2.7E3 213.1956 2.5E3 213.6250 2.4E3 214.3223 2.9E3 214.8626 3.1E3 215.3881 2.3E3 218.3433 2.4E3 218.8001 2.7E3 218.9747 2.3E3 219.4967 2.3E3 221.7699 2.3E3 227.9492 3.1E3 229.3735 2.6E3 231.8981 2.4E3 233.9773 2.9E3 234.2215 5.6E4 238.6894 2.7E3 241.4608 2.5E3 END IONS BEGIN IONS FEATURE_ID=772 PEPMASS=615.2582 SCANS=772 RTINSECONDS=950.728 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 7 (3 removed due to low quality, 0 removed due to low cosine). 67.5215 3.3E3 74.6301 3.2E3 88.2261 4.9E3 89.0592 5.3E4 91.3362 4.0E3 91.5351 3.2E3 100.0811 3.4E3 103.9146 4.0E3 107.1733 4.9E3 113.6381 4.1E3 119.5229 5.1E3 122.9875 3.6E3 128.5595 3.0E3 133.0855 3.0E4 134.8040 4.6E4 134.8160 4.0E4 137.2410 4.4E3 148.5369 5.1E3 168.6604 3.6E3 170.1851 3.7E3 173.5237 7.4E4 173.5420 8.5E4 202.5217 5.1E3 252.9174 4.5E3 269.5602 4.8E3 275.0966 4.3E3 301.0934 3.9E3 348.1919 3.5E3 495.1821 5.5E3 509.1933 1.8E4 510.2026 1.1E6 510.2904 1.4E4 511.2380 1.0E4 512.2289 4.5E3 523.2112 2.5E4 524.1332 7.1E3 524.2184 4.3E5 535.0834 3.7E3 537.2269 3.3E4 538.2333 5.0E4 538.9413 5.0E3 538.9907 2.6E4 539.0486 1.6E5 539.0868 1.4E5 539.2411 2.3E7 539.3952 9.6E4 539.4354 1.6E5 539.4905 3.1E4 539.5452 6.9E3 539.5987 6.6E3 540.2477 3.2E4 542.2187 4.3E3 555.2396 6.1E3 571.2657 2.7E4 583.2314 5.9E3 END IONS BEGIN IONS FEATURE_ID=773 PEPMASS=413.3240 SCANS=773 RTINSECONDS=950.747 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 54.1072 2.4E3 54.3167 2.3E3 58.3698 2.1E3 61.8683 2.1E3 64.6257 2.7E3 66.9646 2.6E3 67.2797 2.1E3 68.5223 2.2E3 70.9928 2.1E3 72.3619 2.5E3 74.7521 2.2E3 76.8791 2.3E3 84.6892 2.8E3 84.8587 2.4E3 118.2784 2.3E3 121.3246 2.6E3 134.3031 2.5E3 148.4318 2.3E3 149.6877 5.3E3 173.5227 4.1E4 173.5417 5.3E4 200.6866 2.3E3 202.8106 2.6E3 208.5774 2.4E3 211.4388 2.4E3 214.6309 2.6E3 238.1476 2.4E3 381.4850 2.9E3 413.3244 9.6E5 423.5662 2.4E3 END IONS BEGIN IONS FEATURE_ID=774 PEPMASS=591.2609 SCANS=774 RTINSECONDS=951.312 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 65.6948 5.4E4 65.6977 1.0E4 71.9076 2.3E3 78.7387 2.9E3 97.3638 2.3E3 105.2960 2.4E3 106.8060 7.2E3 125.8065 5.8E3 125.8156 3.7E3 132.3514 2.4E3 133.0852 2.7E3 173.5293 8.4E4 173.5378 1.8E4 174.1629 2.4E3 213.3500 2.3E3 247.0325 2.2E3 420.2318 8.9E3 429.2075 2.7E3 430.2187 7.2E3 433.2375 2.7E3 444.2314 2.6E4 445.2381 1.6E4 447.2584 8.7E3 457.2373 2.8E4 458.2105 6.7E3 458.2479 1.3E4 459.1581 2.6E4 459.2186 2.3E6 460.2267 4.3E4 460.2659 1.4E4 461.2343 1.2E4 469.2386 5.1E3 472.2269 4.8E4 473.2320 3.1E4 474.2405 5.3E4 475.2165 3.6E4 475.2468 2.6E4 476.2229 6.7E4 477.2304 1.7E4 485.2340 2.6E5 486.2070 4.8E4 487.2492 2.8E5 488.2245 7.5E4 489.2282 6.0E4 490.2360 1.4E4 491.2451 3.6E4 492.2533 1.3E4 496.4760 2.8E3 497.2329 9.1E3 499.2144 8.5E3 500.2209 2.2E4 501.2294 8.9E3 502.2392 1.1E4 503.0725 7.5E3 503.2445 2.9E6 504.2505 1.3E5 505.2258 3.8E3 513.2286 4.2E4 515.1567 5.2E3 515.2446 2.8E5 517.2271 1.6E4 518.2334 4.4E4 519.2429 1.3E5 521.2159 2.7E3 531.2393 1.6E6 531.4279 4.6E3 532.2472 1.8E5 533.2543 9.8E4 535.2370 4.2E4 541.2232 3.9E4 547.2711 3.6E4 549.2521 1.2E4 559.2349 2.4E5 563.2636 4.0E4 577.2424 9.6E3 591.2609 1.5E6 591.4323 9.4E3 592.2692 4.3E4 593.2835 3.1E3 END IONS BEGIN IONS FEATURE_ID=775 PEPMASS=592.2685 SCANS=775 RTINSECONDS=951.354 CHARGE=1+ MSLEVEL=2 MERGED_STATS=1 / 5 (4 removed due to low quality, 0 removed due to low cosine). 64.1365 3.8E4 64.1397 3.4E4 65.8050 9.9E4 65.8094 9.9E4 81.3716 2.1E4 99.4788 2.1E4 105.3635 1.9E4 132.7303 2.6E4 133.3090 2.4E4 133.3181 3.0E4 134.4323 2.3E4 151.7208 2.4E4 163.2912 1.9E4 173.5186 4.8E4 173.5372 2.1E5 213.8565 2.3E4 358.1572 2.5E4 360.1721 3.7E4 373.1780 6.0E4 386.1865 4.0E4 388.2009 7.7E4 431.1858 3.1E4 432.2324 7.2E4 433.2385 2.0E5 434.2475 6.7E4 444.1931 4.0E4 445.2033 8.1E4 446.2121 9.5E4 447.2529 3.6E4 448.2690 2.2E4 449.2316 5.0E4 458.2152 2.2E4 459.0681 6.7E4 459.2182 1.0E7 460.2255 2.5E6 461.2339 8.9E5 461.3031 3.9E4 473.2336 3.0E5 474.2408 4.6E4 475.2473 3.3E4 476.2577 8.3E4 477.2284 6.8E4 478.2341 3.0E4 486.2420 1.2E5 487.2483 4.3E5 488.2446 9.0E4 489.2253 7.0E4 491.2442 8.5E5 492.2522 9.6E5 501.2280 1.1E5 503.2350 4.7E4 504.2476 4.7E5 505.2259 9.0E5 506.2680 1.9E5 514.2358 3.9E4 515.2476 3.3E4 516.2520 8.9E4 517.1345 3.8E4 517.2233 8.4E5 518.2339 8.8E4 519.2397 2.4E6 520.2474 3.0E5 521.2540 1.3E5 531.2407 3.4E4 532.2463 1.2E6 533.0635 8.6E4 533.2548 1.2E7 543.2401 2.8E4 545.2213 3.9E4 547.2719 4.2E4 548.2791 9.3E4 549.2494 5.7E5 550.2594 3.4E4 559.2352 2.7E4 560.2419 6.9E5 562.2214 2.6E5 563.2310 1.5E5 564.2657 2.0E5 574.2552 3.7E4 575.2683 3.6E4 577.2452 1.4E6 591.2612 5.7E4 592.2684 5.2E6 593.2762 7.0E5 END IONS BEGIN IONS FEATURE_ID=776 PEPMASS=593.2761 SCANS=776 RTINSECONDS=951.378 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 7 (4 removed due to low quality, 0 removed due to low cosine). 64.2399 2.2E5 65.9167 4.4E6 65.9198 2.6E7 69.0438 2.7E5 85.2441 2.2E5 92.7388 1.8E5 107.0285 2.5E5 109.8029 1.6E5 125.1009 2.1E5 133.3086 8.3E5 133.3185 5.9E5 140.3841 2.4E5 143.6221 2.0E5 148.3115 1.0E6 148.3255 1.0E6 173.5240 2.6E6 173.5373 3.6E6 173.5438 1.0E6 201.6268 2.8E5 207.0597 2.6E5 226.5033 2.1E5 230.2695 2.3E5 289.2507 2.4E5 298.4194 2.3E5 393.2070 2.8E5 419.2232 4.6E5 431.1862 5.4E6 432.1889 7.0E5 433.2384 4.9E6 434.2453 1.8E6 445.2023 3.0E6 446.2093 3.3E6 447.2174 8.6E6 449.2306 2.9E5 459.2178 8.9E6 460.2239 3.6E7 461.2325 2.4E7 462.2401 2.9E6 473.2330 7.8E6 474.2412 1.6E6 476.2577 3.2E6 477.2301 1.3E6 477.2462 1.6E5 478.2383 2.8E5 487.2475 5.2E6 488.2439 7.5E5 489.2600 2.2E6 491.2089 5.0E5 491.2426 1.5E6 492.2503 9.7E6 493.2578 2.3E6 503.2430 7.9E5 504.2143 6.8E5 505.2240 1.9E7 506.2242 1.9E5 515.2438 3.5E6 517.2540 7.6E5 518.2291 3.4E6 519.2392 3.3E6 520.2438 5.7E6 533.0663 4.7E5 533.2539 3.3E8 533.4006 8.0E5 533.4387 1.3E6 534.2578 1.5E7 547.2698 4.3E6 549.2362 2.5E5 549.2504 1.9E5 550.2544 1.5E6 551.2643 1.5E6 561.2487 8.0E6 563.2281 4.0E5 564.2367 1.4E7 565.2793 1.5E7 575.2651 7.5E6 578.2494 5.4E6 592.9285 4.1E5 592.9885 6.5E5 593.0519 4.6E6 593.0969 3.6E6 593.2749 7.5E8 593.4497 3.8E6 593.4985 5.3E6 593.5625 1.4E6 594.2779 7.0E5 END IONS BEGIN IONS FEATURE_ID=777 PEPMASS=501.3762 SCANS=777 RTINSECONDS=951.524 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 59.6915 2.2E3 70.0432 2.2E3 70.0608 2.2E3 77.2015 2.2E3 83.0591 2.5E3 85.2982 2.3E3 100.8441 2.4E3 111.4132 2.5E3 141.7552 2.3E3 148.5643 2.3E3 173.5252 4.5E4 173.5430 1.8E4 183.3521 3.2E3 231.6503 2.9E3 270.8022 2.5E3 290.0879 2.4E3 291.0823 2.6E3 304.6770 3.0E3 305.1568 3.2E3 338.2215 2.6E3 501.2872 1.2E4 501.3761 1.4E6 END IONS BEGIN IONS FEATURE_ID=778 PEPMASS=578.2533 SCANS=778 RTINSECONDS=951.524 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 73.8219 2.5E3 75.5637 2.4E3 82.5382 2.2E3 83.4738 2.5E3 85.8224 2.3E3 87.4384 2.8E3 88.4300 2.8E3 89.3932 2.1E3 92.5040 2.5E3 101.6191 2.2E3 110.6565 2.3E3 129.2876 2.6E3 143.8690 2.5E3 149.6817 5.6E3 149.6932 5.5E3 160.4792 2.2E3 173.5317 6.1E4 173.9039 2.2E3 236.7776 2.4E3 259.7413 2.4E3 269.0890 2.6E3 296.2509 2.5E3 346.0334 2.7E3 397.8845 2.5E3 500.8141 2.4E3 END IONS BEGIN IONS FEATURE_ID=779 PEPMASS=625.2653 SCANS=779 RTINSECONDS=951.525 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 65.9148 6.5E3 65.9169 3.6E3 67.5947 2.3E3 77.8735 2.4E3 83.6681 2.5E3 84.3653 2.5E3 86.6204 2.4E3 100.6792 2.3E3 103.6446 2.2E3 107.8302 2.7E3 120.4270 3.1E3 124.1910 2.4E3 134.2050 2.4E3 135.8625 2.4E3 154.8921 2.4E3 173.5273 3.2E4 173.5356 4.7E4 173.5576 2.3E3 181.7323 2.9E3 182.3555 2.4E3 203.1153 2.2E3 204.0667 2.6E3 206.2206 2.4E3 210.6753 2.1E3 213.8833 2.7E3 214.9532 3.1E3 220.3722 2.4E3 223.9444 2.5E3 225.1374 7.4E3 239.1541 1.3E4 247.0663 2.7E3 253.1327 1.2E4 263.9424 2.4E3 265.1306 3.7E3 267.1491 3.9E3 269.1288 3.0E3 281.1326 3.0E3 301.8343 2.4E3 308.1744 3.9E3 380.1804 2.6E3 386.1851 2.9E3 420.2315 8.0E4 422.6134 2.8E3 430.1760 4.4E3 433.1324 2.6E3 434.2470 9.3E3 447.2153 1.1E4 448.2251 1.8E4 449.2356 1.5E4 452.2210 2.0E4 454.1765 4.3E3 458.1713 1.2E4 459.2195 2.0E4 460.2246 3.9E4 461.2141 2.7E3 462.2038 1.7E4 463.2065 1.3E4 465.2276 2.4E4 473.1920 3.3E3 474.2068 2.7E3 475.2136 6.4E4 476.2215 2.8E4 477.2283 1.3E5 479.2472 4.4E3 489.2282 2.2E4 490.1978 1.2E4 491.1951 9.7E3 491.2493 1.4E4 492.2495 3.3E4 493.2593 1.9E4 501.2263 9.1E3 501.2358 3.3E3 503.2366 4.1E4 504.2323 4.4E3 505.2207 4.6E4 506.2224 8.0E3 507.2371 3.0E4 509.2185 2.9E3 515.2046 4.4E3 517.2235 2.3E4 518.2292 1.5E4 518.2391 2.9E3 519.2388 4.0E5 519.3292 2.8E3 520.2122 1.3E4 520.2242 7.5E3 521.2241 9.9E4 522.2252 2.1E4 523.2301 2.4E4 524.2325 2.8E3 529.2217 1.4E4 531.2385 2.5E4 532.2409 3.0E4 533.2187 8.7E4 534.2260 3.1E4 535.1389 4.0E3 535.2339 4.0E5 536.2418 3.9E4 537.2494 5.1E4 538.2588 8.0E3 547.2337 1.7E5 548.2388 3.0E4 549.2499 1.9E5 550.2203 1.7E4 551.2246 2.0E4 561.2173 8.8E3 563.1878 4.2E3 563.2701 1.3E4 565.2452 1.1E5 573.4300 2.6E3 575.2277 8.1E4 578.2132 1.6E4 579.2373 1.5E4 580.2586 1.2E4 581.2720 3.6E3 582.2402 3.8E3 592.2692 3.2E3 593.2395 3.4E5 597.2729 2.3E4 607.2542 6.9E4 608.2628 3.1E4 625.2685 2.8E4 633.6635 2.5E3 END IONS BEGIN IONS FEATURE_ID=780 PEPMASS=637.2655 SCANS=780 RTINSECONDS=951.525 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 65.3227 2.7E3 65.6970 5.4E3 67.6958 9.0E3 81.0697 2.9E3 83.0849 2.6E3 95.0851 2.2E3 122.2129 2.5E3 149.6798 2.8E3 149.6899 1.1E4 149.6999 3.0E3 152.4704 2.6E3 173.5326 3.2E4 181.0462 2.4E3 181.0852 2.6E3 185.1998 2.8E3 231.2725 2.7E3 239.1546 6.6E3 284.5981 2.4E3 323.1042 2.5E3 457.2364 3.0E3 459.1590 2.6E3 459.2182 6.3E5 460.2267 3.8E3 473.2319 6.8E3 474.2421 6.9E3 475.2141 2.2E4 476.2216 2.4E4 477.2296 2.2E4 480.3864 2.8E3 485.2337 8.2E4 486.2065 2.0E4 487.2483 6.1E4 488.2194 7.0E3 488.2357 3.3E3 489.2268 1.5E4 490.2380 2.9E3 491.2452 1.1E4 496.4073 1.7E4 497.2367 3.3E3 500.2230 6.5E3 503.2441 7.6E5 504.2479 3.1E4 505.2414 3.2E3 506.2279 1.9E4 507.2369 6.7E3 513.2278 1.4E4 515.2444 1.2E5 518.2291 1.7E4 519.2463 3.2E4 520.2433 3.4E3 521.2478 2.4E4 531.1468 5.5E3 531.2390 3.9E5 532.2463 3.5E4 533.2531 3.4E4 534.1412 2.7E3 534.2236 2.7E4 535.2352 2.1E4 536.2416 8.7E3 541.2244 2.4E4 547.2714 1.9E4 548.2403 3.8E3 549.2499 1.8E5 550.2554 2.1E4 559.2349 1.7E5 561.2239 2.0E5 562.2187 1.3E4 563.2628 2.0E4 566.2462 6.3E3 566.6882 3.1E3 567.2647 1.2E4 577.2465 5.6E4 581.2754 1.7E4 591.1536 5.5E3 591.2608 3.0E5 592.2681 4.1E4 593.2739 1.8E4 594.2433 2.9E4 608.2632 1.2E4 609.1079 2.9E3 609.2713 3.0E5 628.4839 2.5E3 637.2668 1.2E5 END IONS BEGIN IONS FEATURE_ID=781 PEPMASS=595.2822 SCANS=781 RTINSECONDS=951.659 CHARGE=1+ MSLEVEL=2 MERGED_STATS=1 / 2 (1 removed due to low quality, 0 removed due to low cosine). 66.1398 3.1E5 66.1443 3.7E5 99.5247 2.8E4 128.5897 2.6E4 148.8148 2.8E4 148.8252 2.8E4 173.5357 2.7E5 222.1614 2.6E4 381.0846 2.8E4 421.2240 2.6E4 432.1874 4.2E4 433.1914 5.1E4 435.2441 8.7E4 447.2113 9.1E4 448.2191 1.1E5 449.2244 1.7E5 459.2187 3.0E4 460.2225 1.6E5 461.2270 3.7E5 462.2319 5.9E5 463.2390 3.8E5 464.2453 5.2E4 474.2346 3.9E4 475.2382 1.4E5 478.2633 6.2E4 487.2461 2.9E4 489.2559 1.3E5 492.2535 3.7E4 493.2484 9.4E4 494.2575 1.8E5 495.2618 4.4E4 506.2247 1.2E5 507.2303 3.7E5 517.2513 8.2E4 520.2363 5.4E4 521.2483 7.0E4 522.2509 9.0E4 533.2540 4.2E5 534.2573 8.4E5 535.2603 7.0E6 536.2634 1.5E5 549.2767 1.0E5 552.2625 5.4E4 553.2747 3.6E4 553.4649 2.8E4 563.2546 1.9E5 565.2350 6.3E4 566.2432 3.1E5 567.2866 2.8E5 577.2719 1.8E5 580.2591 9.3E4 595.0591 1.1E5 595.2814 1.7E7 595.4606 7.3E4 595.5071 1.3E5 END IONS BEGIN IONS FEATURE_ID=782 PEPMASS=623.2500 SCANS=782 RTINSECONDS=951.907 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 67.5744 2.3E3 67.8524 2.7E3 69.1024 2.2E3 70.4070 2.5E3 73.7704 2.6E3 74.9809 2.9E3 82.5834 2.2E3 96.5570 2.2E3 121.2898 2.2E3 125.7642 2.4E3 134.1648 2.5E3 147.4514 2.7E3 173.5280 5.6E4 173.5413 1.6E4 197.2913 2.7E3 198.7820 2.5E3 200.1799 2.3E3 214.0880 2.4E3 253.1341 3.9E3 255.4918 2.8E3 264.1485 8.2E3 276.1504 1.7E4 307.1096 2.6E3 345.5237 2.3E3 383.1893 1.1E4 398.1843 5.9E3 426.1818 2.9E3 447.2169 2.7E3 459.2159 2.8E3 461.1980 6.6E4 462.2033 1.2E4 463.2124 2.9E4 474.1612 2.9E3 474.1710 3.7E3 475.2144 1.3E4 477.2298 5.6E3 488.1870 8.4E3 489.1928 1.8E5 490.1982 8.6E3 495.2325 2.9E3 501.2299 3.0E3 501.8893 2.7E3 503.2082 6.7E4 505.2240 3.6E4 507.2009 3.5E3 516.1798 1.2E4 517.2253 1.7E4 518.1923 5.9E3 519.2284 1.4E4 520.2047 3.7E3 521.2174 4.5E4 523.2326 2.2E4 529.2266 3.5E3 531.2124 1.8E5 532.2079 3.2E3 533.1820 6.9E3 534.1886 1.5E4 535.2322 1.8E4 543.1603 3.2E3 545.2179 3.4E4 547.2308 1.4E4 548.2053 1.7E4 549.2149 9.3E4 551.1941 1.1E4 558.1886 3.6E3 561.1787 2.0E4 563.2592 1.4E5 566.2163 6.6E3 573.2137 9.5E4 576.2002 1.9E4 577.2450 4.0E3 581.2397 5.1E4 590.2095 3.9E3 590.2247 3.5E3 591.2262 1.2E5 593.2045 1.5E4 595.2562 5.4E3 595.2818 7.1E3 595.2940 2.5E3 605.2390 1.4E4 608.2405 3.3E3 623.2831 8.9E4 END IONS BEGIN IONS FEATURE_ID=783 PEPMASS=497.4244 SCANS=783 RTINSECONDS=952.045 CHARGE=1+ MSLEVEL=2 MERGED_STATS=1 / 1 (0 removed due to low quality, 0 removed due to low cosine). 65.4131 2.1E3 70.2722 2.2E3 87.0439 2.7E3 89.0535 5.2E3 89.0593 1.2E5 90.0628 2.0E4 95.5473 2.6E3 114.3080 2.4E3 114.7369 2.4E3 133.0856 6.5E4 134.0891 1.6E4 143.2634 2.3E3 173.5202 1.1E4 173.5391 2.8E4 177.1123 4.8E3 178.1174 3.3E3 197.0791 2.3E3 204.7163 2.2E3 211.0822 2.8E3 231.4864 2.5E3 282.9391 2.5E3 283.1761 5.0E3 497.3945 5.2E3 END IONS BEGIN IONS FEATURE_ID=784 PEPMASS=609.2704 SCANS=784 RTINSECONDS=952.119 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 64.1362 2.6E3 67.6946 2.6E3 67.6969 1.8E4 73.1962 2.2E3 74.6638 3.0E3 91.6817 2.2E3 99.4273 2.3E3 107.0852 2.5E3 108.1346 2.8E3 115.0622 2.4E3 118.7830 2.8E3 119.1282 2.6E3 149.6839 1.1E4 149.6946 8.2E3 149.7056 6.8E3 173.5226 8.8E3 173.5323 5.3E3 173.5362 3.7E4 284.3261 2.4E3 292.1808 1.9E4 305.0201 2.8E3 309.5731 2.6E3 337.2962 2.4E3 421.2393 5.4E3 433.2406 6.9E3 449.2295 6.4E3 459.2184 7.4E4 460.2258 1.8E4 461.2362 7.3E3 462.2057 3.0E3 463.2136 1.6E5 465.2382 2.8E3 473.2318 2.7E3 475.2140 3.1E4 476.2151 4.3E4 477.2301 4.8E4 480.2510 2.5E4 481.2613 3.6E4 485.2333 6.2E4 486.2037 9.5E3 487.2491 2.0E4 489.2257 1.1E4 490.2274 3.7E3 491.2452 3.3E4 492.2514 2.5E4 499.2114 7.0E3 500.2197 3.1E3 503.2436 1.1E5 504.2147 3.0E3 504.2331 8.7E3 505.2553 2.1E4 506.2250 1.1E4 507.2371 7.5E3 508.2402 1.2E4 509.2539 2.3E4 513.2266 6.8E3 515.2440 1.1E5 517.2234 2.8E4 518.2307 2.2E4 519.2449 3.4E3 519.2565 2.5E3 520.2128 2.7E3 520.2403 3.0E3 521.2494 5.5E4 522.2578 4.0E3 531.1461 9.1E3 531.2392 3.8E5 532.2467 1.9E4 533.2544 2.1E5 534.2230 3.8E4 535.2346 2.6E5 536.2421 1.6E5 541.2234 2.1E4 547.1953 4.5E3 548.2394 1.4E4 549.2496 2.6E5 550.2578 1.0E5 559.2347 1.7E5 562.2185 3.2E4 563.2659 2.3E4 565.2809 5.2E4 566.2504 1.2E4 569.0058 2.6E3 577.2448 2.1E5 579.2208 3.1E3 580.2299 3.4E3 581.2712 1.9E4 591.2607 2.7E5 594.2451 5.8E4 609.2710 4.5E5 END IONS BEGIN IONS FEATURE_ID=785 PEPMASS=607.2552 SCANS=785 RTINSECONDS=952.311 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 2 (0 removed due to low quality, 0 removed due to low cosine). 65.4047 2.3E3 67.5244 2.2E3 72.3930 2.6E3 107.2053 2.6E3 111.3005 2.3E3 173.5205 1.4E4 173.5383 5.0E4 222.5515 2.5E3 237.1385 3.4E3 251.1214 3.4E3 328.3976 2.5E3 355.9943 2.2E3 380.8912 2.3E3 436.7724 2.4E3 446.2091 2.6E3 447.2190 3.9E3 454.1742 1.1E4 458.2139 2.9E3 459.2282 2.5E3 461.2332 2.8E3 473.2322 4.2E3 474.2025 7.8E3 475.2153 4.7E3 475.2308 2.5E3 485.1931 3.1E3 487.2084 6.8E3 488.2215 3.8E3 489.2234 7.4E3 491.2057 4.6E3 501.2269 1.8E4 502.2029 7.5E3 503.2443 2.7E4 504.2184 2.9E3 505.2195 8.2E3 515.2080 6.5E3 516.2183 2.8E3 519.2371 2.7E4 529.2231 1.7E4 531.2390 1.6E4 532.2118 2.8E3 533.2165 4.0E3 534.2288 1.1E4 537.0652 2.7E3 547.2343 1.4E5 548.2416 4.1E4 557.2191 8.4E3 563.2626 3.4E3 575.2296 3.9E4 579.2610 1.5E4 589.2427 3.7E3 607.2556 7.7E4 607.4212 2.9E3 END IONS BEGIN IONS FEATURE_ID=786 PEPMASS=457.3502 SCANS=786 RTINSECONDS=952.597 CHARGE=1+ MSLEVEL=2 MERGED_STATS=7 / 7 (0 removed due to low quality, 0 removed due to low cosine). 56.6645 2.6E3 56.7749 2.4E3 57.3326 2.3E3 57.5543 2.4E3 58.1712 2.1E3 58.5091 2.3E3 62.0315 2.3E3 62.8535 2.2E3 63.1053 2.4E3 70.2726 2.2E3 73.6565 2.3E3 75.1079 2.3E3 75.2746 2.4E3 75.7350 2.2E3 76.0191 2.4E3 77.6431 2.2E3 77.7481 2.6E3 78.0257 2.6E3 78.9745 2.3E3 79.3041 2.3E3 88.4340 2.3E3 91.0660 2.3E3 92.2829 2.5E3 94.1445 2.4E3 95.6813 2.6E3 96.2724 2.1E3 99.1671 2.4E3 99.6224 2.3E3 103.1683 2.3E3 113.2175 2.5E3 139.2465 3.1E3 141.8824 2.2E3 145.8263 2.3E3 148.4690 2.7E3 149.6702 2.9E3 149.6810 4.5E3 149.6908 1.1E4 151.5893 2.5E3 165.7539 3.1E3 173.5231 3.1E4 173.5318 2.6E4 173.5402 5.6E4 181.6564 2.8E3 186.5734 2.5E3 187.5005 2.3E3 261.1302 1.3E4 282.0934 2.5E3 284.5290 2.8E3 291.9035 2.6E3 295.8712 3.0E3 338.6106 2.9E3 388.8661 2.6E3 390.4782 2.4E3 453.3900 2.6E3 457.2736 1.9E4 457.3500 2.4E6 END IONS BEGIN IONS FEATURE_ID=787 PEPMASS=453.3983 SCANS=787 RTINSECONDS=953.133 CHARGE=1+ MSLEVEL=2 MERGED_STATS=1 / 1 (0 removed due to low quality, 0 removed due to low cosine). 57.0697 3.6E3 59.6754 2.8E3 67.6426 2.5E3 71.0853 3.0E3 87.0437 3.9E3 89.0592 1.8E5 89.0655 3.8E3 90.0577 2.7E3 90.0626 3.8E4 103.5073 2.6E3 104.4422 2.2E3 107.0702 3.8E3 133.0854 8.1E4 134.0890 2.4E4 151.0961 5.5E3 173.5203 3.8E3 173.5385 1.5E4 177.1117 8.0E3 195.1226 4.9E3 196.1248 3.2E3 239.1485 1.1E4 240.1521 6.4E3 319.2003 2.5E3 347.3362 2.3E3 END IONS BEGIN IONS FEATURE_ID=788 PEPMASS=759.5730 SCANS=788 RTINSECONDS=954.215 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 3 (1 removed due to low quality, 0 removed due to low cosine). 71.0728 4.2E3 86.0961 1.9E5 86.1025 4.3E3 87.0994 2.5E4 95.0851 2.6E3 98.9839 8.4E3 104.1066 1.8E4 124.9995 9.2E4 126.0026 2.7E3 135.9316 2.5E3 144.9270 2.6E3 153.4008 2.4E3 173.5249 1.8E4 173.5396 2.3E4 180.2381 2.3E3 184.0352 9.2E3 184.0733 2.1E6 184.1030 5.3E3 184.1121 9.8E3 185.0505 2.6E3 185.0766 2.9E5 245.7511 2.5E3 312.9821 2.3E3 416.5186 2.5E3 431.5018 2.4E3 759.4279 2.8E3 END IONS BEGIN IONS FEATURE_ID=789 PEPMASS=758.5695 SCANS=789 RTINSECONDS=954.32 CHARGE=1+ MSLEVEL=2 MERGED_STATS=33 / 33 (0 removed due to low quality, 0 removed due to low cosine). 70.7941 2.2E3 70.9921 2.2E3 71.0726 1.9E5 71.8643 2.3E3 72.6590 2.6E3 72.8933 2.4E3 72.9080 4.6E3 73.0465 1.5E4 75.5635 2.3E3 75.5719 2.3E3 75.6984 2.3E3 76.2334 4.4E3 76.6828 2.3E3 76.7043 2.5E3 77.2408 2.2E3 77.6998 2.6E3 77.7398 2.7E3 77.7538 2.7E3 79.2652 2.2E3 79.7970 2.4E3 80.8623 2.4E3 81.0698 5.0E3 81.1035 2.2E3 81.3055 3.6E3 81.4327 2.5E3 81.4940 2.6E3 81.5289 4.5E3 84.3240 2.4E3 84.8248 2.1E3 85.7006 2.4E3 86.0960 3.9E6 86.1023 3.7E3 89.6351 2.2E3 91.0569 1.4E4 91.2906 2.4E3 91.8669 2.3E3 92.6688 2.4E3 94.5236 2.7E3 95.0732 2.5E3 95.0853 9.1E3 96.3730 2.3E3 96.6262 2.2E3 97.6419 2.6E3 97.8722 2.4E3 98.4669 2.4E3 98.7162 2.3E3 98.9839 1.8E5 100.2240 4.4E3 100.5240 2.1E3 100.9746 2.4E3 101.0596 2.3E3 102.0075 2.4E3 102.6227 2.4E3 104.0074 2.6E3 104.1066 4.0E5 108.8944 2.3E3 109.9063 2.5E3 111.0485 2.4E3 112.4777 2.4E3 113.1067 2.3E3 113.2161 2.7E3 113.3916 2.8E3 116.3460 2.6E3 116.3916 2.5E3 117.6850 2.5E3 118.5122 2.5E3 119.1391 2.2E3 120.6973 2.8E3 123.4145 2.7E3 124.2269 2.6E3 124.3044 3.1E3 124.9897 2.2E4 124.9995 1.8E6 125.0103 1.4E4 125.1987 2.5E3 125.3793 2.1E3 126.7447 2.6E3 126.8694 2.2E3 132.7459 2.7E3 138.3851 2.1E3 140.3654 2.3E3 142.6834 2.5E3 145.9642 2.7E3 147.2624 2.1E3 149.0103 2.4E3 149.0449 1.2E4 149.6883 5.0E3 150.3425 2.2E3 151.3696 2.5E3 152.3595 2.3E3 153.1212 2.5E3 154.6342 2.3E3 155.5982 3.4E3 156.4575 2.3E3 157.5243 2.4E3 157.7558 2.5E3 158.5651 2.4E3 160.4346 2.4E3 160.6052 2.2E3 160.8972 2.3E3 163.6245 2.6E3 165.4177 2.5E3 166.0264 2.3E3 167.0553 8.4E3 171.3790 2.3E3 172.1232 2.3E3 173.5241 3.7E5 173.5383 5.6E5 173.9842 2.5E3 175.1709 2.2E3 176.7903 2.6E3 180.0883 2.4E3 181.9297 2.9E3 183.9487 2.3E3 184.0136 7.3E3 184.0240 6.4E3 184.0350 2.4E5 184.0425 1.9E4 184.0732 4.1E7 184.1031 1.0E5 184.1121 1.8E5 184.1230 3.5E4 184.1450 9.9E3 184.7319 2.4E3 185.0767 1.4E5 185.1197 2.5E3 186.0776 3.5E4 190.0332 2.4E3 191.5498 2.2E3 192.8828 2.4E3 194.2270 2.4E3 195.5092 2.8E3 196.1825 2.6E3 197.3054 2.4E3 198.9149 2.5E3 199.5731 2.5E3 200.1978 2.6E3 200.5831 2.5E3 201.0338 2.3E3 202.1187 2.5E3 203.8069 2.3E3 206.5892 2.7E3 206.6091 2.3E3 211.4036 2.5E3 212.7793 2.2E3 215.1229 2.5E3 215.3143 2.6E3 216.4641 2.3E3 218.8786 2.4E3 219.2489 2.8E3 219.4895 2.9E3 220.1756 2.1E3 221.0200 2.7E3 223.5563 2.3E3 225.0432 9.9E3 225.1216 2.3E3 230.6530 2.4E3 236.6143 2.7E3 239.0959 9.4E3 239.5944 2.7E3 242.4921 2.4E3 246.1961 2.8E3 247.6134 2.4E3 249.5196 2.3E3 251.4678 2.4E3 252.7056 2.4E3 254.5832 2.4E3 255.0598 2.7E3 258.0122 3.1E3 268.0721 2.4E3 270.5685 2.6E3 281.0848 2.6E3 282.4843 2.7E3 284.3668 2.5E3 285.0092 2.6E3 287.1337 2.7E3 288.8817 2.3E3 299.0625 5.3E4 300.6722 2.4E3 301.8999 2.8E3 308.3896 2.6E3 312.4662 2.2E3 312.4890 2.6E3 313.7160 2.6E3 316.6418 3.0E3 317.8825 2.4E3 318.2357 2.5E3 339.8500 2.5E3 340.2777 2.5E3 344.9734 5.4E3 349.7533 2.5E3 351.3725 2.3E3 351.8616 2.7E3 352.3801 2.8E3 353.2968 2.6E3 355.0708 5.5E3 359.0292 2.9E4 378.9215 2.6E3 400.1996 3.1E3 401.6791 2.3E3 402.0132 2.5E3 414.8456 2.7E3 418.4522 2.9E3 418.8665 2.8E3 424.1663 2.4E3 431.6930 2.5E3 436.7520 2.7E3 443.0634 3.0E3 445.9784 2.5E3 446.3630 2.4E3 454.5396 2.7E3 458.0302 2.8E3 475.2258 2.4E3 475.5357 2.6E3 478.3284 1.7E4 480.1482 2.9E3 489.0585 2.7E3 494.7827 2.4E3 496.3422 2.5E3 498.2758 2.5E3 502.3335 3.2E3 518.4486 2.6E3 527.5348 2.4E3 530.0026 2.5E3 530.4404 3.1E3 540.9172 2.9E3 548.5548 2.7E3 552.8876 2.9E3 553.3553 2.5E3 572.0468 2.6E3 585.3878 2.7E3 588.6595 3.0E3 597.2927 2.9E3 608.7272 3.1E3 647.7231 2.5E3 651.3852 2.4E3 652.3825 3.2E3 671.1947 3.2E3 674.2781 2.3E3 680.7303 2.7E3 714.9096 5.6E3 720.7181 2.4E3 737.5146 2.5E3 757.9864 2.7E3 758.7286 2.5E3 761.2037 2.6E3 767.3091 2.8E3 END IONS BEGIN IONS FEATURE_ID=790 PEPMASS=716.5224 SCANS=790 RTINSECONDS=954.758 CHARGE=1+ MSLEVEL=2 MERGED_STATS=31 / 31 (0 removed due to low quality, 0 removed due to low cosine). 67.9986 2.4E3 68.1433 2.3E3 68.2164 2.3E3 68.7648 2.3E3 68.8720 2.6E3 69.0360 2.3E3 69.0695 3.0E5 69.7729 2.6E3 70.6219 2.2E3 70.6424 2.3E3 71.0012 2.3E3 71.0486 2.3E3 71.0852 4.8E5 71.1285 2.2E3 72.7835 2.3E3 73.0281 1.1E5 73.0646 5.2E3 74.5569 2.6E3 74.7187 2.5E3 75.0807 2.3E3 75.3690 2.5E3 76.1862 2.5E3 78.0078 2.1E3 78.9707 2.4E3 79.0539 1.6E5 79.8508 2.6E3 80.0831 2.2E3 80.0993 2.1E3 80.4092 2.4E3 80.4768 2.1E3 81.0153 2.6E3 81.0695 1.2E6 81.3691 2.2E3 82.0835 2.7E3 83.0852 4.9E5 83.1275 2.2E3 83.2642 2.2E3 83.5727 2.5E3 83.8183 2.0E3 84.3973 2.6E3 85.0641 1.1E4 85.1008 4.0E5 85.1798 2.3E3 86.0383 2.8E3 86.3262 2.3E3 87.0436 4.6E4 87.9632 2.6E3 88.5064 2.3E3 89.0592 4.4E5 90.5394 2.4E3 91.0539 7.0E4 91.2287 2.7E3 91.4628 2.3E3 91.8222 2.0E3 93.0695 2.5E5 93.0905 2.8E3 93.2101 2.2E3 93.3600 2.5E3 93.7127 2.3E3 94.2202 2.1E3 94.7366 2.5E3 95.0082 2.8E3 95.0851 1.3E6 96.1602 2.1E3 96.3188 2.4E3 97.0643 9.1E3 97.1008 2.9E5 97.6326 2.4E3 99.0801 1.1E4 99.7349 2.5E3 100.4336 2.7E3 100.6273 2.6E3 101.9156 2.2E3 102.2977 2.4E3 102.4035 2.3E3 104.2888 2.3E3 105.0116 2.3E3 105.0694 6.5E4 105.5459 2.5E3 105.8063 2.1E3 105.8988 2.4E3 106.4033 2.3E3 107.0851 1.8E5 107.1487 2.4E3 107.5417 2.8E3 108.0108 2.4E3 108.3286 2.8E3 108.8434 2.3E3 109.1008 6.8E5 110.6985 2.4E3 110.7728 2.4E3 111.0798 1.1E4 111.1165 5.5E4 111.9369 2.5E3 113.0951 2.4E3 113.8308 2.5E3 114.2567 2.2E3 116.5805 2.5E3 117.3544 2.8E3 119.0851 7.3E4 120.3883 2.8E3 121.1008 2.3E5 121.1821 2.3E3 122.2213 2.2E3 123.1164 4.4E5 124.4530 2.4E3 125.0956 2.9E3 125.1321 8.8E3 126.4057 2.4E3 126.8982 2.5E3 126.9127 2.5E3 127.1104 2.4E3 129.5272 2.5E3 130.7688 2.2E3 130.8589 2.3E3 131.0701 5.6E3 132.8890 2.7E3 133.0854 1.9E5 133.1009 1.1E5 135.0990 2.7E3 135.1165 1.5E5 137.1321 1.8E5 138.3481 2.5E3 138.9494 2.5E3 139.3550 2.1E3 143.0677 2.6E3 143.8676 2.1E3 143.8870 2.8E3 146.0079 2.3E3 147.1164 9.1E4 148.5191 2.9E3 149.1320 6.5E4 149.6879 3.7E4 149.6974 3.2E3 149.8968 2.5E3 150.7867 2.7E3 151.1477 4.7E4 151.7819 2.2E3 153.1265 1.7E4 153.1869 2.7E3 155.0099 8.6E3 156.1038 2.9E3 158.1177 2.6E3 161.1322 7.6E4 162.7343 2.3E3 163.1478 4.7E4 164.0916 2.7E3 164.4752 2.4E3 165.1637 1.1E4 166.1757 2.2E3 167.3941 2.2E3 167.5936 2.2E3 167.7020 2.3E3 168.6940 2.2E3 169.0801 2.3E3 171.2242 2.4E3 171.9465 2.5E3 173.5143 3.2E3 173.5242 1.6E4 173.5298 4.0E5 173.5420 1.2E5 173.5534 3.5E3 175.1480 5.9E4 177.1117 2.0E4 177.1646 2.5E3 180.5535 3.0E3 181.3994 2.6E3 182.1811 2.4E3 183.0400 2.4E3 188.6855 2.4E3 189.1632 2.7E3 189.5597 2.3E3 190.4684 2.6E3 193.9954 2.6E3 194.6079 2.3E3 197.4326 2.4E3 202.0613 2.7E3 203.1788 2.5E3 206.2687 2.5E3 210.5452 2.3E3 210.8956 2.3E3 213.2902 2.4E3 216.1422 2.4E3 217.3170 2.8E3 218.1834 2.7E3 221.2268 1.3E4 222.9127 2.6E3 226.4146 2.3E3 229.6614 2.5E3 232.3888 2.5E3 234.6832 2.6E3 237.9634 2.5E3 238.5622 2.8E3 239.2366 1.7E5 245.2258 1.9E4 249.9818 2.9E3 251.1828 2.3E3 252.6499 2.7E3 259.5567 2.4E3 261.2231 3.0E3 262.2530 1.5E4 262.3032 2.4E3 263.2361 1.4E5 263.2595 5.4E3 264.8881 2.5E3 268.2750 2.6E3 276.7149 2.4E3 280.5891 2.5E3 282.2793 5.1E4 286.3180 2.6E3 290.6279 2.6E3 301.7164 2.6E3 306.2792 2.5E5 307.5021 2.5E3 307.5738 2.6E3 311.5699 2.9E3 313.2740 1.2E5 314.3589 2.5E3 314.3831 2.4E3 314.7646 2.8E3 317.0927 2.3E3 330.0018 2.6E3 332.4828 2.7E3 337.2734 9.4E4 340.8206 2.8E3 356.4203 2.4E3 356.8652 2.8E3 361.5662 2.4E3 365.4274 2.3E3 378.0869 2.6E3 381.6018 2.4E3 387.4032 2.6E3 387.6505 2.9E3 393.3732 2.8E3 393.7509 2.5E3 393.9296 2.5E3 394.3550 2.4E3 401.7914 2.4E3 404.6420 2.5E3 405.3759 2.6E3 406.5590 2.5E3 406.8868 2.8E3 407.0698 2.6E3 412.4703 2.7E3 413.2047 2.5E3 416.5734 2.7E3 422.8932 2.5E3 437.5087 2.3E3 438.4325 2.3E3 439.6970 2.5E3 441.5930 2.4E3 455.6075 2.7E3 463.3105 2.8E3 475.9422 2.6E3 492.1132 2.8E3 493.4934 2.8E3 494.3549 2.3E3 497.3583 2.5E3 503.5542 3.0E3 516.6235 2.7E3 528.4865 2.4E3 536.7540 2.6E3 551.6639 2.7E3 553.2613 2.7E3 554.0922 2.7E3 566.7211 2.7E3 573.4891 7.4E4 575.4055 7.2E3 575.5034 1.2E6 575.6008 3.8E3 582.8725 2.6E3 607.0582 2.8E3 614.0221 2.6E3 641.7460 2.7E3 650.6205 2.5E3 653.3632 3.0E3 658.2759 3.6E3 682.6240 2.7E3 717.6682 2.3E3 END IONS BEGIN IONS FEATURE_ID=791 PEPMASS=827.4916 SCANS=791 RTINSECONDS=957.397 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 73.0281 1.1E4 75.5892 2.5E3 79.0538 1.3E4 81.0694 1.8E4 83.0849 3.4E3 85.0279 2.1E4 91.0385 1.4E4 91.0537 3.2E3 91.9402 5.0E3 91.9441 2.4E4 93.0693 1.5E4 95.0850 1.8E4 97.0279 2.0E4 97.1007 3.0E3 99.0440 2.6E3 100.7638 2.7E3 101.0226 5.4E3 107.0850 1.5E4 109.1005 1.2E4 119.0848 2.4E3 121.1005 1.0E4 125.0953 3.6E3 127.0384 7.2E3 133.1019 2.4E3 141.1751 2.6E3 147.1163 3.4E3 173.5208 1.8E4 173.5344 6.7E4 173.5413 1.5E4 183.0658 2.5E3 185.0419 1.4E4 187.9097 2.7E3 227.1272 7.9E3 243.0835 3.5E4 258.5496 3.1E3 260.8489 2.4E3 261.2214 6.1E3 289.1938 2.4E3 291.1952 1.3E4 331.1878 9.0E4 335.2585 2.6E4 337.2716 2.9E3 338.1385 3.0E3 338.2767 3.2E3 387.2149 8.9E3 490.0255 3.0E3 497.3039 3.5E3 519.2926 5.1E5 519.3810 6.3E3 549.2665 2.7E5 571.0659 2.7E3 656.6649 2.5E3 665.4386 2.6E4 827.3099 5.6E3 827.4902 5.5E5 827.6812 3.5E3 END IONS BEGIN IONS FEATURE_ID=792 PEPMASS=822.5362 SCANS=792 RTINSECONDS=957.602 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 79.0539 1.0E5 81.0331 6.9E3 81.0695 2.0E5 81.3746 2.6E3 82.0312 2.4E3 82.1476 2.2E3 83.0486 3.1E3 83.0852 4.5E4 84.0829 3.0E3 85.0648 2.7E3 91.0539 5.8E4 91.3192 2.2E3 93.0638 3.9E3 93.0695 1.4E5 95.0490 2.6E4 95.0793 3.7E3 95.0852 1.9E5 97.0281 4.2E4 97.0645 1.5E4 97.1008 5.4E4 99.0801 8.3E3 105.0695 6.0E4 107.0490 1.2E4 107.0851 1.3E5 109.0645 2.3E4 109.1008 1.2E5 110.3442 2.4E3 110.3632 2.2E3 111.0804 1.2E4 112.8509 2.7E3 113.9884 2.3E3 117.0695 3.4E4 119.0851 8.6E4 121.0647 3.8E3 121.1008 1.1E5 123.0803 2.1E4 123.1165 3.1E4 124.1286 2.4E3 125.0956 6.0E4 127.0749 2.7E4 129.0697 6.9E3 131.0852 6.1E4 132.9174 2.4E3 133.1009 6.9E4 135.0800 2.4E4 135.1165 8.0E4 137.0959 1.6E4 143.0851 1.5E4 145.1008 5.0E4 147.0800 2.4E4 147.1165 5.4E4 149.0963 1.5E4 149.1323 5.0E4 149.6685 2.6E3 149.6869 7.7E3 151.1116 9.2E3 151.1337 2.3E3 153.0906 6.3E3 154.5570 2.3E3 157.1008 1.7E4 159.1165 3.9E4 161.0962 1.5E4 161.1323 3.2E4 163.1117 1.1E4 163.1472 1.3E4 163.7261 3.0E3 165.0908 1.5E4 165.1278 3.1E3 166.8953 2.3E3 171.1019 1.8E4 171.1168 1.4E4 173.1321 3.4E4 173.5103 3.4E3 173.5265 3.1E4 173.5398 2.5E4 173.5487 4.2E3 175.1113 1.5E4 175.1481 9.9E3 177.1273 1.7E4 181.1214 2.8E3 185.1327 8.9E3 187.1483 1.0E4 189.1115 1.3E4 189.1291 2.7E3 193.1228 1.1E4 195.1382 1.4E4 201.1642 2.9E3 205.1225 1.2E4 223.1327 1.5E5 227.1280 1.1E4 233.6464 2.6E3 243.2108 1.3E4 245.1903 1.2E4 253.1438 4.8E3 255.1730 6.7E3 261.2212 4.4E4 261.2471 2.8E3 263.1997 2.8E3 273.1849 1.2E5 291.1574 5.6E3 291.1955 9.6E5 291.2336 7.7E3 325.8294 2.5E3 335.2172 2.5E3 335.2580 3.9E5 335.2970 2.2E3 365.2322 6.8E4 368.7884 2.6E3 408.2386 2.4E3 420.4617 2.6E3 625.4463 6.2E4 697.8460 2.5E3 822.4528 2.6E3 END IONS BEGIN IONS FEATURE_ID=793 PEPMASS=635.2870 SCANS=793 RTINSECONDS=957.933 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 5 (2 removed due to low quality, 0 removed due to low cosine). 65.4730 2.5E4 67.4742 1.2E5 67.4772 5.3E5 69.2594 2.1E4 70.5844 2.7E5 70.5879 1.3E6 72.8449 2.9E4 101.2571 3.0E4 115.3567 3.2E4 123.1606 3.3E4 126.1559 3.0E4 143.8091 1.9E5 143.8227 2.0E5 149.2585 2.6E4 158.8131 5.7E4 158.8284 3.6E4 173.5214 1.3E5 173.5320 5.9E5 173.5407 2.6E5 174.4133 4.0E4 176.1376 2.8E4 180.3371 3.1E4 188.3798 2.1E4 188.4713 2.8E4 204.0651 4.5E4 221.5264 3.5E4 251.1162 4.1E4 403.1965 2.6E4 404.1939 3.4E4 404.2051 4.0E4 417.1683 1.7E5 419.1275 4.5E4 419.2229 7.7E5 420.2345 4.2E4 431.1828 2.2E5 432.1931 2.0E5 433.1992 2.2E5 442.1744 2.0E5 445.2021 8.8E5 446.2095 1.5E6 447.2172 3.5E6 448.2261 1.9E5 458.2105 4.2E4 458.3954 4.1E4 459.2162 9.7E5 460.1758 4.0E4 460.1866 3.0E4 460.2177 4.8E4 460.2296 5.3E4 461.1968 4.3E5 473.1993 1.7E6 474.2041 3.5E6 475.2123 7.0E6 476.2186 3.0E5 478.2347 2.0E5 486.2070 3.5E4 487.2121 5.5E6 488.2195 4.9E5 489.2285 1.5E5 490.2264 4.4E4 490.2382 3.6E4 491.2107 4.4E5 501.2273 3.4E6 501.2938 3.0E4 502.2311 2.6E5 503.2407 4.0E5 505.2246 2.9E5 506.2320 5.8E5 507.2407 8.1E4 513.2289 4.1E4 515.2069 2.7E5 517.2231 4.1E5 518.2258 7.3E4 519.2379 2.5E6 529.2225 2.4E6 530.2271 9.7E4 531.2387 1.1E6 532.2420 2.0E5 533.2468 6.3E5 534.2266 9.6E5 545.2145 3.2E4 545.2312 3.9E4 546.2371 7.6E4 547.2667 2.1E7 548.2426 4.2E4 548.2753 4.2E4 551.2706 8.8E4 557.2175 1.8E5 560.2409 3.7E5 561.2491 2.3E6 574.2547 9.3E4 575.0513 5.8E5 575.2648 1.0E8 575.4304 4.8E5 575.4795 6.7E5 575.5417 9.9E4 576.2692 1.3E6 578.2536 1.4E5 579.2641 2.3E6 588.2188 4.4E4 589.2447 2.7E6 592.2669 1.3E5 603.2592 2.8E6 606.2646 1.3E5 606.2778 8.0E4 607.2874 1.6E7 617.2751 2.9E5 620.2609 1.5E5 635.2859 3.9E7 635.5303 1.6E5 END IONS BEGIN IONS FEATURE_ID=794 PEPMASS=634.2794 SCANS=794 RTINSECONDS=958.212 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 7 (2 removed due to low quality, 0 removed due to low cosine). 66.0083 2.3E3 66.9165 2.2E4 67.5081 2.6E3 68.8040 3.8E3 70.4734 3.7E3 70.4771 4.6E3 71.9965 2.4E3 83.2552 2.2E3 87.0443 3.1E3 90.0077 2.4E3 96.9574 3.1E3 98.6075 2.3E3 101.7778 2.3E3 103.4436 2.3E3 107.9533 2.3E3 117.9342 2.7E3 118.2944 5.8E3 122.5062 2.4E3 136.4651 2.6E3 139.6413 2.3E3 143.8105 3.2E3 143.8218 3.4E3 159.0050 2.4E3 173.5222 4.3E4 173.5396 9.2E4 193.4095 2.4E3 195.8554 2.4E3 204.0655 1.9E4 204.0971 4.6E3 209.5141 2.4E3 237.1020 2.6E4 238.1083 6.6E3 251.8275 2.7E3 263.1165 9.7E3 296.1538 4.5E3 310.2650 2.2E3 342.1606 3.5E3 354.1571 2.9E3 378.1285 2.7E3 382.1573 1.1E4 391.8062 2.5E3 393.1475 1.3E4 394.1581 3.5E3 394.8525 2.3E3 398.1492 9.9E3 403.1914 2.6E3 405.2094 3.1E3 406.1200 3.1E3 410.1498 1.1E4 412.1289 1.5E4 417.2104 1.7E4 419.2249 1.1E4 421.1412 6.2E3 424.1297 2.5E4 426.1454 2.0E4 430.2135 1.8E4 431.1805 1.5E4 438.1456 7.8E4 439.1544 2.7E3 440.1604 3.1E3 441.1688 2.3E5 441.2317 4.1E3 442.1781 3.3E3 444.1964 2.6E3 445.2031 1.7E5 446.2105 5.4E4 447.2189 1.0E5 448.2238 3.9E3 453.1686 2.2E4 454.1764 1.1E5 455.1857 6.5E3 458.2144 4.0E3 459.2183 4.9E4 460.2228 2.7E3 461.2335 4.0E4 463.2188 3.4E3 472.2247 1.1E4 473.1350 1.4E4 473.1978 2.1E6 474.2063 4.2E5 475.2133 3.9E5 476.2585 4.7E3 477.2289 3.6E3 485.1973 4.3E3 486.2036 1.3E4 487.2129 2.4E5 488.2193 4.2E4 490.1997 1.1E4 491.2063 9.1E3 500.2196 7.1E4 501.1995 3.9E5 502.2356 1.8E5 503.2425 2.1E4 504.2122 3.8E3 505.2250 1.2E5 506.2319 8.3E4 511.2254 3.5E3 512.2223 1.0E4 513.1931 3.9E3 514.1992 4.3E4 515.2087 1.4E5 517.2226 3.1E4 518.2299 3.9E3 519.2163 5.5E4 521.3212 2.9E3 528.2179 2.4E4 529.2234 1.1E5 530.2306 2.6E4 531.2375 8.2E4 532.2131 3.3E3 532.2393 3.4E3 533.1379 1.8E4 533.2198 2.5E6 534.2220 4.9E3 534.2361 2.1E4 545.2315 3.9E4 546.2249 4.4E3 546.2479 5.0E4 547.2465 2.8E5 548.2747 6.2E3 556.2091 2.6E4 557.2358 2.8E3 557.2529 3.9E3 558.2629 6.8E3 559.2349 1.9E5 560.2418 2.9E4 561.2497 5.0E4 563.2603 3.2E4 573.2481 7.1E4 574.2576 6.0E5 575.0568 2.2E4 575.2660 4.1E6 575.3472 4.7E3 576.2467 3.2E3 576.2619 8.0E3 577.2483 8.4E3 579.2646 4.3E3 585.2485 2.7E4 587.2300 4.5E4 588.2380 7.0E3 589.2442 9.4E3 591.2599 1.9E5 601.2452 2.6E4 602.1360 9.9E3 602.2532 7.3E5 602.3643 4.5E3 603.2592 1.6E4 605.2655 5.8E4 606.2740 2.8E4 607.2864 8.5E4 615.2563 3.4E3 616.2674 1.2E4 617.2773 2.8E4 619.2556 2.6E5 619.3665 4.8E3 633.2722 1.6E4 634.2791 3.8E5 634.4604 3.1E4 635.2868 2.0E5 END IONS BEGIN IONS FEATURE_ID=795 PEPMASS=657.2690 SCANS=795 RTINSECONDS=958.301 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 7 (2 removed due to low quality, 0 removed due to low cosine). 66.4833 2.8E3 66.8185 3.0E3 70.6332 2.4E3 71.4522 3.7E3 72.9184 3.3E3 73.0293 1.6E5 73.0322 1.6E4 73.2594 3.3E3 75.9832 3.1E3 76.4532 2.8E3 77.1620 2.2E3 77.4737 2.5E3 78.3045 3.3E3 78.6336 2.8E3 82.0261 2.5E3 87.7355 3.4E3 88.0602 3.4E3 90.3970 2.8E3 94.4505 2.7E3 103.0163 4.6E3 106.2551 2.4E3 119.4118 3.2E3 139.3704 2.8E3 163.0514 2.9E3 164.3244 2.8E3 166.6010 3.0E3 173.5253 1.1E5 173.5441 6.8E4 173.6723 2.4E3 238.6155 2.9E3 245.1155 3.2E3 269.2126 2.9E3 274.6851 2.8E3 311.4817 4.6E3 342.9514 2.4E3 397.7065 2.2E3 449.4338 3.0E3 501.0530 3.1E3 515.4762 3.0E3 517.2548 4.2E3 525.2233 6.2E3 541.1776 3.2E3 552.2107 6.9E3 553.2206 1.6E5 557.2089 3.5E3 559.3325 4.7E3 597.2480 3.4E3 625.2453 3.1E4 642.2252 3.1E3 657.0093 1.3E4 657.2676 4.1E6 657.5271 1.9E4 658.2709 3.8E3 END IONS BEGIN IONS FEATURE_ID=796 PEPMASS=673.2426 SCANS=796 RTINSECONDS=958.764 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 5 (1 removed due to low quality, 0 removed due to low cosine). 83.7105 2.1E3 89.0593 3.6E4 93.5530 2.4E3 101.1560 2.6E3 109.3214 2.2E3 126.1972 2.2E3 133.0856 1.9E4 133.2585 2.6E3 173.5250 3.8E4 173.5434 4.2E4 174.1083 2.4E3 257.7571 2.3E3 260.8362 2.5E3 275.6751 2.4E3 330.6683 2.4E3 376.2023 2.3E3 397.0511 2.3E3 402.1538 2.3E3 497.3895 2.7E3 515.3527 2.8E3 577.6830 2.5E3 607.0112 2.5E3 END IONS BEGIN IONS FEATURE_ID=797 PEPMASS=431.3525 SCANS=797 RTINSECONDS=960.557 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 12 (6 removed due to low quality, 0 removed due to low cosine). 55.0542 1.6E5 55.8832 2.2E3 57.0334 6.2E4 57.0699 1.1E6 60.1943 2.3E3 60.3574 2.1E3 60.9687 2.4E3 67.0541 1.0E5 67.9890 2.2E3 69.0334 3.6E3 69.0698 4.7E5 71.0490 3.5E4 71.0854 1.0E6 74.4236 2.5E3 76.5654 2.5E3 78.5491 2.8E3 79.0542 2.5E4 81.0697 4.3E5 83.0491 1.2E5 83.0854 3.9E5 84.3186 2.8E3 84.6616 2.2E3 85.0648 2.2E4 85.1010 5.7E5 91.0543 9.1E3 93.0697 6.5E4 95.0503 2.7E3 95.0854 4.8E5 95.0929 4.6E3 97.0649 1.2E4 97.1011 3.0E5 99.0444 5.3E3 99.0806 5.5E3 105.0704 1.1E4 107.0854 4.1E4 108.3732 2.4E3 109.0648 3.0E4 109.1011 2.9E5 109.8921 2.2E3 111.0440 2.5E4 111.0805 6.8E3 111.1167 1.3E5 113.0595 2.9E3 117.0701 2.5E3 119.0487 2.4E3 119.0854 3.2E4 121.0648 1.9E4 121.1011 1.8E4 123.0803 4.7E4 123.1167 1.3E5 125.0599 1.3E4 125.1323 2.4E4 127.0386 1.1E4 131.0856 2.0E4 133.0646 3.1E4 133.1011 2.9E4 135.0804 7.4E4 135.1167 1.8E4 137.0596 3.5E5 137.0961 9.5E3 137.1325 6.1E4 138.0672 2.9E3 139.0389 5.3E4 139.0753 8.6E4 143.0855 3.0E4 145.1015 3.2E4 146.7880 2.4E3 147.0804 9.2E4 147.1165 3.0E4 148.0786 2.5E3 149.0596 5.9E4 149.0960 4.1E4 149.1325 1.2E4 151.0632 1.5E4 151.0753 1.8E6 151.1118 2.1E4 151.1483 3.6E4 153.0549 4.5E3 157.1010 6.3E4 159.0805 1.3E5 159.1168 2.3E4 160.6048 2.7E3 161.0597 2.3E5 161.0961 1.2E5 161.1322 2.9E4 163.0753 5.5E4 163.1119 1.2E4 163.1481 3.4E3 165.0547 8.2E5 165.0911 6.8E5 165.1269 2.0E4 165.1638 2.3E4 167.0271 4.5E3 167.0372 1.1E4 167.0439 7.2E3 167.0703 5.8E6 167.0819 1.2E4 167.0973 5.0E3 167.1036 2.8E4 170.4522 2.6E3 171.0804 2.5E4 171.1169 4.2E4 173.0961 5.7E4 173.1321 6.8E3 173.5211 2.2E4 173.5353 1.6E5 173.5468 5.0E3 174.0685 3.4E3 175.0755 2.8E5 175.0923 3.3E3 175.1119 1.5E5 175.1483 9.4E3 177.0911 4.0E5 177.1079 4.7E3 177.1273 6.9E3 178.0628 9.9E3 179.0535 7.5E3 179.0704 5.1E5 179.1068 3.3E5 179.1428 1.5E4 181.0860 3.3E5 185.0962 6.7E4 185.1325 1.0E4 187.1118 2.8E4 188.0834 4.9E4 189.0734 6.5E3 189.0912 5.5E5 189.1275 1.3E5 191.0713 1.9E4 191.1067 1.7E5 191.1433 2.8E3 192.0782 6.0E4 193.0653 1.6E4 193.0861 8.7E5 193.1219 7.2E4 193.1968 2.3E3 195.1016 1.1E5 199.1117 4.7E4 199.1485 4.4E3 201.1277 1.1E4 202.0992 2.1E4 203.1069 5.0E5 203.1426 4.6E4 205.1225 1.0E5 206.0937 3.3E4 207.0835 2.0E3 207.1018 9.0E5 207.1382 5.7E4 207.1759 3.1E3 213.1279 2.4E4 215.1430 1.1E4 217.1226 3.2E5 217.1581 1.1E4 219.1383 2.8E4 220.1090 2.6E3 221.1174 3.6E5 221.1543 2.3E4 227.1430 5.4E3 231.1382 1.2E5 231.1634 2.9E3 231.1758 7.9E3 233.1539 3.7E3 235.1330 1.8E5 235.1599 3.4E3 235.1709 2.7E3 241.1588 5.1E3 245.1538 4.5E4 245.1910 4.4E3 249.1486 6.9E4 259.1691 2.3E4 261.1801 2.7E3 263.1641 3.9E4 269.1932 3.1E3 273.1855 1.8E4 277.1802 4.1E4 277.2133 6.6E3 283.9964 3.2E3 287.2004 1.3E4 291.1959 3.6E4 291.3027 3.1E3 301.2155 1.0E4 305.2109 3.7E4 319.2263 2.9E4 333.2413 3.9E3 347.2595 2.6E3 361.2716 1.1E4 375.2912 2.0E4 375.3589 3.5E3 385.3465 4.7E4 389.3427 3.3E3 402.3112 6.1E3 403.3601 1.4E4 413.3417 4.6E4 416.3281 2.8E4 431.3521 1.6E5 END IONS BEGIN IONS FEATURE_ID=798 PEPMASS=822.5365 SCANS=798 RTINSECONDS=961.276 CHARGE=1+ MSLEVEL=2 MERGED_STATS=1 / 1 (0 removed due to low quality, 0 removed due to low cosine). 74.5333 2.3E3 79.0538 1.6E4 81.0694 2.9E4 83.0489 2.9E3 83.0850 8.4E3 91.0538 9.0E3 93.0694 2.6E4 95.0484 2.7E3 95.0795 2.2E3 95.0850 3.0E4 97.0278 6.8E3 97.1008 1.0E4 105.0694 8.2E3 107.0486 2.7E3 107.0851 2.0E4 109.1006 2.2E4 117.0689 3.4E3 119.0850 8.8E3 121.1008 1.8E4 123.0805 2.9E3 123.1169 4.3E3 125.0955 1.1E4 131.0851 7.6E3 133.1007 8.7E3 135.1166 1.0E4 137.1325 2.3E3 145.1007 1.0E4 147.0796 4.3E3 147.1159 9.1E3 149.0953 3.1E3 149.1318 9.4E3 157.7185 2.9E3 159.1164 7.8E3 161.1319 3.6E3 163.1486 3.2E3 165.0904 3.1E3 171.1011 3.1E3 173.1319 5.6E3 173.5368 3.4E4 175.1136 3.0E3 189.1115 4.0E3 223.1328 2.5E4 243.2115 3.2E3 261.2211 8.1E3 273.1849 1.7E4 291.1575 3.3E3 291.1955 1.6E5 335.2583 5.1E4 365.2327 1.1E4 625.4490 1.1E4 656.7913 2.8E3 811.7130 2.5E3 END IONS BEGIN IONS FEATURE_ID=799 PEPMASS=681.3289 SCANS=799 RTINSECONDS=962.334 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 2 (0 removed due to low quality, 0 removed due to low cosine). 69.9239 2.3E3 70.6281 2.4E3 71.6818 2.3E3 94.0767 2.6E3 109.0634 2.5E3 139.8509 2.3E3 151.2516 2.5E3 173.5188 4.5E3 173.5372 5.9E4 225.1392 5.7E3 226.1458 4.2E3 239.1537 5.5E3 290.1378 2.8E3 294.9744 2.4E3 422.1484 2.9E3 446.2116 5.6E3 447.2183 4.5E3 451.2829 5.2E3 454.1767 9.6E3 459.2194 5.5E3 472.1845 3.7E3 473.2264 3.1E3 474.2043 1.0E4 475.2201 3.3E3 487.2121 3.4E4 489.2257 6.5E3 501.2273 1.5E4 502.2028 1.5E4 515.2077 2.6E4 519.2388 1.6E4 529.2236 4.3E4 533.2535 8.8E3 534.2271 1.4E4 547.2407 3.2E4 561.2488 3.1E3 575.2651 7.2E5 576.2719 4.0E3 583.9219 3.1E3 603.2604 5.4E4 607.2833 4.2E3 635.2862 7.9E4 646.9149 3.2E3 END IONS BEGIN IONS FEATURE_ID=800 PEPMASS=615.2582 SCANS=800 RTINSECONDS=965.009 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 68.4896 2.2E3 81.0695 3.7E3 89.0592 7.0E4 90.1715 2.2E3 93.0692 9.3E3 95.0488 1.2E4 95.0851 1.4E4 95.1576 2.5E3 97.0641 2.7E3 105.0693 2.3E3 107.0850 1.1E4 107.2692 2.7E3 109.1003 2.9E3 119.0851 1.6E4 121.1007 1.4E4 123.0800 1.2E4 125.0591 3.1E4 133.0854 2.9E4 133.1003 1.3E4 134.8042 1.4E4 134.8162 1.2E4 135.0796 4.0E3 136.5770 2.2E3 137.0954 2.9E3 143.0843 7.7E3 145.1010 1.8E4 147.0802 1.2E4 150.2494 3.0E3 151.0747 3.2E4 157.1009 1.1E4 159.1166 9.6E3 161.0953 8.8E3 161.1324 2.9E3 163.1114 5.7E4 165.0904 5.6E4 171.1169 1.4E4 173.1323 4.9E3 173.5262 4.9E4 173.5413 5.3E4 179.1063 2.8E3 181.1217 8.1E4 183.1172 2.5E3 185.1326 3.2E3 189.1280 1.2E4 191.1425 3.3E3 197.1328 5.1E3 198.3016 2.9E3 199.1123 9.4E3 203.1429 2.6E4 207.1376 1.8E4 211.1465 5.8E3 217.6695 2.4E3 221.1533 7.8E4 227.1417 7.5E3 233.1523 6.0E3 243.1389 3.0E3 245.8130 2.6E3 247.1697 1.0E4 271.1707 3.0E3 285.1849 3.0E3 286.1914 1.2E4 287.2004 1.1E4 297.1835 2.4E3 300.2108 7.4E3 312.2077 2.7E4 349.1802 2.4E3 352.2386 2.8E3 407.2569 1.4E4 494.3347 2.8E3 495.2533 9.0E3 509.1962 3.7E3 510.1129 2.8E3 510.2026 3.6E5 510.2889 5.1E3 511.2457 6.0E3 523.2180 3.3E3 524.2185 1.4E5 537.2301 1.0E4 538.2323 8.7E3 539.0480 4.6E4 539.0868 3.1E4 539.2411 7.4E6 539.3940 2.3E4 539.4356 3.9E4 539.4905 1.6E4 540.2431 9.1E3 571.2647 2.3E4 581.0372 3.0E3 583.2274 9.4E3 615.4037 1.6E4 END IONS BEGIN IONS FEATURE_ID=801 PEPMASS=592.2685 SCANS=801 RTINSECONDS=965.227 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 64.4444 2.3E3 65.8050 4.6E3 65.8092 2.1E4 66.0303 2.5E3 72.0936 2.1E3 73.0282 3.5E3 77.9784 2.2E3 91.0714 2.3E3 91.2528 2.1E3 91.4325 2.2E3 96.0359 2.7E3 96.7253 2.3E3 101.0329 2.8E3 111.5360 2.4E3 112.3027 2.2E3 116.0702 6.0E3 128.1600 2.3E3 141.8264 2.8E3 155.3744 2.6E3 162.0758 1.2E4 164.6237 2.6E3 167.0704 1.1E4 173.5222 2.8E4 173.5327 3.6E4 173.5409 4.0E4 185.2935 2.4E3 195.8635 2.9E3 203.4260 2.9E3 205.5678 2.4E3 255.4696 2.7E3 262.3892 2.3E3 321.3161 2.5E3 325.2555 2.5E3 333.2571 2.8E3 354.5404 2.4E3 373.1799 7.3E3 388.2040 6.8E3 393.1474 2.4E3 431.1914 2.3E3 432.2330 2.7E3 432.9573 2.3E3 433.2406 1.8E4 434.2437 4.3E3 444.1961 2.8E3 445.2003 3.2E3 446.2113 3.3E3 449.2303 3.2E3 458.6775 3.1E3 459.2180 1.2E6 460.2248 3.2E5 461.2334 1.3E5 473.2328 4.6E4 474.2402 1.2E4 475.2495 2.8E3 476.2553 1.1E4 477.2224 2.4E3 477.2350 2.8E3 477.2622 3.1E3 486.2400 5.8E3 487.1251 2.7E3 487.2467 5.1E4 488.2504 3.6E4 489.2275 7.3E3 490.2357 4.1E3 491.2439 1.1E5 492.2523 1.1E5 501.2282 1.7E4 503.2421 8.8E3 504.2469 9.6E4 505.2268 9.6E4 506.2668 1.4E4 516.2498 1.3E4 517.2231 9.5E4 518.2318 9.3E3 519.1481 4.0E3 519.2392 3.1E5 520.2490 2.8E4 521.2508 7.2E3 531.2338 3.4E3 532.2453 2.0E5 532.3378 3.9E3 533.2545 1.6E6 545.2187 4.2E3 548.2760 8.0E3 549.2493 6.1E4 560.2422 6.9E4 562.2229 3.4E4 563.2293 2.1E4 564.2663 2.6E4 565.2807 6.0E3 577.2451 1.7E5 577.3502 3.3E3 592.2671 6.7E5 593.2761 1.6E5 END IONS BEGIN IONS FEATURE_ID=802 PEPMASS=593.2767 SCANS=802 RTINSECONDS=965.228 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 6 (3 removed due to low quality, 0 removed due to low cosine). 64.5444 2.1E4 65.9167 3.6E5 65.9208 1.3E6 66.7092 8.2E3 71.3990 1.7E4 81.9419 1.7E4 86.2625 1.8E4 87.9132 7.5E3 98.2098 2.1E4 110.5297 2.1E4 133.3074 5.5E4 133.3193 1.3E5 134.4801 2.3E4 148.3123 8.8E4 148.3250 8.0E4 173.5247 1.9E5 173.5380 3.3E5 194.3828 9.1E3 214.7210 8.6E3 294.0371 8.7E3 415.5414 8.1E3 417.2072 4.1E4 419.2322 8.9E3 431.1865 4.4E5 432.1930 6.1E4 433.2382 5.9E5 434.2470 1.4E5 445.2023 2.4E5 446.2110 3.1E5 447.2173 6.6E5 447.2734 2.0E4 449.2371 3.5E4 459.2181 6.7E5 460.1504 1.8E4 460.2248 2.8E6 461.1599 4.8E4 461.2331 2.7E6 462.2407 2.1E5 463.2158 5.4E4 473.2332 6.9E5 474.2402 1.7E5 475.2567 2.5E4 476.2567 3.7E5 477.2636 2.1E5 487.2480 6.0E5 488.2570 8.0E4 489.2622 2.4E5 491.2407 2.5E5 492.2515 7.6E5 493.2580 1.1E5 503.2441 1.3E5 504.2374 1.0E4 504.2479 6.2E4 505.2249 1.2E6 506.2559 2.5E4 507.2764 2.2E4 515.2440 3.8E5 517.2569 1.3E5 518.2311 2.4E5 519.2397 2.6E5 520.2447 2.4E5 531.2508 9.5E3 532.9608 2.9E4 533.0638 3.6E5 533.1025 1.6E5 533.2543 5.8E7 533.4012 2.3E5 533.4463 3.3E5 533.4987 8.2E4 533.5542 4.8E4 534.2588 6.0E5 543.2383 3.7E4 547.2705 6.9E5 549.2267 1.9E4 549.2465 3.4E4 549.2600 1.1E4 550.2578 1.2E5 551.2652 2.7E4 558.1580 9.9E3 561.2493 5.3E5 563.2303 2.5E4 564.2371 7.7E5 564.3244 1.2E4 565.2806 1.8E6 568.5850 2.2E4 575.2650 9.9E5 578.2525 1.9E5 593.0539 2.7E5 593.0975 2.0E5 593.2756 4.0E7 593.4533 1.5E5 593.4998 2.8E5 END IONS BEGIN IONS FEATURE_ID=803 PEPMASS=600.4175 SCANS=803 RTINSECONDS=965.311 CHARGE=1+ MSLEVEL=2 MERGED_STATS=8 / 13 (5 removed due to low quality, 0 removed due to low cosine). 65.0342 2.1E3 65.2173 2.6E3 66.7096 2.6E3 67.0542 7.4E4 67.8100 2.6E3 69.0334 6.9E4 69.0698 8.4E4 69.8449 5.6E3 71.0493 4.0E3 71.3020 2.4E3 74.0870 2.2E3 75.4261 2.9E3 75.7886 3.7E3 75.9991 2.6E3 76.0360 3.6E3 76.5459 3.0E3 78.8900 4.1E3 79.0541 1.1E5 80.0621 1.0E4 80.4737 3.6E3 81.0328 3.0E3 81.0697 3.1E5 82.0731 8.8E3 83.0490 1.0E5 83.0854 4.6E4 85.0646 7.1E4 87.0443 5.9E3 87.7390 2.3E3 88.2096 3.4E3 89.0596 2.1E5 91.0542 1.4E5 92.0621 1.2E4 93.0697 4.9E5 94.0728 1.9E4 94.1703 2.7E3 94.7406 2.2E3 95.0490 1.8E5 95.0854 3.3E5 96.0573 3.4E3 96.0887 1.8E4 97.0647 8.9E4 99.0803 5.2E3 99.1058 3.3E3 99.2063 3.6E3 101.8937 2.1E3 103.7130 2.6E3 105.0697 4.9E5 106.0777 2.6E4 106.0787 3.5E3 107.0493 6.1E3 107.0854 3.8E5 107.4122 2.7E3 108.0901 1.4E4 109.0647 1.5E5 109.1011 1.7E5 110.1041 3.0E3 110.3789 3.9E3 111.0440 1.1E4 111.0804 5.4E4 111.2850 2.3E3 113.3862 2.4E3 115.0539 3.8E3 116.4538 2.3E3 117.0697 7.6E4 117.3846 2.2E3 118.0776 3.0E3 119.0487 9.1E3 119.0758 1.4E4 119.0854 8.8E5 119.0954 5.5E3 120.0918 7.1E4 121.0646 8.7E4 121.0911 5.2E3 121.1010 6.5E5 121.1093 2.1E3 122.0725 1.1E4 122.1043 4.4E4 123.0803 3.2E5 123.1167 5.8E4 124.0842 1.3E4 125.0491 4.3E3 125.0595 4.4E5 125.0958 8.5E3 125.6301 2.7E3 126.0623 9.5E3 128.0620 6.5E3 129.0699 6.0E4 130.0778 6.1E3 131.0854 2.9E5 132.0931 9.9E4 133.0649 5.1E4 133.0860 1.1E5 133.1011 5.4E5 134.1082 9.2E4 135.0803 3.2E5 135.1167 2.5E5 136.0847 2.1E4 136.1200 3.4E3 137.0598 3.2E4 137.0960 3.0E5 137.1320 3.2E3 137.2213 3.3E3 138.1001 3.5E4 139.0752 1.2E5 139.1117 3.1E4 140.0786 2.8E3 141.0694 1.2E4 142.0777 4.9E4 143.0854 3.0E5 144.0929 1.2E5 145.0646 6.2E3 145.1011 8.9E5 145.1143 2.1E4 146.0723 8.9E3 146.1068 7.6E4 146.9372 2.7E3 147.0803 5.8E5 147.0933 3.7E3 147.1166 1.9E5 148.0844 7.9E4 148.1220 1.6E4 149.0960 2.3E5 149.1321 1.0E4 150.1033 3.4E4 151.0752 3.4E5 151.1119 3.8E4 152.0804 4.7E4 153.0907 2.5E4 155.0853 1.1E5 156.0931 7.4E4 157.1011 7.0E5 158.1078 1.7E5 159.0804 1.3E5 159.1168 5.4E5 160.0880 3.4E4 160.1233 9.2E4 161.0961 2.5E5 161.1324 2.4E5 161.1461 2.8E3 162.1021 3.3E4 162.1359 4.6E4 163.0761 1.9E4 163.1117 9.0E5 163.1270 3.2E3 164.1161 5.5E4 165.0771 4.5E3 165.0910 2.6E6 165.1095 9.4E3 166.0795 5.1E3 166.0945 4.3E5 166.1105 6.0E3 167.0861 2.4E4 167.1066 2.1E4 167.3969 3.8E3 168.0933 1.3E4 169.1012 2.5E5 170.1082 9.9E4 171.0809 2.8E4 171.1169 5.0E5 172.0893 8.4E3 172.1234 1.6E5 173.0962 1.9E5 173.1326 2.4E5 173.5225 2.2E4 173.5331 2.3E5 173.5431 1.1E4 174.1018 1.9E4 174.1378 1.6E4 175.1117 2.6E5 175.1483 1.3E5 176.1190 3.9E4 176.1512 1.1E4 177.0911 1.2E5 177.1109 1.7E4 177.1275 9.6E4 178.0987 1.0E5 179.0876 1.1E4 179.1066 6.1E4 179.1431 3.0E4 180.0972 5.8E3 180.1143 1.4E5 181.0850 4.8E3 181.1019 8.7E4 181.1224 9.2E5 182.1085 5.3E4 182.1259 1.5E4 183.1169 3.8E5 184.1224 1.1E5 185.0963 5.5E4 185.1326 3.9E5 185.1514 5.1E3 186.1036 2.8E4 186.1377 9.5E4 187.1117 1.5E5 187.1482 1.4E5 188.1184 2.5E4 188.1518 9.7E3 189.1275 2.8E5 190.1350 3.5E5 191.0875 4.0E3 191.1067 2.2E5 191.1429 9.3E4 192.1111 3.6E4 193.1026 4.4E4 193.1223 2.5E5 194.1086 2.6E4 195.1168 2.0E5 195.1380 9.2E4 196.1238 6.9E4 196.1423 5.9E3 196.3422 3.5E3 197.0973 3.1E4 197.1324 3.5E5 198.1034 2.3E4 198.1384 5.9E4 199.1119 1.4E5 199.1479 1.2E5 200.1185 2.3E4 200.1538 7.2E3 201.1275 1.9E5 201.1631 4.1E4 202.1341 2.6E4 203.1091 9.8E3 203.1432 1.1E6 204.1466 2.5E5 205.1221 4.0E4 205.1593 1.1E4 206.1091 4.6E3 206.1299 1.9E4 207.1167 8.8E4 207.1382 3.7E5 207.1585 7.1E3 208.1245 3.3E4 208.1454 1.9E5 209.0964 4.0E3 209.1326 2.3E5 209.1534 2.1E4 210.1384 6.6E4 211.1120 6.9E4 211.1483 3.0E5 211.1684 2.5E3 212.1177 2.6E4 212.1544 1.1E5 213.1273 1.3E5 213.1639 6.9E4 214.1337 3.2E4 215.1071 2.2E4 215.1435 1.1E5 216.1507 1.0E5 217.1225 3.5E4 217.1593 2.9E4 218.1293 9.9E3 219.1157 9.5E3 219.1381 2.3E5 220.1245 9.2E3 220.1468 1.4E4 221.1341 8.5E4 221.1538 2.8E6 222.1572 6.3E5 223.1117 3.5E4 223.1482 1.3E5 224.1183 6.1E3 224.1539 2.5E4 225.1273 1.1E5 225.1641 1.4E5 226.1344 1.7E4 226.1698 2.3E4 227.1432 1.0E5 227.1800 5.2E4 228.1486 1.1E4 228.1844 4.2E3 229.1221 2.7E4 229.1587 1.5E5 230.1307 8.8E3 230.1635 3.6E4 231.1383 8.8E4 231.1751 1.3E4 232.1445 3.5E4 232.1774 2.9E3 233.1314 4.2E4 233.1539 1.8E5 234.1399 2.0E4 234.1614 4.6E5 235.1477 6.3E4 235.1705 3.6E4 236.1531 7.5E3 237.1277 6.6E4 237.1637 7.7E4 238.1339 1.7E4 238.1700 2.3E4 239.1434 7.5E4 239.1793 8.5E4 240.1505 2.5E4 240.1869 1.7E5 241.1236 2.0E4 241.1588 8.2E4 242.1675 3.8E3 243.1382 8.9E4 243.1723 9.0E3 244.1431 8.1E3 245.1544 7.0E4 246.1620 7.3E3 247.1444 7.1E3 247.1694 7.6E5 247.1993 4.4E3 248.1744 2.2E5 249.1320 1.3E4 249.1634 6.7E4 250.1688 7.2E3 251.1429 7.0E4 251.1787 7.3E4 252.1489 8.3E3 253.1302 4.4E3 253.1585 9.4E4 253.1939 2.7E4 254.1638 4.7E3 255.1395 2.4E4 255.1740 5.7E4 256.1456 1.6E4 256.1801 3.0E4 257.1533 5.1E4 257.1865 1.5E4 258.1571 4.5E3 259.1446 3.4E3 259.1692 1.4E5 260.1506 5.2E3 260.1770 8.4E4 261.1578 9.9E3 261.1852 9.6E4 263.1479 4.3E3 263.1788 6.7E4 264.1845 1.0E4 265.1581 4.6E4 265.1934 4.4E4 266.1663 9.1E3 267.1421 3.1E3 267.1740 6.8E4 268.1815 7.6E3 269.1542 7.4E4 269.1891 6.7E4 270.1606 3.2E3 270.1940 1.9E4 271.1695 1.2E5 272.1769 2.6E4 273.1857 7.8E4 274.1930 3.7E5 275.1769 1.5E4 277.1596 8.3E3 277.1938 3.3E4 279.1743 8.8E4 279.2092 2.8E4 280.1818 5.7E3 281.1524 3.2E3 281.1902 1.4E5 282.1957 2.6E4 283.1699 3.8E4 283.2045 9.5E3 284.1766 2.1E4 285.1849 1.1E5 286.1925 1.9E5 287.1670 8.0E3 287.2008 5.3E5 288.2040 1.3E5 289.1953 3.1E4 291.1749 2.6E4 291.2100 1.8E4 292.1802 7.7E3 293.1902 5.0E4 294.1952 2.3E4 295.1721 5.0E3 295.2065 3.9E4 297.1849 1.4E5 297.2199 2.5E4 298.1922 1.8E4 299.2007 5.3E5 300.2078 1.1E5 301.2184 6.8E3 305.1912 6.4E3 307.2056 8.0E4 309.1845 5.2E4 309.2217 2.6E4 310.1927 6.3E4 311.2004 1.5E5 312.2083 2.2E5 313.2163 4.8E5 314.2199 5.2E4 315.2076 3.9E3 318.2003 4.7E3 319.2055 5.2E4 321.2208 9.2E3 322.2282 1.2E4 323.1998 2.6E4 324.2071 1.1E4 325.2163 5.9E5 326.2224 7.2E4 327.1979 4.0E3 327.2320 2.0E5 328.2355 7.0E4 333.2219 5.9E3 334.2287 9.9E3 336.2039 4.4E3 337.2160 1.8E5 338.2212 4.9E3 338.2612 8.4E3 339.2319 1.6E5 340.1690 3.8E3 340.1953 4.5E3 340.2396 1.2E6 347.2365 9.7E3 348.2420 4.7E3 349.2132 3.5E3 351.2318 5.9E4 352.2396 5.5E5 353.2467 1.3E4 363.2319 2.2E4 365.2471 3.0E5 366.2521 6.4E4 374.2526 2.8E3 376.2343 3.0E3 377.2476 4.3E4 378.2545 4.7E3 379.2627 6.3E4 385.2362 2.2E4 387.2563 5.2E4 391.2640 9.0E4 392.2673 6.8E4 395.0955 2.5E3 402.2848 3.4E3 405.2787 8.8E4 411.2525 5.6E4 413.2690 2.0E5 414.1276 4.4E3 414.2719 5.1E4 419.2942 9.3E4 420.3000 1.3E5 425.2025 4.2E3 425.2684 6.5E5 425.3300 4.3E3 426.2764 1.1E5 427.2844 5.5E5 427.3501 5.8E3 428.2874 1.3E5 428.6857 2.7E3 429.2822 4.4E3 439.2820 1.4E4 440.2918 9.3E5 440.3466 3.2E3 440.3584 4.2E3 453.2984 1.6E4 454.3027 3.4E4 487.3195 3.5E4 493.3307 2.3E4 505.3289 7.5E4 505.4060 4.0E3 507.3459 2.6E4 508.3481 2.6E4 516.9064 2.8E3 519.3450 3.4E3 520.3522 1.4E5 535.8594 2.8E3 545.1984 3.0E3 554.4011 2.6E3 567.3805 1.4E4 581.1110 4.5E3 582.4059 3.1E3 585.3927 7.8E4 600.4129 7.6E4 605.4372 3.9E3 609.4781 2.8E3 END IONS BEGIN IONS FEATURE_ID=804 PEPMASS=599.4101 SCANS=804 RTINSECONDS=965.613 CHARGE=1+ MSLEVEL=2 MERGED_STATS=1 / 1 (0 removed due to low quality, 0 removed due to low cosine). 67.0540 4.2E3 69.0334 4.4E3 69.0695 6.0E3 69.7538 2.4E3 75.2282 2.3E3 79.0542 2.9E3 81.0696 1.5E4 83.0489 3.7E3 83.0854 5.1E3 85.0646 3.5E3 90.4930 2.6E3 91.0541 5.0E3 93.0695 2.2E4 95.0490 7.7E3 95.0852 2.0E4 97.0646 7.7E3 105.0696 1.9E4 107.0852 2.2E4 109.0646 7.1E3 109.1008 7.6E3 113.0961 2.6E3 117.0693 3.2E3 119.0852 3.1E4 121.0645 3.6E3 121.1009 3.4E4 123.0801 1.8E4 123.1165 4.4E3 125.0593 1.2E4 131.0851 1.0E4 133.0641 3.0E3 133.1009 2.0E4 135.0800 1.6E4 135.1166 1.2E4 137.0606 3.4E3 137.0958 2.2E4 139.0750 7.5E3 143.0854 1.3E4 145.1010 2.7E4 147.0801 4.7E4 147.1164 6.6E3 149.0960 1.0E4 151.0751 2.3E4 153.0906 3.0E3 155.0848 6.6E3 156.0930 4.7E3 157.1009 3.9E4 159.0808 4.4E3 159.1166 1.8E4 161.0960 1.1E4 161.1322 1.9E4 163.1115 3.1E4 165.0909 2.3E5 165.1036 2.4E3 167.1061 2.9E3 169.1009 1.3E4 170.1087 3.1E3 171.1167 3.2E4 173.0961 1.0E4 173.1325 1.0E4 173.5345 2.6E4 175.1117 5.8E3 175.1487 7.4E3 177.0907 5.6E3 177.1270 3.9E3 179.1073 3.3E3 179.1427 4.7E3 181.1024 3.5E3 181.1224 1.2E4 183.1169 2.9E4 185.1324 2.4E4 187.1477 7.1E3 189.1274 1.4E4 191.1066 1.5E4 191.1437 4.7E3 195.1165 9.1E3 195.1363 5.3E3 196.1263 2.4E3 197.0979 3.2E3 197.1324 1.5E4 199.1117 5.3E3 199.1477 4.6E3 201.1273 5.1E3 203.1430 9.7E4 207.1165 6.0E3 207.1382 1.4E4 209.1324 1.3E4 211.1124 4.9E3 211.1482 1.7E4 213.1284 4.9E3 215.1441 5.9E3 221.1346 7.1E3 221.1537 2.3E5 223.1488 4.8E3 225.1272 6.3E3 225.1642 4.9E3 227.1424 3.6E3 227.1798 4.4E3 229.1232 3.7E3 229.1583 9.2E3 231.1388 6.5E3 233.1546 5.1E3 235.1478 3.9E3 237.1273 3.4E3 237.1642 4.7E3 239.1782 2.5E3 247.1438 2.7E3 247.1692 4.9E4 249.1638 3.2E3 251.1432 4.4E3 251.1781 2.5E3 263.1790 5.1E3 263.8222 2.3E3 265.1582 2.9E3 267.1730 3.4E3 269.1901 4.7E3 271.1707 4.2E3 281.1908 3.9E3 285.1854 4.5E3 286.1922 3.9E3 287.2012 3.8E4 293.1904 4.3E3 295.2077 4.2E3 299.2011 1.2E4 309.1862 3.6E3 310.1919 2.8E3 311.2012 9.6E3 313.2179 1.2E4 325.2176 7.9E3 327.2328 1.4E4 335.2045 2.8E3 365.2483 1.3E4 391.2635 8.1E3 413.2704 9.5E3 419.2956 1.4E4 427.2855 2.5E4 453.2996 6.5E3 507.3503 2.5E3 519.3483 7.6E3 599.4095 8.1E3 END IONS BEGIN IONS FEATURE_ID=805 PEPMASS=434.2819 SCANS=805 RTINSECONDS=965.656 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 57.0697 2.4E4 59.0490 1.0E4 67.0541 5.1E3 68.6670 2.5E3 69.0331 2.7E3 69.0696 5.5E3 79.0540 3.4E3 81.0696 3.3E4 85.0646 1.3E4 89.0341 2.2E3 91.0541 9.8E3 93.0696 3.3E4 94.7147 2.2E3 95.0488 1.7E4 95.0851 2.0E4 95.3232 2.3E3 96.7550 2.4E3 97.0643 6.6E3 105.0627 4.0E3 105.0696 1.2E5 107.0852 2.6E4 108.3976 2.5E3 109.0645 6.7E4 109.1009 8.3E3 111.0803 3.8E3 117.0693 5.6E3 119.0852 1.4E5 121.0645 1.1E4 121.1008 3.8E4 123.0802 4.0E4 125.0594 1.8E4 129.0701 3.5E3 130.3509 2.3E3 131.0853 3.7E4 133.0648 7.1E3 133.1008 4.8E4 135.0801 5.2E4 135.1166 1.1E4 137.0599 7.5E3 137.0959 3.1E4 142.0765 2.5E3 143.0853 3.6E4 144.0936 3.1E3 145.1009 6.7E4 147.0802 1.1E5 147.1164 1.1E4 148.0876 7.0E3 149.0959 3.8E4 149.6819 5.5E3 149.6934 5.3E3 150.1035 3.0E3 151.0752 4.5E4 155.0851 1.8E4 156.0931 1.2E4 157.1009 6.6E4 159.0802 1.8E4 159.1166 4.8E4 161.0960 3.8E4 161.1323 2.2E4 162.1037 7.2E3 163.0744 3.1E3 163.1119 2.9E4 164.1204 2.4E3 165.0909 2.2E5 167.0861 6.2E3 168.0937 1.1E4 169.1012 3.5E4 170.1092 1.3E4 171.1169 6.2E4 173.0961 2.4E4 173.1324 1.6E4 173.5267 1.1E4 173.5352 2.3E4 175.1117 4.7E4 175.1479 3.2E3 177.0911 2.6E4 177.1289 3.1E3 178.0989 1.3E4 179.1067 2.9E3 181.1014 1.6E4 181.1221 7.7E3 182.1075 3.0E3 183.1169 1.3E5 184.1238 3.9E3 185.0962 4.7E3 185.1325 2.4E4 187.1118 2.8E4 187.1483 1.5E4 188.1205 3.2E3 189.1274 2.4E4 190.1352 3.0E4 191.1069 3.7E4 191.1438 2.5E3 193.1028 9.5E3 193.1224 2.8E4 195.1169 2.9E4 196.1244 1.1E4 197.0966 3.5E3 197.1324 2.9E4 199.1120 2.8E4 201.1272 2.9E4 202.1338 2.8E3 203.1433 7.3E4 207.1171 1.5E4 207.1384 2.8E4 209.1323 2.6E4 210.1392 2.7E3 211.1120 1.8E4 211.1485 5.6E4 213.1273 3.1E4 214.1340 2.6E3 215.1075 3.2E3 215.1430 1.3E4 216.1517 6.2E3 219.1382 3.2E4 221.1323 1.4E4 221.1540 9.9E4 222.1401 2.7E3 223.1127 3.7E3 223.1486 8.0E3 225.1272 2.3E4 225.1641 2.6E4 227.1441 9.9E3 229.1226 8.8E3 229.1588 1.8E4 230.1305 3.3E4 233.1314 3.3E3 233.1544 1.1E4 234.1615 1.9E4 235.1491 7.5E3 237.1261 3.0E3 237.1640 8.0E3 239.1436 2.1E4 239.1789 6.0E3 240.1515 7.2E3 241.1590 2.7E3 243.1386 1.9E4 247.1694 2.8E4 249.1638 3.4E3 251.1446 3.6E3 251.1794 3.0E3 253.1596 1.7E4 255.1379 4.6E3 259.1693 8.7E3 265.1575 2.5E3 267.1731 2.9E3 268.1820 2.0E4 270.4082 2.7E3 271.1698 2.0E4 273.1617 4.1E3 275.1785 3.5E3 281.1899 1.8E4 285.1857 4.2E3 286.1933 1.0E5 287.2015 1.3E4 291.1755 3.4E3 295.2043 2.7E3 297.1849 9.5E3 299.2011 3.3E4 309.1826 2.8E3 311.2005 1.4E4 312.2089 1.5E4 313.2170 2.4E4 315.2103 3.0E3 327.1966 7.1E3 335.2011 1.5E4 337.2176 8.2E3 355.2278 3.1E4 373.2531 1.2E4 391.2643 8.1E4 391.3138 3.7E3 397.0024 2.6E3 419.2598 4.5E3 END IONS BEGIN IONS FEATURE_ID=806 PEPMASS=761.1888 SCANS=806 RTINSECONDS=965.656 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 70.6448 2.2E3 80.7479 2.2E3 86.0962 4.6E3 89.0592 3.8E3 91.9130 2.5E3 99.7762 2.5E3 116.7568 2.4E3 121.0503 2.3E3 143.9239 2.7E3 148.3262 2.7E3 149.6865 1.1E4 149.6973 7.6E3 173.5227 1.4E4 173.5327 1.2E4 173.5422 1.7E4 184.0730 6.3E4 185.0770 1.3E4 186.0775 7.3E3 235.0194 2.6E3 279.6432 2.5E3 327.2959 2.6E3 335.1139 2.7E3 343.0356 2.5E3 387.1494 2.7E3 417.7068 2.5E3 433.2405 1.1E4 447.2199 3.8E3 459.2176 2.1E4 460.2257 3.5E4 461.2337 3.7E4 468.6784 2.8E3 473.2328 3.7E3 476.2599 3.2E3 477.2639 2.5E3 487.2491 8.1E3 492.2535 1.5E4 505.2263 1.5E4 515.2421 6.2E3 533.2542 1.7E6 534.2592 5.7E3 547.2711 1.9E4 561.2501 1.2E4 564.2353 1.1E4 565.2808 6.2E4 575.2653 3.2E4 592.2677 2.5E4 593.0540 1.2E4 593.2753 2.6E6 595.2793 1.1E4 650.1749 3.0E3 END IONS BEGIN IONS FEATURE_ID=807 PEPMASS=641.2969 SCANS=807 RTINSECONDS=966.304 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 66.4751 3.4E4 66.4772 1.3E4 66.5864 1.8E5 66.5896 5.2E4 66.9797 7.0E3 70.8580 5.1E3 76.5184 4.3E3 81.2928 4.6E3 95.8790 4.0E3 96.2914 5.3E3 106.8136 7.3E3 110.9986 5.5E3 112.3280 4.0E3 112.3498 6.2E3 137.2184 4.3E3 147.3331 3.7E3 149.8153 1.4E4 173.5209 1.1E4 173.5286 1.0E5 173.5411 3.6E4 239.1543 1.0E4 246.1120 3.2E4 261.3122 6.7E3 264.7310 4.2E3 278.1647 6.6E3 304.1438 4.6E3 316.7363 6.2E3 318.1597 8.0E4 332.1778 4.5E3 381.2060 1.0E4 397.2081 2.7E4 409.2016 5.5E4 410.2125 1.6E4 411.2184 6.2E4 412.2255 7.6E4 421.2001 8.7E3 422.2086 3.9E4 423.2183 1.9E5 424.2233 5.0E5 425.1981 2.5E5 435.2167 1.7E4 436.2247 1.7E4 437.2330 1.2E5 438.2029 3.5E4 439.2132 2.7E5 440.1602 3.7E3 440.2209 5.4E5 449.6644 5.1E3 450.2037 2.2E4 451.2450 5.6E3 452.2173 4.2E4 453.2279 1.4E5 454.2351 5.5E4 455.2466 7.1E3 464.2193 4.3E4 465.2223 1.3E4 465.2355 1.1E4 466.2470 7.2E3 467.2492 3.2E4 468.2587 2.4E4 469.2235 7.3E4 477.2295 2.7E4 481.2249 1.0E5 482.2319 9.1E4 483.2003 1.5E4 483.2784 2.6E4 484.2475 6.4E4 491.2438 8.7E3 494.2475 5.0E3 494.2580 3.3E4 495.2468 8.6E4 496.2468 2.8E5 497.2219 3.8E5 498.2264 7.1E4 501.2655 2.1E4 505.2583 5.4E3 508.2350 6.3E3 508.2520 1.0E4 509.2539 7.5E4 510.2575 7.1E4 511.2694 7.2E5 512.2777 3.6E5 519.2374 9.0E3 521.2604 7.9E3 522.2570 6.3E4 523.2684 1.9E5 524.2749 1.7E5 525.2537 8.8E4 526.2624 3.8E4 527.2668 9.4E4 528.2854 7.3E3 537.2732 1.1E5 538.2549 3.8E5 539.2646 2.2E5 540.2734 2.9E5 543.2933 1.0E4 547.2669 1.4E4 550.2572 6.2E3 551.2637 1.7E4 553.2740 7.2E4 554.2854 1.6E5 555.2192 1.1E4 555.2972 1.3E6 555.4411 6.8E3 565.2813 2.3E5 566.2491 6.2E4 567.2624 6.4E3 568.2674 6.9E3 569.2793 6.2E4 570.2506 1.1E5 571.2764 1.9E5 576.2865 5.2E3 582.2837 6.0E4 583.2564 5.6E4 584.2639 2.8E4 597.3073 4.6E5 597.4141 9.3E3 598.1939 1.8E4 598.2788 1.5E6 599.0654 1.7E4 599.2870 5.7E6 613.3018 7.1E4 641.2967 7.5E4 END IONS BEGIN IONS FEATURE_ID=808 PEPMASS=663.2793 SCANS=808 RTINSECONDS=966.304 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 79.8468 2.4E3 89.4507 2.4E3 113.1271 2.6E3 118.6758 2.4E3 118.8608 2.5E3 119.0849 2.4E3 121.0997 4.3E3 125.0588 7.2E3 132.3129 2.5E3 133.0995 3.1E3 134.7840 2.5E3 141.7642 2.3E3 142.9660 2.7E3 145.1003 2.8E3 147.0797 3.2E3 163.1110 1.0E4 165.0898 6.0E3 173.5350 8.0E4 176.5329 2.1E3 180.5347 2.4E3 181.1212 5.1E3 182.1246 3.4E3 183.1163 2.7E3 207.1382 3.2E3 221.1531 5.5E3 269.2261 2.5E3 286.1908 2.4E3 310.2124 2.7E3 318.1594 1.3E4 334.9964 2.5E3 341.1498 6.5E4 346.9832 2.3E3 355.2200 3.5E3 381.3690 2.8E3 407.2546 7.4E3 423.2184 1.0E5 431.1838 1.0E4 434.4071 2.5E3 439.2027 7.2E3 445.1999 7.7E4 446.2083 6.6E4 449.2340 1.8E4 450.2382 2.9E3 458.2084 1.8E4 459.2155 2.5E5 459.2847 7.6E3 460.2227 2.9E4 463.2505 1.4E4 471.2164 1.6E4 472.2235 1.1E4 473.2312 2.0E4 477.2261 3.6E3 477.2650 2.6E3 482.2121 5.9E3 485.2313 8.8E4 486.2373 5.5E4 487.2107 2.2E4 489.1625 4.0E3 491.2463 3.4E3 491.5969 2.6E3 492.5615 3.1E3 495.2547 3.3E4 497.2314 7.8E4 499.2399 8.0E3 500.2546 6.1E4 503.2809 9.9E3 504.2136 3.7E4 509.2568 2.5E3 513.2253 2.4E4 514.2341 2.9E4 515.2399 9.1E3 517.2194 1.5E4 518.2289 4.7E5 519.1472 5.2E3 519.2370 3.3E5 522.2579 3.9E3 523.2711 7.6E4 528.2503 1.9E4 531.2354 7.3E3 536.2401 2.8E3 541.2213 1.6E5 543.2695 2.0E4 545.2524 9.6E4 546.2600 3.2E4 547.2668 4.2E3 551.2649 3.9E4 558.2265 2.6E4 559.2590 3.2E3 560.2745 4.2E3 565.2813 9.3E4 569.2582 3.0E3 573.1431 3.6E3 573.2477 2.8E5 573.3513 9.3E3 587.2634 1.9E5 589.1769 6.9E3 619.2896 7.2E4 663.4657 2.3E4 END IONS BEGIN IONS FEATURE_ID=809 PEPMASS=299.2011 SCANS=809 RTINSECONDS=967.734 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 6 (0 removed due to low quality, 0 removed due to low cosine). 67.0542 6.5E3 67.3104 2.3E3 68.5184 2.4E3 69.0329 2.4E3 71.8842 2.5E3 73.0282 8.4E3 79.0539 1.2E4 81.0696 5.7E4 85.0645 4.6E4 91.0542 1.3E4 93.0191 2.3E3 93.0697 2.5E4 95.0852 1.6E4 95.1508 2.6E3 96.4148 2.8E3 97.0273 2.3E3 97.0646 3.6E3 101.3111 2.4E3 103.3844 2.6E3 105.0697 3.6E4 106.3130 2.5E3 107.0853 3.2E4 109.0647 2.2E4 111.0439 3.4E3 117.0693 3.3E3 119.0852 6.6E4 121.0648 5.4E3 121.1009 1.2E4 121.1776 2.7E3 123.0803 2.4E4 129.0697 5.6E3 131.0851 2.8E4 133.0642 6.2E3 133.1010 4.7E4 135.0803 3.4E4 135.1173 3.1E3 135.7467 2.2E3 137.0594 2.4E4 137.0959 7.8E3 143.0853 2.9E4 144.0931 1.2E4 145.1008 3.8E4 146.0725 6.9E3 147.0800 4.6E4 147.1157 2.8E3 148.0268 2.3E3 148.0880 5.0E3 149.0959 2.1E4 149.6902 5.6E3 150.9515 2.8E3 151.0751 1.0E5 152.9865 2.7E3 155.0851 6.0E3 156.0929 6.3E3 156.3131 2.2E3 157.1010 5.2E4 158.1074 3.5E3 159.0805 1.5E4 159.0991 2.9E3 159.1166 3.1E4 160.0891 2.2E3 160.1054 3.5E3 161.0959 2.2E4 165.0909 4.0E4 168.8618 2.5E3 169.1012 2.6E4 170.1088 2.6E3 171.1165 3.5E4 173.0958 1.9E4 173.1323 1.3E4 173.2680 2.2E3 173.5214 7.4E3 173.5324 1.1E5 173.5467 5.1E3 175.1121 1.8E4 177.0911 4.1E4 181.1150 2.9E3 182.1080 3.2E3 182.6514 2.5E3 183.1170 3.3E4 184.1246 2.8E3 186.1042 3.2E3 187.1117 1.2E4 188.1201 5.4E3 189.1284 6.9E3 191.1075 2.9E3 193.1012 3.3E3 194.1080 3.2E3 195.1158 3.2E4 196.1234 6.0E3 197.0951 5.3E3 197.1322 2.7E4 199.1121 3.0E4 200.1187 9.9E3 201.0926 2.4E3 201.1271 2.3E4 203.1429 8.4E3 207.1169 6.8E3 209.1328 1.5E4 210.1374 2.7E3 211.1121 3.1E3 211.1486 2.7E3 213.1274 3.7E4 214.1356 6.7E3 218.1294 2.8E3 219.8236 2.6E3 221.1292 1.0E4 221.6279 8.9E3 222.1328 2.7E3 223.1476 7.7E3 225.1263 1.3E4 227.1038 2.4E3 227.1429 7.0E3 228.1322 2.6E4 229.1221 1.6E4 231.1368 2.8E3 233.6343 2.4E3 234.1334 7.9E3 234.6360 1.5E4 235.1471 3.0E3 237.1635 2.9E3 239.1414 2.5E3 241.1237 5.1E3 241.1578 7.4E3 243.1381 8.7E4 243.6397 7.5E3 247.1501 5.6E3 249.1649 2.7E3 251.1429 2.6E3 253.1593 4.0E3 255.1359 5.6E3 257.1544 2.8E3 260.4546 2.6E3 262.1649 1.4E4 271.1702 5.0E3 281.1526 2.8E3 282.2799 1.0E4 285.1869 2.5E3 291.8777 2.5E3 299.0909 3.7E4 299.1257 5.1E3 299.1627 9.7E3 299.2015 3.0E4 299.2378 4.2E4 313.9702 2.5E3 333.2265 2.6E3 334.1867 2.3E3 347.9002 2.5E3 388.3049 2.3E3 422.1680 2.6E3 450.2637 2.5E3 473.4591 2.8E3 560.5996 2.8E3 565.5994 2.6E3 END IONS BEGIN IONS FEATURE_ID=810 PEPMASS=607.2921 SCANS=810 RTINSECONDS=968.532 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 67.4741 8.9E4 67.4777 2.4E5 76.8958 2.4E3 91.7807 2.7E3 96.5214 2.1E3 97.4884 2.2E3 102.4482 2.6E3 102.5471 1.0E4 116.5331 2.8E3 142.8804 1.1E4 145.0490 2.4E3 151.8170 2.9E4 151.8288 2.3E4 152.0752 2.5E3 163.0316 2.6E3 164.9449 2.9E3 169.3143 2.7E3 173.5199 4.1E3 173.5342 1.6E5 182.2766 2.4E3 188.2295 2.8E3 317.5583 2.7E3 405.2095 3.1E3 431.1861 3.7E4 432.1936 3.4E3 433.2398 4.3E4 434.2469 5.0E4 435.2542 1.6E4 445.2033 4.5E3 446.2094 3.7E4 447.2174 1.5E5 459.2177 9.5E4 460.2241 3.8E5 461.2328 2.6E5 462.2402 7.3E4 473.2331 9.9E4 474.2304 3.4E3 474.2424 5.4E3 476.2554 3.0E4 477.2701 3.1E3 478.2317 4.0E3 487.2490 8.2E4 489.2636 9.5E4 491.2422 2.4E4 492.2481 2.3E4 504.2124 4.5E3 505.2259 8.6E4 506.2388 5.6E4 506.2538 8.7E3 507.2738 7.2E4 515.2456 3.4E4 517.2585 9.4E4 518.2310 2.6E4 519.1623 3.5E3 519.2390 9.4E4 520.2442 2.4E4 532.2074 2.9E3 533.2543 3.9E6 534.2581 2.9E5 535.2699 2.0E6 547.2355 4.6E3 550.2534 3.7E3 561.2542 1.0E5 563.3061 2.8E4 565.2815 2.0E4 578.2514 1.2E5 579.2939 1.1E5 589.2815 4.4E4 592.2670 6.1E4 607.0625 4.8E4 607.2913 7.9E6 607.4695 7.3E3 607.5245 1.4E4 END IONS BEGIN IONS FEATURE_ID=811 PEPMASS=653.2974 SCANS=811 RTINSECONDS=969.952 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 2 (0 removed due to low quality, 0 removed due to low cosine). 74.8839 2.3E3 87.3715 2.4E3 93.5774 2.4E3 108.9735 3.3E3 116.0944 2.8E3 141.3050 2.4E3 156.9287 2.4E3 171.1291 2.5E3 173.5262 3.4E4 173.5428 9.3E3 213.7589 2.5E3 218.7256 2.7E3 220.4082 2.4E3 245.8504 2.2E3 266.2087 2.6E3 420.2316 8.0E3 465.2184 3.0E3 477.2663 1.2E4 479.2440 2.0E4 491.2085 8.0E3 492.2129 3.0E4 493.2598 1.0E4 494.2679 1.5E4 503.2437 1.6E5 504.2473 6.7E4 505.2237 3.7E3 505.2339 2.7E3 519.2299 2.2E3 520.1314 3.0E4 521.2541 1.0E5 522.2576 1.4E4 534.2294 4.4E3 537.2500 1.9E4 547.2332 5.3E4 548.2415 7.0E3 563.2675 2.9E3 565.2444 1.6E6 566.2507 2.0E4 575.2325 3.1E3 579.2601 2.2E4 594.2807 3.5E4 607.2556 5.3E4 653.1834 9.4E3 653.2955 4.7E4 END IONS BEGIN IONS FEATURE_ID=812 PEPMASS=657.2691 SCANS=812 RTINSECONDS=969.952 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 71.3300 2.5E3 71.4537 2.6E3 72.3462 2.3E3 73.0281 4.3E4 73.0322 1.0E4 74.0468 2.4E3 77.4550 2.5E3 79.2686 2.3E3 93.7712 2.4E3 100.9274 2.2E3 113.3579 2.5E3 123.2959 2.2E3 128.4890 2.8E3 150.5723 2.4E3 173.5239 2.1E4 173.5358 5.7E4 173.5441 7.7E3 246.8581 2.6E3 276.4243 2.8E3 280.5375 2.5E3 317.2854 2.9E3 337.8051 2.7E3 439.0823 2.4E3 466.9698 3.0E3 493.7986 2.8E3 498.1982 5.4E3 541.1833 3.1E3 553.2213 4.3E4 597.2511 1.4E4 643.1121 2.5E3 653.2824 2.4E3 656.7162 2.4E3 657.2677 1.2E6 END IONS BEGIN IONS FEATURE_ID=813 PEPMASS=635.2870 SCANS=813 RTINSECONDS=970.045 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 4 (2 removed due to low quality, 0 removed due to low cosine). 65.4697 3.9E3 67.4749 4.3E3 67.4783 4.5E3 70.5850 6.6E3 70.5895 5.5E3 95.0431 2.3E3 101.3141 1.2E4 110.2588 1.2E4 140.8576 2.3E3 141.6648 2.3E3 143.8099 3.7E4 143.8233 3.2E4 173.5373 1.6E5 177.1967 2.4E3 195.6899 2.9E3 215.5670 2.5E3 226.6592 2.5E3 417.1684 4.5E3 417.2135 1.6E4 419.2237 7.6E4 431.1813 2.2E4 432.1949 4.1E3 433.2005 4.1E3 442.1751 5.3E3 445.2025 6.2E4 446.2105 1.2E5 447.2191 3.8E5 448.2260 3.2E3 459.2164 5.8E4 460.2195 1.6E4 461.1989 2.4E4 473.1997 1.6E5 474.2053 5.7E5 475.2138 1.2E6 476.2176 9.1E3 478.2321 4.4E3 487.2136 4.6E5 488.2212 8.7E4 489.2313 3.8E3 491.2449 1.9E4 501.2291 4.2E5 502.2366 3.5E4 503.2413 4.6E4 506.2335 6.2E4 507.2395 4.2E3 515.2026 6.2E3 517.2251 1.0E5 518.2309 2.0E4 519.2428 1.5E5 529.2244 2.2E5 530.2314 2.3E4 531.2412 2.1E5 532.2312 3.9E3 533.2490 6.1E4 534.2278 1.5E5 545.2237 2.5E4 546.2375 2.1E4 547.2627 1.3E6 548.2386 4.6E3 557.2215 7.3E3 560.2417 6.9E4 561.2508 6.1E5 574.9953 3.1E4 575.0545 1.2E5 575.1814 1.9E5 575.2662 1.7E7 575.4318 1.8E4 575.4803 2.4E4 576.1596 2.9E3 576.2691 2.5E5 579.2700 8.6E4 589.2461 3.9E5 592.2622 4.1E3 603.2590 1.2E5 606.2775 4.3E3 607.2911 7.1E5 620.2603 7.3E3 635.1602 2.7E3 635.1904 1.1E4 635.2874 1.1E6 END IONS BEGIN IONS FEATURE_ID=814 PEPMASS=634.2796 SCANS=814 RTINSECONDS=970.574 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 2 (0 removed due to low quality, 0 removed due to low cosine). 71.8055 2.4E3 73.4399 2.5E3 109.3131 2.6E3 129.1769 2.4E3 129.9301 2.1E3 168.2073 2.8E3 173.5250 3.5E4 173.5436 1.9E4 204.0660 3.5E3 208.5326 2.5E3 222.3264 2.7E3 237.1039 2.7E3 270.4842 2.8E3 296.7384 2.3E3 383.1642 3.0E3 412.1304 3.2E3 430.8851 2.5E3 438.1461 1.3E4 441.1693 3.0E4 445.2030 3.0E4 446.2089 3.8E3 447.2184 1.4E4 454.1781 1.4E4 459.2157 3.5E3 461.2335 2.7E3 462.6381 2.8E3 473.1350 2.2E3 473.1978 3.4E5 474.2064 6.8E4 475.2136 6.1E4 487.2128 4.0E4 500.2193 8.2E3 501.1981 6.5E4 502.2354 3.0E4 505.2254 2.2E4 506.2330 1.2E4 514.2032 3.4E3 515.2090 2.4E4 517.2205 4.6E3 519.2220 5.8E3 529.2259 1.6E4 530.2322 4.9E3 531.2379 1.5E4 533.1365 3.4E3 533.2201 4.1E5 534.2625 2.9E3 535.9294 2.7E3 546.2513 3.4E3 546.2623 2.4E3 547.2414 4.1E4 556.2154 3.2E3 559.2340 3.1E4 560.2516 3.0E3 561.2499 4.1E3 563.2568 4.5E3 573.2458 9.0E3 574.2575 8.3E4 575.2660 6.2E5 587.2288 4.2E3 591.2592 3.3E4 601.2515 3.9E3 602.2537 1.1E5 602.3542 4.5E3 605.2777 1.3E4 619.2548 4.6E4 634.2793 6.4E4 635.2911 3.5E3 END IONS BEGIN IONS FEATURE_ID=815 PEPMASS=600.4177 SCANS=815 RTINSECONDS=976.819 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 7 (2 removed due to low quality, 0 removed due to low cosine). 67.0539 5.1E4 67.5758 2.2E3 69.0333 2.8E4 69.0696 4.6E4 71.0130 2.7E3 71.0490 1.2E4 73.0645 2.8E3 77.0388 2.8E3 79.0539 8.1E4 80.0618 1.6E4 81.0645 3.9E3 81.0695 2.1E5 81.1993 2.1E3 81.6937 2.4E3 83.0445 2.5E3 83.0488 8.1E4 83.0852 4.5E4 85.0646 3.7E4 87.0437 9.7E3 89.0593 1.3E5 91.0539 8.9E4 92.0620 1.0E4 92.4242 2.2E3 93.0695 2.6E5 94.0779 5.0E3 95.0427 2.9E3 95.0488 1.4E5 95.0795 3.5E3 95.0851 1.8E5 97.0644 7.9E4 97.1010 6.0E3 98.7878 2.5E3 99.0441 7.8E3 101.0595 2.3E3 105.0695 2.8E5 106.0775 2.1E4 107.0486 3.6E3 107.0851 2.8E5 108.0932 4.7E3 109.0644 9.1E4 109.0858 2.4E3 109.1008 1.5E5 110.0722 6.5E3 111.0434 6.8E3 111.0801 3.6E4 113.0959 1.8E4 113.1817 2.2E3 114.0681 3.3E3 117.0695 6.5E4 118.0776 8.0E3 119.0755 1.0E4 119.0852 5.7E5 119.0956 1.2E4 120.0930 5.0E4 121.0646 4.0E4 121.0922 3.7E3 121.1008 2.9E5 122.0723 4.1E3 122.1051 2.9E3 123.0801 1.8E5 123.1164 3.8E4 125.0503 4.3E3 125.0593 1.8E5 125.0958 3.1E4 128.0622 1.0E4 129.0697 3.9E4 130.0774 1.5E4 131.0748 5.0E3 131.0852 2.2E5 132.0930 6.6E4 133.0647 1.4E4 133.0857 6.4E4 133.1009 3.2E5 134.1087 3.0E4 135.0802 1.1E5 135.1165 1.2E5 136.0878 9.9E3 137.0594 1.1E4 137.0957 1.2E5 138.1037 1.7E4 139.0750 2.1E4 139.1115 3.6E4 141.0696 7.0E3 142.0775 3.0E4 143.0852 2.0E5 144.0930 8.1E4 145.0650 1.4E4 145.0889 8.0E3 145.1009 5.9E5 146.0707 2.6E3 146.1082 4.1E4 147.0801 1.4E5 147.1165 1.5E5 148.0882 2.7E3 149.0959 8.6E4 149.1323 1.9E4 150.1036 1.1E4 151.0752 6.7E4 151.1117 2.1E4 151.1478 2.4E3 152.0802 2.7E3 153.0904 2.0E4 153.1256 2.4E3 154.0654 2.4E3 155.0853 5.5E4 155.1064 2.1E4 156.0929 5.9E4 157.0837 7.8E3 157.1009 3.9E5 157.1124 2.2E3 158.1085 8.3E4 159.0802 5.7E4 159.1024 5.3E3 159.1166 3.1E5 160.0878 5.9E4 160.1236 2.3E4 160.3652 2.5E3 161.0960 9.4E4 161.1323 8.0E4 162.1026 6.8E3 163.1115 2.8E5 165.0908 4.2E5 166.0943 5.1E4 167.0857 1.1E4 167.1066 5.0E3 168.0933 8.6E3 169.1011 1.4E5 169.3143 2.3E3 170.1087 4.7E4 171.0808 1.0E4 171.1167 2.6E5 172.1243 6.2E4 173.0962 6.0E4 173.1324 1.9E5 173.5211 4.5E4 173.5396 9.9E4 174.1039 3.1E3 174.1387 2.8E3 175.1116 8.4E4 175.1264 2.5E3 175.1482 1.0E5 176.1179 6.1E3 176.6667 2.7E3 177.0909 2.6E4 177.1272 4.4E4 178.0987 1.9E4 179.0870 1.2E4 179.1064 2.0E4 179.1429 1.1E4 180.0937 5.8E3 180.1142 2.6E4 181.1016 5.9E4 181.1222 1.9E5 182.1090 3.0E4 183.1167 1.9E5 184.1237 3.8E4 185.0961 2.5E4 185.1324 1.9E5 185.1510 2.6E3 186.1397 2.9E4 187.1116 4.9E4 187.1480 8.6E4 189.1272 8.1E4 189.1642 3.2E3 190.1350 7.7E4 191.1068 3.5E4 191.1429 6.8E4 192.1511 3.7E3 193.1020 3.7E4 193.1223 1.2E5 194.1087 1.8E4 195.1167 1.3E5 195.1368 2.3E4 196.1243 4.7E4 197.0988 4.3E3 197.1128 4.3E3 197.1324 2.0E5 198.1053 3.1E3 198.1397 3.0E4 199.1118 5.2E4 199.1480 7.8E4 200.1182 9.7E3 200.1560 5.8E3 201.1274 6.0E4 201.1636 3.6E4 203.1081 4.6E3 203.1430 2.1E5 203.4512 2.5E3 204.1472 3.0E4 205.1234 2.9E3 205.1586 1.0E4 206.1101 5.4E3 207.1167 5.9E4 207.1381 7.8E4 208.1245 2.1E4 208.1454 3.3E4 209.0970 3.4E3 209.1324 1.7E5 209.1538 5.3E3 210.1398 2.4E4 211.1118 2.8E4 211.1482 1.5E5 212.1187 3.1E3 212.1551 2.6E4 213.1275 5.1E4 213.1636 3.5E4 214.1349 1.0E4 215.1069 9.5E3 215.1429 4.5E4 216.1503 2.5E4 217.1217 1.0E4 217.1586 2.6E4 219.1166 8.5E3 219.1382 5.5E4 220.1245 5.3E3 220.1453 2.9E3 221.1322 6.0E4 221.1537 4.6E5 221.1784 5.0E3 222.1573 6.3E4 223.1118 7.5E3 223.1481 9.8E4 224.1563 1.4E4 225.1274 3.6E4 225.1638 6.6E4 226.1359 6.6E3 226.1713 4.9E3 227.1429 3.4E4 227.1797 9.2E3 228.1499 4.1E3 229.1584 3.4E4 229.1910 2.7E3 230.1641 2.9E3 231.1385 2.4E4 231.1736 7.5E3 233.1143 3.9E3 233.1331 3.4E3 233.1543 3.7E4 234.1396 3.5E3 234.1614 9.8E4 235.1482 5.5E4 236.1551 2.8E3 237.1269 2.2E4 237.1639 6.4E4 238.1714 8.9E3 239.1434 1.9E4 239.1792 4.7E4 240.1874 2.3E4 241.1590 1.8E4 241.1957 6.5E3 243.1384 1.4E4 243.1731 7.9E3 245.1545 9.5E3 247.1476 1.6E4 247.1695 1.2E5 248.1763 2.0E4 249.1640 4.1E4 250.1719 3.6E3 251.1423 1.0E4 251.1796 3.3E4 252.1868 3.2E3 253.1582 2.9E4 253.1952 9.9E3 255.1738 1.0E4 257.1532 6.9E3 257.1884 9.3E3 259.1699 3.2E4 259.2044 9.0E3 260.1763 3.5E3 261.1613 1.7E4 261.1881 8.4E3 263.1471 7.5E3 263.1794 4.0E4 264.1852 3.3E3 265.1606 1.3E4 265.1950 3.0E4 266.2028 2.6E3 267.1747 2.2E4 267.2113 8.7E3 269.1558 1.5E4 269.1889 2.1E4 270.1977 4.5E3 271.1693 3.1E4 271.2061 6.2E3 273.1867 1.9E4 274.1933 7.4E4 275.1790 1.9E4 277.1586 3.1E3 277.1958 1.9E4 279.1743 2.2E4 279.2098 9.7E3 281.1902 3.2E4 283.1693 6.6E3 283.2059 8.3E3 285.1865 2.9E4 285.2209 9.8E3 286.1929 4.5E4 287.2005 9.0E4 288.2043 6.0E3 289.1969 7.7E3 291.2096 6.0E3 293.1905 4.1E3 294.5488 3.0E3 296.2124 3.4E3 297.1855 3.0E4 297.2213 1.5E4 298.1942 4.4E3 299.2009 1.1E5 300.2093 1.9E4 303.2093 9.0E3 304.2011 2.3E3 305.2258 4.9E3 307.2055 1.3E4 309.1838 6.3E3 310.1917 3.7E3 311.2009 2.6E4 312.2081 4.1E4 313.2159 8.3E4 319.2066 6.3E3 323.1990 2.8E3 323.2382 2.3E4 325.2165 9.7E4 326.2228 3.4E3 327.2329 2.4E4 329.2240 3.4E3 337.2164 5.1E4 338.2614 6.9E4 339.2315 3.4E4 340.2399 1.7E5 347.2384 2.7E3 351.2306 3.4E3 352.2397 1.2E5 353.2436 3.9E3 363.5620 3.4E3 365.2476 5.9E4 377.2446 5.1E3 379.2637 1.0E4 387.2533 9.2E3 391.2652 7.4E3 405.2777 6.4E3 413.2699 2.9E4 419.2948 7.9E3 420.3027 1.5E4 425.2692 1.1E5 426.2764 1.6E4 427.2856 9.2E4 430.3243 3.0E4 440.2928 1.7E5 470.6750 3.0E3 476.3657 1.4E4 487.3156 2.7E3 505.3325 1.3E4 507.3471 3.2E3 508.3500 1.1E4 520.3531 2.0E4 564.3828 2.8E3 568.4301 2.0E4 585.3954 6.8E3 600.4187 7.4E3 END IONS BEGIN IONS FEATURE_ID=816 PEPMASS=653.2973 SCANS=816 RTINSECONDS=977.314 CHARGE=1+ MSLEVEL=2 MERGED_STATS=1 / 1 (0 removed due to low quality, 0 removed due to low cosine). 75.1234 2.3E3 112.7680 2.3E3 166.0646 2.6E3 173.5212 8.8E3 173.5399 1.9E4 175.2823 2.5E3 185.4997 2.3E3 217.4010 2.3E3 405.2144 3.4E3 420.2310 8.6E4 421.2401 7.4E3 424.2262 5.2E3 433.2418 5.7E3 434.2447 9.4E3 447.2161 3.2E3 448.2205 7.7E3 449.2344 2.1E4 452.2194 2.5E4 459.2187 1.5E4 460.2254 3.7E4 461.2398 3.5E3 462.2047 1.1E4 463.2115 2.8E3 465.2278 2.0E4 475.2135 3.0E4 476.2206 1.9E4 477.1487 3.9E3 477.2282 1.1E5 488.2220 2.9E3 489.2325 4.6E3 491.2304 2.7E3 492.2510 4.3E4 501.2244 5.3E3 502.2311 9.0E3 503.2422 1.9E4 504.2556 3.2E3 507.2410 2.8E3 518.2313 1.4E4 521.2178 5.7E4 521.2929 7.8E3 535.2332 3.0E4 536.2415 4.0E4 537.2475 4.4E3 547.2507 3.5E3 549.2852 2.7E4 551.2629 7.5E3 561.2513 3.2E3 563.2695 6.4E3 575.2646 9.1E3 576.2689 1.6E4 577.2791 1.7E4 593.2742 6.0E3 607.2888 5.1E3 608.2955 7.7E3 621.2689 4.4E3 636.2927 1.0E4 END IONS BEGIN IONS FEATURE_ID=817 PEPMASS=824.5523 SCANS=817 RTINSECONDS=979.246 CHARGE=1+ MSLEVEL=2 MERGED_STATS=8 / 8 (0 removed due to low quality, 0 removed due to low cosine). 73.0282 3.6E3 73.5804 4.3E3 74.4899 2.8E3 75.1705 2.6E3 77.0384 1.1E4 79.0538 4.5E5 81.0332 5.1E4 81.0695 6.8E5 83.0488 6.9E4 83.0852 1.3E5 85.0282 5.2E4 85.0646 3.9E4 86.5343 2.3E3 87.0436 2.2E3 88.7152 2.8E3 90.1631 2.1E3 91.0388 9.0E3 91.0485 3.1E3 91.0539 3.1E5 93.0695 6.0E5 95.0489 6.9E4 95.0852 6.0E5 95.6265 2.4E3 97.0280 4.9E4 97.0645 7.5E4 97.1009 6.2E4 98.6786 2.6E3 99.0436 4.0E3 99.0802 3.5E4 99.1511 2.8E3 100.4730 2.4E3 103.1380 2.4E3 103.1704 2.3E3 105.0695 3.2E5 107.0487 2.0E4 107.0852 4.1E5 109.0645 3.9E4 109.0928 3.6E3 109.1008 3.5E5 111.0431 3.2E3 111.0802 3.8E4 111.9063 2.2E3 113.0964 3.7E3 115.0543 4.1E3 117.0618 2.6E3 117.0695 1.5E5 119.0757 2.8E3 119.0852 3.8E5 121.0642 1.3E4 121.0914 1.2E4 121.1008 4.4E5 122.3534 2.7E3 123.0800 3.8E4 123.1165 1.0E5 125.0958 3.3E4 125.1957 2.3E3 127.0386 2.8E4 129.0542 1.6E4 129.0696 6.1E4 131.0749 3.1E3 131.0852 2.6E5 132.1246 2.4E3 133.0645 8.1E3 133.0905 4.6E3 133.1009 4.5E5 133.1128 4.9E3 135.0802 3.7E4 135.1166 3.1E5 137.0958 4.0E4 137.1322 1.7E4 137.7774 2.4E3 138.9001 2.4E3 139.1116 1.8E4 139.6448 2.4E3 141.0695 6.1E3 143.0854 6.1E4 145.1009 2.6E5 145.1633 2.3E3 147.0803 6.2E3 147.1041 2.6E3 147.1165 3.4E5 149.0958 4.7E4 149.1322 2.0E5 151.1118 2.0E4 155.0841 5.8E3 155.1063 1.0E4 157.1008 1.0E5 158.2993 2.3E3 159.0811 2.6E3 159.1166 2.9E5 161.0966 1.1E4 161.1323 2.2E5 163.1118 3.0E4 163.1478 5.3E4 165.1273 5.8E3 169.1009 2.0E4 169.2522 2.5E3 171.1018 2.5E3 171.1167 1.2E5 173.1178 3.2E3 173.1324 1.8E5 173.5191 2.2E4 173.5332 2.3E5 173.5462 7.6E3 174.8505 2.5E3 175.1121 3.4E3 175.1480 8.0E4 177.1276 2.3E4 179.1428 5.4E3 183.1169 3.8E4 185.1325 1.0E5 187.1479 6.7E4 189.1636 1.0E4 191.1427 4.2E3 193.6879 2.3E3 195.1383 6.7E3 197.1325 2.7E4 199.1480 7.3E4 201.1640 3.2E4 202.2376 2.9E3 203.1430 8.0E3 205.1576 2.8E3 211.1486 1.0E4 213.1638 3.1E4 217.1581 1.0E4 219.1744 9.4E3 224.3697 2.4E3 229.1959 7.5E3 231.1728 2.4E3 231.2105 2.9E4 234.4676 2.3E3 235.1711 3.9E3 239.1787 1.6E4 241.1950 1.4E5 243.2109 2.5E4 257.1898 4.3E4 259.2054 4.1E5 261.2210 8.3E4 271.7361 2.8E3 275.2012 7.0E4 277.2163 1.2E4 277.6296 2.9E3 277.6394 3.2E3 289.2147 2.5E3 293.2118 8.7E4 294.8957 2.7E3 296.7598 2.5E3 307.2671 2.6E3 310.2440 2.5E3 315.2320 2.5E4 323.0296 2.5E3 323.5420 2.6E3 333.2425 1.9E5 335.2582 4.6E5 336.2625 2.7E3 337.2651 3.5E3 349.2361 3.1E3 412.6738 2.7E3 416.8531 2.7E3 471.0158 2.3E3 480.1902 2.5E3 525.7731 2.3E3 535.6514 2.5E3 539.4589 2.7E3 559.2403 2.4E3 569.4140 3.4E3 611.4657 1.4E4 632.2296 3.1E3 651.0586 2.8E3 728.5739 2.6E3 751.9543 3.0E3 771.8162 2.9E3 END IONS BEGIN IONS FEATURE_ID=818 PEPMASS=829.5074 SCANS=818 RTINSECONDS=979.463 CHARGE=1+ MSLEVEL=2 MERGED_STATS=9 / 9 (0 removed due to low quality, 0 removed due to low cosine). 73.0281 2.2E4 73.7910 2.1E3 73.8952 2.4E3 78.1534 3.9E3 78.1579 4.7E3 78.9919 2.5E3 79.0538 2.1E4 81.0330 1.3E4 81.0694 5.6E4 81.2717 2.3E3 82.6008 3.6E3 82.6044 2.6E4 83.0852 5.1E3 83.3959 2.2E3 85.0278 4.5E4 85.1593 2.1E3 87.0508 2.6E4 87.0539 3.5E3 87.9795 2.8E3 89.3932 2.2E3 90.3843 2.4E3 90.9158 2.8E3 91.0385 4.1E4 91.0540 8.6E3 93.0694 3.2E4 94.9855 2.3E3 95.0850 3.9E4 97.0281 5.7E4 97.0892 2.8E3 99.0435 3.2E3 101.0227 1.1E4 101.8608 2.8E3 103.0382 3.6E3 105.0696 1.4E4 105.3823 2.2E3 106.1081 2.3E3 106.9072 2.4E3 106.9316 2.6E3 107.0852 1.9E4 107.5678 2.5E3 108.4579 2.4E3 109.0279 2.7E3 109.1008 2.5E4 109.7366 2.4E3 114.1872 2.3E3 118.1819 2.1E3 119.0848 2.6E3 120.8695 2.2E3 121.1003 2.5E4 123.1172 9.1E3 127.0384 2.2E4 127.2187 2.5E3 133.1009 3.2E3 135.1159 1.4E4 145.1014 2.7E3 147.1160 8.2E3 147.6490 2.5E3 149.1327 9.2E3 149.6815 7.0E3 149.6915 1.0E4 153.3261 2.4E3 154.1302 2.9E3 159.0654 2.5E3 159.1162 3.7E3 161.1325 5.5E3 161.5265 2.6E3 163.5646 2.1E3 167.1063 2.3E3 171.1158 2.8E3 173.1319 3.1E3 173.5234 3.4E4 173.5342 1.8E5 173.5434 1.2E4 173.9438 2.5E3 181.3383 2.4E3 183.6372 2.5E3 185.0418 7.4E4 190.0449 2.3E3 201.0358 1.3E4 203.0517 7.4E3 220.5653 2.4E3 226.8842 2.5E3 227.1288 2.5E3 241.0677 1.0E4 243.0835 9.4E4 247.1299 2.5E4 259.8218 2.9E3 261.2203 1.0E4 287.1619 2.1E4 301.0893 6.8E4 306.7919 2.5E3 313.0902 2.9E3 315.1049 5.1E4 315.1925 2.7E3 327.1032 3.0E3 327.2281 2.8E3 331.1879 9.0E3 333.2030 5.8E4 335.2575 6.1E4 339.6160 2.7E3 343.1406 3.3E3 351.0359 2.3E3 355.1361 3.5E3 357.1514 5.3E3 359.9273 2.6E3 369.1506 1.1E4 371.1676 6.9E4 373.1107 5.8E4 379.3342 2.8E3 383.1678 1.0E4 385.1833 3.6E4 387.1264 9.4E3 413.1801 5.4E3 415.0974 2.6E3 423.1993 2.7E4 425.1782 1.1E5 425.2166 1.7E4 429.1730 2.5E4 430.6182 3.0E3 435.7151 2.3E3 439.1857 2.6E3 443.1895 1.3E4 453.2063 4.2E3 454.7294 2.8E3 457.2053 1.2E4 463.2259 9.5E3 465.2096 1.9E5 469.2035 1.6E4 469.3326 2.3E3 470.9035 2.4E3 473.8995 2.7E3 475.2300 2.9E3 483.2172 1.0E4 483.3445 3.3E3 493.2339 3.4E3 497.2359 6.2E3 497.3106 4.5E3 505.2406 1.2E5 509.2357 1.6E4 519.2927 1.0E6 520.2959 1.8E4 521.2980 2.1E4 523.2532 5.7E3 523.3491 2.5E3 533.2706 6.5E4 534.0808 2.5E3 537.2618 8.3E3 541.3558 4.4E3 549.2687 7.5E3 551.2822 1.2E5 553.2970 9.9E3 563.2772 3.2E3 563.3713 4.0E3 581.3815 1.0E4 591.3149 2.0E5 593.3260 1.0E4 597.4636 2.6E3 605.3298 4.8E4 607.3502 2.8E3 613.4908 2.6E3 619.3459 2.6E4 626.5969 2.4E3 633.3588 5.8E4 636.8063 2.9E3 639.3459 2.5E3 647.3745 6.7E4 649.4414 2.4E3 661.3913 5.5E4 673.3810 7.4E3 687.3987 7.4E3 691.4053 6.0E3 701.4223 1.1E5 703.2628 5.1E3 703.4022 5.0E5 713.4209 1.5E4 715.4464 3.2E3 726.4763 2.7E3 731.4275 1.6E4 741.4530 2.6E4 743.2746 3.6E3 743.4331 8.2E5 743.5887 4.8E3 744.4056 3.0E3 749.4306 2.9E3 755.4679 2.1E4 783.2975 4.2E3 783.4639 5.7E5 811.4960 7.3E4 829.5039 1.7E5 END IONS BEGIN IONS FEATURE_ID=819 PEPMASS=599.4103 SCANS=819 RTINSECONDS=980.398 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 67.0540 1.4E4 69.0333 1.0E4 69.0696 9.5E3 70.3302 2.2E3 71.0490 5.2E3 71.9338 2.2E3 79.0540 1.6E4 81.0696 4.4E4 81.8020 2.1E3 83.0488 1.0E4 83.0853 2.0E4 84.6230 2.3E3 85.0645 1.1E4 85.3098 2.2E3 87.0437 4.9E3 89.0596 2.5E3 91.0540 1.2E4 93.0695 7.8E4 95.0488 2.1E4 95.0852 5.8E4 95.9713 2.4E3 97.0645 4.4E4 105.0695 4.8E4 107.0852 7.4E4 109.0646 2.3E4 109.1009 3.6E4 111.0803 1.2E4 113.0957 2.2E4 117.0697 8.4E3 119.0852 9.2E4 121.0644 1.2E4 121.1009 9.6E4 123.0801 5.1E4 123.1165 5.4E3 125.0596 2.1E4 125.0960 1.5E4 129.0690 6.1E3 131.0853 3.5E4 133.0645 2.9E3 133.1009 5.9E4 134.7551 2.5E3 135.0802 3.4E4 135.1165 3.4E4 137.0596 6.0E3 137.0957 5.0E4 139.0753 1.1E4 139.1113 2.3E4 141.4513 2.4E3 143.0853 3.6E4 144.0935 3.7E3 145.1009 9.8E4 147.0802 8.3E4 147.1163 3.3E4 149.0957 1.9E4 151.0751 6.2E4 151.1113 7.5E3 153.0900 2.9E3 153.1270 9.2E3 155.0853 1.4E4 155.1063 1.4E4 156.0931 8.1E3 157.1009 9.7E4 158.1087 3.5E3 159.0800 6.6E3 159.1166 6.3E4 161.0960 3.1E4 161.1323 3.1E4 163.1116 5.0E4 164.9971 2.3E3 165.0909 3.4E5 167.1067 1.4E4 169.1010 3.4E4 170.1090 7.8E3 171.0797 2.9E3 171.1167 6.6E4 172.2615 2.5E3 173.0962 1.8E4 173.1326 3.5E4 173.5281 4.3E4 173.5451 9.0E3 175.1113 2.0E4 175.1479 2.2E4 177.0906 8.3E3 177.1268 1.2E4 179.1430 1.4E4 181.1017 1.3E4 181.1223 3.8E4 182.1078 3.3E3 183.1167 5.3E4 185.0963 2.9E3 185.1323 5.0E4 187.1112 1.4E4 187.1479 1.8E4 189.1275 2.9E4 191.1062 1.4E4 191.1425 7.4E3 193.1017 6.7E3 193.1219 3.2E3 195.1167 3.3E4 195.1376 1.5E4 196.1250 7.4E3 197.1325 5.0E4 199.1116 9.7E3 199.1484 1.2E4 201.1276 1.1E4 203.1431 1.5E5 203.1644 3.7E3 205.1584 7.1E3 207.1170 1.7E4 207.1381 3.7E4 208.1249 9.0E3 209.1325 3.7E4 211.1124 8.5E3 211.1484 3.4E4 213.1276 1.1E4 213.1637 3.8E3 215.1436 1.0E4 217.1236 4.9E3 219.3885 2.5E3 220.1245 3.3E3 221.1333 1.4E4 221.1537 3.3E5 222.1404 4.0E3 223.1484 2.5E4 225.1277 4.9E3 225.1642 1.1E4 227.1426 7.0E3 227.1804 3.2E3 229.1221 6.2E3 229.1587 1.5E4 231.1395 3.1E3 233.1306 3.6E3 233.1539 1.4E4 235.1481 1.8E4 237.1270 6.8E3 237.1644 1.3E4 239.1411 4.6E3 241.1585 6.6E3 243.1742 3.7E3 245.1542 3.5E3 247.1455 2.6E3 247.1693 5.7E4 248.1538 3.1E3 249.1650 8.1E3 251.1445 4.5E3 251.1790 8.7E3 255.1384 2.6E3 261.1609 3.3E3 261.1881 3.2E3 263.1804 4.3E3 265.1954 3.1E3 267.1746 3.7E3 269.1910 5.4E3 271.1707 4.1E3 275.1786 4.0E3 279.1754 3.2E3 281.1904 8.3E3 283.1716 2.9E3 285.1847 1.9E4 286.1936 2.1E4 287.2008 5.0E4 289.1955 4.3E3 291.1773 3.5E3 293.1915 2.6E3 297.1843 3.1E3 298.1937 8.4E3 299.2009 3.0E4 311.2020 9.2E3 312.2070 8.8E3 313.2163 1.5E4 325.2171 1.0E4 327.2323 1.5E4 347.2357 3.4E3 347.5928 2.7E3 364.2396 6.1E3 365.2481 1.6E4 387.2586 2.8E3 391.2625 8.6E3 413.2706 1.7E4 419.2966 8.5E3 426.8123 2.5E3 427.2846 1.7E4 441.9625 2.3E3 453.2972 2.7E3 507.3472 4.8E4 519.3478 4.8E3 527.4471 2.7E3 599.4109 1.2E4 END IONS BEGIN IONS FEATURE_ID=820 PEPMASS=780.5537 SCANS=820 RTINSECONDS=980.842 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 5 (0 removed due to low quality, 0 removed due to low cosine). 71.0726 7.5E3 71.3240 2.3E3 71.3817 2.2E3 73.5277 2.2E3 73.8543 2.5E3 77.6908 2.2E3 81.0694 1.1E4 82.0327 2.3E3 82.2619 2.3E3 82.4598 2.9E3 85.6959 2.4E3 86.0961 2.8E5 87.8644 2.3E3 91.3257 2.7E3 95.0853 3.9E3 97.0610 2.3E3 98.9839 7.7E3 101.7824 2.6E3 104.1068 2.4E4 104.8966 2.5E3 124.6083 2.3E3 124.9996 1.1E5 146.9815 1.2E5 173.5206 1.3E4 173.5319 1.4E5 180.3097 2.7E3 184.0352 3.8E3 184.0733 2.3E6 195.3660 2.4E3 201.5991 2.4E3 216.8859 2.5E3 217.5763 2.1E3 220.3674 3.1E3 231.4682 2.3E3 232.0138 2.5E3 235.3181 2.3E3 262.2534 1.5E4 278.8469 2.3E3 299.3138 2.5E3 326.5239 2.7E3 359.0281 3.4E3 374.6740 2.9E3 476.1272 2.5E3 490.6158 2.6E3 553.6021 2.9E3 575.5035 1.4E4 597.4869 2.8E4 648.0811 2.5E3 700.4622 2.9E3 END IONS BEGIN IONS FEATURE_ID=821 PEPMASS=535.2705 SCANS=821 RTINSECONDS=980.994 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 2 (0 removed due to low quality, 0 removed due to low cosine). 69.7821 2.2E3 121.5463 2.7E3 138.5106 2.5E3 173.5165 2.6E3 173.5294 6.6E4 173.5460 8.1E3 208.6768 3.0E3 213.7012 2.3E3 240.2592 3.4E3 279.2464 2.4E3 280.2612 2.6E3 294.9753 2.4E3 304.3607 2.2E3 405.2065 2.9E3 433.2012 1.3E4 434.2452 3.5E4 435.2542 9.8E4 447.2175 7.4E4 448.2210 1.8E4 461.2329 2.8E4 462.2362 8.1E4 463.2853 1.9E4 489.2556 3.0E3 489.2666 3.4E3 500.4920 3.1E3 506.2311 4.5E4 507.2747 2.4E5 517.2604 1.7E4 520.2452 1.8E4 535.2695 1.8E6 535.5164 3.6E3 END IONS BEGIN IONS FEATURE_ID=822 PEPMASS=827.4919 SCANS=822 RTINSECONDS=981.214 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 5 (0 removed due to low quality, 0 removed due to low cosine). 73.0279 1.3E4 75.5852 2.2E3 79.0539 2.9E4 81.0331 7.9E3 81.0694 6.3E4 82.9281 2.8E3 82.9868 2.1E3 83.0492 2.7E3 83.0852 1.4E4 85.0279 3.5E4 87.0437 2.4E3 90.1687 2.3E3 91.0385 2.4E4 91.0537 1.5E4 93.0694 3.7E4 95.0851 5.8E4 97.0280 3.1E4 97.0640 3.4E3 98.6590 2.4E3 99.0436 3.0E3 102.4414 2.5E3 105.0693 1.5E4 107.0850 2.6E4 109.0277 3.1E3 109.0640 3.2E3 109.1006 3.1E4 117.0694 4.2E3 119.0851 1.8E4 121.1008 3.0E4 121.6664 2.4E3 123.1161 6.4E3 125.0957 2.5E3 127.0384 1.8E4 131.0853 1.2E4 133.1008 3.1E4 135.1165 2.2E4 145.1008 3.5E3 147.1162 1.7E4 149.1320 1.3E4 149.6832 5.6E3 149.6936 4.5E3 159.1161 6.3E3 161.1321 3.6E3 167.6153 2.6E3 173.1321 8.0E3 173.5370 1.0E5 175.6691 2.6E3 179.5064 2.9E3 183.4600 2.4E3 184.0732 2.8E3 185.0423 2.1E4 188.5969 2.5E3 193.1215 8.1E3 195.5787 2.8E3 213.3290 2.3E3 217.5463 3.2E3 237.0455 2.4E3 243.0838 4.2E4 260.2089 2.9E3 261.2241 2.9E3 270.1804 3.3E3 273.1794 3.0E3 275.2011 2.8E3 313.1769 7.3E4 331.1878 2.1E5 335.2583 3.5E4 337.2732 2.8E4 338.2760 1.4E4 386.3588 2.3E3 387.2142 2.9E3 397.8145 2.6E3 451.1938 5.7E4 488.2908 2.7E3 491.2221 6.8E3 495.4072 2.4E3 506.8096 2.4E3 519.2925 5.6E5 519.3824 4.4E3 531.2561 1.5E5 532.4124 3.5E3 549.2668 1.4E5 591.3140 3.9E4 595.6996 2.6E3 633.3608 2.8E3 646.9890 3.2E3 647.4229 6.9E3 665.4358 9.5E3 691.6677 3.0E3 715.4000 1.5E4 729.4162 9.9E4 757.4139 3.2E3 759.5660 2.8E3 769.4483 6.8E3 799.4988 3.2E3 809.4800 2.3E5 827.4891 2.3E5 END IONS BEGIN IONS FEATURE_ID=823 PEPMASS=870.5657 SCANS=823 RTINSECONDS=982.044 CHARGE=1+ MSLEVEL=2 MERGED_STATS=1 / 1 (0 removed due to low quality, 0 removed due to low cosine). 78.3716 2.2E3 81.6430 2.7E3 173.5312 3.2E4 191.6997 3.3E3 459.2176 4.0E4 460.2249 2.0E4 461.2341 3.2E3 491.2462 3.7E3 492.2509 1.7E4 503.2417 5.4E3 505.2239 8.0E3 516.2503 6.5E3 519.2379 5.3E4 520.2463 1.6E4 531.2380 6.8E4 532.2462 1.3E4 533.2537 5.7E4 548.2660 4.5E3 560.2392 7.7E3 577.2419 8.9E3 591.2600 3.7E4 592.1577 4.1E3 592.2673 9.0E4 593.2762 8.4E3 832.4004 2.7E3 870.5668 6.7E3 END IONS BEGIN IONS FEATURE_ID=824 PEPMASS=584.4224 SCANS=824 RTINSECONDS=982.855 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 5 (0 removed due to low quality, 0 removed due to low cosine). 63.2037 2.3E3 65.0387 3.1E3 65.5617 2.2E3 65.8456 2.4E3 66.2403 2.6E3 67.0541 3.2E4 69.0334 1.8E4 69.0697 4.5E4 73.0281 1.0E4 79.0540 5.0E4 80.0620 2.4E4 81.0697 1.6E5 83.0489 2.9E4 83.0854 2.8E4 85.0646 2.0E4 87.0438 1.4E4 89.0594 2.7E5 90.9764 2.3E3 91.0541 5.5E4 91.8154 2.5E3 92.0620 4.4E3 93.0696 2.1E5 94.0780 1.1E4 95.0490 6.0E4 95.0853 1.5E5 96.0886 3.6E3 97.0647 2.9E4 105.0696 2.2E5 106.0776 3.0E4 107.0853 2.1E5 108.0882 2.7E3 109.0646 4.9E4 109.1009 1.1E5 111.0802 1.6E4 115.8673 2.4E3 117.0697 4.5E4 118.0772 4.1E3 119.0756 7.3E3 119.0853 4.2E5 120.0931 3.1E4 121.0646 2.2E4 121.0917 8.8E3 121.1009 2.8E5 122.0720 2.9E3 122.1044 8.3E3 122.4726 2.7E3 123.0802 1.5E5 123.1166 3.3E4 125.0596 4.3E4 125.0960 3.8E3 129.0696 3.1E4 131.0853 1.8E5 132.0931 5.4E4 133.0650 6.8E3 133.0858 1.3E5 133.1010 2.8E5 134.1076 1.7E4 135.0802 8.1E4 135.1166 1.1E5 136.0878 4.1E3 136.1205 2.4E3 137.0602 6.6E3 137.0959 9.1E4 138.1038 2.8E4 139.0752 3.0E4 139.1115 1.6E4 142.0776 2.3E4 143.0853 1.7E5 144.0929 7.3E4 145.0887 4.4E3 145.1010 5.4E5 145.1203 3.5E3 146.1072 4.1E4 147.0802 1.3E5 147.1166 1.4E5 148.0880 8.4E3 148.1211 3.6E3 149.0960 6.7E4 149.1323 1.7E4 150.1023 3.1E3 151.0752 8.5E4 151.0893 2.3E3 151.1117 3.1E4 152.0815 2.8E3 153.0905 1.3E4 154.5883 2.5E3 155.0854 3.8E4 156.0931 4.3E4 157.1009 4.0E5 157.1165 2.8E3 158.1086 1.3E5 159.0803 3.3E4 159.1167 3.2E5 160.1230 2.9E4 161.0959 7.7E4 161.1323 9.6E4 162.1033 8.3E3 163.1116 1.3E5 164.1175 3.6E3 165.0909 4.8E5 166.0943 2.1E4 167.0857 6.5E3 167.1068 3.1E4 168.0932 3.8E3 169.1011 1.0E5 170.1085 4.9E4 171.1168 2.5E5 172.1242 8.1E4 173.0960 4.2E4 173.1325 1.8E5 173.5287 1.2E5 173.5399 2.8E4 173.7299 2.7E3 174.1389 3.3E4 175.1117 8.5E4 175.1480 1.0E5 176.1192 1.3E4 177.0911 2.4E4 177.1115 2.1E4 177.1276 3.9E4 177.4812 3.0E3 178.0983 1.9E4 179.0856 2.8E3 179.1064 5.9E3 180.1144 5.0E4 181.1012 5.0E4 181.1222 8.4E4 182.1079 2.0E4 182.1417 2.5E3 183.1168 1.6E5 184.1239 3.3E4 185.0958 1.8E4 185.1148 4.3E3 185.1324 1.8E5 186.1037 3.6E3 186.1389 3.7E4 187.1118 4.5E4 187.1480 9.2E4 188.1189 6.5E3 189.1273 8.7E4 190.1351 1.1E5 191.1065 4.2E4 191.1430 6.6E4 193.1021 2.6E4 193.1223 7.8E4 194.1089 1.1E4 195.1168 1.1E5 195.1366 2.0E4 196.1235 3.8E4 197.0970 8.6E3 197.1323 1.6E5 198.1038 1.1E4 198.1388 3.8E4 199.1121 4.2E4 199.1478 6.6E4 200.1193 2.8E3 200.1551 7.1E3 201.1274 5.0E4 201.1637 4.2E4 203.1095 4.5E3 203.1430 2.9E5 204.1470 1.9E4 205.1228 3.9E3 207.1164 4.7E4 207.1382 1.0E5 208.1239 2.4E4 208.1455 5.8E4 209.1325 1.4E5 209.1529 1.3E4 210.1390 3.7E4 211.1120 2.9E4 211.1482 1.2E5 212.1199 4.1E3 212.1546 2.0E4 213.1274 3.8E4 213.1642 4.0E4 214.1338 7.3E3 214.1713 2.5E3 215.1431 2.7E4 216.1509 1.3E4 217.1221 3.6E3 217.1588 2.0E4 219.1169 7.3E3 219.1381 4.4E4 220.1476 2.8E3 221.1328 5.0E4 221.1538 5.7E5 222.1370 8.6E3 222.1586 1.5E4 223.1481 1.0E5 224.1174 2.5E3 224.1541 1.9E4 225.1276 3.3E4 225.1638 6.6E4 226.1714 5.9E3 227.1435 3.3E4 227.1789 2.2E4 229.1220 3.1E3 229.1589 2.8E4 231.1377 1.5E4 233.1312 1.6E4 233.1545 3.0E4 234.1384 6.0E3 234.1612 9.1E4 235.1480 4.4E4 236.1540 1.3E4 237.1272 3.4E4 237.1635 5.7E4 238.1694 2.3E4 239.1434 2.1E4 239.1796 3.5E4 239.8537 2.4E3 241.1583 2.6E4 241.1953 1.0E4 243.1390 9.1E3 243.1727 3.1E3 244.1446 2.9E3 245.1545 2.4E4 247.1453 1.4E4 247.1694 1.1E5 248.1541 4.0E3 249.1633 4.7E4 250.1695 4.1E3 251.1444 1.7E4 251.1790 4.6E4 252.1479 5.5E3 252.1848 2.6E3 253.1588 3.0E4 253.1927 1.2E4 255.1740 1.8E4 256.1798 3.1E3 257.1537 3.7E3 257.1895 2.5E3 259.1450 3.1E3 259.1692 8.9E4 259.2012 3.4E3 260.1776 1.6E4 261.1612 1.2E4 261.1859 1.3E4 263.1438 9.4E3 263.1788 3.9E4 264.1541 2.8E3 264.1856 2.8E3 265.1589 1.4E4 265.1948 3.4E4 266.2027 6.9E4 267.1741 2.7E4 268.1802 6.8E3 269.1561 1.1E4 269.1896 1.8E4 271.1693 3.3E4 272.1775 1.0E4 273.1859 2.9E4 274.1930 7.1E4 275.1789 1.2E4 277.1602 9.3E3 277.1944 1.4E4 279.1752 1.8E4 279.2101 1.1E4 281.1904 3.4E4 283.2059 1.1E4 283.2825 2.6E3 285.1852 4.6E4 286.1924 7.0E4 287.2006 1.9E5 289.1967 1.0E4 291.1742 5.3E3 291.2103 1.2E4 293.1897 9.4E3 295.1695 3.2E3 296.1776 3.2E3 296.2144 3.8E3 297.1848 3.4E4 297.2217 1.1E4 298.1915 3.0E3 299.2006 7.4E4 300.2078 3.5E4 307.2004 3.1E3 308.4910 2.7E3 309.1851 2.5E4 309.2219 1.8E4 310.1927 2.0E4 311.2012 2.6E4 312.2081 2.2E4 312.2471 7.6E3 313.2164 2.5E4 315.2087 3.0E3 319.2063 2.8E4 323.1999 7.1E3 325.2160 5.9E4 326.2253 2.8E3 333.2188 5.0E3 334.2277 3.6E3 335.2366 3.0E3 337.2164 1.3E5 338.2224 3.3E3 339.2315 1.9E4 347.2373 7.9E3 348.2456 3.6E3 349.2138 3.9E3 350.2251 2.8E3 351.2313 3.4E4 352.2397 2.8E5 353.2470 7.4E4 354.2522 1.7E4 363.2318 3.6E3 364.2379 6.5E3 365.2472 1.8E5 366.2559 5.4E4 375.9521 2.7E3 383.2578 1.2E4 391.2652 3.4E3 397.2737 2.9E4 398.2822 1.6E4 404.3077 2.6E4 411.2886 1.2E4 412.2978 2.9E4 423.2883 3.0E3 425.3054 2.5E4 431.2873 3.3E3 438.3102 1.1E4 448.2971 1.3E4 453.3182 2.6E3 474.3482 2.8E3 477.3310 3.0E3 489.3357 2.3E4 491.3518 7.5E4 492.3548 8.1E4 504.3597 1.8E5 512.4713 3.0E3 569.3982 6.8E3 584.4206 1.9E4 END IONS BEGIN IONS FEATURE_ID=825 PEPMASS=813.5126 SCANS=825 RTINSECONDS=985.24 CHARGE=1+ MSLEVEL=2 MERGED_STATS=7 / 7 (0 removed due to low quality, 0 removed due to low cosine). 73.0278 6.3E4 73.6361 2.5E3 74.5853 2.1E3 75.5078 2.2E3 75.6305 2.1E3 76.0680 2.3E3 76.1769 2.5E3 79.0265 2.5E3 79.0536 5.9E4 80.8688 2.6E3 81.0329 3.5E4 81.0692 1.2E5 82.6324 2.4E3 83.0487 8.9E3 83.0849 2.4E4 85.0276 1.5E5 85.1009 3.3E3 87.0436 1.2E4 90.3893 1.4E5 90.3936 1.9E4 91.0382 1.3E5 91.0535 3.4E4 92.3049 2.3E3 93.0691 1.0E5 93.1803 2.3E3 95.0483 2.3E3 95.0847 1.2E5 97.0276 1.4E5 97.1004 4.3E3 99.0436 2.8E4 101.0226 6.1E4 101.1153 2.3E3 101.6404 2.4E3 103.0385 1.7E4 103.4049 2.2E3 103.9869 2.5E3 104.4308 2.2E3 105.0692 4.0E4 107.0847 7.8E4 107.3553 2.3E3 108.6217 2.7E3 109.0277 2.4E4 109.0645 2.5E3 109.1004 7.3E4 115.0384 1.0E4 116.2851 2.2E3 117.0694 5.0E3 119.0847 6.2E4 121.1004 8.6E4 123.1159 2.4E4 127.0381 8.7E4 129.0539 9.2E3 129.8301 2.2E3 131.0849 3.6E4 133.1003 6.5E4 135.1160 8.1E4 137.1316 2.5E3 138.9200 2.3E3 143.0839 3.0E3 145.0489 1.9E4 145.1003 3.1E4 146.6958 2.9E3 147.1160 4.9E4 148.0025 2.6E3 149.1317 3.9E4 153.2820 2.7E3 157.1001 3.1E3 159.1160 3.8E4 161.1316 3.9E4 163.1478 1.1E4 171.1170 4.1E3 173.1318 2.6E4 173.5282 1.9E5 173.5441 3.5E4 174.9842 2.2E3 175.1473 1.5E4 183.0650 4.0E3 184.0727 3.0E4 185.0412 1.0E5 185.0749 2.6E3 185.1307 3.7E3 185.1561 2.4E3 187.1476 6.8E3 192.1287 2.4E3 199.1445 2.5E3 201.0363 7.8E3 201.0749 2.7E3 203.0518 3.7E4 203.3698 2.9E3 231.2103 2.7E3 235.6669 2.3E3 241.0685 1.3E4 241.1953 3.2E3 243.0831 2.0E5 243.2103 4.7E3 256.3856 2.6E3 259.2052 5.6E4 261.2204 4.9E4 287.2032 2.3E3 299.1976 2.5E4 301.0887 3.2E4 301.2142 6.0E3 313.0873 2.9E3 313.2740 3.5E4 314.2764 2.5E4 315.1038 2.2E4 317.2079 2.1E5 323.2897 2.7E3 333.2421 4.0E4 335.2573 2.0E5 339.8165 2.5E3 341.1228 2.7E3 357.2408 2.7E3 363.2540 3.9E3 371.1669 1.1E4 373.1102 2.5E4 373.2344 3.5E4 377.8758 2.6E3 385.1844 1.2E4 397.1805 2.6E3 399.2545 3.1E3 401.7305 2.8E3 419.5729 2.5E3 425.2131 1.7E4 428.3698 2.7E3 429.1721 1.5E4 439.2228 2.5E3 465.2092 5.1E4 467.2234 2.6E3 469.2062 9.0E3 470.9940 2.5E3 483.2176 4.6E3 486.9359 2.6E3 497.3104 2.5E4 516.4214 2.7E3 517.2777 2.2E4 519.2006 3.8E3 519.2924 3.1E6 520.2888 3.5E3 523.2490 4.0E3 535.1926 1.1E4 535.2872 2.1E6 535.3818 1.5E4 552.5071 4.9E3 563.2827 3.1E3 578.3056 8.8E3 591.3144 9.4E4 605.3271 2.1E4 619.3442 2.6E4 633.3517 1.9E4 633.4554 2.0E4 647.3522 1.3E4 647.3715 7.6E3 651.4596 1.1E5 661.3937 2.0E4 665.0187 2.8E3 666.8761 2.6E3 675.4050 3.3E4 701.4220 1.3E4 703.4402 1.4E4 715.4343 2.6E4 742.7803 3.0E3 743.4353 1.0E5 743.7706 2.5E3 795.4973 1.0E4 813.1603 5.8E3 813.5116 3.6E6 END IONS BEGIN IONS FEATURE_ID=826 PEPMASS=611.4676 SCANS=826 RTINSECONDS=985.459 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 6 (0 removed due to low quality, 0 removed due to low cosine). 65.3547 2.4E3 67.0539 2.2E5 68.7324 2.3E3 69.0696 8.4E4 71.0494 2.9E3 71.0852 6.2E3 79.0495 3.3E3 79.0539 1.5E5 80.5932 2.1E3 81.0695 3.1E5 81.1553 2.3E3 83.0489 5.8E3 83.0852 6.5E4 85.0646 1.3E4 91.0539 1.1E5 91.7549 2.8E3 93.0694 2.6E5 95.0004 2.5E3 95.0489 1.2E4 95.0852 2.9E5 97.0644 1.9E4 97.1009 3.7E4 99.0800 6.8E3 100.6933 2.5E3 101.1184 2.5E3 104.4202 2.8E3 105.0695 1.5E5 107.0775 3.0E3 107.0852 1.8E5 108.6559 2.3E3 109.0645 1.2E4 109.1008 1.6E5 111.0802 1.2E4 113.9388 2.4E3 117.0696 6.6E4 118.1925 2.4E3 119.0852 1.9E5 121.1008 2.0E5 123.0803 8.2E3 123.1164 5.2E4 125.0958 8.7E3 129.0697 3.2E4 131.0853 1.3E5 133.1008 2.1E5 133.6644 2.8E3 135.1055 7.0E3 135.1165 1.6E5 137.0951 3.4E3 137.1322 1.3E4 139.1112 6.1E3 143.0852 5.0E4 145.1009 1.5E5 147.1165 2.1E5 149.0959 3.7E3 149.1321 9.7E4 149.6852 4.6E3 149.6952 3.9E3 151.1116 7.1E3 155.0856 1.2E4 157.1009 7.9E4 159.0792 2.6E3 159.1166 1.7E5 159.1312 3.0E3 161.1322 1.5E5 163.1123 6.2E3 163.1478 3.3E4 167.8018 2.3E3 168.7478 2.4E3 169.1008 2.3E4 171.1167 1.1E5 171.7483 2.7E3 173.1324 1.3E5 173.5239 3.1E4 173.5354 1.2E5 175.1119 3.2E3 175.1481 7.0E4 177.1258 3.7E3 177.1646 4.4E3 181.1013 3.9E3 183.1168 4.7E4 185.1324 9.4E4 185.1495 3.8E3 187.1481 5.7E4 189.1278 5.6E3 189.1640 2.1E4 190.1067 2.5E3 195.1171 1.4E4 197.1323 4.1E4 198.7604 3.0E3 199.1480 7.8E4 200.1591 2.4E3 201.1638 3.8E4 207.7198 2.4E3 209.1324 1.5E4 211.1481 3.2E4 213.1637 4.2E4 215.1792 2.3E4 217.1941 4.9E3 221.1317 6.6E3 223.1481 1.3E4 225.1638 1.8E4 227.1792 1.5E4 229.1947 1.2E4 231.2105 1.9E4 237.1644 2.8E3 239.1793 1.6E4 241.1951 8.2E4 243.2095 1.1E4 252.0994 2.2E3 253.1967 6.9E3 257.1887 1.9E4 259.1750 4.2E3 259.2054 2.1E5 259.2361 2.9E3 261.2214 3.5E4 264.0560 2.7E3 267.2101 3.0E3 271.2085 2.8E3 273.2216 2.5E3 275.2006 6.2E3 283.2812 2.7E3 285.2213 3.4E3 287.2373 2.9E3 297.2208 6.7E3 299.2362 9.9E3 311.2366 9.8E3 313.2531 4.2E3 315.2330 3.5E3 317.2495 2.6E3 325.2536 3.9E3 333.2428 4.8E4 335.2582 9.1E4 337.2532 3.9E3 339.2688 1.0E4 349.0735 2.1E3 351.4283 2.7E3 353.2849 1.2E4 367.2981 6.9E3 371.2998 3.0E3 394.2626 2.6E3 405.2600 2.6E3 449.3426 2.8E3 519.4191 4.6E4 529.3964 3.0E3 537.4299 9.3E3 541.3914 3.6E3 542.6165 2.6E3 544.9203 3.2E3 593.4541 1.0E4 611.4679 1.4E5 END IONS BEGIN IONS FEATURE_ID=827 PEPMASS=653.2975 SCANS=827 RTINSECONDS=985.646 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 67.9945 2.3E3 70.1427 2.7E3 73.1621 2.4E3 81.5497 2.7E3 88.0977 2.7E3 106.4932 2.2E3 110.4182 2.5E3 116.8133 2.1E3 125.8747 2.5E3 125.9981 2.3E3 126.6553 2.6E3 128.5506 2.6E3 133.8872 3.0E3 161.5540 2.6E3 166.7035 2.7E3 173.5218 1.0E4 173.5343 7.9E4 197.3633 2.4E3 211.1201 2.5E3 228.1462 2.6E3 297.1235 2.7E3 318.3719 2.4E3 321.5282 2.4E3 328.3874 2.2E3 391.1923 1.0E4 405.2077 3.2E4 406.2150 7.4E3 419.2249 2.0E4 420.1647 5.1E3 420.2313 9.6E5 421.2393 5.4E4 424.2260 3.6E4 426.8539 2.6E3 432.2354 3.2E3 433.2393 8.3E4 434.2469 1.2E5 446.2521 3.7E3 447.2523 7.1E3 447.2615 1.1E4 448.2278 1.2E5 448.2786 5.4E3 449.2341 2.6E5 451.2149 7.0E3 452.2213 3.2E5 459.2187 1.5E5 460.2259 4.0E5 461.2322 2.9E4 462.2059 1.1E5 463.2133 6.5E4 465.2289 2.5E5 474.2375 1.2E4 474.2456 3.6E3 475.2135 3.5E5 476.2206 1.7E5 477.1471 4.9E3 477.2289 1.3E6 477.3076 6.5E3 478.2382 1.1E4 479.2449 2.4E4 480.2556 3.8E3 487.2134 4.0E4 488.2188 1.8E4 489.2284 3.2E4 490.2356 4.1E3 491.2137 1.6E4 491.2390 2.1E4 492.2520 4.6E5 493.2250 2.8E4 493.2471 3.8E3 501.2287 6.8E4 502.2358 5.9E4 503.2437 2.3E5 504.2497 3.3E4 505.2556 3.3E3 507.2398 1.8E4 518.2315 1.6E5 519.2386 3.8E3 519.2478 1.0E4 520.1359 6.0E3 520.2819 3.9E3 521.2184 6.9E5 521.2925 8.4E4 522.3028 1.0E4 523.2344 4.3E3 533.2521 4.6E3 534.2294 1.3E4 535.1649 2.1E3 535.2344 3.3E5 535.3283 3.2E3 536.2421 4.4E5 537.2499 5.1E4 545.2592 3.6E3 547.2470 3.7E4 547.2619 1.0E4 548.2794 3.7E3 549.2855 2.9E5 551.2662 1.2E5 559.2714 1.3E4 561.2503 5.9E4 562.2602 7.7E3 563.2654 7.7E4 564.2709 6.2E3 565.2762 5.4E4 566.2897 4.3E4 575.2652 1.1E5 576.2717 6.9E4 577.2814 1.5E5 593.2753 7.3E4 603.2635 3.1E3 607.2880 4.1E4 608.2941 9.5E3 621.2715 5.9E4 635.2856 8.6E3 636.2934 8.8E4 END IONS BEGIN IONS FEATURE_ID=828 PEPMASS=600.4174 SCANS=828 RTINSECONDS=986.001 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 6 (3 removed due to low quality, 0 removed due to low cosine). 67.0541 1.9E4 69.0334 3.7E4 69.0698 3.9E4 69.2396 4.2E3 76.3387 9.2E3 79.0540 4.5E4 81.0698 1.5E5 83.0490 6.0E4 83.0854 1.8E4 85.0646 4.5E4 87.0443 2.9E3 87.3190 7.2E3 87.9228 7.7E3 89.0596 5.8E4 91.0541 7.8E4 92.0621 3.0E3 93.0638 5.5E3 93.0697 2.4E5 93.3756 2.6E3 94.0727 4.9E3 95.0490 7.4E4 95.0793 5.2E3 95.0854 1.8E5 96.0571 2.9E3 96.0889 1.1E4 97.0648 4.5E4 101.2342 4.7E3 101.2418 4.3E3 102.2934 2.3E3 104.7600 8.3E3 105.0697 2.6E5 106.0775 1.8E4 107.0494 2.8E3 107.0854 2.1E5 108.0884 1.0E4 108.9954 3.4E3 109.0646 8.8E4 109.1010 8.4E4 111.0803 3.1E4 113.0962 7.4E3 115.0543 3.7E3 115.3073 2.4E3 117.0698 3.7E4 119.0492 9.1E3 119.0755 2.6E3 119.0854 4.7E5 119.0956 9.6E3 120.0917 3.6E4 121.0647 4.6E4 121.1010 3.5E5 122.1043 3.1E4 123.0803 1.8E5 123.1168 3.2E4 124.0840 5.5E3 125.0595 2.7E5 125.0966 7.7E3 126.0627 3.0E3 128.0625 3.8E3 129.0698 2.8E4 130.0776 3.8E3 131.0854 1.4E5 132.0932 5.2E4 133.0645 4.0E4 133.0861 3.4E4 133.1011 2.7E5 134.1083 4.9E4 135.0803 1.9E5 135.1167 1.3E5 136.0841 3.2E3 136.1203 5.8E3 137.0594 2.9E4 137.0961 1.8E5 138.0996 1.3E4 139.0751 7.2E4 139.1118 8.6E3 141.0707 3.7E3 142.0782 1.2E4 143.0855 1.6E5 144.0928 6.6E4 145.0650 3.9E3 145.0906 3.2E3 145.1011 4.4E5 145.1143 5.2E3 146.1066 4.4E4 147.0803 3.7E5 147.1168 9.8E4 148.0844 6.2E4 148.1213 9.9E3 149.0961 1.4E5 150.1038 2.6E4 151.0752 2.3E5 151.1115 1.0E4 152.0802 2.4E4 153.0907 1.8E4 155.0850 5.8E4 156.0928 4.2E4 157.1010 4.2E5 157.1122 4.0E3 158.1075 1.1E5 159.0803 8.3E4 159.1168 3.3E5 159.1316 6.3E3 160.0876 1.4E4 160.1232 5.5E4 161.0960 1.4E5 161.1324 1.7E5 162.1013 1.3E4 162.1360 2.0E4 163.0766 2.5E3 163.1117 6.0E5 164.0826 2.8E3 164.1159 3.9E4 165.0910 1.7E6 165.1037 9.2E3 165.1247 3.6E3 165.4994 2.4E3 166.0944 2.7E5 167.0855 9.9E3 168.0938 6.7E3 169.1012 1.4E5 170.1082 5.4E4 171.0807 4.7E3 171.1168 2.8E5 172.1233 1.1E5 173.0962 1.3E5 173.1123 4.5E3 173.1155 4.7E3 173.1325 1.3E5 173.5228 7.5E4 173.5418 8.8E4 174.1016 1.7E4 174.1369 9.9E3 175.1118 1.7E5 175.1481 5.6E4 176.1193 1.8E4 176.1514 5.4E3 177.0908 7.7E4 177.1069 3.6E3 177.1276 5.5E4 178.0985 8.1E4 178.1314 1.1E4 179.0892 8.3E3 179.1068 5.3E4 179.1432 1.3E4 180.0971 4.9E3 180.1143 8.0E4 181.1026 3.5E4 181.1223 6.1E5 181.1368 3.3E3 182.1083 2.8E4 182.1254 2.4E4 183.1168 2.4E5 184.1225 6.9E4 185.0960 2.6E4 185.1325 2.3E5 186.1036 2.0E4 186.1375 4.6E4 187.1118 1.0E5 187.1482 8.5E4 188.1181 1.5E4 188.1501 3.2E3 189.0909 9.7E3 189.1274 1.7E5 190.1349 2.3E5 191.1066 1.5E5 191.1431 5.1E4 192.1125 1.2E4 192.1475 3.9E3 193.1023 1.5E4 193.1224 1.8E5 194.1089 8.3E3 195.1168 1.1E5 195.1383 6.0E4 196.1236 4.4E4 196.1423 3.0E3 197.0973 2.0E4 197.1324 1.8E5 198.1037 1.3E4 198.1380 2.5E4 199.1120 8.8E4 199.1481 5.9E4 200.1186 5.6E3 200.1536 2.7E3 200.6958 8.6E3 201.1274 1.2E5 201.1642 1.2E4 202.1335 6.0E3 203.1431 7.6E5 203.1644 1.4E4 203.1748 4.0E3 204.1144 7.4E3 204.1465 1.6E5 205.1224 1.9E4 206.1299 6.1E3 207.1171 5.5E4 207.1383 2.4E5 208.1241 2.5E4 208.1450 1.3E5 209.1325 1.2E5 209.1529 2.7E4 210.1390 4.0E4 211.1119 4.8E4 211.1482 1.7E5 212.1193 1.2E4 212.1543 6.5E4 213.1275 9.4E4 213.1636 5.0E4 214.1342 1.7E4 215.1080 1.3E4 215.1431 8.2E4 216.1508 8.0E4 217.1217 2.7E4 217.1593 1.1E4 218.1297 1.3E4 219.1165 1.1E4 219.1381 1.7E5 220.1457 1.4E4 221.0733 7.6E3 221.1341 4.2E4 221.1537 1.9E6 222.1352 2.0E4 222.1572 4.0E5 223.1112 2.6E4 223.1483 8.0E4 224.1192 5.8E3 224.1526 2.1E4 225.1276 7.1E4 225.1639 8.2E4 226.1336 1.3E4 226.1695 1.3E4 227.1432 5.4E4 227.1799 2.8E4 228.1485 5.0E3 228.1827 3.2E3 229.1222 3.2E4 229.1590 9.4E4 230.1284 5.6E3 230.1636 3.0E4 231.1381 6.6E4 231.1757 4.0E3 232.1442 2.6E4 233.1311 3.3E4 233.1540 1.1E5 234.1391 5.1E3 234.1613 3.4E5 235.1469 3.8E4 235.1705 3.4E4 236.1526 9.6E3 237.1275 5.0E4 237.1638 4.8E4 238.1347 5.0E3 238.1706 2.3E4 239.1432 4.3E4 239.1801 6.1E4 240.1506 1.0E4 240.1599 5.0E3 240.1869 1.1E5 241.1218 1.1E4 241.1583 4.5E4 242.1642 5.0E3 243.1376 5.7E4 243.1750 1.1E4 245.1540 4.4E4 246.1613 6.1E3 247.1693 5.2E5 247.1990 1.2E4 248.1506 4.2E3 248.1745 1.4E5 249.1635 3.9E4 250.1357 6.3E3 250.1706 8.9E3 251.1429 4.5E4 251.1787 4.0E4 252.1501 5.4E3 253.1276 2.5E3 253.1582 6.0E4 253.1929 4.6E3 254.1662 1.1E4 255.1378 2.8E4 255.1735 3.1E4 256.1815 7.3E3 257.1541 4.5E4 257.1863 5.3E3 258.1588 5.1E3 259.1694 9.2E4 260.1182 2.4E3 260.1766 7.0E4 261.1591 1.2E4 261.1851 6.0E4 263.1443 1.0E4 263.1785 3.5E4 264.1877 4.1E3 265.1587 3.8E4 265.1941 1.3E4 266.1654 1.3E4 266.1990 2.7E3 267.1436 3.0E3 267.1742 4.5E4 268.1817 4.8E3 269.1537 4.9E4 269.1896 5.2E4 270.1941 1.2E4 271.1696 7.8E4 272.1761 1.8E4 273.1852 5.5E4 274.1929 2.5E5 275.1777 6.1E3 277.1587 5.7E3 277.1953 1.0E4 279.1748 5.4E4 279.2092 1.1E4 280.1815 6.1E3 281.1539 1.5E4 281.1902 7.8E4 282.1944 2.3E4 283.1701 2.6E4 283.2023 5.6E3 284.1760 4.5E3 285.1852 7.4E4 286.1926 1.4E5 287.2007 3.5E5 288.2038 8.0E4 289.1939 2.1E4 291.1747 1.6E4 291.2095 1.2E4 293.1901 3.1E4 294.1968 1.7E4 295.1708 1.1E4 295.2056 3.1E4 296.1777 4.0E3 297.1851 9.3E4 297.2199 2.5E4 298.1932 2.6E4 299.2008 3.8E5 300.2071 7.7E4 305.1909 1.0E4 306.1971 3.5E3 306.5211 3.0E3 307.2062 5.8E4 309.1848 3.8E4 309.2211 2.6E4 310.1920 4.5E4 311.2003 1.0E5 312.2077 1.5E5 313.1790 1.2E4 313.2162 3.3E5 314.2198 3.5E4 319.2065 3.0E4 321.2217 4.2E3 323.2007 2.4E4 324.2057 8.8E3 325.2161 3.9E5 326.2225 4.7E4 327.2325 1.2E5 328.2355 3.9E4 333.2205 4.3E3 335.1986 1.1E4 335.2383 5.0E3 336.2008 3.8E3 337.2165 1.2E5 339.2315 1.2E5 340.2039 4.4E3 340.2396 7.9E5 340.2868 1.1E4 345.2185 2.9E3 347.2379 1.1E4 349.2135 3.9E3 351.2329 4.1E4 352.2395 3.7E5 353.2463 1.3E4 359.2354 3.6E3 363.2307 1.5E4 364.2383 9.5E3 365.2470 1.8E5 366.2521 4.4E4 367.2242 3.8E3 373.2522 3.8E3 375.2353 3.3E3 377.2460 2.7E4 379.2635 4.3E4 385.2353 2.6E4 387.2544 4.5E4 390.2535 2.8E3 391.2636 6.5E4 392.2684 4.9E4 395.2630 3.1E3 397.2710 3.3E3 400.2619 1.1E4 403.2635 2.5E3 405.2790 5.4E4 407.2582 3.2E3 411.2535 4.9E4 413.2686 1.4E5 414.2701 3.3E4 419.2944 6.9E4 420.2987 7.5E4 425.2683 4.2E5 426.2765 7.6E4 427.2844 3.6E5 428.2870 8.0E4 439.2826 9.5E3 440.2316 3.6E3 440.2919 6.3E5 440.3462 3.8E3 453.2992 1.6E4 454.3044 2.6E4 487.3176 1.5E4 493.3266 1.3E4 505.3329 4.7E4 507.3465 1.2E4 508.3499 1.6E4 520.3520 9.9E4 567.3805 3.7E3 585.3928 5.1E4 594.8237 5.2E3 600.4110 4.6E4 END IONS BEGIN IONS FEATURE_ID=829 PEPMASS=808.5572 SCANS=829 RTINSECONDS=986.083 CHARGE=1+ MSLEVEL=2 MERGED_STATS=7 / 7 (0 removed due to low quality, 0 removed due to low cosine). 72.9563 2.3E3 77.0388 1.5E4 78.8987 2.2E3 79.0541 4.3E5 80.8625 2.3E3 81.0697 8.3E5 81.0743 2.2E3 83.0491 2.6E4 83.0854 1.6E5 85.0283 2.2E4 85.0648 4.2E4 86.0963 3.1E3 88.4877 2.6E3 90.5499 2.8E3 91.0393 8.9E3 91.0541 3.2E5 93.0631 3.9E3 93.0698 7.0E5 93.0769 5.7E3 94.4776 2.8E3 95.0490 5.1E4 95.0786 4.6E3 95.0854 8.2E5 97.0285 3.3E3 97.0647 6.3E4 97.1010 8.3E4 99.0803 4.2E4 103.0397 3.4E3 105.0444 4.0E3 105.0617 3.5E3 105.0697 4.3E5 107.0490 1.2E4 107.0854 5.3E5 107.0921 2.2E3 109.0647 2.9E4 109.0927 4.9E3 109.1010 4.6E5 110.4408 2.4E3 111.0804 4.6E4 111.1168 1.0E4 112.4300 2.4E3 112.5164 2.3E3 113.0960 9.7E3 113.3800 2.5E3 117.0698 1.9E5 119.0755 9.8E3 119.0854 5.7E5 119.0956 4.1E3 121.0645 7.2E3 121.0910 1.5E4 121.1010 6.2E5 121.1115 3.5E3 123.0804 4.1E4 123.1167 1.6E5 125.0960 2.6E4 129.0545 1.4E4 129.0699 7.1E4 129.9221 2.4E3 131.0747 4.9E3 131.0854 3.6E5 131.1434 2.5E3 133.0647 3.2E3 133.0907 1.0E4 133.1011 6.9E5 133.1149 8.6E3 135.0804 2.3E4 135.1055 3.7E3 135.1167 5.4E5 135.1286 5.7E3 137.0960 3.6E4 137.1325 3.8E4 139.0747 2.2E3 139.1116 2.1E4 140.9382 2.3E3 141.0701 7.2E3 143.0855 1.0E5 145.1011 4.3E5 145.1141 3.8E3 146.9815 1.3E4 147.0808 1.1E4 147.1056 2.2E3 147.1167 6.8E5 149.0959 4.9E4 149.1324 3.2E5 149.1447 4.5E3 149.6622 2.4E3 151.1116 1.7E4 151.1489 6.4E3 153.1275 5.8E3 155.0721 2.2E3 155.0856 2.5E4 157.1011 1.5E5 159.1168 4.5E5 161.0966 1.0E4 161.1325 4.9E5 161.1478 3.6E3 163.1116 3.7E4 163.1480 1.1E5 163.5795 3.1E3 164.6411 2.3E3 165.1276 1.7E4 169.1013 4.5E4 171.1004 3.8E3 171.1169 2.4E5 173.0964 2.7E3 173.1326 3.3E5 173.5234 1.5E4 173.5347 1.9E5 173.5440 1.6E4 175.1120 2.1E4 175.1482 2.1E5 177.1274 3.0E4 177.1639 2.3E4 179.1442 2.7E3 181.1015 1.0E4 183.1169 5.3E4 184.0733 2.9E4 185.1325 2.2E5 187.1124 9.0E3 187.1480 1.3E5 189.1277 2.8E4 189.1639 3.4E4 191.1429 1.5E4 195.1168 1.8E4 195.8706 2.5E3 197.1327 4.6E4 199.1140 5.2E3 199.1483 1.4E5 201.1278 3.1E3 201.1640 5.7E4 203.1436 1.8E4 203.1795 7.3E3 205.1595 3.1E3 207.8530 2.8E3 209.1329 2.0E4 210.8010 2.4E3 211.1107 3.1E3 211.1483 3.1E4 213.1640 7.0E4 213.5597 2.7E3 215.1796 3.5E4 217.1594 1.1E4 217.1951 1.3E4 217.3083 2.9E3 223.1478 7.9E3 225.1282 2.7E3 225.1636 1.6E4 227.1805 1.4E4 229.1950 2.0E4 231.1734 1.7E4 231.1869 3.1E3 231.2109 1.1E5 235.1691 3.3E3 237.1640 8.3E3 239.1791 3.7E4 241.1950 3.5E5 243.2105 5.8E4 244.9707 2.4E3 247.1701 2.6E3 253.1954 4.1E3 253.2610 2.6E3 257.1897 7.1E4 259.1804 6.9E3 259.2054 1.0E6 261.2212 1.6E5 263.2379 3.7E3 271.2060 1.2E4 273.2205 1.3E4 275.2009 3.3E4 275.2323 2.7E3 277.2164 3.8E4 283.2053 6.2E3 285.2208 8.2E3 289.2169 2.1E4 295.2066 2.7E3 297.2220 6.9E3 299.2383 4.8E3 301.2169 1.9E4 303.2321 1.1E4 313.2161 4.0E3 315.2323 6.6E4 325.2542 2.8E3 327.2677 3.7E3 333.2058 2.7E3 333.2426 4.0E5 333.2873 3.0E3 335.2581 8.9E5 336.2626 2.6E3 337.2706 7.2E3 339.2699 3.4E3 340.6796 2.8E3 349.2322 7.8E3 351.2546 1.0E4 367.2249 1.1E4 379.2979 3.2E3 426.3686 2.7E3 449.9368 2.4E3 519.4192 2.6E4 541.3837 2.6E3 593.4559 1.2E4 611.4649 5.6E4 614.6127 2.6E3 END IONS BEGIN IONS FEATURE_ID=830 PEPMASS=599.4102 SCANS=830 RTINSECONDS=986.166 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 67.0539 1.0E4 69.0334 2.8E3 69.0695 5.7E3 70.0093 2.3E3 74.1282 2.2E3 78.5765 2.5E3 79.0542 2.9E3 81.0695 2.7E4 83.0488 8.6E3 83.0853 1.2E4 87.0444 2.4E3 91.0538 8.2E3 93.0694 4.4E4 95.0488 1.1E4 95.0851 4.0E4 97.0646 1.7E4 104.3414 2.8E3 105.0695 3.2E4 107.0851 3.9E4 109.0643 1.3E4 109.1007 2.3E4 109.9317 2.5E3 113.0960 7.2E3 117.0695 5.3E3 119.0851 5.5E4 121.0644 5.5E3 121.1008 6.2E4 123.0802 2.4E4 123.1173 4.7E3 125.0595 1.0E4 125.0959 5.4E3 131.0853 2.3E4 133.1008 4.3E4 135.0802 1.9E4 135.1164 2.2E4 137.0959 2.5E4 137.1318 2.3E3 139.0755 3.3E3 139.1114 1.4E4 143.0853 2.1E4 145.1009 5.7E4 147.0801 4.0E4 147.1163 2.1E4 149.0959 1.4E4 151.0262 2.5E3 151.0751 3.0E4 151.1111 2.9E3 153.0908 2.8E3 155.0858 3.4E3 157.1008 4.4E4 159.0806 5.5E3 159.1166 3.5E4 161.0960 1.5E4 161.1321 2.2E4 163.1116 3.1E4 165.0908 1.7E5 167.1065 2.8E4 169.1008 1.9E4 171.1166 4.0E4 173.0961 9.0E3 173.1320 2.0E4 173.5262 4.4E4 173.5354 4.8E4 173.5463 9.2E3 175.1478 4.0E3 177.0911 3.4E3 177.1276 5.7E3 179.1430 4.6E3 181.1221 1.8E4 183.1166 2.8E4 185.1326 2.5E4 187.1113 7.3E3 187.1485 3.8E3 189.1273 2.0E4 191.1060 3.6E3 193.0326 2.2E3 195.1169 1.4E4 195.1371 5.5E3 196.1244 4.5E3 197.1321 2.4E4 199.1120 3.0E3 199.1483 6.1E3 203.1430 7.7E4 207.1169 7.1E3 207.1377 1.7E4 208.1247 2.9E3 209.1331 2.0E4 211.1481 2.0E4 212.3659 2.5E3 213.1275 3.5E3 215.1434 5.6E3 221.1317 8.4E3 221.1536 1.8E5 223.1486 1.3E4 225.1268 3.8E3 225.1620 3.4E3 229.1593 3.1E3 231.1388 2.8E3 233.1540 1.7E4 234.1598 9.6E3 235.1482 7.6E3 237.1638 6.2E3 247.1693 3.5E4 249.1650 2.6E3 249.9474 2.3E3 251.1789 7.7E3 267.1744 2.7E3 269.1892 2.8E3 273.1861 3.4E3 285.1862 1.0E4 286.1937 2.1E4 287.2012 2.6E4 299.2007 1.8E4 304.6459 2.5E3 311.1998 4.2E3 313.2174 8.3E3 327.2304 3.6E3 367.5950 2.5E3 404.7153 3.2E3 413.2701 2.6E3 419.2967 3.4E3 427.2845 6.8E3 434.6273 2.8E3 507.3462 1.4E4 562.8354 2.7E3 599.4084 7.0E3 END IONS BEGIN IONS FEATURE_ID=831 PEPMASS=434.2819 SCANS=831 RTINSECONDS=986.296 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 2 (0 removed due to low quality, 0 removed due to low cosine). 57.0697 9.9E3 59.0489 3.2E3 63.2782 2.4E3 64.9456 2.7E3 78.9056 2.2E3 79.0539 2.8E3 81.0695 1.5E4 85.0645 7.5E3 86.7228 2.3E3 91.0542 2.7E3 93.0696 1.5E4 95.0489 4.3E3 95.0852 1.0E4 97.0648 3.5E3 105.0626 2.8E3 105.0695 5.8E4 107.0851 1.3E4 109.0644 4.1E4 111.0802 3.0E3 115.6980 2.6E3 117.0694 3.2E3 119.0851 6.3E4 121.0646 5.4E3 121.1009 1.6E4 123.0800 1.6E4 125.0594 6.8E3 131.0854 1.6E4 133.0639 2.6E3 133.1007 2.6E4 135.0800 2.4E4 135.1165 3.5E3 137.0956 1.4E4 143.0851 2.0E4 145.1008 3.2E4 147.0801 4.6E4 147.1163 3.4E3 148.1039 2.4E3 149.0958 1.9E4 149.6843 4.2E3 150.9865 2.4E3 151.0749 2.2E4 155.0846 1.1E4 157.1008 2.9E4 159.0802 7.9E3 159.1166 2.0E4 161.0959 1.9E4 161.1326 9.3E3 163.1118 1.3E4 165.0908 1.0E5 169.1009 1.8E4 170.1085 5.4E3 171.1166 2.6E4 173.0961 1.4E4 173.1329 1.1E4 173.5314 2.0E4 175.1117 2.0E4 177.0908 1.1E4 180.1136 2.5E3 181.1009 9.0E3 182.1087 2.9E3 183.1167 5.9E4 185.0964 3.3E3 185.1322 1.1E4 187.1116 1.3E4 187.1489 6.6E3 189.1272 1.7E4 189.6381 2.4E3 190.1352 1.4E4 191.1067 1.8E4 193.1027 5.0E3 193.1219 1.2E4 194.1062 2.5E3 195.1164 1.4E4 196.1246 6.9E3 197.1327 1.5E4 199.1120 1.3E4 200.1189 3.6E3 201.1270 1.2E4 203.1430 4.0E4 207.1174 8.0E3 207.1380 1.5E4 209.1324 1.5E4 211.1120 8.9E3 211.1482 2.7E4 213.1277 1.3E4 215.1434 4.4E3 219.1384 1.6E4 221.1328 4.4E3 221.1536 4.9E4 223.1479 5.8E3 225.1262 3.9E3 225.1638 1.3E4 229.1237 2.7E3 229.1590 7.1E3 230.1304 9.8E3 231.1381 2.9E3 233.1537 3.7E3 234.1609 3.6E3 235.1473 8.0E3 237.1283 3.0E3 239.1420 3.1E3 243.1376 9.6E3 247.1449 3.9E3 247.1690 1.1E4 253.1595 7.3E3 259.1718 2.7E3 268.1821 8.4E3 271.1692 1.2E4 275.1788 3.2E3 279.1759 2.8E3 281.1886 3.4E3 285.1869 3.2E3 286.1931 4.1E4 287.2023 6.3E3 299.2010 1.6E4 311.1982 3.4E3 312.2076 6.6E3 313.2159 9.9E3 335.2000 7.2E3 354.2204 3.6E3 355.2270 1.3E4 373.2541 3.1E3 391.0800 2.6E3 391.2632 3.2E4 419.2607 4.4E3 END IONS BEGIN IONS FEATURE_ID=832 PEPMASS=435.2887 SCANS=832 RTINSECONDS=986.296 CHARGE=1+ MSLEVEL=2 MERGED_STATS=1 / 1 (0 removed due to low quality, 0 removed due to low cosine). 57.0697 4.1E3 57.2699 2.6E3 64.3367 2.4E3 69.0696 3.3E3 79.0540 4.5E3 81.0696 8.8E3 85.0644 3.6E3 89.0595 4.4E3 91.0541 3.1E3 93.0696 1.6E4 95.0489 5.2E3 95.0852 1.4E4 105.0695 1.9E4 107.0852 1.1E4 109.0562 5.6E3 109.0644 1.3E5 109.1004 2.9E3 111.0802 4.7E3 117.0690 2.7E3 119.0851 2.1E4 120.0890 3.6E3 121.0650 3.3E3 121.1010 8.6E3 123.0800 1.1E4 125.0585 2.9E3 131.0853 1.2E4 133.1010 1.2E4 135.0801 1.3E4 135.1167 2.6E3 137.0959 5.9E3 143.0853 9.0E3 145.1008 1.4E4 147.0799 1.5E4 147.1166 4.8E3 149.0958 6.8E3 151.0750 2.9E4 155.0851 3.2E3 156.0925 3.3E3 157.1007 1.6E4 159.0801 3.1E3 159.1168 8.3E3 161.0955 8.2E3 161.1327 3.4E3 162.1009 2.6E3 163.1114 4.7E3 165.0908 2.5E4 166.0945 9.2E3 169.1010 1.5E4 171.1171 9.5E3 173.0961 5.0E3 173.1321 4.0E3 173.5345 1.7E4 175.1117 5.6E3 177.0915 5.1E3 181.1017 6.2E3 182.1076 4.0E3 183.1168 1.6E4 184.1199 5.7E3 185.1325 5.6E3 187.1113 4.9E3 189.1275 1.1E4 193.1020 2.7E3 195.1167 8.6E3 197.1319 1.1E4 199.1115 3.6E3 201.1269 6.4E3 203.1432 1.1E4 204.1459 2.9E3 207.1181 4.1E3 207.1379 9.2E3 209.1321 5.6E3 211.1479 5.3E3 212.1537 6.2E3 213.1265 4.5E3 213.1625 3.5E3 221.1540 6.7E3 227.1447 2.8E3 229.1221 3.8E3 230.1274 3.8E3 231.1351 2.5E3 271.1693 4.2E3 286.1929 9.0E3 287.1994 3.7E3 309.1896 2.6E3 312.2071 4.1E3 392.2677 5.3E3 409.6420 2.4E3 433.7020 2.4E3 END IONS BEGIN IONS FEATURE_ID=833 PEPMASS=583.4152 SCANS=833 RTINSECONDS=986.709 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 67.0540 1.4E4 69.0333 7.8E3 69.0696 2.1E4 71.0488 3.2E3 71.9163 2.3E3 78.1092 2.2E3 78.6824 2.1E3 79.0539 2.3E4 79.8012 2.5E3 81.0695 7.5E4 83.0489 1.3E4 83.0852 1.5E4 85.1637 2.5E3 91.0539 2.2E4 93.0695 8.9E4 93.2831 2.7E3 95.0489 2.7E4 95.0852 5.8E4 96.8465 2.6E3 97.0647 1.7E4 104.3244 2.3E3 105.0695 9.8E4 107.0852 8.7E4 109.0646 1.5E4 109.1008 7.3E4 111.0802 1.3E4 112.6975 2.5E3 114.3824 2.6E3 117.0697 5.2E3 119.0852 1.3E5 121.0648 7.4E3 121.1008 1.4E5 123.0802 2.9E4 123.1165 2.0E4 123.9729 2.4E3 125.0591 1.3E4 129.0699 5.4E3 131.0852 5.1E4 133.1009 9.9E4 135.0801 2.3E4 135.1165 4.7E4 137.0595 2.6E3 137.0957 4.1E4 139.0754 1.4E4 139.1115 1.8E4 143.0854 4.1E4 144.0926 1.2E4 145.0888 3.8E3 145.1009 1.6E5 147.0802 3.0E4 147.1165 8.4E4 149.0959 1.8E4 149.1320 5.9E3 151.0752 5.1E4 151.1115 1.2E4 153.0910 5.3E3 155.0852 6.7E3 156.0933 7.0E3 157.1009 8.5E4 158.1077 5.7E3 159.0804 1.1E4 159.1167 7.1E4 161.0960 2.3E4 161.1322 2.6E4 163.1114 3.9E4 165.0908 1.2E5 167.1063 3.8E3 169.1012 5.6E4 170.1088 6.0E3 171.1167 6.4E4 173.0964 1.3E4 173.1323 6.5E4 173.5221 2.1E4 173.5322 1.1E4 173.5407 3.5E4 175.1121 1.4E4 175.1483 2.5E4 177.0905 5.4E3 177.1273 9.0E3 179.1058 2.3E3 181.1009 1.7E4 181.1218 1.3E4 183.1169 4.4E4 184.1237 5.6E3 185.0961 3.2E3 185.1325 3.9E4 187.1120 9.0E3 187.1481 1.9E4 189.1274 2.6E4 191.1065 5.9E3 191.1431 1.6E4 194.1085 2.4E3 195.1169 3.4E4 196.1245 1.3E4 197.1325 5.4E4 199.1115 6.9E3 199.1481 2.0E4 201.1276 1.2E4 201.1631 5.6E3 203.1430 5.1E4 203.4109 2.3E3 205.1244 2.7E3 207.1175 1.5E4 207.1382 4.2E4 208.1258 2.6E3 209.1324 5.3E4 211.1133 9.6E3 211.1483 4.8E4 213.1268 7.0E3 213.1642 3.4E3 215.1061 2.5E3 215.1438 3.9E3 220.1248 2.6E3 221.1324 1.5E4 221.1537 9.4E4 222.1411 3.0E3 223.1134 3.0E3 223.1481 2.7E4 224.1195 2.9E3 225.1278 6.4E3 225.1640 1.7E4 227.1432 1.4E4 227.1799 3.1E3 229.1223 7.2E3 231.1375 3.4E3 233.1545 1.3E4 235.1477 2.6E4 237.1266 7.4E3 237.1635 3.2E4 239.1425 2.6E3 247.1456 9.0E3 247.1708 1.4E4 249.1636 7.0E3 251.1792 2.7E3 255.1727 2.6E3 261.1589 3.4E3 261.1866 1.7E4 263.1815 3.4E3 265.1598 3.9E3 265.1950 7.9E3 269.1896 6.1E3 281.2943 3.6E3 282.2793 4.1E4 283.2827 3.8E4 285.1846 2.5E4 286.1939 1.0E4 287.2012 2.6E4 291.2105 3.1E3 299.2022 1.3E4 299.3063 1.2E4 300.3084 3.1E3 311.2016 1.1E4 329.2260 2.4E3 335.2396 3.1E3 337.2159 3.2E3 340.7810 2.4E3 349.2162 1.0E4 351.2299 4.2E3 352.2393 6.2E3 353.2478 5.7E4 361.2648 2.6E3 364.2404 2.4E4 434.2140 2.9E3 436.5270 2.4E3 454.9714 2.5E3 473.3380 7.7E3 491.3521 1.4E5 504.3631 3.0E3 583.4136 2.7E4 END IONS BEGIN IONS FEATURE_ID=834 PEPMASS=584.4223 SCANS=834 RTINSECONDS=986.804 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 63.9463 2.2E3 66.8634 2.4E3 68.1900 2.3E3 69.3535 2.3E3 69.9257 2.6E3 71.0853 6.0E3 72.2838 2.7E3 73.0281 1.6E4 75.5541 2.5E3 75.6593 2.9E3 81.0697 1.8E4 87.0438 1.4E4 88.9407 2.5E3 89.0593 2.3E5 89.4778 2.2E3 91.0537 2.3E3 91.7122 2.8E3 92.7732 2.1E3 93.0695 2.5E4 95.0492 5.6E3 95.0852 1.2E4 97.5029 2.3E3 101.3897 2.3E3 105.0696 2.7E4 107.0850 2.1E4 109.1009 1.4E4 111.3318 2.1E3 114.0829 2.5E3 119.0853 4.6E4 121.1009 2.5E4 123.0802 1.2E4 126.6077 2.4E3 127.5037 2.6E3 130.5206 2.5E3 131.0851 1.1E4 133.0856 1.4E5 133.1004 3.4E4 135.0801 7.6E3 135.1168 9.4E3 137.0956 2.6E3 143.0852 1.9E4 145.1009 6.1E4 147.0803 9.5E3 147.1165 2.0E4 157.1008 3.9E4 158.1091 1.1E4 159.1168 2.7E4 163.1120 6.5E3 165.0910 4.3E4 169.1016 6.5E3 171.1168 2.5E4 173.1323 2.0E4 173.5238 3.2E4 173.5398 5.5E4 175.1118 3.3E3 175.1488 7.9E3 177.1118 1.8E4 177.1287 2.4E3 177.2065 2.5E3 181.1010 3.0E3 183.1175 1.7E4 185.1324 1.4E4 191.1435 2.4E3 193.1235 3.0E3 197.1322 1.9E4 203.1425 1.8E4 207.1386 3.3E3 209.1324 6.2E3 210.4134 2.5E3 211.1486 1.0E4 213.1619 3.1E3 221.1327 3.0E3 221.1540 4.3E4 223.1481 7.5E3 227.4021 2.5E3 237.1650 3.3E3 257.1877 2.8E3 259.1685 1.1E4 265.1004 2.6E3 266.2031 2.6E3 287.2008 1.6E4 332.3561 2.8E3 337.2158 9.5E3 352.2395 2.2E4 353.2487 3.8E3 365.2488 9.3E3 385.9086 3.3E3 395.0779 3.0E3 504.3602 3.3E3 539.1588 2.6E3 559.4808 2.5E3 END IONS BEGIN IONS FEATURE_ID=835 PEPMASS=613.2660 SCANS=835 RTINSECONDS=988.231 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 64.9587 2.7E3 66.0712 2.1E3 67.0542 3.9E3 68.9192 2.2E3 70.5176 2.2E3 73.0280 1.5E4 78.9090 2.2E3 79.0541 4.5E3 81.0695 1.1E4 83.0859 2.5E3 89.0593 1.3E4 93.0695 1.0E4 93.2791 2.5E3 95.0851 1.0E4 96.0886 2.7E3 99.1442 2.6E3 100.3145 2.5E3 105.0696 9.6E3 107.0854 1.4E4 109.1010 1.2E4 115.8543 2.3E3 119.0853 2.2E4 121.1012 1.4E4 123.1169 2.5E3 126.0751 2.4E3 126.2021 2.4E3 131.0850 5.5E3 133.1008 1.4E4 134.1046 2.5E3 135.1161 2.9E3 143.0851 3.0E3 145.1009 1.7E4 146.1036 2.7E3 147.1164 1.1E4 148.1202 2.8E3 149.6823 3.2E3 149.6925 5.2E3 149.7034 3.5E3 157.1014 1.2E4 159.1174 2.5E3 160.1182 3.4E3 166.5043 2.5E3 171.1168 2.8E3 172.1222 3.2E3 173.1326 3.8E3 173.5263 3.6E4 173.5417 1.7E4 185.1322 9.7E3 195.1157 2.7E3 197.1330 3.4E3 211.1504 3.0E3 225.8105 3.0E3 251.1183 2.9E3 259.0667 3.1E3 260.2082 2.7E3 279.1494 3.9E4 345.9432 2.6E3 354.1831 2.4E3 358.1925 1.4E4 369.2072 6.3E4 370.2148 4.9E3 377.2006 2.4E3 379.1929 5.9E3 397.2028 4.6E4 398.2109 1.2E4 407.2238 5.5E3 408.2283 8.9E3 409.2029 3.0E3 410.1678 2.8E3 421.2026 7.6E3 423.2213 1.1E4 424.2296 7.4E3 425.1289 6.4E3 425.1449 7.5E3 425.1980 5.6E5 426.2048 8.0E3 433.2044 7.0E3 435.2163 2.4E4 436.2235 3.7E3 437.1982 5.8E4 438.2029 3.6E4 439.2137 9.0E3 440.2337 7.0E3 441.1900 4.9E3 442.2399 3.0E3 448.1902 3.1E4 450.2037 1.5E4 451.2127 4.8E5 452.2190 1.7E5 453.1958 3.4E4 453.2224 5.8E4 458.2441 3.5E4 461.1978 6.7E4 462.1310 2.3E3 462.2052 2.0E5 462.2801 2.8E3 463.2129 4.8E4 465.1910 1.4E4 467.2424 6.1E3 469.2588 2.0E4 470.2663 7.3E4 476.1851 3.2E4 479.2103 4.8E4 480.2161 7.1E4 481.2540 5.2E4 482.2578 1.3E4 483.2405 1.8E4 487.1495 2.9E3 489.1928 5.2E4 491.2093 2.1E4 495.2389 1.6E4 496.2103 1.3E4 497.2507 7.3E4 498.2622 3.0E5 506.1936 1.1E4 507.2070 3.7E4 508.2236 7.1E3 509.2499 7.7E4 510.2271 2.5E4 511.2334 7.8E4 512.2006 2.8E4 521.2183 1.3E4 522.2251 1.7E4 524.2409 4.3E4 525.2492 2.3E5 526.2577 1.5E6 535.2340 1.1E5 536.2295 4.4E3 537.2318 4.9E3 537.2438 1.1E4 538.2172 3.5E3 539.2293 1.3E4 540.2460 9.8E3 541.2773 3.1E3 549.2203 5.2E3 552.2373 6.6E3 553.2449 1.0E6 554.2484 3.4E4 557.2769 6.6E3 567.2442 7.1E3 567.2558 1.4E4 568.2288 2.1E4 568.2460 5.5E3 569.2762 3.6E4 570.2570 4.7E3 580.2159 1.1E4 581.2226 8.0E3 585.2679 1.5E4 595.2561 3.8E4 596.2395 1.1E5 598.2447 7.3E3 613.2663 9.8E4 END IONS BEGIN IONS FEATURE_ID=836 PEPMASS=870.5658 SCANS=836 RTINSECONDS=989.496 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 2 (0 removed due to low quality, 0 removed due to low cosine). 81.2567 2.1E3 85.3848 2.5E3 120.9391 3.2E3 127.7096 2.8E3 146.2695 2.5E3 172.9718 2.6E3 173.5197 8.7E3 173.5376 5.5E4 274.3145 2.4E3 299.8331 2.8E3 449.2300 2.8E3 459.2176 2.0E5 460.2252 9.0E4 461.2329 1.7E4 464.3071 2.3E3 473.2267 3.8E3 485.2296 4.1E3 486.2408 5.4E3 487.2202 7.8E3 488.2580 5.5E3 491.2437 2.2E4 492.2515 7.9E4 500.9707 2.5E3 503.2443 2.9E4 505.2237 3.7E4 515.2460 4.5E3 516.2511 2.3E4 517.2229 8.1E3 518.2323 3.9E3 519.2384 2.3E5 520.2468 5.2E4 531.2383 3.0E5 532.2459 3.7E4 533.1176 3.7E3 533.2541 2.7E5 534.2632 3.5E3 547.2737 4.6E3 548.2782 2.4E4 549.2520 9.7E3 559.2321 1.4E4 560.2405 4.9E4 564.2681 6.8E3 577.2441 3.6E4 591.2599 1.5E5 592.1581 4.7E3 592.2672 4.0E5 593.2749 2.9E4 855.5472 3.2E3 870.5647 2.8E4 END IONS BEGIN IONS FEATURE_ID=837 PEPMASS=871.5729 SCANS=837 RTINSECONDS=990.495 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 6 (0 removed due to low quality, 0 removed due to low cosine). 78.6525 3.1E3 82.2490 3.4E3 82.5761 2.3E3 82.6880 2.4E3 83.0852 1.6E4 84.6086 2.6E3 85.1009 3.2E3 85.9178 2.6E3 88.9329 2.4E3 89.0945 2.5E3 89.2446 2.8E3 89.3560 2.6E3 90.4627 2.3E3 96.0311 2.7E3 96.5366 2.3E3 96.8458 2.5E3 97.1008 4.5E3 109.5882 2.2E3 111.9992 2.3E3 127.2768 2.3E3 128.2437 2.7E3 128.3452 2.3E3 130.2389 2.5E3 133.3081 2.6E3 141.2296 2.4E3 145.0790 2.9E3 148.3129 1.8E4 148.3248 1.4E4 153.3868 2.5E3 153.4191 2.5E3 156.3845 2.4E3 165.0892 2.4E3 173.5233 2.2E4 173.5332 1.0E5 173.5421 2.2E4 181.1579 2.5E3 192.3922 2.2E3 203.4464 2.9E3 210.9773 2.8E3 216.8087 2.6E3 230.3023 2.9E3 230.7472 3.2E3 237.5133 2.9E3 263.7076 2.6E3 320.7367 2.8E3 334.3294 2.8E3 342.5092 2.4E3 362.3214 2.4E3 415.1957 2.3E3 420.4778 2.3E3 431.1794 2.9E3 437.6060 2.3E3 447.2169 2.5E3 459.2180 4.7E5 460.2237 3.5E5 460.2925 3.4E3 461.2314 1.6E5 462.2409 1.6E4 471.3392 2.6E3 473.2338 3.6E4 474.2383 2.6E3 476.2559 8.8E3 477.2689 3.9E3 487.2476 3.6E4 488.2231 3.0E3 488.2526 4.9E3 489.2592 8.8E3 489.2660 2.4E3 491.2435 7.1E4 492.2514 1.6E5 493.2543 6.2E4 503.2411 8.5E3 504.2479 2.5E4 505.2243 9.5E4 506.2240 2.2E4 515.2443 2.4E4 516.2499 2.3E4 517.2440 4.3E4 518.2309 2.1E4 519.2386 3.1E5 520.2440 3.2E5 521.2501 5.9E4 531.2387 1.7E5 531.3273 4.5E3 532.2437 3.8E5 533.0666 2.6E4 533.2543 5.2E6 534.2574 2.3E5 547.2713 2.0E4 548.2758 3.7E4 549.2621 1.5E4 549.2763 7.5E3 560.2414 1.2E5 561.2473 1.2E5 562.2188 4.1E3 564.2470 4.1E4 565.2805 9.4E4 575.2643 4.1E4 577.2443 9.1E4 578.2498 4.3E4 591.2605 8.6E4 592.0458 7.1E3 592.2676 3.5E6 592.3795 6.2E3 593.0536 3.2E4 593.0972 1.1E4 593.2752 7.5E6 593.4517 1.2E4 593.4994 2.3E4 594.2770 2.7E4 612.0107 3.4E3 615.9713 3.2E3 753.1719 2.9E3 778.7983 3.0E3 788.9424 2.7E3 811.5292 6.3E3 811.5495 3.5E3 871.5700 2.5E5 871.7482 2.5E3 878.2520 2.7E3 END IONS BEGIN IONS FEATURE_ID=838 PEPMASS=806.5417 SCANS=838 RTINSECONDS=991.112 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 5 (0 removed due to low quality, 0 removed due to low cosine). 73.0167 2.4E3 77.0385 3.1E3 79.0539 2.0E5 81.0336 2.8E3 81.0697 5.1E5 83.0490 3.9E4 83.0854 8.2E4 85.0647 2.8E4 85.6263 2.1E3 86.0959 2.6E3 91.0541 2.3E5 93.0697 2.9E5 93.5541 2.2E3 95.0127 1.8E4 95.0489 3.6E4 95.0854 3.8E5 95.1852 2.8E3 97.0646 2.2E5 97.1010 5.4E4 97.7400 2.2E3 98.3402 2.0E3 99.0440 7.4E3 99.0804 1.9E4 101.0594 2.9E3 103.0534 2.7E3 105.0617 4.7E3 105.0697 4.7E5 105.0782 2.6E3 107.0490 5.9E4 107.0853 2.0E5 109.0647 5.4E4 109.1010 1.8E5 109.2822 2.2E3 110.5425 2.3E3 111.0804 2.7E4 111.1169 5.4E3 113.0593 4.2E3 113.0960 5.2E3 117.0697 7.6E4 119.0476 2.5E3 119.0755 3.3E3 119.0854 3.6E5 121.0650 1.0E4 121.1010 2.1E5 123.0441 3.6E3 123.0803 4.2E4 123.1167 6.8E4 124.9887 2.3E3 125.0961 3.0E4 126.8236 2.2E3 127.0758 3.2E3 127.3204 2.4E3 129.0698 1.7E4 131.0854 2.3E5 132.0218 2.2E3 133.0655 3.0E3 133.0924 2.2E3 133.1010 5.4E5 133.1127 9.0E3 135.0801 4.1E4 135.1167 1.6E5 137.0960 4.3E4 137.1327 1.6E4 139.0751 1.6E4 139.1120 2.8E3 141.0702 1.1E4 143.0856 2.5E4 145.0650 8.8E3 145.1011 2.4E5 147.0809 4.3E3 147.1167 2.6E5 149.0959 9.2E4 149.1323 1.1E5 151.0746 3.2E3 151.1114 2.5E4 153.1271 9.4E3 155.0854 1.6E4 157.1010 3.9E4 158.6959 2.7E3 159.1167 1.8E5 161.0966 6.7E3 161.1180 4.6E3 161.1325 1.1E5 163.1117 4.3E4 163.1477 3.2E4 165.0907 2.6E4 165.1275 1.5E4 169.1017 2.6E4 171.1169 4.5E4 173.1326 8.9E4 173.5238 8.6E4 173.5413 9.0E4 175.1121 1.2E4 175.1482 3.0E4 177.1276 5.5E4 179.1251 2.7E3 179.1430 2.5E5 179.8498 2.3E3 180.1165 2.6E3 183.1171 3.6E4 184.0737 5.3E3 185.1329 3.4E4 187.1118 4.3E4 187.1483 2.4E4 189.1641 3.6E3 191.1443 6.8E3 191.4820 2.7E3 193.1225 8.8E3 195.1382 1.0E4 197.1322 3.0E4 201.1279 2.9E3 201.1638 4.0E4 203.1435 1.2E4 205.1220 2.2E4 207.1368 5.9E3 209.1533 6.9E3 211.1480 7.1E3 215.1434 2.5E3 219.1377 7.0E3 219.1490 8.1E3 219.1744 7.5E5 219.1998 1.1E4 223.1327 1.8E4 229.1949 3.4E4 233.1534 8.3E3 239.1796 3.5E4 243.2100 9.8E3 247.1717 6.4E3 247.2052 6.0E4 257.1898 1.1E5 261.2211 4.8E4 264.2108 3.0E3 275.1658 5.4E3 275.2008 9.4E5 275.2264 2.3E3 275.2361 4.0E3 279.1600 1.4E4 285.5490 2.9E3 293.2108 2.7E4 321.1307 2.8E3 333.9424 2.6E3 334.0114 2.6E3 335.2582 1.2E6 349.2369 1.5E5 371.7031 2.7E3 443.9252 2.4E3 481.0618 2.5E3 515.5590 2.7E3 587.6212 2.8E3 609.4503 2.2E5 625.9579 2.4E3 END IONS BEGIN IONS FEATURE_ID=839 PEPMASS=811.4971 SCANS=839 RTINSECONDS=991.112 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 6 (0 removed due to low quality, 0 removed due to low cosine). 73.0280 2.8E4 74.2056 2.2E3 77.5314 2.3E3 79.0540 2.6E4 79.3556 2.4E3 81.0332 5.5E3 81.0694 6.2E4 82.2096 2.7E3 83.0852 3.0E3 85.0279 6.7E4 87.0435 2.4E3 90.1647 8.2E4 90.1699 1.4E4 90.2569 2.3E3 91.0386 5.2E4 91.0536 1.5E4 91.0842 2.6E3 93.0695 3.9E4 95.0849 5.4E4 97.0279 5.7E4 97.0643 2.6E3 97.1014 2.5E3 98.2243 2.5E3 99.0437 8.3E3 101.0229 2.1E4 105.0696 1.9E4 107.0851 2.4E4 109.0278 5.5E3 109.1007 2.9E4 115.0388 3.4E3 115.5076 2.7E3 115.5628 2.7E3 117.0689 2.8E3 118.7051 2.4E3 119.0849 2.9E4 121.1009 2.7E4 123.1162 4.2E3 124.6458 2.3E3 125.1672 2.4E3 127.0384 3.8E4 131.0853 1.7E4 133.1006 2.4E4 135.1165 2.1E4 142.1965 3.0E3 142.9826 2.4E3 145.0492 3.9E3 145.1003 1.2E4 147.1164 8.0E3 149.0956 5.5E3 149.1325 5.4E3 151.4683 2.7E3 152.7172 2.5E3 159.1165 5.5E3 161.1323 1.3E4 162.1763 2.5E3 173.1325 2.8E3 173.5236 6.9E4 173.5395 1.4E5 177.8700 2.4E3 179.1423 1.6E4 183.1169 2.3E3 184.0728 1.5E4 185.0417 4.1E4 187.1461 2.8E3 201.0742 2.7E3 202.8868 2.4E3 203.0526 1.1E4 219.1740 2.4E4 221.2047 2.6E3 223.2639 2.2E3 241.0676 2.9E3 243.0836 9.1E4 259.6677 2.4E3 261.2212 2.1E4 269.7774 2.4E3 275.2002 3.4E4 285.1814 2.8E3 301.2135 5.0E3 315.1928 6.1E5 334.0689 2.3E3 335.2579 8.9E4 335.2991 2.7E3 336.4156 2.4E3 349.2390 3.4E3 371.2189 5.5E4 378.2071 2.6E3 380.2767 2.2E3 383.3644 2.8E3 465.6983 2.3E3 469.3661 2.9E3 477.2029 2.4E3 497.3159 7.1E3 519.1146 3.7E3 519.1984 5.0E3 519.2241 1.1E4 519.2924 1.7E6 521.8826 2.8E3 533.1769 1.3E4 533.2715 1.2E6 533.3667 8.8E3 546.1979 2.4E3 572.4286 2.7E3 617.3507 2.7E3 631.4348 3.1E4 649.3344 2.4E3 649.4444 9.7E4 670.7371 2.3E3 697.9990 2.6E3 767.2820 2.3E3 811.4954 2.2E6 811.6308 4.1E3 END IONS BEGIN IONS FEATURE_ID=840 PEPMASS=789.5152 SCANS=840 RTINSECONDS=991.948 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 5 (0 removed due to low quality, 0 removed due to low cosine). 71.4054 2.3E3 76.2854 2.4E3 77.3838 2.2E3 79.0539 3.8E4 79.1360 2.2E3 80.7100 2.5E3 81.0695 1.0E5 83.0487 6.5E3 83.0853 1.5E4 84.3345 2.4E3 86.8329 2.3E3 90.8822 2.4E3 91.0539 4.8E4 92.0596 2.5E3 93.0695 7.0E4 95.0126 3.4E3 95.0851 7.8E4 97.0644 4.7E4 97.1012 3.0E3 105.0695 9.2E4 105.3429 2.3E3 107.0490 1.1E4 107.0852 4.7E4 109.0648 7.3E3 109.1008 3.6E4 111.0801 2.4E3 117.0697 1.7E4 119.0852 6.8E4 121.1008 4.8E4 123.0800 2.8E3 123.1166 9.6E3 131.0852 3.6E4 133.1009 1.1E5 135.0803 3.7E3 135.1164 3.2E4 137.0963 2.7E3 137.1319 2.9E3 143.0861 3.1E3 145.1008 4.1E4 147.1164 5.7E4 149.0953 1.5E4 149.1322 1.7E4 159.1165 3.0E4 161.1325 1.8E4 162.5415 2.3E3 163.1117 4.8E3 165.0902 3.1E3 169.1010 3.0E3 171.1164 3.0E3 173.0429 2.3E3 173.1329 1.2E4 173.5222 4.9E4 173.5393 9.4E4 173.5441 9.1E3 175.1478 3.4E3 177.1271 7.8E3 179.1428 3.8E4 180.7399 2.5E3 182.2946 2.4E3 183.1165 2.6E3 184.0723 5.7E3 185.4917 2.5E3 187.1115 3.9E3 205.1208 3.2E3 211.7893 2.4E3 213.6046 2.3E3 217.4867 2.3E3 219.1742 1.0E5 232.3289 2.6E3 246.3853 2.2E3 246.9475 2.7E3 247.2056 8.1E3 257.1899 7.9E3 259.1255 2.2E3 261.2211 3.0E3 263.9665 2.4E3 275.2006 1.2E5 283.6164 2.3E3 298.6985 2.5E3 309.0251 2.3E3 315.9683 2.5E3 319.0833 2.8E3 333.1981 2.6E3 335.2583 1.4E5 345.3800 2.5E3 349.2381 1.5E4 566.2880 4.1E3 609.4527 7.2E3 693.9716 3.0E3 706.5137 2.5E3 750.8487 2.8E3 END IONS BEGIN IONS FEATURE_ID=841 PEPMASS=568.4265 SCANS=841 RTINSECONDS=996.035 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 62.5747 3.2E3 67.0539 8.0E4 69.0332 1.6E4 69.0696 1.0E5 71.0490 1.8E4 71.0859 6.0E3 73.0280 9.9E3 74.5578 3.7E3 75.7032 3.3E3 79.0539 1.1E5 80.0619 1.5E4 81.0696 3.5E5 82.0729 3.1E4 83.0489 4.9E4 83.0852 5.2E4 85.0645 3.2E4 86.4591 3.5E3 89.0592 5.4E3 91.0540 1.3E5 92.0619 3.8E3 93.0695 4.6E5 94.0728 3.4E4 95.0488 1.8E5 95.0852 2.8E5 96.0885 2.2E4 97.0645 4.7E4 97.1012 1.0E4 103.0543 8.1E3 104.3747 4.0E3 105.0444 1.2E4 105.0696 5.2E5 106.0731 5.4E4 106.5900 6.2E3 107.0852 4.4E5 108.0881 2.9E4 109.0645 4.4E4 109.1009 2.9E5 110.1045 3.2E4 111.0802 5.6E4 116.6631 3.4E3 117.0697 6.9E4 118.0778 2.0E4 119.0757 1.8E4 119.0853 9.2E5 119.0944 1.4E4 120.0902 6.7E4 121.0644 9.2E3 121.0911 4.6E3 121.1009 4.9E5 122.0728 6.9E3 122.1045 6.3E4 123.0802 1.3E5 123.1166 7.8E4 124.1200 1.3E4 125.0958 3.6E4 128.0622 1.5E4 129.0698 5.0E4 130.0772 1.4E4 131.0748 9.5E3 131.0853 3.2E5 132.0928 1.0E5 133.1010 6.3E5 133.1127 1.4E4 134.1052 7.6E4 135.0802 6.5E4 135.1167 2.4E5 136.1202 3.5E4 137.0959 1.2E5 138.1031 3.5E4 139.1116 3.5E4 141.0689 1.2E4 142.0779 3.7E4 143.0854 2.8E5 144.0927 9.9E4 145.1011 9.1E5 145.1143 1.6E4 146.1061 1.0E5 147.0803 3.3E4 147.1167 3.8E5 148.1203 5.9E4 148.5787 4.4E3 149.0960 7.9E4 149.1323 4.8E4 151.1117 5.4E4 151.1490 9.9E3 155.0854 7.7E4 156.0931 7.9E4 157.1011 4.9E5 158.1075 1.2E5 159.0806 1.7E4 159.1168 4.3E5 160.1215 6.1E4 160.7710 6.4E3 161.0960 7.9E4 161.1324 1.0E5 163.1117 4.2E4 163.1478 2.0E4 165.0915 6.9E3 167.0855 2.3E4 168.6966 3.5E3 169.1013 2.3E5 170.1076 7.5E4 171.1169 3.9E5 171.1331 1.3E4 172.1227 7.3E4 173.0963 3.2E4 173.1327 3.5E5 173.5272 6.3E4 173.5378 7.0E4 174.1373 3.4E4 175.1115 2.1E4 175.1483 2.5E5 176.1520 1.2E4 177.1273 6.2E4 179.0850 2.0E4 181.1014 9.7E4 182.1084 5.5E4 183.1170 2.8E5 184.1232 5.5E4 185.0945 6.9E3 185.1327 2.9E5 186.1392 8.1E4 187.1126 1.1E4 187.1483 1.7E5 188.1522 2.2E4 189.1277 4.8E4 189.1640 5.7E3 191.1433 1.1E5 192.1482 7.3E3 193.1011 5.0E4 194.1089 5.1E4 195.1170 1.9E5 196.1238 9.5E4 197.1325 3.3E5 197.1528 5.0E3 198.1384 8.2E4 199.1122 9.4E3 199.1483 1.7E5 200.1537 3.4E4 201.1277 4.6E4 201.1639 9.2E4 203.1435 4.4E4 205.1595 9.5E3 206.1102 4.1E3 207.1170 9.5E4 208.1241 5.1E4 209.1328 3.0E5 210.1385 5.3E4 211.1486 2.5E5 212.1536 5.3E4 213.1281 2.0E4 213.1643 6.2E4 215.1441 1.7E4 217.1593 5.7E4 219.1175 1.2E4 220.1251 1.4E4 221.1329 1.1E5 221.1519 6.4E3 222.1388 3.8E4 223.1487 1.6E5 224.1549 6.0E4 225.1641 8.5E4 226.1701 1.8E4 227.1442 5.9E3 227.1799 1.5E4 229.1584 2.0E4 231.1744 2.4E4 233.1323 2.9E4 234.1378 2.1E4 235.1484 9.0E4 236.1540 3.0E4 236.1965 4.4E3 237.1641 9.6E4 238.1709 1.9E4 239.1798 7.4E4 241.1959 4.0E4 243.1750 7.7E3 246.1404 1.2E4 247.1482 4.2E4 248.1538 2.6E4 249.1640 7.2E4 250.1684 2.1E4 251.1792 5.1E4 252.1856 1.5E4 253.1946 3.1E4 255.1740 2.8E4 257.1903 2.6E4 259.1490 1.2E4 259.2045 2.0E4 260.1552 4.7E3 261.1642 3.8E4 262.1707 1.9E4 263.1800 5.4E4 264.1842 1.4E4 265.1955 5.7E4 267.2111 2.5E4 269.1906 6.5E3 270.1972 3.9E3 271.2057 1.2E4 273.1623 6.5E3 275.1788 2.8E4 276.1857 1.1E4 277.1957 4.9E4 278.2028 1.5E4 279.2109 2.5E4 281.1907 2.0E4 283.2067 3.4E4 285.2220 1.9E4 287.1787 1.4E4 291.2114 2.0E4 295.2070 4.4E3 296.2136 6.0E3 297.2223 1.8E4 303.2139 7.4E3 305.2277 2.7E4 323.2383 6.0E4 331.2423 4.1E3 335.2380 6.4E3 338.2615 4.6E4 347.2301 4.3E3 349.2517 1.2E4 351.2702 8.5E3 378.5384 6.6E3 415.3034 1.6E4 430.3262 1.2E4 454.1918 6.6E3 473.2769 4.2E3 547.1200 4.0E3 564.4832 7.5E3 END IONS BEGIN IONS FEATURE_ID=842 PEPMASS=585.4275 SCANS=842 RTINSECONDS=996.122 CHARGE=1+ MSLEVEL=2 MERGED_STATS=1 / 1 (0 removed due to low quality, 0 removed due to low cosine). 67.0540 3.3E3 69.0698 5.6E3 73.5641 2.2E3 79.0542 5.4E3 81.0697 1.4E4 83.0487 3.3E3 83.0854 3.2E3 87.0436 2.8E3 89.0596 1.1E4 91.0541 6.1E3 93.0697 2.0E4 94.0727 3.2E3 95.0489 3.8E3 95.0853 8.8E3 95.4250 2.5E3 97.0651 5.2E3 105.0697 1.9E4 107.0853 1.8E4 109.1009 1.4E4 109.1083 2.2E3 117.0697 3.5E3 119.0854 2.6E4 120.0890 6.6E3 121.1009 2.4E4 123.0803 1.1E4 131.0853 1.0E4 133.0854 3.3E3 133.1010 2.0E4 134.1050 3.8E3 135.1170 8.6E3 137.0962 2.9E3 139.1118 4.1E3 143.0853 1.1E4 144.0925 4.1E3 145.1010 3.4E4 146.1049 6.4E3 147.1167 1.3E4 149.0957 4.4E3 154.6168 2.4E3 157.1010 1.7E4 158.1058 5.6E3 159.1166 1.8E4 160.0876 6.3E3 161.0922 3.0E3 161.1325 3.1E3 167.1067 1.6E4 169.1013 6.1E3 170.1064 2.4E3 171.1167 1.1E4 171.5995 2.5E3 172.1222 3.5E3 173.1326 8.4E3 173.5329 2.6E4 175.1490 5.7E3 181.1014 2.5E3 183.1166 5.5E3 184.1206 2.5E3 185.1326 8.2E3 186.1359 3.1E3 187.1484 5.1E3 191.1428 3.1E3 195.1165 6.3E3 196.1250 3.1E3 197.1323 1.2E4 199.1478 5.9E3 207.1171 3.5E3 209.1321 8.0E3 211.1477 7.7E3 221.1325 2.8E3 221.1547 2.7E3 223.1471 5.1E3 225.1635 3.1E3 226.1688 2.7E3 509.0430 2.9E3 533.9009 2.5E3 END IONS BEGIN IONS FEATURE_ID=843 PEPMASS=583.4152 SCANS=843 RTINSECONDS=996.183 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 65.0384 8.0E3 67.0541 7.2E4 68.1375 2.2E3 69.0334 4.8E4 69.0697 8.2E4 71.0489 4.8E4 74.0557 2.3E3 76.9073 2.9E3 77.0388 8.3E3 79.0494 3.1E3 79.0541 1.1E5 81.0697 3.4E5 83.0489 7.3E4 83.0853 1.7E5 85.0080 3.1E3 85.0286 6.9E3 85.0646 2.5E4 87.0440 1.3E4 91.0541 1.2E5 93.0697 4.0E5 95.0490 9.7E4 95.0853 3.1E5 95.0925 2.4E3 97.0647 2.8E5 97.1011 1.2E4 101.0596 2.5E3 103.0545 7.7E3 104.0614 4.6E3 105.0440 2.7E3 105.0697 6.5E5 105.0761 4.0E3 107.0491 7.7E3 107.0854 4.1E5 109.0646 5.6E4 109.1010 2.6E5 111.0803 6.0E4 113.0960 1.6E5 115.0541 1.0E4 117.0697 4.7E4 119.0487 2.5E3 119.0756 5.8E3 119.0854 6.4E5 119.0926 4.4E3 119.0954 5.2E3 120.0937 5.5E3 121.0646 4.5E4 121.1010 5.1E5 121.1086 2.6E3 123.0803 1.4E5 123.1166 7.0E4 125.0596 1.4E4 125.0960 1.0E5 128.0623 4.2E3 129.0697 3.0E4 130.0775 9.3E3 131.0747 4.4E3 131.0854 1.9E5 132.0933 7.4E3 133.0647 9.0E3 133.1011 3.7E5 133.1127 7.2E3 135.0247 3.8E3 135.0803 5.8E4 135.1167 1.5E5 137.0959 1.2E5 139.0751 1.3E4 139.1015 2.8E3 139.1117 3.2E5 141.0699 3.9E3 142.0778 2.6E4 143.0854 1.8E5 144.0932 3.1E4 145.0653 3.9E3 145.0886 6.8E3 145.1011 5.4E5 145.1203 3.2E3 146.1090 3.7E3 147.0804 5.9E4 147.1167 5.5E5 149.0961 5.1E4 149.1325 2.8E4 151.0752 5.1E4 151.1115 4.7E4 153.0911 2.1E4 153.1273 7.5E4 155.0854 6.4E4 155.1065 5.8E4 156.0935 3.6E4 157.0864 6.2E3 157.1011 3.5E5 157.1168 4.0E3 158.1085 2.3E4 159.0806 3.1E4 159.1168 2.3E5 160.0882 4.7E3 161.0961 6.1E4 161.1324 7.6E4 163.1117 8.6E4 163.1469 7.0E3 165.0910 1.2E5 165.1276 1.9E4 167.0854 1.2E4 167.1065 1.4E4 167.1431 3.9E3 168.0936 1.0E4 169.1013 1.7E5 169.1179 6.0E3 170.1089 3.1E4 171.0812 7.1E3 171.1169 2.3E5 172.1247 1.7E4 173.0960 4.2E4 173.1326 1.6E5 173.5224 2.0E4 173.5325 2.5E4 173.5411 3.3E4 175.1121 3.2E4 175.1482 8.6E4 177.0910 1.1E4 177.1278 2.1E4 179.0861 1.8E4 179.1433 6.9E4 180.0933 8.0E3 181.1015 8.5E4 181.1225 1.8E5 182.1087 3.0E4 183.1170 1.7E5 184.1249 1.9E4 185.0959 3.2E4 185.1326 1.5E5 186.1406 7.6E3 187.1116 3.3E4 187.1482 7.9E4 188.7135 2.9E3 189.1276 4.0E4 191.1064 2.6E3 191.1431 4.1E4 193.1014 3.9E4 193.1204 5.7E3 194.1092 3.2E4 195.1169 1.4E5 195.1381 4.8E4 196.1248 6.8E4 197.0992 7.9E3 197.1326 2.1E5 198.1407 1.1E4 199.1124 2.0E4 199.1483 9.8E4 199.8557 2.5E3 200.1555 3.4E3 201.1278 2.4E4 201.1639 4.2E4 203.1432 8.7E4 205.1589 5.7E4 206.1089 1.4E4 207.1169 7.2E4 207.1385 5.6E4 208.1247 3.4E4 208.1451 8.1E3 209.1102 3.0E3 209.1327 2.4E5 209.1516 2.7E3 210.1405 2.2E4 211.1126 1.5E4 211.1484 1.7E5 213.1277 2.0E4 213.1642 2.6E4 214.1350 4.9E3 215.1433 2.8E4 215.1777 2.9E3 217.1593 2.0E4 219.1172 2.0E4 219.1747 1.1E4 220.1244 1.9E4 221.1323 1.0E5 221.1542 1.7E5 222.1406 3.2E4 223.1124 9.4E3 223.1485 1.2E5 224.1201 2.5E3 224.1563 1.1E4 225.1281 1.8E4 225.1640 5.2E4 227.1435 3.1E4 227.1811 4.1E3 229.1593 1.5E4 231.1163 4.9E3 231.1739 4.5E3 233.1325 2.7E4 233.1546 2.4E4 234.1399 1.4E4 235.1484 8.7E4 235.1706 2.5E3 236.1553 6.2E3 237.1273 1.9E4 237.1642 7.1E4 238.1363 5.2E3 239.1435 1.3E4 239.1794 2.0E4 241.1593 1.7E4 241.1945 5.8E3 243.1753 2.8E4 245.1310 1.3E4 245.1542 2.7E4 245.1884 3.2E3 246.1375 4.9E3 246.1619 3.2E4 247.1466 2.6E4 247.1699 1.0E5 248.1566 1.3E4 249.1253 2.7E3 249.1366 3.3E3 249.1639 4.6E4 251.1469 5.1E3 251.1793 2.8E4 253.1578 1.3E4 253.1933 8.0E3 255.1391 3.1E3 255.1734 1.0E4 257.1896 1.4E4 259.1446 5.2E3 259.1723 1.2E4 260.1567 2.8E3 260.1790 9.5E3 261.1632 2.8E4 261.1888 1.4E4 262.1715 1.4E4 263.1472 3.4E3 263.1793 4.4E4 265.1607 1.1E4 265.1952 2.6E4 267.1750 1.4E4 267.2096 4.7E3 269.1908 2.9E4 271.1718 1.1E4 272.1793 1.1E4 273.1875 2.0E4 275.1796 4.5E4 276.1886 5.5E3 277.1561 2.6E3 277.1667 3.9E3 277.1960 3.8E4 279.1761 4.3E3 281.1905 1.1E4 281.2950 3.2E3 282.2801 1.1E4 283.1710 8.7E3 283.2052 1.6E4 283.2827 1.2E4 285.1857 1.2E5 285.2180 2.6E3 286.1940 1.8E4 287.2014 4.1E4 289.1960 1.6E4 291.1750 4.7E3 291.2098 1.0E4 293.1907 1.1E4 297.1857 1.6E4 298.1936 3.5E4 299.2013 8.1E4 300.2085 3.5E3 300.3076 3.6E3 301.1953 4.6E3 303.2135 9.0E3 306.1966 4.9E3 307.2065 4.3E3 309.1853 1.3E4 309.2242 4.0E3 311.2011 4.6E4 312.2073 8.5E3 313.2170 1.6E4 321.2232 3.8E3 324.2097 1.2E4 325.2151 3.6E3 335.2375 5.9E3 337.2190 6.0E3 339.2337 8.7E3 349.2163 3.1E4 351.0088 2.8E3 351.2318 1.4E4 352.2412 9.9E3 353.2480 5.5E4 363.2307 1.0E4 364.2405 5.5E4 365.2487 3.7E3 375.2309 4.5E3 377.2473 2.7E4 390.2544 7.4E3 415.3048 3.1E3 417.2649 2.6E3 425.3038 2.6E3 427.2984 2.7E3 445.3100 1.3E4 491.3523 1.3E5 545.2259 2.6E3 565.4034 5.5E3 583.4152 3.7E4 END IONS BEGIN IONS FEATURE_ID=844 PEPMASS=567.4202 SCANS=844 RTINSECONDS=996.221 CHARGE=1+ MSLEVEL=2 MERGED_STATS=1 / 6 (5 removed due to low quality, 0 removed due to low cosine). 63.9283 1.3E4 65.0383 1.3E4 67.0539 1.5E5 69.0332 5.5E4 69.0664 1.1E4 69.0696 1.4E5 71.0488 5.0E4 79.0495 1.6E4 79.0539 2.5E5 79.4813 1.3E4 81.0696 6.8E5 83.0488 7.7E4 83.0853 7.0E4 83.6807 1.1E4 85.0646 2.9E4 91.0482 2.1E4 91.0539 2.7E5 93.0696 7.8E5 93.0768 1.8E4 95.0489 1.4E5 95.0852 3.9E5 97.0645 1.3E5 97.1008 2.5E4 103.0543 1.6E4 105.0696 1.1E6 105.0769 1.6E4 105.0782 2.6E4 107.0490 1.7E4 107.0731 1.5E4 107.0772 2.4E4 107.0852 7.4E5 109.0645 7.9E4 109.0927 2.4E4 109.1009 5.5E5 110.5979 1.4E4 111.0801 1.5E5 115.0544 1.4E4 117.0696 1.1E5 119.0852 1.3E6 119.0935 2.0E4 120.0930 1.6E4 121.0646 3.2E4 121.1009 1.1E6 121.1094 1.6E4 122.0733 1.7E4 123.0801 8.9E4 123.1165 1.4E5 125.0958 8.6E4 128.0622 2.7E4 129.0695 6.3E4 130.0776 2.9E4 131.0853 4.0E5 132.0926 1.5E4 133.0652 1.6E4 133.0763 1.8E4 133.1009 1.0E6 133.1110 2.0E4 135.0803 7.2E4 135.1166 4.2E5 137.0958 3.1E5 137.1074 1.1E4 137.1328 2.1E4 139.1116 8.0E4 141.0699 2.5E4 142.0775 4.0E4 143.0852 3.6E5 144.0931 7.2E4 145.1009 1.1E6 145.1122 2.0E4 146.1084 2.3E4 147.0801 8.8E4 147.1165 8.5E5 147.1275 1.1E4 149.0959 7.1E4 149.1322 4.5E4 151.1114 1.2E5 155.0851 1.1E5 156.0932 7.0E4 157.1009 6.5E5 157.1127 1.1E4 158.1091 5.4E4 159.0798 3.3E4 159.1166 5.3E5 160.1243 1.5E4 161.0958 1.0E5 161.1323 1.4E5 163.1116 5.0E4 163.1472 2.1E4 165.0903 1.4E4 165.1270 1.3E4 167.0857 4.7E4 168.0930 2.1E4 169.1011 2.9E5 170.1089 6.3E4 171.0805 1.9E4 171.1168 4.2E5 172.1245 2.7E4 173.0960 4.8E4 173.1324 3.3E5 173.5314 1.4E5 175.1116 3.5E4 175.1482 2.0E5 177.1269 1.6E4 179.0858 5.6E4 181.1011 1.1E5 182.1090 6.6E4 183.1168 2.6E5 184.1241 3.7E4 185.1324 2.8E5 186.1401 2.4E4 187.1118 1.9E4 187.1481 1.7E5 189.1271 3.8E4 189.1629 2.0E4 191.1431 3.0E4 192.0933 1.6E4 193.1012 7.7E4 194.1089 7.8E4 195.1167 2.6E5 196.1246 1.0E5 197.1126 2.3E4 197.1325 3.4E5 198.1395 3.3E4 199.1117 1.7E4 199.1482 2.1E5 201.1285 1.7E4 201.1638 6.7E4 203.1425 4.1E4 205.1581 1.7E4 206.1094 3.6E4 207.1170 1.3E5 208.1249 6.4E4 209.1324 3.1E5 209.1509 8.0E3 210.1407 4.8E4 211.1482 2.9E5 211.1708 1.4E4 212.1563 2.4E4 213.1275 3.7E4 213.1643 4.2E4 215.1427 2.2E4 217.1586 1.5E4 219.1171 1.6E4 220.1238 3.1E4 221.1325 1.8E5 221.1551 9.6E3 222.1401 4.6E4 223.1484 2.0E5 224.1540 2.7E4 225.1638 9.2E4 225.1875 1.5E4 227.1432 2.7E4 227.1797 2.1E4 229.1582 2.7E4 231.1154 1.7E4 232.1248 1.4E4 233.1326 5.3E4 234.1399 3.3E4 235.1486 1.1E5 236.1556 2.2E4 237.1640 9.1E4 239.1430 1.9E4 239.1791 4.2E4 241.1950 2.0E4 245.1317 2.7E4 246.1405 2.5E4 247.1477 7.3E4 248.1554 3.4E4 249.1637 7.0E4 251.1797 6.0E4 253.1603 1.4E4 253.1951 3.1E4 257.1319 1.3E4 259.1478 3.8E4 260.1559 2.5E4 261.1638 6.0E4 262.1711 2.6E4 263.1802 5.9E4 264.1858 1.3E4 265.1942 4.3E4 267.1760 1.6E4 267.2106 1.9E4 269.1899 2.1E4 273.1630 2.6E4 274.1712 2.0E4 275.1799 5.3E4 276.1856 1.4E4 277.1953 5.6E4 281.1919 1.3E4 285.1658 1.6E4 287.1793 1.6E4 289.1952 3.7E4 290.2049 1.3E4 291.2119 1.7E4 299.1783 1.9E4 301.1944 2.2E4 303.2140 1.4E4 315.2088 2.3E4 317.2277 1.7E4 341.2267 1.3E4 343.2402 1.7E4 355.2453 1.5E4 411.3050 2.0E4 END IONS BEGIN IONS FEATURE_ID=845 PEPMASS=584.4218 SCANS=845 RTINSECONDS=996.294 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 5 (1 removed due to low quality, 0 removed due to low cosine). 67.0539 4.7E4 69.0333 2.7E4 69.0695 5.7E4 70.3857 3.3E3 71.0489 2.7E4 71.0853 2.8E3 73.0280 3.2E3 77.0384 6.8E3 79.0539 8.1E4 79.4770 2.3E3 80.0619 2.2E4 81.0696 2.3E5 81.6369 2.2E3 82.0730 1.2E4 83.0488 4.1E4 83.0852 7.2E4 84.0885 6.9E3 84.1596 2.8E3 85.0645 2.0E4 87.0437 1.5E4 89.0594 1.5E5 91.0540 7.6E4 92.0620 4.4E3 93.0695 3.1E5 94.0729 1.0E4 95.0489 1.0E5 95.0852 1.8E5 96.0885 1.0E4 97.0645 1.2E5 98.0678 1.0E4 103.0545 3.1E3 105.0447 2.7E3 105.0696 3.5E5 106.0728 2.1E4 107.0488 7.0E3 107.0852 2.9E5 108.0563 2.7E3 108.0881 1.4E4 109.0645 4.2E4 109.0928 2.7E3 109.1009 2.1E5 110.1042 1.1E4 111.0801 3.7E4 113.0959 6.2E4 114.0996 3.0E3 115.0544 3.1E3 117.0695 5.0E4 119.0754 4.9E3 119.0852 4.7E5 119.0930 2.8E3 119.0955 1.0E4 120.0911 3.3E4 121.0646 2.8E4 121.0910 4.1E3 121.1009 3.2E5 121.1097 2.9E3 122.1044 2.9E4 123.0802 2.0E5 123.1165 4.4E4 124.0837 3.5E3 125.0596 3.9E3 125.0958 5.4E4 128.0624 7.5E3 129.0695 3.3E4 130.0776 1.6E4 131.0853 2.0E5 132.0928 4.7E4 133.0646 6.9E3 133.0858 6.5E4 133.1009 3.3E5 133.1128 6.3E3 134.1070 2.8E4 135.0803 5.1E4 135.1166 1.1E5 136.0860 4.9E3 136.1201 7.3E3 137.0959 7.7E4 137.1333 4.2E3 138.1033 3.1E4 139.1115 1.1E5 140.1149 1.7E4 142.0773 2.1E4 143.0853 2.0E5 144.0926 6.0E4 145.0647 2.2E4 145.1010 5.8E5 145.1142 8.6E3 145.6926 2.6E3 146.0728 3.4E3 146.1066 5.6E4 147.0802 4.3E4 147.1166 2.5E5 148.1200 4.2E4 149.0958 4.7E4 149.1322 2.6E4 150.1022 3.6E3 151.0752 1.1E4 151.1116 3.1E4 153.0902 4.4E3 153.1274 1.8E4 155.0852 5.5E4 155.1061 4.6E4 156.0930 5.2E4 157.1009 3.5E5 158.1082 8.6E4 159.0806 4.5E4 159.1166 2.9E5 160.0882 2.6E5 160.1036 5.7E3 160.1215 2.4E4 161.0959 6.2E4 161.1323 6.1E4 162.1002 4.7E3 163.1116 5.7E4 163.1474 6.2E3 163.3852 3.1E3 164.1172 4.1E3 165.0910 5.7E4 165.1268 6.5E3 166.0946 3.4E3 167.0856 1.3E4 167.1066 5.9E4 168.0926 8.1E3 169.1011 1.4E5 170.1079 4.4E4 171.1008 3.8E3 171.1168 2.5E5 172.1233 3.5E4 173.0963 2.7E4 173.1324 1.5E5 173.5229 1.5E4 173.5318 8.9E4 173.5433 2.3E4 174.1371 1.9E4 175.1120 4.0E4 175.1482 6.4E4 176.1206 3.0E3 176.1515 5.2E3 177.1109 7.5E3 177.1272 1.7E4 179.0859 1.3E4 179.1434 2.3E4 180.0939 4.6E3 180.1461 5.1E3 181.1012 5.9E4 181.1224 7.2E4 182.1082 3.2E4 182.1259 5.2E3 183.1168 1.6E5 184.1229 4.3E4 185.0963 2.0E4 185.1325 1.7E5 186.1387 3.8E4 187.1120 2.8E4 187.1481 6.7E4 188.1181 4.4E3 189.1276 4.4E4 190.1334 7.9E3 191.1431 4.4E4 193.1011 3.2E4 193.1208 1.1E4 194.1086 2.5E4 195.1167 1.4E5 195.1371 2.5E4 196.1237 4.7E4 196.4696 2.6E3 197.1324 2.3E5 198.1386 4.1E4 199.1124 1.8E4 199.1482 9.9E4 200.1535 1.5E4 201.1277 2.5E4 201.1637 2.7E4 202.1335 4.2E3 203.1431 5.7E4 204.1476 7.1E3 205.1591 1.5E4 207.1167 5.9E4 207.1372 2.7E4 208.1238 2.7E4 208.1449 5.4E3 209.1325 1.6E5 210.1385 4.6E4 211.1133 1.8E4 211.1483 1.4E5 212.1541 2.5E4 213.1274 2.6E4 213.1636 4.6E4 214.1335 3.7E3 215.1429 1.4E4 217.1588 9.4E3 219.1158 3.4E3 220.1256 1.0E4 221.1323 6.7E4 221.1541 9.1E4 222.1379 2.4E4 222.1577 8.4E3 223.1483 1.1E5 224.1540 2.9E4 225.1274 1.6E4 225.1641 7.0E4 226.1708 1.6E4 227.1434 1.9E4 227.1803 3.2E3 229.1585 1.3E4 231.1171 4.0E3 231.1381 3.3E3 231.1703 2.9E3 233.1318 2.6E4 233.1551 2.0E4 234.1377 1.1E4 234.1600 2.6E3 235.1483 5.7E4 236.1542 1.6E4 237.1640 5.7E4 238.1676 8.5E3 239.1439 1.3E4 239.1792 2.9E4 241.1587 1.0E4 243.1752 7.3E3 245.1310 3.8E3 245.1544 3.7E3 246.1612 3.3E4 247.1460 2.5E4 247.1702 2.9E4 248.1511 4.1E3 248.1754 5.1E3 249.1643 3.9E4 250.1689 6.9E3 251.1796 2.7E4 251.3520 2.8E3 252.1849 3.1E3 253.1590 1.0E4 253.1955 1.6E4 255.1746 1.3E4 257.1909 4.1E3 258.1396 2.8E3 259.1699 1.3E4 260.1785 5.0E3 261.1624 2.9E4 263.1798 3.9E4 264.1841 8.3E3 265.1949 2.2E4 266.2010 1.2E4 267.1763 8.1E3 269.1895 5.9E3 271.1705 2.0E4 273.1863 9.5E3 274.1936 3.3E3 275.1785 2.5E4 276.1836 6.1E3 277.1950 1.5E4 278.1989 5.4E3 279.2107 5.2E3 281.1886 4.0E3 283.2058 1.0E4 285.1861 2.1E4 286.1922 4.0E4 287.2012 2.9E4 289.1956 9.7E3 291.2109 1.1E4 297.1854 1.1E4 298.1935 6.5E3 299.1999 3.5E4 300.2060 9.2E3 310.1920 4.2E3 311.2023 1.6E4 312.2067 1.0E4 321.2198 4.0E3 325.2171 7.2E3 337.2159 1.2E4 339.2292 6.1E3 345.2591 3.3E3 352.2396 2.9E4 353.2480 1.3E4 354.2518 6.2E3 365.2456 3.1E4 366.2566 6.3E3 409.2767 3.4E3 446.3151 3.7E3 459.3012 3.1E3 491.3615 4.6E3 492.3582 2.0E4 492.6389 2.9E3 526.8341 3.7E3 545.2681 2.4E3 553.0750 2.3E3 584.4188 4.2E3 END IONS BEGIN IONS FEATURE_ID=846 PEPMASS=613.4236 SCANS=846 RTINSECONDS=996.323 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 67.0539 2.7E4 69.0333 4.0E3 69.0696 4.0E4 70.9707 2.7E3 71.0491 2.9E3 79.0539 5.3E4 81.0695 1.4E5 83.0489 2.2E4 83.0852 2.2E4 84.0317 2.5E3 85.0646 3.4E3 86.4860 2.6E3 87.2105 2.2E3 89.4703 2.3E3 91.0539 5.8E4 93.0695 1.8E5 94.0733 3.3E3 95.0488 3.8E4 95.0852 1.0E5 97.0645 2.2E4 97.1011 5.6E3 99.0437 8.4E3 105.0695 2.3E5 106.0724 3.1E3 107.0851 1.7E5 109.0644 2.9E4 109.1008 1.3E5 111.0802 1.6E4 117.0696 2.7E4 119.0760 9.9E3 119.0852 3.1E5 119.0951 8.6E3 121.0645 8.9E3 121.1008 2.2E5 122.1043 7.6E3 123.0800 4.5E4 123.1164 4.2E4 125.0956 2.9E4 129.0696 1.7E4 131.0852 1.1E5 132.0925 2.5E4 133.1008 2.5E5 133.1126 3.3E3 134.1048 9.9E3 135.0801 2.9E4 135.1165 9.2E4 136.1203 2.7E3 137.0959 4.9E4 138.1028 6.7E3 139.1112 1.6E4 142.0777 1.3E4 142.4554 2.4E3 143.0851 9.0E4 144.0927 1.6E4 145.0892 2.8E3 145.1009 3.1E5 146.1051 2.6E4 147.0801 1.8E4 147.1165 1.9E5 149.0955 2.7E4 149.1322 1.6E4 151.1114 2.3E4 155.0851 2.7E4 156.0928 2.2E4 157.1008 1.8E5 158.1066 3.1E4 159.0803 9.3E3 159.1166 1.6E5 159.9436 2.5E3 160.1209 8.1E3 161.0958 2.7E4 161.1321 3.8E4 163.1116 1.4E4 163.1480 1.2E4 165.0697 3.3E3 167.0855 7.6E3 167.1067 2.7E3 169.1010 7.9E4 170.1074 2.2E4 171.0808 2.7E3 171.1166 1.2E5 172.1223 1.8E4 173.0959 1.0E4 173.1323 1.2E5 173.5222 1.8E4 173.5328 4.3E4 173.5420 1.6E4 174.1359 8.5E3 175.1116 1.6E4 175.1481 6.7E4 177.1272 3.6E3 179.0845 4.5E3 180.6527 2.7E3 181.1010 3.5E4 182.1084 1.8E4 183.1168 7.7E4 184.1233 2.6E4 185.1324 7.3E4 186.1374 1.6E4 187.1121 5.8E3 187.1479 5.0E4 188.1523 2.3E3 189.1277 1.4E4 191.1429 2.5E4 193.1012 1.6E4 194.1086 1.7E4 195.1165 7.3E4 196.1235 3.0E4 197.1323 1.0E5 198.1378 2.4E4 199.1133 7.7E3 199.1479 9.5E4 200.1525 6.9E3 201.1280 7.1E3 201.1637 2.8E4 203.1412 9.1E3 205.7311 2.7E3 206.1104 3.1E3 207.1170 3.2E4 208.1237 2.2E4 209.1323 8.8E4 210.1381 2.9E4 211.1480 9.1E4 212.1527 2.0E4 213.1275 1.1E4 213.1637 2.4E4 215.1427 7.3E3 217.1587 3.1E4 219.1175 7.6E3 220.1252 7.3E3 221.1325 4.9E4 222.1385 1.4E4 223.1479 6.7E4 224.1540 1.8E4 225.1252 2.6E3 225.1634 2.9E4 226.1687 8.0E3 227.1426 8.1E3 227.1778 3.0E3 228.1500 3.0E3 231.5155 3.0E3 233.1318 1.6E4 234.1391 8.5E3 235.1481 3.7E4 236.1546 1.2E4 237.1637 3.7E4 238.1680 1.4E4 239.1443 4.0E3 239.1785 1.7E4 241.1940 3.6E3 245.1321 7.1E3 247.1480 2.2E4 248.1546 8.7E3 249.1635 2.2E4 250.1689 8.7E3 251.1793 2.3E4 252.1860 9.4E3 253.1933 1.5E4 257.1891 2.7E3 259.1486 5.5E3 260.1551 7.9E3 261.1628 1.9E4 262.1717 8.0E3 263.1792 2.5E4 264.1838 7.3E3 265.1950 2.3E4 269.1902 1.1E4 271.2082 3.7E3 273.1624 3.1E3 274.1733 4.3E3 275.1798 1.4E4 276.1866 1.0E4 277.1947 1.5E4 281.1888 4.3E3 283.2056 9.6E3 287.1783 3.5E3 289.1969 1.1E4 291.2110 6.3E3 295.2058 9.7E3 298.1914 3.6E3 299.1952 5.0E3 314.2034 2.5E3 317.2267 3.6E3 333.2219 3.1E3 348.2462 3.7E3 391.2589 2.8E3 417.1725 2.5E3 429.3153 3.3E3 512.2758 3.0E3 END IONS BEGIN IONS FEATURE_ID=847 PEPMASS=629.4198 SCANS=847 RTINSECONDS=996.323 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 4 (1 removed due to low quality, 0 removed due to low cosine). 65.1955 2.3E3 67.0540 1.6E4 67.5380 2.8E3 69.0695 7.4E3 69.1309 2.3E3 70.8596 2.6E3 79.0541 1.8E4 81.0696 4.3E4 81.1388 2.5E3 83.0488 4.5E3 83.0854 3.7E3 89.0593 3.2E4 91.0538 1.7E4 93.0695 4.5E4 93.2469 2.3E3 95.0488 1.0E4 95.0851 2.5E4 97.0645 1.5E4 97.2676 2.3E3 100.1380 2.3E3 100.4685 2.6E3 105.0695 5.3E4 105.6171 2.7E3 107.0851 4.8E4 109.0644 1.4E4 109.1009 4.8E4 111.6779 2.2E3 117.0701 6.0E3 118.9178 2.4E3 119.0852 7.0E4 121.0247 2.3E3 121.1008 6.4E4 123.0803 9.4E3 123.1167 1.0E4 125.0956 8.4E3 125.2557 2.7E3 126.0329 2.1E3 129.0689 3.3E3 131.0852 3.2E4 133.0855 1.4E4 133.0893 3.0E3 133.1009 6.8E4 135.0810 5.0E3 135.1166 2.1E4 137.0958 1.9E4 139.1112 1.3E4 143.0852 3.0E4 144.0933 2.5E3 145.1010 7.9E4 147.0810 7.4E3 147.1164 2.4E4 151.0760 3.8E3 151.1110 3.7E3 156.0930 3.8E3 156.2626 2.6E3 157.1008 5.2E4 159.1167 3.4E4 161.0959 1.1E4 161.1319 9.2E3 163.1116 1.3E4 167.1078 3.3E3 169.1011 2.9E4 171.1167 3.0E4 173.1326 2.2E4 173.5285 4.7E4 173.5384 2.7E4 175.1118 3.3E3 175.1479 1.3E4 181.1020 6.9E3 183.1168 2.7E4 185.1324 2.1E4 186.9973 2.5E3 187.1472 5.0E3 189.1268 3.2E3 191.1433 3.4E3 191.9778 2.7E3 193.0858 2.5E3 195.1171 1.9E4 196.1245 6.2E3 197.1323 2.7E4 199.1483 1.3E4 201.1638 3.3E3 207.1169 9.2E3 209.1326 2.6E4 211.1484 1.6E4 221.1325 1.1E4 223.1482 1.7E4 223.9691 2.7E3 225.1638 8.4E3 235.1478 6.9E3 237.1642 8.9E3 249.1636 4.0E3 259.1432 2.3E3 261.1651 2.7E3 263.1792 2.7E3 275.1802 2.4E3 300.0621 2.9E3 376.1250 2.6E3 398.4460 2.5E3 402.0728 2.7E3 412.0632 2.5E3 507.4015 2.6E3 553.2368 2.8E3 598.4518 2.4E3 635.7117 2.8E3 END IONS BEGIN IONS FEATURE_ID=848 PEPMASS=630.4266 SCANS=848 RTINSECONDS=996.323 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 5 (3 removed due to low quality, 0 removed due to low cosine). 67.0538 3.9E3 69.0696 3.0E3 70.0772 2.2E3 71.0489 3.6E3 74.5191 2.9E3 79.0540 5.6E3 81.0695 1.6E4 83.0853 2.5E3 89.0594 9.2E3 91.0540 2.8E3 93.0696 2.3E4 95.0489 6.4E3 95.0852 1.1E4 97.1414 2.6E3 105.0695 2.3E4 107.0851 2.2E4 107.5158 2.3E3 109.0647 9.0E3 109.1008 1.8E4 117.0693 4.4E3 117.1773 2.2E3 119.0851 3.9E4 119.9619 2.5E3 120.0887 2.3E3 121.1007 2.1E4 123.0799 1.2E4 125.0593 2.6E3 125.0962 4.9E3 131.0853 1.5E4 132.0933 3.6E3 133.1007 2.9E4 135.0806 6.6E3 135.1165 9.1E3 137.0960 5.0E3 143.0854 1.8E4 144.0920 3.4E3 145.1008 4.4E4 147.1165 1.5E4 149.0955 6.4E3 151.1104 3.1E3 155.0848 4.0E3 157.1008 1.9E4 158.1069 6.8E3 159.1162 1.6E4 161.0962 3.2E3 161.1329 3.6E3 163.1107 6.9E3 169.1012 1.1E4 171.1165 1.4E4 173.1324 1.3E4 173.5315 4.4E4 175.1480 9.3E3 181.1019 2.8E3 181.1217 3.3E3 183.1165 1.3E4 185.1321 8.5E3 187.1483 2.7E3 190.6258 2.6E3 190.6846 2.4E3 191.1429 3.7E3 195.1161 9.0E3 197.1321 1.0E4 199.1118 2.6E3 199.1488 5.3E3 201.1280 3.0E3 207.1161 3.8E3 209.1328 7.9E3 211.1484 6.2E3 212.4924 2.6E3 213.1625 6.7E3 218.4745 2.5E3 221.1331 3.8E3 223.1476 5.0E3 225.1634 2.8E3 252.1838 2.7E3 286.1885 2.6E3 558.7722 2.5E3 END IONS BEGIN IONS FEATURE_ID=849 PEPMASS=566.4117 SCANS=849 RTINSECONDS=996.538 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 63.2242 2.2E3 67.0540 1.3E4 67.5864 2.2E3 69.0697 1.1E4 70.1956 2.3E3 71.0491 5.1E3 72.4141 2.4E3 78.3476 2.2E3 79.0539 1.7E4 80.0617 6.1E3 81.0696 3.8E4 82.2681 2.4E3 83.0490 3.6E3 83.0854 1.1E4 87.1276 2.5E3 91.0539 1.5E4 93.0696 5.6E4 95.0489 1.9E4 95.0853 4.1E4 97.0644 2.4E4 105.0695 6.8E4 105.4417 2.4E3 107.0852 6.2E4 109.0645 6.7E3 109.1009 4.2E4 110.1045 2.5E3 111.0802 1.2E4 113.0959 1.8E4 113.9882 2.7E3 117.0698 1.3E4 119.0767 3.0E3 119.0852 9.9E4 121.0643 3.2E3 121.1008 5.4E4 123.0801 2.9E4 123.1165 7.6E3 125.0958 7.4E3 130.0773 3.2E3 131.0851 4.3E4 132.0933 1.0E4 133.1008 6.7E4 135.0804 7.6E3 135.1168 2.6E4 137.0961 1.3E4 139.1114 2.0E4 143.0852 4.6E4 144.0928 1.5E4 145.1009 1.2E5 146.1083 4.0E3 147.0803 1.0E4 147.1165 3.7E4 149.0950 3.4E3 151.1122 3.2E3 152.5439 2.8E3 155.0850 8.3E3 155.1067 3.1E3 156.0931 1.6E4 157.1008 7.8E4 158.1087 1.0E4 159.0801 1.5E4 159.1166 5.6E4 160.0877 6.5E3 161.0958 1.4E4 161.1323 3.4E3 162.0478 2.4E3 167.0853 5.7E3 169.1009 3.6E4 170.1085 1.1E4 171.0806 2.7E3 171.1165 4.1E4 173.0964 8.2E3 173.1324 3.8E4 173.5072 2.9E3 173.5300 6.5E4 173.5438 9.4E3 175.1103 2.7E3 175.1478 1.6E4 179.1428 7.8E3 181.1016 2.0E4 181.1217 1.6E4 183.1166 4.6E4 184.1234 1.0E4 185.0960 6.4E3 185.1323 3.7E4 187.1106 4.4E3 187.1483 1.8E4 189.1265 4.2E3 191.1436 4.3E3 192.5698 2.6E3 193.1006 3.5E3 194.1093 3.4E3 195.1166 4.4E4 196.1237 1.3E4 197.1323 5.5E4 198.1393 5.7E3 199.1124 5.8E3 199.1481 2.3E4 200.1192 3.4E3 201.1269 5.7E3 203.1430 1.5E4 207.1169 2.2E4 208.1251 5.0E3 209.1326 3.6E4 210.1393 7.4E3 211.1123 2.7E3 211.1481 3.0E4 213.1280 9.6E3 213.1624 8.6E3 215.1424 1.1E4 219.1178 4.1E3 221.1322 2.5E4 221.1535 2.2E4 222.1403 3.3E3 223.1479 2.5E4 225.1280 1.3E4 225.1641 1.2E4 227.1437 6.2E3 231.1170 4.2E3 233.1319 7.7E3 235.1478 1.8E4 237.1295 2.6E3 237.1630 1.1E4 239.1417 2.9E3 239.1791 2.9E3 247.1472 1.4E4 249.1632 1.3E4 251.1475 2.6E3 251.1793 9.9E3 253.1589 3.9E3 254.4491 2.6E3 261.1632 1.6E4 263.1776 9.4E3 265.1944 2.7E3 275.1800 1.0E4 279.2171 2.3E3 281.1907 1.1E4 282.2802 3.3E3 283.2067 2.6E3 283.2830 3.3E3 287.2030 2.6E3 298.1921 3.9E3 299.2014 8.3E3 310.3080 5.9E3 311.3165 3.5E3 332.2477 2.4E3 386.6606 2.6E3 536.8918 2.6E3 END IONS BEGIN IONS FEATURE_ID=850 PEPMASS=612.4175 SCANS=850 RTINSECONDS=996.79 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 6 (0 removed due to low quality, 0 removed due to low cosine). 64.4930 2.6E3 64.8053 2.1E3 65.3313 2.2E3 67.0537 1.2E4 68.6482 2.9E3 69.0697 1.3E4 69.3136 2.4E3 70.1481 2.6E3 71.5235 2.3E3 73.0281 1.3E4 73.7840 2.3E3 74.3933 2.4E3 76.5689 2.1E3 79.0539 2.0E4 80.0616 2.8E3 80.6609 2.5E3 81.0024 2.6E3 81.0696 5.9E4 81.0743 2.4E3 83.0489 7.8E3 83.0853 1.5E4 84.1768 2.4E3 84.3249 2.5E3 84.7553 2.2E3 89.0595 1.2E4 90.9362 2.3E3 91.0540 2.5E4 93.0202 2.6E3 93.0695 7.4E4 95.0489 4.6E4 95.0851 3.6E4 97.0644 8.2E3 99.0437 3.4E4 99.0814 2.5E3 99.8256 2.6E3 101.1928 2.7E3 102.3823 2.5E3 105.0695 1.0E5 106.0776 2.5E3 107.0852 1.0E5 109.0408 2.7E3 109.0644 1.3E4 109.1008 4.3E4 109.2047 2.5E3 110.7815 2.9E3 111.0800 2.8E3 117.0696 1.8E4 119.0851 1.5E5 120.0929 1.1E4 121.0647 1.1E4 121.1009 9.0E4 122.1093 2.5E3 122.2311 2.4E3 123.0712 2.2E3 123.0801 1.0E5 123.1161 2.9E3 125.0958 4.7E4 129.0701 4.0E3 129.8257 2.8E3 131.0852 7.8E4 132.0930 5.4E4 133.1009 1.5E5 134.1085 5.0E3 135.0799 1.0E4 135.1166 2.6E4 135.9643 2.7E3 136.3532 2.4E3 137.0957 2.6E4 138.1036 2.3E4 138.1827 2.4E3 141.0691 3.1E3 143.0852 8.1E4 144.0930 2.8E4 145.0888 8.2E3 145.1009 2.5E5 146.1087 1.2E4 146.4084 2.4E3 147.0802 1.1E4 147.1164 8.5E4 149.0956 3.3E4 151.1109 9.9E3 155.0855 2.0E4 156.0931 2.1E4 157.0879 4.1E3 157.1009 1.6E5 158.1085 3.9E4 159.0804 5.7E3 159.1165 1.1E5 160.1242 1.0E4 161.0959 3.7E4 161.1321 1.1E4 163.1115 7.6E3 169.1010 7.8E4 170.1090 1.9E4 171.1167 1.1E5 172.1244 1.6E4 173.0958 9.9E3 173.1325 8.4E4 173.5280 9.3E4 173.5405 4.1E4 175.1122 9.8E3 175.1483 1.3E4 181.1008 2.5E4 182.1097 3.8E3 183.1167 7.7E4 184.1246 1.8E4 185.1324 9.0E4 186.1404 6.7E3 187.1113 7.2E3 187.1479 2.4E4 189.1272 2.2E4 189.5451 2.4E3 191.1428 4.5E4 193.1007 1.1E4 194.1085 1.4E4 195.1165 8.1E4 195.1365 2.3E3 196.1241 2.8E4 197.1323 1.2E5 198.1401 1.8E4 199.1121 6.4E3 199.1481 7.6E4 201.1288 6.2E3 201.1620 3.0E3 203.1424 3.0E3 203.1841 2.6E3 207.1167 2.5E4 208.1253 1.3E4 209.1323 1.1E5 210.1401 2.0E4 211.1482 1.0E5 213.1275 1.1E4 213.1642 9.7E3 215.1424 3.7E3 217.1601 2.7E3 220.1265 3.0E3 221.1323 3.2E4 222.1400 1.0E4 223.1481 6.9E4 224.1560 1.4E4 225.1268 7.0E3 225.1636 2.8E4 227.1436 1.1E4 229.1584 3.1E3 233.1323 6.2E3 233.1548 6.6E3 233.7520 2.4E3 235.1481 2.1E4 237.1638 7.3E4 239.1422 1.1E4 239.1781 2.6E3 241.1621 2.6E3 247.1488 1.1E4 249.1635 2.2E4 250.3430 2.5E3 251.1787 1.6E4 252.1868 8.6E3 253.1946 1.2E4 261.1634 1.9E4 263.1785 2.2E4 265.1932 1.0E4 273.1667 3.0E3 275.1793 7.2E3 276.1864 2.8E3 277.1950 1.2E4 283.1693 3.1E3 283.2072 3.8E3 287.1818 3.4E3 298.1931 4.4E4 329.2259 5.3E3 390.2551 2.8E4 436.2950 3.0E3 446.8841 2.9E3 528.3614 1.3E4 538.3205 2.6E3 615.9606 3.4E3 END IONS BEGIN IONS FEATURE_ID=851 PEPMASS=600.4161 SCANS=851 RTINSECONDS=999.328 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 3 (1 removed due to low quality, 0 removed due to low cosine). 69.0332 3.4E3 69.0695 3.3E3 79.0206 2.4E3 79.0538 5.3E3 81.0697 2.3E4 83.0492 4.7E3 83.0853 4.9E3 85.0647 3.3E3 88.8461 2.3E3 89.0594 4.2E4 91.0540 1.0E4 93.0696 3.0E4 95.0489 1.0E4 95.0854 2.3E4 96.4889 2.1E3 97.0647 9.2E3 105.0697 2.9E4 107.0853 2.6E4 109.0645 9.8E3 109.1009 1.4E4 111.0805 3.5E3 112.2567 2.9E3 113.4288 2.2E3 117.0698 3.6E3 119.0853 5.8E4 121.0652 4.2E3 121.1009 4.1E4 122.1043 4.7E3 123.0802 1.6E4 123.1166 3.0E3 125.0596 2.0E4 131.0852 2.1E4 132.0932 2.2E3 133.0640 2.5E3 133.0860 2.2E4 133.1009 3.9E4 134.1079 2.5E3 134.6264 2.3E3 135.0801 1.7E4 135.1168 1.5E4 137.0960 1.9E4 138.0988 2.4E3 139.0754 3.0E3 143.0851 2.2E4 145.1009 5.3E4 146.1060 3.4E3 147.0802 3.7E4 147.1167 1.7E4 148.0843 4.3E3 149.0960 1.3E4 151.0752 2.0E4 151.1124 2.7E3 152.0795 2.4E3 153.0926 4.0E3 155.0857 5.4E3 156.0921 4.0E3 156.6785 2.5E3 157.1011 4.3E4 158.1051 9.2E3 159.0804 3.9E3 159.1167 3.3E4 160.1213 2.7E3 161.0959 1.1E4 161.1323 1.6E4 163.1116 4.7E4 165.0910 1.4E5 166.0943 3.0E4 168.0933 2.3E3 169.1010 1.7E4 170.1079 4.7E3 171.1167 3.5E4 172.1223 8.6E3 173.0958 7.5E3 173.1322 1.6E4 173.5201 5.1E3 173.5364 4.3E4 175.1115 1.1E4 175.1486 8.4E3 177.0914 5.0E3 177.1283 4.2E3 181.1035 5.3E3 181.1222 4.0E4 182.1261 4.0E3 183.1168 2.6E4 184.1213 7.7E3 185.1324 2.2E4 186.1364 4.6E3 187.1119 1.1E4 187.1472 5.9E3 189.1274 1.3E4 190.1349 1.3E4 191.1070 1.0E4 191.1427 8.1E3 193.1225 1.6E4 194.1079 6.7E3 195.1171 1.1E4 196.1237 4.0E3 197.1320 2.1E4 198.1377 3.7E3 199.1107 4.3E3 199.1475 3.6E3 201.1275 1.1E4 203.1431 5.9E4 204.1462 1.8E4 207.1176 4.6E3 207.1375 1.7E4 208.1441 8.1E3 209.1327 1.4E4 210.1389 3.3E3 211.1118 6.5E3 211.1483 1.6E4 212.1522 5.1E3 213.1277 8.1E3 215.1419 4.5E3 216.1495 3.9E3 219.1385 8.2E3 221.1325 8.3E3 221.1537 1.5E5 222.1570 4.4E4 223.1489 8.5E3 225.1274 6.9E3 225.1634 8.0E3 227.1433 4.6E3 229.1226 3.8E3 229.1585 5.6E3 233.1542 7.0E3 234.1619 1.7E4 235.1468 4.6E3 237.1641 4.7E3 239.1428 2.9E3 239.1802 3.2E3 240.1861 3.6E3 241.1585 2.5E3 247.1691 3.9E4 248.1739 1.3E4 249.1657 2.7E3 251.1434 4.0E3 251.1782 5.5E3 253.1589 3.4E3 255.5271 2.6E3 259.1700 4.7E3 261.1865 3.1E3 263.1785 2.7E3 265.1610 3.8E3 267.1739 2.7E3 271.1696 3.5E3 273.1837 4.0E3 274.1930 1.0E4 281.1897 7.7E3 285.1864 2.6E3 286.1937 1.1E4 287.2005 3.1E4 288.2022 7.0E3 293.1895 2.9E3 297.1855 4.4E3 299.2008 2.4E4 300.2064 4.4E3 307.2030 2.9E3 309.2798 4.7E3 311.2010 4.3E3 312.2061 7.9E3 313.2155 1.9E4 314.2224 3.5E3 325.2160 2.6E4 326.2199 4.1E3 327.2322 1.0E4 328.2343 5.8E3 337.2156 7.4E3 339.2310 3.9E3 340.2394 4.2E4 351.2304 2.9E3 352.2394 2.2E4 365.2462 1.3E4 366.2523 3.9E3 391.2643 4.0E3 392.2660 3.5E3 406.3339 2.6E3 413.2702 1.0E4 420.2982 8.3E3 425.2689 2.5E4 427.2840 2.3E4 428.2877 6.8E3 428.6165 2.6E3 440.2925 3.3E4 454.2995 3.7E3 481.8927 3.0E3 520.3521 5.1E3 542.5720 2.4E3 600.4097 3.7E3 END IONS BEGIN IONS FEATURE_ID=852 PEPMASS=599.4100 SCANS=852 RTINSECONDS=999.408 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 63.3311 2.3E3 67.0542 2.1E4 69.0336 1.8E4 69.0697 1.9E4 71.0494 3.1E3 79.0543 2.2E4 81.0699 7.8E4 81.9849 2.4E3 83.0492 2.8E4 83.0854 1.5E4 85.0283 2.4E3 85.0647 2.3E4 87.0442 2.5E3 91.0542 2.5E4 93.0699 1.2E5 95.0492 2.5E4 95.0855 8.3E4 97.0648 3.3E4 105.0699 9.1E4 107.0855 8.6E4 109.0648 2.6E4 109.1012 4.6E4 111.0803 1.9E4 113.0961 4.0E3 117.0697 1.3E4 119.0856 1.5E5 121.0647 1.7E4 121.1012 1.6E5 123.0804 6.6E4 123.1170 1.9E4 125.0597 4.4E4 125.0961 1.2E4 129.0701 7.6E3 131.0856 5.2E4 132.9713 2.3E3 133.0645 6.4E3 133.1012 1.1E5 135.0804 7.4E4 135.1168 5.4E4 137.0961 8.6E4 139.0755 2.8E4 139.1112 1.7E4 142.0775 7.6E3 143.0855 5.3E4 144.0931 3.9E3 145.1012 1.4E5 145.1141 3.0E3 147.0805 1.8E5 147.0934 5.0E3 147.1168 4.3E4 149.0962 3.5E4 151.0754 9.6E4 151.1115 1.2E4 153.0910 1.2E4 153.1283 2.9E3 155.0855 2.3E4 156.0935 1.2E4 157.1012 1.5E5 158.1098 2.6E3 159.0804 1.6E4 159.1169 9.4E4 160.1260 3.7E3 161.0962 5.4E4 161.1327 7.7E4 163.1118 1.1E5 165.0783 1.1E4 165.0912 8.7E5 165.1251 2.8E3 167.1073 3.3E3 168.0520 2.5E3 168.0932 4.7E3 169.1013 5.7E4 170.1086 1.2E4 171.1170 1.3E5 173.0963 4.2E4 173.1328 4.5E4 173.5271 3.4E4 173.5407 3.0E4 174.1037 2.8E3 175.1118 2.0E4 175.1482 3.3E4 177.0910 2.1E4 177.1280 2.1E4 179.1068 9.6E3 179.1241 2.4E3 179.1429 1.3E4 181.1018 2.0E4 181.1225 5.5E4 182.1094 3.3E3 183.1171 1.2E5 185.0961 5.7E3 185.1328 1.0E5 187.1121 2.3E4 187.1482 3.6E4 187.7612 2.6E3 189.1276 5.1E4 191.0884 3.5E3 191.1069 5.7E4 191.1425 1.7E4 193.1021 8.3E3 194.1092 3.0E3 195.1169 4.1E4 195.1382 2.0E4 196.1244 1.2E4 197.1327 5.8E4 198.1405 2.5E3 198.6922 2.5E3 199.1121 2.1E4 199.1484 1.7E4 201.1280 1.7E4 201.1641 3.1E3 203.1433 3.5E5 203.1648 4.4E3 205.1207 3.3E3 207.1177 1.5E4 207.1385 6.2E4 208.1248 5.2E3 209.1328 5.7E4 211.1127 1.6E4 211.1485 7.5E4 212.1179 2.4E3 213.1280 2.1E4 213.1630 2.7E3 215.1433 2.0E4 217.1580 5.8E3 219.1389 3.6E3 221.1338 2.6E4 221.1539 8.5E5 223.1121 2.8E3 223.1484 2.6E4 225.1277 1.7E4 225.1642 2.1E4 225.2357 2.6E3 227.1434 1.8E4 227.1796 1.2E4 229.1226 1.0E4 229.1586 3.4E4 231.1380 2.4E4 233.1317 9.4E3 233.1544 2.0E4 234.1623 8.3E3 235.1483 1.6E4 236.1551 3.5E3 237.1273 3.8E3 237.1643 1.7E4 239.1433 1.5E4 239.1792 1.1E4 243.1400 6.9E3 243.1730 6.8E3 245.1544 6.4E3 247.1431 1.0E4 247.1695 1.9E5 248.1546 2.6E3 249.1634 1.1E4 251.1434 9.3E3 251.1790 7.9E3 253.1587 7.6E3 255.1382 5.3E3 255.1761 3.0E3 257.1547 1.1E4 260.1534 2.9E3 261.1609 8.3E3 261.1872 6.9E3 262.6438 2.5E3 263.1784 2.0E4 265.1578 6.7E3 265.1963 7.2E3 267.1743 3.4E3 269.1534 2.5E3 269.1903 2.0E4 271.1712 1.3E4 272.1773 6.6E3 275.1799 5.1E3 277.1962 6.3E3 281.1900 1.8E4 283.1698 3.6E3 285.1863 2.0E4 286.1931 3.1E4 287.2011 1.4E5 289.1945 1.0E4 291.1743 3.9E3 293.1900 1.3E4 295.2064 7.3E3 298.1926 9.8E3 299.2013 4.9E4 301.2169 3.3E3 302.3251 2.4E3 307.2062 3.4E3 309.1848 5.0E3 311.2010 2.9E4 312.2093 1.0E4 313.2168 4.0E4 324.2104 7.4E3 325.2159 2.1E4 327.2324 4.8E4 335.2000 5.9E3 363.2316 2.9E3 365.2477 3.8E4 373.2521 6.6E3 391.2117 2.6E3 391.2630 3.7E4 405.0207 2.9E3 413.2684 4.5E4 419.2950 4.0E4 427.2843 9.2E4 453.3002 1.9E4 507.3506 9.6E3 512.2527 2.8E3 517.2160 2.6E3 519.3458 3.1E4 527.0642 2.7E3 545.0072 2.5E3 581.3990 5.7E3 599.4094 2.6E4 599.5038 3.8E3 END IONS BEGIN IONS FEATURE_ID=853 PEPMASS=234.0973 SCANS=853 RTINSECONDS=1001.247 CHARGE=1+ MSLEVEL=2 MERGED_STATS=26 / 26 (0 removed due to low quality, 0 removed due to low cosine). 43.0486 2.2E3 43.4549 2.0E3 43.5703 4.2E3 43.6985 2.1E3 44.2711 2.3E3 44.9535 2.2E3 45.0333 9.9E5 45.1681 2.2E3 45.3370 2.4E3 45.5580 2.8E3 45.6758 2.3E3 46.0439 2.4E3 47.3794 2.7E3 48.0995 2.6E3 50.0204 2.8E3 50.8281 2.1E3 51.0936 2.1E3 51.1655 2.2E3 51.8096 2.3E3 52.0425 2.4E3 52.0857 2.5E3 52.4184 2.1E3 52.7703 2.3E3 53.0005 2.3E3 53.0450 2.5E3 53.0502 2.1E3 54.0852 2.5E3 54.7347 2.8E3 55.2201 2.3E3 56.8061 2.3E3 57.8555 2.7E3 58.9757 2.4E3 59.9872 2.5E3 60.1293 2.3E3 60.8268 2.0E3 61.5923 2.5E3 61.6895 2.4E3 62.3602 2.4E3 63.8582 2.0E3 66.1895 2.4E3 66.2393 2.4E3 66.5204 2.5E3 66.6900 2.1E3 66.8876 2.4E3 67.1196 2.4E3 67.2912 2.5E3 67.4524 2.2E3 67.7277 2.4E3 68.0607 2.5E3 68.2827 2.7E3 68.4055 2.1E3 68.7910 2.2E3 70.0649 8.2E4 70.6443 2.2E3 70.7130 2.1E3 71.8841 2.3E3 72.6547 2.4E3 72.7682 2.4E3 72.9736 2.2E3 73.0283 1.2E7 73.0351 2.0E4 73.0353 9.5E3 73.0379 4.1E3 73.4080 2.2E3 76.6288 2.4E3 77.1065 3.1E3 77.9290 2.2E3 78.5417 2.4E3 78.6268 2.4E3 78.6500 2.3E3 78.8180 2.6E3 78.8956 2.8E3 79.1328 2.3E3 79.4824 2.2E3 79.9686 2.1E3 80.2132 2.4E3 80.5634 2.4E3 81.1706 2.6E3 81.9889 2.3E3 82.2332 2.4E3 82.7117 2.7E3 83.0922 2.4E3 84.1186 2.7E3 85.4515 2.5E3 86.2875 2.3E3 86.4427 2.1E3 87.4483 2.4E3 87.5292 2.4E3 88.0752 5.3E3 88.0989 2.6E3 88.3001 2.8E3 88.4454 2.4E3 90.0288 2.3E3 90.0557 2.2E3 90.5152 2.9E3 90.5632 2.4E3 91.0574 2.8E3 91.0753 2.5E3 92.7970 2.3E3 93.5966 2.4E3 95.2076 2.2E3 95.6456 2.5E3 98.8457 2.3E3 98.8701 2.2E3 101.4513 2.2E3 103.4077 2.4E3 103.9890 2.4E3 104.8282 2.3E3 105.2384 2.1E3 108.0557 2.4E3 108.1604 2.6E3 108.7373 2.3E3 109.8841 2.7E3 111.0582 2.4E3 111.7187 2.4E3 112.4897 2.3E3 114.0911 4.7E4 114.1665 2.4E3 115.1837 2.4E3 116.0703 3.4E5 118.0480 2.6E3 118.1953 2.5E3 118.9482 2.2E3 120.1578 2.2E3 120.5504 2.4E3 121.3823 2.7E3 121.6779 2.3E3 123.0906 2.3E3 125.1898 2.5E3 125.3704 2.3E3 127.1017 2.5E3 127.4138 2.4E3 129.2750 2.3E3 133.3313 2.6E3 135.1661 2.3E3 136.9979 2.4E3 137.2906 2.6E3 138.1629 2.4E3 139.7137 2.3E3 140.8808 2.4E3 140.9544 2.4E3 141.0175 2.5E3 142.1369 2.6E3 142.2185 2.6E3 142.8779 2.3E3 147.2000 2.6E3 149.6884 5.7E3 149.6992 3.6E3 149.7192 2.6E3 151.0751 4.6E4 152.0785 1.0E5 155.8563 2.2E3 157.7961 2.5E3 162.3478 2.5E3 164.9929 2.2E3 168.3019 2.3E3 170.0709 2.5E3 171.5229 2.2E3 173.4452 2.8E3 173.5038 4.3E3 173.5184 6.1E3 173.5266 2.7E5 173.5410 2.2E5 173.5701 4.6E3 173.6608 2.4E3 175.6172 2.4E3 177.5785 2.8E3 178.2020 2.5E3 178.8920 2.5E3 179.2704 2.4E3 181.1216 2.6E3 182.0463 2.6E3 185.1260 2.3E3 187.8844 2.5E3 188.0916 3.0E5 189.2927 2.6E3 190.3435 2.4E3 190.7096 2.5E3 191.8577 2.2E3 192.0576 2.2E3 193.7045 2.4E3 194.8505 2.8E3 196.1325 2.6E3 202.4616 2.3E3 204.0922 2.2E3 204.7910 2.6E3 209.3129 2.4E3 213.6014 2.3E3 214.4439 2.4E3 220.0561 2.4E3 221.7136 2.2E3 223.5273 2.4E3 224.7023 2.5E3 226.2804 2.4E3 226.5024 2.5E3 228.4837 2.4E3 234.1864 2.3E3 234.2211 3.0E4 239.2800 2.5E3 243.7870 2.9E3 END IONS BEGIN IONS FEATURE_ID=854 PEPMASS=341.1385 SCANS=854 RTINSECONDS=1001.272 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 4 (1 removed due to low quality, 0 removed due to low cosine). 55.0177 3.9E3 55.0752 2.7E3 55.3838 2.1E3 57.0690 2.1E3 61.6717 2.2E3 64.8917 2.5E3 69.8435 2.2E3 72.1129 2.2E3 73.5907 2.2E3 77.0386 2.5E3 78.4698 2.4E3 79.0539 1.4E4 81.0334 3.2E3 81.0690 2.3E3 86.0598 6.9E3 91.0538 1.4E4 93.7577 2.5E3 95.0488 1.7E4 95.0847 2.5E3 96.6099 2.4E3 99.7101 2.2E3 103.0539 1.8E4 105.0696 3.9E4 106.0410 2.8E3 107.0490 2.1E4 109.0647 2.6E3 110.9546 2.6E3 115.0542 3.9E3 117.0695 6.8E3 119.0491 8.6E3 121.0646 2.5E4 121.9090 2.5E3 123.0437 2.3E4 124.1235 2.5E3 125.0030 3.1E3 129.0698 6.9E3 131.0489 1.7E5 133.0540 4.3E3 133.0646 2.3E5 133.0764 5.2E3 134.0360 6.3E4 135.0438 1.1E6 135.0560 5.3E3 137.0592 1.5E4 143.0491 4.8E3 143.0850 8.7E3 145.0644 4.1E4 149.0462 2.8E3 149.0595 1.6E5 151.9119 2.3E3 157.0646 1.4E4 159.0441 3.9E3 159.0810 3.4E3 160.0514 8.7E3 161.0369 3.2E3 161.0596 1.8E5 161.0752 2.5E3 163.0749 1.2E4 169.0648 4.8E3 171.0803 2.0E4 173.0598 5.0E4 173.5254 2.6E4 173.5413 8.1E3 174.0660 3.6E3 175.0755 1.1E4 182.5873 3.2E3 185.0594 1.2E4 186.0675 1.5E4 187.0753 5.6E4 197.0600 9.9E3 199.0759 3.5E3 201.0914 2.0E4 203.0705 4.2E3 207.0806 3.1E3 207.1163 3.4E3 209.0608 2.6E3 209.0975 3.3E3 211.0760 3.1E3 213.0925 3.0E3 217.1027 3.3E3 221.0976 3.6E3 227.0694 3.1E3 229.0861 1.3E4 232.5334 3.0E3 235.1127 1.7E4 245.0971 6.9E3 247.1112 2.8E3 248.0836 2.7E3 255.2136 2.5E3 263.1068 1.1E4 293.1168 5.7E3 308.1059 2.0E4 319.6915 2.8E3 323.1286 2.0E4 326.1161 2.3E4 341.1394 1.2E5 341.2833 3.4E3 345.7422 2.5E3 END IONS BEGIN IONS FEATURE_ID=855 PEPMASS=323.1282 SCANS=855 RTINSECONDS=1001.411 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 5 (2 removed due to low quality, 0 removed due to low cosine). 51.0233 8.0E3 53.0388 4.4E3 55.0178 2.4E4 55.3875 2.3E3 56.8251 2.5E3 66.6896 2.5E3 69.0339 3.0E3 69.2725 2.5E3 71.9894 2.5E3 73.0284 3.2E3 76.9309 2.7E3 77.0388 1.4E4 79.0540 4.9E4 80.7791 2.5E3 81.0333 3.1E3 91.0540 5.3E4 93.0698 1.4E4 95.0489 2.6E4 103.0540 1.5E5 104.3586 2.4E3 105.0332 1.2E4 105.0446 4.6E3 105.0697 2.3E5 105.0767 2.1E3 105.0781 3.4E3 107.0490 1.0E5 115.0542 3.2E4 117.0697 2.9E4 119.0489 3.8E4 120.0572 3.5E3 121.0646 2.0E5 123.0803 5.5E3 128.0622 1.2E4 129.0698 1.6E4 131.0489 1.2E6 131.0581 6.7E3 131.0608 3.1E3 132.0568 1.8E4 133.0646 1.7E6 133.0743 8.4E3 135.0439 3.4E6 135.0536 1.8E4 135.0632 1.3E4 135.0679 2.1E4 135.0751 3.7E3 135.0815 4.6E3 137.0598 1.6E4 141.0692 2.8E3 143.0490 6.2E4 143.0853 2.5E4 144.0567 8.7E3 145.0646 2.1E5 148.0517 1.0E4 149.0457 4.6E3 149.0595 5.4E5 149.0704 2.5E3 151.0751 4.6E3 156.0883 2.3E3 157.0646 8.8E4 159.0440 2.8E4 159.0809 2.5E3 160.0518 6.2E4 161.0595 1.3E6 161.0727 1.2E4 163.0753 4.8E4 169.0645 1.3E4 171.0443 4.8E3 171.0804 6.5E4 172.0520 1.2E4 173.0597 2.2E5 173.5254 2.1E4 173.5425 1.5E4 174.0675 1.4E4 175.0754 4.7E4 179.0855 3.6E3 181.0656 3.2E3 182.0734 2.7E3 184.8954 2.7E3 185.0598 1.1E5 186.0676 1.3E5 187.0754 1.7E5 194.0741 3.3E3 195.0800 3.4E3 199.0751 1.6E4 201.0910 4.7E4 202.0783 8.9E3 207.0805 1.4E4 207.1169 2.4E4 215.0858 2.6E3 217.1011 3.9E4 219.0804 3.0E3 220.0883 2.7E4 221.0968 8.6E3 223.0749 3.9E3 233.0964 1.4E4 235.0744 8.8E3 235.1119 1.5E5 241.0826 3.0E3 245.0961 8.1E4 247.1112 4.0E3 248.0832 3.6E4 251.0690 2.9E3 261.0923 8.5E3 263.1065 1.5E5 265.0873 4.6E3 265.1220 9.2E3 275.1065 4.9E3 278.0945 1.7E4 291.1006 4.8E3 291.8394 2.5E3 293.1175 8.6E4 296.8578 2.7E3 308.1046 2.4E5 323.0820 3.0E3 323.1283 3.8E5 326.1166 3.1E3 END IONS BEGIN IONS FEATURE_ID=856 PEPMASS=653.2970 SCANS=856 RTINSECONDS=1001.452 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 3 (1 removed due to low quality, 0 removed due to low cosine). 67.4783 4.4E3 70.5864 2.3E4 70.5890 9.3E3 86.9937 3.6E3 94.6703 3.8E3 130.6677 3.0E3 141.5775 3.4E3 147.7201 6.3E3 173.5193 1.7E4 173.5372 1.0E5 237.8998 7.4E3 357.1450 3.7E3 368.1756 5.3E3 405.2114 1.1E4 407.2232 1.3E5 412.1648 4.8E3 416.2313 2.1E4 420.2307 1.0E5 421.2385 3.1E5 422.2464 3.4E5 428.2321 4.2E3 433.2388 4.5E4 434.2446 6.6E3 435.2536 2.3E4 446.2452 4.0E3 447.2576 6.2E3 448.2614 1.3E5 449.2281 1.5E4 449.2715 2.5E4 450.2772 1.3E5 451.2128 1.4E5 452.2182 9.1E3 459.2522 6.0E3 461.2340 4.0E4 465.1519 6.6E3 465.2282 6.6E5 466.2352 1.1E5 467.2549 3.2E3 474.2399 4.8E3 475.2183 2.8E4 475.2472 2.1E4 476.2548 4.7E4 478.2357 7.5E3 479.2444 3.0E4 487.2114 4.2E4 488.2194 2.9E4 489.2275 2.2E4 491.2080 8.5E4 492.2171 2.0E5 493.2188 8.8E3 493.2571 2.4E4 494.2661 4.9E3 501.2283 1.4E5 501.3081 1.1E4 502.2354 6.4E4 503.2436 1.0E6 503.3333 6.0E3 504.2474 4.9E5 505.2238 2.8E4 507.2732 3.9E4 515.2191 7.7E3 519.2544 4.7E3 520.2560 9.7E3 520.2709 6.7E3 521.2900 5.6E5 522.2978 3.5E5 530.2306 2.6E4 532.2593 8.4E3 534.2290 7.5E4 535.2781 9.5E3 537.2494 1.5E5 538.2592 1.3E4 547.2593 1.0E5 548.2707 3.6E4 549.2856 1.5E6 550.2897 2.1E5 551.2651 3.3E5 557.2565 8.2E3 559.2670 1.4E4 564.2721 2.4E4 565.2794 2.8E5 566.2885 2.1E6 574.2587 5.7E3 575.2653 8.5E5 576.2724 2.2E5 577.2805 2.9E4 578.2461 5.8E3 579.2771 2.8E4 581.2874 7.0E3 589.2535 1.6E4 591.2966 2.1E4 593.2756 7.2E5 594.2801 2.3E5 601.1774 7.9E3 603.2597 3.9E4 607.2903 3.7E5 609.3064 2.4E5 617.2759 4.2E4 620.2632 4.0E3 623.2490 4.3E3 635.2861 7.3E5 635.4060 1.6E4 638.2684 6.1E3 653.2961 2.1E5 653.4182 7.3E3 END IONS BEGIN IONS FEATURE_ID=857 PEPMASS=652.2897 SCANS=857 RTINSECONDS=1001.856 CHARGE=1+ MSLEVEL=2 MERGED_STATS=1 / 1 (0 removed due to low quality, 0 removed due to low cosine). 72.0853 2.3E3 102.2465 2.5E3 151.2885 2.2E3 173.5380 2.4E4 222.8640 3.1E3 259.7971 2.6E3 348.6403 2.8E3 406.2151 2.9E3 420.2293 8.1E3 421.2400 4.1E3 447.2571 3.2E3 449.2682 5.7E3 475.2473 1.1E4 488.2211 8.6E3 491.2067 3.4E3 492.2162 1.0E4 501.2282 4.2E3 503.2432 5.6E5 505.2266 8.4E3 521.2877 1.6E4 537.2479 7.5E3 547.2662 4.2E3 549.1870 4.7E3 549.2854 1.7E5 565.2802 8.7E4 575.2640 5.9E3 593.2753 2.1E5 END IONS BEGIN IONS FEATURE_ID=858 PEPMASS=870.5657 SCANS=858 RTINSECONDS=1002.794 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 2 (0 removed due to low quality, 0 removed due to low cosine). 117.8971 2.3E3 127.0554 2.3E3 173.5193 7.1E3 173.5276 2.2E4 173.5383 3.2E4 221.4857 2.6E3 287.3850 2.4E3 434.2449 3.3E3 447.2537 3.2E3 448.7699 2.8E3 459.2180 2.7E5 460.2258 1.3E5 461.2328 2.8E4 473.2344 4.3E3 486.2393 8.2E3 487.2166 1.2E4 487.2443 2.8E3 488.2540 1.3E4 489.2374 3.8E3 491.2437 2.8E4 492.2518 9.2E4 501.2280 6.4E3 503.2443 3.3E4 505.2245 4.4E4 506.2750 3.1E3 515.2461 1.2E4 516.2517 3.5E4 517.2267 1.8E4 518.2319 4.9E3 519.1458 5.5E3 519.2392 3.2E5 519.3324 4.6E3 520.2476 8.3E4 531.1461 4.8E3 531.2389 4.1E5 532.2467 5.4E4 533.1626 5.9E3 533.2546 3.7E5 548.2771 3.2E4 549.2483 8.1E3 559.2337 2.1E4 560.2414 6.4E4 562.2153 4.0E3 563.2604 4.7E3 564.2759 4.4E3 577.2453 3.9E4 591.2608 2.0E5 592.1579 4.6E3 592.2680 5.2E5 593.2757 5.1E4 625.4969 3.3E3 838.5188 4.2E3 838.5400 5.7E3 855.5471 3.9E3 870.5662 4.0E4 END IONS BEGIN IONS FEATURE_ID=859 PEPMASS=871.5726 SCANS=859 RTINSECONDS=1002.794 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 6 (0 removed due to low quality, 0 removed due to low cosine). 76.5967 2.8E3 78.2813 2.6E3 79.3180 2.9E3 83.0851 1.8E4 83.2026 3.2E3 86.0344 2.4E3 90.3064 2.6E3 96.8407 9.8E3 97.1008 1.7E4 99.8987 2.4E3 104.5295 2.6E3 107.1317 2.6E3 110.0171 2.3E3 113.2686 2.4E3 119.3253 2.6E3 129.9708 2.8E3 133.3089 1.2E4 133.3182 1.3E4 135.9726 2.4E3 139.3855 3.2E3 148.0608 8.8E3 148.0726 4.4E3 148.3123 9.5E3 148.3255 2.5E4 155.7028 2.9E3 157.2782 2.6E3 158.0006 2.4E3 161.6117 2.8E3 165.0796 3.0E3 173.5266 1.1E5 173.5423 5.2E4 194.2691 3.1E3 215.1328 3.0E3 225.8965 2.5E3 242.5596 2.6E3 259.9907 3.2E3 260.9164 2.8E3 263.2610 2.7E3 296.3610 2.7E3 310.0641 2.9E3 322.7130 2.4E3 328.8342 3.1E3 407.2365 2.7E3 431.1868 9.5E3 433.2405 2.8E4 434.2466 3.1E3 445.2024 1.3E4 446.2087 7.4E3 447.2112 1.8E4 456.0517 2.6E3 459.1576 2.6E3 459.2179 8.3E5 460.1504 5.0E3 460.2236 6.6E5 461.2310 3.0E5 462.2376 3.6E4 473.2330 6.2E4 474.2400 1.0E4 475.2493 2.7E3 476.2549 2.4E4 477.2544 3.7E3 486.2400 4.2E3 487.2459 5.9E4 488.2156 1.5E4 488.2412 2.3E3 488.2606 7.2E3 489.2291 2.7E3 489.2560 1.9E4 490.2619 3.2E3 491.2431 1.2E5 492.2510 2.8E5 493.2543 1.1E5 501.2299 3.5E3 502.2248 3.2E3 503.2426 3.6E4 504.2463 5.2E4 505.2245 1.6E5 506.2287 5.5E4 515.2425 4.7E4 516.2500 4.3E4 517.2391 6.9E4 518.2291 4.7E4 519.1490 9.0E3 519.2387 5.6E5 520.1528 7.6E3 520.2437 5.9E5 521.2507 9.6E4 531.2385 3.1E5 532.2435 6.7E5 532.3365 1.4E4 533.0117 5.1E3 533.0661 4.5E4 533.2542 8.8E6 533.4010 1.7E4 533.4455 2.0E4 534.2579 4.5E5 546.2430 2.6E3 547.2709 2.9E4 548.2771 6.1E4 549.2564 7.8E3 549.2706 5.0E4 550.2537 1.8E4 551.2617 2.9E3 555.0651 2.8E3 559.2373 1.1E4 560.2412 2.2E5 561.2476 2.0E5 563.2313 2.2E4 564.2495 9.5E4 565.2799 1.7E5 573.7711 2.6E3 575.2649 7.4E4 577.2445 1.6E5 578.2503 8.0E4 579.2494 3.5E3 591.2602 1.7E5 592.0477 3.3E4 592.2676 5.9E6 592.4393 5.0E3 592.4910 1.1E4 593.0533 8.4E4 593.0972 4.6E4 593.2752 1.3E7 593.4525 4.9E4 593.4990 8.8E4 594.2787 4.5E4 667.9307 2.8E3 713.0066 2.6E3 804.9289 3.1E3 811.5564 1.4E4 821.7227 3.2E3 839.5339 6.4E3 856.5490 3.2E3 871.5707 4.4E5 END IONS BEGIN IONS FEATURE_ID=860 PEPMASS=610.6251 SCANS=860 RTINSECONDS=1005.057 CHARGE=1+ MSLEVEL=2 MERGED_STATS=13 / 13 (0 removed due to low quality, 0 removed due to low cosine). 65.3032 2.2E3 67.5251 2.5E3 70.2853 2.4E3 70.5353 2.1E3 71.8035 2.3E3 72.2232 2.3E3 72.3739 2.2E3 73.4896 2.5E3 73.7188 2.3E3 75.8000 2.5E3 75.9592 2.3E3 79.4149 2.3E3 81.2636 2.5E3 81.8775 2.3E3 82.6897 2.4E3 84.1779 2.5E3 86.1940 2.6E3 86.3926 2.3E3 94.8892 2.4E3 96.5846 2.1E3 101.0184 2.3E3 102.0772 2.2E3 102.9965 2.1E3 103.7660 2.4E3 104.3724 2.3E3 105.7691 2.6E3 105.9982 2.1E3 106.2750 2.4E3 107.0591 2.1E3 107.9136 2.7E3 108.2279 2.4E3 109.3833 2.4E3 111.6054 2.3E3 111.7690 2.9E3 112.7308 2.6E3 112.8624 2.7E3 115.0459 2.5E3 116.1698 2.3E3 120.3053 2.6E3 121.3555 2.4E3 124.0865 2.8E3 125.0708 2.6E3 128.8136 2.5E3 129.7524 2.2E3 130.3460 2.4E3 135.0901 2.9E3 138.3564 2.7E3 142.7481 2.4E3 145.1729 2.3E3 145.4664 2.2E3 146.5238 2.7E3 147.6664 2.2E3 149.6877 1.4E4 149.6961 3.5E3 151.3288 2.5E3 158.8325 3.1E3 170.2855 2.5E3 173.5224 2.4E4 173.5310 2.2E5 173.5424 4.6E4 179.6403 2.3E3 209.7989 2.2E3 215.8631 2.5E3 221.6458 2.3E3 223.3222 2.7E3 225.4226 2.5E3 226.3603 2.4E3 245.1218 2.7E3 249.4484 2.8E3 255.3085 2.6E3 274.5496 2.6E3 275.2386 2.3E3 281.2954 5.4E5 282.2427 2.9E4 282.2792 2.3E6 282.3162 2.3E4 283.2865 2.8E3 283.9033 2.9E3 299.3058 5.2E5 303.5646 2.4E3 309.2882 1.0E4 309.3267 5.7E5 309.3630 3.6E3 310.2675 1.5E4 310.2793 4.4E3 310.3106 2.3E6 310.3518 1.3E4 310.3703 3.7E3 320.6311 2.5E3 327.3369 4.7E5 333.4936 2.7E3 381.7379 2.5E3 396.5428 2.3E3 559.7508 2.6E3 565.5683 6.4E3 571.3445 2.5E3 589.4516 2.9E3 594.0964 2.6E3 595.0941 2.6E3 610.3439 8.8E3 END IONS BEGIN IONS FEATURE_ID=861 PEPMASS=659.2843 SCANS=861 RTINSECONDS=1005.98 CHARGE=1+ MSLEVEL=2 MERGED_STATS=1 / 3 (2 removed due to low quality, 0 removed due to low cosine). 66.5827 5.2E3 66.5868 4.6E3 69.6933 3.4E3 69.6968 2.9E3 73.2511 7.1E3 73.2561 5.9E3 89.0594 7.9E3 133.0856 3.5E3 173.5222 1.2E4 173.5406 2.0E4 288.7334 2.5E3 293.6254 2.3E3 482.2053 3.7E3 483.2175 5.6E3 498.2000 3.6E3 499.2131 7.5E3 500.2194 3.3E3 508.1897 4.8E3 510.2393 5.4E3 517.2205 5.7E3 521.1926 1.3E4 522.1987 4.4E3 526.1959 1.0E4 536.2155 6.4E3 537.2252 7.1E4 539.2046 1.9E4 540.2120 9.2E3 541.2164 6.7E3 543.2776 3.4E3 555.2646 9.0E3 559.2677 7.2E3 561.2877 4.4E3 581.2330 8.4E3 583.2675 4.4E4 587.2651 7.8E3 599.2621 1.9E5 599.3742 5.5E3 600.2700 4.1E4 601.2759 5.7E3 609.2471 4.1E4 615.2922 2.1E4 619.2889 9.8E3 627.2569 1.6E5 628.2676 4.5E3 641.2730 8.3E4 642.2748 3.6E3 659.2833 3.3E5 END IONS BEGIN IONS FEATURE_ID=862 PEPMASS=637.3014 SCANS=862 RTINSECONDS=1006.184 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 4 (1 removed due to low quality, 0 removed due to low cosine). 65.2507 1.9E5 65.2539 3.2E4 68.8093 1.3E5 68.8125 2.4E4 70.8108 5.8E4 70.8133 8.3E3 76.4578 9.2E3 82.5793 1.0E4 87.1572 9.5E3 89.5212 9.4E3 90.1865 7.1E3 100.6543 5.8E3 139.8112 5.2E4 139.8239 4.5E4 140.0998 8.6E3 140.4849 1.2E4 147.2643 8.7E3 172.3585 7.0E3 173.5203 2.4E4 173.5283 1.2E5 173.5395 1.1E5 173.5471 9.0E3 239.1552 7.9E3 247.4420 5.5E3 256.5115 7.4E3 304.2236 8.0E3 316.0206 7.1E3 334.3954 7.4E3 406.2146 2.3E4 407.2235 2.5E5 420.2311 1.2E5 421.2373 4.0E5 422.2467 3.5E5 429.2057 2.4E4 430.2216 1.4E4 433.2393 3.7E4 434.2445 7.2E4 435.2524 5.1E4 443.2198 1.2E4 443.2307 7.1E3 444.2309 8.1E4 445.2450 1.0E4 447.2482 1.0E4 448.2158 9.8E3 448.2631 6.5E4 449.2663 6.5E4 450.2266 9.4E3 450.2792 3.3E4 453.2233 3.0E4 457.2383 7.6E4 458.2459 1.5E5 459.2185 1.2E6 460.2247 1.3E5 461.2290 1.0E5 462.2051 1.0E4 463.2120 7.1E4 472.2262 2.8E5 473.2337 2.3E6 474.2386 3.2E4 475.2169 2.2E5 476.2184 6.1E5 477.2271 2.7E5 478.2324 2.8E5 485.2335 9.9E5 486.2091 3.5E5 487.2470 2.6E5 488.2233 6.4E4 489.2274 1.3E5 490.2336 5.2E4 491.2441 3.5E4 492.2512 3.7E4 493.2543 9.4E4 497.2345 5.6E4 499.2133 5.7E5 500.2213 1.4E5 501.2278 3.9E4 502.2356 1.2E5 503.2435 1.2E6 504.2460 7.4E5 505.2256 9.5E4 513.2287 5.9E5 514.2364 2.4E5 515.2444 7.2E5 515.3282 1.6E4 517.2251 3.3E5 518.2304 1.4E5 519.2389 1.4E5 521.2196 4.5E4 521.2844 1.4E4 522.2217 1.3E5 522.2986 9.2E4 530.2338 2.1E4 531.2443 9.3E5 532.2448 5.3E4 533.2534 8.0E3 535.2623 2.6E4 536.2391 1.1E5 537.2439 6.2E4 541.2240 1.2E5 543.2756 2.2E5 544.2488 5.6E4 545.2559 5.3E4 547.2698 1.4E4 548.2775 1.4E4 549.2853 1.3E6 550.2892 1.2E6 559.0069 2.2E4 559.0651 1.7E5 559.2705 2.7E7 559.4288 3.8E4 559.4772 1.1E5 560.2753 7.7E4 561.2849 8.6E4 562.2539 1.3E4 563.2682 5.1E4 572.2411 4.7E4 573.2514 1.2E4 575.2657 5.8E4 576.2729 1.9E5 577.2795 3.5E5 578.1819 1.3E4 578.2865 8.9E5 587.1826 2.5E4 587.2658 5.5E6 591.2891 4.5E5 605.2762 5.2E5 609.2837 8.9E4 619.2916 3.7E6 622.2753 4.4E4 637.3025 1.3E6 END IONS BEGIN IONS FEATURE_ID=863 PEPMASS=636.2951 SCANS=863 RTINSECONDS=1006.844 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 4 (1 removed due to low quality, 0 removed due to low cosine). 78.3759 2.6E3 81.2896 2.2E3 84.6031 2.4E3 85.4538 2.3E3 87.0436 1.0E4 89.4551 2.3E3 110.6308 2.6E3 111.1917 2.2E3 147.9388 2.7E3 152.8977 2.4E3 153.1293 2.4E3 161.4364 2.4E3 162.5115 2.5E3 171.4568 2.7E3 173.5192 8.8E3 173.5366 8.6E4 178.5023 2.3E3 189.6493 2.8E3 192.8577 2.4E3 270.8943 2.5E3 283.4525 2.8E3 291.6269 2.4E3 304.7704 2.6E3 413.8291 2.4E3 420.2308 1.0E5 421.2384 9.3E3 433.2388 2.1E4 434.2482 1.3E4 447.2179 1.6E4 448.2612 2.8E4 449.2332 2.4E4 452.2201 2.9E4 458.2463 6.7E3 459.2185 1.5E4 460.2253 4.0E4 462.2041 1.7E4 463.2067 2.8E3 463.2185 3.0E3 465.2286 3.5E3 474.2416 3.1E4 475.2129 2.3E5 476.2203 6.0E4 477.2281 1.3E5 485.2356 2.4E3 487.2112 6.4E3 488.2206 6.5E3 489.2297 1.2E4 492.2513 4.7E4 493.2231 4.4E3 499.2044 3.3E3 501.2248 1.1E4 502.2362 8.6E4 503.2436 3.1E5 503.3321 2.7E3 513.2292 6.3E3 516.2184 3.1E3 517.2208 1.5E4 518.2310 9.7E3 521.2184 6.5E4 530.2336 4.1E3 535.2342 4.1E4 536.2418 3.3E4 548.2773 1.6E4 549.2856 5.1E5 559.2670 2.8E3 561.2506 6.4E3 563.2675 5.4E3 575.2666 9.2E3 576.2720 4.3E4 577.2810 2.0E5 577.3840 5.5E3 586.2573 1.5E4 611.1716 3.3E3 621.2695 3.6E3 636.2850 6.2E3 636.3015 3.4E3 END IONS BEGIN IONS FEATURE_ID=864 PEPMASS=341.1386 SCANS=864 RTINSECONDS=1010.744 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 6 (2 removed due to low quality, 0 removed due to low cosine). 51.0233 2.6E3 51.7051 2.6E3 55.0177 1.9E4 55.2074 2.5E3 55.7713 2.4E3 59.5542 2.5E3 69.0329 2.3E3 77.0387 1.6E4 77.8153 2.3E3 79.0540 4.3E4 81.0331 9.6E3 81.0696 1.0E4 83.6819 2.4E3 85.4748 2.6E3 86.0597 1.1E4 91.0539 3.4E4 92.5178 2.6E3 93.0698 1.0E4 95.0488 4.7E4 95.8603 2.5E3 98.5491 2.2E3 100.7132 2.5E3 103.0539 7.2E4 105.0330 1.6E4 105.0449 4.1E3 105.0696 1.2E5 106.0411 7.0E3 107.0488 6.7E4 108.3031 2.4E3 109.0643 7.0E3 111.0795 3.2E3 115.0543 1.7E4 117.0695 2.9E4 119.0489 2.0E4 121.0281 1.0E4 121.0646 7.4E4 123.0437 6.2E4 125.0487 2.2E3 128.0618 4.2E3 128.6954 2.5E3 129.0697 2.5E4 130.0777 2.8E3 131.0489 5.2E5 131.0852 3.1E3 132.0566 3.8E3 133.0646 6.3E5 133.0758 6.9E3 133.1016 2.6E3 134.0360 1.7E5 135.0439 3.2E6 135.0537 2.5E4 135.0677 3.7E4 135.0753 3.4E3 135.0814 2.8E3 136.8185 2.5E3 137.0593 3.2E4 137.2727 2.6E3 143.0490 1.6E4 143.0851 2.9E4 144.0570 6.4E3 145.0645 1.1E5 148.0522 1.0E4 149.0595 4.9E5 157.0647 5.4E4 159.0439 2.0E4 159.0805 9.5E3 160.0518 3.0E4 161.0438 1.1E4 161.0596 5.1E5 161.0746 1.3E4 161.0931 2.2E3 163.0754 4.3E4 165.0545 2.5E3 169.0648 1.4E4 171.0804 5.6E4 173.0597 1.3E5 173.5244 1.8E4 173.5360 3.5E4 173.5432 4.5E3 174.0668 2.5E4 175.0754 4.4E4 179.0859 2.6E3 181.0647 6.7E3 183.0796 8.5E3 185.0596 4.1E4 186.0674 5.0E4 187.0753 1.6E5 195.0805 4.2E3 197.0595 3.1E4 197.0943 3.5E3 199.0754 1.4E4 201.0909 5.6E4 203.0700 2.8E4 204.6718 2.9E3 207.0806 9.6E3 207.1168 8.6E3 209.0601 3.3E3 211.0754 7.5E3 212.7321 2.6E3 213.0909 5.0E3 217.1019 1.7E4 220.0886 1.3E4 221.0955 1.0E4 222.8655 2.6E3 223.0752 7.8E3 225.0925 5.5E3 227.0696 1.2E4 229.0860 3.8E4 235.1117 5.4E4 245.0958 3.1E4 247.1111 7.3E3 248.0829 8.0E3 263.1064 5.0E4 265.0862 2.7E3 265.1198 4.9E3 275.1039 3.0E3 278.0931 3.1E3 293.1166 2.9E4 295.1343 3.5E3 308.1049 5.1E4 323.1280 4.7E4 326.1152 1.0E5 341.1383 3.7E5 341.1854 5.0E3 347.0853 2.5E3 END IONS BEGIN IONS FEATURE_ID=865 PEPMASS=323.1282 SCANS=865 RTINSECONDS=1010.939 CHARGE=1+ MSLEVEL=2 MERGED_STATS=8 / 11 (3 removed due to low quality, 0 removed due to low cosine). 49.1179 2.4E3 51.0234 1.5E4 52.5610 2.2E3 53.0387 3.6E3 53.2755 2.2E3 55.0178 8.8E4 57.6996 2.5E3 61.0310 2.3E3 61.0556 4.8E3 62.8005 2.9E3 62.9767 2.1E3 65.0387 4.5E3 68.1439 3.1E3 69.0336 2.3E3 73.0284 3.0E3 75.7381 2.6E3 76.2307 2.7E3 77.0389 3.9E4 79.0541 1.6E5 79.1002 2.5E3 81.0700 2.6E3 82.4005 3.3E3 82.6226 2.6E3 83.3208 2.7E3 84.8552 2.4E3 88.2431 2.5E3 91.0541 1.6E5 92.4192 2.9E3 93.0698 5.0E4 95.0490 9.1E4 99.4900 2.7E3 103.0540 4.8E5 105.0335 3.8E4 105.0443 2.1E4 105.0697 7.3E5 105.0758 4.1E3 107.0490 3.2E5 111.4895 4.9E3 115.0542 9.4E4 117.0698 1.2E5 119.0490 1.2E5 120.0570 5.2E3 121.0646 6.4E5 122.6093 2.4E3 123.0436 7.1E3 123.0805 2.3E4 128.0619 2.7E4 129.0697 7.2E4 131.0261 5.5E3 131.0490 3.8E6 131.0595 5.5E4 132.0567 4.4E4 133.0647 5.4E6 133.0745 2.4E4 133.0901 1.6E4 135.0212 3.7E4 135.0315 2.2E3 135.0439 1.1E7 135.0530 3.6E4 135.0679 9.6E4 136.0521 4.1E3 137.0596 5.0E4 139.8140 3.6E3 141.0702 1.1E4 143.0490 2.1E5 143.0854 8.1E4 144.0570 2.3E4 145.0515 3.2E3 145.0646 6.6E5 147.8355 5.1E3 148.0518 2.9E4 149.0460 9.6E3 149.0596 1.8E6 149.0710 2.7E3 149.0722 1.3E4 150.3292 2.4E3 151.0752 2.7E4 152.5498 2.0E3 153.0695 1.2E4 156.0572 5.3E3 157.0647 2.8E5 159.0438 1.0E5 160.0519 2.0E5 161.0191 2.7E3 161.0294 5.6E3 161.0438 7.6E3 161.0596 4.3E6 161.0730 1.4E4 161.0912 1.9E4 162.0681 5.9E3 163.0754 1.7E5 164.0326 2.3E3 164.6451 2.6E3 169.0650 5.1E4 171.0442 2.1E4 171.0804 2.1E5 172.0518 3.5E4 173.0598 6.4E5 173.5212 1.1E4 173.5301 1.2E5 173.5442 6.8E3 174.0677 4.0E4 175.0755 1.4E5 179.0852 3.5E3 185.0597 3.4E5 186.0676 4.3E5 187.0593 6.7E3 187.0754 5.3E5 192.0940 1.4E4 193.0640 5.5E3 193.1029 3.3E3 193.4975 2.4E3 194.0730 1.3E4 199.0759 4.2E4 201.0910 1.5E5 202.0780 2.5E4 207.0807 6.1E4 207.1170 5.8E4 210.2138 2.5E3 217.1013 1.6E5 217.8663 2.7E3 219.0804 1.9E4 220.0884 9.0E4 221.0962 3.3E4 223.0776 4.4E3 227.5196 2.5E3 229.1013 4.0E3 231.0810 3.0E3 233.0963 4.6E4 234.6730 2.5E3 235.0739 1.1E4 235.0781 4.0E4 235.1119 4.8E5 237.0917 3.0E3 241.4535 2.6E3 241.4717 2.6E3 245.0700 6.2E3 245.0962 2.7E5 247.0741 4.4E3 247.1120 2.3E4 248.0580 2.8E3 248.0833 1.0E5 251.1056 3.7E3 261.0907 1.7E4 263.1066 4.9E5 264.0756 5.4E3 265.0873 7.1E3 265.1223 1.0E4 265.7325 2.4E3 275.1070 3.4E4 278.0942 5.4E4 289.0864 2.6E3 291.1016 2.9E3 293.1174 2.7E5 305.1187 3.4E3 308.0716 4.1E3 308.1047 7.7E5 317.7413 3.3E3 321.5409 2.4E3 323.0817 4.7E3 323.1283 1.2E6 323.1644 2.6E3 323.1724 2.2E4 323.1920 6.4E3 326.1145 1.1E4 END IONS BEGIN IONS FEATURE_ID=866 PEPMASS=871.5724 SCANS=866 RTINSECONDS=1010.971 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 77.5552 2.7E3 83.0848 1.8E4 85.1007 2.3E3 88.3047 2.3E3 91.9641 2.1E3 93.5334 2.4E3 95.8813 3.4E3 96.8426 9.2E3 97.5206 2.4E3 113.8275 4.2E3 117.2932 2.3E3 133.3083 7.1E3 133.3183 1.2E4 143.3039 2.2E3 148.0615 2.8E3 148.0726 3.2E3 148.3127 1.3E4 148.3243 1.3E4 157.0075 2.5E3 173.5274 5.1E4 173.5365 4.7E4 177.1161 2.3E3 206.5068 2.9E3 218.5299 2.7E3 221.7522 2.4E3 257.1980 3.7E3 344.0567 3.3E3 348.1360 2.1E3 431.1821 2.9E3 433.2395 1.6E4 434.2416 3.3E3 445.2057 6.9E3 447.2131 1.5E4 459.2174 6.0E5 460.2227 5.4E5 461.2301 2.4E5 462.2387 3.3E4 473.2323 3.9E4 474.2390 7.5E3 475.2451 4.9E3 476.2546 1.4E4 477.2481 3.3E3 478.3554 3.1E3 485.2320 2.8E3 486.2402 1.9E4 487.2437 4.4E4 488.2209 2.4E4 488.2501 4.2E3 489.2586 2.0E4 489.2699 4.1E3 491.2435 8.2E4 492.2505 2.1E5 493.2545 1.1E5 501.2281 6.7E3 503.2428 2.9E4 504.2465 5.1E4 505.2239 9.9E4 506.2281 4.7E4 515.2410 3.0E4 516.2488 4.1E4 517.2470 5.7E4 518.2290 3.2E4 519.1479 7.0E3 519.2383 4.6E5 519.3285 4.3E3 520.1119 3.4E3 520.1510 4.7E3 520.2428 5.2E5 521.2490 9.1E4 531.2381 3.2E5 532.1483 8.5E3 532.2427 6.1E5 532.3362 3.9E3 533.0142 3.7E3 533.0659 8.2E3 533.2538 5.4E6 533.3527 3.6E3 533.4451 1.1E4 534.2570 4.1E5 547.2716 2.3E4 548.2784 5.1E4 549.2684 4.0E4 550.2522 1.3E4 559.2330 1.5E4 560.2402 1.4E5 561.2468 1.4E5 562.2278 9.6E3 563.2339 1.2E4 564.2484 6.0E4 565.2790 1.0E5 575.2523 3.7E3 575.2647 3.8E4 577.2448 1.0E5 578.2487 7.3E4 591.2600 1.5E5 592.0467 6.9E3 592.2672 3.7E6 592.3811 3.9E3 592.4902 8.3E3 593.0535 4.6E4 593.0961 1.1E4 593.2748 7.7E6 593.4477 3.4E4 593.4990 5.0E4 593.5624 7.2E3 594.2756 2.9E4 697.5482 4.5E3 811.5534 1.2E4 839.5442 1.5E4 856.5468 5.8E3 871.5705 2.9E5 END IONS BEGIN IONS FEATURE_ID=867 PEPMASS=870.5660 SCANS=867 RTINSECONDS=1011.327 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 88.0185 2.3E3 92.7004 2.1E3 93.5066 2.3E3 96.1774 2.1E3 102.4121 2.3E3 108.1365 2.3E3 110.0206 2.2E3 112.0323 2.2E3 113.9509 2.5E3 113.9600 2.3E3 133.5384 2.4E3 140.1817 2.4E3 148.0751 2.3E3 173.5260 6.5E3 173.5378 2.7E4 183.8424 2.4E3 188.6861 2.7E3 259.3507 2.4E3 328.9689 2.6E3 367.1147 2.6E3 433.2387 1.2E4 434.2465 2.9E3 447.2579 6.6E3 459.2175 6.2E5 460.1506 4.0E3 460.2250 2.8E5 461.2330 5.5E4 464.8045 2.4E3 472.9730 3.1E3 473.1938 3.0E3 473.2395 4.4E3 474.2407 4.3E3 475.2513 5.3E3 485.2349 9.0E3 486.2408 2.9E4 487.2166 3.9E4 488.2521 3.2E4 489.2625 7.5E3 489.2682 2.7E3 491.2429 6.7E4 492.2514 2.2E5 501.2300 1.8E4 503.2439 8.1E4 504.2465 2.8E3 505.2235 1.1E5 515.2431 2.0E4 516.2511 7.2E4 517.2252 3.3E4 518.2298 1.5E4 519.1467 5.4E3 519.2386 7.3E5 519.3316 7.9E3 520.2471 1.9E5 531.2384 8.7E5 532.2462 1.2E5 533.2541 7.9E5 547.2688 7.0E3 548.2775 7.2E4 549.2491 2.2E4 553.0486 2.7E3 559.2340 4.4E4 560.2414 1.4E5 562.2241 6.5E3 563.2667 4.8E3 564.2722 1.6E4 574.2588 2.9E3 575.2652 3.4E3 577.2442 1.0E5 591.2601 4.5E5 592.2675 1.2E6 592.3806 5.6E3 593.2753 7.5E4 838.5373 2.1E4 855.5398 9.9E3 870.5637 8.8E4 END IONS BEGIN IONS FEATURE_ID=868 PEPMASS=205.1954 SCANS=868 RTINSECONDS=1012.532 CHARGE=1+ MSLEVEL=2 MERGED_STATS=8 / 8 (0 removed due to low quality, 0 removed due to low cosine). 41.0385 1.0E5 43.0178 5.2E3 43.0541 6.3E4 44.0900 2.1E3 46.7352 2.4E3 48.8283 2.6E3 49.9027 2.0E3 50.3496 2.6E3 51.5205 2.7E3 52.5710 2.5E3 53.0385 3.3E4 53.4747 2.4E3 54.5975 2.6E3 55.0540 5.1E5 56.3135 2.6E3 57.0697 1.3E5 58.8938 2.3E3 59.5185 2.3E3 60.1506 2.4E3 60.6211 2.4E3 60.6432 2.6E3 61.9648 2.3E3 62.5948 2.5E3 63.4634 2.4E3 64.2583 2.9E3 65.0385 6.2E3 65.5267 2.4E3 67.0539 3.5E5 68.6448 2.2E3 69.0001 2.3E3 69.0696 7.5E5 69.0738 4.6E3 69.5099 2.4E3 71.0852 1.7E4 72.9370 2.1E4 73.6236 2.4E3 74.6709 2.2E3 75.5923 2.3E3 77.0386 2.8E4 78.3217 2.6E3 79.0539 5.9E5 79.0595 5.4E3 79.4892 2.5E3 79.7760 2.6E3 80.0618 2.7E3 81.0696 2.4E6 81.0760 2.0E4 81.0783 1.2E4 83.0852 1.2E5 85.5513 2.4E3 88.8720 2.2E3 90.9475 1.5E4 91.0539 2.8E5 93.0696 2.9E6 93.0785 2.4E4 93.0802 1.1E4 93.0835 4.8E3 93.0886 2.1E3 95.0488 6.9E4 95.0852 7.3E5 95.0927 5.4E3 95.3869 2.7E3 97.1009 7.7E4 103.0542 3.4E3 105.0445 1.9E4 105.0617 2.6E3 105.0696 2.4E5 106.0754 6.2E3 107.0852 1.0E6 109.0644 1.6E4 109.0928 7.4E3 109.1009 4.2E5 111.1162 2.5E3 113.9635 5.0E4 116.0769 2.4E3 116.4163 2.6E3 117.0697 3.8E4 117.3531 2.8E3 118.3820 2.4E3 119.0853 6.4E4 119.6562 2.3E3 121.1009 3.8E6 121.1097 6.5E4 121.1215 1.6E4 123.0801 2.6E5 123.1165 1.9E5 128.0616 3.3E3 129.0696 1.2E5 133.0756 5.7E3 133.1010 6.4E3 135.0440 4.3E3 135.1166 2.7E5 137.1325 1.8E4 142.3638 2.2E3 144.0572 6.2E3 145.0645 1.0E5 145.1016 2.4E3 147.0799 1.2E4 147.1162 6.2E3 149.1199 3.0E3 149.1323 5.0E5 149.1464 3.5E3 154.5445 2.4E3 155.6734 2.9E3 157.0647 6.0E4 162.1357 6.5E3 163.1483 4.7E4 164.1372 2.7E3 171.0087 2.7E3 173.5224 3.1E4 173.5379 9.9E4 174.0676 2.8E4 174.3111 2.3E3 175.0752 2.6E4 185.7244 2.3E3 187.0752 6.6E4 191.5091 2.7E3 205.1581 3.6E3 205.1955 1.1E4 215.1617 2.8E3 215.5778 2.3E3 END IONS BEGIN IONS FEATURE_ID=869 PEPMASS=587.5493 SCANS=869 RTINSECONDS=1012.729 CHARGE=1+ MSLEVEL=2 MERGED_STATS=17 / 17 (0 removed due to low quality, 0 removed due to low cosine). 63.0497 2.3E3 65.2806 1.2E4 65.2833 3.0E5 65.4682 2.4E3 67.6592 2.9E3 67.7063 2.4E3 68.1058 2.0E3 68.8621 2.2E3 69.1624 2.3E3 70.6532 2.9E3 71.0623 2.1E3 71.5238 2.5E3 72.6250 2.3E3 75.1931 2.1E3 75.3643 2.6E3 76.4018 2.2E3 78.2489 2.5E3 78.8670 2.5E3 79.1360 2.1E3 80.2177 2.7E3 80.2401 2.6E3 80.8455 2.4E3 81.6002 2.7E3 84.5080 2.4E3 84.6906 2.6E3 85.1812 2.4E3 86.6095 2.4E3 88.3556 2.1E3 88.5233 2.2E3 88.9721 2.4E3 89.0592 9.1E3 89.1532 2.2E3 92.3482 2.9E3 97.9363 2.5E3 98.1036 2.4E3 102.2278 2.3E3 104.1858 2.6E3 107.0850 2.5E3 107.7846 2.2E3 107.9433 2.1E3 109.4618 2.4E3 111.1113 2.5E3 111.7721 2.6E3 111.9851 2.4E3 112.2157 2.1E3 114.1166 2.3E3 119.1166 2.2E3 119.1502 2.1E3 121.0983 2.6E3 121.9562 2.5E3 122.0663 3.3E3 123.3239 2.1E3 124.9643 2.2E3 126.3375 2.4E3 126.4117 2.3E3 127.9355 2.4E3 128.5217 2.2E3 130.0336 2.1E3 130.1643 2.4E3 131.5112 3.0E3 133.0855 3.2E3 133.6817 2.4E3 134.1949 2.5E3 135.6698 2.1E3 140.2132 2.7E3 146.8810 2.6E3 146.8933 5.5E3 149.6810 7.7E3 149.6920 9.7E3 165.9159 2.3E3 168.1443 2.4E3 172.8015 2.5E3 172.8550 2.3E3 173.5221 9.4E3 173.5337 3.4E5 173.5491 2.3E3 174.6872 2.6E3 175.7675 2.4E3 186.4324 2.6E3 193.7831 2.5E3 198.9040 2.3E3 199.2808 2.2E3 202.9274 2.6E3 203.8664 2.7E3 204.3425 2.3E3 205.1663 2.5E3 205.4917 2.4E3 232.2119 2.8E3 239.5070 2.6E3 241.5218 2.4E3 242.0416 2.3E3 248.8316 2.5E3 253.3494 2.4E3 260.2709 2.3E3 277.7798 2.2E3 282.0877 2.6E3 282.7912 2.3E3 286.5987 2.8E3 294.5876 2.7E3 303.3437 2.3E3 307.8511 2.4E3 316.3970 2.4E3 334.5417 2.6E3 336.8360 2.5E3 359.7122 2.9E3 361.8897 2.5E3 363.7084 3.0E3 378.6411 2.5E3 382.3721 2.3E3 385.1583 2.9E3 387.8464 2.6E3 397.3838 2.4E3 418.2571 2.5E3 422.7269 2.7E3 429.3858 5.8E3 444.3644 2.4E3 461.9099 2.5E3 472.0430 2.6E3 478.7024 2.4E3 485.8189 2.5E3 530.7207 2.8E3 547.0746 2.7E3 566.3757 2.6E3 587.3294 5.9E3 587.4391 1.1E4 587.5482 7.7E6 587.6588 6.3E3 587.7696 3.8E3 END IONS BEGIN IONS FEATURE_ID=870 PEPMASS=567.4201 SCANS=870 RTINSECONDS=1012.979 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 2 (0 removed due to low quality, 0 removed due to low cosine). 65.3580 2.5E3 67.0540 1.2E4 69.0331 2.9E3 69.0696 1.4E4 73.0501 2.4E3 73.2995 2.2E3 79.0539 1.4E4 79.5252 2.2E3 81.0695 4.8E4 83.0487 6.5E3 83.0852 4.4E3 85.0644 2.7E3 91.0539 1.7E4 92.5542 2.6E3 93.0649 2.1E3 93.0695 5.4E4 95.0488 9.5E3 95.0852 3.4E4 97.0644 5.1E3 100.4237 2.4E3 105.0627 3.6E3 105.0695 8.7E4 107.0852 5.8E4 109.0641 3.0E3 109.1009 4.2E4 111.0801 1.0E4 117.0697 8.6E3 119.0852 8.9E4 121.1008 7.3E4 123.0801 9.2E3 123.1166 1.0E4 124.4265 2.4E3 125.0957 4.3E3 130.0770 2.8E3 131.0853 2.4E4 133.1009 8.0E4 135.0799 3.4E3 135.1165 3.3E4 137.0958 2.4E4 142.0770 3.0E3 143.0851 2.4E4 145.1008 7.2E4 147.0803 2.5E3 147.1165 5.2E4 151.1116 8.1E3 155.0857 7.3E3 156.0934 3.6E3 157.1010 4.4E4 158.1091 2.3E3 159.1165 3.7E4 161.0957 5.2E3 161.1329 6.5E3 169.1009 2.3E4 171.1164 2.8E4 172.1226 2.4E3 173.0313 2.4E3 173.1324 3.1E4 173.5249 1.6E4 173.5338 2.2E4 173.5449 1.1E4 175.1480 1.4E4 179.0852 2.8E3 181.1011 8.2E3 182.1084 2.8E3 183.1171 2.4E4 185.1322 2.0E4 187.1476 1.2E4 193.1004 6.0E3 195.1166 1.6E4 196.1250 2.5E3 197.1323 2.3E4 199.1478 1.7E4 201.1635 2.7E3 206.4726 2.3E3 207.1168 9.2E3 208.1249 4.2E3 209.1326 2.0E4 210.1380 2.7E3 211.1483 2.1E4 219.1170 2.5E3 220.1242 6.6E3 221.1326 1.3E4 223.1484 1.5E4 235.1485 4.0E3 261.1661 3.0E3 263.1772 6.0E3 265.1940 2.4E3 282.2798 2.0E4 283.2832 3.9E4 284.2862 2.2E4 299.3077 2.7E3 300.3095 3.1E3 309.3253 3.0E3 310.3112 1.7E4 311.3143 4.0E4 312.3178 2.4E4 328.3402 2.7E3 337.2479 2.8E3 352.3225 2.5E3 366.2081 2.4E3 454.4991 2.4E3 502.4044 2.5E3 567.2985 1.9E4 END IONS BEGIN IONS FEATURE_ID=871 PEPMASS=610.6251 SCANS=871 RTINSECONDS=1013.036 CHARGE=1+ MSLEVEL=2 MERGED_STATS=8 / 8 (0 removed due to low quality, 0 removed due to low cosine). 64.0861 2.0E3 64.5863 2.4E3 68.1971 2.1E3 71.0849 2.9E3 77.1743 2.5E3 77.5749 2.4E3 80.2557 2.4E3 80.2865 2.3E3 82.9121 3.1E3 88.8642 2.3E3 94.1545 2.4E3 95.0854 1.3E4 95.5215 2.3E3 97.1010 2.4E3 99.0646 2.1E3 100.6518 2.4E3 105.1644 2.6E3 106.8457 2.5E3 107.5819 2.0E3 109.1000 2.4E3 111.6787 2.8E3 117.7187 2.5E3 118.8408 2.6E3 120.5925 2.6E3 127.2260 2.1E3 128.7473 2.4E3 131.7032 2.2E3 147.2144 2.2E3 149.6821 4.1E3 149.6924 4.4E3 151.6094 2.3E3 162.4232 2.3E3 170.5081 2.3E3 173.5272 1.1E5 173.5432 6.1E4 174.4068 2.4E3 181.2297 2.3E3 185.5725 2.6E3 195.2516 2.4E3 199.1459 2.9E3 217.0534 2.3E3 242.2804 2.4E3 250.7673 2.4E3 260.6291 2.7E3 262.1229 2.8E3 276.4529 2.3E3 281.2953 6.1E5 281.3313 4.4E3 282.2036 3.4E3 282.2791 2.6E6 282.3159 1.6E4 283.2825 1.2E4 285.0103 2.4E3 299.2685 5.2E3 299.3057 5.7E5 299.3447 1.1E4 300.3098 2.9E3 308.2953 1.4E4 309.2902 1.4E4 309.3266 6.0E5 310.2675 1.1E4 310.2795 8.2E3 310.3105 2.6E6 313.2728 8.0E3 322.6875 2.4E3 327.3369 5.3E5 337.2740 8.4E3 346.1705 2.7E3 375.6155 2.5E3 375.7675 2.7E3 376.4943 2.7E3 380.9055 2.4E3 407.8240 2.7E3 437.7500 3.1E3 452.4535 2.9E3 452.7443 2.7E3 469.9238 2.9E3 559.9020 2.7E3 565.5652 1.5E4 END IONS BEGIN IONS FEATURE_ID=872 PEPMASS=565.5673 SCANS=872 RTINSECONDS=1013.173 CHARGE=1+ MSLEVEL=2 MERGED_STATS=17 / 17 (0 removed due to low quality, 0 removed due to low cosine). 62.0756 2.1E3 62.1571 2.4E3 64.2286 2.8E3 65.1140 2.2E3 65.2234 2.2E3 65.3287 2.7E3 67.0538 9.6E3 67.1503 2.2E3 69.0695 2.7E3 69.1232 2.6E3 70.5695 5.5E4 70.5718 4.6E3 71.0419 3.0E3 71.0853 5.4E4 72.3561 2.2E3 72.7064 2.9E3 72.9176 2.3E3 73.0367 2.1E3 73.3010 2.3E3 73.8513 2.4E3 74.2083 2.1E3 74.8920 2.3E3 76.7203 2.2E3 77.5772 6.1E4 77.5796 3.9E3 77.9177 2.2E3 79.8068 2.3E3 80.7720 2.1E3 80.8682 2.4E3 80.9695 2.4E3 81.0696 2.2E4 81.2070 2.3E3 82.7498 2.4E3 83.0852 1.8E4 83.2243 2.5E3 83.9824 2.1E3 84.4601 2.3E3 85.1010 2.9E4 89.6567 2.5E3 91.0426 2.5E3 94.8032 2.7E3 95.0853 4.8E4 95.4912 2.4E3 97.1012 2.9E3 97.9207 2.5E3 98.0627 4.7E3 98.1303 2.4E3 101.7919 2.2E3 101.9738 2.9E3 102.2344 2.7E3 102.2563 2.4E3 103.1817 2.5E3 103.2123 2.1E3 103.5204 2.4E3 104.5179 2.3E3 105.0080 2.5E3 109.0615 2.2E3 109.1009 1.7E4 109.6611 2.7E3 110.3881 2.3E3 111.1260 2.7E3 111.1350 2.5E3 111.7693 2.1E3 112.3271 2.5E3 114.0603 2.6E3 114.6999 2.3E3 119.0856 3.1E3 119.9956 2.2E3 122.0616 2.4E3 123.1171 3.0E3 123.7583 2.3E3 124.7133 2.4E3 124.7782 2.5E3 131.1649 2.8E3 134.1829 2.2E3 137.1375 2.6E3 138.3647 2.3E3 138.6177 2.6E3 139.4393 2.9E3 141.6845 2.2E3 141.7229 2.4E3 142.5487 2.2E3 142.7439 2.3E3 145.1004 2.7E3 146.8178 2.5E3 147.7240 2.6E3 148.6170 2.3E3 155.4559 2.6E3 156.2449 2.7E3 156.8346 3.5E3 167.2138 2.4E3 168.6876 2.6E3 173.5229 9.8E4 173.5374 2.7E5 187.3704 2.4E3 193.0880 2.5E3 200.6896 2.3E3 211.1946 2.4E3 211.8610 2.7E3 218.1495 2.2E3 230.8297 2.4E3 231.0553 2.5E3 239.6391 2.3E3 241.0426 2.7E3 243.3807 2.5E3 245.9245 2.5E3 257.2287 2.8E3 267.4435 2.4E3 276.9807 2.8E3 278.5076 2.4E3 281.2585 2.6E4 281.2954 3.4E6 281.3311 1.3E4 282.1856 7.9E3 282.2065 1.2E5 282.2205 4.6E4 282.2426 4.6E3 282.2791 1.9E7 282.3163 4.3E3 282.3375 4.2E4 282.3525 9.7E4 298.7331 2.8E3 299.2752 2.2E3 299.3059 1.7E6 299.3444 5.7E3 300.2658 2.7E3 301.2866 2.7E3 307.6499 2.8E3 309.2845 3.2E4 309.2966 4.3E3 309.3267 3.4E6 309.3680 1.9E4 310.2261 9.7E4 310.2458 7.0E4 310.2797 4.8E4 310.3106 1.9E7 310.3783 8.1E3 310.3943 9.6E4 310.4180 1.3E4 327.2924 2.0E4 327.3370 1.5E6 327.3710 2.6E3 331.8257 2.3E3 335.0652 2.5E3 349.9879 3.3E3 361.1826 2.4E3 366.6606 2.7E3 373.8409 2.5E3 390.6766 2.9E3 391.5020 3.0E3 397.1122 2.5E3 410.4055 2.6E3 413.3027 2.6E3 416.1871 3.0E3 422.6970 2.6E3 447.8319 2.7E3 465.7290 2.8E3 482.0700 2.4E3 493.7944 2.6E3 554.4422 2.7E3 565.6119 4.8E4 END IONS BEGIN IONS FEATURE_ID=873 PEPMASS=566.5706 SCANS=873 RTINSECONDS=1013.613 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 4 (1 removed due to low quality, 0 removed due to low cosine). 70.0633 2.6E3 81.0692 3.1E3 82.1170 2.7E3 85.5091 2.3E3 93.0692 3.9E3 95.0847 4.6E3 97.7740 2.6E3 109.1004 2.6E3 119.0852 4.9E3 126.5598 2.6E3 131.0850 3.4E3 133.1010 3.3E3 143.0846 3.6E3 145.1007 4.6E3 147.1155 4.7E3 157.1006 5.4E3 165.6931 2.5E3 171.1167 3.1E3 173.5228 1.2E4 173.5299 2.7E4 173.5419 1.4E4 177.0547 2.5E3 185.1323 4.0E3 197.1305 3.6E3 248.9904 2.9E3 250.5687 2.6E3 281.2956 4.1E4 282.2794 2.2E5 283.2827 2.4E5 299.3051 1.6E4 300.3092 1.5E4 309.3269 4.0E4 310.3113 2.0E5 311.3139 2.7E5 327.3379 1.7E4 328.3407 2.0E4 349.5651 2.9E3 411.5236 2.4E3 431.8867 2.9E3 END IONS BEGIN IONS FEATURE_ID=874 PEPMASS=584.4217 SCANS=874 RTINSECONDS=1014.627 CHARGE=1+ MSLEVEL=2 MERGED_STATS=7 / 7 (0 removed due to low quality, 0 removed due to low cosine). 67.0541 2.6E4 67.2224 2.3E3 68.4316 2.2E3 69.0333 5.8E3 69.0696 3.0E4 71.0487 3.0E3 71.0852 3.5E3 73.0284 1.3E4 75.1384 3.0E3 79.0539 4.0E4 80.0618 9.9E3 81.0696 1.2E5 83.0490 1.8E4 83.0852 1.9E4 83.7399 2.7E3 85.0649 2.6E3 85.2516 2.2E3 87.0438 1.6E4 89.0594 2.6E5 91.0539 4.2E4 91.1452 2.2E3 91.4817 2.5E3 93.0694 1.6E5 94.0730 2.3E3 95.0488 4.5E4 95.0852 9.5E4 97.0646 3.1E4 105.0696 1.8E5 106.0733 3.4E3 107.0852 1.4E5 108.0888 5.5E3 109.0645 2.7E4 109.1009 9.8E4 111.0800 1.6E4 111.3710 2.4E3 113.0958 3.6E3 114.6765 3.2E3 115.2863 2.1E3 117.0696 2.4E4 119.0766 3.7E3 119.0852 2.6E5 120.0880 3.2E3 121.0639 3.5E3 121.1008 1.8E5 122.1042 1.7E4 123.0801 9.3E4 123.1168 2.3E4 123.8740 2.4E3 125.0587 1.3E4 125.0957 1.0E4 126.7300 2.5E3 129.0699 1.0E4 129.3150 2.7E3 131.0853 1.0E5 132.0928 2.4E4 133.0857 1.3E5 133.1009 1.8E5 134.1044 1.2E4 135.0803 3.6E4 135.1166 6.8E4 137.0959 5.0E4 138.1037 6.4E3 139.1116 2.7E4 141.1341 2.4E3 142.0782 2.8E3 143.0852 1.0E5 144.0928 3.1E4 145.0889 7.2E3 145.1009 3.2E5 146.1056 3.2E4 147.0801 4.9E4 147.1165 9.9E4 148.1196 8.9E3 149.0962 2.1E4 149.1324 6.6E3 151.0753 3.4E4 151.1112 1.8E4 152.1605 2.6E3 155.0852 1.7E4 156.0198 2.6E3 156.0926 1.9E4 157.1009 2.0E5 158.1081 5.6E4 159.0805 1.9E4 159.1166 1.6E5 160.0881 7.7E4 160.1230 5.8E3 161.0961 4.1E4 161.1323 3.8E4 163.1114 5.2E4 165.0908 1.7E5 166.0947 9.8E3 167.0853 2.4E3 167.1064 3.5E4 169.1011 7.5E4 170.1073 1.6E4 171.1167 1.4E5 172.1235 2.6E4 173.0958 1.8E4 173.1325 9.6E4 173.5244 3.2E4 173.5361 1.2E5 174.1376 1.5E4 175.1113 2.6E4 175.1480 4.7E4 176.1203 3.0E3 177.0901 2.7E3 177.1125 4.1E3 177.1276 3.2E3 180.1137 7.1E3 181.1010 3.3E4 181.1220 4.0E4 182.1081 1.0E4 182.5432 2.9E3 183.1168 8.2E4 184.1234 1.6E4 185.1323 9.6E4 186.1389 1.9E4 187.1118 6.2E3 187.1481 4.7E4 189.1272 2.6E4 190.1348 2.5E4 191.1064 8.8E3 191.1430 2.9E4 193.1015 1.5E4 193.1219 1.9E4 194.1083 9.9E3 195.1167 6.8E4 195.1352 3.1E3 196.1233 2.1E4 197.1324 1.1E5 198.1384 1.7E4 199.1117 8.4E3 199.1481 3.7E4 201.1267 1.4E4 201.1640 8.1E3 203.1430 8.1E4 204.1479 5.0E3 207.1173 2.4E4 207.1380 2.9E4 208.1234 1.2E4 208.1446 1.2E4 209.1324 8.4E4 210.1382 2.0E4 211.1481 7.3E4 212.1536 5.6E3 213.1278 8.1E3 213.1631 1.4E4 215.1425 3.9E3 216.1485 3.0E3 217.1576 2.5E3 219.1390 2.8E3 221.1321 3.3E4 221.1538 1.6E5 222.1388 2.9E3 222.1566 5.1E3 223.1485 5.7E4 224.1535 3.4E3 225.1639 3.8E4 227.1434 4.4E3 227.1785 3.1E3 233.1314 3.3E3 234.1614 1.9E4 235.1479 3.4E4 237.1292 3.5E3 237.1639 3.6E4 238.1680 6.6E3 239.1805 7.1E3 241.1583 2.8E3 247.1692 2.1E4 248.1561 3.1E3 249.1640 8.3E3 251.1784 1.9E4 253.1588 3.5E3 253.1922 3.2E3 255.1759 2.9E3 259.1699 3.1E4 260.1769 2.6E3 261.1604 3.4E3 263.1787 1.5E4 265.1939 9.7E3 266.2031 2.1E4 267.1744 5.3E3 271.1691 3.5E3 272.1767 2.4E3 273.1855 2.7E3 273.1970 2.5E3 274.1091 2.7E3 274.1933 8.0E3 275.1785 6.1E3 281.1904 3.0E3 283.2042 3.4E3 283.2822 2.9E3 286.1165 2.7E3 286.1915 1.8E4 287.2010 5.5E4 291.2107 3.3E3 297.1847 3.2E3 299.2015 1.8E4 300.2079 1.0E4 311.2004 2.6E3 312.2091 2.9E3 325.2175 2.9E3 327.0812 2.4E3 337.2153 2.0E4 351.2307 3.9E3 352.2393 6.1E4 353.2464 3.1E4 354.2515 7.7E3 356.3028 2.8E3 365.2472 5.0E4 366.2543 1.2E4 403.3059 2.5E3 404.4293 2.5E3 449.4476 2.5E3 491.3511 2.6E4 492.3557 6.9E4 492.8877 2.5E3 504.3598 3.7E4 535.6949 2.3E3 571.0925 2.5E3 575.5451 2.3E3 584.4216 3.7E3 END IONS BEGIN IONS FEATURE_ID=875 PEPMASS=619.2921 SCANS=875 RTINSECONDS=1015.066 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 65.4838 2.4E3 66.3058 2.9E3 68.8087 2.8E4 68.8120 4.8E3 72.2267 2.5E3 72.8781 2.2E3 75.8253 2.6E3 79.3595 2.8E3 81.0701 2.9E3 81.4734 2.3E3 88.4358 2.2E3 92.2592 2.3E3 110.9050 2.8E3 119.4905 3.3E3 157.2281 2.8E3 172.8428 2.7E3 173.5228 2.7E4 173.5393 4.5E4 209.8410 2.4E3 213.2377 2.9E3 219.9874 2.4E3 230.4471 2.3E3 238.8281 2.5E3 252.7262 2.6E3 277.8203 2.3E3 282.5424 2.3E3 328.8600 2.3E3 341.3073 3.8E3 360.2280 2.6E3 399.1661 2.3E3 417.6016 2.7E3 473.2338 2.6E4 485.2331 1.2E4 487.2494 4.0E4 488.2572 2.1E4 503.2441 1.2E4 531.2395 2.5E4 532.2467 7.7E3 559.2702 2.0E5 560.2782 3.1E4 587.2660 3.5E4 591.2609 1.2E5 591.3522 4.0E3 619.2912 8.1E5 619.4149 2.9E3 END IONS BEGIN IONS FEATURE_ID=876 PEPMASS=323.1283 SCANS=876 RTINSECONDS=1019.008 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 3 (1 removed due to low quality, 0 removed due to low cosine). 49.0797 2.2E3 52.7735 2.2E3 53.0383 2.4E3 55.0176 1.2E4 55.2539 2.2E3 65.6078 2.4E3 71.8018 2.4E3 73.2700 2.5E3 77.0388 1.1E4 79.0540 2.2E4 91.0539 3.0E4 93.0696 8.2E3 95.0183 2.3E3 95.0489 2.0E4 103.0539 7.8E4 105.0330 3.8E3 105.0443 4.3E3 105.0696 1.2E5 107.0486 5.5E4 115.0541 1.5E4 117.0696 2.2E4 119.0487 1.7E4 121.0553 3.2E3 121.0645 1.0E5 128.0621 3.5E3 129.0697 1.4E4 131.0489 6.3E5 131.0586 3.6E3 131.0597 7.0E3 132.0566 7.0E3 133.0645 8.5E5 133.0748 8.5E3 135.0438 1.7E6 135.0540 1.6E4 135.0626 1.1E4 137.0595 8.9E3 141.0695 2.9E3 143.0489 3.4E4 143.0852 1.6E4 144.0572 4.2E3 145.0645 1.0E5 148.0515 7.0E3 149.0460 1.1E4 149.0594 2.7E5 149.0710 2.9E3 151.0754 3.1E3 157.0646 4.3E4 159.0440 1.6E4 160.0517 3.3E4 161.0595 6.9E5 161.0710 6.6E3 161.0914 3.0E3 163.0754 2.7E4 169.0645 5.9E3 171.0447 2.6E3 171.0802 3.3E4 172.0525 4.5E3 173.0597 1.1E5 173.5193 4.1E3 173.5312 2.8E4 174.0672 3.9E3 175.0757 2.5E4 179.0848 2.7E3 185.0597 5.9E4 186.0674 6.7E4 187.0577 4.3E3 187.0752 8.7E4 187.0923 3.3E3 193.1014 3.0E3 194.0729 3.0E3 199.0748 4.3E3 201.0907 2.5E4 207.0796 9.2E3 207.1169 8.2E3 217.1013 2.4E4 220.0881 1.4E4 221.0965 6.2E3 229.2949 2.6E3 233.0944 8.3E3 235.0747 2.9E3 235.0844 2.9E3 235.1119 7.4E4 245.0957 4.0E4 247.1120 3.3E3 248.0833 2.0E4 263.1067 7.3E4 265.1243 2.4E3 275.1073 6.7E3 278.0944 4.2E3 291.1009 3.0E3 293.1173 4.4E4 308.1048 1.3E5 313.0815 2.7E3 323.1285 1.8E5 326.1156 3.3E3 END IONS BEGIN IONS FEATURE_ID=877 PEPMASS=663.4545 SCANS=877 RTINSECONDS=1020.423 CHARGE=1+ MSLEVEL=2 MERGED_STATS=8 / 8 (0 removed due to low quality, 0 removed due to low cosine). 68.6496 2.4E3 72.8977 3.1E3 73.6239 2.2E3 74.2663 2.5E3 74.3327 2.4E3 75.3417 2.6E3 76.2983 2.4E3 78.9626 2.1E3 81.1011 2.6E3 86.3038 2.6E3 86.5016 2.5E3 87.0978 2.1E3 87.4752 2.4E3 88.6855 2.5E3 89.5880 2.4E3 96.9248 2.1E3 98.1925 2.7E3 100.0521 2.3E3 103.8366 2.3E3 107.1305 2.6E3 110.8743 2.4E3 112.2924 2.2E3 112.5982 2.2E3 119.0838 2.6E3 128.2009 2.6E3 131.8036 2.8E3 144.5446 2.5E3 146.6585 2.4E3 147.1170 3.3E3 149.2796 2.1E3 149.6721 3.3E3 149.6822 4.3E3 149.7032 3.5E3 153.8750 2.3E3 154.7740 2.4E3 157.4822 2.6E3 160.0910 2.4E3 173.5238 9.0E4 173.5424 1.2E5 176.7992 2.7E3 188.0861 2.5E3 192.9053 2.4E3 211.5136 2.7E3 216.2829 2.1E3 241.0785 2.6E3 251.0467 9.4E3 261.5096 2.5E3 281.2764 2.8E3 295.0612 2.4E3 307.1097 1.5E4 327.0780 1.7E5 339.5422 2.7E3 363.1720 1.3E4 382.5083 2.5E3 383.1409 6.4E5 383.1978 1.4E4 439.1022 3.5E3 439.2031 2.3E6 481.9989 2.7E3 483.0013 2.7E3 483.0960 2.2E3 484.5492 2.7E3 495.2005 3.4E3 495.2651 4.8E6 496.2666 2.9E3 526.2087 2.7E3 534.6275 2.4E3 551.3283 6.7E5 551.4261 3.7E3 607.3919 3.2E4 621.7942 2.7E3 645.3411 2.8E3 END IONS BEGIN IONS FEATURE_ID=878 PEPMASS=680.4810 SCANS=878 RTINSECONDS=1020.872 CHARGE=1+ MSLEVEL=2 MERGED_STATS=7 / 7 (0 removed due to low quality, 0 removed due to low cosine). 67.0746 2.2E3 68.9794 2.3E3 69.7282 2.3E3 73.5707 2.4E3 73.7532 2.5E3 76.2477 4.8E3 78.4101 2.4E3 79.6241 2.2E3 80.1767 2.4E3 82.9268 2.2E3 84.3911 3.0E3 86.3782 2.3E3 88.3747 2.6E3 90.6299 2.4E3 92.2489 2.6E3 95.5647 2.3E3 96.3066 2.6E3 99.3456 2.5E3 108.2242 2.1E3 109.7869 2.4E3 111.2282 2.3E3 116.0781 2.2E3 124.6824 2.5E3 126.6638 2.7E3 135.9212 2.2E3 138.6075 2.1E3 139.5303 2.3E3 149.6833 5.1E3 149.6934 4.3E3 164.6189 2.4E3 169.8023 2.2E3 173.3165 2.6E3 173.5245 8.9E4 173.5404 7.7E4 182.1122 2.3E3 188.2554 2.7E3 195.6119 2.4E3 209.1566 3.0E3 211.9854 2.6E3 223.7060 2.4E3 227.6562 2.8E3 227.8689 2.9E3 241.5627 2.4E3 277.0699 2.5E3 282.8149 2.9E3 291.6202 2.4E3 295.6397 2.5E3 327.0777 2.1E4 334.8299 2.7E3 338.0374 2.5E3 347.5876 2.5E3 353.9821 2.9E3 383.1407 1.3E5 395.5779 2.5E3 395.6216 2.9E3 400.4029 2.7E3 439.2031 6.8E5 486.0945 2.5E3 491.8739 2.7E3 495.1451 4.0E3 495.2654 2.6E6 531.8410 2.5E3 535.5344 2.6E3 551.2277 2.4E3 551.3284 9.5E5 551.4253 4.6E3 552.4612 3.0E3 607.3904 1.5E5 617.1117 2.6E3 624.2827 2.6E3 663.4559 3.9E3 680.4286 2.4E3 END IONS BEGIN IONS FEATURE_ID=879 PEPMASS=621.3069 SCANS=879 RTINSECONDS=1022.525 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 12 (8 removed due to low quality, 0 removed due to low cosine). 65.4762 2.5E4 65.9208 1.6E5 66.7760 5.9E3 67.6761 3.4E4 68.8302 2.5E4 69.0337 1.9E6 69.0366 3.1E5 77.7709 4.1E3 85.2656 3.3E4 89.0078 4.2E4 101.5093 6.1E3 102.7033 3.2E4 105.8006 3.9E3 126.0590 3.4E4 133.7634 3.2E4 138.7319 3.3E4 140.3156 8.2E4 140.3280 3.6E4 147.5434 8.6E3 151.4656 3.1E4 155.3194 7.5E4 155.3338 7.0E4 161.0392 2.7E4 173.5197 6.3E4 173.5376 7.2E5 176.2116 7.8E3 181.7646 4.3E3 193.8562 3.1E4 240.6224 3.0E4 252.9787 7.5E3 264.0071 6.6E3 268.9718 7.3E3 283.1401 3.9E3 315.1678 6.7E3 360.7830 4.6E3 373.5623 9.1E3 379.2455 3.6E4 381.3627 4.0E3 390.3597 7.8E3 405.2082 7.4E3 417.2071 4.2E4 418.2168 9.9E3 419.2220 1.8E4 431.1869 3.7E5 432.1935 3.1E4 433.2387 8.4E5 434.2462 1.5E5 445.2025 2.8E5 446.2097 3.3E5 447.2178 6.9E5 449.2341 1.7E4 452.9404 4.0E4 453.7283 3.7E4 459.2180 1.7E6 460.1638 2.0E4 460.2240 4.2E6 461.2335 3.8E6 462.2384 3.2E5 472.2244 1.0E4 473.2335 1.6E6 473.2944 6.7E3 474.2398 2.9E5 475.2484 2.8E4 476.2594 8.8E3 477.2291 2.9E4 487.2487 1.1E6 488.2160 9.6E4 488.2516 1.0E5 489.2624 1.4E5 491.2096 2.5E5 492.2516 6.5E5 493.2596 7.7E4 499.2524 2.2E4 501.2292 7.7E4 502.2339 3.5E4 503.2463 2.1E5 504.2348 7.5E3 505.2261 8.2E5 506.2573 1.1E4 515.2442 8.9E5 516.2508 2.8E4 517.2610 3.7E5 518.2300 5.7E3 518.2443 2.1E4 519.2468 4.0E5 520.2456 1.5E6 521.2806 7.6E3 521.2913 5.6E3 531.2427 2.1E4 532.2460 1.2E5 533.2566 3.1E6 534.2619 9.6E4 543.2383 5.1E4 545.2715 7.2E3 546.2617 3.9E5 547.2709 9.2E5 548.2701 1.4E4 548.2831 6.2E3 549.2526 4.5E3 560.2476 2.1E5 561.0209 2.8E4 561.0798 2.4E5 561.1275 3.4E4 561.2865 4.7E7 561.4489 1.2E5 561.4902 2.0E5 561.5500 3.5E4 562.2898 2.3E6 563.2531 4.6E3 564.2413 2.3E4 565.2795 1.6E5 572.2742 1.1E4 574.2563 2.2E4 575.1625 7.8E3 575.2659 1.5E6 575.3455 6.5E3 577.2468 2.1E4 577.2748 7.7E3 578.2852 1.9E5 579.2958 3.0E4 589.1701 1.0E4 589.2802 1.9E6 589.3903 6.9E3 591.2609 9.3E4 592.2686 8.4E5 593.2821 4.5E6 593.4856 8.8E3 606.2814 5.5E5 620.3019 2.6E4 621.0658 2.7E5 621.1206 8.8E4 621.3073 5.4E7 621.4958 1.2E5 621.5450 2.5E5 621.6168 3.5E4 622.3063 2.5E4 END IONS BEGIN IONS FEATURE_ID=880 PEPMASS=620.3005 SCANS=880 RTINSECONDS=1022.631 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 64.0735 1.2E4 64.9920 5.4E3 65.3633 8.1E4 65.3655 1.2E4 65.7621 3.8E3 67.2506 8.7E3 67.2533 3.0E4 68.9212 1.0E5 68.9244 2.0E4 69.3283 1.1E4 75.4846 2.5E3 78.1664 9.4E3 80.5955 5.1E3 85.2502 5.4E3 85.5787 9.2E3 87.7470 1.0E4 94.1063 3.7E3 94.4586 4.2E3 104.5269 2.4E3 114.8025 1.5E4 114.8078 7.3E3 119.2640 2.7E3 129.8049 2.5E3 133.9677 4.6E3 140.3169 7.5E3 140.3269 6.7E3 144.2314 3.8E3 166.7575 4.4E3 173.5263 1.5E5 173.5408 1.2E5 208.5152 2.5E3 241.1063 2.5E3 242.6782 5.0E3 246.3869 1.2E4 270.0830 5.8E3 277.1349 2.4E3 296.1525 2.9E3 299.6984 4.2E3 325.0976 4.1E3 355.1169 2.5E3 388.2038 1.4E4 400.2034 1.3E4 401.2115 5.6E4 414.2203 5.0E3 416.2334 6.9E4 419.2285 6.8E3 431.1839 1.1E4 432.2311 2.7E4 433.2393 1.7E5 434.2478 1.6E4 444.1951 4.6E4 445.1978 4.3E4 445.2455 1.6E4 446.2055 2.4E4 447.2545 1.1E5 449.2345 4.0E3 459.0689 2.5E4 459.1579 5.9E4 459.2184 8.4E6 460.2263 9.4E5 461.2339 7.6E5 461.3031 4.7E3 462.2790 4.5E4 471.2203 7.2E3 472.2327 1.2E4 473.2336 3.1E5 474.2417 6.4E4 475.2519 1.8E4 476.2215 5.6E4 477.2289 1.2E4 486.2422 6.3E4 487.2168 6.7E5 488.2561 3.2E5 489.2655 2.8E4 491.2443 2.6E5 492.2522 2.2E5 498.2449 7.2E3 500.2198 6.0E4 501.2293 2.7E5 503.2422 2.3E4 505.2295 1.4E5 514.2360 3.2E4 515.2452 1.3E5 516.2519 5.2E4 517.2561 9.6E4 518.2368 2.9E4 519.1584 1.3E4 519.2409 5.5E6 520.1659 6.4E3 520.2702 1.0E5 531.2402 5.3E4 532.2508 9.0E4 533.2581 5.3E5 534.2978 2.1E4 542.2344 4.5E4 544.2840 4.7E3 545.2556 6.5E5 546.2630 6.8E4 547.2711 1.3E5 548.2764 2.3E4 549.2814 6.9E4 559.2633 6.6E4 560.2785 1.2E6 561.0796 3.0E4 561.1286 2.1E4 561.2103 2.2E4 561.2868 8.2E6 561.4903 1.7E4 563.2540 6.9E3 571.2718 9.4E4 573.2512 1.0E5 575.2382 5.5E3 577.2783 3.7E5 578.2891 2.3E4 579.3021 3.2E3 588.1570 4.5E3 588.1893 2.9E4 588.2738 2.0E6 588.3801 2.5E4 589.2813 3.0E4 590.2532 2.5E5 591.2660 1.5E5 592.2793 1.7E5 593.2766 1.4E4 602.2922 1.0E4 605.1615 2.3E4 605.2763 1.3E6 605.3892 2.3E4 619.2907 6.0E4 620.1321 1.7E4 620.2998 2.9E6 621.3080 2.2E5 END IONS BEGIN IONS FEATURE_ID=881 PEPMASS=643.2895 SCANS=881 RTINSECONDS=1023.626 CHARGE=1+ MSLEVEL=2 MERGED_STATS=9 / 9 (0 removed due to low quality, 0 removed due to low cosine). 65.9014 2.4E3 68.1019 2.3E3 68.9740 2.2E3 70.5754 2.1E3 71.4738 5.8E3 71.4768 1.1E5 71.8092 2.8E3 72.3223 2.2E3 72.5395 2.6E3 72.5576 2.5E3 77.4464 2.6E3 79.4961 2.3E3 81.1161 2.3E3 81.6053 3.3E3 82.1822 2.6E3 85.4327 2.3E3 90.6753 2.3E3 96.4303 2.5E3 98.1846 2.4E3 105.6301 3.1E3 106.6309 2.4E3 108.2921 2.1E3 111.6072 2.3E3 115.8292 2.6E3 121.2638 2.8E3 122.5383 2.3E3 130.3238 2.3E3 130.8413 2.2E3 133.5010 2.4E3 135.9066 2.6E3 140.3328 2.5E3 146.7957 2.2E3 150.0547 2.5E3 160.8132 2.6E3 163.8056 2.7E3 164.7461 2.5E3 168.6263 2.3E3 169.0122 2.4E3 173.5277 1.6E5 173.5404 8.7E4 175.9397 2.4E3 181.2581 2.3E3 189.6208 2.5E3 194.4278 2.3E3 211.3551 3.2E3 216.6756 2.4E3 223.1416 2.5E3 231.6538 2.7E3 232.9069 2.7E3 257.8361 2.4E3 266.2321 2.9E3 289.8859 2.3E3 304.1057 2.5E3 316.0955 2.3E3 334.3308 2.6E3 342.7552 2.7E3 371.1113 2.7E3 375.1234 2.9E3 390.0533 2.5E3 434.8353 2.8E3 452.8821 2.5E3 467.8610 2.4E3 469.1967 9.3E3 504.8311 2.3E3 527.2018 3.6E3 539.2410 1.5E5 541.6743 2.7E3 561.8602 2.9E3 583.2561 4.1E3 583.2706 7.4E3 589.2828 2.8E3 611.2638 1.7E4 643.2888 2.9E6 END IONS BEGIN IONS FEATURE_ID=882 PEPMASS=665.2969 SCANS=882 RTINSECONDS=1023.787 CHARGE=1+ MSLEVEL=2 MERGED_STATS=2 / 4 (2 removed due to low quality, 0 removed due to low cosine). 70.8095 2.4E3 82.9549 2.5E3 86.4143 2.4E3 91.8163 2.4E3 99.1256 2.4E3 119.3113 2.2E3 149.6872 3.6E3 161.4251 2.4E3 173.5208 7.7E3 173.5341 3.0E4 173.5474 7.9E3 174.0708 2.4E3 190.5164 2.5E3 226.1452 2.5E3 227.8777 2.3E3 261.2164 2.5E3 275.1606 2.4E3 325.1551 2.8E3 351.1358 3.2E3 376.6248 2.6E3 417.4562 2.6E3 458.2435 3.9E3 459.2188 2.7E4 460.2253 7.2E3 472.2247 9.0E3 473.2338 6.3E4 475.2101 7.8E3 476.2208 1.4E4 477.2301 2.1E4 485.2334 2.2E4 487.2503 1.9E4 488.2595 7.0E3 489.2258 7.5E3 496.2697 3.3E3 497.2753 2.9E3 503.2428 2.0E4 513.2266 5.7E3 515.2452 2.8E3 518.2305 2.4E3 519.2422 2.4E4 531.2448 2.7E4 532.2480 2.4E3 535.2425 4.5E3 536.2430 3.7E3 545.2547 8.1E3 549.2760 1.4E4 559.2708 3.8E5 560.2782 2.2E4 561.2865 5.0E4 562.2555 3.0E3 563.2662 4.3E3 576.2725 1.0E4 577.2814 2.3E5 587.2652 2.8E4 588.2731 1.2E4 591.2883 6.9E4 595.2929 5.6E3 605.2766 7.8E4 608.2733 3.0E3 609.2859 8.7E3 609.2982 6.9E3 619.2917 9.8E4 620.2998 5.7E4 621.3059 9.9E3 637.3027 1.6E5 665.2977 4.4E4 END IONS BEGIN IONS FEATURE_ID=883 PEPMASS=708.5119 SCANS=883 RTINSECONDS=1024.792 CHARGE=1+ MSLEVEL=2 MERGED_STATS=7 / 7 (0 removed due to low quality, 0 removed due to low cosine). 72.6429 2.7E3 73.7802 2.4E3 74.4942 2.4E3 75.8497 2.6E3 75.9550 2.5E3 80.1409 2.2E3 80.3507 2.7E3 89.4888 2.2E3 94.2998 2.3E3 105.1873 2.3E3 105.7072 2.5E3 108.5198 2.2E3 118.2974 2.5E3 122.0777 2.3E3 130.7858 2.9E3 135.0125 2.5E3 143.3580 2.5E3 149.6570 2.5E3 149.6876 4.8E3 150.3964 2.2E3 154.5340 2.6E3 157.5875 2.4E3 160.4642 2.7E3 160.7212 2.3E3 166.0502 2.4E3 171.8956 2.4E3 173.5227 5.8E4 173.5377 1.2E5 178.1441 2.6E3 184.6122 2.7E3 189.5213 2.7E3 190.1605 2.5E3 197.9023 2.4E3 205.2786 2.7E3 223.3818 2.6E3 234.9740 2.7E3 253.3808 2.6E3 257.0910 2.3E3 270.2212 2.5E3 271.6176 2.3E3 299.3405 2.4E3 310.4879 2.6E3 327.0780 2.2E4 334.8044 2.4E3 340.2769 2.6E3 354.1740 2.9E3 383.1411 1.2E5 439.2033 6.4E5 439.6482 2.5E3 466.7266 2.8E3 495.2655 2.7E6 496.2690 1.0E4 497.2725 8.2E3 526.6011 2.5E3 551.2318 9.0E3 551.2540 4.4E3 551.3285 1.1E6 551.4265 4.7E3 552.3359 3.5E3 553.3375 4.0E3 578.0035 2.9E3 607.3909 2.2E5 638.7976 2.7E3 663.4545 1.4E4 END IONS BEGIN IONS FEATURE_ID=884 PEPMASS=470.3635 SCANS=884 RTINSECONDS=1025.411 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 57.0697 8.5E3 57.9036 2.3E3 67.0539 3.2E4 67.7362 3.0E3 69.0695 8.5E4 70.0748 2.5E3 70.6352 2.1E3 71.0852 4.6E3 73.2845 2.2E3 74.2491 2.4E3 76.5481 2.4E3 79.0540 2.5E4 79.0697 2.3E3 81.0695 4.2E5 81.0779 4.1E3 83.0852 1.9E4 89.0593 3.9E3 90.2504 2.4E3 90.2677 2.3E3 93.0696 3.6E4 95.0852 1.9E5 97.1011 1.5E4 100.4204 2.3E3 100.9132 2.4E3 105.0693 4.9E3 107.0852 4.1E4 109.1008 1.1E5 111.1165 2.5E3 115.0239 3.3E3 118.2323 2.8E3 119.0852 9.5E3 121.1009 7.8E4 123.1165 5.7E4 133.1007 6.5E3 135.1166 5.2E4 137.1242 2.0E3 137.1322 5.8E4 137.9292 2.5E3 141.0545 4.2E4 147.1170 9.4E3 149.1323 6.7E4 151.0751 2.0E4 159.1169 1.2E4 161.1316 2.6E3 163.1481 1.7E4 165.0546 1.5E4 165.0909 6.0E3 165.1626 2.7E3 167.0554 4.3E3 167.0703 2.7E5 170.1540 5.5E3 171.0714 2.5E3 173.5255 5.2E4 173.5405 3.0E4 175.0748 2.6E3 175.1480 4.2E3 177.0914 3.5E3 177.1640 1.2E4 179.0701 8.5E3 179.1066 2.5E3 181.0857 1.9E4 187.1118 6.2E3 189.1638 5.6E3 191.0707 1.3E4 191.1072 2.9E3 193.0859 1.7E4 203.1813 3.1E3 205.0864 2.0E4 205.1226 8.3E3 207.1017 3.1E4 215.1070 2.1E4 219.1018 1.2E4 221.1178 1.2E4 233.1177 1.0E4 241.7877 2.3E3 245.1185 3.1E3 253.5385 2.7E3 257.1526 2.5E3 275.1649 3.4E3 282.2795 1.6E4 411.4010 2.6E3 419.1956 2.7E3 435.8606 2.5E3 END IONS BEGIN IONS FEATURE_ID=885 PEPMASS=447.2876 SCANS=885 RTINSECONDS=1025.445 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 6 (1 removed due to low quality, 0 removed due to low cosine). 56.8179 2.7E3 57.0696 2.6E3 63.8934 2.8E3 65.2935 2.2E3 72.7603 2.6E3 73.3351 2.2E3 73.7617 2.1E3 73.9982 2.1E3 77.4312 2.5E3 83.5177 2.3E3 83.9849 2.3E3 85.0668 2.4E3 95.1618 2.3E3 96.5051 2.2E3 96.9010 2.5E3 100.0401 2.9E3 119.0848 2.2E3 124.6678 2.6E3 125.7162 2.4E3 127.7635 2.3E3 134.4385 2.3E3 136.8240 2.4E3 139.1762 2.6E3 142.3381 2.4E3 146.2720 2.3E3 155.5906 2.7E3 172.2158 2.6E3 173.3271 3.0E3 173.5226 8.6E3 173.5302 6.6E4 173.5425 2.1E4 173.5522 2.5E3 180.3015 2.8E3 187.0170 6.8E3 187.0365 2.5E6 189.0513 3.4E3 205.0470 1.1E4 212.8032 2.7E3 215.7319 2.7E3 221.1680 2.3E3 228.0633 8.6E3 251.7472 2.6E3 269.8737 2.4E3 272.3237 2.5E3 296.9544 2.7E3 296.9686 3.0E3 300.3926 2.4E3 307.7408 2.4E3 319.3158 2.7E3 330.8475 2.4E3 343.2168 2.7E3 347.7944 2.2E3 354.8920 2.4E3 447.2912 1.8E4 447.3944 2.9E4 END IONS BEGIN IONS FEATURE_ID=886 PEPMASS=425.3056 SCANS=886 RTINSECONDS=1025.553 CHARGE=1+ MSLEVEL=2 MERGED_STATS=8 / 9 (1 removed due to low quality, 0 removed due to low cosine). 55.0182 2.9E3 55.0540 2.4E5 56.6663 2.5E3 57.0336 2.5E3 57.0697 1.4E5 57.7544 2.2E3 57.8815 2.6E3 59.4719 2.3E3 60.0342 2.1E3 60.9908 2.1E3 62.1793 2.5E3 64.0953 2.3E3 65.0385 1.8E4 65.9399 2.2E3 67.0178 2.7E4 67.0500 3.7E3 67.0539 6.3E5 69.0697 1.1E6 69.0735 3.6E3 70.4438 2.2E3 71.0491 2.5E3 71.0853 5.0E4 71.6465 2.5E3 73.0328 2.4E3 73.5628 2.2E3 74.9793 2.6E3 76.6236 2.2E3 77.0386 7.4E3 77.1099 2.5E3 79.0539 4.0E5 81.0698 5.4E6 81.0782 6.8E4 81.0811 7.7E3 82.4850 2.2E3 83.0490 4.7E4 83.0852 3.1E5 85.0287 2.5E3 89.0593 8.1E4 89.2695 2.6E3 90.0628 1.0E4 91.0540 1.2E5 93.0631 5.4E3 93.0696 8.7E5 93.0767 5.2E3 95.0489 7.3E4 95.0854 2.8E6 97.1009 2.3E5 100.5943 2.6E3 105.0449 4.7E3 105.0696 1.9E5 107.0486 2.5E3 107.0772 4.5E3 107.0853 8.6E5 107.0919 3.5E3 109.0647 6.4E3 109.0886 3.5E3 109.1010 1.7E6 109.1136 4.1E3 110.3457 2.4E3 110.9142 2.3E3 111.0438 2.2E4 111.0808 2.3E3 111.1166 1.2E5 111.7587 2.4E3 113.0595 2.6E4 113.8790 2.3E3 117.0694 1.3E4 119.0491 2.7E4 119.0853 2.5E5 119.0946 4.4E3 121.0647 3.9E4 121.0910 8.9E3 121.1010 1.0E6 123.0440 8.4E3 123.0804 1.6E4 123.1069 1.2E4 123.1166 7.5E5 123.1253 2.1E3 125.0597 4.4E3 128.1014 2.4E3 129.4497 2.3E3 131.0855 4.8E4 131.5289 2.7E3 133.0648 2.0E4 133.0866 2.7E4 133.1011 1.9E5 135.0804 5.6E4 135.1056 4.2E3 135.1167 6.8E5 137.0595 1.4E5 137.1204 4.6E3 137.1323 4.8E5 138.0674 8.0E3 138.1797 2.4E3 139.0390 6.7E4 139.0751 1.1E5 141.0427 4.6E3 141.0545 5.1E5 141.0671 4.7E3 143.0853 1.1E4 143.5344 2.5E3 145.1011 8.0E4 146.5609 2.2E3 147.0802 4.0E4 147.1167 2.4E5 149.0596 9.7E4 149.0957 1.4E4 149.1192 1.3E4 149.1324 8.1E5 149.1462 1.3E4 151.0619 4.9E3 151.0752 3.7E5 151.1483 2.6E4 151.9738 2.8E3 153.0547 1.9E4 155.2007 2.3E3 157.1013 3.3E4 159.0803 2.7E4 159.1168 2.0E5 160.0887 2.4E3 161.0597 7.0E4 161.0962 4.1E4 161.1325 1.3E5 161.7321 2.4E3 163.0753 5.8E4 163.1124 1.2E4 163.1481 2.5E5 165.0547 2.6E5 165.0911 1.4E5 167.0704 4.8E6 167.1035 6.0E3 169.1015 1.2E4 169.1699 2.2E4 169.5178 2.4E3 169.8862 2.4E3 170.1540 1.7E5 171.0797 3.8E3 171.1165 9.9E3 172.0885 3.1E3 173.0962 6.1E4 173.1327 3.6E4 173.5256 8.0E4 173.5414 6.8E4 174.1039 2.9E3 175.0755 1.3E5 175.1119 1.9E4 175.1482 1.2E5 177.0545 4.1E4 177.0912 1.1E5 177.1277 6.8E3 177.1639 1.7E5 178.0622 3.6E4 179.0704 1.4E5 179.0863 3.3E3 179.0920 2.4E3 179.1069 1.0E5 181.0860 3.0E5 181.1033 4.5E3 183.1163 2.4E3 185.0960 1.0E4 187.0756 2.7E4 187.1118 1.1E5 187.1483 1.1E4 187.1810 3.0E3 188.0853 3.0E3 189.0913 1.6E5 189.1277 8.6E3 189.1638 9.3E4 189.4780 2.4E3 190.0987 2.8E3 191.0704 2.5E5 191.1067 7.3E4 191.1796 5.1E4 192.0780 3.2E4 193.0862 2.1E5 193.1213 1.2E4 195.1010 1.1E4 197.0959 5.4E3 199.1116 1.5E4 201.0915 9.1E4 201.1273 6.9E3 201.1638 2.2E4 203.1070 9.5E4 203.1798 9.6E4 204.0383 2.3E3 205.0862 2.9E5 205.1226 1.2E5 205.1953 3.4E4 206.0931 3.1E3 207.1019 4.6E5 211.1129 2.5E3 211.1483 6.8E3 213.0919 1.0E4 213.1252 3.1E3 214.0987 2.6E3 215.1070 2.3E5 215.1791 3.8E3 217.0857 1.7E4 217.1225 3.4E4 217.1956 1.7E4 218.0948 3.2E3 219.1020 1.5E5 219.1386 8.6E3 221.1176 9.3E4 221.6783 2.6E3 227.1066 4.0E4 229.1230 4.6E4 229.1591 9.6E3 231.1021 4.2E4 231.1393 1.0E4 233.1176 1.2E5 237.1267 2.5E3 240.1136 2.8E3 241.1234 1.8E4 243.1387 1.3E4 245.1174 7.1E4 245.1416 3.1E3 245.2264 2.9E4 247.1335 4.1E4 253.1240 5.3E3 254.1309 2.7E3 255.1381 1.6E4 257.1533 4.8E4 259.1334 3.3E4 259.2420 5.3E4 261.1480 9.7E3 269.1525 7.3E3 271.1694 4.0E3 273.1494 2.5E4 275.1642 3.1E4 281.2954 1.6E4 282.2803 1.7E5 283.1699 7.6E3 287.1634 1.0E4 301.1797 2.7E3 310.8773 3.5E3 338.3570 3.5E3 340.1745 2.5E3 343.2319 2.6E3 369.9068 2.4E3 380.3418 2.5E3 393.3571 2.4E3 411.4879 2.7E3 412.7444 2.8E3 415.5596 2.7E3 425.3041 2.8E4 END IONS BEGIN IONS FEATURE_ID=887 PEPMASS=619.2919 SCANS=887 RTINSECONDS=1026.174 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 5 (0 removed due to low quality, 0 removed due to low cosine). 68.8083 1.4E4 68.8113 3.4E3 74.5153 2.3E3 74.6786 2.3E3 78.8337 2.4E3 78.9090 2.5E3 81.4614 2.2E3 82.8791 2.4E3 87.8254 2.4E3 114.3000 2.3E3 124.4833 2.6E3 129.3679 2.3E3 145.6003 2.5E3 154.8171 2.3E3 168.5631 2.4E3 173.5236 5.8E4 173.5402 6.5E4 204.2141 2.3E3 225.2562 2.4E3 302.0652 2.5E3 302.2236 3.0E3 343.2348 2.5E3 351.9849 2.7E3 376.2426 2.6E3 396.8940 2.8E3 431.2225 1.2E4 445.2025 3.0E3 457.2026 2.2E4 457.5622 2.3E3 458.2076 7.4E4 459.2186 9.8E4 460.2217 6.2E3 471.2177 2.6E4 472.3056 2.4E3 473.2323 1.3E4 485.2326 2.2E4 490.2287 3.0E3 503.2100 4.7E3 513.2261 1.4E4 518.2294 3.1E4 519.2427 1.2E4 521.8139 2.9E3 531.2410 4.3E4 544.2447 2.8E3 545.2569 8.5E3 559.2701 7.0E5 560.2755 4.3E4 561.2844 3.4E4 573.2480 1.6E4 587.2643 4.0E4 591.2670 5.3E4 605.2751 4.8E3 619.1743 1.0E4 619.2906 4.9E5 619.4112 4.0E3 619.4407 8.2E3 620.2920 4.7E3 END IONS BEGIN IONS FEATURE_ID=888 PEPMASS=643.2893 SCANS=888 RTINSECONDS=1031.961 CHARGE=1+ MSLEVEL=2 MERGED_STATS=5 / 5 (0 removed due to low quality, 0 removed due to low cosine). 65.7348 2.5E3 65.9516 2.4E3 66.3471 2.3E3 70.5919 2.0E3 71.4757 5.7E4 71.4788 1.2E4 73.1333 2.3E3 75.2584 2.2E3 77.5602 2.4E3 79.4135 2.5E3 81.7168 2.2E3 88.6314 2.3E3 107.9206 2.3E3 107.9725 2.5E3 108.8737 2.1E3 118.4580 2.5E3 120.1887 2.1E3 122.3129 2.3E3 129.3178 2.3E3 156.9083 2.1E3 157.3515 2.6E3 163.8140 2.3E3 173.5330 1.5E5 173.5502 4.7E3 173.5705 2.8E3 183.2530 2.2E3 186.0150 2.5E3 190.0609 2.6E3 196.4513 2.3E3 244.3639 2.5E3 292.0366 2.6E3 309.0046 2.9E3 309.9188 2.5E3 317.1909 2.5E3 362.5660 2.4E3 366.1390 2.5E3 404.4565 2.3E3 447.6716 2.6E3 469.1992 1.1E4 483.2157 3.4E3 507.0905 2.6E3 514.4669 2.9E3 527.2045 1.2E4 536.5212 3.2E3 537.2250 3.5E3 538.2271 2.6E3 539.2404 8.6E4 542.2311 7.0E3 543.2354 3.0E3 583.2661 2.5E4 611.2657 1.7E4 617.8308 2.5E3 643.2888 1.8E6 END IONS BEGIN IONS FEATURE_ID=889 PEPMASS=621.3068 SCANS=889 RTINSECONDS=1033.05 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 7 (4 removed due to low quality, 0 removed due to low cosine). 65.7210 1.6E4 65.9209 1.5E4 69.0312 6.1E4 69.0350 3.7E5 71.3075 2.1E4 74.2613 1.4E4 77.2839 1.4E4 77.8764 1.8E4 91.0264 1.7E4 99.6694 8.8E3 110.0459 1.0E4 119.6691 8.8E3 130.1258 1.9E4 140.3165 2.9E4 140.3264 5.7E4 146.9892 9.7E3 164.8265 1.8E4 173.5211 6.3E4 173.5357 4.3E5 175.8194 1.0E4 244.8217 2.0E4 350.2942 1.8E4 431.1855 8.9E4 433.2382 4.1E5 434.2460 5.8E4 445.1985 4.2E4 446.2086 1.1E5 447.2176 1.6E5 449.9467 1.5E4 459.2175 6.5E5 460.2226 1.8E6 461.1585 3.2E4 461.2326 1.8E6 462.2367 1.3E5 473.2321 5.7E5 474.2387 1.5E5 475.2456 9.9E3 487.2480 4.6E5 488.2122 5.7E4 488.2231 3.1E4 488.2535 5.3E4 489.2589 6.4E4 491.2128 3.4E4 491.2239 1.1E4 492.2504 2.0E5 501.2253 9.7E3 502.2323 1.4E4 503.2444 7.7E4 505.2254 2.0E5 515.2426 3.3E5 516.2461 1.3E4 517.2601 1.8E5 518.2351 1.2E4 519.2444 1.3E5 520.2442 6.8E5 532.2485 3.9E4 533.2562 1.2E6 534.2607 2.8E4 543.2413 1.5E4 546.2589 1.7E5 547.2700 5.9E5 560.2570 4.1E4 561.0208 2.2E4 561.0804 1.1E5 561.1262 8.3E4 561.2856 2.8E7 561.4885 1.9E5 561.5485 3.6E4 561.9056 1.2E4 562.2891 1.1E6 565.2787 3.9E4 572.2669 1.0E4 575.2652 7.7E5 578.2833 8.6E4 588.2770 2.2E4 589.2779 4.7E5 592.2695 1.8E5 593.2912 1.1E6 606.2791 2.3E5 621.3065 1.1E7 END IONS BEGIN IONS FEATURE_ID=890 PEPMASS=620.3004 SCANS=890 RTINSECONDS=1033.123 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 6 (0 removed due to low quality, 0 removed due to low cosine). 64.1401 2.5E3 65.3626 5.0E4 65.3656 4.9E3 67.2515 2.1E4 67.2548 4.8E3 68.7090 4.3E3 68.9209 5.3E4 68.9244 8.2E3 69.3127 2.4E3 80.7185 4.6E3 82.4499 4.1E3 83.2196 2.3E3 84.8509 4.7E3 89.0600 2.7E3 89.6873 2.5E3 105.6801 4.2E3 108.1907 5.0E3 111.0957 2.4E3 114.8058 1.2E4 114.8079 2.7E3 116.4643 4.6E3 117.5169 2.9E3 128.9741 2.5E3 133.0875 2.8E3 136.5186 2.3E3 140.3167 2.4E3 140.3283 2.3E3 146.5212 2.2E3 156.6121 2.8E3 163.0178 4.4E3 165.5880 2.4E3 173.5240 9.7E4 173.5395 1.6E5 194.8472 5.8E3 221.8868 4.9E3 241.9776 2.8E3 251.3478 4.6E3 256.9364 2.3E3 268.2651 2.5E3 268.3002 2.5E3 277.1341 3.4E3 297.0726 5.7E3 322.7321 5.4E3 385.9282 2.4E3 388.2042 1.5E4 391.7391 2.8E3 400.2051 3.2E3 401.2120 2.0E4 414.2181 7.0E3 416.2350 2.8E4 421.8427 4.5E3 424.1652 3.0E3 431.1774 1.0E4 432.2338 1.7E4 433.2392 1.3E5 434.2460 4.1E3 444.1947 2.5E4 445.1985 1.6E4 445.2434 7.4E3 446.2064 3.3E3 447.2549 6.5E4 451.7973 4.8E3 457.8624 5.5E3 459.0690 1.4E4 459.1588 1.7E4 459.2184 5.5E6 460.2262 6.4E5 460.2937 9.6E3 461.1582 5.3E3 461.2339 5.0E5 462.2755 2.1E4 471.2192 3.2E3 473.2336 2.3E5 474.2412 3.0E4 475.2419 2.8E3 475.2527 3.4E3 476.2203 3.3E4 477.2281 1.0E4 486.2408 5.1E4 487.2167 4.3E5 488.2559 2.0E5 489.2612 3.4E3 489.2712 4.7E3 489.9861 4.7E3 491.2440 1.6E5 492.2520 1.4E5 500.2201 4.0E4 501.2286 1.6E5 503.2423 1.7E4 504.2177 4.1E3 504.2435 4.0E3 505.2277 7.1E4 505.2574 5.7E3 514.2356 3.0E4 515.2447 7.6E4 516.2512 2.5E4 517.2567 6.1E4 518.2317 9.3E3 519.0042 3.1E3 519.1621 4.2E3 519.2408 3.5E6 520.2738 5.8E4 520.3782 4.7E3 524.3839 3.3E3 531.2382 4.4E4 532.2503 6.0E4 532.6578 2.7E3 533.2589 3.3E5 534.2984 1.2E4 542.2325 2.8E4 544.2834 2.8E3 545.2551 4.2E5 546.2636 4.3E4 547.2688 8.0E4 548.2724 5.4E3 549.2828 3.2E4 559.2634 3.3E4 560.2784 8.0E5 561.0797 8.5E3 561.2107 6.3E4 561.2867 5.3E6 561.4897 7.2E3 563.2545 5.1E3 571.2703 6.5E4 573.2503 4.8E4 575.2472 4.1E3 577.2777 2.6E5 578.2885 2.0E4 587.2672 3.3E3 588.1917 2.6E3 588.2738 1.2E6 589.2806 9.2E3 590.2529 1.5E5 591.2640 8.3E4 592.2802 1.1E5 605.1616 5.2E3 605.2763 8.4E5 605.3904 4.4E3 619.2906 3.4E4 620.1842 9.4E3 620.2997 1.8E6 621.3072 6.8E4 END IONS BEGIN IONS FEATURE_ID=891 PEPMASS=796.5939 SCANS=891 RTINSECONDS=1034.921 CHARGE=1+ MSLEVEL=2 MERGED_STATS=16 / 19 (3 removed due to low quality, 0 removed due to low cosine). 71.0488 5.0E4 71.0851 1.3E5 71.3874 2.7E3 71.9980 2.1E3 72.8620 4.3E3 73.0279 9.9E3 75.9530 2.3E3 77.2975 2.6E3 79.0538 5.8E5 79.4648 2.6E3 79.5068 2.1E3 80.8750 2.2E3 81.0694 3.0E6 81.0777 2.3E4 82.7949 2.8E3 83.0488 6.7E4 83.0850 1.1E6 85.0279 1.0E5 85.0643 1.2E5 85.1008 1.1E5 87.5771 2.4E3 89.6362 2.6E3 90.0749 2.6E3 90.7958 2.3E3 91.0386 3.9E4 91.0538 3.5E5 93.0694 9.5E5 93.5416 2.2E3 95.0488 5.1E4 95.0750 2.6E3 95.0851 3.0E6 95.5680 2.8E3 96.9925 3.3E3 97.0280 5.2E4 97.0643 2.5E5 97.1007 8.6E5 97.4474 2.3E3 98.9511 2.8E3 99.0800 1.7E5 99.9900 2.5E3 101.0591 2.0E4 102.9032 2.1E3 102.9830 2.2E3 104.9241 2.7E3 105.0694 4.2E5 107.0775 5.3E3 107.0850 8.3E5 107.2744 2.3E3 107.4773 2.8E3 109.0643 2.5E4 109.1007 1.8E6 109.1377 2.3E3 110.1134 2.3E3 111.0800 2.0E5 111.1162 2.4E5 112.3270 2.9E3 113.0730 2.2E3 113.0956 1.0E5 115.0743 6.2E3 116.5430 2.2E3 116.7333 2.2E3 117.0694 5.2E4 118.7096 2.9E3 119.0767 9.2E3 119.0850 5.2E5 119.3248 5.7E3 121.0918 1.5E4 121.1006 1.1E6 121.7474 2.7E3 123.0802 6.9E4 123.1070 3.2E4 123.1163 1.0E6 124.7649 2.7E3 125.0955 1.4E5 125.1322 2.3E4 127.0381 3.4E3 127.0750 5.5E3 127.1115 3.2E4 130.3658 2.7E3 130.8887 2.7E3 131.0850 2.0E5 131.9193 2.2E3 132.6467 2.5E3 133.0905 2.5E4 133.1006 6.9E5 135.1056 7.9E3 135.1163 8.2E5 135.1285 5.1E3 137.0956 1.0E5 137.1222 8.8E3 137.1319 4.7E5 139.1113 1.2E5 141.1269 8.2E3 143.0847 6.8E3 143.1181 2.6E3 145.0490 3.2E3 145.1006 1.8E5 147.1057 2.9E3 147.1163 5.8E5 148.1604 2.5E3 149.0960 1.1E4 149.1199 2.2E4 149.1319 6.5E5 151.1111 8.9E4 151.1477 2.7E5 151.1894 2.4E3 151.6128 3.0E3 153.1268 1.0E5 153.2122 2.8E3 154.1496 2.3E3 154.7342 2.7E3 155.1423 2.8E3 157.1012 1.1E4 157.5455 2.4E3 159.1163 1.7E5 161.1183 4.7E3 161.1320 6.1E5 161.3319 3.1E3 163.1128 8.9E3 163.1326 3.5E3 163.1476 5.7E5 165.1272 7.1E4 165.1634 1.5E5 167.1429 5.7E4 171.1164 3.3E4 173.1322 1.8E5 173.5200 9.2E3 173.5301 4.7E5 173.5444 8.0E4 173.7505 2.9E3 173.9792 2.5E3 175.1479 4.6E5 177.1270 4.2E3 177.1635 2.3E5 179.1427 6.5E4 179.1790 6.8E4 181.1583 4.9E4 185.1320 3.6E4 187.1479 1.3E5 189.1634 2.2E5 191.1791 7.7E4 193.1586 4.7E4 195.1746 8.3E3 197.1334 2.8E3 199.1484 9.4E3 201.1635 6.0E4 201.5807 2.6E3 203.1793 8.5E4 205.1588 1.0E4 205.1950 3.4E4 207.1742 3.9E4 207.2104 3.3E3 207.6523 2.5E3 208.9484 3.1E3 213.1654 2.7E3 215.1790 3.7E4 215.6570 2.4E3 217.1950 4.6E4 219.1732 2.6E3 219.2107 2.7E4 221.1898 2.0E4 221.2255 7.1E3 223.1705 5.2E3 227.1636 4.1E3 229.1944 5.6E3 231.1730 2.6E3 231.2112 9.4E3 233.1904 5.4E3 233.2260 4.5E4 235.2415 3.0E3 235.4607 2.6E3 236.8218 2.6E3 243.2103 1.9E5 245.2260 5.1E5 246.4839 2.7E3 247.2408 4.4E4 249.1849 5.8E3 251.5373 2.5E3 257.2246 6.3E3 258.9561 2.9E3 259.2026 2.7E3 261.2208 3.1E5 261.2518 1.0E4 263.2038 1.8E4 263.2364 8.2E5 265.2528 1.0E4 271.2406 3.8E3 271.3033 3.2E3 273.2559 3.1E3 273.3317 2.6E3 275.2364 7.3E4 277.2171 5.3E3 277.2479 5.4E3 279.2305 9.2E3 281.8064 3.1E3 287.2387 2.9E3 289.2148 2.5E3 289.2529 5.5E4 291.2325 2.8E3 293.2479 1.1E4 294.2795 4.5E3 301.2527 1.1E4 303.2301 3.2E3 303.2680 4.0E4 305.2478 3.1E3 310.5408 6.1E3 315.1045 2.6E3 317.2474 2.1E4 317.2835 8.2E3 319.2632 6.7E4 321.2781 3.2E3 326.6966 2.8E3 331.2610 6.8E3 331.2996 6.3E3 335.2580 1.9E5 337.2265 1.1E4 337.2736 9.0E6 337.3210 3.0E3 337.3690 3.6E3 337.3970 3.5E3 339.2891 4.1E5 347.2961 3.4E3 349.2763 2.9E3 359.3315 7.9E3 365.2640 2.6E3 373.3458 1.4E4 387.3647 1.8E4 401.3772 5.5E3 405.3769 2.6E3 427.3549 2.8E3 441.3667 6.0E3 442.0201 5.6E3 446.5235 2.3E3 459.3871 2.6E3 475.8719 2.4E3 492.2736 2.2E3 507.4565 6.8E3 512.4795 3.0E3 525.4655 1.4E5 526.8559 5.2E3 543.4780 6.1E4 591.5057 2.5E3 596.9152 2.5E3 599.4077 2.1E3 599.5037 8.0E5 599.6013 3.2E3 617.5140 6.6E4 621.5573 4.6E3 629.6570 2.8E3 727.3373 5.3E3 743.4796 2.5E3 748.6930 2.2E3 785.3446 2.6E3 END IONS BEGIN IONS FEATURE_ID=892 PEPMASS=801.5494 SCANS=892 RTINSECONDS=1035.38 CHARGE=1+ MSLEVEL=2 MERGED_STATS=18 / 18 (0 removed due to low quality, 0 removed due to low cosine). 72.1090 2.4E3 72.7714 2.3E3 73.0278 8.2E4 74.7756 2.2E3 74.9230 2.4E3 75.4935 2.3E3 75.9560 2.5E3 79.0537 1.7E4 79.5410 2.4E3 80.6997 2.1E3 81.0331 2.9E4 81.0692 1.7E5 83.0850 5.2E4 83.5915 2.2E3 85.0277 2.0E5 85.7257 2.3E3 86.3228 2.3E3 87.0437 9.0E3 89.0571 9.2E3 89.0613 1.4E5 89.1001 2.2E3 90.6385 2.3E3 91.0382 1.7E5 91.0537 5.5E3 93.0694 2.6E4 93.8461 2.4E3 95.0848 1.7E5 97.0277 1.8E5 97.1005 3.4E4 97.3843 2.9E3 99.0434 3.3E4 99.0801 2.5E3 100.0667 2.3E3 101.0225 7.0E4 101.2420 2.1E3 101.3743 2.4E3 101.8093 2.5E3 103.0384 1.7E4 103.7509 2.5E3 105.0693 2.4E3 106.3043 2.4E3 107.0849 3.4E4 107.3263 5.3E3 107.8568 2.4E3 109.0278 2.5E4 109.1005 9.6E4 109.8892 2.2E3 110.1942 2.2E3 111.3114 2.3E3 113.5985 2.3E3 115.0382 1.1E4 115.4727 2.8E3 117.5908 3.0E3 119.0850 8.8E3 119.3898 2.4E3 121.1004 3.8E4 123.1161 5.7E4 125.0507 2.8E3 127.0382 1.2E5 127.5055 3.0E3 128.2069 2.3E3 129.0533 2.8E3 129.7838 2.6E3 130.9809 2.5E3 131.0056 2.6E3 131.8177 2.7E3 133.1005 2.6E4 135.1162 2.1E4 137.1317 2.1E4 139.9716 2.4E3 141.4321 2.7E3 145.0488 3.1E4 146.3627 2.6E3 147.1160 2.1E4 149.1321 6.8E3 149.6884 5.4E3 150.0607 2.4E3 150.6658 2.3E3 155.1720 2.4E3 159.2484 2.5E3 160.1483 2.5E3 161.1320 2.1E4 161.1944 2.5E3 161.4474 2.2E3 163.1475 1.3E4 167.7406 2.3E3 167.8130 2.3E3 168.2527 2.3E3 169.1961 2.6E3 169.2600 2.4E3 171.6676 2.6E3 173.4814 2.8E3 173.5019 5.0E3 173.5135 7.4E3 173.5214 8.0E4 173.5285 1.5E5 173.5377 3.3E5 173.5493 1.5E4 174.5828 2.5E3 174.9967 2.2E3 175.1481 1.5E4 183.0646 1.5E4 185.0413 1.3E5 189.1628 2.8E3 191.7140 2.5E3 193.1586 2.7E3 200.2559 2.7E3 201.0737 2.4E3 203.0522 7.4E4 206.2870 2.3E3 215.7881 2.6E3 218.8973 2.3E3 220.1750 3.0E3 221.3977 2.4E3 243.0830 1.9E5 245.2261 4.1E4 248.6310 2.7E3 248.8231 2.4E3 263.2361 1.1E5 267.5798 2.4E3 268.4493 2.5E3 269.2780 2.3E3 277.6866 3.1E3 280.4324 2.4E3 286.4600 3.0E3 291.0696 2.2E3 292.8412 2.8E3 303.2303 3.8E3 305.4133 2.5E3 306.1870 2.4E3 306.7350 2.7E3 308.9026 2.7E3 317.8103 2.5E3 337.2729 4.3E5 343.3186 2.5E3 346.9401 2.3E3 365.2676 1.6E4 377.7772 2.8E3 393.8593 2.6E3 399.0658 2.6E3 421.5227 2.8E3 442.5502 2.3E3 446.0921 2.5E3 451.7335 2.6E3 480.2709 2.6E3 493.9192 2.4E3 499.3267 4.4E4 512.9623 2.4E3 521.2370 7.8E3 521.3080 5.4E6 521.3955 4.7E3 528.5768 2.6E3 534.6191 2.9E3 542.6381 2.6E3 549.1141 2.5E3 557.7511 2.6E3 577.9202 2.5E3 607.1112 2.5E3 626.2878 2.9E3 639.4945 4.1E4 643.6057 2.8E3 651.2961 2.8E3 701.5363 2.5E3 732.0976 3.2E3 738.7349 2.8E3 763.4907 2.8E3 766.5982 2.8E3 776.0019 2.6E3 801.3745 2.5E4 801.5481 3.7E6 801.7220 3.4E4 808.9143 2.5E3 END IONS BEGIN IONS FEATURE_ID=893 PEPMASS=635.3225 SCANS=893 RTINSECONDS=1035.637 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 67.4781 2.5E3 70.5885 1.2E5 70.5925 2.8E5 78.3703 2.7E3 99.1407 1.4E4 100.9383 1.5E4 106.6228 2.4E3 109.0046 2.4E3 140.2811 8.4E3 140.3156 2.7E3 140.3261 3.1E3 148.6977 1.5E4 158.8238 2.2E4 158.8373 2.3E4 173.5244 2.1E5 173.5415 1.8E5 187.6907 1.4E4 209.2881 7.6E3 213.6689 1.7E4 261.3384 9.5E3 262.3392 1.7E4 333.8257 2.4E3 419.1833 1.6E4 431.1876 4.9E4 433.2380 1.2E5 434.2457 5.5E4 435.2552 2.7E4 445.1957 3.2E3 446.2089 6.2E4 447.2178 1.7E5 448.2612 3.5E3 451.9113 1.0E4 459.2179 2.4E5 460.2237 5.7E5 461.1592 2.2E4 461.2332 7.0E5 462.2392 9.5E4 473.2327 2.8E5 474.2397 5.2E4 475.2502 1.8E4 480.5093 1.6E4 487.2488 2.2E5 488.2564 3.4E4 489.2638 6.4E4 491.2426 3.4E3 501.2271 6.8E3 502.2255 2.0E4 505.2259 1.7E4 505.2373 2.4E4 506.2644 5.6E4 507.2721 4.7E3 515.2437 1.4E5 516.2508 2.0E4 517.2605 1.5E5 519.2408 7.0E4 520.2771 5.8E4 529.2161 2.6E3 532.2468 2.6E4 533.2561 5.5E5 534.2593 2.4E5 535.2746 2.2E5 546.2665 5.6E4 547.2691 3.6E3 548.2734 2.6E4 560.2477 2.5E4 561.2860 9.1E6 561.4899 3.5E4 562.2899 4.1E5 563.1966 1.3E4 563.3017 2.1E6 575.2652 4.0E4 579.2913 3.5E3 589.2805 5.3E5 591.2590 2.8E3 593.3142 3.1E3 605.2730 3.0E3 606.2823 9.7E4 607.2958 7.4E5 620.2991 7.9E4 635.3223 9.7E6 635.5631 8.1E3 END IONS BEGIN IONS FEATURE_ID=894 PEPMASS=567.4200 SCANS=894 RTINSECONDS=1037.152 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 4 (1 removed due to low quality, 0 removed due to low cosine). 65.0385 2.6E4 65.7480 3.1E3 67.0541 2.7E5 67.1603 3.4E3 68.0264 2.9E3 69.0334 9.2E4 69.0698 2.6E5 70.4077 5.9E3 71.0491 6.9E4 75.3013 3.5E3 77.0388 2.7E4 77.2161 3.2E3 79.0542 3.9E5 80.0045 3.1E3 81.0619 7.2E3 81.0698 1.1E6 81.0742 5.5E3 82.0986 3.6E3 82.1935 5.7E3 83.0491 1.4E5 83.0855 1.4E5 85.0648 3.4E4 86.4394 3.3E3 91.0542 4.2E5 91.0590 3.7E3 91.0607 6.6E3 93.0630 1.3E4 93.0698 1.3E6 95.0491 2.0E5 95.0785 5.7E3 95.0855 7.2E5 95.0927 7.7E3 97.0648 2.0E5 97.1013 2.2E4 99.0297 3.1E3 103.0544 3.5E4 105.0444 2.1E4 105.0698 1.9E6 105.0782 8.7E3 106.0784 8.2E3 106.2036 3.4E3 107.0491 1.4E4 107.0734 8.0E3 107.0855 1.2E6 107.0929 1.5E4 108.0407 3.1E3 109.0647 1.2E5 109.1011 9.3E5 110.4826 3.5E3 111.0803 2.8E5 115.0545 3.4E4 116.0622 7.6E3 117.0698 1.9E5 119.0495 3.2E3 119.0603 3.9E3 119.0651 4.3E3 119.0855 2.1E6 120.0929 1.8E4 121.0647 5.6E4 121.1011 1.9E6 121.1114 6.4E3 122.0727 1.5E4 123.0803 1.6E5 123.1167 2.6E5 125.0961 1.2E5 128.0620 4.5E4 129.0699 9.8E4 130.0776 4.7E4 131.0768 4.5E3 131.0855 6.4E5 131.0966 1.1E4 132.0930 3.5E4 133.0643 2.4E4 133.0771 8.8E3 133.0892 2.0E4 133.1011 1.8E6 134.1087 5.9E3 135.0803 1.1E5 135.1167 7.1E5 135.1269 2.7E3 137.0960 5.5E5 137.1057 4.2E3 137.1325 2.1E4 138.1044 5.1E3 139.1117 1.2E5 141.0700 3.3E4 142.0777 9.9E4 143.0855 5.6E5 144.0932 1.0E5 145.0874 1.2E4 145.1011 1.8E6 146.0730 3.4E3 146.1088 3.6E4 147.0804 1.3E5 147.1167 1.4E6 148.1234 3.5E3 149.0960 1.3E5 149.1325 9.3E4 151.1117 1.9E5 151.1480 4.4E3 153.0693 6.4E3 154.0770 3.8E3 155.0854 2.0E5 156.0802 5.3E3 156.0932 1.4E5 157.1011 1.1E6 157.1155 1.6E4 158.1088 9.8E4 159.0804 6.1E4 159.1168 8.8E5 160.0882 3.4E3 160.1246 2.8E4 161.0961 1.5E5 161.1325 2.4E5 161.1479 4.3E3 163.1119 8.2E4 163.1484 4.9E4 165.0696 7.4E3 165.0914 6.6E3 165.1279 1.4E4 167.0856 6.5E4 167.1059 5.7E3 168.0935 3.8E4 169.1013 5.1E5 170.1090 1.0E5 171.0819 1.1E4 171.1002 1.2E4 171.1169 6.5E5 172.1245 5.7E4 173.0962 8.1E4 173.1326 6.2E5 173.1498 9.8E3 173.5298 1.1E5 173.5439 2.2E4 174.1392 4.5E3 175.1118 4.8E4 175.1482 3.0E5 177.1271 2.9E4 177.1639 1.0E4 178.0792 3.9E3 179.0855 7.0E4 180.0936 3.8E4 181.1012 2.2E5 181.1195 9.2E3 182.1091 1.1E5 183.1169 4.7E5 184.1244 6.3E4 185.0970 2.2E4 185.1326 4.7E5 185.1516 1.1E4 186.1399 3.3E4 187.1117 3.7E4 187.1482 2.8E5 189.1272 5.3E4 189.1638 2.7E4 191.1431 7.1E4 192.0928 1.1E4 193.1013 1.3E5 193.1587 6.4E3 194.1090 1.2E5 195.0965 7.5E3 195.1168 4.1E5 196.1245 1.6E5 197.1325 6.2E5 197.1629 4.4E3 198.1402 5.7E4 199.1120 3.2E4 199.1481 3.5E5 200.1560 1.5E4 201.1276 3.3E4 201.1638 1.1E5 203.1431 5.3E4 205.1019 1.9E4 205.1589 1.2E4 206.1092 6.3E4 207.1169 2.1E5 208.1247 1.2E5 209.1099 7.1E3 209.1326 5.3E5 209.1504 2.3E3 210.1404 9.5E4 210.7117 3.4E3 211.1126 2.2E4 211.1483 4.5E5 211.1716 7.3E3 212.1556 3.5E4 213.1275 7.0E4 213.1637 9.9E4 215.1435 3.2E4 217.1588 2.4E4 219.1172 5.4E4 220.1245 6.1E4 221.1326 2.9E5 221.1547 1.8E4 222.1407 7.1E4 223.1110 5.2E3 223.1482 3.5E5 224.1554 4.1E4 225.1275 1.4E4 225.1639 1.3E5 225.4743 6.1E3 227.1432 3.0E4 227.1795 3.5E4 228.1501 3.8E3 229.1581 3.0E4 231.1166 2.6E4 232.1246 2.3E4 233.1324 1.0E5 234.1405 5.0E4 235.1482 2.0E5 236.1557 5.1E4 237.1259 1.6E4 237.1636 1.6E5 238.1711 2.6E4 239.1431 3.1E4 239.1793 8.8E4 241.1589 1.2E4 241.1947 3.9E4 243.1169 1.1E4 243.1734 8.1E3 245.1322 5.0E4 246.1401 5.2E4 247.1479 1.2E5 248.1302 3.8E3 248.1559 4.2E4 249.1634 1.4E5 250.1714 3.5E4 251.1500 1.7E4 251.1794 8.8E4 252.1875 1.0E4 253.1613 1.1E4 253.1948 5.3E4 255.1741 1.2E4 257.1319 1.3E4 258.1403 1.6E4 259.1480 6.9E4 260.1554 4.2E4 261.1636 1.2E5 262.1710 3.5E4 263.1503 7.7E3 263.1792 9.8E4 264.1865 2.9E4 265.1949 8.5E4 267.1745 3.7E3 267.2113 2.7E4 268.1815 4.2E3 269.1893 7.6E3 271.1488 1.5E4 272.1554 1.6E4 273.1640 4.9E4 274.1711 2.8E4 275.1799 8.2E4 276.1863 2.2E4 277.1608 5.6E3 277.1953 9.7E4 279.1751 7.2E3 279.2096 2.4E4 281.1895 5.1E3 283.2057 1.2E4 285.1644 2.3E4 286.1688 4.1E3 287.1791 4.9E4 288.1880 7.0E3 289.1952 5.9E4 290.2044 4.9E3 291.1767 5.2E3 291.2110 4.9E4 292.1819 3.7E3 293.1909 4.6E3 295.2069 1.4E4 299.1804 1.1E4 301.1965 3.0E4 302.2020 5.5E3 303.2104 1.5E4 305.2261 1.3E4 313.1950 2.3E4 315.2110 3.9E4 317.2259 3.5E4 319.2045 4.4E3 319.2415 2.3E4 320.2522 4.2E3 325.1955 4.4E3 327.2111 5.7E3 329.2280 4.9E3 330.2335 1.4E4 331.2398 2.2E4 333.2219 1.2E4 335.2375 3.5E3 341.2256 2.2E4 343.2423 2.7E4 348.2430 2.2E4 350.2577 4.0E3 355.2434 5.0E3 357.2570 4.4E3 361.2526 8.5E3 369.2543 3.8E3 411.3073 7.1E3 452.6557 6.2E3 464.9594 4.2E3 495.7991 5.6E3 END IONS BEGIN IONS FEATURE_ID=895 PEPMASS=566.4119 SCANS=895 RTINSECONDS=1037.221 CHARGE=1+ MSLEVEL=2 MERGED_STATS=3 / 3 (0 removed due to low quality, 0 removed due to low cosine). 64.9202 2.5E3 69.0698 2.8E3 76.7149 2.5E3 78.2498 2.4E3 79.0540 7.4E3 81.0695 2.2E4 83.0852 2.5E3 84.9773 2.4E3 91.0542 7.2E3 91.4796 2.4E3 92.2965 3.0E3 93.0695 2.7E4 95.0490 1.0E4 95.0852 2.5E4 96.4002 2.7E3 97.0644 1.9E4 97.9607 2.4E3 100.2876 2.1E3 103.6328 2.5E3 105.0695 3.5E4 107.0852 3.5E4 109.0643 2.5E3 109.1007 2.2E4 112.8670 2.5E3 113.0958 9.6E3 119.0852 5.3E4 120.0932 2.7E3 121.1009 3.1E4 123.0802 1.8E4 123.1167 2.9E3 131.0852 2.4E4 133.1008 4.1E4 135.1165 1.4E4 137.0957 5.0E3 139.1118 8.7E3 143.0851 2.8E4 144.0930 4.6E3 145.1008 7.4E4 146.1086 2.6E3 147.0806 3.8E3 147.1164 2.2E4 149.6839 4.9E3 149.6943 5.4E3 155.0850 8.3E3 155.5004 2.6E3 156.0932 3.3E3 157.1008 4.5E4 158.1081 9.0E3 159.1167 3.5E4 160.0890 4.4E3 161.0958 9.6E3 163.1114 3.2E3 169.1009 2.4E4 169.1180 2.5E3 170.1092 4.5E3 171.1167 2.6E4 173.1321 2.1E4 173.5274 4.5E4 173.5432 1.2E4 175.1480 8.3E3 179.1428 9.5E3 181.1013 1.6E4 181.1217 6.3E3 183.1163 2.5E4 185.0961 2.6E3 185.1324 1.5E4 186.9882 2.4E3 187.1481 8.4E3 195.1168 2.4E4 196.1248 5.2E3 197.1325 2.8E4 199.1123 3.5E3 199.1482 1.4E4 203.1435 2.6E3 205.1598 2.6E3 205.5273 2.8E3 207.1167 1.5E4 209.1323 3.0E4 210.1399 3.9E3 211.1133 3.2E3 211.1480 1.7E4 219.1159 3.1E3 221.1325 1.2E4 221.1536 1.2E4 223.1478 1.2E4 225.1284 3.6E3 225.1638 6.5E3 227.1432 3.0E3 233.1325 3.0E3 235.1472 1.4E4 237.1630 7.7E3 241.1583 3.3E3 247.1478 5.1E3 251.1805 4.1E3 263.1795 4.0E3 275.1784 3.8E3 282.2795 1.6E4 283.2828 1.7E4 285.1852 2.7E3 289.1979 2.7E3 299.2031 3.9E3 310.3100 1.7E4 311.3147 2.1E4 341.9279 3.0E3 504.7094 2.4E3 552.4758 2.4E3 END IONS BEGIN IONS FEATURE_ID=896 PEPMASS=584.4214 SCANS=896 RTINSECONDS=1037.221 CHARGE=1+ MSLEVEL=2 MERGED_STATS=6 / 6 (0 removed due to low quality, 0 removed due to low cosine). 65.0776 2.2E3 65.7599 2.0E3 67.0539 5.3E4 68.9518 2.6E3 69.0331 1.5E4 69.0696 5.7E4 70.5442 2.1E3 70.8409 2.2E3 71.0489 1.8E4 73.0281 2.5E3 77.0386 2.8E3 78.1465 2.3E3 79.0539 8.2E4 79.8558 2.3E3 80.0619 2.6E4 81.0695 2.2E5 81.6004 2.3E3 82.0728 5.2E3 83.0488 4.1E4 83.0852 4.9E4 84.0888 3.0E3 85.0645 1.0E4 87.0437 1.0E4 89.0593 1.5E5 90.8272 2.3E3 91.0540 7.4E4 91.8434 2.5E3 93.0638 3.7E3 93.0695 2.7E5 93.4001 2.4E3 93.5428 2.5E3 94.0726 6.8E3 95.0489 7.9E4 95.0852 1.7E5 96.0886 3.1E3 97.0644 9.7E4 98.0681 3.5E3 100.5944 2.5E3 105.0617 3.1E3 105.0695 3.2E5 106.0728 1.3E4 107.0852 2.6E5 108.0889 1.1E4 109.0645 3.8E4 109.1009 1.9E5 110.1045 4.7E3 111.0801 3.1E4 111.1166 3.1E3 113.0958 4.3E4 114.0591 2.3E3 117.0236 2.6E3 117.0697 4.1E4 119.0761 7.4E3 119.0852 4.4E5 119.0955 2.6E3 120.0901 2.0E4 120.0924 2.5E3 120.7373 2.5E3 121.0646 2.4E4 121.0913 3.0E3 121.1008 3.2E5 122.1043 2.1E4 122.4192 2.4E3 123.0801 1.6E5 123.1165 3.9E4 124.4682 2.3E3 125.0958 3.7E4 127.0657 2.7E3 128.0619 1.0E4 129.0696 3.0E4 130.0774 7.8E3 131.0852 2.0E5 131.0964 3.3E3 132.0926 4.1E4 133.0651 2.8E3 133.0857 7.6E4 133.1009 3.2E5 134.1071 1.8E4 135.0803 4.3E4 135.1166 1.0E5 137.0957 7.4E4 138.1031 2.0E4 139.1115 8.6E4 140.1146 8.9E3 141.0696 6.0E3 142.0775 1.6E4 143.0853 1.9E5 144.0928 5.6E4 145.0648 1.6E4 145.0890 3.7E3 145.1009 5.2E5 145.1144 5.6E3 146.1066 4.6E4 147.0801 4.1E4 147.1165 2.1E5 148.1199 3.1E4 149.0957 4.3E4 149.1322 1.8E4 149.6775 3.2E3 149.6883 6.4E3 150.1042 2.6E3 151.0750 7.6E3 151.1114 2.0E4 153.1275 6.1E3 154.1315 3.1E3 155.0851 4.3E4 155.1064 3.0E4 156.0928 3.6E4 156.2641 2.7E3 157.0865 2.7E3 157.1009 3.3E5 158.1079 7.6E4 159.0803 3.5E4 159.1166 2.6E5 160.0739 3.8E3 160.0880 2.3E5 160.1213 1.3E4 161.0961 5.5E4 161.1322 5.7E4 163.1113 3.8E4 165.0910 5.5E4 165.1275 4.1E3 166.0937 2.6E3 167.0888 4.4E3 167.1064 1.4E5 168.0920 2.7E3 169.1011 1.3E5 170.1081 4.0E4 171.1167 2.3E5 172.1228 2.7E4 173.0960 1.8E4 173.1324 1.5E5 173.5232 1.4E4 173.5358 1.0E5 174.1368 1.5E4 175.1117 3.3E4 175.1481 6.4E4 177.1120 3.7E3 177.1278 1.0E4 179.1426 9.8E3 181.1010 5.2E4 181.1220 5.3E4 181.9293 3.1E3 182.1084 2.3E4 182.1261 7.7E3 183.1167 1.5E5 184.1236 3.1E4 185.0955 1.2E4 185.1324 1.6E5 186.1391 2.7E4 187.1114 1.9E4 187.1480 7.0E4 188.1179 3.1E3 189.1278 2.7E4 189.1633 3.0E3 190.1338 7.4E3 191.1428 3.9E4 193.1011 2.2E4 193.1224 4.9E3 194.1083 1.7E4 195.1167 1.2E5 195.1367 9.9E3 196.1237 4.0E4 197.1323 2.1E5 198.1387 3.3E4 199.1121 1.1E4 199.1480 1.0E5 200.1535 1.2E4 201.1276 2.3E4 201.1638 2.6E4 203.1432 5.6E4 205.1593 1.2E4 206.1098 3.4E3 207.1167 5.2E4 207.1382 1.1E4 208.1238 2.7E4 208.1445 7.3E3 209.1324 1.5E5 209.1513 3.4E3 210.1391 4.3E4 211.1483 1.3E5 212.1531 2.1E4 213.1278 2.5E4 213.1638 4.2E4 215.1428 1.8E4 217.1592 7.1E3 219.1165 9.3E3 219.1376 3.1E3 221.1322 5.5E4 221.1541 7.5E4 222.1373 1.2E4 222.1590 4.3E3 223.1481 9.8E4 224.1549 1.9E4 225.1274 1.0E4 225.1637 6.0E4 226.1707 3.0E3 227.1432 1.4E4 227.1798 6.8E3 228.1510 2.7E3 229.1581 8.1E3 233.1319 1.8E4 233.1559 8.2E3 234.1393 5.4E3 235.1482 5.6E4 236.1532 7.8E3 236.2048 2.6E3 237.1638 5.6E4 238.1676 3.7E3 239.1424 6.9E3 239.1793 2.4E4 241.1589 3.1E3 241.1944 7.5E3 246.1615 2.0E4 247.1468 1.8E4 247.1707 1.2E4 249.1639 4.0E4 250.1696 6.6E3 251.1789 2.5E4 252.1509 2.6E3 252.1872 2.9E3 253.1601 2.6E3 253.1945 1.4E4 255.1731 5.7E3 255.8519 3.0E3 259.1703 9.8E3 260.1534 5.0E3 261.0308 2.6E3 261.1629 2.5E4 262.1684 3.7E3 263.1787 2.6E4 264.1855 2.7E3 265.1956 2.1E4 266.2025 6.6E3 267.1742 6.3E3 269.1905 1.1E4 271.1704 8.7E3 272.1760 2.7E3 273.1629 3.2E3 274.1933 3.4E3 275.1800 1.4E4 277.1950 1.1E4 278.3087 2.9E3 279.1760 4.4E3 279.2105 4.7E3 281.1900 6.7E3 283.2052 2.6E3 285.1852 1.8E4 286.1928 2.1E4 287.2022 1.6E4 289.1958 9.4E3 291.2108 3.8E3 296.8914 2.7E3 297.1862 3.5E3 299.2010 2.5E4 300.2073 5.3E3 303.2108 5.9E3 311.2014 7.4E3 312.2063 3.7E3 325.2136 6.4E3 337.2172 6.1E3 352.2396 2.0E4 353.2483 6.7E3 354.2545 2.5E3 365.2475 2.9E4 366.2583 3.0E3 469.1390 2.8E3 492.3564 7.4E3 509.9944 2.6E3 521.1894 3.0E3 528.0188 2.5E3 536.2395 2.6E3 549.8351 3.0E3 END IONS BEGIN IONS FEATURE_ID=897 PEPMASS=613.4233 SCANS=897 RTINSECONDS=1037.221 CHARGE=1+ MSLEVEL=2 MERGED_STATS=1 / 1 (0 removed due to low quality, 0 removed due to low cosine). 67.0542 4.6E3 69.0696 6.4E3 79.0539 8.9E3 80.0615 2.3E3 81.0696 1.7E4 83.0853 3.1E3 88.3874 2.2E3 91.0541 5.3E3 93.0696 2.2E4 95.0489 4.9E3 95.0851 1.4E4 97.0645 3.5E3 105.0695 3.0E4 107.0852 2.6E4 109.0646 4.3E3 109.1008 1.8E4 112.8976 2.2E3 119.0851 4.3E4 121.1009 3.2E4 123.0803 7.1E3 123.1164 4.5E3 124.0839 3.2E3 125.0961 5.1E3 129.0695 2.5E3 131.0853 1.7E4 132.0923 3.2E3 133.1009 3.3E4 134.1037 4.7E3 135.1165 9.1E3 137.0957 4.9E3 138.1032 2.7E3 142.0778 4.2E3 143.0851 1.4E4 145.1008 4.3E4 146.1046 4.0E3 147.1165 2.1E4 149.0955 3.5E3 149.1315 3.1E3 151.1112 3.7E3 155.0845 3.2E3 157.1009 2.7E4 158.1058 5.2E3 159.1164 2.4E4 160.1216 3.1E3 161.0953 5.8E3 161.1320 3.3E3 169.1011 9.8E3 170.1069 3.6E3 171.1163 2.1E4 172.1210 6.1E3 173.1324 2.1E4 173.5244 1.7E4 173.5432 1.1E4 175.1110 3.0E3 175.1480 1.1E4 181.1015 4.3E3 182.1068 5.4E3 183.1164 1.1E4 184.1229 5.5E3 185.1321 1.0E4 187.1475 5.5E3 191.1427 3.4E3 193.1020 6.0E3 195.1170 1.1E4 196.1227 6.8E3 197.1322 1.6E4 198.1369 5.5E3 199.1476 1.4E4 207.1167 5.5E3 208.1220 3.2E3 209.1322 1.5E4 210.1386 6.6E3 211.1484 1.3E4 212.1518 5.1E3 217.1605 3.8E3 221.1324 7.3E3 222.1419 3.3E3 223.1478 6.7E3 224.1548 4.2E3 225.1635 4.8E3 233.1313 2.7E3 235.1484 6.3E3 237.1628 7.3E3 238.1677 2.9E3 247.1479 4.9E3 249.1634 3.3E3 251.1797 5.0E3 261.1625 3.7E3 263.1787 2.7E3 264.1851 2.7E3 295.2061 2.9E3 388.3653 2.3E3 549.9994 2.4E3 END IONS BEGIN IONS FEATURE_ID=898 PEPMASS=612.4174 SCANS=898 RTINSECONDS=1037.66 CHARGE=1+ MSLEVEL=2 MERGED_STATS=4 / 4 (0 removed due to low quality, 0 removed due to low cosine). 65.8040 2.4E3 66.3626 2.8E3 66.5446 2.3E3 67.0540 5.0E3 71.8813 2.4E3 78.9624 2.6E3 79.0542 9.4E3 81.0695 3.9E4 82.0768 2.5E3 83.0488 8.4E3 83.0854 8.0E3 91.0539 1.7E4 93.0695 5.4E4 95.0489 2.6E4 95.0852 2.9E4 97.0642 7.2E3 97.1492 2.5E3 99.0437 1.7E4 100.5189 2.2E3 104.6006 2.5E3 105.0695 6.2E4 107.0851 6.3E4 109.0645 1.1E4 109.1009 2.9E4 117.0697 1.1E4 117.4156 2.6E3 119.0851 1.0E5 119.2731 2.4E3 120.0929 7.2E3 121.0645 2.8E3 121.1008 5.7E4 123.0800 5.1E4 125.0955 2.6E4 129.0695 3.6E3 130.0780 2.4E3 131.0853 4.7E4 132.0929 3.1E4 133.1008 9.2E4 134.2142 2.3E3 135.0800 9.2E3 135.1166 2.1E4 137.0955 1.8E4 138.1035 1.3E4 143.0852 4.9E4 144.0930 2.0E4 145.1008 1.5E5 146.1090 1.1E4 147.0801 6.8E3 147.1164 4.9E4 149.0956 1.8E4 155.0853 1.5E4 156.0927 9.4E3 157.1009 9.6E4 158.1083 2.5E4 159.1165 7.0E4 160.1242 3.1E3 161.0957 1.4E4 161.1322 3.3E3 163.1118 3.5E3 167.0847 3.2E3 169.1010 4.5E4 170.1088 9.5E3 170.2861 2.3E3 171.1166 7.1E4 172.1242 7.5E3 173.0961 1.1E4 173.1323 4.5E4 173.5288 4.7E4 173.5399 3.8E4 174.5016 2.8E3 175.1112 2.9E3 175.1492 4.9E3 176.1201 2.5E3 177.1278 2.7E3 181.1011 2.0E4 182.1091 2.8E3 183.1166 5.0E4 184.1238 1.2E4 185.1321 5.2E4 186.1412 2.6E3 187.1475 6.2E3 189.1273 1.1E4 191.1426 2.4E4 193.1001 4.3E3 195.1166 4.5E4 196.1247 1.4E4 197.1324 6.5E4 198.1402 8.4E3 198.1652 2.4E3 199.1129 6.7E3 199.1481 4.3E4 199.3868 2.8E3 199.4339 2.8E3 203.1425 3.2E3 207.1165 2.1E4 208.1257 7.1E3 209.1324 6.8E4 210.1400 9.5E3 211.1481 6.4E4 211.1691 3.4E3 213.1279 3.4E3 213.1636 4.0E3 215.1434 7.1E3 217.1576 2.9E3 220.1243 2.5E3 221.1327 1.8E4 223.1480 3.6E4 224.1562 6.4E3 225.1640 1.1E4 233.1313 3.4E3 233.1546 7.0E3 235.1481 1.7E4 236.1536 2.7E3 237.1637 4.6E4 239.1445 3.1E3 239.1771 3.0E3 247.1481 8.2E3 249.1638 1.2E4 250.1703 3.3E3 251.1780 7.5E3 252.1869 9.4E3 253.1963 3.6E3 261.1628 9.4E3 263.1778 9.5E3 265.1960 2.8E3 275.1776 3.4E3 276.1871 3.7E3 277.1943 3.9E3 298.1923 2.1E4 302.1332 2.4E3 303.2107 3.1E3 326.1895 2.8E3 329.2253 2.7E3 390.2565 1.2E4 436.2928 2.7E3 442.9029 2.6E3 474.3080 3.0E3 488.3394 2.8E3 508.0648 2.6E3 528.3597 3.7E3 END IONS nf_output/PNNL-LIPIDS-POSITIVE.mgf.tsv0000644000000000000000000000000114664572141016077 0ustar rootroot nf_output/RESPECT.mgf.tsv0000644000000000000000000000000114664572140014212 0ustar rootroot nf_output/metadata/0000755000000000000000000000000014664572137013376 5ustar rootrootnf_output/metadata/merged_metadata.tsv0000644000000000000000000000067214664572137017244 0ustar rootrootfilename ATTRIBUTE_Tissue ATTRIBUTE_Replicate 202312_20_P09-Leaf-r1_1uL.mzML Leaf Leaf-r1 202312_21_P09-Leaf-r2_1uL.mzML Leaf Leaf-r2 202312_22_P09-Leaf-r3_1uL.mzML Leaf Leaf-r3 202312_24_P09-Stem-r1_1uL.mzML Stem Stem-r1 202312_25_P09-Stem-r2_1uL.mzML Stem Stem-r2 202312_26_P09-Stem-r3_1uL.mzML Stem Stem-r3 202312_28_P09-Root-r1_1uL.mzML Root Root-r1 202312_29_P09-Root-r2_1uL.mzML Root Root-r2 202312_30_P09-Root-r3_1uL.mzML Root Root-r3 nf_output/DMIM-DRUG-METABOLITE-LIBRARY.mgf.tsv0000644000000000000000000000000114664572141017120 0ustar rootroot nf_output/GNPS-NIH-CLINICALCOLLECTION2.mgf.tsv0000644000000000000000000000000114664572140017102 0ustar rootroot nf_output/NEO-MSMS.mgf.tsv0000644000000000000000000000000114664572140014303 0ustar rootroot nf_output/PSU-MSMLS.mgf.tsv0000644000000000000000000000000114664572140014445 0ustar rootroot nf_output/CMMC-REFRAME-POSITIVE-LIBRARY.mgf.tsv0000644000000000000000000000000114664572140017245 0ustar rootroot nf_output/GNPS-SCIEX-LIBRARY.mgf.tsv0000644000000000000000000000000114664572140015627 0ustar rootroot nf_output/GNPS-IOBA-NHC.mgf.tsv0000644000000000000000000000000114664572140014772 0ustar rootroot nf_output/LDB_POSITIVE.mgf.tsv0000644000000000000000000000000114664572140015030 0ustar rootroot nf_output/XANTHONES-DB.mgf.tsv0000644000000000000000000000000114664572140014737 0ustar rootroot nf_output/GNPS-NIST14-MATCHES.mgf.tsv0000644000000000000000000000000114664572140015656 0ustar rootroot nf_output/GNPS-COLLECTIONS-MISC.mgf.tsv0000644000000000000000000000000114664572140016161 0ustar rootroot nf_output/GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_NEGATIVE.mgf.tsv0000644000000000000000000000000114664572140022120 0ustar rootroot nf_output/HCE-CELL-LYSATE-LIPIDS.mgf.tsv0000644000000000000000000000000114664572140016202 0ustar rootroot nf_output/DEREPLICATOR_IDENTIFIED_LIBRARY.mgf.tsv0000644000000000000000000000000114664572140017632 0ustar rootroot nf_output/GNPS-SELLECKCHEM-FDA-PART2.mgf.tsv0000644000000000000000000000000114664572140016607 0ustar rootroot nf_output/GNPS-N-ACYL-LIPIDS-MASSQL.mgf.tsv0000644000000000000000000000000114664572140016555 0ustar rootroot nf_resume_cmd.sh0000644000000000000000000000121114664572124012724 0ustar rootrootnextflow run /app/workflows_user/feature_based_molecular_networking_workflow/nf_workflow.nf -params-file /data/nf_data/server/nf_tasks/43853471d153488b95144abd3af36a9d/job_parameters.yaml -w /data/nf_data/server/nf_work/43853471d153488b95144abd3af36a9d -with-report /data/nf_data/server/nf_tasks/43853471d153488b95144abd3af36a9d/job_report.html -with-timeline /data/nf_data/server/nf_tasks/43853471d153488b95144abd3af36a9d/job_timeline.html -with-dag /data/nf_data/server/nf_tasks/43853471d153488b95144abd3af36a9d/job_dag.html -resume -with-weblog http://localhost:4000/nf_weblog/43853471d153488b95144abd3af36a9d -c /app/launchserver/nextflow.configsubmission_parameters.yaml0000644000000000000000000000155314664572124015075 0ustar rootrootcreate_time: 2024-08-31 03:45:05 PDT-0700 description: 20240831_PiperFIM_FBMN featurefindingtool: MZMINE fragment_tolerance: '0.01' input_libraries: LIBRARYLOCATION/LC/LIBRARY input_raw_spectra: '' input_supplemental_edges: '' inputfeatures: USERUPLOAD/Tito_Damiani/PiperFIM/fbmn_quant.csv inputspectra: USERUPLOAD/Tito_Damiani/PiperFIM/fbmn.mgf library_analog_search: '1' library_min_cosine: '0.7' library_min_matched_peaks: '6' library_topk: '1' metadata_filename: USERUPLOAD/Tito_Damiani/PiperFIM/fbmn_metadata.tsv min_peak_intensity: '0.0' networking_max_shift: '1999' networking_min_cosine: '0.7' networking_min_matched_peaks: '6' normalization: None pm_tolerance: '0.01' precursor_filter: 'yes' task: 43853471d153488b95144abd3af36a9d window_filter: 'yes' workflow_version: SERVER:2024.08.28;WORKFLOW:2024.08.07 workflowname: feature_based_molecular_networking_workflow workflowdisplay.yaml0000644000000000000000000002603014664572124013714 0ustar rootrootname: feature_based_molecular_networking_workflow displayname: STUFF Views: - name: Cluster Summary displayname: Cluster Summary viewname: clustersummary displaytype: datatable parameters: filename: nf_output/networking/clustersummary_with_network.tsv columns: - title: "View" data: - title: "Cluster" data: "cluster index" - title: "Parent mass" data: "parent mass" - title: "Compound_Name" data: "Compound_Name" columnDefs: '[ {"targets": 0,"data": null,"render": function ( data, type, row, meta ) { return ` View Spectrum
View Box Plot `;}}]' - name: Library Results displayname: Library Results viewname: librarymatches displaytype: datatable parameters: filename: nf_output/library/merged_results_with_gnps.tsv columns: - title: "View" data: - title: "#Scan#" data: "#Scan#" - title: "Compound_Name" data: "Compound_Name" - title: "Ion" data: Ion_Source - title: "Adduct" data: Adduct - title: "Library" data: Organism - title: "Precursor m/z" data: SpecMZ - title: "Cosine" data: MQScore - title: "Shared Peaks" data: SharedPeaks - title: "MassDiff" data: MassDiff - title: "SpectrumID" data: SpectrumID - title: "Smiles" data: Smiles columnDefs: '[ {"targets": 0,"data": null,"render": function ( data, type, row, meta ) { return ` View Mirror `;}}, {"targets": 11,"data": null,"render": function ( data, type, row, meta ) { return ` `;}},]' - name: Files Summary displayname: Files Summary viewname: filesummary displaytype: datatable parameters: filename: nf_output/filesummary/summaryresult.tsv columns: - title: "Visualize" data: - title: "Filename" data: "Filename" - title: "Vendor" data: "Vendor" - title: "Model" data: "Model" - title: "MS1s" data: "MS1s" - title: "MS2s" data: "MS2s" columnDefs: '[ {"targets": 0,"data": null,"render": function ( data, type, row, meta ) { return ` View LCMS Run `;}}]' - name: Network Pairs List displayname: Pairs List viewname: pairslist displaytype: datatable_serverbig parameters: filename: nf_output/networking/filtered_pairs.tsv columns: - title: "View" data: - title: "CLUSTERID1" data: CLUSTERID1 - title: "CLUSTERID2" data: CLUSTERID2 - title: "DeltaMZ" data: DeltaMZ - title: "DeltaMZ" data: DeltaMZ - title: "Cosine" data: Cosine - title: "MatchedPeaks" data: MatchedPeaks columnDefs: '[ {"targets": 0,"data": null,"render": function ( data, type, row, meta ) { return ` View Mirror `;}}]' - name: Network Unfiltered Pairs List displayname: Pairs Unfiltered List viewname: unfilteredpairslist displaytype: datatable_serverbig parameters: filename: nf_output/networking/merged_pairs.tsv columns: - title: "View" data: - title: "CLUSTERID1" data: CLUSTERID1 - title: "CLUSTERID2" data: CLUSTERID2 - title: "DeltaMZ" data: DeltaMZ - title: "DeltaMZ" data: DeltaMZ - title: "Cosine" data: Cosine - title: "MatchedPeaks" data: MatchedPeaks columnDefs: '[ {"targets": 0,"data": null,"render": function ( data, type, row, meta ) { return ` View Mirror `;}}]' - name: section displayname: Network Visualizations viewname: section displaytype: section - name: Visualize Network in Browser displayname: Visualize Full Network in Browser viewname: visualizefullnetwork displaytype: linkout parameters: baseurl: /dashboards/networkviewer urlparam: - usi:mzdata:GNPS2:TASK-[task]-nf_output/networking/network.graphml - usi-mgf:mzdata:GNPS2:TASK-[task]-nf_output/clustering/spectra_reformatted.mgf - name: Visualize Network w/ Singletons in Browser displayname: Visualize Full Network w/ Singletons in Browser viewname: visualizefullsingletonnetwork displaytype: linkout parameters: baseurl: /dashboards/networkviewer urlparam: - usi:mzdata:GNPS2:TASK-[task]-nf_output/networking/network_singletons.graphml - usi-mgf:mzdata:GNPS2:TASK-[task]-nf_output/clustering/spectra_reformatted.mgf - name: Export Network in Cytoscape displayname: Export Network in Cytoscape viewname: visualizecytoscape displaytype: linkout parameters: baseurl: https://cytoscape.gnps2.org/process urlparam: - task:[task] - name: Export Network in Cytoscape with Singletons displayname: Export Network in Cytoscape with Singletons viewname: visualizecytoscapesingleton displaytype: linkout parameters: baseurl: https://cytoscape.gnps2.org/process urlparam: - task:[task] - override_path:nf_output/networking/network_singletons.graphml - name: section displayname: Download Network Files viewname: section displaytype: section - name: Download Network GraphML displayname: Download Network GraphML viewname: graphml displaytype: download parameters: filename: nf_output/networking/network.graphml - name: Download Network with Singletons GraphML displayname: Download Network with Singletons GraphML viewname: graphmlsingletons displaytype: download parameters: filename: nf_output/networking/network_singletons.graphml - name: Download Consensus MS/MS MGF displayname: Download Consensus MS/MS MGF viewname: specms displaytype: download parameters: filename: nf_output/clustering/spectra_reformatted.mgf - name: Download Quantification File displayname: Download Quantification File viewname: quantificationdownload displaytype: download parameters: filename: nf_output/clustering/featuretable_reformated.csv - name: section displayname: Downstream Analysis viewname: section displaytype: section - name: Downstream Analysis - Run Chemwalker Analysis displayname: Downstream Analysis - Run Chemwalker Analysis viewname: downstreamchemwalker displaytype: linkout parameters: baseurl: /workflowinput urlparam: - workflowname:chemwalker_nextflow_workflow hashparam: - taskid:[task] - workflow:GNPS2 - description:Downstream from [task] Feature Based Molecular Networking - name: Downstream Analysis - Hitchhiker Statistics Guide displayname: Downstream Analysis - Hitchhiker Statistics Guide viewname: downstreamhitchhiker displaytype: linkout parameters: baseurl: https://fbmn-statsguide.gnps2.org/Data_Preparation - name: Downstream Analysis - Run Transitive Alignments displayname: Downstream Analysis - Run Transitive Alignments viewname: downstreamtransitive displaytype: linkout parameters: baseurl: /workflowinput urlparam: - workflowname:Transitive_alignment_workflow hashparam: - input_graphml:TASKLOCATION/[task]/nf_output/networking/network_singletons.graphml - input_pairs:TASKLOCATION/[task]/nf_output/networking/merged_pairs.tsv - input_spectra:TASKLOCATION/[task]/nf_output/clustering/spectra_reformatted.mgf - description:Downstream from [task] Feature Based Molecular Networking - name: Downstream Analysis - Overlay Custom Network displayname: Downstream Analysis - Overlay Custom Network viewname: downstreamoverlay displaytype: linkout parameters: baseurl: /workflowinput urlparam: - workflowname:gnps2_network_overlay_workflow hashparam: - input_graphml:TASKLOCATION/[task]/nf_output/networking/network_singletons.graphml - input_mgf:TASKLOCATION/[task]/nf_output/clustering/spectra_reformatted.mgf - description:Downstream from [task] Feature Based Molecular Networking # CMMC Linkouts - name: Downstream Analysis - CMMC Enrichment Analysis displayname: Downstream Analysis - CMMC Enrichment Analysis viewname: downstreamcmmc displaytype: linkout parameters: baseurl: /workflowinput urlparam: - workflowname:cmmc_gnps_network_enrichment_workflow hashparam: - gnps2_graphml:TASKLOCATION/[task]/nf_output/networking/network_singletons.graphml - gnps2_mgf:TASKLOCATION/[task]/nf_output/clustering/spectra_reformatted.mgf - datasource:GNPS2 - description:Downstream from [task] Feature Based Molecular Networking