Mercurial > repos > galaxyp > metanovo
diff test-data/sample_data_2.mgf @ 4:7a5ff5359b13 draft
"planemo upload for repository https://github.com/galaxyproteomics/tools-galaxyp/tree/master/tools/metanovo commit c220dc85d59698a73b0f173d46e269e27264d6d8"
author | galaxyp |
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date | Fri, 22 Apr 2022 13:31:08 +0000 |
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--- /dev/null Thu Jan 01 00:00:00 1970 +0000 +++ b/test-data/sample_data_2.mgf Fri Apr 22 13:31:08 2022 +0000 @@ -0,0 +1,9936 @@ +# +# MS.PreferredSpectrumFormat = 0 +# MS.UncentroidingHalfWidth = 0.2 +# MS.UncentroidingPointsPerDa = 20 +# MS.AlwaysUncentroid = 1 +# MS.RegriddingPointsPerDa = 40 +# MS.AggregationMethod = 1 +# MS.MinPeakCount = 1 +# MS.MinPeakCharge = 1 +# MS.MaxPeakCharge = 4 +# MSMS.PreferredSpectrumFormat = 0 +# MSMS.UncentroidingHalfWidth = 0.2 +# MSMS.UncentroidingPointsPerDa = 20 +# MSMS.AlwaysUncentroid = 1 +# MSMS.RegriddingPointsPerDa = 40 +# MSMS.AggregationMethod = 2 +# MSMS.MinPeakCount = 10 +# MSMS.MinPeakCharge = 1 +# MSMS.MaxPeakCharge = 2 +# MSMS.UsePrecursorAsMaxCharge = 0 +# MSMS.PrecursorChargeSources = 1; 0 +# MSMS.PrecursorDefaultCharges = 2; 3; 4; 5 +# MSMS.RedeterminePrecursorMZ = 1 +# MSMS.PrecursorMZTolerance = 3 +# MSMS.IgnoreSingleChargedPrecursor = 0 +# TimeDomain.MinPrecursorMass = 700 +# TimeDomain.MaxPrecursorMass = 16000 +# TimeDomain.PrecursorGroupingTolerance = 0.3 +# TimeDomain.MaxIntermediateTime = 30 +# TimeDomain.MaxIntermediateScans = 1 +# TimeDomain.UseIntermediateScanCount = 1 +# TimeDomain.MinScansInGroup = 1 +# TimeDomain.CollapseMSn = 0 +# PeakSelection.FilteringThreshold = 0.7 +# PeakSelection.MinFilteringPeakMZ = 50 +# PeakSelection.MaxFilteringPeakMZ = 100000 +# PeakSelection.FilteringMinSNRatio = 2 +# PeakSelection.MinPeakWidth = 0.01 +# PeakSelection.ExpectedPeakWidth = 0.1 +# PeakSelection.MaxPeakWidth = 1 +# PeakSelection.MaxIterations = 500 +# PeakSelection.RejectWidthOutliers = 0 +# PeakSelection.BaselineCorrection = 0 +# PeakSelection.BaselineSubtractMethod = 0 +# PeakSelection.PeakFitMethod = 0 +# PeakSelection.IsotopeEnvelopeMode = 0 +# PeakSelection.IsotopePeakIntensities = +# PeakSelection.SinglePeakCharge = 1 +# PeakSelection.SinglePeakWindow = 0 +# PeakSelection.MinSglPeakWindowMZ = 112.5 +# PeakSelection.MaxSglPeakWindowMZ = 121.5 +# +BEGIN IONS +TITLE=1: Scan 68 (rt=10.7767, f=2, i=2) [F:\Distiller Data\Lab212\Nitrosylation\YiJu\100512_SNOCRC\YJC_100327SNOCRC_B11b372_N02.raw] +PEPMASS=505.57237 2535 +CHARGE=4+ +SCANS=68 +RTINSECONDS=646.6 +126.68747 0.0095610886 +147.07 0.031638011 +149.05163 0.056459291 +150.05645 0.019850346 +156.14706 0.010908528 +187.21247 0.011306827 +221.09147 0.070367436 +223.09152 0.027119914 +227.20898 0.018819948 +241.01204 0.016283331 +258.26071 0.022885642 +281.05783 0.50117416 +282.06195 0.28568775 +283.05827 0.18865751 +307.20522 0.0078820481 +307.97957 0.0087505494 +312.15435 0.0087667276 +315.33012 0.017828172 +318.07859 0.0087557308 +320.90563 0.0092218301 +327.60525 0.0090809066 +328.97869 0.033006492 +329.75461 0.008363671 +330.96287 0.015192568 +341.0305 0.027068039 +343.04191 0.041163204 +345.15502 0.0094837177 +347.09883 0.016383096 +348.95513 0.0090857161 +371.17976 0.0098787316 +376.96514 0.017792904 +383.13001 0.010277052 +385.9094 0.0087485971 +403.86525 0.018276962 +410.3541 0.010160575 +415.05061 0.097539253 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0.013404254 +750.35492 0.014285055 +756.57992 0.012560136 +760.40716 0.014469825 +768.77259 0.013593169 +775.65624 0.014633176 +779.39048 0.014000299 +784.37221 0.013740464 +786.20609 0.015464232 +799.5808 0.014054061 +841.80932 0.013864713 +860.50496 0.013270504 +870.83783 0.014837517 +883.80459 0.015949992 +887.41668 0.01500486 +890.33129 0.015772653 +905.15528 0.01639609 +911.85617 0.016835365 +957.90868 0.014858982 +967.58701 0.015536026 +988.63058 0.017496167 +990.83085 0.017678473 +999.33108 0.017365573 +1042.4333 0.016268626 +1079.7057 0.015954051 +1096.4833 0.015612357 +1103.6309 0.017753052 +1110.7813 0.017870092 +1143.4458 0.016820154 +1170.7698 0.017046585 +1182.7931 0.017119994 +1330.0315 0.019812864 +1348.6559 0.020854996 +1356.3329 0.018077837 +END IONS + +BEGIN IONS +TITLE=2: Scan 550 (rt=15.8785, f=2, i=3) [F:\Distiller Data\Lab212\Nitrosylation\YiJu\100512_SNOCRC\YJC_100327SNOCRC_B11b372_N02.raw] +PEPMASS=435.08133 16344 +CHARGE=2+,3+,4+,5+ +SCANS=550 +RTINSECONDS=952.71297 +101.07857 0.15441606 +102.05869 0.069699582 +110.07449 1.1823047 +112.08598 0.11509592 +113.08531 0.053629044 +114.08577 0.047626391 +115.09198 0.1290629 +129.10401 2.0963612 +130.05624 0.37226225 +130.09475 0.07100309 +131.08434 0.17467889 +136.07722 0.071258815 +138.08072 0.053688314 +139.07662 0.060675433 +141.10792 0.095048221 +143.11601 0.41805217 +144.1033 0.033141912 +145.08356 0.072474864 +147.08008 0.63439034 +149.04957 0.51700955 +153.10557 0.037129293 +154.0938 0.046203953 +156.08444 0.10139689 +156.14977 0.28013145 +158.09684 0.050073804 +159.07926 0.050185022 +167.09317 0.19689646 +170.16911 0.098591203 +171.11915 0.059344307 +173.09896 0.088866038 +175.1201 0.16350402 +186.11956 0.10444659 +191.10923 0.067626202 +193.14339 0.10119479 +195.09575 0.1244526 +197.12648 0.18420854 +200.14204 0.089940681 +201.13279 0.053276061 +201.20593 0.13571124 +207.08148 0.18891239 +209.10117 0.16388738 +211.13039 0.2644754 +213.20558 0.14540092 +222.1549 0.075089097 +223.08078 0.10225841 +225.10634 0.19383656 +226.14118 0.21946312 +230.14638 0.097737533 +231.12773 0.69507295 +235.12527 0.090408315 +238.15126 0.08087105 +240.15225 0.14984816 +242.19521 0.22493781 +244.16448 0.093411692 +246.18344 0.10465106 +248.15632 0.16925056 +266.17163 0.43693159 +270.14511 0.15047542 +273.13647 0.050004667 +275.177 0.26468696 +278.13478 0.067087255 +297.19657 0.13204355 +303.21844 0.14721565 +309.1985 0.088156972 +319.19751 0.18898953 +324.99755 0.2602001 +341.0259 5.4091447 +342.02003 0.64089907 +343.02418 0.50411988 +370.2403 0.17375539 +388.25415 0.27409383 +429.09751 0.47855612 +455.30851 0.29450857 +456.2804 0.39691833 +464.2952 0.39628358 +469.29922 0.76793084 +487.31502 0.6825301 +524.32696 0.32609047 +532.82846 0.53390137 +538.32862 0.36502821 +546.81729 0.39168063 +590.85952 0.53829235 +614.31938 0.28132073 +646.40021 0.55750968 +778.96144 0.1417028 +END IONS + +BEGIN IONS +TITLE=3: Scan 551 (rt=15.8991, f=3, i=1) [F:\Distiller Data\Lab212\Nitrosylation\YiJu\100512_SNOCRC\YJC_100327SNOCRC_B11b372_N02.raw] +PEPMASS=1143.4063 3420 +CHARGE=2+ +SCANS=551 +RTINSECONDS=953.94402 +104.10955 0.060748915 +109.03282 0.041405096 +110.07336 0.033846933 +113.08161 0.010069596 +115.04589 0.03197674 +116.95263 0.0091389333 +126.07227 0.029565385 +127.04393 0.3192826 +129.10866 0.019223307 +138.05405 0.10774316 +139.0773 0.038454153 +140.07254 0.061221992 +144.06616 0.027892554 +145.05172 0.76055187 +155.0848 0.010769153 +156.14905 0.02748665 +158.0849 0.027333918 +163.06391 0.58847569 +168.06702 0.058646423 +171.08078 0.012170304 +175.12076 0.027875557 +176.09644 0.38764218 +184.07982 0.3969379 +187.09928 0.044925964 +195.11243 0.012527691 +204.08958 0.031218675 +211.02771 0.0091775081 +211.07067 0.023746439 +222.10537 0.014202528 +226.08388 0.060399654 +229.07803 0.029129154 +241.80469 0.014062169 +243.10295 0.022934843 +252.09019 0.039338068 +255.05319 0.014828587 +256.10026 0.030346061 +259.10895 0.015111947 +271.09803 0.062655971 +277.16697 0.02165888 +282.08779 0.016170883 +289.0926 0.16276683 +291.50399 0.014716271 +305.13246 0.037684279 +307.09005 0.042062805 +310.12062 0.078080072 +321.07986 0.018479147 +323.13821 0.3177858 +325.1211 1.0395408 +333.12949 0.31995209 +341.15317 0.25845462 +359.16035 0.058600224 +388.15262 0.017821391 +414.15681 0.36307429 +436.10018 0.021075837 +451.14098 0.066342924 +477.20457 0.039966182 +495.17696 0.28695979 +500.18632 0.13788364 +503.20247 0.59218808 +521.23407 0.041448835 +536.75622 0.025713989 +543.26683 0.016815808 +557.77807 0.019237063 +576.21147 0.5074363 +629.23478 0.017802021 +648.22574 0.035479106 +653.2259 0.034381685 +657.24479 0.41736277 +665.27355 1.1377179 +683.28177 0.10416639 +775.88005 0.014483017 +827.31861 1.0901854 +989.37657 0.70864933 +1151.4345 0.49986515 +1439.4561 0.033331536 +1531.7522 0.03379542 +END IONS + +BEGIN IONS +TITLE=4: Scan 553 (rt=15.9611, f=2, i=4) [F:\Distiller Data\Lab212\Nitrosylation\YiJu\100512_SNOCRC\YJC_100327SNOCRC_B11b372_N02.raw] +PEPMASS=488.62481 60681 +CHARGE=3+ +SCANS=553 +RTINSECONDS=957.66397 +102.0495 0.65746601 +102.10007 2.5233211 +110.07461 0.67348252 +112.08992 0.65749171 +113.07657 0.16781604 +114.07471 0.18972855 +115.09141 0.93748367 +116.07677 0.17394442 +126.1073 0.27012196 +127.08711 0.66093157 +128.0811 0.19440046 +129.09842 0.61193562 +130.09542 0.16999753 +139.08359 0.2846 +140.1012 0.19673492 +142.12718 0.11827712 +143.12153 1.45694 +145.05658 0.14923183 +147.1149 0.12154492 +150.10306 0.21284383 +151.08485 0.11972157 +154.09594 0.29542912 +155.08364 1.9453976 +156.1511 0.50473556 +157.10887 0.41136898 +158.09812 0.19608943 +167.10378 0.18009036 +171.11707 0.59266413 +172.11167 1.1750891 +173.09743 2.346608 +175.12205 0.68922664 +183.08071 1.0222057 +183.13312 0.29513364 +185.12801 0.22903539 +186.12696 0.13756469 +194.10186 0.15450274 +198.09357 0.14500395 +199.09354 0.12185876 +201.09219 1.8590501 +201.21146 0.22179778 +211.12166 0.75963292 +212.14271 0.52882163 +213.17083 0.63234667 +215.14198 0.16146733 +223.10401 0.18811331 +225.12333 0.22844624 +228.13857 0.19359511 +229.13061 0.24293953 +240.13276 0.19631959 +243.13218 0.31633587 +251.11612 0.24307452 +254.15205 1.1633885 +255.14805 0.3247192 +258.26625 0.17831132 +269.14778 0.26641005 +270.15063 0.59545169 +272.17467 0.34337485 +277.14881 0.14097076 +282.15204 1.6221879 +283.15334 0.34314261 +294.15644 0.22254282 +300.16151 0.48639721 +311.19072 0.26845015 +312.17962 0.41537176 +325.19657 0.64941797 +329.19166 0.4351269 +342.21871 0.25416111 +353.19682 0.47956549 +369.20849 0.42453676 +375.22099 0.42132994 +382.22526 0.41945042 +386.22559 1.4944893 +413.2531 0.58371186 +END IONS + +BEGIN IONS +TITLE=5: Scan 554 (rt=15.9816, f=3, i=2) [F:\Distiller Data\Lab212\Nitrosylation\YiJu\100512_SNOCRC\YJC_100327SNOCRC_B11b372_N02.raw] +PEPMASS=418.96875 27785 +CHARGE=2+,3+,4+,5+ +SCANS=554 +RTINSECONDS=958.89599 +100.08041 0.07744312 +101.08286 0.10117855 +102.04707 0.28944522 +102.09982 0.72623815 +110.07624 0.68340887 +111.0898 0.1261686 +112.08899 0.27084253 +113.08233 0.11039425 +114.08172 0.1119721 +115.08786 0.47263401 +116.08431 0.085796347 +120.08063 0.17003953 +126.09997 0.11120206 +127.07965 0.47500913 +128.08063 0.11177929 +129.10406 0.98727787 +130.08864 0.16746706 +136.07539 0.13690191 +138.07651 0.087758508 +139.0762 1.4228896 +141.09525 0.12217255 +143.12326 0.55863517 +145.08298 0.099659127 +147.0831 0.21577542 +149.0473 0.28480549 +149.12737 0.063733276 +151.07652 0.78927398 +155.08649 0.72201188 +156.15702 0.26466458 +158.10156 0.13216216 +161.12871 0.082377252 +167.08836 0.18508105 +170.17382 0.11978695 +171.11229 0.30760851 +172.10827 0.41014142 +173.10253 0.77916435 +175.12021 0.4753162 +180.0818 0.085619072 +181.10179 0.18795108 +183.0982 0.38831139 +189.10976 0.097408249 +193.11009 0.10019711 +195.0964 0.21679668 +197.12887 0.4848147 +199.11646 0.12900106 +201.09863 0.38126567 +209.11813 0.18788464 +215.13489 0.092493987 +216.13251 0.13636422 +221.109 0.119325 +223.12049 0.1645455 +227.09232 0.36007924 +235.11125 0.11193931 +237.1307 0.11296884 +239.12933 0.15449545 +240.133 0.17317131 +242.15786 0.16629738 +243.09002 0.29789212 +251.11412 0.15903141 +254.15233 0.37671197 +270.15052 0.65886448 +272.17766 0.20678665 +274.18307 0.10217613 +276.1847 0.1088903 +277.1427 1.2589387 +281.14789 0.21132969 +282.15342 0.43793064 +283.15414 0.20627495 +286.15176 0.3063818 +289.14681 1.9527877 +297.16117 0.10723399 +300.16403 0.13108281 +301.14417 0.50115998 +305.1806 0.1998777 +312.16879 0.19334989 +314.17138 0.207844 +329.20951 0.22184064 +341.02388 2.9938278 +343.01533 0.4459742 +347.19995 0.19271183 +351.18677 0.17340475 +375.22591 0.32858966 +384.20221 0.37760275 +386.22617 0.51910081 +END IONS + +BEGIN IONS +TITLE=6: Scan 555 (rt=16.0021, f=4, i=1) [F:\Distiller Data\Lab212\Nitrosylation\YiJu\100512_SNOCRC\YJC_100327SNOCRC_B11b372_N02.raw] +PEPMASS=586.10396 15019 +CHARGE=4+ +SCANS=555 +RTINSECONDS=960.12703 +101.0785 0.10068765 +102.04565 0.056948907 +102.09981 0.24679829 +110.08105 0.47909216 +112.07308 0.045715084 +112.09252 0.088376347 +113.07845 0.066482013 +115.09264 0.23088486 +116.08128 0.10985988 +120.08559 0.046055625 +126.09915 0.061793609 +127.07877 0.20119507 +129.10321 0.71900182 +130.08287 0.092775153 +132.05496 0.054610429 +136.07773 0.14819459 +139.08045 0.20364593 +140.09387 0.071225175 +141.09297 0.14296397 +143.12014 0.71423325 +145.05375 0.10223777 +147.09904 0.10333225 +149.06129 0.041134883 +150.08763 0.054559236 +151.07262 0.097567125 +154.10241 0.090638893 +156.07734 0.08685946 +156.15214 0.19072366 +157.10545 0.11253656 +158.09597 0.059443475 +166.08289 0.08327091 +167.08813 0.1022028 +169.10405 0.11495707 +171.08362 0.14309407 +172.10406 0.11929319 +175.11957 0.18400896 +181.10109 0.10330127 +183.08819 0.17383608 +189.08645 0.048898398 +193.1087 0.14189997 +195.09873 0.11619978 +197.13013 0.24951424 +201.09257 0.18987024 +205.09215 0.072240788 +208.11081 0.10096024 +214.16415 0.18041199 +215.13178 0.088392117 +219.12295 0.050368234 +221.10367 0.20577856 +223.11666 0.087236216 +226.12753 0.2670445 +231.11961 0.097798139 +237.13749 0.076472792 +239.12217 0.12599289 +240.15183 0.15666189 +244.10008 0.099225391 +249.10239 0.14467656 +252.10865 0.1105572 +254.14978 0.12445902 +258.16853 0.22861191 +267.0091 0.21298873 +270.13498 0.29736453 +277.15234 0.15373632 +278.13223 0.10733251 +282.14821 0.13658214 +289.15156 0.20564244 +301.14518 0.096127401 +320.15899 0.05600994 +332.1693 0.14528381 +345.1887 0.080131838 +355.07152 0.21879668 +386.23948 0.20612455 +391.22594 0.16273928 +427.27548 0.25256585 +701.35953 0.40412056 +END IONS + +BEGIN IONS +TITLE=7: Scan 557 (rt=16.0641, f=2, i=5) [F:\Distiller Data\Lab212\Nitrosylation\YiJu\100512_SNOCRC\YJC_100327SNOCRC_B11b372_N02.raw] +PEPMASS=633.80352 13878 +CHARGE=2+ +SCANS=557 +RTINSECONDS=963.84899 +101.07635 0.069844742 +110.07528 0.13894997 +113.07199 0.031694187 +115.08763 0.063565933 +127.06091 0.083418577 +129.10061 0.35228655 +130.06625 0.039860413 +132.05196 0.57645543 +134.05387 0.03670325 +136.0745 0.059608617 +139.07565 0.090963859 +141.08576 0.05326791 +143.12256 0.16622069 +147.11608 0.15102937 +151.0846 0.031615073 +157.10053 0.084147875 +158.08649 0.043223136 +159.09031 0.069304568 +167.0838 0.22188764 +169.09573 0.040381251 +175.12015 0.11074631 +177.09902 0.034677892 +187.09432 0.061668367 +193.10229 0.17162463 +195.11094 0.094574313 +197.11998 0.032519615 +208.0841 0.033131239 +210.12495 0.2011632 +212.14102 0.57028937 +221.0904 0.03244486 +222.13364 0.050700262 +223.11357 0.096069087 +227.09262 0.23950097 +230.14093 0.06610879 +233.0927 0.041702933 +235.119 0.050137435 +237.13167 0.0518139 +240.13403 0.16940764 +244.11615 0.11157811 +250.15568 0.045212055 +261.1439 0.063475659 +270.1321 3.5873755 +272.12778 0.16043309 +275.22035 0.078236342 +277.15061 0.15912845 +281.11177 0.073078582 +286.12991 0.16675625 +289.14349 0.14695294 +295.18118 0.57342779 +296.12806 0.11393302 +301.14735 0.083308155 +305.14845 0.041663154 +307.14299 0.070037333 +323.17181 0.093382928 +327.13636 0.044100994 +332.17271 1.4410698 +341.15645 0.10965308 +359.19628 0.063404705 +361.17726 0.086939267 +372.20872 0.079712198 +375.22012 0.24287284 +382.17982 0.049287706 +387.19298 0.90023146 +391.20421 0.07601694 +401.16896 0.054451233 +405.20606 1.3429592 +407.2015 0.14487444 +415.1986 0.12308531 +427.2228 0.41558742 +439.22424 0.10517465 +443.26443 0.060649011 +445.20935 0.27440216 +463.2126 3.2255158 +465.21031 0.34836917 +471.22983 0.31734957 +485.19288 0.21874698 +510.25566 0.1851407 +614.88038 1.9926958 +640.83797 0.97125076 +665.34435 0.54514706 +699.38195 2.1526367 +END IONS + +BEGIN IONS +TITLE=8: Scan 558 (rt=16.0847, f=3, i=3) [F:\Distiller Data\Lab212\Nitrosylation\YiJu\100512_SNOCRC\YJC_100327SNOCRC_B11b372_N02.raw] +PEPMASS=581.29145 14062 +CHARGE=2+ +SCANS=558 +RTINSECONDS=965.08003 +101.0753 0.054147941 +102.0859 0.083325395 +110.08075 0.25027866 +112.09425 0.053165302 +113.08287 0.031078395 +114.09665 0.037397568 +115.08978 0.06972496 +120.07084 0.048868759 +126.05676 0.057107315 +127.07421 0.12738222 +129.1054 0.49615237 +130.0934 0.12635419 +132.05244 0.19684595 +133.0532 0.04118596 +136.07922 0.089841807 +139.07598 0.27539523 +143.11991 0.25863161 +145.06055 0.084945381 +147.11139 0.093451975 +151.07641 0.12059974 +156.15414 0.097368354 +157.13513 0.26931272 +167.08357 0.093242085 +169.08806 0.075528196 +172.08432 0.060571964 +173.10852 0.10285452 +175.12033 0.17977262 +179.12181 0.029549658 +181.09092 0.066122773 +184.07513 0.036092131 +185.1226 0.10593818 +189.08484 0.048933248 +193.10052 0.055795832 +195.1038 0.15135589 +198.12121 0.036068433 +210.13481 0.043348142 +212.14473 0.18137033 +213.09938 0.083630446 +213.21187 0.093888188 +221.09615 0.11915453 +227.1088 0.16170988 +229.11652 0.045797869 +230.13539 0.05507219 +233.14243 0.036648161 +235.1325 0.072144835 +239.12543 0.077076954 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0.12315737 +281.16871 0.1311677 +286.13145 0.73086371 +289.14492 2.7621858 +295.14086 0.12930935 +297.17287 0.14325267 +301.15634 0.28455234 +303.18015 0.27642372 +308.15877 0.21418446 +310.1457 0.27392488 +311.15158 0.15438848 +313.18122 0.25501015 +318.15485 0.12180626 +332.17243 0.6357792 +341.21164 0.42090588 +354.19173 0.28750414 +357.2112 0.32874414 +369.20334 0.3887336 +375.20871 0.9245482 +391.21278 0.62943032 +398.21726 0.386263 +409.23488 1.1240859 +413.23477 1.4833888 +419.23703 0.94278858 +421.22874 0.44608781 +427.22921 0.46650661 +439.21862 0.61610268 +485.7656 0.46077298 +489.25644 0.36897744 +498.2774 0.7381986 +507.278 0.96952491 +552.28674 0.34779531 +671.39311 0.79861958 +END IONS + +BEGIN IONS +TITLE=12: Scan 563 (rt=16.2083, f=4, i=3) [F:\Distiller Data\Lab212\Nitrosylation\YiJu\100512_SNOCRC\YJC_100327SNOCRC_B11b372_N02.raw] +PEPMASS=487.24625 28559 +CHARGE=2+,3+,4+,5+ +SCANS=563 +RTINSECONDS=972.495 +101.08 0.10793897 +102.0668 0.082692658 +110.07487 0.65529264 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0.50549515 +744.36513 1.7895822 +762.37421 0.80224651 +784.34034 1.317478 +805.40847 0.61579884 +END IONS + +BEGIN IONS +TITLE=14: Scan 567 (rt=16.3036, f=3, i=5) [F:\Distiller Data\Lab212\Nitrosylation\YiJu\100512_SNOCRC\YJC_100327SNOCRC_B11b372_N02.raw] +PEPMASS=415.20843 33641 +CHARGE=2+ +SCANS=567 +RTINSECONDS=978.21796 +101.08137 0.19147379 +102.05299 0.18702436 +110.07422 1.0544147 +112.08866 0.28964927 +113.0768 0.16227649 +115.08668 0.30649876 +116.07731 0.082542981 +120.08453 0.29179348 +123.03337 0.085914003 +127.08368 0.95372909 +129.1033 2.1925559 +130.08874 0.47103471 +133.07155 0.1332474 +136.07892 0.15213102 +137.07414 0.086592123 +138.07711 0.17768169 +139.07518 4.8194345 +141.10347 0.24652644 +143.10006 0.13952249 +147.11645 0.39686863 +149.1301 0.24623012 +150.10274 0.092184439 +151.07631 1.9229546 +153.09283 0.10917119 +154.09549 0.16657957 +155.08754 0.38701059 +158.09336 0.17257553 +159.09172 0.15342008 +166.07088 0.22119811 +167.08673 0.72843298 +169.10329 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0.64282352 +END IONS + +BEGIN IONS +TITLE=15: Scan 568 (rt=16.3242, f=4, i=4) [F:\Distiller Data\Lab212\Nitrosylation\YiJu\100512_SNOCRC\YJC_100327SNOCRC_B11b372_N02.raw] +PEPMASS=427.21749 32054 +CHARGE=2+ +SCANS=568 +RTINSECONDS=979.44901 +101.0768 0.24060876 +102.0591 0.1574492 +110.07414 1.0689206 +112.08746 0.24009873 +113.07694 0.10469192 +115.07974 0.14309085 +116.07017 0.073695691 +120.08178 0.20792927 +125.05552 0.078134325 +127.08553 0.34887347 +129.10298 1.6559229 +130.08928 0.53415948 +132.05188 0.10897219 +136.07632 0.1559051 +139.07511 0.75508216 +141.1003 0.28457443 +143.09914 0.22462061 +145.09722 0.074920191 +147.11456 0.68231186 +149.05292 0.28907609 +149.13139 0.12480774 +151.07607 0.3658224 +153.09111 0.10625602 +154.09341 0.13898097 +155.08353 0.38592809 +161.09981 0.086379912 +166.06968 0.28873265 +167.08729 0.38018513 +171.07742 0.15757967 +173.11121 0.21814306 +175.12252 1.3630242 +177.10232 0.13913279 +180.0798 0.087395149 +181.08799 0.13810729 +183.08118 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0.91077145 +530.78464 0.66342366 +534.2698 1.4422188 +538.2634 0.78822315 +539.78018 1.0406627 +556.28245 0.63567057 +570.29449 0.44507372 +585.35718 1.3653618 +595.32269 0.5697387 +625.29875 0.53226914 +672.35449 0.55050151 +680.35986 0.50459093 +688.34427 1.0553233 +698.34921 0.39871244 +715.37852 0.54532881 +726.38441 1.5097332 +799.37925 0.81672258 +854.43706 0.46694389 +941.46478 0.63646305 +END IONS + +BEGIN IONS +TITLE=16: Scan 570 (rt=16.3861, f=2, i=8) [F:\Distiller Data\Lab212\Nitrosylation\YiJu\100512_SNOCRC\YJC_100327SNOCRC_B11b372_N02.raw] +PEPMASS=488.24659 31305 +CHARGE=2+ +SCANS=570 +RTINSECONDS=983.16799 +101.07794 0.18089572 +102.05789 0.1084041 +110.07268 0.48357659 +112.07961 0.085253921 +113.08411 0.065221053 +115.08501 0.1049893 +120.08204 0.11054027 +126.06595 0.086201227 +127.08312 0.18432734 +129.10321 1.0609471 +130.09291 0.22553854 +131.10687 0.10798849 +132.05112 0.14237663 +133.05275 0.072364947 +136.08307 0.13520177 +139.07975 0.11618484 +141.10274 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0.17657513 +276.15723 0.23215531 +277.13293 0.1084388 +284.14515 0.18507886 +286.13032 0.51120925 +289.12726 0.10130008 +298.15765 0.18192985 +299.16854 0.16519906 +301.16792 0.17018225 +303.212 0.27489343 +310.13854 0.12162995 +325.1674 0.16085253 +332.16879 0.54149131 +352.17313 0.10619902 +361.19024 0.27542602 +375.21826 0.87728243 +377.20588 0.20738034 +383.23287 0.23410257 +391.20556 0.36321028 +394.21009 0.30807105 +403.20961 0.34526009 +441.73459 0.55158878 +492.26019 2.3201061 +495.26249 1.4776452 +498.27432 1.4036612 +499.28006 2.3891154 +524.27096 0.82968543 +528.33214 1.0796962 +542.29678 1.0058852 +590.82121 1.2412191 +677.33763 0.65349057 +771.42082 1.0402137 +799.43193 0.56274234 +805.42223 1.2973326 +882.45776 0.34495718 +899.47805 0.50826373 +1012.5647 0.42862447 +END IONS + +BEGIN IONS +TITLE=17: Scan 571 (rt=16.4067, f=3, i=6) [F:\Distiller Data\Lab212\Nitrosylation\YiJu\100512_SNOCRC\YJC_100327SNOCRC_B11b372_N02.raw] +PEPMASS=527.29562 24414 +CHARGE=2+ +SCANS=571 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0.068311389 +237.12917 0.15159047 +239.13212 0.15136772 +240.14248 0.10237147 +243.08421 0.16387149 +244.16504 0.14265219 +251.16773 0.23242461 +253.12868 0.1346872 +258.15619 0.082422147 +268.12395 0.10494403 +270.13174 2.3888028 +272.13844 0.23109848 +275.17419 0.1034608 +277.15625 0.095355339 +281.05678 0.9110778 +284.17911 0.10390282 +286.12839 0.8829352 +288.13299 0.19213373 +312.16903 0.17477274 +332.17074 0.58614651 +345.18323 0.18518198 +348.1652 0.11469661 +359.17239 0.18094354 +373.19814 0.20041592 +375.21509 0.75327387 +391.20716 1.1533687 +393.18469 0.19749582 +401.18548 0.2207522 +411.15997 0.31549342 +415.04864 0.40745555 +418.2218 0.26842703 +463.21944 0.73904732 +513.25632 1.2513062 +526.28764 1.30435 +527.29078 2.2695314 +536.28301 27.52858 +538.28119 2.8691693 +826.43006 0.73160474 +END IONS + +BEGIN IONS +TITLE=18: Scan 572 (rt=16.4272, f=4, i=5) [F:\Distiller Data\Lab212\Nitrosylation\YiJu\100512_SNOCRC\YJC_100327SNOCRC_B11b372_N02.raw] +PEPMASS=432.22403 38620 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0.15059398 +281.16298 0.22446605 +284.15616 0.28947018 +286.12735 2.0670167 +289.15051 0.51930315 +290.65312 0.23919624 +292.15098 0.30846266 +298.16776 0.54181254 +303.16838 0.30683085 +310.12762 0.51517999 +312.16387 0.44323808 +315.1733 0.1959132 +316.15116 0.20374505 +325.17691 0.25408879 +328.15032 0.31000649 +329.18546 0.23762067 +332.17053 0.75144622 +336.1648 0.32636083 +338.17614 0.21298969 +341.21463 0.73393703 +343.02375 0.55447259 +348.16924 0.69472067 +350.19142 0.27089204 +353.18803 0.39343381 +369.20604 0.77889522 +375.2142 1.7068657 +384.19981 0.50399127 +385.21251 0.35143456 +386.20326 0.68778985 +388.21 0.2935868 +391.20854 1.3912804 +397.21243 0.5756286 +400.22744 1.0260276 +403.20964 0.69214454 +412.25739 1.5053588 +415.21541 0.77061888 +422.224 0.56636299 +426.22562 0.96100566 +427.24012 1.1074005 +432.23094 2.4443362 +435.75228 4.0802686 +438.23357 1.1705012 +441.2461 1.1949845 +442.23675 1.8116642 +444.24341 1.216107 +446.2476 1.072584 +453.25764 0.45810623 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0.19306411 +181.09075 0.081551835 +183.08642 0.07728657 +186.12231 0.091173921 +187.10672 0.095801868 +195.10412 0.11381606 +198.11682 0.10375502 +199.10456 0.12389912 +200.14617 0.13633741 +204.12817 0.085391579 +209.09647 0.14112424 +212.13225 0.17333171 +215.14271 0.088911649 +216.12093 0.11565438 +218.15417 0.65075279 +221.10843 0.17430632 +223.1086 0.0565384 +225.10195 0.13087844 +226.11583 0.32834447 +227.0927 0.98458652 +231.10385 0.087272314 +232.13999 0.090726945 +235.12757 0.1008529 +240.13643 0.21117104 +243.09657 0.38663879 +244.15903 0.4472844 +252.11258 0.094332635 +257.18281 0.090447697 +258.13901 0.16947333 +267.11648 0.10244522 +270.13209 3.6568538 +272.15157 0.44655088 +275.17221 0.1525194 +277.14857 0.08724127 +283.14691 0.069003934 +286.13272 0.89257664 +287.12667 0.29355884 +288.12399 0.19519813 +289.1528 0.092819801 +290.14151 0.09467574 +295.1588 0.096301428 +298.14628 0.24231782 +305.18252 0.37933784 +315.18349 0.15574249 +321.07559 0.22001918 +329.18521 0.21850796 +332.17106 0.92214253 +335.16638 0.11003689 +336.15624 0.16653976 +344.16668 0.13134732 +348.16619 0.47705848 +375.21705 1.1350597 +377.19724 0.18159552 +391.20907 0.46180674 +392.20482 0.11931523 +397.22777 0.33093454 +403.20982 0.26961133 +415.21709 0.41058786 +426.23524 0.40972413 +427.22592 1.0143814 +429.19889 0.72418719 +431.21686 0.50164819 +444.25004 2.3485895 +463.21473 1.8737432 +485.2136 9.2901259 +492.25303 4.4704967 +493.2548 2.5598665 +498.26468 0.74091348 +505.26855 0.61894907 +511.30893 1.0043924 +516.27898 0.69502042 +562.29651 0.54981985 +585.3047 0.54051443 +587.78643 0.71659901 +598.26793 1.0054482 +613.76542 0.90264979 +645.31951 0.55861986 +649.28618 0.61799608 +713.32405 0.50145734 +715.3849 0.22700734 +END IONS + +BEGIN IONS +TITLE=20: Scan 575 (rt=16.5098, f=3, i=7) [F:\Distiller Data\Lab212\Nitrosylation\YiJu\100512_SNOCRC\YJC_100327SNOCRC_B11b372_N02.raw] +PEPMASS=406.70773 67118 +CHARGE=2+ +SCANS=575 +RTINSECONDS=990.58697 +101.07882 0.48424219 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0.76020786 +197.11866 0.33222614 +198.11557 0.2791509 +199.09435 0.68065483 +201.12953 0.17011536 +204.13807 2.6281003 +206.12955 0.21600541 +209.08926 1.3354293 +212.1154 0.84933682 +215.11535 0.20304896 +216.11698 0.30252191 +217.08625 0.22459012 +218.15333 0.40362641 +226.10614 1.4838331 +227.09013 11.689919 +229.09379 0.91466951 +230.15406 1.0785692 +232.14683 0.15181223 +235.10764 0.34996129 +239.13447 0.34346748 +240.13287 1.280638 +241.1327 0.64392111 +243.08471 0.27249908 +244.14681 0.48828705 +252.1203 0.93217359 +257.1713 0.46167124 +258.15001 0.96555214 +261.14328 0.56611344 +262.63952 0.54841131 +266.14157 0.82021213 +267.12678 0.30794429 +269.13393 1.2979174 +270.13139 18.228269 +272.13178 1.380777 +275.17942 0.65996773 +276.15766 0.52885257 +277.1483 0.69954329 +279.14816 0.24219792 +281.16521 0.72191712 +283.14998 0.3896806 +284.15404 0.28441351 +285.1552 0.50272841 +286.14038 0.79598736 +288.14282 0.25251352 +290.15143 0.34606651 +291.14658 0.71568649 +294.17444 1.2214714 +296.13377 0.47747664 +297.1552 0.5412428 +298.16408 0.72999115 +303.16791 0.5287041 +305.15014 0.80040689 +306.14568 0.36165426 +307.14102 0.24531011 +309.15556 0.27962066 +310.14521 0.62006301 +312.17476 1.3646275 +314.17133 0.75499912 +316.15239 0.26541706 +324.16339 0.84225016 +325.16035 1.1359973 +327.17088 0.59602789 +332.17086 1.9831275 +335.1901 0.312457 +341.18765 1.3494562 +342.18629 1.6627343 +346.1749 0.28534236 +348.17466 0.38595859 +350.17425 0.36073706 +354.18175 0.99037021 +357.21445 0.90129991 +363.18345 1.2152557 +364.19143 0.5606927 +365.19117 0.38800511 +368.19428 0.60716941 +369.19662 1.0885702 +375.21254 5.6514623 +377.20293 1.1530151 +378.1997 2.1297409 +380.1995 2.8745535 +381.19082 1.6826212 +383.21745 2.7849029 +385.2005 0.68443937 +387.20161 0.98909506 +388.21318 0.67633623 +389.19383 2.2750189 +391.19596 0.56083865 +397.21372 1.5674044 +398.21178 10.261839 +403.19988 0.84306924 +404.20828 1.3022008 +406.71105 3.9211067 +407.20685 16.837785 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0.96912241 +458.25331 1.9486882 +461.24332 1.1317057 +463.21485 4.0323802 +465.21459 2.713992 +467.23327 0.91277097 +469.24088 1.0651238 +474.23433 0.8812692 +478.91368 1.0126522 +488.24768 1.97917 +505.25909 1.156351 +510.25379 2.0084648 +511.31717 3.639169 +516.25981 3.4369096 +528.25509 11.147283 +529.2653 4.0540948 +538.28537 8.2936324 +543.28623 14.700198 +545.2919 18.449418 +546.27979 10.247509 +552.28702 2.8731876 +556.28215 1.1202751 +570.27972 1.4424211 +585.31151 2.3740039 +611.32805 2.8766138 +619.31901 2.5224654 +628.36167 2.0447859 +645.32699 1.5614569 +649.33819 1.6991693 +653.32487 1.5565354 +676.34473 7.2800292 +680.34975 1.8196719 +689.36674 3.0336616 +697.86387 1.7061271 +698.3698 5.5975651 +710.3564 1.3530903 +717.88358 1.3209252 +723.84973 2.013528 +737.37821 1.1213028 +744.38546 1.0605688 +755.39506 3.7761364 +797.41681 1.306773 +810.46072 4.6279392 +826.46168 1.8376605 +883.49346 2.4901793 +895.4572 0.72116408 +921.49321 2.3437541 +929.47484 0.83947617 +938.4914 2.7629553 +1020.5528 0.70086857 +END IONS + +BEGIN IONS +TITLE=22: Scan 578 (rt=16.5923, f=2, i=10) [F:\Distiller Data\Lab212\Nitrosylation\YiJu\100512_SNOCRC\YJC_100327SNOCRC_B11b372_N02.raw] +PEPMASS=521.92674 38898 +CHARGE=3+ +SCANS=578 +RTINSECONDS=995.53997 +101.08924 0.14375439 +110.07485 0.36197496 +112.08697 0.070876222 +115.09439 0.097709481 +120.0843 0.078039628 +127.08282 0.09560837 +129.10237 1.1375981 +130.09521 0.28805959 +132.05244 0.55953049 +136.08039 0.083301049 +139.06953 0.084691316 +141.07608 0.10833398 +143.10556 0.12146288 +147.11803 0.47460621 +149.0568 0.090105084 +158.09594 0.075657317 +159.08482 0.13371655 +167.09752 0.10251069 +169.07544 0.10328836 +171.09429 0.10833353 +173.10266 0.10829339 +175.12227 0.73646318 +183.11422 0.10299173 +195.08979 0.20264528 +198.11317 0.11953253 +199.08952 0.15844533 +201.11142 0.12043899 +204.13527 0.10756002 +209.10545 0.30823783 +212.11934 0.18678456 +213.10344 0.097274606 +216.14283 0.16487387 +226.11955 0.34031997 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4.6680935 +541.30104 1.6576429 +548.23658 7.7313655 +552.29265 3.1201698 +555.31015 5.04003 +558.27001 5.1732139 +559.28464 3.8028351 +560.28762 1.1625117 +563.32784 2.47832 +575.29594 0.76813637 +593.30448 0.51879405 +620.35131 0.61882169 +631.28745 14.1449 +645.31027 1.3201098 +665.27612 11.090717 +698.36255 1.1149018 +705.26995 12.087013 +742.37393 0.6135428 +748.31404 1.007325 +771.41481 0.69997238 +787.40048 0.90439868 +805.40848 1.7772861 +810.35468 4.2428701 +827.39311 0.83295057 +853.40299 0.67195245 +END IONS + +BEGIN IONS +TITLE=29: Scan 588 (rt=16.8395, f=4, i=9) [F:\Distiller Data\Lab212\Nitrosylation\YiJu\100512_SNOCRC\YJC_100327SNOCRC_B11b372_N02.raw] +PEPMASS=471.24166 45162 +CHARGE=2+ +SCANS=588 +RTINSECONDS=1010.368 +101.08089 0.23138379 +102.05641 0.13670493 +110.07492 0.55017042 +112.08826 0.15968133 +113.08123 0.076235857 +115.09321 0.12775659 +120.07801 0.14351495 +126.05973 0.12117566 +127.07704 0.20220004 +129.10312 1.9900498 +130.09064 0.67117419 +132.05138 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[F:\Distiller Data\Lab212\Nitrosylation\YiJu\100512_SNOCRC\YJC_100327SNOCRC_B11b372_N02.raw] +PEPMASS=442.71124 54984 +CHARGE=2+ +SCANS=590 +RTINSECONDS=1014.087 +101.08022 0.35952376 +102.05469 0.44048928 +104.05612 0.088700736 +110.07652 0.45323126 +112.09059 0.1921313 +113.07355 0.14126585 +115.09462 0.14159683 +122.06561 0.09594696 +126.05905 0.30842018 +127.08332 0.17983963 +129.10257 2.4907134 +130.08987 0.81142717 +132.05277 0.34114102 +133.06706 0.11792347 +136.07766 0.27848986 +139.07676 0.18950936 +141.07557 0.30495998 +143.12075 0.55588464 +144.06643 0.13496143 +147.11648 1.6519262 +149.05059 0.51443346 +149.1249 0.16910053 +156.08249 0.10364795 +157.11547 0.21062873 +159.08022 1.2386423 +159.12914 0.19901957 +166.07417 0.19216164 +167.07146 0.45306415 +171.10962 0.33003342 +173.11008 0.23455338 +175.12379 0.75931824 +176.08593 0.099847973 +181.09478 0.20632458 +182.06888 0.10325008 +187.08456 0.55737161 +189.0932 0.11238902 +193.10111 0.2067855 +195.08836 0.26350716 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3.4911154 +407.72815 1.3000325 +413.1958 0.88326078 +415.20942 0.47066356 +427.22935 0.79388194 +438.22059 0.48899958 +441.24058 0.81124293 +445.20219 4.8682182 +447.21213 1.8606304 +449.21825 1.5804016 +455.23615 3.2465252 +456.2352 6.2370156 +459.25435 4.7441795 +463.20447 107.67054 +465.21646 15.832165 +473.22386 1.0286873 +495.21134 0.55381068 +509.23712 0.78016425 +516.25987 0.63638688 +531.22728 0.45787256 +552.28688 0.61868065 +574.78573 0.95300631 +588.28971 0.30644097 +625.31436 0.32619223 +791.33967 0.63072581 +END IONS + +BEGIN IONS +TITLE=33: Scan 594 (rt=17.0046, f=2, i=14) [F:\Distiller Data\Lab212\Nitrosylation\YiJu\100512_SNOCRC\YJC_100327SNOCRC_B11b372_N02.raw] +PEPMASS=476.76164 30832 +CHARGE=2+ +SCANS=594 +RTINSECONDS=1020.2731 +101.08326 0.099329098 +102.05739 0.14016793 +110.07378 0.61855064 +120.07984 0.14708691 +126.06713 0.10906179 +127.08443 0.11226596 +129.10408 1.4732545 +130.0926 0.54629905 +132.05031 0.42795421 +133.05763 0.073040004 +136.07654 0.21828125 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1.759248 +487.23027 2.3618458 +488.2445 2.1230295 +498.76427 2.9504783 +499.29275 6.6084477 +507.25648 0.74362167 +524.27143 0.88108308 +563.31296 1.33059 +579.29623 1.1230299 +652.34511 0.98257583 +759.38761 1.5810585 +913.43535 1.7265785 +923.45759 0.92097214 +END IONS + +BEGIN IONS +TITLE=35: Scan 599 (rt=17.1205, f=2, i=15) [F:\Distiller Data\Lab212\Nitrosylation\YiJu\100512_SNOCRC\YJC_100327SNOCRC_B11b372_N02.raw] +PEPMASS=572.27886 29133 +CHARGE=2+ +SCANS=599 +RTINSECONDS=1027.229 +101.07739 0.11575886 +102.05411 0.086136649 +110.07595 0.64196882 +112.08678 0.11581017 +114.092 0.07124936 +115.08522 0.10262454 +126.05686 0.066775664 +127.0943 0.143513 +129.10308 1.223759 +130.09469 0.3405479 +132.0504 0.70853847 +136.07759 0.14559762 +141.0762 0.15647281 +147.11775 0.53079287 +155.09037 0.37436859 +158.09952 0.097228853 +167.09358 0.22442472 +171.08481 0.39360124 +173.12782 0.13061503 +175.12152 0.54766574 +181.09187 0.1568245 +183.11162 0.18946796 +185.10007 0.48926495 +186.12494 0.13441394 +193.10294 0.10554712 +195.09185 0.19789315 +199.10756 0.13148815 +200.12997 0.13561657 +201.11533 0.16822839 +204.1324 0.092745116 +209.10302 0.13404683 +212.12529 0.17046522 +221.10269 0.31368565 +227.08988 1.1114582 +232.14052 0.13768651 +234.13772 0.16480467 +235.12108 0.087514027 +237.14406 0.18412882 +239.12163 0.17433455 +240.11966 0.33001842 +243.11346 0.1902591 +249.10372 0.60607959 +251.09405 0.18895245 +254.13569 0.11074457 +260.14353 0.11449644 +261.15794 0.16553482 +262.1428 0.12633864 +266.13475 0.29986691 +267.11684 0.40666702 +270.13168 7.524054 +272.13464 0.68651773 +276.16817 0.19851421 +278.15701 0.12166319 +282.13883 0.17952447 +284.15318 0.17631276 +286.13187 0.65678651 +291.0804 0.11192344 +293.13943 0.14984826 +303.18275 0.16249609 +305.18355 0.24024803 +314.16069 0.29824428 +331.17063 0.1497458 +332.17145 2.0001537 +341.19221 0.34781376 +348.17896 0.37593066 +352.18156 0.15435586 +355.07468 0.47447071 +366.18336 0.21437975 +369.1774 0.19943615 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20.174306 +419.21671 3.9568436 +420.23454 12.283866 +421.22378 4.4274755 +423.21182 7.0515455 +423.72259 2.7781886 +427.21658 1.8143667 +431.20999 0.96797143 +432.23346 1.759104 +439.23977 0.82959528 +449.19618 2.5522739 +450.15627 1.2283849 +454.22009 0.58389652 +458.24023 1.480372 +464.31316 2.3079231 +470.21433 0.96982707 +472.22595 1.3042795 +473.20534 1.0312252 +486.30141 1.2157807 +493.19844 1.958415 +498.25303 0.8912926 +507.2483 1.3669374 +515.28271 1.0052608 +520.28968 3.4453264 +524.27685 2.2256428 +529.32035 1.0022285 +535.2524 1.7810765 +537.2375 0.99959289 +538.21687 2.1728393 +555.23775 9.4836823 +559.31647 1.3393091 +560.29088 4.1285559 +563.33212 6.9818732 +565.28911 0.79436077 +570.34894 2.9851491 +572.30543 2.0555209 +577.31235 2.2411396 +585.32102 0.85175647 +587.29945 0.4728277 +598.28053 3.0904886 +600.29231 0.75830177 +603.32758 2.279483 +615.34479 0.56625231 +616.32644 0.98925434 +620.34731 1.0759379 +637.35374 1.6720499 +664.34005 1.7994854 +665.35993 1.0011211 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10.350035 +407.22588 3.33753 +415.1887 150.76992 +416.23038 24.392781 +417.20451 13.261403 +437.19552 0.79252931 +439.21238 0.52537078 +449.2006 0.54477442 +457.23705 0.25940196 +458.24705 0.97483588 +464.24134 0.2050334 +471.17782 3.8072819 +473.18908 0.71701018 +480.24652 0.75598392 +484.26577 0.33865893 +487.14801 0.48977432 +499.25816 0.44412504 +520.29555 0.58154591 +524.27539 0.61013656 +532.29198 0.67463372 +542.27595 5.3356949 +544.27796 0.64332423 +550.29806 0.86778507 +555.25187 0.86193912 +563.32692 0.73017393 +585.31985 1.9142353 +637.3538 0.26774559 +663.27829 1.3749643 +666.3298 0.47274311 +684.35298 1.1190447 +706.31512 3.1179708 +708.32584 0.51125242 +724.32898 1.9739252 +768.35463 12.211087 +789.41239 3.9472557 +811.39811 0.97234906 +END IONS + +BEGIN IONS +TITLE=43: Scan 611 (rt=17.4297, f=2, i=18) [F:\Distiller Data\Lab212\Nitrosylation\YiJu\100512_SNOCRC\YJC_100327SNOCRC_B11b372_N02.raw] +PEPMASS=420.23583 9898 +CHARGE=2+ +SCANS=611 +RTINSECONDS=1045.7821 +100.06893 0.020973367 +101.07558 0.065101652 +106.09069 0.025814404 +110.08123 0.056995649 +112.09842 0.036338432 +114.1091 0.026659431 +115.08661 0.047136184 +120.09101 0.058339134 +126.06036 0.060007779 +129.10454 0.15899474 +130.08409 0.098153011 +133.07732 0.062253543 +136.07941 0.064485665 +139.08409 0.047652641 +147.11238 0.15648713 +149.04207 0.081714592 +149.13316 0.036612944 +157.11121 0.081521785 +158.09421 0.032228552 +166.06523 0.040196269 +167.08469 0.052145872 +175.12063 0.41950343 +177.13028 0.037999711 +181.1057 0.069477616 +182.08279 0.023038342 +187.15517 0.025553957 +193.10994 0.098950299 +195.10032 0.036739273 +197.10575 0.060594611 +205.05757 0.089361546 +207.03718 0.04114764 +209.08723 0.07671312 +212.12733 0.039149872 +214.14727 0.044899623 +222.65503 0.29207072 +226.1086 0.17994587 +227.0924 1.169137 +231.14661 0.07696773 +243.08206 0.10960652 +254.17295 0.14494356 +255.15041 0.064196231 +258.1621 0.071747841 +262.63655 0.12320242 +267.10287 0.042339205 +270.13237 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0.076198972 +584.31941 0.17831604 +587.33579 0.30381584 +742.40337 1.114723 +755.43559 0.19242849 +926.46996 0.06281406 +956.50944 0.030011795 +1000.5473 0.0242506 +END IONS + +BEGIN IONS +TITLE=45: Scan 613 (rt=17.4707, f=4, i=15) [F:\Distiller Data\Lab212\Nitrosylation\YiJu\100512_SNOCRC\YJC_100327SNOCRC_B11b372_N02.raw] +PEPMASS=549.28969 6107 +CHARGE=3+ +SCANS=613 +RTINSECONDS=1048.244 +110.07737 0.099242644 +113.06895 0.013641861 +115.07348 0.029480559 +129.10209 0.11786719 +130.08675 0.09055143 +132.05398 0.063442113 +136.07562 0.029438521 +141.08554 0.037620692 +143.12673 0.015587434 +147.11659 0.065495184 +155.08888 0.02754725 +169.10537 0.016909588 +171.10429 0.039025391 +175.12261 0.14301188 +177.10236 0.027810163 +183.0808 0.030269796 +189.09724 0.037782124 +195.10537 0.024432171 +197.15397 0.039904873 +198.1116 0.037936613 +199.11002 0.044284175 +201.11832 0.058179313 +213.09334 0.032610026 +217.08307 0.10014703 +220.06832 0.01445642 +221.10044 0.029193812 +223.10175 0.044160084 +227.09167 0.12679565 +230.14046 0.029286449 +234.14295 0.02138443 +237.11845 0.041674498 +244.15987 0.074206037 +246.19197 0.022046485 +248.1623 0.043685742 +251.09496 0.095948292 +254.13684 0.030547151 +256.11026 0.021936438 +258.15893 0.037204284 +262.15546 0.052743482 +270.13476 1.0860141 +272.15595 0.086138219 +276.178 0.036878027 +281.16464 0.030676577 +284.1617 0.032001295 +286.12667 0.14476914 +291.0642 0.27028268 +301.15119 0.0562686 +309.1464 0.082428944 +321.1821 0.032837492 +327.17898 0.034043252 +330.156 0.035727902 +332.17167 0.33468038 +341.20785 0.15399672 +348.17731 0.084823095 +359.17235 0.038736244 +361.19583 0.060052358 +375.20998 0.56303689 +389.2138 0.052615226 +391.20608 0.11596899 +397.19948 0.11802192 +403.175 0.052461944 +413.21056 0.078379902 +416.23367 0.047034458 +457.21634 0.12040488 +458.22796 0.093927264 +463.22351 0.30082825 +485.2214 0.11973859 +543.29543 0.4459903 +549.77922 0.78380831 +551.26479 0.93491548 +556.26342 1.5395528 +556.78387 0.85392441 +559.33232 2.839316 +561.31955 1.6277621 +584.3159 0.097610104 +658.39335 0.20233972 +END IONS + +BEGIN IONS +TITLE=46: Scan 615 (rt=17.5328, f=2, i=19) [F:\Distiller Data\Lab212\Nitrosylation\YiJu\100512_SNOCRC\YJC_100327SNOCRC_B11b372_N02.raw] +PEPMASS=426.23734 18259 +CHARGE=2+ +SCANS=615 +RTINSECONDS=1051.966 +100.08335 0.020409486 +101.07729 0.050593233 +102.05773 0.029654721 +106.09273 0.12478539 +110.0797 0.073935118 +112.09547 0.042442365 +115.07997 0.075196286 +120.0835 0.055359579 +126.05635 0.81108431 +128.10259 0.093842674 +129.10102 0.18937388 +130.09213 0.10176917 +132.09269 0.035149951 +137.04818 0.036250976 +138.08818 0.051406722 +139.08716 0.060868436 +141.04877 0.077381525 +144.06846 0.095108319 +147.1043 0.18781769 +149.0513 0.15311473 +149.13113 0.83129034 +156.08389 0.02633252 +158.09465 0.059789277 +166.08748 0.046809728 +167.07396 0.060564815 +169.09195 0.13478636 +170.08702 0.099409799 +175.12214 0.40614549 +182.06954 0.10913004 +183.06654 0.084971798 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Data\Lab212\Nitrosylation\YiJu\100512_SNOCRC\YJC_100327SNOCRC_B11b372_N02.raw] +PEPMASS=454.22975 14747 +CHARGE=2+ +SCANS=616 +RTINSECONDS=1053.197 +102.06482 0.025186523 +110.07532 0.091149179 +112.09016 0.033526136 +113.07517 0.02224245 +120.08564 0.064100548 +125.06432 0.027560296 +126.06013 0.14206311 +129.10511 0.31497236 +130.09526 0.099112809 +132.05055 2.2318386 +134.04827 0.094581291 +136.08184 0.054165291 +143.11192 0.025896046 +147.11514 0.13949376 +149.13483 0.025178594 +167.0773 0.066290876 +169.10968 0.05787176 +171.09827 0.035735926 +175.11571 0.12447852 +181.09727 0.023918154 +187.1164 0.07611294 +189.09981 0.024302582 +192.0998 0.024813068 +193.10181 0.067801066 +194.10714 0.028967824 +195.09758 0.035275159 +201.11982 0.026704863 +207.12385 0.02640105 +209.08559 0.089703525 +213.12131 0.051902737 +215.14249 0.05418278 +217.09454 0.043422145 +219.12654 0.12212763 +221.12138 0.058458092 +222.09049 0.039214012 +226.11118 0.15275055 +227.09134 0.95547096 +231.14035 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0.94641847 +446.2502 25.146592 +448.22904 2.418015 +449.19626 1.2263652 +458.24909 0.26692754 +470.24423 0.080071057 +473.23663 0.36127457 +476.25749 0.28028031 +483.24581 0.32613411 +489.24048 0.12940316 +498.23888 0.13167238 +516.27893 0.24233923 +518.29517 0.1212486 +563.30283 0.24226535 +588.3267 0.33153617 +601.28026 0.16010652 +621.35317 0.24981623 +643.3249 2.2283216 +692.34221 0.16748802 +725.32616 1.4988105 +801.37547 0.044795677 +830.42559 0.39362149 +851.46246 0.14035123 +1280.5697 0.06151552 +END IONS + +BEGIN IONS +TITLE=50: Scan 620 (rt=17.6564, f=3, i=18) [F:\Distiller Data\Lab212\Nitrosylation\YiJu\100512_SNOCRC\YJC_100327SNOCRC_B11b372_N02.raw] +PEPMASS=663.29923 7314 +CHARGE=2+ +SCANS=620 +RTINSECONDS=1059.382 +102.06541 0.016850165 +110.06493 0.017672122 +118.03928 0.050266389 +119.06763 0.022399351 +126.06059 0.05560639 +127.06702 0.034007468 +129.10353 0.10236327 +132.05529 0.049058617 +136.05273 0.021021776 +141.08139 0.037404781 +147.10484 0.03758411 +169.09204 0.025350679 +173.1122 0.024775517 +175.11696 0.054544243 +181.10313 0.017957699 +182.07267 0.033262758 +185.09058 0.065169814 +187.07976 0.024211899 +191.14629 0.018495929 +193.09902 0.031227025 +195.08537 0.037264398 +199.11362 0.044998016 +201.12459 0.043114215 +207.0656 0.062266649 +208.08324 0.026930565 +215.1356 0.019763673 +221.09197 0.020689173 +223.11038 0.09002766 +225.10233 0.086448893 +226.12336 0.064159718 +227.10698 0.027841526 +231.12444 0.064735075 +237.1068 0.045401593 +243.09686 0.1387071 +245.07487 0.021409335 +251.08658 0.04570468 +252.07912 0.016642974 +268.11415 0.19315716 +270.13258 0.5314258 +276.20144 0.063828683 +284.12977 0.051693626 +286.12922 1.0753668 +288.1395 0.14640585 +291.06865 1.9115927 +305.11813 0.08511192 +308.13021 0.043375927 +310.13865 0.1047497 +312.15342 0.024176455 +330.17322 0.073666756 +332.17335 0.15206597 +341.02152 0.1628375 +341.23003 0.57133333 +345.16988 0.036037525 +348.16666 0.24794668 +373.19489 0.088659887 +375.21675 0.9283697 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+PEPMASS=502.24958 9660 +CHARGE=2+ +SCANS=623 +RTINSECONDS=1064.335 +101.07691 0.025459649 +102.05885 0.033859686 +110.08049 0.066586927 +113.07537 0.03614693 +116.07269 0.020083998 +120.08194 0.04076211 +129.10251 0.32325196 +130.08694 0.038880268 +133.05946 0.037477265 +136.0799 0.034345064 +141.08435 0.019628443 +143.12892 0.020916382 +147.10697 0.22436924 +149.04646 0.11072301 +154.0872 0.032546855 +157.13118 0.08181857 +158.08106 0.025391667 +170.05513 0.03072214 +172.06513 0.040052821 +173.10758 0.038193407 +175.12391 0.074718287 +185.12494 0.082408493 +186.08598 0.037008866 +187.11458 0.07707592 +199.1063 0.096813428 +209.09761 0.072659006 +216.10396 0.10032836 +218.14616 0.026335174 +221.0899 0.090849961 +222.10452 0.051129572 +225.11315 0.049985258 +226.12369 0.079186793 +227.09445 0.30892845 +232.16445 0.049404831 +235.09414 0.060820783 +237.12365 0.078671158 +240.13474 0.061262239 +244.14993 0.12636915 +262.13868 0.05676388 +270.13387 2.2981383 +272.1376 0.27434615 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+PEPMASS=527.60406 10676 +CHARGE=2+,3+,4+,5+ +SCANS=624 +RTINSECONDS=1065.566 +101.0762 0.02922154 +102.06023 0.029061052 +110.07244 0.091717335 +112.08288 0.022126138 +127.0633 0.030512762 +129.10146 0.43368934 +130.08959 0.093600419 +131.08813 0.035419374 +132.0573 0.06907496 +136.08269 0.03139538 +141.07821 0.066709025 +143.123 0.040944264 +147.11828 0.098642035 +148.06483 0.026361542 +149.04646 0.026513624 +155.08814 0.04883834 +158.0934 0.027357065 +159.0836 0.049091392 +167.10154 0.040449668 +169.12812 0.058927507 +171.1174 0.050028085 +173.12501 0.047566512 +175.12664 0.094007433 +181.1093 0.023676122 +187.10486 0.10383327 +193.08714 0.056798528 +197.13128 0.052530713 +200.13961 0.071722006 +202.05449 0.031252115 +204.13438 0.028140694 +209.10779 0.032334222 +212.10914 0.025464604 +213.08769 0.040224524 +218.15526 0.026408039 +221.08914 0.059233861 +223.10516 0.04345176 +226.12361 0.14614332 +227.09145 0.23128409 +235.13455 0.020303458 +237.13786 0.063331739 +239.14057 0.028731628 +240.12834 0.062156126 +243.0844 0.065814089 +244.14192 0.14914521 +246.16643 0.039307077 +258.15839 0.061666104 +261.14378 0.030844865 +262.63601 0.17091233 +270.13316 1.3551627 +272.13796 0.18771574 +276.17311 0.05374824 +281.05661 0.57610291 +283.05279 0.082241007 +286.13801 0.21243897 +315.17486 0.045811542 +329.19522 0.045315598 +332.17535 0.34228816 +333.13718 0.051643126 +337.18459 0.040610025 +341.20111 0.15394177 +351.1801 0.13085814 +373.19371 0.11670886 +375.21119 0.54496667 +387.21514 0.12369334 +391.19757 0.24054659 +397.19775 1.0916262 +413.16242 1.6795945 +419.18503 0.4445158 +433.22894 0.55174732 +446.26003 0.13976472 +457.23559 0.20000128 +463.21171 0.96931517 +473.2115 0.20615744 +518.27361 2.3351948 +529.27054 1.016953 +531.27991 1.4358843 +534.26875 1.3447655 +536.28824 3.1504067 +538.26925 1.0190533 +539.29344 0.8408326 +598.2888 0.55818206 +641.7972 0.52240145 +701.37433 0.80450647 +741.37046 0.27903076 +880.4455 0.27425354 +916.4659 0.16147797 +END IONS + +BEGIN IONS +TITLE=53: Scan 625 (rt=17.7799, f=4, i=18) [F:\Distiller Data\Lab212\Nitrosylation\YiJu\100512_SNOCRC\YJC_100327SNOCRC_B11b372_N02.raw] +PEPMASS=523.78196 10855 +CHARGE=2+ +SCANS=625 +RTINSECONDS=1066.797 +102.05781 0.047968317 +110.07144 0.11439056 +120.08199 0.032198097 +128.08962 0.034057728 +129.1042 0.53318801 +130.08895 0.081135758 +132.05331 0.073495231 +133.06019 0.040628575 +136.08448 0.034825285 +141.0733 0.0723194 +143.11997 0.051578973 +147.07514 0.028779891 +147.1168 0.18332641 +149.07318 0.042576495 +159.0785 0.055296657 +167.09137 0.057684759 +171.10821 0.099175292 +175.06485 0.10427751 +175.13264 0.15011454 +177.08706 0.034956746 +184.11063 0.03136845 +186.09144 0.057594285 +187.08323 0.054555182 +193.09152 0.062976654 +195.0903 0.03999974 +197.1294 0.18284068 +200.1473 0.10310062 +201.1273 0.29905468 +207.11278 0.036467603 +209.10472 0.083716166 +213.09466 0.066386243 +221.08842 0.041328051 +227.09325 0.46061649 +229.12733 0.074788685 +235.13957 0.058446136 +236.13075 0.036928046 +237.11121 0.0439684 +243.07962 0.072949737 +244.14093 0.12439443 +245.09978 0.05306875 +254.14508 0.054318583 +255.14372 0.07252201 +258.15562 0.15693568 +261.16056 0.070538229 +262.63818 0.11488636 +270.13426 2.2448622 +272.13807 0.11327226 +275.18429 0.050425992 +276.15278 0.0972623 +281.05532 0.19050412 +282.04351 0.074935376 +283.05726 0.10671376 +285.13544 0.094768611 +286.12713 0.42247481 +294.16903 0.055209643 +301.15839 0.074411757 +309.14983 0.029904609 +314.15492 0.044446501 +326.19293 0.098830331 +332.17239 0.59475375 +334.16655 0.058236576 +348.16704 0.06935953 +351.17806 0.11281292 +375.20547 0.98383509 +387.20744 0.18681361 +391.20242 0.31003492 +397.19889 0.91820801 +399.20902 0.14426414 +409.72112 0.17638693 +413.16375 1.7653531 +419.17427 0.39167246 +433.22356 0.20319061 +454.20902 0.19956115 +457.22415 0.27666282 +463.21779 0.52349122 +466.26777 0.24570148 +488.25456 0.28786409 +515.27434 0.36874822 +518.27489 0.64374054 +522.27766 1.1083193 +523.78167 1.9126072 +530.27946 0.86702336 +534.27721 0.86372549 +535.27755 0.45839685 +536.28394 0.70977515 +589.30132 0.28447586 +644.3706 0.2954158 +701.35893 0.60736927 +777.44378 0.40629644 +818.44631 0.68319902 +900.47705 0.2537424 +987.46599 0.13072731 +1086.458 0.13292174 +END IONS + +BEGIN IONS +TITLE=54: Scan 627 (rt=17.842, f=2, i=22) [F:\Distiller Data\Lab212\Nitrosylation\YiJu\100512_SNOCRC\YJC_100327SNOCRC_B11b372_N02.raw] +PEPMASS=458.23621 20574 +CHARGE=2+,3+,4+,5+ +SCANS=627 +RTINSECONDS=1070.519 +101.08248 0.061214499 +110.06765 0.083077252 +112.09339 0.043615572 +115.09166 0.037542678 +120.08273 0.041721227 +126.06121 0.13274911 +127.08854 0.059670283 +129.10338 0.42485952 +130.08298 0.086518993 +132.0512 3.3599703 +134.04871 0.18455562 +136.07759 0.09707089 +139.07879 0.025789355 +143.13146 0.027621289 +147.11587 0.21846599 +149.13455 0.058549136 +151.08431 0.037126485 +155.08771 0.092417999 +158.0977 0.050525036 +159.09375 0.029405094 +166.06589 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0.36611646 +369.19444 0.13684473 +375.21158 1.8682965 +377.22008 0.13208854 +385.20363 0.27698397 +387.21014 0.18928856 +391.20627 0.40987203 +401.20194 0.25445375 +412.20945 0.14197661 +413.19358 0.29512236 +415.21535 0.4932084 +420.21801 0.11883638 +432.22937 0.16383277 +439.20694 0.29924682 +444.23657 0.66177069 +445.20389 2.0321903 +458.25426 2.0709547 +463.21487 13.575979 +467.14546 2.1890673 +470.24829 0.72810849 +486.23909 0.1528933 +533.25096 0.16867105 +583.28191 0.17726971 +666.31224 0.29516411 +709.33594 0.076367912 +789.41134 0.15878893 +END IONS + +BEGIN IONS +TITLE=55: Scan 628 (rt=17.8625, f=3, i=20) [F:\Distiller Data\Lab212\Nitrosylation\YiJu\100512_SNOCRC\YJC_100327SNOCRC_B11b372_N02.raw] +PEPMASS=423.21206 14684 +CHARGE=2+ +SCANS=628 +RTINSECONDS=1071.75 +100.071 0.029290486 +101.07793 0.26038467 +102.05467 0.035472407 +105.06702 0.15358049 +106.08319 0.085622781 +107.09108 0.033417944 +110.07206 0.10075965 +111.05454 0.052459718 +112.09376 0.039927919 +113.07347 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0.62184872 +429.19766 1.7109664 +431.19687 0.96685686 +432.23877 2.9706935 +443.24321 0.19506896 +446.2454 0.35299377 +449.20468 0.29633083 +458.25729 0.42640178 +461.26687 0.50349441 +465.17804 0.27238332 +472.23518 0.67315624 +473.22948 0.43229052 +503.29931 0.33667669 +513.1976 0.3634322 +516.76065 0.31093953 +520.28213 0.41875551 +527.77753 0.38828252 +529.29647 0.21990923 +538.28395 0.43568353 +560.28584 0.23112071 +563.32405 0.69976386 +566.34733 0.49792297 +577.31268 0.91303877 +591.33574 0.36987078 +620.35095 0.32484263 +637.32425 0.89121403 +640.32028 0.19953511 +680.34243 0.13229212 +684.33249 0.21378451 +730.36797 0.21385249 +END IONS + +BEGIN IONS +TITLE=56: Scan 629 (rt=17.883, f=4, i=19) [F:\Distiller Data\Lab212\Nitrosylation\YiJu\100512_SNOCRC\YJC_100327SNOCRC_B11b372_N02.raw] +PEPMASS=573.31561 9309 +CHARGE=2+ +SCANS=629 +RTINSECONDS=1072.981 +101.07893 0.02985496 +102.04764 0.025956458 +110.07454 0.13058004 +112.09619 0.036324117 +114.09426 0.022591165 +120.08671 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1.3260259 +649.2842 0.44273026 +675.37305 0.44275572 +677.34983 0.73692246 +686.35375 0.54505909 +696.27662 1.126298 +739.3166 0.41346538 +760.38736 0.31642757 +911.42095 0.24940882 +940.37846 0.20396257 +965.39738 0.38974375 +983.41485 0.21474124 +1011.4362 0.093111902 +END IONS + +BEGIN IONS +TITLE=59: Scan 634 (rt=17.9989, f=4, i=20) [F:\Distiller Data\Lab212\Nitrosylation\YiJu\100512_SNOCRC\YJC_100327SNOCRC_B11b372_N02.raw] +PEPMASS=501.74731 12768 +CHARGE=2+,3+,4+,5+ +SCANS=634 +RTINSECONDS=1079.935 +101.0842 0.050213291 +102.0612 0.033174105 +110.07705 0.12605763 +112.08745 0.035659534 +120.08003 0.04644994 +126.05999 0.095132321 +129.10336 0.4107615 +132.04912 0.097900108 +133.05321 0.032683292 +136.08201 0.079730806 +141.0863 0.046385587 +145.09437 0.03281336 +147.10626 0.19512642 +149.04185 0.11063025 +151.05907 0.032401332 +157.11451 0.068098158 +166.07001 0.033971356 +170.06752 0.03670876 +171.07829 0.054864079 +175.12411 0.20139657 +188.09481 0.039682476 +201.12472 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2.3707987 +473.23022 0.39569547 +478.21975 0.56898128 +496.22483 3.2666659 +516.23204 0.50894002 +520.27948 0.2741317 +544.30776 0.19526388 +547.31777 0.3850236 +551.30039 0.22539806 +569.32363 0.32490553 +579.31819 0.30071441 +583.31753 0.33452706 +599.2943 0.41484784 +601.31132 0.85549374 +724.33034 0.34938559 +768.36617 0.48358126 +938.45436 0.095861561 +END IONS + +BEGIN IONS +TITLE=61: Scan 637 (rt=18.0815, f=3, i=22) [F:\Distiller Data\Lab212\Nitrosylation\YiJu\100512_SNOCRC\YJC_100327SNOCRC_B11b372_N02.raw] +PEPMASS=713.82777 6459 +CHARGE=2+ +SCANS=637 +RTINSECONDS=1084.889 +101.08305 0.01332996 +110.06962 0.021613357 +116.08262 0.031086486 +118.09469 0.018383156 +129.10645 0.11924122 +130.10021 0.059868762 +132.05403 0.12029811 +136.07322 0.029801323 +147.11641 0.063863183 +155.09119 0.027051043 +175.11435 0.044280943 +181.05939 0.016515417 +185.05782 0.014609728 +193.10375 0.016944401 +195.09469 0.019126682 +216.10945 0.12069666 +218.15713 0.068512295 +226.10475 0.02056769 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IONS +TITLE=62: Scan 638 (rt=18.102, f=4, i=21) [F:\Distiller Data\Lab212\Nitrosylation\YiJu\100512_SNOCRC\YJC_100327SNOCRC_B11b372_N02.raw] +PEPMASS=558.2807 14377 +CHARGE=2+ +SCANS=638 +RTINSECONDS=1086.12 +101.07316 0.076925031 +106.08401 0.034360955 +110.07289 0.16658744 +112.08323 0.050967974 +115.08837 0.0708523 +126.05797 0.072690247 +129.10498 0.58545032 +130.08801 0.22630236 +132.05144 0.15764524 +133.05697 0.04456046 +136.08319 0.064207277 +139.09016 0.040651577 +141.06669 0.058225633 +143.11955 0.083111113 +147.11664 0.2453819 +149.13631 0.0465582 +151.09214 0.043661299 +153.07404 0.04122987 +156.08168 0.055532597 +157.10715 0.04009804 +159.08434 0.06036446 +166.06976 0.041183156 +167.09998 0.06015135 +169.10658 0.051222559 +173.10505 0.073903278 +175.12433 0.22184086 +177.09582 0.045134329 +183.08602 0.045692155 +187.08156 0.14341343 +189.08906 0.057741519 +195.09382 0.13625289 +197.1315 0.067184629 +201.12436 0.051518702 +209.08511 0.033614834 +211.11803 0.035761818 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0.26584953 +639.32844 1.4991826 +643.28807 1.3740517 +647.35798 0.76656774 +657.33344 8.5901606 +665.35898 1.2149535 +672.34339 0.82882866 +682.37813 0.42660457 +700.36981 1.4116796 +726.38157 1.0412528 +752.36532 0.88983977 +755.43085 5.465289 +780.34556 1.8846184 +789.41173 2.1134459 +798.37156 1.0663108 +802.34069 0.36515557 +829.41278 10.427397 +END IONS + +BEGIN IONS +TITLE=66: Scan 645 (rt=18.2876, f=3, i=24) [F:\Distiller Data\Lab212\Nitrosylation\YiJu\100512_SNOCRC\YJC_100327SNOCRC_B11b372_N02.raw] +PEPMASS=430.7196 114095 +CHARGE=2+ +SCANS=645 +RTINSECONDS=1097.256 +100.07726 0.15201084 +101.07326 11.97988 +106.08822 0.30074779 +110.07377 0.31027549 +115.08973 3.4060506 +118.03375 0.71491755 +125.07364 1.1700743 +129.10207 0.84567072 +130.08973 0.44637553 +136.08065 0.21988692 +139.08775 0.21314937 +145.10043 0.26341442 +147.11728 0.59091349 +148.10192 0.18690457 +149.0512 0.18618264 +149.13099 0.62820331 +158.09801 0.18671065 +159.11776 0.30263063 +161.12329 0.24456907 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0.4578972 +665.36724 2.8834298 +672.33142 0.6179794 +698.34457 0.8843078 +708.40776 0.43210271 +726.3861 0.8134828 +729.43078 0.36788457 +755.42361 4.1403829 +769.39522 0.31003824 +789.415 2.0225102 +829.4132 7.6147854 +831.40862 1.0400898 +END IONS + +BEGIN IONS +TITLE=68: Scan 649 (rt=18.3907, f=3, i=25) [F:\Distiller Data\Lab212\Nitrosylation\YiJu\100512_SNOCRC\YJC_100327SNOCRC_B11b372_N02.raw] +PEPMASS=609.30884 16577 +CHARGE=2+ +SCANS=649 +RTINSECONDS=1103.44 +101.0766 0.046757005 +102.06401 0.047002841 +110.07277 0.10984777 +118.03498 0.10490667 +120.08073 0.070290124 +126.06111 0.08121388 +127.09996 0.049029571 +129.10236 0.43403539 +130.09201 0.10499536 +132.0582 0.15756219 +133.06938 0.094928854 +136.07641 0.069338999 +141.10168 0.077389432 +143.11926 0.047742805 +145.0778 0.04441783 +147.1164 0.13239787 +149.10205 0.10176241 +155.09507 0.082902895 +159.09704 0.08818808 +167.1018 0.11156621 +169.11714 0.080043309 +171.08753 0.053873138 +173.12369 0.059153456 +175.12232 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35.289507 +434.2324 15.941066 +438.21553 1.7659017 +446.25089 1.1247923 +449.20434 1.0544645 +451.19262 0.7693656 +458.25319 0.57661784 +460.26277 1.2964184 +470.24715 0.38130112 +486.25265 0.74917951 +500.26643 0.72474923 +520.29038 0.6813244 +522.23453 1.0072573 +524.26614 0.3564879 +529.2804 0.77874931 +545.3152 0.58480716 +563.33554 6.5014715 +581.30179 1.1714994 +584.27527 1.185631 +589.29612 0.72245919 +591.33358 1.9956578 +605.33995 1.1121228 +634.36647 0.48687324 +674.34392 0.65055995 +745.36552 0.34690405 +789.40755 0.59194026 +END IONS + +BEGIN IONS +TITLE=72: Scan 654 (rt=18.5142, f=4, i=25) [F:\Distiller Data\Lab212\Nitrosylation\YiJu\100512_SNOCRC\YJC_100327SNOCRC_B11b372_N02.raw] +PEPMASS=741.353 13032 +CHARGE=2+ +SCANS=654 +RTINSECONDS=1110.854 +110.07878 0.026687844 +118.03765 0.054258558 +126.05934 0.026323317 +129.10246 0.088479244 +130.08639 0.028202991 +132.04739 0.077947497 +136.06957 0.025048897 +143.12427 0.051343409 +147.10694 0.03245081 +159.09466 0.040706551 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0.1428319 +248.16808 0.24580549 +255.15448 0.17702709 +260.20009 0.36817949 +263.14653 0.11727689 +270.10127 1.30036 +270.13659 10.130165 +272.11833 0.44290856 +272.17633 4.2377443 +276.17116 0.24989667 +282.13117 0.45281718 +284.14835 0.26959247 +286.13059 0.7717983 +288.13635 0.16323634 +298.15471 0.28780887 +302.08973 0.28458637 +310.12463 0.25632863 +312.15064 0.67402507 +316.18104 0.14856301 +331.21686 0.42141232 +332.17303 2.2877747 +334.16816 0.30561757 +341.0254 5.0072956 +341.18045 0.68082243 +343.02292 1.1831309 +345.23257 0.42480153 +348.17029 0.40172525 +363.19903 0.23646637 +369.19389 0.51500983 +375.21356 15.061805 +377.21159 1.1028932 +387.21181 38.909932 +389.21318 3.0131769 +391.21127 1.0435517 +399.22363 0.71603735 +401.22512 1.8308991 +415.20789 1.0975087 +425.24879 1.357612 +433.2211 1.1666264 +443.19135 20.003383 +446.23648 139.35991 +447.27566 15.296065 +448.2491 24.917329 +449.23816 11.103345 +452.23261 2.7942828 +454.22198 11.319658 +458.23879 0.63299426 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0.092000306 +355.18068 0.14901012 +357.19828 0.2253124 +364.15292 0.090146086 +372.19645 0.17370285 +375.2123 1.9125694 +377.20923 0.37659583 +387.2156 0.11466565 +391.20705 0.63525487 +412.20463 0.20078051 +415.21741 0.27025296 +431.21302 0.30433771 +445.21044 0.64103868 +457.22061 0.86478471 +459.22607 0.50519026 +463.21316 8.0484803 +465.21101 0.93708206 +466.7366 0.45852389 +469.23286 0.45092106 +473.22426 0.72127638 +475.24249 0.35533304 +476.23696 0.4874366 +485.19993 0.4955967 +502.26802 0.16725028 +513.27821 0.54301634 +570.27758 0.40295327 +589.2917 1.45722 +637.24896 0.49855545 +660.28376 0.66018588 +690.33818 1.3926488 +695.34207 1.5553434 +700.37546 7.098352 +703.34865 2.267848 +707.35307 1.9487197 +887.47605 0.5617695 +929.48733 2.166205 +931.47149 13.768695 +934.44315 2.8667748 +949.51296 1.4038376 +951.47955 4.6897842 +END IONS + +BEGIN IONS +TITLE=75: Scan 658 (rt=18.6172, f=4, i=26) [F:\Distiller Data\Lab212\Nitrosylation\YiJu\100512_SNOCRC\YJC_100327SNOCRC_B11b372_N02.raw] +PEPMASS=627.64211 26998 +CHARGE=3+ +SCANS=658 +RTINSECONDS=1117.034 +101.07768 0.052742953 +110.08086 0.084114849 +119.09007 0.063308875 +129.10442 0.36288851 +130.09388 0.13580256 +132.05118 0.49956531 +136.07969 0.069408199 +141.0838 0.058833264 +143.10671 0.055579447 +147.11368 0.31931924 +157.10915 0.05606963 +166.07195 0.090535468 +167.09814 0.051465431 +173.11161 0.19603329 +175.12426 0.23787225 +183.09913 0.066379646 +187.14078 0.19182878 +195.09266 0.092559595 +200.13342 0.16370373 +201.11397 0.10258765 +207.12389 0.092606096 +213.09427 0.082119463 +215.14233 0.17724182 +217.10119 0.090696672 +218.14745 0.097880658 +225.14399 0.04835783 +227.08184 0.31682234 +229.11749 0.10442427 +232.12785 0.058519929 +234.12924 0.13552734 +235.12273 0.3059983 +236.16066 0.065735342 +237.13174 0.14571812 +242.15175 0.13798274 +246.17001 0.10123279 +258.14016 0.13473541 +262.09541 0.25476067 +270.13369 6.1724953 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