Mercurial > repos > galaxyp > pepquery2

comparison test-data/iTRAQ_f4.mgf @ 0:a07976bbc4d9 draft

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planemo upload for repository https://github.com/galaxyproteomics/tools-galaxyp/tree/master/tools/pepquery2 commit 00e1b1770d0b1f9fe31384b37b55f7ae9d97b597
author galaxyp
date Sun, 06 Nov 2022 16:25:25 +0000
parents
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comparison
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-1:000000000000 0:a07976bbc4d9
1 COM=Conversion to mascot generic
2 CHARGE=2+ and 3+
3 BEGIN IONS
4 PEPMASS=740.462952
5 CHARGE=3+
6 SCANS=277
7 TITLE=Mo_Tai_iTRAQ_f4.00277.00277.3
8 111.017494 85.198502
9 112.240982 97.204994
10 114.110542 168.274780
11 115.107582 369.265503
12 115.650398 84.005325
13 117.296082 86.641182
14 117.595589 82.974037
15 120.657990 81.247025
16 123.208023 88.939392
17 126.714996 76.470490
18 126.995316 81.651260
19 129.369080 82.580246
20 129.410400 90.817963
21 132.734039 124.614685
22 143.307465 87.847046
23 178.966888 94.961578
24 179.972855 89.878273
25 183.256714 104.533241
26 188.080093 123.015953
27 212.102753 442.314178
28 213.104324 84.621696
29 233.001801 107.842552
30 244.242355 102.163200
31 281.079132 97.696259
32 291.216034 243.588058
33 309.183807 104.681831
34 325.188324 282.187622
35 345.226288 167.099777
36 347.629883 88.744476
37 357.377533 105.747673
38 388.266266 1321.324341
39 430.317047 94.113419
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41 489.807434 100.114334
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43 501.355072 164.809708
44 517.545532 119.780251
45 529.344849 395.354340
46 529.599487 100.128220
47 535.189514 101.317970
48 657.405518 110.483780
49 699.552063 101.576553
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51 752.286011 111.876389
52 756.181641 93.424118
53 771.447876 505.619843
54 776.288391 100.766472
55 804.153748 99.673531
56 840.959473 131.680695
57 870.515198 596.371582
58 871.524719 224.175797
59 938.853760 112.032951
60 983.596008 538.290894
61 985.851929 109.672272
62 999.183228 110.428818
63 1006.435791 110.520103
64 1098.597168 117.997414
65 1102.095825 108.774673
66 1154.624023 115.541344
67 1179.853027 115.300293
68 1188.129639 112.100708
69 1328.742920 120.317390
70 1535.381592 114.408516
71 1578.387207 112.895355
72 1696.229492 122.310112
73 1865.684937 119.336388
74 1891.318359 108.014870
75 END IONS
76 BEGIN IONS
77 PEPMASS=596.816895
78 CHARGE=2+
79 SCANS=3419
80 TITLE=Mo_Tai_iTRAQ_f4.03419.03419.2
81 112.086548 2060.700684
82 113.070908 591.413391
83 114.110237 56227.753906
84 115.107254 40715.632813
85 116.110573 1253.002075
86 124.087646 334.579498
87 129.065491 335.658569
88 129.682831 322.525909
89 130.096924 432.119598
90 135.059509 290.456573
91 135.933548 316.717255
92 141.158234 324.162384
93 143.102081 1042.657227
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102 157.107681 821.452209
103 158.092041 3474.361572
104 163.116852 649.046387
105 163.123260 573.363525
106 163.860764 368.470825
107 172.107132 547.236511
108 173.091751 424.643494
109 173.713470 325.451202
110 174.132874 1181.682129
111 174.138977 1457.565674
112 175.118500 19209.625000
113 176.121841 895.593079
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115 185.090881 577.591370
116 185.163925 667.431763
117 189.086395 384.102600
118 193.535583 299.085999
119 198.085999 304.650818
120 202.127197 776.504089
121 202.133865 1047.345337
122 205.158951 325.465912
123 206.438217 407.963379
124 215.112625 944.689087
125 216.097275 349.972809
126 216.178452 628.929138
127 216.187073 1542.270264
128 218.158371 710.665344
129 219.997772 493.154785
130 226.117889 345.579254
131 227.530579 380.890015
132 229.117340 398.719696
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142 246.153458 2635.449219
143 246.159882 2076.769775
144 255.143784 947.695679
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147 268.138641 800.600464
148 269.122375 665.910522
149 269.220001 322.280029
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151 271.523804 335.527252
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191 404.777496 526.729858
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207 497.196106 873.354187
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209 503.294342 597.645569
210 511.149689 353.095825
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216 548.277344 1113.044312
217 558.261963 1086.223267
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219 560.315735 580.912170
220 562.276917 335.608765
221 564.272888 702.601379
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223 565.308411 432.052307
224 566.312805 402.429840
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226 576.274780 1495.794922
227 577.275513 370.333984
228 579.258240 488.650421
229 586.329773 924.428833
230 586.824341 763.742798
231 587.328796 1918.114868
232 587.812134 2967.306152
233 588.309631 1265.537964
234 594.755310 400.626099
235 595.833008 10111.694336
236 596.332397 7990.095215
237 596.816284 25143.017578
238 597.162964 543.470703
239 597.319031 6673.245117
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242 617.357422 1058.755737
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246 648.339661 426.476868
247 658.327637 1623.402832
248 659.310608 1560.553711
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250 677.323730 1165.182739
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266 778.363281 793.077942
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268 788.440674 369.447174
269 789.358887 436.979340
270 797.422058 949.151123
271 801.456482 2018.613281
272 802.453003 1038.883423
273 805.359070 696.158020
274 806.363647 7031.405762
275 807.365295 934.853821
276 833.400391 617.893799
277 847.425964 2543.552246
278 848.427246 772.212708
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286 889.477844 696.127258
287 901.470032 1463.045898
288 902.496460 1266.257813
289 903.503845 698.129333
290 904.442261 1038.665894
291 905.432617 2050.675537
292 919.481445 17119.210938
293 920.485657 3316.843506
294 927.563293 359.592102
295 930.460938 851.465942
296 931.465820 651.002625
297 946.600769 384.072571
298 948.455444 5336.049805
299 948.531555 1947.049316
300 949.462769 3090.331299
301 982.512085 809.105103
302 989.529297 2285.907715
303 990.528381 1016.524780
304 1002.532959 606.857239
305 1004.502136 1042.749634
306 1005.535583 806.390625
307 1016.546387 611.005005
308 1018.514465 890.451599
309 1028.542358 881.013977
310 1029.543945 751.198486
311 1030.513184 4668.985840
312 1031.514404 1352.692383
313 1031.903931 531.207397
314 1046.556763 10195.110352
315 1047.549683 10636.351563
316 1048.524292 27357.046875
317 1049.521240 6269.379395
318 1050.536743 817.544556
319 1058.510132 602.429749
320 1059.512817 806.930664
321 1074.545654 670.111877
322 1111.347778 383.419983
323 1135.563232 590.543945
324 1191.850830 385.573975
325 1199.484863 378.615051
326 END IONS
327 BEGIN IONS
328 PEPMASS=596.819946
329 CHARGE=2+
330 SCANS=4266
331 TITLE=Mo_Tai_iTRAQ_f4.04266.04266.2
332 112.086632 6256.541992
333 113.106850 1200.777588
334 114.110283 291903.562500
335 115.107292 205773.750000
336 116.070198 9381.364258
337 118.625160 1156.606079
338 121.846268 1173.889160
339 125.281631 1188.704590
340 125.512619 1180.603516
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347 145.112564 51772.304688
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355 159.076263 1429.104614
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363 176.121765 4773.125488
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365 186.087280 2240.476807
366 188.765823 1949.310425
367 197.055084 1148.568359
368 201.086807 1300.619141
369 204.149704 4709.141113
370 215.261887 1138.700195
371 216.096863 2107.551758
372 229.128571 2454.522217
373 232.146118 11049.886719
374 235.964767 1241.629761
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376 246.154465 35329.953125
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380 271.175903 15609.878906
381 272.144226 2525.952148
382 272.179108 1290.274536
383 274.153015 49036.832031
384 275.149841 1420.499634
385 275.158844 2601.916016
386 282.143555 1384.911743
387 287.134125 2822.687256
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389 288.202240 7083.480469
390 299.169952 3699.752686
391 303.176483 4045.447021
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393 315.129456 2996.855469
394 317.192169 3992.310791
395 317.232452 2488.542480
396 324.201965 3728.532471
397 327.216888 1340.828613
398 328.181183 1415.114990
399 328.658539 1123.353027
400 332.220734 1271.077026
401 339.128540 1531.501343
402 341.227722 2042.626709
403 342.177856 4745.867676
404 342.213135 5806.857422
405 342.680176 1253.430786
406 345.227722 6977.128906
407 346.227631 1417.045288
408 351.181580 2593.887451
409 355.195465 1410.892944
410 359.239166 131598.187500
411 360.241974 7494.800781
412 371.703064 1232.090332
413 372.227325 1063.592041
414 374.165833 1593.182251
415 378.128571 1477.884521
416 379.190033 2009.720215
417 383.951935 1167.295410
418 385.217102 2160.023926
419 387.088654 1181.940674
420 387.237122 17242.986328
421 388.270752 2137.781494
422 399.691681 1897.866455
423 402.981964 1403.929321
424 410.200531 1473.366943
425 412.146576 2755.270752
426 416.178741 2011.218384
427 416.264343 8740.199219
428 418.226563 1685.087158
429 418.503876 1317.556885
430 420.906189 1468.914551
431 428.260590 10760.098633
432 435.430603 1235.131470
433 439.228638 3462.746582
434 443.721893 2301.887451
435 444.259033 19408.619141
436 445.910492 1555.476196
437 446.234131 4515.197266
438 452.213654 2224.779785
439 453.244629 1466.538086
440 456.254028 11374.475586
441 457.236298 6505.964355
442 460.252441 5049.501953
443 461.199280 2477.136963
444 461.257202 1220.848389
445 473.282104 2383.668213
446 474.265259 18389.148438
447 474.347229 1335.815796
448 475.268738 1576.179443
449 487.300934 3418.517334
450 497.238434 1320.483154
451 501.193390 2363.973633
452 501.281799 2294.974609
453 503.293304 5307.897461
454 506.236969 2415.770264
455 507.221161 2141.243408
456 513.280212 8979.766602
457 513.520874 1255.733276
458 515.397583 1283.797607
459 518.220520 2333.504883
460 524.244141 2337.022705
461 531.288818 12616.497070
462 532.292053 2919.514648
463 543.240479 2208.620361
464 557.302246 2227.384277
465 558.287842 2620.560791
466 564.282898 3061.575439
467 564.783386 2126.333008
468 567.635071 1528.431152
469 572.318420 3588.414307
470 574.332886 6353.251953
471 575.275513 2038.389526
472 575.317810 3120.288818
473 575.813110 1280.671021
474 578.257324 2028.924072
475 578.808960 2204.031494
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477 586.805847 4880.877441
478 587.321655 10993.145508
479 587.815430 4840.189453
480 588.315308 3987.762451
481 590.326782 4101.055176
482 595.808716 13652.512695
483 596.326172 56460.394531
484 596.820496 73703.304688
485 597.325012 10493.157227
486 600.311584 11091.863281
487 603.256470 1375.655518
488 614.278687 3044.310303
489 617.342529 2611.205322
490 618.321533 11686.435547
491 620.278381 2692.279785
492 631.304932 3489.041748
493 642.333923 1463.009766
494 643.356995 2144.768555
495 657.334106 2211.700439
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507 719.369812 5286.986328
508 731.363892 6544.432617
509 732.374146 3260.844238
510 735.998413 1453.624878
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518 773.555115 1370.550049
519 775.356812 6727.154297
520 776.364441 2762.483398
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522 789.387451 2614.257813
523 805.414490 59632.191406
524 806.403381 47422.496094
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526 815.398743 5865.412109
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528 818.412598 1527.970459
529 828.385437 4316.563477
530 832.396667 2064.102783
531 833.411438 12668.332031
532 834.397095 17313.691406
533 835.401672 3613.251709
534 836.389221 3638.201172
535 837.386047 2715.394531
536 846.392822 13464.495117
537 847.398560 4506.627441
538 854.086304 1410.738037
539 859.436096 1434.342163
540 869.417786 2140.526367
541 874.438904 2894.846924
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543 877.441833 3256.387451
544 884.456360 2767.287598
545 886.439087 2288.198242
546 887.428406 2524.863770
547 900.501099 5556.912598
548 901.481323 4092.769531
549 902.469177 2563.342041
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551 905.443420 9426.941406
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553 918.500122 65733.820313
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555 920.492371 10120.558594
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557 959.473206 8787.570313
558 960.478210 5710.833496
559 970.508484 1540.445313
560 983.451904 7412.620117
561 984.465027 4973.284180
562 986.509155 2271.588623
563 1003.521057 3541.061523
564 1004.511292 2234.473145
565 1012.509521 4455.150879
566 1013.487671 2531.277588
567 1017.535645 3410.644043
568 1018.537476 2418.473877
569 1028.498779 9095.230469
570 1029.529297 14408.421875
571 1030.519287 22318.728516
572 1031.523926 3820.234375
573 1046.506348 27647.564453
574 1047.543335 99298.734375
575 1048.535767 93244.648438
576 1049.536743 15710.309570
577 1059.525513 2875.163330
578 END IONS
579 BEGIN IONS
580 PEPMASS=593.990784
581 CHARGE=3+
582 SCANS=8055
583 TITLE=Mo_Tai_iTRAQ_f4.08055.08055.3
584 110.070747 1733.929932
585 112.086494 691.703613
586 114.110207 40570.949219
587 115.107246 29732.470703
588 116.110382 1231.719482
589 116.696106 632.937317
590 117.730354 471.628967
591 124.086235 1593.573853
592 127.085846 719.726074
593 127.191467 500.313782
594 129.064926 511.926025
595 129.129395 1360.861450
596 136.075058 651.347961
597 137.249298 489.442627
598 143.102310 528.153137
599 143.108459 983.870300
600 145.106354 5602.307617
601 145.112564 9344.262695
602 155.080536 649.520813
603 158.091660 1477.552002
604 162.132690 594.649658
605 162.139435 534.015381
606 173.417542 600.326477
607 175.118454 8973.086914
608 176.120972 555.123108
609 178.371323 511.018158
610 183.148560 607.971863
611 186.086960 652.429138
612 188.148453 816.252747
613 188.154907 1523.843628
614 199.106628 571.695862
615 206.436493 1035.268555
616 212.269272 591.934021
617 214.144180 900.448364
618 216.150284 2525.229248
619 227.101578 976.558044
620 230.201385 1142.054443
621 242.148682 1397.006470
622 243.107559 677.465942
623 243.133698 1371.145142
624 244.138000 891.661987
625 244.180954 1242.425537
626 246.153366 2297.038574
627 254.730103 532.118347
628 255.144455 987.050415
629 256.688324 533.629761
630 257.158569 875.375305
631 272.170959 2529.128906
632 272.908997 502.400146
633 274.186554 13132.186523
634 287.221313 1091.025513
635 291.214172 2984.217773
636 300.154175 1022.979675
637 308.174438 1182.723389
638 311.169250 569.517273
639 315.217712 1153.479858
640 320.089233 1019.081665
641 329.195770 1409.046875
642 330.298096 523.613220
643 331.206055 940.368896
644 345.223816 1784.856079
645 348.235840 683.953247
646 348.581970 560.229858
647 368.226654 641.918640
648 371.281464 720.593628
649 372.184631 537.945129
650 378.248566 1106.098633
651 379.243256 531.171021
652 386.216095 1908.169556
653 388.270569 1083.493164
654 399.715698 3641.003906
655 402.287842 531.509766
656 407.745789 883.040344
657 407.965881 569.346497
658 412.240295 632.917664
659 415.698425 1032.095337
660 428.227112 4306.428711
661 428.261108 1225.675537
662 428.725769 881.870422
663 429.260712 3728.557373
664 429.697418 1331.391235
665 445.288818 567.610901
666 448.071899 583.037292
667 455.416718 647.968628
668 464.268341 654.572754
669 470.773743 1128.713501
670 472.250061 3780.671875
671 473.252808 1594.682739
672 473.278687 2412.803467
673 481.325806 1259.738159
674 484.769775 1385.499390
675 485.271332 613.115601
676 491.173309 585.062622
677 491.329742 911.582214
678 497.316864 671.196655
679 499.275757 1172.343262
680 499.337067 1123.132935
681 500.283569 1279.582520
682 500.335480 1331.533203
683 501.255157 671.378113
684 506.350983 526.060120
685 515.294067 595.644592
686 520.279419 564.501221
687 528.327942 1453.140137
688 528.796143 1023.938416
689 530.344971 699.704163
690 534.306091 632.479187
691 556.821533 578.409241
692 557.308167 996.385559
693 562.368835 1061.597290
694 562.630188 599.749634
695 563.383240 597.036011
696 572.329102 704.391174
697 575.329651 597.594116
698 578.266602 569.538757
699 584.834595 1397.603638
700 585.341125 596.237427
701 585.828064 634.964417
702 592.849548 948.947998
703 593.338867 8331.064453
704 593.809753 1243.525757
705 593.850098 3570.665283
706 594.347534 5469.266113
707 601.328064 1251.846069
708 612.421753 868.523682
709 615.363525 1159.816772
710 635.785217 692.349304
711 645.406799 926.912354
712 647.354187 1344.844971
713 660.368103 1515.965698
714 667.035950 629.281006
715 678.553528 864.705811
716 686.401672 1415.408081
717 687.406799 956.555176
718 701.317932 638.253906
719 713.436462 577.175781
720 714.438171 979.025330
721 721.332031 1133.021240
722 734.864807 659.578308
723 758.495483 1101.013306
724 759.436768 1680.954834
725 814.488220 766.761841
726 825.458008 2101.567139
727 873.476807 3603.638672
728 876.500122 1146.794800
729 877.493591 2904.569092
730 878.501526 2154.676025
731 879.500305 1179.630981
732 896.207703 648.875244
733 914.434082 1090.736938
734 914.517822 1977.191284
735 928.515015 1886.298706
736 930.495483 1311.800903
737 952.429504 625.323181
738 965.766296 606.633911
739 972.546692 2437.769531
740 999.546753 632.162537
741 1026.609131 980.280151
742 1040.573853 1742.042114
743 1041.564087 3165.200439
744 1042.581787 3063.955566
745 1043.577515 6683.765625
746 1045.518311 945.700500
747 1147.621704 832.881104
748 1148.635742 1159.247681
749 1467.104980 653.335815
750 1533.474243 661.718018
751 1620.307251 616.238525
752 1664.717529 648.275024
753 END IONS