NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
501750 |
2kdk   |
cing | 1-original | 1 | AMBER | distance | NOE | simple |
#
# 401 PHE QB 416 SER HA 5.81 (#peak 3 )
&rst
ixpk= 3, nxpk= 0, iat= -1,1736, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
rk2=20.0, rk3=20.0, ir6=1, ialtd=0,
igr1=1493,1492,
&end
#
# 359 GLN QB 362 HIE HE2 6.00 (#peak 8 )
&rst
ixpk= 8, nxpk= 0, iat= -1, 851, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1= 802, 801,
&end
#
# 359 GLN HA 362 HIE HE2 6.00 (#peak 10 )
&rst
ixpk= 10, nxpk= 0, iat= 799, 851, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 359 GLN QG 362 HIE HE2 6.00 (#peak 11 )
&rst
ixpk= 11, nxpk= 0, iat= -1, 851, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1= 805, 804,
&end
#
# 378 LYS H 403 PHE HA 6.00 (#peak 27 )
&rst
ixpk= 27, nxpk= 0, iat=1099,1521, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 401 PHE QD 416 SER HA 5.37 (#peak 49 )
&rst
ixpk= 49, nxpk= 0, iat= -1,1736, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
igr1=1496,1504,
&end
#
# 400 TRP HA 401 PHE QD 4.76 (#peak 51 )
&rst
ixpk= 51, nxpk= 0, iat=1466, -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr2=1496,1504,
&end
#
# 372 VAL HA 380 LEU QQD 5.11 (#peak 70 )
&rst
ixpk= 70, nxpk= 0, iat=1001, -1, r1= 1.30, r2= 1.80, r3= 6.89, r4= 7.39,
igr2=1149,1150,1151,1153,1154,1155,
&end
#
# 373 LEU QQD 403 PHE H 6.00 (#peak 82 )
&rst
ixpk= 82, nxpk= 0, iat= -1,1519, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
igr1=1024,1025,1026,1028,1029,1030,
&end
#
# 376 LYS QD 411 LEU HA 4.95 (#peak 99 )
&rst
ixpk= 99, nxpk= 0, iat= -1,1646, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
igr1=1073,1072,
&end
#
# 408 THR QG2 409 LYS H 4.58 (#peak 118 )
&rst
ixpk= 118, nxpk= 0, iat= -1,1607, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
igr1=1601,1602,1603,
&end
#
# 358 HIE H 365 LEU HG 6.00 (#peak 144 )
&rst
ixpk= 144, nxpk= 0, iat= 780, 890, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 376 LYS QE 411 LEU H 6.00 (#peak 148 )
&rst
ixpk= 148, nxpk= 0, iat= -1,1644, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1=1076,1075,
&end
#
# 372 VAL HA 379 ILE QD1 5.50 (#peak 165 )
&rst
ixpk= 165, nxpk= 0, iat=1001, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2=1134,1135,1136,
&end
#
# 397 LYS H 419 THR H 6.00 (#peak 169 )
&rst
ixpk= 169, nxpk= 0, iat=1414,1775, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 404 THR H 412 GLU H 6.00 (#peak 172 )
&rst
ixpk= 172, nxpk= 0, iat=1539,1663, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 394 VAL HA 420 LEU QB 4.87 (#peak 200 )
&rst
ixpk= 200, nxpk= 0, iat=1367, -1, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,
igr2=1794,1793,
&end
#
# 403 PHE QB 414 ILE QG1 5.44 (#peak 224 )
&rst
ixpk= 224, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.85, r4= 7.35,
igr1=1524,1523,
igr2=1710,1709,
&end
#
# 340 ILE HB 420 LEU HG 6.00 (#peak 233 )
&rst
ixpk= 233, nxpk= 0, iat= 495,1796, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 340 ILE QG1 420 LEU HG 4.18 (#peak 284 )
&rst
ixpk= 284, nxpk= 0, iat= -1,1796, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,
igr1= 502, 501,
&end
#
# 326 VAL H 413 TYR HA 6.00 (#peak 378 )
&rst
ixpk= 378, nxpk= 0, iat= 272,1680, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 324 PHE QB 330 PHE HA 4.45 (#peak 408 )
&rst
ixpk= 408, nxpk= 0, iat= -1, 333, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,
igr1= 247, 246,
&end
#
# 320 PHE QB 343 TYR QD 6.00 (#peak 413 )
&rst
ixpk= 413, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
igr1= 170, 169,
igr2= 544, 551,
&end
#
# 397 LYS H 419 THR HB 5.06 (#peak 440 )
&rst
ixpk= 440, nxpk= 0, iat=1414,1779, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56, &end
#
# 404 THR HB 405 ASN H 5.18 (#peak 453 )
&rst
ixpk= 453, nxpk= 0, iat=1543,1553, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68, &end
#
# 386 PHE QD 396 LEU QQD 4.48 (#peak 465 )
&rst
ixpk= 465, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.78, r4= 7.28,
igr1=1247,1255,
igr2=1404,1405,1406,1408,1409,1410,
&end
#
# 340 ILE HA 420 LEU QQD 4.22 (#peak 508 )
&rst
ixpk= 508, nxpk= 0, iat= 493, -1, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
igr2=1798,1799,1800,1802,1803,1804,
&end
#
# 367 ASP HA 368 LYS HA 4.85 (#peak 530 )
&rst
ixpk= 530, nxpk= 0, iat= 918, 930, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35, &end
#
# 396 LEU HA 419 THR H 6.00 (#peak 574 )
&rst
ixpk= 574, nxpk= 0, iat=1397,1775, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 349 LEU QB 350 GLY QA 5.30 (#peak 583 )
&rst
ixpk= 583, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.68, r4= 7.18,
igr1= 646, 645,
igr2= 663, 662,
&end
#
# 330 PHE H 350 GLY HA2 6.00 (#peak 584 )
&rst
ixpk= 584, nxpk= 0, iat= 331, 663, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 341 LEU H 342 GLY HA3 6.00 (#peak 588 )
&rst
ixpk= 588, nxpk= 0, iat= 510, 531, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 366 THR QG2 367 ASP QB 5.81 (#peak 620 )
&rst
ixpk= 620, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.83, r4= 8.33,
igr1= 910, 911, 912,
igr2= 921, 920,
&end
#
# 367 ASP QB 368 LYS QD 5.81 (#peak 620 )
&rst
ixpk= 620, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.32, r4= 7.82,
igr1= 921, 920,
igr2= 939, 938,
&end
#
# 399 GLN QB 400 TRP HB2 6.00 (#peak 630 )
&rst
ixpk= 630, nxpk= 0, iat= -1,1469, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1=1452,1451,
&end
#
# 387 ARG HA 388 ALA HA 6.00 (#peak 645 )
&rst
ixpk= 645, nxpk= 0, iat=1261,1285, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 358 HIE H 386 PHE HA 6.00 (#peak 689 )
&rst
ixpk= 689, nxpk= 0, iat= 780,1241, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 318 THR HB 319 GLU QB 6.00 (#peak 693 )
&rst
ixpk= 693, nxpk= 0, iat= 140, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2= 155, 154,
&end
#
# 338 THR HB 339 ALA QB 5.82 (#peak 696 )
&rst
ixpk= 696, nxpk= 0, iat= 471, -1, r1= 1.30, r2= 1.80, r3= 6.99, r4= 7.49,
igr2= 485, 486, 487,
&end
#
# 394 VAL HA 395 THR HB 5.79 (#peak 697 )
&rst
ixpk= 697, nxpk= 0, iat=1367,1385, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29, &end
#
# 361 ASP HA 363 ASN QB 6.00 (#peak 713 )
&rst
ixpk= 713, nxpk= 0, iat= 828, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2= 860, 859,
&end
#
# 379 ILE HB 400 TRP QB 6.00 (#peak 727 )
&rst
ixpk= 727, nxpk= 0, iat=1125, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=1469,1468,
&end
#
# 320 PHE H 418 ASN QB 5.15 (#peak 739 )
&rst
ixpk= 739, nxpk= 0, iat= 165, -1, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr2=1766,1765,
&end
#
# 365 LEU HB2 385 LYS H 6.00 (#peak 759 )
&rst
ixpk= 759, nxpk= 0, iat= 888,1217, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 376 LYS QE 412 GLU H 6.00 (#peak 794 )
&rst
ixpk= 794, nxpk= 0, iat= -1,1663, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1=1076,1075,
&end
#
# 368 LYS QD 369 HIE H 6.00 (#peak 823 )
&rst
ixpk= 823, nxpk= 0, iat= -1, 950, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1= 939, 938,
&end
#
# 385 LYS QE 397 LYS QD 6.00 (#peak 838 )
&rst
ixpk= 838, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
igr1=1231,1230,
igr2=1425,1424,
&end
#
# 329 LYS QB 350 GLY H 5.81 (#peak 849 )
&rst
ixpk= 849, nxpk= 0, iat= -1, 660, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
igr1= 314, 313,
&end
#
# 341 LEU QB 389 LYS QG 5.81 (#peak 858 )
&rst
ixpk= 858, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.32, r4= 7.82,
igr1= 515, 514,
igr2=1301,1300,
&end
#
# 370 LYS QB 371 ALA QB 5.81 (#peak 860 )
&rst
ixpk= 860, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.83, r4= 8.33,
igr1= 972, 971,
igr2= 993, 994, 995,
&end
#
# 371 ALA QB 374 GLN QB 5.81 (#peak 860 )
&rst
ixpk= 860, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.83, r4= 8.33,
igr1= 993, 994, 995,
igr2=1039,1038,
&end
#
# 339 ALA QB 341 LEU H 6.00 (#peak 862 )
&rst
ixpk= 862, nxpk= 0, iat= -1, 510, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr1= 485, 486, 487,
&end
#
# 377 GLU H 380 LEU QQD 6.00 (#peak 887 )
&rst
ixpk= 887, nxpk= 0, iat=1084, -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
igr2=1149,1150,1151,1153,1154,1155,
&end
#
# 386 PHE QD 396 LEU QB 5.81 (#peak 908 )
&rst
ixpk= 908, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.32, r4= 7.82,
igr1=1247,1255,
igr2=1400,1399,
&end
#
# 396 LEU HA 421 VAL QQG 5.92 (#peak 938 )
&rst
ixpk= 938, nxpk= 0, iat=1397, -1, r1= 1.30, r2= 1.80, r3= 7.98, r4= 8.48,
igr2=1814,1815,1816,1818,1819,1820,
&end
#
# 343 TYR H 348 LEU HG 6.00 (#peak 965 )
&rst
ixpk= 965, nxpk= 0, iat= 536, 629, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 333 VAL HB 348 LEU HG 6.00 (#peak 968 )
&rst
ixpk= 968, nxpk= 0, iat= 392, 629, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 357 PHE HA 396 LEU QQD 6.00 (#peak 976 )
&rst
ixpk= 976, nxpk= 0, iat= 762, -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
igr2=1404,1405,1406,1408,1409,1410,
&end
#
# 401 PHE QB 416 SER QB 5.18 (#peak 985 )
&rst
ixpk= 985, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.53, r4= 7.03,
igr1=1493,1492,
igr2=1739,1738,
&end
#
# 319 GLU H 336 ARG QD 6.00 (#peak 1017 )
&rst
ixpk= 1017, nxpk= 0, iat= 150, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2= 444, 443,
&end
#
# 331 VAL QQG 332 TYR QD 5.92 (#peak 1050 )
&rst
ixpk= 1050, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.96, r4= 9.46,
igr1= 357, 358, 359, 361, 362, 363,
igr2= 375, 382,
&end
#
# 343 TYR QE 389 LYS HA 5.83 (#peak 1056 )
&rst
ixpk= 1056, nxpk= 0, iat= -1,1295, r1= 1.30, r2= 1.80, r3= 6.54, r4= 7.04,
igr1= 546, 549,
&end
#
# 314 ASN HA 315 VAL HA 6.00 (#peak 1074 )
&rst
ixpk= 1074, nxpk= 0, iat= 72, 86, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 389 LYS QB 390 ASP QB 5.18 (#peak 1095 )
&rst
ixpk= 1095, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.53, r4= 7.03,
igr1=1298,1297,
igr2=1320,1319,
&end
#
# 318 THR HB 319 GLU QG 6.00 (#peak 1100 )
&rst
ixpk= 1100, nxpk= 0, iat= 140, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2= 158, 157,
&end
#
# 325 ALA QB 329 LYS QB 5.81 (#peak 1136 )
&rst
ixpk= 1136, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.83, r4= 8.33,
igr1= 266, 267, 268,
igr2= 314, 313,
&end
#
# 386 PHE HA 387 ARG HB2 5.24 (#peak 1157 )
&rst
ixpk= 1157, nxpk= 0, iat=1241,1264, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74, &end
#
# 368 LYS QD 369 HIE QB 5.81 (#peak 1165 )
&rst
ixpk= 1165, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.32, r4= 7.82,
igr1= 939, 938,
igr2= 955, 954,
&end
#
# 340 ILE H 420 LEU QQD 5.92 (#peak 1173 )
&rst
ixpk= 1173, nxpk= 0, iat= 491, -1, r1= 1.30, r2= 1.80, r3= 7.98, r4= 8.48,
igr2=1798,1799,1800,1802,1803,1804,
&end
#
# 357 PHE QB 396 LEU QQD 5.81 (#peak 1213 )
&rst
ixpk= 1213, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.79, r4= 9.29,
igr1= 765, 764,
igr2=1404,1405,1406,1408,1409,1410,
&end
#
# 329 LYS QG 352 SER HA 6.00 (#peak 2983 )
&rst
ixpk= 2983, nxpk= 0, iat= -1, 683, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1= 317, 316,
&end
#
# 320 PHE QD 337 ALA QB 4.50 (#peak 20001 )
&rst
ixpk= 20001, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
igr1= 173, 181,
igr2= 461, 462, 463,
&end
#
# 388 ALA QB 396 LEU QQD 4.94 (#peak 20066 )
&rst
ixpk= 20066, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.00, r4= 8.50,
igr1=1287,1288,1289,
igr2=1404,1405,1406,1408,1409,1410,
&end
#
# 372 VAL QQG 402 SER QB 4.65 (#peak 20067 )
&rst
ixpk= 20067, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.04, r4= 7.54,
igr1=1005,1006,1007,1009,1010,1011,
igr2=1513,1512,
&end
#
# 370 LYS QG 373 LEU QQD 4.98 (#peak 20089 )
&rst
ixpk= 20089, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.54, r4= 8.04,
igr1= 975, 974,
igr2=1024,1025,1026,1028,1029,1030,
&end
#
# 357 PHE QB 365 LEU HG 4.27 (#peak 20104 )
&rst
ixpk= 20104, nxpk= 0, iat= -1, 890, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
igr1= 765, 764,
&end
#
# 374 GLN QG 380 LEU QQD 4.66 (#peak 20107 )
&rst
ixpk= 20107, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.05, r4= 7.55,
igr1=1042,1041,
igr2=1149,1150,1151,1153,1154,1155,
&end
#
# 347 GLU HA 351 THR HB 4.73 (#peak 20108 )
&rst
ixpk= 20108, nxpk= 0, iat= 609, 671, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, &end
#
# 370 LYS HA 373 LEU QQD 4.39 (#peak 20119 )
&rst
ixpk= 20119, nxpk= 0, iat= 969, -1, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
igr2=1024,1025,1026,1028,1029,1030,
&end
#
# 340 ILE QD1 419 THR QG2 4.66 (#peak 20122 )
&rst
ixpk= 20122, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.72, r4= 7.22,
igr1= 504, 505, 506,
igr2=1783,1784,1785,
&end
#
# 389 LYS QE 390 ASP HA 3.68 (#peak 20175 )
&rst
ixpk= 20175, nxpk= 0, iat= -1,1317, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
igr1=1307,1306,
&end
#
# 344 LEU QQD 345 PRO QD 3.94 (#peak 20187 )
&rst
ixpk= 20187, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
igr1= 566, 567, 568, 570, 571, 572,
igr2= 578, 577,
&end
#
# 386 PHE HB3 396 LEU QQD 4.94 (#peak 20192 )
&rst
ixpk= 20192, nxpk= 0, iat=1243, -1, r1= 1.30, r2= 1.80, r3= 6.66, r4= 7.16,
igr2=1404,1405,1406,1408,1409,1410,
&end
#
# 316 LYS QE 317 PRO QD 3.84 (#peak 20201 )
&rst
ixpk= 20201, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
igr1= 114, 113,
igr2= 124, 123,
&end
#
# 343 TYR HA 389 LYS QE 4.14 (#peak 20205 )
&rst
ixpk= 20205, nxpk= 0, iat= 538, -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
igr2=1307,1306,
&end
#
# 410 GLU QG 412 GLU HB3 3.83 (#peak 20257 )
&rst
ixpk= 20257, nxpk= 0, iat= -1,1667, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
igr1=1637,1636,
&end
#
# 316 LYS QD 339 ALA HA 4.75 (#peak 20293 )
&rst
ixpk= 20293, nxpk= 0, iat= -1, 483, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
igr1= 111, 110,
&end
#
# 353 CYS QB 354 TYR QD 4.95 (#peak 20303 )
&rst
ixpk= 20303, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
igr1= 697, 696,
igr2= 711, 718,
&end
#
# 372 VAL H 380 LEU QQD 4.51 (#peak 20322 )
&rst
ixpk= 20322, nxpk= 0, iat= 999, -1, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
igr2=1149,1150,1151,1153,1154,1155,
&end
#
# 365 LEU HG 386 PHE QD 4.72 (#peak 20324 )
&rst
ixpk= 20324, nxpk= 0, iat= 890, -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr2=1247,1255,
&end
#
# 326 VAL H 411 LEU QQD 4.68 (#peak 20328 )
&rst
ixpk= 20328, nxpk= 0, iat= 272, -1, r1= 1.30, r2= 1.80, r3= 6.31, r4= 6.81,
igr2=1653,1654,1655,1657,1658,1659,
&end
#
# 340 ILE H 341 LEU QQD 4.88 (#peak 20334 )
&rst
ixpk= 20334, nxpk= 0, iat= 491, -1, r1= 1.30, r2= 1.80, r3= 6.58, r4= 7.08,
igr2= 519, 520, 521, 523, 524, 525,
&end
#
# 353 CYS HA 357 PHE H 5.02 (#peak 20343 )
&rst
ixpk= 20343, nxpk= 0, iat= 694, 760, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52, &end
#
# 364 ASN H 365 LEU QQD 6.00 (#peak 20357 )
&rst
ixpk= 20357, nxpk= 0, iat= 869, -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
igr2= 892, 893, 894, 896, 897, 898,
&end
#
# 333 VAL QQG 347 GLU H 5.29 (#peak 20360 )
&rst
ixpk= 20360, nxpk= 0, iat= -1, 607, r1= 1.30, r2= 1.80, r3= 7.13, r4= 7.63,
igr1= 394, 395, 396, 398, 399, 400,
&end
#
# 324 PHE H 414 ILE QG2 6.00 (#peak 20376 )
&rst
ixpk= 20376, nxpk= 0, iat= 242, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr2=1705,1706,1707,
&end
#
# 371 ALA HA 373 LEU H 4.93 (#peak 20382 )
&rst
ixpk= 20382, nxpk= 0, iat= 991,1015, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43, &end
#
# 328 GLY QA 354 TYR QD 4.00 (#peak 20397 )
&rst
ixpk= 20397, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr1= 305, 304,
igr2= 711, 718,
&end
#
# 393 PHE H 394 VAL HB 4.71 (#peak 20434 )
&rst
ixpk= 20434, nxpk= 0, iat=1345,1369, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21, &end
#
# 366 THR HB 370 LYS H 5.94 (#peak 20436 )
&rst
ixpk= 20436, nxpk= 0, iat= 906, 967, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44, &end
#
# 376 LYS H 377 GLU HB3 6.00 (#peak 20451 )
&rst
ixpk= 20451, nxpk= 0, iat=1062,1088, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 395 THR HB 421 VAL H 5.50 (#peak 20456 )
&rst
ixpk= 20456, nxpk= 0, iat=1385,1808, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 385 LYS HA 386 PHE HB3 4.87 (#peak 20479 )
&rst
ixpk= 20479, nxpk= 0, iat=1219,1243, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37, &end
#
# 341 LEU QB 343 TYR QE 5.14 (#peak 20509 )
&rst
ixpk= 20509, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.48, r4= 6.98,
igr1= 515, 514,
igr2= 546, 549,
&end
#
# 342 GLY HA3 343 TYR HA 4.36 (#peak 20512 )
&rst
ixpk= 20512, nxpk= 0, iat= 531, 538, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86, &end
#
# 346 GLN HA 350 GLY QA 5.23 (#peak 20516 )
&rst
ixpk= 20516, nxpk= 0, iat= 592, -1, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,
igr2= 663, 662,
&end
#
# 370 LYS QD 373 LEU QQD 4.27 (#peak 20535 )
&rst
ixpk= 20535, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.46, r4= 6.96,
igr1= 978, 977,
igr2=1024,1025,1026,1028,1029,1030,
&end
#
# 317 PRO QB 336 ARG QD 4.58 (#peak 20543 )
&rst
ixpk= 20543, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,
igr1= 129, 128,
igr2= 444, 443,
&end
#
# 403 PHE QB 413 TYR H 4.94 (#peak 20549 )
&rst
ixpk= 20549, nxpk= 0, iat= -1,1678, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
igr1=1524,1523,
&end
#
# 376 LYS H 377 GLU HB2 6.00 (#peak 20550 )
&rst
ixpk= 20550, nxpk= 0, iat=1062,1089, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 338 THR HA 342 GLY H 5.04 (#peak 20551 )
&rst
ixpk= 20551, nxpk= 0, iat= 469, 529, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54, &end
#
# 400 TRP HA 401 PHE HA 6.00 (#peak 20557 )
&rst
ixpk= 20557, nxpk= 0, iat=1466,1490, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 379 ILE HB 400 TRP HA 6.00 (#peak 20558 )
&rst
ixpk= 20558, nxpk= 0, iat=1125,1466, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 372 VAL QQG 400 TRP HA 6.00 (#peak 20559 )
&rst
ixpk= 20559, nxpk= 0, iat= -1,1466, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
igr1=1005,1006,1007,1009,1010,1011,
&end
#
# 388 ALA HA 390 ASP H 5.63 (#peak 20575 )
&rst
ixpk= 20575, nxpk= 0, iat=1285,1315, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13, &end
#
# 343 TYR QD 388 ALA HA 6.00 (#peak 20576 )
&rst
ixpk= 20576, nxpk= 0, iat= -1,1285, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1= 544, 551,
&end
#
# 325 ALA HA 413 TYR QB 6.00 (#peak 20578 )
&rst
ixpk= 20578, nxpk= 0, iat= 264, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=1683,1682,
&end
#
# 342 GLY QA 389 LYS H 6.00 (#peak 20579 )
&rst
ixpk= 20579, nxpk= 0, iat= -1,1293, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1= 532, 531,
&end
#
# 338 THR QG2 342 GLY QA 5.95 (#peak 20580 )
&rst
ixpk= 20580, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.02, r4= 8.52,
igr1= 475, 476, 477,
igr2= 532, 531,
&end
#
# 342 GLY HA3 389 LYS QG 6.00 (#peak 20587 )
&rst
ixpk= 20587, nxpk= 0, iat= 531, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=1301,1300,
&end
#
# 320 PHE HA 334 ASP HB3 5.71 (#peak 20590 )
&rst
ixpk= 20590, nxpk= 0, iat= 167, 408, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21, &end
#
# 321 ILE HB 334 ASP HB3 5.96 (#peak 20591 )
&rst
ixpk= 20591, nxpk= 0, iat= 189, 408, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46, &end
#
# 334 ASP HB3 337 ALA QB 5.65 (#peak 20592 )
&rst
ixpk= 20592, nxpk= 0, iat= 408, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2= 461, 462, 463,
&end
#
# 334 ASP HB2 335 GLN H 6.00 (#peak 20593 )
&rst
ixpk= 20593, nxpk= 0, iat= 409, 416, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 321 ILE HB 334 ASP HB2 5.15 (#peak 20595 )
&rst
ixpk= 20595, nxpk= 0, iat= 189, 409, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65, &end
#
# 334 ASP HB2 337 ALA QB 4.53 (#peak 20596 )
&rst
ixpk= 20596, nxpk= 0, iat= 409, -1, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
igr2= 461, 462, 463,
&end
#
# 387 ARG QD 391 GLY H 6.00 (#peak 20603 )
&rst
ixpk= 20603, nxpk= 0, iat= -1,1327, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1=1270,1269,
&end
#
# 323 ARG QD 415 VAL H 6.00 (#peak 20618 )
&rst
ixpk= 20618, nxpk= 0, iat= -1,1718, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1= 229, 228,
&end
#
# 379 ILE H 401 PHE QB 5.17 (#peak 20623 )
&rst
ixpk= 20623, nxpk= 0, iat=1121, -1, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
igr2=1493,1492,
&end
#
# 380 LEU H 400 TRP QB 6.00 (#peak 20628 )
&rst
ixpk= 20628, nxpk= 0, iat=1140, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=1469,1468,
&end
#
# 404 THR HB 409 LYS QD 6.00 (#peak 20631 )
&rst
ixpk= 20631, nxpk= 0, iat=1543, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=1618,1617,
&end
#
# 404 THR HB 409 LYS QB 5.81 (#peak 20633 )
&rst
ixpk= 20633, nxpk= 0, iat=1543, -1, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
igr2=1612,1611,
&end
#
# 419 THR HB 421 VAL QQG 5.45 (#peak 20640 )
&rst
ixpk= 20640, nxpk= 0, iat=1779, -1, r1= 1.30, r2= 1.80, r3= 7.35, r4= 7.85,
igr2=1814,1815,1816,1818,1819,1820,
&end
#
# 404 THR HA 413 TYR H 5.39 (#peak 20647 )
&rst
ixpk= 20647, nxpk= 0, iat=1541,1678, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89, &end
#
# 404 THR HA 411 LEU QB 6.00 (#peak 20648 )
&rst
ixpk= 20648, nxpk= 0, iat=1541, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=1649,1648,
&end
#
# 403 PHE HA 404 THR HA 5.85 (#peak 20649 )
&rst
ixpk= 20649, nxpk= 0, iat=1521,1541, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35, &end
#
# 386 PHE HA 396 LEU QQD 6.00 (#peak 20688 )
&rst
ixpk= 20688, nxpk= 0, iat=1241, -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
igr2=1404,1405,1406,1408,1409,1410,
&end
#
# 408 THR HB 409 LYS QB 5.81 (#peak 20695 )
&rst
ixpk= 20695, nxpk= 0, iat=1597, -1, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
igr2=1612,1611,
&end
#
# 395 THR HB 397 LYS QD 5.86 (#peak 20698 )
&rst
ixpk= 20698, nxpk= 0, iat=1385, -1, r1= 1.30, r2= 1.80, r3= 6.58, r4= 7.08,
igr2=1425,1424,
&end
#
# 404 THR HB 409 LYS HA 5.80 (#peak 20709 )
&rst
ixpk= 20709, nxpk= 0, iat=1543,1609, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30, &end
#
# 397 LYS QB 419 THR HB 5.04 (#peak 20712 )
&rst
ixpk= 20712, nxpk= 0, iat= -1,1779, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr1=1419,1418,
&end
#
# 404 THR HA 412 GLU QG 4.35 (#peak 20717 )
&rst
ixpk= 20717, nxpk= 0, iat=1541, -1, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
igr2=1671,1670,
&end
#
# 412 GLU QG 413 TYR H 6.00 (#peak 20720 )
&rst
ixpk= 20720, nxpk= 0, iat= -1,1678, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1=1671,1670,
&end
#
# 397 LYS QB 421 VAL QQG 5.28 (#peak 20722 )
&rst
ixpk= 20722, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.99, r4= 8.49,
igr1=1419,1418,
igr2=1814,1815,1816,1818,1819,1820,
&end
#
# 348 LEU HA 356 TYR QB 5.38 (#peak 20724 )
&rst
ixpk= 20724, nxpk= 0, iat= 624, -1, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54,
igr2= 744, 743,
&end
#
# 344 LEU QB 346 GLN QG 4.84 (#peak 20732 )
&rst
ixpk= 20732, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.10, r4= 6.60,
igr1= 562, 561,
igr2= 598, 597,
&end
#
# 344 LEU QB 347 GLU HA 5.81 (#peak 20743 )
&rst
ixpk= 20743, nxpk= 0, iat= -1, 609, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
igr1= 562, 561,
&end
#
# 385 LYS QE 395 THR HA 6.00 (#peak 20749 )
&rst
ixpk= 20749, nxpk= 0, iat= -1,1383, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1=1231,1230,
&end
#
# 368 LYS QE 380 LEU QB 4.99 (#peak 20770 )
&rst
ixpk= 20770, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.29, r4= 6.79,
igr1= 942, 941,
igr2=1145,1144,
&end
#
# 396 LEU HG 420 LEU QB 4.90 (#peak 20782 )
&rst
ixpk= 20782, nxpk= 0, iat=1402, -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
igr2=1794,1793,
&end
#
# 347 GLU H 348 LEU HB3 6.00 (#peak 20784 )
&rst
ixpk= 20784, nxpk= 0, iat= 607, 626, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 385 LYS HA 386 PHE HB2 5.82 (#peak 20791 )
&rst
ixpk= 20791, nxpk= 0, iat=1219,1244, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32, &end
#
# 421 VAL HA 422 LEU QB 4.71 (#peak 20801 )
&rst
ixpk= 20801, nxpk= 0, iat=1810, -1, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,
igr2=1829,1828,
&end
#
# 406 PRO HA 408 THR H 6.00 (#peak 20805 )
&rst
ixpk= 20805, nxpk= 0, iat=1571,1593, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 343 TYR HA 389 LYS QD 5.93 (#peak 20833 )
&rst
ixpk= 20833, nxpk= 0, iat= 538, -1, r1= 1.30, r2= 1.80, r3= 6.66, r4= 7.16,
igr2=1304,1303,
&end
#
# 343 TYR H 389 LYS QD 6.00 (#peak 20835 )
&rst
ixpk= 20835, nxpk= 0, iat= 536, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=1304,1303,
&end
#
# 337 ALA HA 340 ILE HA 6.00 (#peak 20859 )
&rst
ixpk= 20859, nxpk= 0, iat= 459, 493, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 317 PRO QB 339 ALA QB 5.81 (#peak 20861 )
&rst
ixpk= 20861, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.83, r4= 8.33,
igr1= 129, 128,
igr2= 485, 486, 487,
&end
#
# 325 ALA QB 326 VAL HB 5.98 (#peak 20864 )
&rst
ixpk= 20864, nxpk= 0, iat= -1, 276, r1= 1.30, r2= 1.80, r3= 7.18, r4= 7.68,
igr1= 266, 267, 268,
&end
#
# 387 ARG HA 388 ALA QB 6.00 (#peak 20868 )
&rst
ixpk= 20868, nxpk= 0, iat=1261, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr2=1287,1288,1289,
&end
#
# 388 ALA QB 389 LYS HA 6.00 (#peak 20869 )
&rst
ixpk= 20869, nxpk= 0, iat= -1,1295, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr1=1287,1288,1289,
&end
#
# 379 ILE QG1 380 LEU H 6.00 (#peak 20877 )
&rst
ixpk= 20877, nxpk= 0, iat= -1,1140, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1=1132,1131,
&end
#
# 386 PHE HB2 396 LEU QQD 6.00 (#peak 20879 )
&rst
ixpk= 20879, nxpk= 0, iat=1244, -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
igr2=1404,1405,1406,1408,1409,1410,
&end
#
# 330 PHE H 353 CYS QB 5.81 (#peak 20881 )
&rst
ixpk= 20881, nxpk= 0, iat= 331, -1, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
igr2= 697, 696,
&end
#
# 325 ALA HA 414 ILE QG1 6.00 (#peak 20883 )
&rst
ixpk= 20883, nxpk= 0, iat= 264, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=1710,1709,
&end
#
# 414 ILE QG1 415 VAL H 5.81 (#peak 20889 )
&rst
ixpk= 20889, nxpk= 0, iat= -1,1718, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
igr1=1710,1709,
&end
#
# 401 PHE QD 415 VAL HB 6.00 (#peak 20895 )
&rst
ixpk= 20895, nxpk= 0, iat= -1,1722, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1=1496,1504,
&end
#
# 325 ALA HA 414 ILE HB 6.00 (#peak 20904 )
&rst
ixpk= 20904, nxpk= 0, iat= 264,1703, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 348 LEU QB 349 LEU H 6.00 (#peak 20907 )
&rst
ixpk= 20907, nxpk= 0, iat= -1, 641, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1= 627, 626,
&end
#
# 313 ILE QD1 315 VAL HB 6.00 (#peak 20916 )
&rst
ixpk= 20916, nxpk= 0, iat= -1, 88, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr1= 64, 65, 66,
&end
#
# 317 PRO QB 340 ILE QD1 5.81 (#peak 20921 )
&rst
ixpk= 20921, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.83, r4= 8.33,
igr1= 129, 128,
igr2= 504, 505, 506,
&end
#
# 340 ILE QD1 341 LEU HA 6.00 (#peak 20923 )
&rst
ixpk= 20923, nxpk= 0, iat= -1, 512, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr1= 504, 505, 506,
&end
#
# 373 LEU HA 414 ILE QD1 6.00 (#peak 20924 )
&rst
ixpk= 20924, nxpk= 0, iat=1017, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr2=1712,1713,1714,
&end
#
# 325 ALA HA 414 ILE QD1 6.00 (#peak 20925 )
&rst
ixpk= 20925, nxpk= 0, iat= 264, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr2=1712,1713,1714,
&end
#
# 320 PHE QB 340 ILE QD1 6.00 (#peak 20927 )
&rst
ixpk= 20927, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
igr1= 170, 169,
igr2= 504, 505, 506,
&end
#
# 402 SER QB 414 ILE QD1 6.00 (#peak 20928 )
&rst
ixpk= 20928, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
igr1=1513,1512,
igr2=1712,1713,1714,
&end
#
# 324 PHE H 414 ILE QD1 6.00 (#peak 20929 )
&rst
ixpk= 20929, nxpk= 0, iat= 242, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr2=1712,1713,1714,
&end
#
# 403 PHE H 414 ILE QD1 6.00 (#peak 20930 )
&rst
ixpk= 20930, nxpk= 0, iat=1519, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr2=1712,1713,1714,
&end
#
# 317 PRO QG 340 ILE QG2 6.00 (#peak 20932 )
&rst
ixpk= 20932, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
igr1= 132, 131,
igr2= 497, 498, 499,
&end
#
# 332 TYR QB 333 VAL QQG 5.73 (#peak 20934 )
&rst
ixpk= 20934, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.67, r4= 9.17,
igr1= 372, 371,
igr2= 394, 395, 396, 398, 399, 400,
&end
#
# 322 THR HB 333 VAL QQG 5.92 (#peak 20936 )
&rst
ixpk= 20936, nxpk= 0, iat= 208, -1, r1= 1.30, r2= 1.80, r3= 7.98, r4= 8.48,
igr2= 394, 395, 396, 398, 399, 400,
&end
#
# 332 TYR HA 333 VAL QQG 5.92 (#peak 20937 )
&rst
ixpk= 20937, nxpk= 0, iat= 369, -1, r1= 1.30, r2= 1.80, r3= 7.98, r4= 8.48,
igr2= 394, 395, 396, 398, 399, 400,
&end
#
# 337 ALA HA 341 LEU HG 6.00 (#peak 20945 )
&rst
ixpk= 20945, nxpk= 0, iat= 459, 517, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 341 LEU HG 343 TYR H 6.00 (#peak 20948 )
&rst
ixpk= 20948, nxpk= 0, iat= 517, 536, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 341 LEU QQD 348 LEU HB2 5.30 (#peak 20950 )
&rst
ixpk= 20950, nxpk= 0, iat= -1, 627, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
igr1= 519, 520, 521, 523, 524, 525,
&end
#
# 400 TRP HA 414 ILE QG2 6.00 (#peak 20952 )
&rst
ixpk= 20952, nxpk= 0, iat=1466, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr2=1705,1706,1707,
&end
#
# 325 ALA HA 414 ILE QG2 6.00 (#peak 20955 )
&rst
ixpk= 20955, nxpk= 0, iat= 264, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr2=1705,1706,1707,
&end
#
# 403 PHE HA 414 ILE QG2 6.00 (#peak 20956 )
&rst
ixpk= 20956, nxpk= 0, iat=1521, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr2=1705,1706,1707,
&end
#
# 365 LEU HG 384 TYR HA 6.00 (#peak 20959 )
&rst
ixpk= 20959, nxpk= 0, iat= 890,1198, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 365 LEU HG 385 LYS H 6.00 (#peak 20962 )
&rst
ixpk= 20962, nxpk= 0, iat= 890,1217, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 343 TYR HA 348 LEU HG 6.00 (#peak 20963 )
&rst
ixpk= 20963, nxpk= 0, iat= 538, 629, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 347 GLU H 348 LEU HG 6.00 (#peak 20967 )
&rst
ixpk= 20967, nxpk= 0, iat= 607, 629, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 357 PHE HA 387 ARG H 4.92 (#peak 20974 )
&rst
ixpk= 20974, nxpk= 0, iat= 762,1259, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42, &end
#
# 416 SER HA 417 VAL HA 6.00 (#peak 20977 )
&rst
ixpk= 20977, nxpk= 0, iat=1736,1747, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 385 LYS HA 396 LEU H 5.13 (#peak 20982 )
&rst
ixpk= 20982, nxpk= 0, iat=1219,1395, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63, &end
#
# 406 PRO HA 409 LYS QD 6.00 (#peak 20987 )
&rst
ixpk= 20987, nxpk= 0, iat=1571, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=1618,1617,
&end
#
# 373 LEU H 402 SER QB 6.00 (#peak 20994 )
&rst
ixpk= 20994, nxpk= 0, iat=1015, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=1513,1512,
&end
#
# 372 VAL HA 375 SER QB 5.04 (#peak 20995 )
&rst
ixpk= 20995, nxpk= 0, iat=1001, -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr2=1056,1055,
&end
#
# 406 PRO HA 409 LYS HA 6.00 (#peak 20997 )
&rst
ixpk= 20997, nxpk= 0, iat=1571,1609, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 322 THR H 415 VAL HA 6.00 (#peak 21000 )
&rst
ixpk= 21000, nxpk= 0, iat= 204,1720, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 329 LYS HA 353 CYS HA 5.60 (#peak 21001 )
&rst
ixpk= 21001, nxpk= 0, iat= 311, 694, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10, &end
#
# 410 GLU HA 411 LEU QB 4.19 (#peak 21004 )
&rst
ixpk= 21004, nxpk= 0, iat=1631, -1, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
igr2=1649,1648,
&end
#
# 378 LYS HA 401 PHE QB 4.65 (#peak 21021 )
&rst
ixpk= 21021, nxpk= 0, iat=1101, -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
igr2=1493,1492,
&end
#
# 378 LYS QB 379 ILE HB 5.03 (#peak 21039 )
&rst
ixpk= 21039, nxpk= 0, iat= -1,1125, r1= 1.30, r2= 1.80, r3= 5.65, r4= 6.15,
igr1=1104,1103,
&end
#
# 325 ALA HA 331 VAL QQG 5.92 (#peak 21049 )
&rst
ixpk= 21049, nxpk= 0, iat= 264, -1, r1= 1.30, r2= 1.80, r3= 7.98, r4= 8.48,
igr2= 357, 358, 359, 361, 362, 363,
&end
#
# 354 TYR HA 357 PHE QB 5.21 (#peak 21054 )
&rst
ixpk= 21054, nxpk= 0, iat= 705, -1, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
igr2= 765, 764,
&end
#
# 349 LEU HA 350 GLY HA2 6.00 (#peak 21058 )
&rst
ixpk= 21058, nxpk= 0, iat= 643, 663, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 372 VAL HA 380 LEU HA 6.00 (#peak 21065 )
&rst
ixpk= 21065, nxpk= 0, iat=1001,1142, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 406 PRO HA 409 LYS H 6.00 (#peak 21066 )
&rst
ixpk= 21066, nxpk= 0, iat=1571,1607, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 399 GLN QG 417 VAL HA 5.81 (#peak 21068 )
&rst
ixpk= 21068, nxpk= 0, iat= -1,1747, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
igr1=1455,1454,
&end
#
# 333 VAL HA 337 ALA QB 6.00 (#peak 21072 )
&rst
ixpk= 21072, nxpk= 0, iat= 390, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr2= 461, 462, 463,
&end
#
# 315 VAL HA 316 LYS HA 6.00 (#peak 21073 )
&rst
ixpk= 21073, nxpk= 0, iat= 86, 102, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 341 LEU QQD 387 ARG HA 6.00 (#peak 21078 )
&rst
ixpk= 21078, nxpk= 0, iat= -1,1261, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
igr1= 519, 520, 521, 523, 524, 525,
&end
#
# 373 LEU QQD 411 LEU HA 5.55 (#peak 21079 )
&rst
ixpk= 21079, nxpk= 0, iat= -1,1646, r1= 1.30, r2= 1.80, r3= 7.48, r4= 7.98,
igr1=1024,1025,1026,1028,1029,1030,
&end
#
# 320 PHE HA 334 ASP HB2 4.59 (#peak 21083 )
&rst
ixpk= 21083, nxpk= 0, iat= 167, 409, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 324 PHE QB 330 PHE H 5.81 (#peak 21085 )
&rst
ixpk= 21085, nxpk= 0, iat= -1, 331, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
igr1= 247, 246,
&end
#
# 372 VAL QQG 401 PHE QB 4.69 (#peak 21092 )
&rst
ixpk= 21092, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.10, r4= 7.60,
igr1=1005,1006,1007,1009,1010,1011,
igr2=1493,1492,
&end
#
# 378 LYS QG 401 PHE QB 5.28 (#peak 21093 )
&rst
ixpk= 21093, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.65, r4= 7.15,
igr1=1107,1106,
igr2=1493,1492,
&end
#
# 385 LYS QD 395 THR HA 6.00 (#peak 21114 )
&rst
ixpk= 21114, nxpk= 0, iat= -1,1383, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1=1228,1227,
&end
#
# 383 SER HA 397 LYS QB 6.00 (#peak 21119 )
&rst
ixpk= 21119, nxpk= 0, iat=1187, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=1419,1418,
&end
#
# 329 LYS QD 353 CYS QB 5.25 (#peak 21135 )
&rst
ixpk= 21135, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 320, 319,
igr2= 697, 696,
&end
#
# 371 ALA QB 372 VAL QQG 4.81 (#peak 21137 )
&rst
ixpk= 21137, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.79, r4= 8.29,
igr1= 993, 994, 995,
igr2=1005,1006,1007,1009,1010,1011,
&end
#
# 322 THR H 333 VAL QQG 5.34 (#peak 21144 )
&rst
ixpk= 21144, nxpk= 0, iat= 204, -1, r1= 1.30, r2= 1.80, r3= 7.20, r4= 7.70,
igr2= 394, 395, 396, 398, 399, 400,
&end
#
# 323 ARG HA 415 VAL HB 5.96 (#peak 21160 )
&rst
ixpk= 21160, nxpk= 0, iat= 220,1722, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46, &end
#
# 401 PHE QB 415 VAL HB 5.81 (#peak 21166 )
&rst
ixpk= 21166, nxpk= 0, iat= -1,1722, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
igr1=1493,1492,
&end
#
# 401 PHE QB 415 VAL QQG 5.28 (#peak 21167 )
&rst
ixpk= 21167, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.99, r4= 8.49,
igr1=1493,1492,
igr2=1724,1725,1726,1728,1729,1730,
&end
#
# 379 ILE QG1 380 LEU QB 4.79 (#peak 21170 )
&rst
ixpk= 21170, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54,
igr1=1132,1131,
igr2=1145,1144,
&end
#
# 331 VAL QQG 349 LEU HG 5.92 (#peak 21175 )
&rst
ixpk= 21175, nxpk= 0, iat= -1, 648, r1= 1.30, r2= 1.80, r3= 7.98, r4= 8.48,
igr1= 357, 358, 359, 361, 362, 363,
&end
#
# 416 SER HA 417 VAL QQG 5.92 (#peak 21176 )
&rst
ixpk= 21176, nxpk= 0, iat=1736, -1, r1= 1.30, r2= 1.80, r3= 7.98, r4= 8.48,
igr2=1751,1752,1753,1755,1756,1757,
&end
#
# 321 ILE HA 417 VAL QQG 5.92 (#peak 21177 )
&rst
ixpk= 21177, nxpk= 0, iat= 187, -1, r1= 1.30, r2= 1.80, r3= 7.98, r4= 8.48,
igr2=1751,1752,1753,1755,1756,1757,
&end
#
# 394 VAL QQG 420 LEU HA 5.92 (#peak 21180 )
&rst
ixpk= 21180, nxpk= 0, iat= -1,1791, r1= 1.30, r2= 1.80, r3= 7.98, r4= 8.48,
igr1=1371,1372,1373,1375,1376,1377,
&end
#
# 339 ALA QB 342 GLY HA2 6.00 (#peak 21184 )
&rst
ixpk= 21184, nxpk= 0, iat= -1, 532, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr1= 485, 486, 487,
&end
#
# 320 PHE H 321 ILE QG2 6.00 (#peak 21189 )
&rst
ixpk= 21189, nxpk= 0, iat= 165, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr2= 191, 192, 193,
&end
#
# 385 LYS QG 386 PHE HB3 6.00 (#peak 21190 )
&rst
ixpk= 21190, nxpk= 0, iat= -1,1243, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1=1225,1224,
&end
#
# 365 LEU QQD 384 TYR QD 6.00 (#peak 21192 )
&rst
ixpk= 21192, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
igr1= 892, 893, 894, 896, 897, 898,
igr2=1204,1211,
&end
#
# 365 LEU QQD 386 PHE QD 6.00 (#peak 21202 )
&rst
ixpk= 21202, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
igr1= 892, 893, 894, 896, 897, 898,
igr2=1247,1255,
&end
#
# 343 TYR HB3 347 GLU QB 5.81 (#peak 21205 )
&rst
ixpk= 21205, nxpk= 0, iat= 540, -1, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
igr2= 612, 611,
&end
#
# 343 TYR QB 344 LEU H 6.00 (#peak 21208 )
&rst
ixpk= 21208, nxpk= 0, iat= -1, 557, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1= 541, 540,
&end
#
# 331 VAL QQG 413 TYR QB 5.92 (#peak 21214 )
&rst
ixpk= 21214, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.96, r4= 9.46,
igr1= 357, 358, 359, 361, 362, 363,
igr2=1683,1682,
&end
#
# 332 TYR QB 333 VAL HB 5.81 (#peak 21224 )
&rst
ixpk= 21224, nxpk= 0, iat= -1, 392, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
igr1= 372, 371,
&end
#
# 329 LYS QD 331 VAL HB 6.00 (#peak 21234 )
&rst
ixpk= 21234, nxpk= 0, iat= -1, 355, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1= 320, 319,
&end
#
# 344 LEU QQD 346 GLN QG 5.18 (#peak 21235 )
&rst
ixpk= 21235, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.84, r4= 8.34,
igr1= 566, 567, 568, 570, 571, 572,
igr2= 598, 597,
&end
#
# 395 THR HA 420 LEU QQD 5.25 (#peak 22422 )
&rst
ixpk= 22422, nxpk= 0, iat=1383, -1, r1= 1.30, r2= 1.80, r3= 7.08, r4= 7.58,
igr2=1798,1799,1800,1802,1803,1804,
&end
#
# 395 THR HA 421 VAL QQG 6.00 (#peak 22423 )
&rst
ixpk= 22423, nxpk= 0, iat=1383, -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
igr2=1814,1815,1816,1818,1819,1820,
&end
#
# 393 PHE HA 394 VAL QQG 5.02 (#peak 22425 )
&rst
ixpk= 22425, nxpk= 0, iat=1347, -1, r1= 1.30, r2= 1.80, r3= 6.77, r4= 7.27,
igr2=1371,1372,1373,1375,1376,1377,
&end
#
# 372 VAL QQG 401 PHE HA 4.02 (#peak 22427 )
&rst
ixpk= 22427, nxpk= 0, iat= -1,1490, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr1=1005,1006,1007,1009,1010,1011,
&end
#
# 379 ILE QD1 401 PHE HA 5.49 (#peak 22428 )
&rst
ixpk= 22428, nxpk= 0, iat= -1,1490, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
igr1=1134,1135,1136,
&end
#
# 380 LEU QQD 401 PHE HA 6.00 (#peak 22429 )
&rst
ixpk= 22429, nxpk= 0, iat= -1,1490, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
igr1=1149,1150,1151,1153,1154,1155,
&end
#
# 379 ILE QD1 399 GLN HA 4.84 (#peak 22430 )
&rst
ixpk= 22430, nxpk= 0, iat= -1,1449, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
igr1=1134,1135,1136,
&end
#
# 379 ILE QG2 380 LEU HA 5.00 (#peak 22431 )
&rst
ixpk= 22431, nxpk= 0, iat= -1,1142, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr1=1127,1128,1129,
&end
#
# 379 ILE QD1 380 LEU HA 4.04 (#peak 22432 )
&rst
ixpk= 22432, nxpk= 0, iat= -1,1142, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
igr1=1134,1135,1136,
&end
#
# 396 LEU HA 397 LYS QB 4.39 (#peak 22433 )
&rst
ixpk= 22433, nxpk= 0, iat=1397, -1, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,
igr2=1419,1418,
&end
#
# 400 TRP HA 417 VAL H 5.04 (#peak 22436 )
&rst
ixpk= 22436, nxpk= 0, iat=1466,1745, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54, &end
#
# 371 ALA QB 372 VAL HA 5.13 (#peak 22438 )
&rst
ixpk= 22438, nxpk= 0, iat= -1,1001, r1= 1.30, r2= 1.80, r3= 6.16, r4= 6.66,
igr1= 993, 994, 995,
&end
#
# 402 SER HA 411 LEU QD1 6.00 (#peak 22440 )
&rst
ixpk= 22440, nxpk= 0, iat=1510, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr2=1653,1654,1655,
&end
#
# 411 LEU QQD 412 GLU HA 5.00 (#peak 22441 )
&rst
ixpk= 22441, nxpk= 0, iat= -1,1665, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
igr1=1653,1654,1655,1657,1658,1659,
&end
#
# 326 VAL HB 411 LEU QQD 4.35 (#peak 22442 )
&rst
ixpk= 22442, nxpk= 0, iat= 276, -1, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
igr2=1653,1654,1655,1657,1658,1659,
&end
#
# 411 LEU QD1 412 GLU QG 6.00 (#peak 22444 )
&rst
ixpk= 22444, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
igr1=1653,1654,1655,
igr2=1671,1670,
&end
#
# 344 LEU QQD 347 GLU QG 3.82 (#peak 22446 )
&rst
ixpk= 22446, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr1= 566, 567, 568, 570, 571, 572,
igr2= 615, 614,
&end
#
# 342 GLY HA2 389 LYS QG 5.00 (#peak 22447 )
&rst
ixpk= 22447, nxpk= 0, iat= 532, -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr2=1301,1300,
&end
#
# 346 GLN QB 349 LEU QQD 4.91 (#peak 22449 )
&rst
ixpk= 22449, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.43, r4= 7.93,
igr1= 595, 594,
igr2= 650, 651, 652, 654, 655, 656,
&end
#
# 368 LYS HA 372 VAL QQG 3.93 (#peak 22451 )
&rst
ixpk= 22451, nxpk= 0, iat= 930, -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr2=1005,1006,1007,1009,1010,1011,
&end
#
# 322 THR QG2 337 ALA QB 6.00 (#peak 22457 )
&rst
ixpk= 22457, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.65, r4= 9.15,
igr1= 212, 213, 214,
igr2= 461, 462, 463,
&end
#
# 368 LYS QB 380 LEU QQD 4.04 (#peak 22458 )
&rst
ixpk= 22458, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
igr1= 933, 932,
igr2=1149,1150,1151,1153,1154,1155,
&end
#
# 325 ALA HA 411 LEU QQD 4.43 (#peak 22459 )
&rst
ixpk= 22459, nxpk= 0, iat= 264, -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr2=1653,1654,1655,1657,1658,1659,
&end
#
# 402 SER HA 411 LEU QD2 6.00 (#peak 22460 )
&rst
ixpk= 22460, nxpk= 0, iat=1510, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr2=1657,1658,1659,
&end
#
# 373 LEU HG 411 LEU QQD 5.50 (#peak 22463 )
&rst
ixpk= 22463, nxpk= 0, iat=1022, -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr2=1653,1654,1655,1657,1658,1659,
&end
#
# 410 GLU QG 411 LEU QQD 5.92 (#peak 22464 )
&rst
ixpk= 22464, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.96, r4= 9.46,
igr1=1637,1636,
igr2=1653,1654,1655,1657,1658,1659,
&end
#
# 411 LEU QD2 412 GLU QG 6.00 (#peak 22465 )
&rst
ixpk= 22465, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
igr1=1657,1658,1659,
igr2=1671,1670,
&end
#
# 326 VAL HB 373 LEU QQD 4.01 (#peak 22466 )
&rst
ixpk= 22466, nxpk= 0, iat= 276, -1, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,
igr2=1024,1025,1026,1028,1029,1030,
&end
#
# 370 LYS HA 373 LEU QQD 6.00 (#peak 22467 )
&rst
ixpk= 22467, nxpk= 0, iat= 969, -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
igr2=1024,1025,1026,1028,1029,1030,
&end
#
# 331 VAL HA 349 LEU HG 4.62 (#peak 22468 )
&rst
ixpk= 22468, nxpk= 0, iat= 353, 648, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12, &end
#
# 368 LYS HA 372 VAL QG2 4.89 (#peak 22469 )
&rst
ixpk= 22469, nxpk= 0, iat= 930, -1, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,
igr2=1009,1010,1011,
&end
#
# 369 HIE QB 372 VAL QQG 5.65 (#peak 22472 )
&rst
ixpk= 22472, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.55, r4= 9.05,
igr1= 955, 954,
igr2=1005,1006,1007,1009,1010,1011,
&end
#
# 397 LYS QB 419 THR QG2 3.64 (#peak 22474 )
&rst
ixpk= 22474, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
igr1=1419,1418,
igr2=1783,1784,1785,
&end
#
# 419 THR QG2 420 LEU HG 6.00 (#peak 22475 )
&rst
ixpk= 22475, nxpk= 0, iat= -1,1796, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr1=1783,1784,1785,
&end
#
# 395 THR QG2 421 VAL QQG 3.48 (#peak 22476 )
&rst
ixpk= 22476, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr1=1389,1390,1391,
igr2=1814,1815,1816,1818,1819,1820,
&end
#
# 326 VAL QQG 411 LEU QQD 3.96 (#peak 22479 )
&rst
ixpk= 22479, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.20, r4= 7.70,
igr1= 278, 279, 280, 282, 283, 284,
igr2=1653,1654,1655,1657,1658,1659,
&end
#
# 326 VAL QQG 373 LEU HG 6.00 (#peak 22480 )
&rst
ixpk= 22480, nxpk= 0, iat= -1,1022, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
igr1= 278, 279, 280, 282, 283, 284,
&end
#
# 332 TYR HA 349 LEU HG 4.20 (#peak 22482 )
&rst
ixpk= 22482, nxpk= 0, iat= 369, 648, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 397 LYS QE 419 THR QG2 4.97 (#peak 22483 )
&rst
ixpk= 22483, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.70, r4= 7.20,
igr1=1428,1427,
igr2=1783,1784,1785,
&end
#
# 333 VAL QQG 348 LEU QQD 4.56 (#peak 22486 )
&rst
ixpk= 22486, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.29, r4= 8.79,
igr1= 394, 395, 396, 398, 399, 400,
igr2= 631, 632, 633, 635, 636, 637,
&end
#
# 394 VAL QQG 420 LEU HG 3.92 (#peak 22488 )
&rst
ixpk= 22488, nxpk= 0, iat= -1,1796, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
igr1=1371,1372,1373,1375,1376,1377,
&end
#
# 347 GLU HA 351 THR QG2 4.54 (#peak 22489 )
&rst
ixpk= 22489, nxpk= 0, iat= 609, -1, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,
igr2= 675, 676, 677,
&end
#
# 368 LYS HA 371 ALA QB 3.78 (#peak 22490 )
&rst
ixpk= 22490, nxpk= 0, iat= 930, -1, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
igr2= 993, 994, 995,
&end
#
# 368 LYS HA 380 LEU QB 6.00 (#peak 22491 )
&rst
ixpk= 22491, nxpk= 0, iat= 930, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=1145,1144,
&end
#
# 340 ILE QG1 388 ALA QB 4.66 (#peak 22492 )
&rst
ixpk= 22492, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.28, r4= 6.78,
igr1= 502, 501,
igr2=1287,1288,1289,
&end
#
# 372 VAL QQG 402 SER HA 4.26 (#peak 22493 )
&rst
ixpk= 22493, nxpk= 0, iat= -1,1510, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
igr1=1005,1006,1007,1009,1010,1011,
&end
#
# 369 HIE HA 372 VAL QQG 3.95 (#peak 22495 )
&rst
ixpk= 22495, nxpk= 0, iat= 952, -1, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
igr2=1005,1006,1007,1009,1010,1011,
&end
#
# 372 VAL QQG 373 LEU HA 4.59 (#peak 22497 )
&rst
ixpk= 22497, nxpk= 0, iat= -1,1017, r1= 1.30, r2= 1.80, r3= 6.19, r4= 6.69,
igr1=1005,1006,1007,1009,1010,1011,
&end
#
# 338 THR QG2 339 ALA QB 4.84 (#peak 22499 )
&rst
ixpk= 22499, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.98, r4= 7.48,
igr1= 475, 476, 477,
igr2= 485, 486, 487,
&end
#
# 372 VAL QQG 414 ILE QG2 4.54 (#peak 22500 )
&rst
ixpk= 22500, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.35, r4= 7.85,
igr1=1005,1006,1007,1009,1010,1011,
igr2=1705,1706,1707,
&end
#
# 380 LEU QQD 414 ILE QG2 4.72 (#peak 22501 )
&rst
ixpk= 22501, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
igr1=1149,1150,1151,1153,1154,1155,
igr2=1705,1706,1707,
&end
#
# 371 ALA QB 380 LEU QQD 4.32 (#peak 22503 )
&rst
ixpk= 22503, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.99, r4= 7.49,
igr1= 993, 994, 995,
igr2=1149,1150,1151,1153,1154,1155,
&end
#
# 363 ASN QB 364 ASN HA 3.36 (#peak 22504 )
&rst
ixpk= 22504, nxpk= 0, iat= -1, 871, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
igr1= 860, 859,
&end
#
# 379 ILE QD1 399 GLN QB 5.70 (#peak 22505 )
&rst
ixpk= 22505, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.68, r4= 8.18,
igr1=1134,1135,1136,
igr2=1452,1451,
&end
#
# 315 VAL HB 316 LYS HA 4.65 (#peak 22506 )
&rst
ixpk= 22506, nxpk= 0, iat= 88, 102, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15, &end
#
# 316 LYS HA 336 ARG HB2 6.00 (#peak 22507 )
&rst
ixpk= 22507, nxpk= 0, iat= 102, 438, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 318 THR QG2 341 LEU HA 5.18 (#peak 22510 )
&rst
ixpk= 22510, nxpk= 0, iat= -1, 512, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
igr1= 144, 145, 146,
&end
#
# 338 THR QG2 339 ALA HA 4.77 (#peak 22511 )
&rst
ixpk= 22511, nxpk= 0, iat= -1, 483, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23,
igr1= 475, 476, 477,
&end
#
# 337 ALA HA 340 ILE QD1 4.35 (#peak 22512 )
&rst
ixpk= 22512, nxpk= 0, iat= 459, -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
igr2= 504, 505, 506,
&end
#
# 344 LEU HA 345 PRO QG 5.16 (#peak 22513 )
&rst
ixpk= 22513, nxpk= 0, iat= 559, -1, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,
igr2= 586, 585,
&end
#
# 344 LEU HA 347 GLU QB 5.81 (#peak 22514 )
&rst
ixpk= 22514, nxpk= 0, iat= 559, -1, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
igr2= 612, 611,
&end
#
# 334 ASP HA 335 GLN QB 5.38 (#peak 22515 )
&rst
ixpk= 22515, nxpk= 0, iat= 406, -1, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54,
igr2= 421, 420,
&end
#
# 340 ILE QD1 394 VAL QQG 5.18 (#peak 22516 )
&rst
ixpk= 22516, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.39, r4= 8.89,
igr1= 504, 505, 506,
igr2=1371,1372,1373,1375,1376,1377,
&end
#
# 372 VAL QG1 414 ILE QD1 5.04 (#peak 22517 )
&rst
ixpk= 22517, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1005,1006,1007,
igr2=1712,1713,1714,
&end
#
# 316 LYS HA 317 PRO QD 3.51 (#peak 22519 )
&rst
ixpk= 22519, nxpk= 0, iat= 102, -1, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,
igr2= 124, 123,
&end
#
# 316 LYS QB 317 PRO QD 4.24 (#peak 22520 )
&rst
ixpk= 22520, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr1= 105, 104,
igr2= 124, 123,
&end
#
# 396 LEU QB 397 LYS QB 4.79 (#peak 22521 )
&rst
ixpk= 22521, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54,
igr1=1400,1399,
igr2=1419,1418,
&end
#
# 396 LEU QB 420 LEU HG 6.00 (#peak 22522 )
&rst
ixpk= 22522, nxpk= 0, iat= -1,1796, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1=1400,1399,
&end
#
# 341 LEU QQD 387 ARG QD 4.57 (#peak 22523 )
&rst
ixpk= 22523, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.91, r4= 7.41,
igr1= 519, 520, 521, 523, 524, 525,
igr2=1270,1269,
&end
#
# 368 LYS QE 380 LEU QQD 3.78 (#peak 22525 )
&rst
ixpk= 22525, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
igr1= 942, 941,
igr2=1149,1150,1151,1153,1154,1155,
&end
#
# 373 LEU QB 411 LEU QQD 4.09 (#peak 22526 )
&rst
ixpk= 22526, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.19, r4= 6.69,
igr1=1020,1019,
igr2=1653,1654,1655,1657,1658,1659,
&end
#
# 367 ASP QB 370 LYS QD 4.84 (#peak 22527 )
&rst
ixpk= 22527, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.10, r4= 6.60,
igr1= 921, 920,
igr2= 978, 977,
&end
#
# 363 ASN QB 367 ASP QB 3.40 (#peak 22528 )
&rst
ixpk= 22528, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,
igr1= 860, 859,
igr2= 921, 920,
&end
#
# 319 GLU QG 417 VAL QQG 5.66 (#peak 22530 )
&rst
ixpk= 22530, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.56, r4= 9.06,
igr1= 158, 157,
igr2=1751,1752,1753,1755,1756,1757,
&end
#
# 326 VAL HB 373 LEU HB2 4.35 (#peak 22533 )
&rst
ixpk= 22533, nxpk= 0, iat= 276,1020, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85, &end
#
# 388 ALA QB 389 LYS QB 4.60 (#peak 22534 )
&rst
ixpk= 22534, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
igr1=1287,1288,1289,
igr2=1298,1297,
&end
#
# 372 VAL HB 380 LEU QQD 4.58 (#peak 22535 )
&rst
ixpk= 22535, nxpk= 0, iat=1003, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2=1149,1150,1151,1153,1154,1155,
&end
#
# 368 LYS QB 371 ALA QB 3.67 (#peak 22536 )
&rst
ixpk= 22536, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr1= 933, 932,
igr2= 993, 994, 995,
&end
#
# 395 THR HB 421 VAL QQG 4.21 (#peak 22537 )
&rst
ixpk= 22537, nxpk= 0, iat=1385, -1, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
igr2=1814,1815,1816,1818,1819,1820,
&end
#
# 333 VAL QQG 345 PRO HA 3.69 (#peak 22538 )
&rst
ixpk= 22538, nxpk= 0, iat= -1, 580, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
igr1= 394, 395, 396, 398, 399, 400,
&end
#
# 352 SER HA 355 GLU QB 6.00 (#peak 22539 )
&rst
ixpk= 22539, nxpk= 0, iat= 683, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2= 729, 728,
&end
#
# 344 LEU QB 345 PRO QG 5.03 (#peak 22540 )
&rst
ixpk= 22540, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.34, r4= 6.84,
igr1= 562, 561,
igr2= 586, 585,
&end
#
# 373 LEU H 411 LEU QQD 5.48 (#peak 22541 )
&rst
ixpk= 22541, nxpk= 0, iat=1015, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=1653,1654,1655,1657,1658,1659,
&end
#
# 365 LEU HG 384 TYR QD 4.97 (#peak 22543 )
&rst
ixpk= 22543, nxpk= 0, iat= 890, -1, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr2=1204,1211,
&end
#
# 372 VAL QQG 400 TRP HD1 5.28 (#peak 22545 )
&rst
ixpk= 22545, nxpk= 0, iat= -1,1472, r1= 1.30, r2= 1.80, r3= 7.12, r4= 7.62,
igr1=1005,1006,1007,1009,1010,1011,
&end
#
# 378 LYS H 380 LEU QQD 4.80 (#peak 22547 )
&rst
ixpk= 22547, nxpk= 0, iat=1099, -1, r1= 1.30, r2= 1.80, r3= 6.47, r4= 6.97,
igr2=1149,1150,1151,1153,1154,1155,
&end
#
# 333 VAL H 331 VAL QQG 6.00 (#peak 22550 )
&rst
ixpk= 22550, nxpk= 0, iat= 388, -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
igr2= 357, 358, 359, 361, 362, 363,
&end
#
# 332 TYR QD 349 LEU HG 4.98 (#peak 22551 )
&rst
ixpk= 22551, nxpk= 0, iat= -1, 648, r1= 1.30, r2= 1.80, r3= 5.59, r4= 6.09,
igr1= 375, 382,
&end
#
# 403 PHE H 414 ILE HA 4.31 (#peak 22552 )
&rst
ixpk= 22552, nxpk= 0, iat=1519,1701, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81, &end
#
# 324 PHE H 331 VAL QQG 4.91 (#peak 22557 )
&rst
ixpk= 22557, nxpk= 0, iat= 242, -1, r1= 1.30, r2= 1.80, r3= 6.62, r4= 7.12,
igr2= 357, 358, 359, 361, 362, 363,
&end
#
# 348 LEU QQD 349 LEU H 6.00 (#peak 22559 )
&rst
ixpk= 22559, nxpk= 0, iat= -1, 641, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
igr1= 631, 632, 633, 635, 636, 637,
&end
#
# 417 VAL QQG 419 THR H 5.92 (#peak 22560 )
&rst
ixpk= 22560, nxpk= 0, iat= -1,1775, r1= 1.30, r2= 1.80, r3= 7.98, r4= 8.48,
igr1=1751,1752,1753,1755,1756,1757,
&end
#
# 333 VAL QQG 348 LEU H 5.61 (#peak 22561 )
&rst
ixpk= 22561, nxpk= 0, iat= -1, 622, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
igr1= 394, 395, 396, 398, 399, 400,
&end
#
# 346 GLN HA 349 LEU H 6.00 (#peak 22563 )
&rst
ixpk= 22563, nxpk= 0, iat= 592, 641, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 355 GLU HA 357 PHE H 5.30 (#peak 22564 )
&rst
ixpk= 22564, nxpk= 0, iat= 726, 760, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80, &end
#
# 321 ILE QG2 322 THR HA 6.00 (#peak 22570 )
&rst
ixpk= 22570, nxpk= 0, iat= -1, 206, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr1= 191, 192, 193,
&end
#
# 383 SER HA 397 LYS QE 4.87 (#peak 22574 )
&rst
ixpk= 22574, nxpk= 0, iat=1187, -1, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,
igr2=1428,1427,
&end
#
# 411 LEU QB 412 GLU H 4.51 (#peak 22576 )
&rst
ixpk= 22576, nxpk= 0, iat= -1,1663, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
igr1=1649,1648,
&end
#
# 364 ASN H 367 ASP QB 4.82 (#peak 22577 )
&rst
ixpk= 22577, nxpk= 0, iat= 869, -1, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,
igr2= 921, 920,
&end
#
# 343 TYR HB3 348 LEU H 6.00 (#peak 22579 )
&rst
ixpk= 22579, nxpk= 0, iat= 540, 622, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 321 ILE HB 322 THR HA 6.00 (#peak 22581 )
&rst
ixpk= 22581, nxpk= 0, iat= 189, 206, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 319 GLU QG 320 PHE H 5.28 (#peak 22585 )
&rst
ixpk= 22585, nxpk= 0, iat= -1, 165, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr1= 158, 157,
&end
#
# 319 GLU QG 418 ASN H 5.24 (#peak 22586 )
&rst
ixpk= 22586, nxpk= 0, iat= -1,1761, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
igr1= 158, 157,
&end
#
# 410 GLU QG 412 GLU H 6.00 (#peak 22587 )
&rst
ixpk= 22587, nxpk= 0, iat= -1,1663, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1=1637,1636,
&end
#
# 319 GLU QB 320 PHE H 5.94 (#peak 22588 )
&rst
ixpk= 22588, nxpk= 0, iat= -1, 165, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
igr1= 155, 154,
&end
#
# 319 GLU QB 418 ASN H 5.18 (#peak 22589 )
&rst
ixpk= 22589, nxpk= 0, iat= -1,1761, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
igr1= 155, 154,
&end
#
# 418 ASN H 419 THR HB 6.00 (#peak 22591 )
&rst
ixpk= 22591, nxpk= 0, iat=1761,1779, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 399 GLN H 417 VAL HB 5.70 (#peak 22592 )
&rst
ixpk= 22592, nxpk= 0, iat=1447,1749, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20, &end
#
# 372 VAL HB 400 TRP HD1 5.13 (#peak 22594 )
&rst
ixpk= 22594, nxpk= 0, iat=1003,1472, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63, &end
#
# 345 PRO QG 346 GLN H 5.76 (#peak 22596 )
&rst
ixpk= 22596, nxpk= 0, iat= -1, 590, r1= 1.30, r2= 1.80, r3= 6.47, r4= 6.97,
igr1= 586, 585,
&end
#
# 344 LEU HG 345 PRO QD 4.22 (#peak 22597 )
&rst
ixpk= 22597, nxpk= 0, iat= 564, -1, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr2= 578, 577,
&end
#
# 379 ILE HB 401 PHE HA 4.52 (#peak 22599 )
&rst
ixpk= 22599, nxpk= 0, iat=1125,1490, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02, &end
#
# 372 VAL QG2 380 LEU QB 6.00 (#peak 22601 )
&rst
ixpk= 22601, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
igr1=1009,1010,1011,
igr2=1145,1144,
&end
#
# 321 ILE HA 322 THR HB 5.84 (#peak 22604 )
&rst
ixpk= 22604, nxpk= 0, iat= 187, 208, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34, &end
#
# 324 PHE HA 325 ALA QB 5.16 (#peak 22606 )
&rst
ixpk= 22606, nxpk= 0, iat= 244, -1, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
igr2= 266, 267, 268,
&end
#
# 340 ILE QG2 341 LEU HA 5.06 (#peak 22608 )
&rst
ixpk= 22608, nxpk= 0, iat= -1, 512, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
igr1= 497, 498, 499,
&end
#
# 363 ASN HA 367 ASP QB 4.42 (#peak 22611 )
&rst
ixpk= 22611, nxpk= 0, iat= 857, -1, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
igr2= 921, 920,
&end
#
# 344 LEU QQD 347 GLU HA 4.90 (#peak 22612 )
&rst
ixpk= 22612, nxpk= 0, iat= -1, 609, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 566, 567, 568, 570, 571, 572,
&end
#
# 338 THR HA 343 TYR HA 4.55 (#peak 22617 )
&rst
ixpk= 22617, nxpk= 0, iat= 469, 538, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05, &end
#
# 376 LYS H 377 GLU HA 4.11 (#peak 22618 )
&rst
ixpk= 22618, nxpk= 0, iat=1062,1086, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 321 ILE HA 322 THR QG2 5.05 (#peak 22622 )
&rst
ixpk= 22622, nxpk= 0, iat= 187, -1, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
igr2= 212, 213, 214,
&end
#
# 321 ILE HA 418 ASN QB 4.91 (#peak 22623 )
&rst
ixpk= 22623, nxpk= 0, iat= 187, -1, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
igr2=1766,1765,
&end
#
# 383 SER HA 395 THR QG2 4.70 (#peak 22624 )
&rst
ixpk= 22624, nxpk= 0, iat=1187, -1, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14,
igr2=1389,1390,1391,
&end
#
# 383 SER HA 397 LYS HA 5.43 (#peak 22625 )
&rst
ixpk= 22625, nxpk= 0, iat=1187,1416, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93, &end
#
# 322 THR HA 333 VAL HA 4.76 (#peak 22626 )
&rst
ixpk= 22626, nxpk= 0, iat= 206, 390, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26, &end
#
# 387 ARG HA 393 PHE HA 4.86 (#peak 22627 )
&rst
ixpk= 22627, nxpk= 0, iat=1261,1347, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36, &end
#
# 378 LYS HA 401 PHE HA 4.40 (#peak 22628 )
&rst
ixpk= 22628, nxpk= 0, iat=1101,1490, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 320 PHE HA 336 ARG HG3 4.96 (#peak 22629 )
&rst
ixpk= 22629, nxpk= 0, iat= 167, 440, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46, &end
#
# 319 GLU HA 419 THR QG2 4.79 (#peak 22631 )
&rst
ixpk= 22631, nxpk= 0, iat= 152, -1, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
igr2=1783,1784,1785,
&end
#
# 324 PHE HA 331 VAL QQG 4.66 (#peak 22633 )
&rst
ixpk= 22633, nxpk= 0, iat= 244, -1, r1= 1.30, r2= 1.80, r3= 6.28, r4= 6.78,
igr2= 357, 358, 359, 361, 362, 363,
&end
#
# 324 PHE HA 330 PHE HA 4.94 (#peak 22635 )
&rst
ixpk= 22635, nxpk= 0, iat= 244, 333, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44, &end
#
# 396 LEU HA 397 LYS HB3 5.00 (#peak 22636 )
&rst
ixpk= 22636, nxpk= 0, iat=1397,1418, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 396 LEU HA 420 LEU HA 4.94 (#peak 22638 )
&rst
ixpk= 22638, nxpk= 0, iat=1397,1791, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44, &end
#
# 319 GLU HA 419 THR HA 4.74 (#peak 22641 )
&rst
ixpk= 22641, nxpk= 0, iat= 152,1777, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24, &end
#
# 321 ILE HA 322 THR H 4.11 (#peak 22642 )
&rst
ixpk= 22642, nxpk= 0, iat= 187, 204, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 321 ILE HA 418 ASN H 5.02 (#peak 22643 )
&rst
ixpk= 22643, nxpk= 0, iat= 187,1761, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52, &end
#
# 322 THR HA 332 TYR QD 5.00 (#peak 22644 )
&rst
ixpk= 22644, nxpk= 0, iat= 206, -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr2= 375, 382,
&end
#
# 398 SER HA 419 THR H 5.03 (#peak 22647 )
&rst
ixpk= 22647, nxpk= 0, iat=1438,1775, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53, &end
#
# 398 SER HA 418 ASN HA 4.42 (#peak 22648 )
&rst
ixpk= 22648, nxpk= 0, iat=1438,1763, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92, &end
#
# 401 PHE H 416 SER HA 5.11 (#peak 22652 )
&rst
ixpk= 22652, nxpk= 0, iat=1488,1736, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61, &end
#
# 385 LYS HA 395 THR HA 4.44 (#peak 22655 )
&rst
ixpk= 22655, nxpk= 0, iat=1219,1383, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94, &end
#
# 380 LEU HA 400 TRP H 5.09 (#peak 22658 )
&rst
ixpk= 22658, nxpk= 0, iat=1142,1464, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59, &end
#
# 400 TRP HA 416 SER HA 4.73 (#peak 22660 )
&rst
ixpk= 22660, nxpk= 0, iat=1466,1736, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, &end
#
# 401 PHE H 400 TRP HA 4.03 (#peak 22661 )
&rst
ixpk= 22661, nxpk= 0, iat=1488,1466, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53, &end
#
# 402 SER QB 411 LEU QQD 3.65 (#peak 22664 )
&rst
ixpk= 22664, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
igr1=1513,1512,
igr2=1653,1654,1655,1657,1658,1659,
&end
#
# 373 LEU HA 411 LEU QQD 5.13 (#peak 22666 )
&rst
ixpk= 22666, nxpk= 0, iat=1017, -1, r1= 1.30, r2= 1.80, r3= 6.92, r4= 7.42,
igr2=1653,1654,1655,1657,1658,1659,
&end
#
# 352 SER QB 356 TYR HA 5.92 (#peak 22669 )
&rst
ixpk= 22669, nxpk= 0, iat= -1, 741, r1= 1.30, r2= 1.80, r3= 6.64, r4= 7.14,
igr1= 686, 685,
&end
#
# 329 LYS QG 353 CYS QB 4.52 (#peak 22671 )
&rst
ixpk= 22671, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
igr1= 317, 316,
igr2= 697, 696,
&end
#
# 383 SER QB 395 THR QG2 4.13 (#peak 22672 )
&rst
ixpk= 22672, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
igr1=1190,1189,
igr2=1389,1390,1391,
&end
#
# 353 CYS QB 354 TYR QB 4.26 (#peak 22674 )
&rst
ixpk= 22674, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr1= 697, 696,
igr2= 708, 707,
&end
#
# 318 THR QG2 341 LEU HG 5.50 (#peak 22676 )
&rst
ixpk= 22676, nxpk= 0, iat= -1, 517, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 144, 145, 146,
&end
#
# 337 ALA QB 341 LEU HG 4.86 (#peak 22677 )
&rst
ixpk= 22677, nxpk= 0, iat= -1, 517, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
igr1= 461, 462, 463,
&end
#
# 322 THR QG2 415 VAL HA 5.02 (#peak 22678 )
&rst
ixpk= 22678, nxpk= 0, iat= -1,1720, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
igr1= 212, 213, 214,
&end
#
# 372 VAL QQG 400 TRP QB 5.50 (#peak 22680 )
&rst
ixpk= 22680, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
igr1=1005,1006,1007,1009,1010,1011,
igr2=1469,1468,
&end
#
# 372 VAL QQG 379 ILE HB 4.58 (#peak 22682 )
&rst
ixpk= 22682, nxpk= 0, iat= -1,1125, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1=1005,1006,1007,1009,1010,1011,
&end
#
# 322 THR QG2 333 VAL QQG 4.26 (#peak 22686 )
&rst
ixpk= 22686, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr1= 212, 213, 214,
igr2= 394, 395, 396, 398, 399, 400,
&end
#
# 411 LEU QQD 412 GLU HB2 5.77 (#peak 22689 )
&rst
ixpk= 22689, nxpk= 0, iat= -1,1668, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
igr1=1653,1654,1655,1657,1658,1659,
&end
#
# 373 LEU QQD 411 LEU QQD 3.22 (#peak 22691 )
&rst
ixpk= 22691, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
igr1=1024,1025,1026,1028,1029,1030,
igr2=1653,1654,1655,1657,1658,1659,
&end
#
# 343 TYR HB3 348 LEU HG 5.35 (#peak 22692 )
&rst
ixpk= 22692, nxpk= 0, iat= 540, 629, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85, &end
#
# 341 LEU QQD 348 LEU HG 3.87 (#peak 22693 )
&rst
ixpk= 22693, nxpk= 0, iat= -1, 629, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
igr1= 519, 520, 521, 523, 524, 525,
&end
#
# 343 TYR HB2 348 LEU HG 6.00 (#peak 22694 )
&rst
ixpk= 22694, nxpk= 0, iat= 541, 629, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 353 CYS QB 365 LEU HG 4.61 (#peak 22695 )
&rst
ixpk= 22695, nxpk= 0, iat= -1, 890, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67,
igr1= 697, 696,
&end
#
# 315 VAL HA 316 LYS QB 5.07 (#peak 22696 )
&rst
ixpk= 22696, nxpk= 0, iat= 86, -1, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
igr2= 105, 104,
&end
#
# 373 LEU QQD 414 ILE QD1 4.38 (#peak 22698 )
&rst
ixpk= 22698, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.09, r4= 7.59,
igr1=1024,1025,1026,1028,1029,1030,
igr2=1712,1713,1714,
&end
#
# 326 VAL HA 373 LEU QQD 4.75 (#peak 22699 )
&rst
ixpk= 22699, nxpk= 0, iat= 274, -1, r1= 1.30, r2= 1.80, r3= 6.40, r4= 6.90,
igr2=1024,1025,1026,1028,1029,1030,
&end
#
# 368 LYS QD 380 LEU QQD 4.11 (#peak 22700 )
&rst
ixpk= 22700, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
igr1= 939, 938,
igr2=1149,1150,1151,1153,1154,1155,
&end
#
# 329 LYS QB 351 THR HB 4.95 (#peak 22701 )
&rst
ixpk= 22701, nxpk= 0, iat= -1, 671, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
igr1= 314, 313,
&end
#
# 340 ILE QG1 341 LEU QQD 3.60 (#peak 22703 )
&rst
ixpk= 22703, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,
igr1= 502, 501,
igr2= 519, 520, 521, 523, 524, 525,
&end
#
# 330 PHE QB 349 LEU HG 4.68 (#peak 22706 )
&rst
ixpk= 22706, nxpk= 0, iat= -1, 648, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
igr1= 336, 335,
&end
#
# 404 THR HA 411 LEU QQD 4.35 (#peak 22709 )
&rst
ixpk= 22709, nxpk= 0, iat=1541, -1, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
igr2=1653,1654,1655,1657,1658,1659,
&end
#
# 323 ARG QG 415 VAL QQG 5.43 (#peak 22710 )
&rst
ixpk= 22710, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.22, r4= 8.72,
igr1= 226, 225,
igr2=1724,1725,1726,1728,1729,1730,
&end
#
# 338 THR QG2 344 LEU HA 5.42 (#peak 22711 )
&rst
ixpk= 22711, nxpk= 0, iat= -1, 559, r1= 1.30, r2= 1.80, r3= 6.51, r4= 7.01,
igr1= 475, 476, 477,
&end
#
# 402 SER HA 414 ILE HA 4.20 (#peak 22712 )
&rst
ixpk= 22712, nxpk= 0, iat=1510,1701, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 372 VAL QQG 380 LEU QQD 4.48 (#peak 22713 )
&rst
ixpk= 22713, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.14, r4= 8.64,
igr1=1005,1006,1007,1009,1010,1011,
igr2=1149,1150,1151,1153,1154,1155,
&end
#
# 372 VAL QG2 414 ILE QD1 5.04 (#peak 22715 )
&rst
ixpk= 22715, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1009,1010,1011,
igr2=1712,1713,1714,
&end
#
# 323 ARG QG 415 VAL QQG 4.41 (#peak 22718 )
&rst
ixpk= 22718, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
igr1= 226, 225,
igr2=1724,1725,1726,1728,1729,1730,
&end
#
# 372 VAL QQG 414 ILE QG1 4.44 (#peak 22719 )
&rst
ixpk= 22719, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.72, r4= 7.22,
igr1=1005,1006,1007,1009,1010,1011,
igr2=1710,1709,
&end
#
# 354 TYR QB 366 THR QG2 5.56 (#peak 22720 )
&rst
ixpk= 22720, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.49, r4= 7.99,
igr1= 708, 707,
igr2= 910, 911, 912,
&end
#
# 319 GLU QG 419 THR QG2 4.70 (#peak 22721 )
&rst
ixpk= 22721, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.34, r4= 6.84,
igr1= 158, 157,
igr2=1783,1784,1785,
&end
#
# 319 GLU QB 419 THR QG2 4.40 (#peak 22722 )
&rst
ixpk= 22722, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr1= 155, 154,
igr2=1783,1784,1785,
&end
#
# 419 THR QG2 421 VAL QQG 4.75 (#peak 22723 )
&rst
ixpk= 22723, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.69, r4= 8.19,
igr1=1783,1784,1785,
igr2=1814,1815,1816,1818,1819,1820,
&end
#
# 325 ALA QB 331 VAL QQG 3.90 (#peak 22724 )
&rst
ixpk= 22724, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.31, r4= 6.81,
igr1= 266, 267, 268,
igr2= 357, 358, 359, 361, 362, 363,
&end
#
# 326 VAL QQG 327 ASN HA 5.02 (#peak 22725 )
&rst
ixpk= 22725, nxpk= 0, iat= -1, 290, r1= 1.30, r2= 1.80, r3= 6.77, r4= 7.27,
igr1= 278, 279, 280, 282, 283, 284,
&end
#
# 341 LEU QQD 348 LEU QQD 4.45 (#peak 22726 )
&rst
ixpk= 22726, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
igr1= 519, 520, 521, 523, 524, 525,
igr2= 631, 632, 633, 635, 636, 637,
&end
#
# 313 ILE QG1 315 VAL QQG 2.68 (#peak 22727 )
&rst
ixpk= 22727, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,
igr1= 62, 61,
igr2= 90, 91, 92, 94, 95, 96,
&end
#
# 364 ASN QB 365 LEU QQD 5.12 (#peak 22728 )
&rst
ixpk= 22728, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.75, r4= 8.25,
igr1= 874, 873,
igr2= 892, 893, 894, 896, 897, 898,
&end
#
# 353 CYS QB 365 LEU QQD 4.70 (#peak 22729 )
&rst
ixpk= 22729, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.11, r4= 7.61,
igr1= 697, 696,
igr2= 892, 893, 894, 896, 897, 898,
&end
#
# 394 VAL QQG 420 LEU QQD 3.07 (#peak 22731 )
&rst
ixpk= 22731, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr1=1371,1372,1373,1375,1376,1377,
igr2=1798,1799,1800,1802,1803,1804,
&end
#
# 333 VAL QQG 351 THR QG2 4.49 (#peak 22733 )
&rst
ixpk= 22733, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 394, 395, 396, 398, 399, 400,
igr2= 675, 676, 677,
&end
#
# 333 VAL QQG 337 ALA QB 3.58 (#peak 22734 )
&rst
ixpk= 22734, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
igr1= 394, 395, 396, 398, 399, 400,
igr2= 461, 462, 463,
&end
#
# 333 VAL QQG 348 LEU HG 5.28 (#peak 22735 )
&rst
ixpk= 22735, nxpk= 0, iat= -1, 629, r1= 1.30, r2= 1.80, r3= 7.12, r4= 7.62,
igr1= 394, 395, 396, 398, 399, 400,
&end
#
# 379 ILE HA 380 LEU QQD 3.76 (#peak 22736 )
&rst
ixpk= 22736, nxpk= 0, iat=1123, -1, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
igr2=1149,1150,1151,1153,1154,1155,
&end
#
# 346 GLN HA 349 LEU QQD 4.50 (#peak 22737 )
&rst
ixpk= 22737, nxpk= 0, iat= 592, -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
igr2= 650, 651, 652, 654, 655, 656,
&end
#
# 386 PHE QB 394 VAL QQG 5.92 (#peak 22738 )
&rst
ixpk= 22738, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.96, r4= 9.46,
igr1=1244,1243,
igr2=1371,1372,1373,1375,1376,1377,
&end
#
# 368 LYS HA 380 LEU QQD 5.08 (#peak 22741 )
&rst
ixpk= 22741, nxpk= 0, iat= 930, -1, r1= 1.30, r2= 1.80, r3= 6.85, r4= 7.35,
igr2=1149,1150,1151,1153,1154,1155,
&end
#
# 341 LEU HA 388 ALA QB 4.88 (#peak 22744 )
&rst
ixpk= 22744, nxpk= 0, iat= 512, -1, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
igr2=1287,1288,1289,
&end
#
# 341 LEU QQD 388 ALA QB 5.33 (#peak 22745 )
&rst
ixpk= 22745, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.63, r4= 9.13,
igr1= 519, 520, 521, 523, 524, 525,
igr2=1287,1288,1289,
&end
#
# 367 ASP HA 370 LYS QB 3.98 (#peak 22746 )
&rst
ixpk= 22746, nxpk= 0, iat= 918, -1, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
igr2= 972, 971,
&end
#
# 367 ASP HA 370 LYS QD 4.87 (#peak 22747 )
&rst
ixpk= 22747, nxpk= 0, iat= 918, -1, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,
igr2= 978, 977,
&end
#
# 341 LEU QB 387 ARG HA 4.57 (#peak 22749 )
&rst
ixpk= 22749, nxpk= 0, iat= -1,1261, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
igr1= 515, 514,
&end
#
# 404 THR HA 409 LYS HA 5.34 (#peak 22750 )
&rst
ixpk= 22750, nxpk= 0, iat=1541,1609, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84, &end
#
# 408 THR QG2 409 LYS HA 4.46 (#peak 22751 )
&rst
ixpk= 22751, nxpk= 0, iat= -1,1609, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
igr1=1601,1602,1603,
&end
#
# 343 TYR HA 389 LYS QB 4.26 (#peak 22752 )
&rst
ixpk= 22752, nxpk= 0, iat= 538, -1, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
igr2=1298,1297,
&end
#
# 409 LYS HA 404 THR QG2 4.09 (#peak 22753 )
&rst
ixpk= 22753, nxpk= 0, iat=1609, -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
igr2=1547,1548,1549,
&end
#
# 330 PHE QB 349 LEU HA 4.69 (#peak 22754 )
&rst
ixpk= 22754, nxpk= 0, iat= -1, 643, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr1= 336, 335,
&end
#
# 407 ASP HA 408 THR HA 4.20 (#peak 22757 )
&rst
ixpk= 22757, nxpk= 0, iat=1583,1595, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 379 ILE QD1 380 LEU QB 4.23 (#peak 22758 )
&rst
ixpk= 22758, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr1=1134,1135,1136,
igr2=1145,1144,
&end
#
# 340 ILE QG2 339 ALA QB 4.22 (#peak 22759 )
&rst
ixpk= 22759, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.09, r4= 6.59,
igr1= 497, 498, 499,
igr2= 485, 486, 487,
&end
#
# 411 LEU QQD 413 TYR HA 4.85 (#peak 22760 )
&rst
ixpk= 22760, nxpk= 0, iat= -1,1680, r1= 1.30, r2= 1.80, r3= 6.54, r4= 7.04,
igr1=1653,1654,1655,1657,1658,1659,
&end
#
# 373 LEU HG 374 GLN HA 3.77 (#peak 22761 )
&rst
ixpk= 22761, nxpk= 0, iat=1022,1036, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27, &end
#
# 373 LEU HB3 374 GLN HA 6.00 (#peak 22762 )
&rst
ixpk= 22762, nxpk= 0, iat=1019,1036, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 376 LYS QB 410 GLU HA 4.24 (#peak 22763 )
&rst
ixpk= 22763, nxpk= 0, iat= -1,1631, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
igr1=1067,1066,
&end
#
# 371 ALA HA 374 GLN QB 4.46 (#peak 22765 )
&rst
ixpk= 22765, nxpk= 0, iat= 991, -1, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
igr2=1039,1038,
&end
#
# 371 ALA HA 380 LEU QQD 4.54 (#peak 22766 )
&rst
ixpk= 22766, nxpk= 0, iat= 991, -1, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,
igr2=1149,1150,1151,1153,1154,1155,
&end
#
# 359 GLN QG 360 ASP HA 3.92 (#peak 22767 )
&rst
ixpk= 22767, nxpk= 0, iat= -1, 816, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,
igr1= 805, 804,
&end
#
# 371 ALA HA 374 GLN QG 4.72 (#peak 22768 )
&rst
ixpk= 22768, nxpk= 0, iat= 991, -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr2=1042,1041,
&end
#
# 371 ALA HA 372 VAL QQG 5.11 (#peak 22769 )
&rst
ixpk= 22769, nxpk= 0, iat= 991, -1, r1= 1.30, r2= 1.80, r3= 6.89, r4= 7.39,
igr2=1005,1006,1007,1009,1010,1011,
&end
#
# 315 VAL QQG 316 LYS HA 4.31 (#peak 22770 )
&rst
ixpk= 22770, nxpk= 0, iat= -1, 102, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
igr1= 90, 91, 92, 94, 95, 96,
&end
#
# 348 LEU HA 351 THR QG2 5.88 (#peak 22772 )
&rst
ixpk= 22772, nxpk= 0, iat= 624, -1, r1= 1.30, r2= 1.80, r3= 7.06, r4= 7.56,
igr2= 675, 676, 677,
&end
#
# 340 ILE QD1 420 LEU HG 4.76 (#peak 22777 )
&rst
ixpk= 22777, nxpk= 0, iat= -1,1796, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
igr1= 504, 505, 506,
&end
#
# 325 ALA HA 326 VAL QQG 4.46 (#peak 22779 )
&rst
ixpk= 22779, nxpk= 0, iat= 264, -1, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51,
igr2= 278, 279, 280, 282, 283, 284,
&end
#
# 321 ILE QG2 417 VAL HA 5.10 (#peak 22780 )
&rst
ixpk= 22780, nxpk= 0, iat= -1,1747, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,
igr1= 191, 192, 193,
&end
#
# 321 ILE QG2 322 THR QG2 4.27 (#peak 22782 )
&rst
ixpk= 22782, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.16, r4= 6.66,
igr1= 191, 192, 193,
igr2= 212, 213, 214,
&end
#
# 317 PRO QD 339 ALA QB 5.08 (#peak 22783 )
&rst
ixpk= 22783, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.85, r4= 7.35,
igr1= 124, 123,
igr2= 485, 486, 487,
&end
#
# 344 LEU HA 345 PRO QD 3.81 (#peak 22785 )
&rst
ixpk= 22785, nxpk= 0, iat= 559, -1, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,
igr2= 578, 577,
&end
#
# 344 LEU QB 345 PRO QD 3.66 (#peak 22786 )
&rst
ixpk= 22786, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
igr1= 562, 561,
igr2= 578, 577,
&end
#
# 342 GLY QA 389 LYS QB 4.56 (#peak 22788 )
&rst
ixpk= 22788, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
igr1= 532, 531,
igr2=1298,1297,
&end
#
# 341 LEU QQD 386 PHE HB2 4.57 (#peak 22789 )
&rst
ixpk= 22789, nxpk= 0, iat= -1,1244, r1= 1.30, r2= 1.80, r3= 6.16, r4= 6.66,
igr1= 519, 520, 521, 523, 524, 525,
&end
#
# 397 LYS QE 421 VAL QQG 4.10 (#peak 22791 )
&rst
ixpk= 22791, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
igr1=1428,1427,
igr2=1814,1815,1816,1818,1819,1820,
&end
#
# 383 SER QB 397 LYS QE 4.29 (#peak 22792 )
&rst
ixpk= 22792, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,
igr1=1190,1189,
igr2=1428,1427,
&end
#
# 329 LYS QE 350 GLY HA2 4.18 (#peak 22794 )
&rst
ixpk= 22794, nxpk= 0, iat= -1, 663, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,
igr1= 323, 322,
&end
#
# 340 ILE HB 341 LEU QQD 4.19 (#peak 22798 )
&rst
ixpk= 22798, nxpk= 0, iat= 495, -1, r1= 1.30, r2= 1.80, r3= 5.65, r4= 6.15,
igr2= 519, 520, 521, 523, 524, 525,
&end
#
# 330 PHE QB 333 VAL QQG 3.89 (#peak 22799 )
&rst
ixpk= 22799, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.89, r4= 6.39,
igr1= 336, 335,
igr2= 394, 395, 396, 398, 399, 400,
&end
#
# 395 THR QG2 397 LYS QB 4.13 (#peak 22802 )
&rst
ixpk= 22802, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
igr1=1389,1390,1391,
igr2=1419,1418,
&end
#
# 333 VAL HB 345 PRO HA 4.86 (#peak 22803 )
&rst
ixpk= 22803, nxpk= 0, iat= 392, 580, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36, &end
#
# 379 ILE QD1 399 GLN QG 4.25 (#peak 22804 )
&rst
ixpk= 22804, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23,
igr1=1134,1135,1136,
igr2=1455,1454,
&end
#
# 378 LYS QB 379 ILE QG1 5.50 (#peak 22809 )
&rst
ixpk= 22809, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
igr1=1104,1103,
igr2=1132,1131,
&end
#
# 399 GLN QB 417 VAL QQG 4.00 (#peak 22814 )
&rst
ixpk= 22814, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
igr1=1452,1451,
igr2=1751,1752,1753,1755,1756,1757,
&end
#
# 395 THR QG2 421 VAL HB 4.59 (#peak 22816 )
&rst
ixpk= 22816, nxpk= 0, iat= -1,1812, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
igr1=1389,1390,1391,
&end
#
# 395 THR HB 421 VAL HB 4.36 (#peak 22818 )
&rst
ixpk= 22818, nxpk= 0, iat=1385,1812, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86, &end
#
# 397 LYS QD 421 VAL QQG 4.74 (#peak 22819 )
&rst
ixpk= 22819, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.17, r4= 7.67,
igr1=1425,1424,
igr2=1814,1815,1816,1818,1819,1820,
&end
#
# 325 ALA HA 326 VAL HA 4.86 (#peak 22821 )
&rst
ixpk= 22821, nxpk= 0, iat= 264, 274, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36, &end
#
# 326 VAL HA 414 ILE QD1 3.94 (#peak 22822 )
&rst
ixpk= 22822, nxpk= 0, iat= 274, -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
igr2=1712,1713,1714,
&end
#
# 408 THR QG2 409 LYS QB 4.40 (#peak 22824 )
&rst
ixpk= 22824, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr1=1601,1602,1603,
igr2=1612,1611,
&end
#
# 316 LYS QD 317 PRO QD 5.14 (#peak 22825 )
&rst
ixpk= 22825, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.48, r4= 6.98,
igr1= 111, 110,
igr2= 124, 123,
&end
#
# 402 SER QB 411 LEU HG 3.87 (#peak 22828 )
&rst
ixpk= 22828, nxpk= 0, iat= -1,1651, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,
igr1=1513,1512,
&end
#
# 335 GLN HA 345 PRO QG 4.91 (#peak 22829 )
&rst
ixpk= 22829, nxpk= 0, iat= 418, -1, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
igr2= 586, 585,
&end
#
# 358 HIE HA 359 GLN QB 5.36 (#peak 22831 )
&rst
ixpk= 22831, nxpk= 0, iat= 782, -1, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,
igr2= 802, 801,
&end
#
# 373 LEU QQD 411 LEU HG 3.69 (#peak 22832 )
&rst
ixpk= 22832, nxpk= 0, iat= -1,1651, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
igr1=1024,1025,1026,1028,1029,1030,
&end
#
# 372 VAL HA 375 SER H 5.03 (#peak 22834 )
&rst
ixpk= 22834, nxpk= 0, iat=1001,1051, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53, &end
#
# 391 GLY H 392 SER QB 5.63 (#peak 22836 )
&rst
ixpk= 22836, nxpk= 0, iat=1327, -1, r1= 1.30, r2= 1.80, r3= 6.32, r4= 6.82,
igr2=1339,1338,
&end
#
# 310 SER QB 312 GLU H 5.46 (#peak 22838 )
&rst
ixpk= 22838, nxpk= 0, iat= -1, 36, r1= 1.30, r2= 1.80, r3= 6.13, r4= 6.63,
igr1= 23, 22,
&end
#
# 329 LYS H 353 CYS QB 5.38 (#peak 22840 )
&rst
ixpk= 22840, nxpk= 0, iat= 309, -1, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54,
igr2= 697, 696,
&end
#
# 321 ILE HA 417 VAL HA 4.64 (#peak 22843 )
&rst
ixpk= 22843, nxpk= 0, iat= 187,1747, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14, &end
#
# 420 LEU QQD 423 GLY H 5.30 (#peak 22846 )
&rst
ixpk= 22846, nxpk= 0, iat= -1,1843, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
igr1=1798,1799,1800,1802,1803,1804,
&end
#
# 396 LEU HA 420 LEU QQD 4.66 (#peak 22848 )
&rst
ixpk= 22848, nxpk= 0, iat=1397, -1, r1= 1.30, r2= 1.80, r3= 6.28, r4= 6.78,
igr2=1798,1799,1800,1802,1803,1804,
&end
#
# 323 ARG HA 415 VAL HA 4.97 (#peak 22850 )
&rst
ixpk= 22850, nxpk= 0, iat= 220,1720, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 372 VAL QQG 379 ILE H 5.92 (#peak 22851 )
&rst
ixpk= 22851, nxpk= 0, iat= -1,1121, r1= 1.30, r2= 1.80, r3= 7.98, r4= 8.48,
igr1=1005,1006,1007,1009,1010,1011,
&end
#
# 322 THR QG2 332 TYR QD 4.12 (#peak 22854 )
&rst
ixpk= 22854, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,
igr1= 212, 213, 214,
igr2= 375, 382,
&end
#
# 372 VAL H 373 LEU QQD 4.90 (#peak 22856 )
&rst
ixpk= 22856, nxpk= 0, iat= 999, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2=1024,1025,1026,1028,1029,1030,
&end
#
# 420 LEU QQD 421 VAL H 4.36 (#peak 22857 )
&rst
ixpk= 22857, nxpk= 0, iat= -1,1808, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
igr1=1798,1799,1800,1802,1803,1804,
&end
#
# 349 LEU H 351 THR HB 4.57 (#peak 22862 )
&rst
ixpk= 22862, nxpk= 0, iat= 641, 671, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07, &end
#
# 348 LEU H 349 LEU HG 5.83 (#peak 22867 )
&rst
ixpk= 22867, nxpk= 0, iat= 622, 648, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33, &end
#
# 413 TYR QE 415 VAL QQG 4.77 (#peak 22869 )
&rst
ixpk= 22869, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.22, r4= 7.72,
igr1=1688,1691,
igr2=1724,1725,1726,1728,1729,1730,
&end
#
# 401 PHE QD 415 VAL QQG 5.46 (#peak 22870 )
&rst
ixpk= 22870, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.26, r4= 8.76,
igr1=1496,1504,
igr2=1724,1725,1726,1728,1729,1730,
&end
#
# 366 THR QG2 370 LYS H 4.78 (#peak 22871 )
&rst
ixpk= 22871, nxpk= 0, iat= -1, 967, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
igr1= 910, 911, 912,
&end
#
# 338 THR QG2 342 GLY H 6.00 (#peak 22872 )
&rst
ixpk= 22872, nxpk= 0, iat= -1, 529, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr1= 475, 476, 477,
&end
#
# 338 THR QG2 339 ALA H 5.76 (#peak 22873 )
&rst
ixpk= 22873, nxpk= 0, iat= -1, 481, r1= 1.30, r2= 1.80, r3= 6.92, r4= 7.42,
igr1= 475, 476, 477,
&end
#
# 353 CYS HA 356 TYR QD 4.34 (#peak 22876 )
&rst
ixpk= 22876, nxpk= 0, iat= 694, -1, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,
igr2= 747, 754,
&end
#
# 415 VAL QQG 416 SER H 5.35 (#peak 22878 )
&rst
ixpk= 22878, nxpk= 0, iat= -1,1734, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr1=1724,1725,1726,1728,1729,1730,
&end
#
# 395 THR QG2 421 VAL H 5.53 (#peak 22880 )
&rst
ixpk= 22880, nxpk= 0, iat= -1,1808, r1= 1.30, r2= 1.80, r3= 6.64, r4= 7.14,
igr1=1389,1390,1391,
&end
#
# 394 VAL QQG 395 THR H 4.83 (#peak 22882 )
&rst
ixpk= 22882, nxpk= 0, iat= -1,1381, r1= 1.30, r2= 1.80, r3= 6.51, r4= 7.01,
igr1=1371,1372,1373,1375,1376,1377,
&end
#
# 336 ARG HA 338 THR H 4.24 (#peak 22887 )
&rst
ixpk= 22887, nxpk= 0, iat= 435, 467, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74, &end
#
# 417 VAL QQG 418 ASN H 4.52 (#peak 22889 )
&rst
ixpk= 22889, nxpk= 0, iat= -1,1761, r1= 1.30, r2= 1.80, r3= 6.09, r4= 6.59,
igr1=1751,1752,1753,1755,1756,1757,
&end
#
# 354 TYR QD 365 LEU QQD 4.71 (#peak 22890 )
&rst
ixpk= 22890, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.13, r4= 7.63,
igr1= 711, 718,
igr2= 892, 893, 894, 896, 897, 898,
&end
#
# 333 VAL QQG 334 ASP H 4.35 (#peak 22893 )
&rst
ixpk= 22893, nxpk= 0, iat= -1, 404, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
igr1= 394, 395, 396, 398, 399, 400,
&end
#
# 401 PHE QE 417 VAL QQG 4.71 (#peak 22897 )
&rst
ixpk= 22897, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.13, r4= 7.63,
igr1=1498,1502,
igr2=1751,1752,1753,1755,1756,1757,
&end
#
# 388 ALA QB 389 LYS H 4.67 (#peak 22906 )
&rst
ixpk= 22906, nxpk= 0, iat= -1,1293, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr1=1287,1288,1289,
&end
#
# 402 SER HA 415 VAL H 5.48 (#peak 22908 )
&rst
ixpk= 22908, nxpk= 0, iat=1510,1718, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98, &end
#
# 369 HIE HA 384 TYR QD 6.00 (#peak 22913 )
&rst
ixpk= 22913, nxpk= 0, iat= 952, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=1204,1211,
&end
#
# 352 SER HA 354 TYR QD 6.00 (#peak 22916 )
&rst
ixpk= 22916, nxpk= 0, iat= 683, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2= 711, 718,
&end
#
# 337 ALA QB 338 THR H 5.60 (#peak 22918 )
&rst
ixpk= 22918, nxpk= 0, iat= -1, 467, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1= 461, 462, 463,
&end
#
# 327 ASN H 331 VAL QQG 5.49 (#peak 22919 )
&rst
ixpk= 22919, nxpk= 0, iat= 288, -1, r1= 1.30, r2= 1.80, r3= 7.40, r4= 7.90,
igr2= 357, 358, 359, 361, 362, 363,
&end
#
# 331 VAL QQG 413 TYR QE 5.92 (#peak 22920 )
&rst
ixpk= 22920, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.96, r4= 9.46,
igr1= 357, 358, 359, 361, 362, 363,
igr2=1688,1691,
&end
#
# 411 LEU HA 413 TYR H 6.00 (#peak 22927 )
&rst
ixpk= 22927, nxpk= 0, iat=1646,1678, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 379 ILE QD1 380 LEU H 5.33 (#peak 22928 )
&rst
ixpk= 22928, nxpk= 0, iat= -1,1140, r1= 1.30, r2= 1.80, r3= 6.40, r4= 6.90,
igr1=1134,1135,1136,
&end
#
# 340 ILE QG2 341 LEU H 5.90 (#peak 22930 )
&rst
ixpk= 22930, nxpk= 0, iat= -1, 510, r1= 1.30, r2= 1.80, r3= 7.09, r4= 7.59,
igr1= 497, 498, 499,
&end
#
# 410 GLU HA 411 LEU H 3.55 (#peak 22934 )
&rst
ixpk= 22934, nxpk= 0, iat=1631,1644, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05, &end
#
# 337 ALA HA 340 ILE H 4.77 (#peak 22939 )
&rst
ixpk= 22939, nxpk= 0, iat= 459, 491, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27, &end
#
# 406 PRO QD 407 ASP H 4.25 (#peak 22943 )
&rst
ixpk= 22943, nxpk= 0, iat= -1,1581, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
igr1=1569,1568,
&end
#
# 321 ILE H 334 ASP HB3 5.37 (#peak 22946 )
&rst
ixpk= 22946, nxpk= 0, iat= 185, 408, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87, &end
#
# 334 ASP HB3 335 GLN H 5.59 (#peak 22947 )
&rst
ixpk= 22947, nxpk= 0, iat= 408, 416, r1= 1.30, r2= 1.80, r3= 5.59, r4= 6.09, &end
#
# 367 ASP QB 368 LYS H 5.47 (#peak 22950 )
&rst
ixpk= 22950, nxpk= 0, iat= -1, 928, r1= 1.30, r2= 1.80, r3= 6.14, r4= 6.64,
igr1= 921, 920,
&end
#
# 357 PHE QB 387 ARG H 4.96 (#peak 22953 )
&rst
ixpk= 22953, nxpk= 0, iat= -1,1259, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
igr1= 765, 764,
&end
#
# 364 ASN QB 365 LEU H 4.19 (#peak 22954 )
&rst
ixpk= 22954, nxpk= 0, iat= -1, 883, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
igr1= 874, 873,
&end
#
# 413 TYR QB 414 ILE H 5.50 (#peak 22955 )
&rst
ixpk= 22955, nxpk= 0, iat= -1,1699, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1=1683,1682,
&end
#
# 363 ASN QB 364 ASN H 4.54 (#peak 22957 )
&rst
ixpk= 22957, nxpk= 0, iat= -1, 869, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
igr1= 860, 859,
&end
#
# 412 GLU QG 413 TYR QE 4.98 (#peak 22958 )
&rst
ixpk= 22958, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
igr1=1671,1670,
igr2=1688,1691,
&end
#
# 376 LYS H 377 GLU QG 5.08 (#peak 22959 )
&rst
ixpk= 22959, nxpk= 0, iat=1062, -1, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr2=1092,1091,
&end
#
# 403 PHE QD 412 GLU HB3 4.68 (#peak 22962 )
&rst
ixpk= 22962, nxpk= 0, iat= -1,1667, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
igr1=1527,1535,
&end
#
# 418 ASN HA 419 THR HB 5.16 (#peak 22964 )
&rst
ixpk= 22964, nxpk= 0, iat=1763,1779, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66, &end
#
# 338 THR HB 339 ALA H 4.40 (#peak 22970 )
&rst
ixpk= 22970, nxpk= 0, iat= 471, 481, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 385 LYS QG 395 THR HA 5.95 (#peak 22972 )
&rst
ixpk= 22972, nxpk= 0, iat= -1,1383, r1= 1.30, r2= 1.80, r3= 6.68, r4= 7.18,
igr1=1225,1224,
&end
#
# 367 ASP H 368 LYS QG 6.00 (#peak 22975 )
&rst
ixpk= 22975, nxpk= 0, iat= 916, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2= 936, 935,
&end
#
# 338 THR HA 343 TYR H 5.48 (#peak 22976 )
&rst
ixpk= 22976, nxpk= 0, iat= 469, 536, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98, &end
#
# 329 LYS HA 353 CYS QB 5.13 (#peak 22977 )
&rst
ixpk= 22977, nxpk= 0, iat= 311, -1, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
igr2= 697, 696,
&end
#
# 343 TYR QE 388 ALA HA 4.75 (#peak 22978 )
&rst
ixpk= 22978, nxpk= 0, iat= -1,1285, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
igr1= 546, 549,
&end
#
# 354 TYR QB 357 PHE QB 4.27 (#peak 22980 )
&rst
ixpk= 22980, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
igr1= 708, 707,
igr2= 765, 764,
&end
#
# 329 LYS QG 351 THR HB 4.82 (#peak 22981 )
&rst
ixpk= 22981, nxpk= 0, iat= -1, 671, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,
igr1= 317, 316,
&end
#
# 322 THR QG2 417 VAL HA 4.85 (#peak 22982 )
&rst
ixpk= 22982, nxpk= 0, iat= -1,1747, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32,
igr1= 212, 213, 214,
&end
#
# 383 SER QB 421 VAL QQG 4.62 (#peak 22984 )
&rst
ixpk= 22984, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.99, r4= 7.49,
igr1=1190,1189,
igr2=1814,1815,1816,1818,1819,1820,
&end
#
# 333 VAL HA 334 ASP HB2 5.49 (#peak 22985 )
&rst
ixpk= 22985, nxpk= 0, iat= 390, 409, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99, &end
#
# 322 THR QG2 333 VAL HA 4.72 (#peak 22986 )
&rst
ixpk= 22986, nxpk= 0, iat= -1, 390, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
igr1= 212, 213, 214,
&end
#
# 370 LYS QB 374 GLN HA 4.06 (#peak 22987 )
&rst
ixpk= 22987, nxpk= 0, iat= -1,1036, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
igr1= 972, 971,
&end
#
# 410 GLU QG 412 GLU HB2 3.00 (#peak 22988 )
&rst
ixpk= 22988, nxpk= 0, iat= -1,1668, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87,
igr1=1637,1636,
&end
#
# 319 GLU QB 417 VAL QQG 5.82 (#peak 22991 )
&rst
ixpk= 22991, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.81, r4= 9.31,
igr1= 155, 154,
igr2=1751,1752,1753,1755,1756,1757,
&end
#
# 322 THR HA 334 ASP H 5.47 (#peak 22993 )
&rst
ixpk= 22993, nxpk= 0, iat= 206, 404, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97, &end
#
# 325 ALA QB 326 VAL HA 4.78 (#peak 22995 )
&rst
ixpk= 22995, nxpk= 0, iat= -1, 274, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
igr1= 266, 267, 268,
&end
#
# 373 LEU HG 411 LEU HG 5.04 (#peak 22996 )
&rst
ixpk= 22996, nxpk= 0, iat=1022,1651, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54, &end
#
# 329 LYS HA 352 SER QB 4.66 (#peak 22998 )
&rst
ixpk= 22998, nxpk= 0, iat= 311, -1, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73,
igr2= 686, 685,
&end
#
# 329 LYS QG 331 VAL QQG 5.84 (#peak 22999 )
&rst
ixpk= 22999, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.84, r4= 9.34,
igr1= 317, 316,
igr2= 357, 358, 359, 361, 362, 363,
&end
#
# 337 ALA HA 341 LEU H 5.45 (#peak 23001 )
&rst
ixpk= 23001, nxpk= 0, iat= 459, 510, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95, &end
#
# 343 TYR HB2 347 GLU QB 4.27 (#peak 23003 )
&rst
ixpk= 23003, nxpk= 0, iat= 541, -1, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
igr2= 612, 611,
&end
#
# 344 LEU QB 347 GLU QG 3.99 (#peak 23004 )
&rst
ixpk= 23004, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
igr1= 562, 561,
igr2= 615, 614,
&end
#
# 343 TYR HB3 344 LEU QB 5.00 (#peak 23005 )
&rst
ixpk= 23005, nxpk= 0, iat= 540, -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr2= 562, 561,
&end
#
# 346 GLN HA 349 LEU QB 3.98 (#peak 23007 )
&rst
ixpk= 23007, nxpk= 0, iat= 592, -1, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
igr2= 646, 645,
&end
#
# 348 LEU HB3 349 LEU QQD 5.18 (#peak 23009 )
&rst
ixpk= 23009, nxpk= 0, iat= 626, -1, r1= 1.30, r2= 1.80, r3= 6.98, r4= 7.48,
igr2= 650, 651, 652, 654, 655, 656,
&end
#
# 352 SER QB 355 GLU QG 5.03 (#peak 23011 )
&rst
ixpk= 23011, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.34, r4= 6.84,
igr1= 686, 685,
igr2= 732, 731,
&end
#
# 328 GLY QA 354 TYR QB 4.37 (#peak 23012 )
&rst
ixpk= 23012, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
igr1= 305, 304,
igr2= 708, 707,
&end
#
# 384 TYR HA 385 LYS HB2 4.97 (#peak 23019 )
&rst
ixpk= 23019, nxpk= 0, iat=1198,1222, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 317 PRO HA 336 ARG HB2 4.75 (#peak 23022 )
&rst
ixpk= 23022, nxpk= 0, iat= 126, 438, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, &end
#
# 316 LYS H 336 ARG HB2 5.95 (#peak 23023 )
&rst
ixpk= 23023, nxpk= 0, iat= 100, 438, r1= 1.30, r2= 1.80, r3= 5.95, r4= 6.45, &end
#
# 403 PHE HA 404 THR HB 4.62 (#peak 23024 )
&rst
ixpk= 23024, nxpk= 0, iat=1521,1543, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12, &end
#
# 320 PHE HA 340 ILE HB 6.00 (#peak 23026 )
&rst
ixpk= 23026, nxpk= 0, iat= 167, 495, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 418 ASN H 419 THR HA 4.14 (#peak 23027 )
&rst
ixpk= 23027, nxpk= 0, iat=1761,1777, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64, &end
#
# 396 LEU QQD 420 LEU HG 4.94 (#peak 23028 )
&rst
ixpk= 23028, nxpk= 0, iat= -1,1796, r1= 1.30, r2= 1.80, r3= 6.66, r4= 7.16,
igr1=1404,1405,1406,1408,1409,1410,
&end
#
# 340 ILE HA 420 LEU HG 4.53 (#peak 23033 )
&rst
ixpk= 23033, nxpk= 0, iat= 493,1796, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03, &end
#
# 419 THR QG2 420 LEU HA 3.67 (#peak 23040 )
&rst
ixpk= 23040, nxpk= 0, iat= -1,1791, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
igr1=1783,1784,1785,
&end
#
# 370 LYS HA 373 LEU HB3 3.79 (#peak 23041 )
&rst
ixpk= 23041, nxpk= 0, iat= 969,1019, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29, &end
#
# 396 LEU QQD 419 THR QG2 4.66 (#peak 23042 )
&rst
ixpk= 23042, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.54, r4= 8.04,
igr1=1404,1405,1406,1408,1409,1410,
igr2=1783,1784,1785,
&end
#
# 358 HIE HA 359 GLN HA 4.41 (#peak 23044 )
&rst
ixpk= 23044, nxpk= 0, iat= 782, 799, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, &end
#
# 372 VAL QQG 379 ILE QD1 3.93 (#peak 23046 )
&rst
ixpk= 23046, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
igr1=1005,1006,1007,1009,1010,1011,
igr2=1134,1135,1136,
&end
#
# 367 ASP HA 368 LYS QE 4.37 (#peak 23048 )
&rst
ixpk= 23048, nxpk= 0, iat= 918, -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
igr2= 942, 941,
&end
#
# 367 ASP HA 370 LYS QE 4.14 (#peak 23049 )
&rst
ixpk= 23049, nxpk= 0, iat= 918, -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
igr2= 981, 980,
&end
#
# 372 VAL QG2 400 TRP QB 5.16 (#peak 23056 )
&rst
ixpk= 23056, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.96, r4= 7.46,
igr1=1009,1010,1011,
igr2=1469,1468,
&end
#
# 372 VAL HA 374 GLN H 5.09 (#peak 23063 )
&rst
ixpk= 23063, nxpk= 0, iat=1001,1034, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59, &end
#
# 373 LEU HG 374 GLN H 5.10 (#peak 23064 )
&rst
ixpk= 23064, nxpk= 0, iat=1022,1034, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, &end
#
# 341 LEU QQD 343 TYR QE 4.88 (#peak 23072 )
&rst
ixpk= 23072, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.38, r4= 7.88,
igr1= 519, 520, 521, 523, 524, 525,
igr2= 546, 549,
&end
#
# 341 LEU QQD 340 ILE H 4.88 (#peak 23073 )
&rst
ixpk= 23073, nxpk= 0, iat= -1, 491, r1= 1.30, r2= 1.80, r3= 6.58, r4= 7.08,
igr1= 519, 520, 521, 523, 524, 525,
&end
#
# 365 LEU QQD 384 TYR H 6.00 (#peak 23076 )
&rst
ixpk= 23076, nxpk= 0, iat= -1,1196, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
igr1= 892, 893, 894, 896, 897, 898,
&end
#
# 365 LEU QQD 385 LYS H 6.00 (#peak 23077 )
&rst
ixpk= 23077, nxpk= 0, iat= -1,1217, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
igr1= 892, 893, 894, 896, 897, 898,
&end
#
# 421 VAL QQG 422 LEU H 4.70 (#peak 23078 )
&rst
ixpk= 23078, nxpk= 0, iat= -1,1824, r1= 1.30, r2= 1.80, r3= 6.34, r4= 6.84,
igr1=1814,1815,1816,1818,1819,1820,
&end
#
# 333 VAL QQG 349 LEU H 5.29 (#peak 23079 )
&rst
ixpk= 23079, nxpk= 0, iat= -1, 641, r1= 1.30, r2= 1.80, r3= 7.13, r4= 7.63,
igr1= 394, 395, 396, 398, 399, 400,
&end
#
# 368 LYS HA 371 ALA H 4.92 (#peak 23081 )
&rst
ixpk= 23081, nxpk= 0, iat= 930, 989, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42, &end
#
# 329 LYS H 352 SER HA 4.84 (#peak 23083 )
&rst
ixpk= 23083, nxpk= 0, iat= 309, 683, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34, &end
#
# 371 ALA HA 374 GLN H 4.93 (#peak 23087 )
&rst
ixpk= 23087, nxpk= 0, iat= 991,1034, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43, &end
#
# 373 LEU HB2 374 GLN H 4.68 (#peak 23088 )
&rst
ixpk= 23088, nxpk= 0, iat=1020,1034, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18, &end
#
# 421 VAL HB 422 LEU H 3.93 (#peak 23093 )
&rst
ixpk= 23093, nxpk= 0, iat=1812,1824, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43, &end
#
# 346 GLN QB 347 GLU H 5.30 (#peak 23099 )
&rst
ixpk= 23099, nxpk= 0, iat= -1, 607, r1= 1.30, r2= 1.80, r3= 5.95, r4= 6.45,
igr1= 595, 594,
&end
#
# 346 GLN QB 349 LEU H 5.30 (#peak 23100 )
&rst
ixpk= 23100, nxpk= 0, iat= -1, 641, r1= 1.30, r2= 1.80, r3= 5.95, r4= 6.45,
igr1= 595, 594,
&end
#
# 394 VAL HB 420 LEU QQD 3.53 (#peak 23102 )
&rst
ixpk= 23102, nxpk= 0, iat=1369, -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
igr2=1798,1799,1800,1802,1803,1804,
&end
#
# 312 GLU HA 313 ILE H 3.56 (#peak 23114 )
&rst
ixpk= 23114, nxpk= 0, iat= 38, 51, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06, &end
#
# 402 SER QB 414 ILE QG1 4.68 (#peak 23117 )
&rst
ixpk= 23117, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
igr1=1513,1512,
igr2=1710,1709,
&end
#
# 399 GLN QB 400 TRP HA 6.00 (#peak 23118 )
&rst
ixpk= 23118, nxpk= 0, iat= -1,1466, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1=1452,1451,
&end
#
# 399 GLN QG 400 TRP HA 5.81 (#peak 23119 )
&rst
ixpk= 23119, nxpk= 0, iat= -1,1466, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
igr1=1455,1454,
&end
#
# 379 ILE QG1 400 TRP HA 6.00 (#peak 23121 )
&rst
ixpk= 23121, nxpk= 0, iat= -1,1466, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1=1132,1131,
&end
#
# 417 VAL HA 418 ASN HA 5.75 (#peak 23122 )
&rst
ixpk= 23122, nxpk= 0, iat=1747,1763, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25, &end
#
# 322 THR HA 334 ASP HB3 5.71 (#peak 23123 )
&rst
ixpk= 23123, nxpk= 0, iat= 206, 408, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21, &end
#
# 387 ARG QD 391 GLY QA 5.09 (#peak 23125 )
&rst
ixpk= 23125, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.41, r4= 6.91,
igr1=1270,1269,
igr2=1330,1329,
&end
#
# 404 THR HB 411 LEU QB 6.00 (#peak 23127 )
&rst
ixpk= 23127, nxpk= 0, iat=1543, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=1649,1648,
&end
#
# 343 TYR HB3 344 LEU HA 5.71 (#peak 23130 )
&rst
ixpk= 23130, nxpk= 0, iat= 540, 559, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21, &end
#
# 411 LEU QB 412 GLU HA 6.00 (#peak 23142 )
&rst
ixpk= 23142, nxpk= 0, iat= -1,1665, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1=1649,1648,
&end
#
# 420 LEU QB 421 VAL H 6.00 (#peak 23144 )
&rst
ixpk= 23144, nxpk= 0, iat= -1,1808, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1=1794,1793,
&end
#
# 386 PHE HB2 388 ALA H 6.00 (#peak 23147 )
&rst
ixpk= 23147, nxpk= 0, iat=1244,1283, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 388 ALA QB 391 GLY QA 5.55 (#peak 23148 )
&rst
ixpk= 23148, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.48, r4= 7.98,
igr1=1287,1288,1289,
igr2=1330,1329,
&end
#
# 385 LYS QG 386 PHE HA 6.00 (#peak 23150 )
&rst
ixpk= 23150, nxpk= 0, iat= -1,1241, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1=1225,1224,
&end
#
# 317 PRO QG 339 ALA QB 6.00 (#peak 23153 )
&rst
ixpk= 23153, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
igr1= 132, 131,
igr2= 485, 486, 487,
&end
#
# 325 ALA QB 414 ILE QG1 5.81 (#peak 23154 )
&rst
ixpk= 23154, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.83, r4= 8.33,
igr1= 266, 267, 268,
igr2=1710,1709,
&end
#
# 379 ILE QG1 401 PHE H 6.00 (#peak 23155 )
&rst
ixpk= 23155, nxpk= 0, iat= -1,1488, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1=1132,1131,
&end
#
# 402 SER HA 414 ILE QG1 6.00 (#peak 23156 )
&rst
ixpk= 23156, nxpk= 0, iat=1510, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=1710,1709,
&end
#
# 313 ILE QD1 315 VAL HA 6.00 (#peak 23163 )
&rst
ixpk= 23163, nxpk= 0, iat= -1, 86, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr1= 64, 65, 66,
&end
#
# 340 ILE QD1 420 LEU HA 6.00 (#peak 23164 )
&rst
ixpk= 23164, nxpk= 0, iat= -1,1791, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr1= 504, 505, 506,
&end
#
# 402 SER HA 414 ILE QD1 6.00 (#peak 23166 )
&rst
ixpk= 23166, nxpk= 0, iat=1510, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr2=1712,1713,1714,
&end
#
# 402 SER H 414 ILE QD1 6.00 (#peak 23168 )
&rst
ixpk= 23168, nxpk= 0, iat=1508, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr2=1712,1713,1714,
&end
#
# 333 VAL QQG 345 PRO QB 5.73 (#peak 23170 )
&rst
ixpk= 23170, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.67, r4= 9.17,
igr1= 394, 395, 396, 398, 399, 400,
igr2= 583, 582,
&end
#
# 400 TRP QB 414 ILE QG2 6.00 (#peak 23172 )
&rst
ixpk= 23172, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
igr1=1469,1468,
igr2=1705,1706,1707,
&end
#
# 402 SER HA 414 ILE QG2 6.00 (#peak 23173 )
&rst
ixpk= 23173, nxpk= 0, iat=1510, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr2=1705,1706,1707,
&end
#
# 348 LEU HG 349 LEU H 6.00 (#peak 23174 )
&rst
ixpk= 23174, nxpk= 0, iat= 629, 641, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 373 LEU HA 402 SER QB 5.24 (#peak 23176 )
&rst
ixpk= 23176, nxpk= 0, iat=1017, -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
igr2=1513,1512,
&end
#
# 372 VAL HA 402 SER QB 5.02 (#peak 23177 )
&rst
ixpk= 23177, nxpk= 0, iat=1001, -1, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr2=1513,1512,
&end
#
# 323 ARG H 415 VAL HA 6.00 (#peak 23178 )
&rst
ixpk= 23178, nxpk= 0, iat= 218,1720, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 331 VAL QQG 413 TYR HA 5.92 (#peak 23184 )
&rst
ixpk= 23184, nxpk= 0, iat= -1,1680, r1= 1.30, r2= 1.80, r3= 7.98, r4= 8.48,
igr1= 357, 358, 359, 361, 362, 363,
&end
#
# 349 LEU HA 351 THR HB 6.00 (#peak 23185 )
&rst
ixpk= 23185, nxpk= 0, iat= 643, 671, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 321 ILE HA 334 ASP HB2 4.59 (#peak 23188 )
&rst
ixpk= 23188, nxpk= 0, iat= 187, 409, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 322 THR HA 334 ASP HB2 4.59 (#peak 23189 )
&rst
ixpk= 23189, nxpk= 0, iat= 206, 409, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 324 PHE QB 325 ALA H 6.00 (#peak 23190 )
&rst
ixpk= 23190, nxpk= 0, iat= -1, 262, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1= 247, 246,
&end
#
# 379 ILE QG1 401 PHE QB 4.74 (#peak 23193 )
&rst
ixpk= 23193, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr1=1132,1131,
igr2=1493,1492,
&end
#
# 418 ASN QB 419 THR HB 5.81 (#peak 23195 )
&rst
ixpk= 23195, nxpk= 0, iat= -1,1779, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
igr1=1766,1765,
&end
#
# 372 VAL QQG 380 LEU QB 5.50 (#peak 23198 )
&rst
ixpk= 23198, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
igr1=1005,1006,1007,1009,1010,1011,
igr2=1145,1144,
&end
#
# 323 ARG H 333 VAL QQG 5.92 (#peak 23199 )
&rst
ixpk= 23199, nxpk= 0, iat= 218, -1, r1= 1.30, r2= 1.80, r3= 7.98, r4= 8.48,
igr2= 394, 395, 396, 398, 399, 400,
&end
#
# 323 ARG HA 415 VAL QQG 5.88 (#peak 23200 )
&rst
ixpk= 23200, nxpk= 0, iat= 220, -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
igr2=1724,1725,1726,1728,1729,1730,
&end
#
# 341 LEU QQD 389 LYS QB 5.81 (#peak 23202 )
&rst
ixpk= 23202, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.79, r4= 9.29,
igr1= 519, 520, 521, 523, 524, 525,
igr2=1298,1297,
&end
#
# 399 GLN HA 417 VAL QQG 5.92 (#peak 23203 )
&rst
ixpk= 23203, nxpk= 0, iat=1449, -1, r1= 1.30, r2= 1.80, r3= 7.98, r4= 8.48,
igr2=1751,1752,1753,1755,1756,1757,
&end
#
# 417 VAL QQG 418 ASN HA 5.92 (#peak 23204 )
&rst
ixpk= 23204, nxpk= 0, iat= -1,1763, r1= 1.30, r2= 1.80, r3= 7.98, r4= 8.48,
igr1=1751,1752,1753,1755,1756,1757,
&end
#
# 338 THR HA 339 ALA QB 5.40 (#peak 23205 )
&rst
ixpk= 23205, nxpk= 0, iat= 469, -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
igr2= 485, 486, 487,
&end
#
# 321 ILE QG2 418 ASN H 6.00 (#peak 23206 )
&rst
ixpk= 23206, nxpk= 0, iat= -1,1761, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr1= 191, 192, 193,
&end
#
# 385 LYS QG 397 LYS QE 6.00 (#peak 23207 )
&rst
ixpk= 23207, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
igr1=1225,1224,
igr2=1428,1427,
&end
#
# 319 GLU HA 418 ASN H 4.90 (#peak 23208 )
&rst
ixpk= 23208, nxpk= 0, iat= 152,1761, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40, &end
#
# 370 LYS HA 373 LEU HB2 6.00 (#peak 23209 )
&rst
ixpk= 23209, nxpk= 0, iat= 969,1020, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 343 TYR QB 347 GLU QG 5.81 (#peak 23211 )
&rst
ixpk= 23211, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.32, r4= 7.82,
igr1= 541, 540,
igr2= 615, 614,
&end
#
# 333 VAL HB 348 LEU HB2 5.04 (#peak 23214 )
&rst
ixpk= 23214, nxpk= 0, iat= 392, 627, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54, &end
#
# 333 VAL HB 345 PRO QB 5.81 (#peak 23215 )
&rst
ixpk= 23215, nxpk= 0, iat= 392, -1, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
igr2= 583, 582,
&end
#
# 346 GLN QG 349 LEU QB 5.18 (#peak 23216 )
&rst
ixpk= 23216, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.53, r4= 7.03,
igr1= 598, 597,
igr2= 646, 645,
&end
#
# 371 ALA QB 374 GLN QG 5.81 (#peak 23218 )
&rst
ixpk= 23218, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.83, r4= 8.33,
igr1= 993, 994, 995,
igr2=1042,1041,
&end
#
# 400 TRP H 400 TRP HD1 3.50 (#peak 30416 )
&rst
ixpk= 30416, nxpk= 0, iat=1464,1472, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 400 TRP HZ2 418 ASN QD2 4.00 (#peak 31001 )
&rst
ixpk= 31001, nxpk= 0, iat=1482, -1, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
igr2=1771,1770,
&end
#
# 405 ASN H 411 LEU HA 4.00 (#peak 40001 )
&rst
ixpk= 40001, nxpk= 0, iat=1553,1646, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 357 PHE QD 362 HIE HE2 6.00 (#peak 40007 )
&rst
ixpk= 40007, nxpk= 0, iat= -1, 851, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1= 768, 776,
&end
#
# 381 THR H 382 ASP H 4.59 (#peak 40165 )
&rst
ixpk= 40165, nxpk= 0, iat=1159,1173, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 380 LEU HA 382 ASP H 6.00 (#peak 40166 )
&rst
ixpk= 40166, nxpk= 0, iat=1142,1173, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 358 HIE HE1 387 ARG H 4.36 (#peak 40761 )
&rst
ixpk= 40761, nxpk= 0, iat= 791,1259, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86, &end
#
# 316 LYS H 317 PRO QD 6.00 (#peak 40762 )
&rst
ixpk= 40762, nxpk= 0, iat= 100, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2= 124, 123,
&end
#
# 362 HIE HE2 363 ASN H 6.00 (#peak 40764 )
&rst
ixpk= 40764, nxpk= 0, iat= 851, 855, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 362 HIE HE2 363 ASN QB 6.00 (#peak 40765 )
&rst
ixpk= 40765, nxpk= 0, iat= 851, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2= 860, 859,
&end
#
# 381 THR HB 382 ASP H 6.00 (#peak 40769 )
&rst
ixpk= 40769, nxpk= 0, iat=1163,1173, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 357 PHE H 358 HIE QB 5.81 (#peak 40771 )
&rst
ixpk= 40771, nxpk= 0, iat= 760, -1, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
igr2= 785, 784,
&end
#
# 407 ASP H 409 LYS H 6.00 (#peak 40772 )
&rst
ixpk= 40772, nxpk= 0, iat=1581,1607, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 363 ASN H 364 ASN QD2 5.81 (#peak 40773 )
&rst
ixpk= 40773, nxpk= 0, iat= 855, -1, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
igr2= 879, 878,
&end
#
# 338 THR H 344 LEU HA 6.00 (#peak 40774 )
&rst
ixpk= 40774, nxpk= 0, iat= 467, 559, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 381 THR H 382 ASP HA 6.00 (#peak 40775 )
&rst
ixpk= 40775, nxpk= 0, iat=1159,1175, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 349 LEU QB 350 GLY H 6.00 (#peak 40778 )
&rst
ixpk= 40778, nxpk= 0, iat= -1, 660, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1= 646, 645,
&end
#
# 341 LEU HG 342 GLY H 6.00 (#peak 40779 )
&rst
ixpk= 40779, nxpk= 0, iat= 517, 529, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 311 GLY QA 313 ILE H 6.00 (#peak 40780 )
&rst
ixpk= 40780, nxpk= 0, iat= -1, 51, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1= 32, 31,
&end
#
# 392 SER H 393 PHE QD 6.00 (#peak 40781 )
&rst
ixpk= 40781, nxpk= 0, iat=1334, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=1353,1361,
&end
#
# 382 ASP QB 383 SER H 6.00 (#peak 40783 )
&rst
ixpk= 40783, nxpk= 0, iat= -1,1185, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1=1178,1177,
&end
#
# 375 SER QB 377 GLU H 5.81 (#peak 40785 )
&rst
ixpk= 40785, nxpk= 0, iat= -1,1084, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
igr1=1056,1055,
&end
#
# 369 HIE HD2 372 VAL H 6.00 (#peak 40786 )
&rst
ixpk= 40786, nxpk= 0, iat= 959, 999, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 309 ASN HA 311 GLY H 6.00 (#peak 40788 )
&rst
ixpk= 40788, nxpk= 0, iat= 6, 29, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 399 GLN H 417 VAL HA 6.00 (#peak 40789 )
&rst
ixpk= 40789, nxpk= 0, iat=1447,1747, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 390 ASP QB 392 SER H 6.00 (#peak 40791 )
&rst
ixpk= 40791, nxpk= 0, iat= -1,1334, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1=1320,1319,
&end
#
# 336 ARG HB2 340 ILE H 6.00 (#peak 40792 )
&rst
ixpk= 40792, nxpk= 0, iat= 438, 491, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 336 ARG HG3 339 ALA H 6.00 (#peak 40793 )
&rst
ixpk= 40793, nxpk= 0, iat= 440, 481, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 336 ARG H 337 ALA QB 6.00 (#peak 40794 )
&rst
ixpk= 40794, nxpk= 0, iat= 433, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr2= 461, 462, 463,
&end
#
# 338 THR H 345 PRO QG 6.00 (#peak 40795 )
&rst
ixpk= 40795, nxpk= 0, iat= 467, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2= 586, 585,
&end
#
# 312 GLU QG 313 ILE H 6.00 (#peak 40796 )
&rst
ixpk= 40796, nxpk= 0, iat= -1, 51, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1= 44, 43,
&end
#
# 320 PHE HA 337 ALA H 6.00 (#peak 40798 )
&rst
ixpk= 40798, nxpk= 0, iat= 167, 457, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 339 ALA H 342 GLY HA2 6.00 (#peak 40799 )
&rst
ixpk= 40799, nxpk= 0, iat= 481, 532, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 340 ILE H 342 GLY HA2 6.00 (#peak 40800 )
&rst
ixpk= 40800, nxpk= 0, iat= 491, 532, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 403 PHE H 404 THR HB 6.00 (#peak 40802 )
&rst
ixpk= 40802, nxpk= 0, iat=1519,1543, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 382 ASP H 384 TYR QD 6.00 (#peak 40807 )
&rst
ixpk= 40807, nxpk= 0, iat=1173, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=1204,1211,
&end
#
# 380 LEU QB 382 ASP H 6.00 (#peak 40808 )
&rst
ixpk= 40808, nxpk= 0, iat= -1,1173, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1=1145,1144,
&end
#
# 380 LEU QQD 382 ASP H 6.00 (#peak 40809 )
&rst
ixpk= 40809, nxpk= 0, iat= -1,1173, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
igr1=1149,1150,1151,1153,1154,1155,
&end
#
# 368 LYS H 380 LEU QQD 6.00 (#peak 40810 )
&rst
ixpk= 40810, nxpk= 0, iat= 928, -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
igr2=1149,1150,1151,1153,1154,1155,
&end
#
# 322 THR H 323 ARG H 6.00 (#peak 40811 )
&rst
ixpk= 40811, nxpk= 0, iat= 204, 218, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 320 PHE QE 418 ASN H 5.81 (#peak 40812 )
&rst
ixpk= 40812, nxpk= 0, iat= -1,1761, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
igr1= 175, 179,
&end
#
# 403 PHE QE 404 THR H 5.65 (#peak 40814 )
&rst
ixpk= 40814, nxpk= 0, iat= -1,1539, r1= 1.30, r2= 1.80, r3= 6.34, r4= 6.84,
igr1=1529,1533,
&end
#
# 403 PHE QE 405 ASN QD2 4.13 (#peak 40816 )
&rst
ixpk= 40816, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
igr1=1529,1533,
igr2=1563,1562,
&end
#
# 402 SER QB 404 THR H 6.00 (#peak 40818 )
&rst
ixpk= 40818, nxpk= 0, iat= -1,1539, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1=1513,1512,
&end
#
# 317 PRO QB 336 ARG QH 3.91 (#peak 40819 )
&rst
ixpk= 40819, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03,
igr1= 129, 128,
igr2= 449, 450, 452, 453,
&end
#
# 400 TRP HE1 418 ASN QD2 4.57 (#peak 40820 )
&rst
ixpk= 40820, nxpk= 0, iat=1478, -1, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
igr2=1771,1770,
&end
#
# 323 ARG QB 324 PHE H 4.34 (#peak 40821 )
&rst
ixpk= 40821, nxpk= 0, iat= -1, 242, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,
igr1= 223, 222,
&end
#
# 395 THR H 421 VAL H 6.00 (#peak 40822 )
&rst
ixpk= 40822, nxpk= 0, iat=1381,1808, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 321 ILE H 322 THR HB 5.68 (#peak 40823 )
&rst
ixpk= 40823, nxpk= 0, iat= 185, 208, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18, &end
#
# 348 LEU HA 351 THR H 5.17 (#peak 40824 )
&rst
ixpk= 40824, nxpk= 0, iat= 624, 667, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67, &end
#
# 322 THR QG2 400 TRP HE1 6.00 (#peak 40826 )
&rst
ixpk= 40826, nxpk= 0, iat= -1,1478, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr1= 212, 213, 214,
&end
#
# 340 ILE H 341 LEU HA 5.75 (#peak 40828 )
&rst
ixpk= 40828, nxpk= 0, iat= 491, 512, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25, &end
#
# 322 THR QG2 333 VAL H 5.28 (#peak 40830 )
&rst
ixpk= 40830, nxpk= 0, iat= -1, 388, r1= 1.30, r2= 1.80, r3= 6.34, r4= 6.84,
igr1= 212, 213, 214,
&end
#
# 324 PHE H 413 TYR HA 4.93 (#peak 40832 )
&rst
ixpk= 40832, nxpk= 0, iat= 242,1680, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43, &end
#
# 389 LYS QE 391 GLY H 4.97 (#peak 40834 )
&rst
ixpk= 40834, nxpk= 0, iat= -1,1327, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr1=1307,1306,
&end
#
# 385 LYS HA 395 THR H 6.00 (#peak 40835 )
&rst
ixpk= 40835, nxpk= 0, iat=1219,1381, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 351 THR HA 353 CYS H 5.90 (#peak 40836 )
&rst
ixpk= 40836, nxpk= 0, iat= 669, 692, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40, &end
#
# 330 PHE H 351 THR H 5.68 (#peak 40837 )
&rst
ixpk= 40837, nxpk= 0, iat= 331, 667, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18, &end
#
# 330 PHE H 353 CYS HA 5.10 (#peak 40838 )
&rst
ixpk= 40838, nxpk= 0, iat= 331, 694, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, &end
#
# 388 ALA QB 394 VAL H 5.70 (#peak 40839 )
&rst
ixpk= 40839, nxpk= 0, iat= -1,1365, r1= 1.30, r2= 1.80, r3= 6.85, r4= 7.35,
igr1=1287,1288,1289,
&end
#
# 354 TYR H 355 GLU H 3.99 (#peak 40840 )
&rst
ixpk= 40840, nxpk= 0, iat= 703, 724, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49, &end
#
# 403 PHE QE 405 ASN H 4.88 (#peak 40843 )
&rst
ixpk= 40843, nxpk= 0, iat= -1,1553, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
igr1=1529,1533,
&end
#
# 315 VAL QQG 336 ARG QH 4.57 (#peak 40844 )
&rst
ixpk= 40844, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.76, r4= 8.26,
igr1= 90, 91, 92, 94, 95, 96,
igr2= 449, 450, 452, 453,
&end
#
# 319 GLU H 336 ARG HA 6.00 (#peak 40845 )
&rst
ixpk= 40845, nxpk= 0, iat= 150, 435, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 395 THR H 420 LEU HG 5.29 (#peak 40846 )
&rst
ixpk= 40846, nxpk= 0, iat=1381,1796, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79, &end
#
# 378 LYS H 379 ILE QD1 6.00 (#peak 40847 )
&rst
ixpk= 40847, nxpk= 0, iat=1099, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr2=1134,1135,1136,
&end
#
# 340 ILE H 342 GLY H 4.70 (#peak 40848 )
&rst
ixpk= 40848, nxpk= 0, iat= 491, 529, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 313 ILE H 314 ASN HA 4.56 (#peak 40849 )
&rst
ixpk= 40849, nxpk= 0, iat= 51, 72, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06, &end
#
# 314 ASN H 315 VAL HB 5.50 (#peak 40850 )
&rst
ixpk= 40850, nxpk= 0, iat= 70, 88, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 314 ASN H 315 VAL HA 4.48 (#peak 40851 )
&rst
ixpk= 40851, nxpk= 0, iat= 70, 86, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98, &end
#
# 327 ASN HA 329 LYS H 5.92 (#peak 40852 )
&rst
ixpk= 40852, nxpk= 0, iat= 290, 309, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42, &end
#
# 316 LYS H 336 ARG QH 5.81 (#peak 40854 )
&rst
ixpk= 40854, nxpk= 0, iat= 100, -1, r1= 1.30, r2= 1.80, r3= 7.32, r4= 7.82,
igr2= 449, 450, 452, 453,
&end
#
# 317 PRO QD 336 ARG QH 5.61 (#peak 40855 )
&rst
ixpk= 40855, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
igr1= 124, 123,
igr2= 449, 450, 452, 453,
&end
#
# 367 ASP H 370 LYS H 5.65 (#peak 40857 )
&rst
ixpk= 40857, nxpk= 0, iat= 916, 967, r1= 1.30, r2= 1.80, r3= 5.65, r4= 6.15, &end
#
# 384 TYR H 398 SER H 6.00 (#peak 40858 )
&rst
ixpk= 40858, nxpk= 0, iat=1196,1436, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 366 THR H 368 LYS QB 4.35 (#peak 40859 )
&rst
ixpk= 40859, nxpk= 0, iat= 902, -1, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
igr2= 933, 932,
&end
#
# 369 HIE H 373 LEU QQD 6.00 (#peak 40860 )
&rst
ixpk= 40860, nxpk= 0, iat= 950, -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
igr2=1024,1025,1026,1028,1029,1030,
&end
#
# 402 SER QB 413 TYR H 6.00 (#peak 40862 )
&rst
ixpk= 40862, nxpk= 0, iat= -1,1678, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1=1513,1512,
&end
#
# 366 THR H 369 HIE H 6.00 (#peak 40863 )
&rst
ixpk= 40863, nxpk= 0, iat= 902, 950, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 396 LEU QB 400 TRP HE1 5.29 (#peak 40864 )
&rst
ixpk= 40864, nxpk= 0, iat= -1,1478, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
igr1=1400,1399,
&end
#
# 400 TRP HE1 417 VAL HA 6.00 (#peak 40865 )
&rst
ixpk= 40865, nxpk= 0, iat=1478,1747, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 341 LEU QQD 388 ALA H 4.94 (#peak 40866 )
&rst
ixpk= 40866, nxpk= 0, iat= -1,1283, r1= 1.30, r2= 1.80, r3= 6.66, r4= 7.16,
igr1= 519, 520, 521, 523, 524, 525,
&end
#
# 386 PHE H 387 ARG H 4.87 (#peak 40867 )
&rst
ixpk= 40867, nxpk= 0, iat=1239,1259, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37, &end
#
# 341 LEU QQD 387 ARG H 5.70 (#peak 40868 )
&rst
ixpk= 40868, nxpk= 0, iat= -1,1259, r1= 1.30, r2= 1.80, r3= 7.68, r4= 8.18,
igr1= 519, 520, 521, 523, 524, 525,
&end
#
# 414 ILE QD1 415 VAL H 4.24 (#peak 40870 )
&rst
ixpk= 40870, nxpk= 0, iat= -1,1718, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
igr1=1712,1713,1714,
&end
#
# 358 HIE H 359 GLN H 5.83 (#peak 40871 )
&rst
ixpk= 40871, nxpk= 0, iat= 780, 797, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33, &end
#
# 379 ILE HB 380 LEU H 4.18 (#peak 40872 )
&rst
ixpk= 40872, nxpk= 0, iat=1125,1140, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68, &end
#
# 386 PHE H 387 ARG HA 5.67 (#peak 40873 )
&rst
ixpk= 40873, nxpk= 0, iat=1239,1261, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17, &end
#
# 404 THR H 405 ASN H 5.78 (#peak 40874 )
&rst
ixpk= 40874, nxpk= 0, iat=1539,1553, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28, &end
#
# 403 PHE QB 404 THR H 5.26 (#peak 40875 )
&rst
ixpk= 40875, nxpk= 0, iat= -1,1539, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
igr1=1524,1523,
&end
#
# 396 LEU HG 418 ASN QD2 4.86 (#peak 40876 )
&rst
ixpk= 40876, nxpk= 0, iat=1402, -1, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
igr2=1771,1770,
&end
#
# 322 THR HB 418 ASN QD2 5.19 (#peak 40877 )
&rst
ixpk= 40877, nxpk= 0, iat= 208, -1, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33,
igr2=1771,1770,
&end
#
# 399 GLN H 417 VAL QQG 4.68 (#peak 40878 )
&rst
ixpk= 40878, nxpk= 0, iat=1447, -1, r1= 1.30, r2= 1.80, r3= 6.31, r4= 6.81,
igr2=1751,1752,1753,1755,1756,1757,
&end
#
# 323 ARG H 332 TYR H 4.02 (#peak 40880 )
&rst
ixpk= 40880, nxpk= 0, iat= 218, 367, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52, &end
#
# 384 TYR H 396 LEU QB 3.72 (#peak 40881 )
&rst
ixpk= 40881, nxpk= 0, iat=1196, -1, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
igr2=1400,1399,
&end
#
# 329 LYS H 330 PHE H 5.57 (#peak 40882 )
&rst
ixpk= 40882, nxpk= 0, iat= 309, 331, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07, &end
#
# 393 PHE H 394 VAL H 4.62 (#peak 40883 )
&rst
ixpk= 40883, nxpk= 0, iat=1345,1365, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12, &end
#
# 393 PHE QD 394 VAL H 4.84 (#peak 40884 )
&rst
ixpk= 40884, nxpk= 0, iat= -1,1365, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
igr1=1353,1361,
&end
#
# 413 TYR QD 414 ILE H 4.87 (#peak 40885 )
&rst
ixpk= 40885, nxpk= 0, iat= -1,1699, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,
igr1=1686,1693,
&end
#
# 334 ASP HB2 336 ARG H 5.50 (#peak 40886 )
&rst
ixpk= 40886, nxpk= 0, iat= 409, 433, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 418 ASN H 419 THR H 4.97 (#peak 40888 )
&rst
ixpk= 40888, nxpk= 0, iat=1761,1775, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 419 THR H 396 LEU HB2 4.50 (#peak 40889 )
&rst
ixpk= 40889, nxpk= 0, iat=1775,1400, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 402 SER H 414 ILE HA 5.80 (#peak 40890 )
&rst
ixpk= 40890, nxpk= 0, iat=1508,1701, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30, &end
#
# 379 ILE QD1 402 SER H 5.33 (#peak 40891 )
&rst
ixpk= 40891, nxpk= 0, iat= -1,1508, r1= 1.30, r2= 1.80, r3= 6.40, r4= 6.90,
igr1=1134,1135,1136,
&end
#
# 383 SER H 368 LYS QG 5.31 (#peak 40893 )
&rst
ixpk= 40893, nxpk= 0, iat=1185, -1, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
igr2= 936, 935,
&end
#
# 372 VAL QQG 401 PHE H 5.30 (#peak 40897 )
&rst
ixpk= 40897, nxpk= 0, iat= -1,1488, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
igr1=1005,1006,1007,1009,1010,1011,
&end
#
# 392 SER H 393 PHE H 5.96 (#peak 40899 )
&rst
ixpk= 40899, nxpk= 0, iat=1334,1345, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46, &end
#
# 322 THR H 418 ASN H 6.00 (#peak 40901 )
&rst
ixpk= 40901, nxpk= 0, iat= 204,1761, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 347 GLU H 348 LEU H 3.65 (#peak 40902 )
&rst
ixpk= 40902, nxpk= 0, iat= 607, 622, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15, &end
#
# 351 THR H 352 SER H 6.00 (#peak 40903 )
&rst
ixpk= 40903, nxpk= 0, iat= 667, 681, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 388 ALA QB 390 ASP H 4.05 (#peak 40904 )
&rst
ixpk= 40904, nxpk= 0, iat= -1,1315, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
igr1=1287,1288,1289,
&end
#
# 320 PHE H 417 VAL QQG 5.35 (#peak 40905 )
&rst
ixpk= 40905, nxpk= 0, iat= 165, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr2=1751,1752,1753,1755,1756,1757,
&end
#
# 313 ILE QG1 314 ASN QD2 5.61 (#peak 40906 )
&rst
ixpk= 40906, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,
igr1= 62, 61,
igr2= 80, 79,
&end
#
# 313 ILE QG2 314 ASN QD2 4.58 (#peak 40907 )
&rst
ixpk= 40907, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 57, 58, 59,
igr2= 80, 79,
&end
#
# 335 GLN QE2 336 ARG HB3 6.00 (#peak 40909 )
&rst
ixpk= 40909, nxpk= 0, iat= -1, 437, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1= 429, 428,
&end
#
# 335 GLN QG 336 ARG QH 5.81 (#peak 40910 )
&rst
ixpk= 40910, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.22, r4= 8.72,
igr1= 424, 423,
igr2= 449, 450, 452, 453,
&end
#
# 349 LEU QB 351 THR H 5.82 (#peak 40912 )
&rst
ixpk= 40912, nxpk= 0, iat= -1, 667, r1= 1.30, r2= 1.80, r3= 6.53, r4= 7.03,
igr1= 646, 645,
&end
#
# 389 LYS H 391 GLY H 5.43 (#peak 40913 )
&rst
ixpk= 40913, nxpk= 0, iat=1293,1327, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93, &end
#
# 327 ASN QD2 330 PHE HA 5.42 (#peak 40914 )
&rst
ixpk= 40914, nxpk= 0, iat= -1, 333, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
igr1= 298, 297,
&end
#
# 325 ALA H 328 GLY H 6.00 (#peak 40916 )
&rst
ixpk= 40916, nxpk= 0, iat= 262, 302, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 331 VAL QQG 350 GLY H 5.14 (#peak 40918 )
&rst
ixpk= 40918, nxpk= 0, iat= -1, 660, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
igr1= 357, 358, 359, 361, 362, 363,
&end
#
# 411 LEU H 412 GLU H 4.13 (#peak 40920 )
&rst
ixpk= 40920, nxpk= 0, iat=1644,1663, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63, &end
#
# 384 TYR H 385 LYS H 5.13 (#peak 40921 )
&rst
ixpk= 40921, nxpk= 0, iat=1196,1217, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63, &end
#
# 324 PHE H 325 ALA H 3.95 (#peak 40922 )
&rst
ixpk= 40922, nxpk= 0, iat= 242, 262, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45, &end
#
# 335 GLN H 337 ALA QB 6.00 (#peak 40923 )
&rst
ixpk= 40923, nxpk= 0, iat= 416, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr2= 461, 462, 463,
&end
#
# 343 TYR QD 389 LYS H 5.15 (#peak 40925 )
&rst
ixpk= 40925, nxpk= 0, iat= -1,1293, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr1= 544, 551,
&end
#
# 326 VAL H 413 TYR QD 6.00 (#peak 40926 )
&rst
ixpk= 40926, nxpk= 0, iat= 272, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=1686,1693,
&end
#
# 323 ARG H 331 VAL QQG 4.23 (#peak 40928 )
&rst
ixpk= 40928, nxpk= 0, iat= 218, -1, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr2= 357, 358, 359, 361, 362, 363,
&end
#
# 388 ALA H 393 PHE H 6.00 (#peak 40929 )
&rst
ixpk= 40929, nxpk= 0, iat=1283,1345, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 398 SER H 399 GLN H 5.25 (#peak 40930 )
&rst
ixpk= 40930, nxpk= 0, iat=1436,1447, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75, &end
#
# 398 SER H 399 GLN HA 6.00 (#peak 40931 )
&rst
ixpk= 40931, nxpk= 0, iat=1436,1449, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 384 TYR QE 397 LYS H 6.00 (#peak 40932 )
&rst
ixpk= 40932, nxpk= 0, iat= -1,1414, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1=1206,1209,
&end
#
# 341 LEU QQD 391 GLY H 6.00 (#peak 40933 )
&rst
ixpk= 40933, nxpk= 0, iat= -1,1327, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
igr1= 519, 520, 521, 523, 524, 525,
&end
#
# 327 ASN QD2 329 LYS QG 5.81 (#peak 40937 )
&rst
ixpk= 40937, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.32, r4= 7.82,
igr1= 298, 297,
igr2= 317, 316,
&end
#
# 327 ASN QD2 329 LYS QB 5.13 (#peak 40938 )
&rst
ixpk= 40938, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.46, r4= 6.96,
igr1= 298, 297,
igr2= 314, 313,
&end
#
# 325 ALA QB 327 ASN QD2 5.02 (#peak 40939 )
&rst
ixpk= 40939, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.77, r4= 7.27,
igr1= 266, 267, 268,
igr2= 298, 297,
&end
#
# 334 ASP HB3 335 GLN QE2 5.81 (#peak 40941 )
&rst
ixpk= 40941, nxpk= 0, iat= 408, -1, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
igr2= 429, 428,
&end
#
# 361 ASP HA 364 ASN QD2 3.76 (#peak 40942 )
&rst
ixpk= 40942, nxpk= 0, iat= 828, -1, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
igr2= 879, 878,
&end
#
# 412 GLU QB 413 TYR H 4.47 (#peak 40944 )
&rst
ixpk= 40944, nxpk= 0, iat= -1,1678, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
igr1=1668,1667,
&end
#
# 320 PHE QB 321 ILE H 4.09 (#peak 40946 )
&rst
ixpk= 40946, nxpk= 0, iat= -1, 185, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
igr1= 170, 169,
&end
#
# 387 ARG QG 388 ALA H 4.46 (#peak 40948 )
&rst
ixpk= 40948, nxpk= 0, iat= -1,1283, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
igr1=1267,1266,
&end
#
# 388 ALA H 391 GLY QA 5.81 (#peak 40949 )
&rst
ixpk= 40949, nxpk= 0, iat=1283, -1, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
igr2=1330,1329,
&end
#
# 401 PHE QE 415 VAL H 6.00 (#peak 40950 )
&rst
ixpk= 40950, nxpk= 0, iat= -1,1718, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1=1498,1502,
&end
#
# 383 SER H 384 TYR QD 6.00 (#peak 40952 )
&rst
ixpk= 40952, nxpk= 0, iat=1185, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=1204,1211,
&end
#
# 379 ILE QG1 400 TRP H 5.17 (#peak 40953 )
&rst
ixpk= 40953, nxpk= 0, iat= -1,1464, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
igr1=1132,1131,
&end
#
# 324 PHE QD 353 CYS H 4.97 (#peak 40954 )
&rst
ixpk= 40954, nxpk= 0, iat= -1, 692, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr1= 250, 258,
&end
#
# 417 VAL HA 418 ASN QD2 6.00 (#peak 40955 )
&rst
ixpk= 40955, nxpk= 0, iat=1747, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=1771,1770,
&end
#
# 398 SER QB 400 TRP HE1 5.74 (#peak 40956 )
&rst
ixpk= 40956, nxpk= 0, iat= -1,1478, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,
igr1=1441,1440,
&end
#
# 396 LEU QB 418 ASN QD2 5.27 (#peak 40957 )
&rst
ixpk= 40957, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.64, r4= 7.14,
igr1=1400,1399,
igr2=1771,1770,
&end
#
# 372 VAL QQG 402 SER H 4.19 (#peak 40958 )
&rst
ixpk= 40958, nxpk= 0, iat= -1,1508, r1= 1.30, r2= 1.80, r3= 5.65, r4= 6.15,
igr1=1005,1006,1007,1009,1010,1011,
&end
#
# 322 THR H 418 ASN QD2 4.36 (#peak 40959 )
&rst
ixpk= 40959, nxpk= 0, iat= 204, -1, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
igr2=1771,1770,
&end
#
# 322 THR H 418 ASN QB 5.81 (#peak 40960 )
&rst
ixpk= 40960, nxpk= 0, iat= 204, -1, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
igr2=1766,1765,
&end
#
# 396 LEU QB 398 SER H 5.33 (#peak 40961 )
&rst
ixpk= 40961, nxpk= 0, iat= -1,1436, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
igr1=1400,1399,
&end
#
# 331 VAL HA 350 GLY H 5.29 (#peak 40962 )
&rst
ixpk= 40962, nxpk= 0, iat= 353, 660, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79, &end
#
# 388 ALA H 394 VAL QQG 5.57 (#peak 40963 )
&rst
ixpk= 40963, nxpk= 0, iat=1283, -1, r1= 1.30, r2= 1.80, r3= 7.51, r4= 8.01,
igr2=1371,1372,1373,1375,1376,1377,
&end
#
# 399 GLN QB 400 TRP H 4.34 (#peak 40965 )
&rst
ixpk= 40965, nxpk= 0, iat= -1,1464, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,
igr1=1452,1451,
&end
#
# 379 ILE QG2 400 TRP H 5.80 (#peak 40966 )
&rst
ixpk= 40966, nxpk= 0, iat= -1,1464, r1= 1.30, r2= 1.80, r3= 6.97, r4= 7.47,
igr1=1127,1128,1129,
&end
#
# 315 VAL HB 316 LYS H 3.89 (#peak 40967 )
&rst
ixpk= 40967, nxpk= 0, iat= 88, 100, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39, &end
#
# 315 VAL QQG 316 LYS H 4.41 (#peak 40968 )
&rst
ixpk= 40968, nxpk= 0, iat= -1, 100, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
igr1= 90, 91, 92, 94, 95, 96,
&end
#
# 357 PHE QB 358 HIE H 4.86 (#peak 40969 )
&rst
ixpk= 40969, nxpk= 0, iat= -1, 780, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
igr1= 765, 764,
&end
#
# 379 ILE H 380 LEU H 5.39 (#peak 40970 )
&rst
ixpk= 40970, nxpk= 0, iat=1121,1140, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89, &end
#
# 379 ILE H 378 LYS QE 5.18 (#peak 40971 )
&rst
ixpk= 40971, nxpk= 0, iat=1121, -1, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
igr2=1113,1112,
&end
#
# 343 TYR QD 344 LEU H 5.12 (#peak 40972 )
&rst
ixpk= 40972, nxpk= 0, iat= -1, 557, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
igr1= 544, 551,
&end
#
# 366 THR QG2 369 HIE H 5.10 (#peak 40973 )
&rst
ixpk= 40973, nxpk= 0, iat= -1, 950, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,
igr1= 910, 911, 912,
&end
#
# 367 ASP H 368 LYS QB 4.88 (#peak 40974 )
&rst
ixpk= 40974, nxpk= 0, iat= 916, -1, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
igr2= 933, 932,
&end
#
# 331 VAL QQG 332 TYR H 3.70 (#peak 40975 )
&rst
ixpk= 40975, nxpk= 0, iat= -1, 367, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,
igr1= 357, 358, 359, 361, 362, 363,
&end
#
# 324 PHE H 414 ILE HB 5.80 (#peak 40976 )
&rst
ixpk= 40976, nxpk= 0, iat= 242,1703, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30, &end
#
# 377 GLU QB 378 LYS H 4.52 (#peak 40978 )
&rst
ixpk= 40978, nxpk= 0, iat= -1,1099, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
igr1=1089,1088,
&end
#
# 409 LYS QG 410 GLU H 5.02 (#peak 40979 )
&rst
ixpk= 40979, nxpk= 0, iat= -1,1629, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr1=1615,1614,
&end
#
# 397 LYS QB 419 THR H 4.86 (#peak 40980 )
&rst
ixpk= 40980, nxpk= 0, iat= -1,1775, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
igr1=1419,1418,
&end
#
# 326 VAL H 414 ILE QG1 5.49 (#peak 40982 )
&rst
ixpk= 40982, nxpk= 0, iat= 272, -1, r1= 1.30, r2= 1.80, r3= 6.16, r4= 6.66,
igr2=1710,1709,
&end
#
# 354 TYR QB 355 GLU H 6.00 (#peak 40983 )
&rst
ixpk= 40983, nxpk= 0, iat= -1, 724, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1= 708, 707,
&end
#
# 338 THR H 340 ILE H 5.38 (#peak 40984 )
&rst
ixpk= 40984, nxpk= 0, iat= 467, 491, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88, &end
#
# 347 GLU QB 348 LEU H 4.28 (#peak 40985 )
&rst
ixpk= 40985, nxpk= 0, iat= -1, 622, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1= 612, 611,
&end
#
# 343 TYR QB 348 LEU H 3.65 (#peak 40986 )
&rst
ixpk= 40986, nxpk= 0, iat= -1, 622, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,
igr1= 541, 540,
&end
#
# 321 ILE QG2 322 THR H 3.94 (#peak 40987 )
&rst
ixpk= 40987, nxpk= 0, iat= -1, 204, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
igr1= 191, 192, 193,
&end
#
# 396 LEU QB 397 LYS H 3.55 (#peak 40988 )
&rst
ixpk= 40988, nxpk= 0, iat= -1,1414, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,
igr1=1400,1399,
&end
#
# 380 LEU QQD 381 THR H 4.33 (#peak 40989 )
&rst
ixpk= 40989, nxpk= 0, iat= -1,1159, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
igr1=1149,1150,1151,1153,1154,1155,
&end
#
# 331 VAL QQG 351 THR H 5.35 (#peak 40990 )
&rst
ixpk= 40990, nxpk= 0, iat= -1, 667, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr1= 357, 358, 359, 361, 362, 363,
&end
#
# 410 GLU QG 411 LEU H 4.72 (#peak 40992 )
&rst
ixpk= 40992, nxpk= 0, iat= -1,1644, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr1=1637,1636,
&end
#
# 384 TYR H 397 LYS QE 5.18 (#peak 40993 )
&rst
ixpk= 40993, nxpk= 0, iat=1196, -1, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
igr2=1428,1427,
&end
#
# 335 GLN H 336 ARG HB3 5.62 (#peak 40994 )
&rst
ixpk= 40994, nxpk= 0, iat= 416, 437, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12, &end
#
# 313 ILE QG2 314 ASN H 5.12 (#peak 40995 )
&rst
ixpk= 40995, nxpk= 0, iat= -1, 70, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
igr1= 57, 58, 59,
&end
#
# 319 GLU H 340 ILE QD1 5.16 (#peak 40996 )
&rst
ixpk= 40996, nxpk= 0, iat= 150, -1, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
igr2= 504, 505, 506,
&end
#
# 384 TYR QB 385 LYS H 3.54 (#peak 40997 )
&rst
ixpk= 40997, nxpk= 0, iat= -1,1217, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47,
igr1=1201,1200,
&end
#
# 324 PHE QD 331 VAL H 4.97 (#peak 40998 )
&rst
ixpk= 40998, nxpk= 0, iat= -1, 351, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr1= 250, 258,
&end
#
# 328 GLY H 329 LYS QB 6.00 (#peak 41001 )
&rst
ixpk= 41001, nxpk= 0, iat= 302, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2= 314, 313,
&end
#
# 322 THR QG2 418 ASN QD2 4.68 (#peak 41002 )
&rst
ixpk= 41002, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.31, r4= 6.81,
igr1= 212, 213, 214,
igr2=1771,1770,
&end
#
# 354 TYR QB 357 PHE H 5.81 (#peak 41003 )
&rst
ixpk= 41003, nxpk= 0, iat= -1, 760, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
igr1= 708, 707,
&end
#
# 401 PHE QE 417 VAL H 4.89 (#peak 41004 )
&rst
ixpk= 41004, nxpk= 0, iat= -1,1745, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
igr1=1498,1502,
&end
#
# 386 PHE H 387 ARG HB2 5.00 (#peak 41005 )
&rst
ixpk= 41005, nxpk= 0, iat=1239,1264, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 330 PHE QD 351 THR H 6.00 (#peak 41006 )
&rst
ixpk= 41006, nxpk= 0, iat= -1, 667, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1= 339, 347,
&end
#
# 326 VAL HA 328 GLY H 4.15 (#peak 41007 )
&rst
ixpk= 41007, nxpk= 0, iat= 274, 302, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65, &end
#
# 415 VAL HB 416 SER H 3.80 (#peak 41008 )
&rst
ixpk= 41008, nxpk= 0, iat=1722,1734, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30, &end
#
# 314 ASN QB 315 VAL H 4.96 (#peak 41009 )
&rst
ixpk= 41009, nxpk= 0, iat= -1, 84, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
igr1= 75, 74,
&end
#
# 396 LEU HA 421 VAL H 5.15 (#peak 41010 )
&rst
ixpk= 41010, nxpk= 0, iat=1397,1808, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65, &end
#
# 326 VAL H 413 TYR QB 5.81 (#peak 41012 )
&rst
ixpk= 41012, nxpk= 0, iat= 272, -1, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
igr2=1683,1682,
&end
#
# 325 ALA HA 327 ASN H 4.63 (#peak 41013 )
&rst
ixpk= 41013, nxpk= 0, iat= 264, 288, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, &end
#
# 405 ASN QD2 406 PRO QG 5.81 (#peak 41014 )
&rst
ixpk= 41014, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.32, r4= 7.82,
igr1=1563,1562,
igr2=1577,1576,
&end
#
# 405 ASN QD2 408 THR QG2 4.40 (#peak 41015 )
&rst
ixpk= 41015, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr1=1563,1562,
igr2=1601,1602,1603,
&end
#
# 319 GLU H 420 LEU QQD 4.80 (#peak 41016 )
&rst
ixpk= 41016, nxpk= 0, iat= 150, -1, r1= 1.30, r2= 1.80, r3= 6.47, r4= 6.97,
igr2=1798,1799,1800,1802,1803,1804,
&end
#
# 388 ALA H 389 LYS H 6.00 (#peak 41017 )
&rst
ixpk= 41017, nxpk= 0, iat=1283,1293, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 341 LEU QQD 386 PHE H 4.99 (#peak 41018 )
&rst
ixpk= 41018, nxpk= 0, iat= -1,1239, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1= 519, 520, 521, 523, 524, 525,
&end
#
# 324 PHE H 413 TYR QB 5.81 (#peak 41019 )
&rst
ixpk= 41019, nxpk= 0, iat= 242, -1, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
igr2=1683,1682,
&end
#
# 328 GLY H 353 CYS H 6.00 (#peak 41020 )
&rst
ixpk= 41020, nxpk= 0, iat= 302, 692, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 333 VAL H 334 ASP H 5.19 (#peak 41023 )
&rst
ixpk= 41023, nxpk= 0, iat= 388, 404, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69, &end
#
# 333 VAL HB 334 ASP H 6.00 (#peak 41024 )
&rst
ixpk= 41024, nxpk= 0, iat= 392, 404, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 321 ILE H 334 ASP H 6.00 (#peak 41025 )
&rst
ixpk= 41025, nxpk= 0, iat= 185, 404, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 416 SER H 417 VAL H 4.95 (#peak 41026 )
&rst
ixpk= 41026, nxpk= 0, iat=1734,1745, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45, &end
#
# 334 ASP HB3 337 ALA H 4.74 (#peak 41027 )
&rst
ixpk= 41027, nxpk= 0, iat= 408, 457, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24, &end
#
# 346 GLN H 349 LEU H 6.00 (#peak 41030 )
&rst
ixpk= 41030, nxpk= 0, iat= 590, 641, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 346 GLN QG 349 LEU H 6.00 (#peak 41031 )
&rst
ixpk= 41031, nxpk= 0, iat= -1, 641, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1= 598, 597,
&end
#
# 329 LYS QG 352 SER H 5.51 (#peak 41033 )
&rst
ixpk= 41033, nxpk= 0, iat= -1, 681, r1= 1.30, r2= 1.80, r3= 6.18, r4= 6.68,
igr1= 317, 316,
&end
#
# 358 HIE H 385 LYS QD 6.00 (#peak 41034 )
&rst
ixpk= 41034, nxpk= 0, iat= 780, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=1228,1227,
&end
#
# 362 HIE H 365 LEU H 6.00 (#peak 41035 )
&rst
ixpk= 41035, nxpk= 0, iat= 838, 883, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 358 HIE H 385 LYS H 5.94 (#peak 41036 )
&rst
ixpk= 41036, nxpk= 0, iat= 780,1217, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44, &end
#
# 385 LYS H 386 PHE H 5.88 (#peak 41037 )
&rst
ixpk= 41037, nxpk= 0, iat=1217,1239, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38, &end
#
# 341 LEU HA 388 ALA H 6.00 (#peak 41038 )
&rst
ixpk= 41038, nxpk= 0, iat= 512,1283, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 397 LYS QG 398 SER H 5.65 (#peak 41040 )
&rst
ixpk= 41040, nxpk= 0, iat= -1,1436, r1= 1.30, r2= 1.80, r3= 6.34, r4= 6.84,
igr1=1422,1421,
&end
#
# 405 ASN H 412 GLU QG 6.00 (#peak 41041 )
&rst
ixpk= 41041, nxpk= 0, iat=1553, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=1671,1670,
&end
#
# 400 TRP H 417 VAL H 6.00 (#peak 41043 )
&rst
ixpk= 41043, nxpk= 0, iat=1464,1745, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 321 ILE HB 418 ASN H 4.16 (#peak 41044 )
&rst
ixpk= 41044, nxpk= 0, iat= 189,1761, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66, &end
#
# 397 LYS H 420 LEU H 6.00 (#peak 41045 )
&rst
ixpk= 41045, nxpk= 0, iat=1414,1789, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 396 LEU HA 420 LEU H 4.72 (#peak 41046 )
&rst
ixpk= 41046, nxpk= 0, iat=1397,1789, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22, &end
#
# 425 SER QB 426 GLU H 4.74 (#peak 41047 )
&rst
ixpk= 41047, nxpk= 0, iat= -1,1878, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
igr1=1872,1871,
&end
#
# 332 TYR QE 333 VAL H 4.53 (#peak 41048 )
&rst
ixpk= 41048, nxpk= 0, iat= -1, 388, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
igr1= 377, 380,
&end
#
# 335 GLN QE2 336 ARG QD 5.81 (#peak 41049 )
&rst
ixpk= 41049, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.32, r4= 7.82,
igr1= 429, 428,
igr2= 444, 443,
&end
#
# 405 ASN QD2 406 PRO QB 5.61 (#peak 41050 )
&rst
ixpk= 41050, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,
igr1=1563,1562,
igr2=1574,1573,
&end
#
# 368 LYS QE 369 HIE H 6.00 (#peak 41051 )
&rst
ixpk= 41051, nxpk= 0, iat= -1, 950, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1= 942, 941,
&end
#
# 368 LYS H 369 HIE HD2 5.63 (#peak 41052 )
&rst
ixpk= 41052, nxpk= 0, iat= 928, 959, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13, &end
#
# 370 LYS QG 371 ALA H 3.94 (#peak 41053 )
&rst
ixpk= 41053, nxpk= 0, iat= -1, 989, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
igr1= 975, 974,
&end
#
# 365 LEU H 384 TYR QE 5.62 (#peak 41054 )
&rst
ixpk= 41054, nxpk= 0, iat= 883, -1, r1= 1.30, r2= 1.80, r3= 6.31, r4= 6.81,
igr2=1206,1209,
&end
#
# 373 LEU H 414 ILE QD1 6.00 (#peak 41055 )
&rst
ixpk= 41055, nxpk= 0, iat=1015, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr2=1712,1713,1714,
&end
#
# 370 LYS H 373 LEU QQD 6.00 (#peak 41056 )
&rst
ixpk= 41056, nxpk= 0, iat= 967, -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
igr2=1024,1025,1026,1028,1029,1030,
&end
#
# 364 ASN QB 366 THR H 4.95 (#peak 41057 )
&rst
ixpk= 41057, nxpk= 0, iat= -1, 902, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
igr1= 874, 873,
&end
#
# 369 HIE HD2 370 LYS H 5.62 (#peak 41058 )
&rst
ixpk= 41058, nxpk= 0, iat= 959, 967, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12, &end
#
# 364 ASN QB 365 LEU H 4.19 (#peak 41059 )
&rst
ixpk= 41059, nxpk= 0, iat= -1, 883, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
igr1= 874, 873,
&end
#
# 372 VAL QQG 373 LEU H 4.00 (#peak 41061 )
&rst
ixpk= 41061, nxpk= 0, iat= -1,1015, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr1=1005,1006,1007,1009,1010,1011,
&end
#
# 371 ALA QB 375 SER H 5.80 (#peak 41063 )
&rst
ixpk= 41063, nxpk= 0, iat= -1,1051, r1= 1.30, r2= 1.80, r3= 6.97, r4= 7.47,
igr1= 993, 994, 995,
&end
#
# 372 VAL QQG 375 SER H 5.92 (#peak 41064 )
&rst
ixpk= 41064, nxpk= 0, iat= -1,1051, r1= 1.30, r2= 1.80, r3= 7.98, r4= 8.48,
igr1=1005,1006,1007,1009,1010,1011,
&end
#
# 370 LYS QE 371 ALA H 6.00 (#peak 41065 )
&rst
ixpk= 41065, nxpk= 0, iat= -1, 989, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1= 981, 980,
&end
#
# 369 HIE HD2 371 ALA H 6.00 (#peak 41066 )
&rst
ixpk= 41066, nxpk= 0, iat= 959, 989, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 372 VAL QQG 374 GLN H 5.37 (#peak 41067 )
&rst
ixpk= 41067, nxpk= 0, iat= -1,1034, r1= 1.30, r2= 1.80, r3= 7.24, r4= 7.74,
igr1=1005,1006,1007,1009,1010,1011,
&end
#
# 364 ASN QD2 365 LEU H 5.81 (#peak 41068 )
&rst
ixpk= 41068, nxpk= 0, iat= -1, 883, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
igr1= 879, 878,
&end
#
# 365 LEU H 384 TYR QD 6.00 (#peak 41069 )
&rst
ixpk= 41069, nxpk= 0, iat= 883, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=1204,1211,
&end
#
# 365 LEU QQD 366 THR H 6.00 (#peak 41070 )
&rst
ixpk= 41070, nxpk= 0, iat= -1, 902, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
igr1= 892, 893, 894, 896, 897, 898,
&end
#
# 365 LEU HG 366 THR H 6.00 (#peak 41071 )
&rst
ixpk= 41071, nxpk= 0, iat= 890, 902, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 374 GLN H 414 ILE QD1 6.00 (#peak 41072 )
&rst
ixpk= 41072, nxpk= 0, iat=1034, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr2=1712,1713,1714,
&end
#
# 422 LEU H 421 VAL HA 3.30 (#peak 41073 )
&rst
ixpk= 41073, nxpk= 0, iat=1824,1810, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80, &end
#
# 386 PHE QD 418 ASN QD2 5.58 (#peak 41075 )
&rst
ixpk= 41075, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.03, r4= 7.53,
igr1=1247,1255,
igr2=1771,1770,
&end
#
# 343 TYR HA 346 GLN HE22 4.89 (#peak 41077 )
&rst
ixpk= 41077, nxpk= 0, iat= 538, 602, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39, &end
#
# 403 PHE QD 405 ASN QD2 6.00 (#peak 41080 )
&rst
ixpk= 41080, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
igr1=1527,1535,
igr2=1563,1562,
&end
#
# 343 TYR HA 346 GLN HE21 5.73 (#peak 41082 )
&rst
ixpk= 41082, nxpk= 0, iat= 538, 603, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23, &end
#
# 343 TYR HB3 346 GLN QE2 6.00 (#peak 41083 )
&rst
ixpk= 41083, nxpk= 0, iat= 540, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2= 603, 602,
&end
#
# 399 GLN H 400 TRP HE1 6.00 (#peak 41085 )
&rst
ixpk= 41085, nxpk= 0, iat=1447,1478, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 418 ASN QD2 419 THR H 5.06 (#peak 41086 )
&rst
ixpk= 41086, nxpk= 0, iat= -1,1775, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
igr1=1771,1770,
&end
#
# 386 PHE QE 388 ALA H 5.29 (#peak 41089 )
&rst
ixpk= 41089, nxpk= 0, iat= -1,1283, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
igr1=1249,1253,
&end
#
# 388 ALA H 393 PHE HA 5.30 (#peak 41090 )
&rst
ixpk= 41090, nxpk= 0, iat=1283,1347, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80, &end
#
# 356 TYR QD 387 ARG H 4.81 (#peak 41091 )
&rst
ixpk= 41091, nxpk= 0, iat= -1,1259, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr1= 747, 754,
&end
#
# 412 GLU H 413 TYR QD 5.14 (#peak 41093 )
&rst
ixpk= 41093, nxpk= 0, iat=1663, -1, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,
igr2=1686,1693,
&end
#
# 332 TYR QE 334 ASP H 4.67 (#peak 41094 )
&rst
ixpk= 41094, nxpk= 0, iat= -1, 404, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr1= 377, 380,
&end
#
# 385 LYS QD 386 PHE H 4.66 (#peak 41096 )
&rst
ixpk= 41096, nxpk= 0, iat= -1,1239, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73,
igr1=1228,1227,
&end
#
# 379 ILE H 401 PHE QD 6.00 (#peak 41097 )
&rst
ixpk= 41097, nxpk= 0, iat=1121, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=1496,1504,
&end
#
# 403 PHE QD 404 THR H 4.78 (#peak 41098 )
&rst
ixpk= 41098, nxpk= 0, iat= -1,1539, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr1=1527,1535,
&end
#
# 324 PHE QD 325 ALA H 5.50 (#peak 41100 )
&rst
ixpk= 41100, nxpk= 0, iat= -1, 262, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 250, 258,
&end
#
# 325 ALA H 331 VAL HB 4.35 (#peak 41101 )
&rst
ixpk= 41101, nxpk= 0, iat= 262, 355, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85, &end
#
# 325 ALA H 331 VAL QQG 4.15 (#peak 41102 )
&rst
ixpk= 41102, nxpk= 0, iat= 262, -1, r1= 1.30, r2= 1.80, r3= 5.59, r4= 6.09,
igr2= 357, 358, 359, 361, 362, 363,
&end
#
# 343 TYR QE 389 LYS H 5.60 (#peak 41104 )
&rst
ixpk= 41104, nxpk= 0, iat= -1,1293, r1= 1.30, r2= 1.80, r3= 6.29, r4= 6.79,
igr1= 546, 549,
&end
#
# 317 PRO HA 319 GLU H 3.60 (#peak 41105 )
&rst
ixpk= 41105, nxpk= 0, iat= 126, 150, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10, &end
#
# 383 SER QB 384 TYR H 4.28 (#peak 41106 )
&rst
ixpk= 41106, nxpk= 0, iat= -1,1196, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1=1190,1189,
&end
#
# 384 TYR H 397 LYS QD 5.37 (#peak 41107 )
&rst
ixpk= 41107, nxpk= 0, iat=1196, -1, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
igr2=1425,1424,
&end
#
# 395 THR H 420 LEU QQD 3.99 (#peak 41109 )
&rst
ixpk= 41109, nxpk= 0, iat=1381, -1, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
igr2=1798,1799,1800,1802,1803,1804,
&end
#
# 324 PHE QD 329 LYS H 5.11 (#peak 41110 )
&rst
ixpk= 41110, nxpk= 0, iat= -1, 309, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
igr1= 250, 258,
&end
#
# 377 GLU H 378 LYS QB 3.85 (#peak 41111 )
&rst
ixpk= 41111, nxpk= 0, iat=1084, -1, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,
igr2=1104,1103,
&end
#
# 405 ASN QB 410 GLU H 4.23 (#peak 41115 )
&rst
ixpk= 41115, nxpk= 0, iat= -1,1629, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25,
igr1=1558,1557,
&end
#
# 401 PHE QD 402 SER H 5.40 (#peak 41117 )
&rst
ixpk= 41117, nxpk= 0, iat= -1,1508, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
igr1=1496,1504,
&end
#
# 336 ARG HG3 337 ALA H 4.63 (#peak 41119 )
&rst
ixpk= 41119, nxpk= 0, iat= 440, 457, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, &end
#
# 309 ASN QB 310 SER H 4.47 (#peak 41120 )
&rst
ixpk= 41120, nxpk= 0, iat= -1, 18, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
igr1= 9, 8,
&end
#
# 352 SER QB 354 TYR H 5.02 (#peak 41121 )
&rst
ixpk= 41121, nxpk= 0, iat= -1, 703, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr1= 686, 685,
&end
#
# 354 TYR QD 366 THR H 5.45 (#peak 41122 )
&rst
ixpk= 41122, nxpk= 0, iat= -1, 902, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,
igr1= 711, 718,
&end
#
# 322 THR H 332 TYR QE 6.00 (#peak 41123 )
&rst
ixpk= 41123, nxpk= 0, iat= 204, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2= 377, 380,
&end
#
# 405 ASN QB 409 LYS H 5.81 (#peak 41124 )
&rst
ixpk= 41124, nxpk= 0, iat= -1,1607, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
igr1=1558,1557,
&end
#
# 384 TYR QE 398 SER H 5.64 (#peak 41125 )
&rst
ixpk= 41125, nxpk= 0, iat= -1,1436, r1= 1.30, r2= 1.80, r3= 6.33, r4= 6.83,
igr1=1206,1209,
&end
#
# 397 LYS QD 398 SER H 5.15 (#peak 41126 )
&rst
ixpk= 41126, nxpk= 0, iat= -1,1436, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr1=1425,1424,
&end
#
# 330 PHE QD 331 VAL H 4.91 (#peak 41127 )
&rst
ixpk= 41127, nxpk= 0, iat= -1, 351, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
igr1= 339, 347,
&end
#
# 389 LYS QG 390 ASP H 4.76 (#peak 41129 )
&rst
ixpk= 41129, nxpk= 0, iat= -1,1315, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr1=1301,1300,
&end
#
# 323 ARG H 332 TYR QD 5.14 (#peak 41130 )
&rst
ixpk= 41130, nxpk= 0, iat= 218, -1, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,
igr2= 375, 382,
&end
#
# 323 ARG H 332 TYR QE 4.84 (#peak 41131 )
&rst
ixpk= 41131, nxpk= 0, iat= 218, -1, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
igr2= 377, 380,
&end
#
# 320 PHE H 319 GLU HB3 4.13 (#peak 41133 )
&rst
ixpk= 41133, nxpk= 0, iat= 165, 154, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63, &end
#
# 375 SER H 373 LEU QD1 6.00 (#peak 41134 )
&rst
ixpk= 41134, nxpk= 0, iat=1051, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr2=1024,1025,1026,
&end
#
# 345 PRO QD 346 GLN H 4.23 (#peak 41135 )
&rst
ixpk= 41135, nxpk= 0, iat= -1, 590, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25,
igr1= 578, 577,
&end
#
# 318 THR H 319 GLU QG 4.45 (#peak 41137 )
&rst
ixpk= 41137, nxpk= 0, iat= 136, -1, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,
igr2= 158, 157,
&end
#
# 422 LEU QQD 423 GLY H 5.45 (#peak 41138 )
&rst
ixpk= 41138, nxpk= 0, iat= -1,1843, r1= 1.30, r2= 1.80, r3= 7.35, r4= 7.85,
igr1=1833,1834,1835,1837,1838,1839,
&end
#
# 405 ASN QB 408 THR H 5.61 (#peak 41139 )
&rst
ixpk= 41139, nxpk= 0, iat= -1,1593, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
igr1=1558,1557,
&end
#
# 408 THR H 409 LYS HA 4.94 (#peak 41140 )
&rst
ixpk= 41140, nxpk= 0, iat=1593,1609, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44, &end
#
# 324 PHE QD 328 GLY H 4.70 (#peak 41141 )
&rst
ixpk= 41141, nxpk= 0, iat= -1, 302, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
igr1= 250, 258,
&end
#
# 328 GLY H 329 LYS QG 6.00 (#peak 41142 )
&rst
ixpk= 41142, nxpk= 0, iat= 302, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2= 317, 316,
&end
#
# 413 TYR QD 415 VAL H 6.00 (#peak 41145 )
&rst
ixpk= 41145, nxpk= 0, iat= -1,1718, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1=1686,1693,
&end
#
# 401 PHE QB 415 VAL H 6.00 (#peak 41146 )
&rst
ixpk= 41146, nxpk= 0, iat= -1,1718, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1=1493,1492,
&end
#
# 384 TYR QD 396 LEU H 6.00 (#peak 41148 )
&rst
ixpk= 41148, nxpk= 0, iat= -1,1395, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1=1204,1211,
&end
#
# 419 THR HB 420 LEU H 3.90 (#peak 41149 )
&rst
ixpk= 41149, nxpk= 0, iat=1779,1789, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40, &end
#
# 329 LYS HA 353 CYS H 3.20 (#peak 41150 )
&rst
ixpk= 41150, nxpk= 0, iat= 311, 692, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 403 PHE QD 405 ASN H 5.55 (#peak 41151 )
&rst
ixpk= 41151, nxpk= 0, iat= -1,1553, r1= 1.30, r2= 1.80, r3= 6.23, r4= 6.73,
igr1=1527,1535,
&end
#
# 405 ASN H 412 GLU HB3 3.54 (#peak 41152 )
&rst
ixpk= 41152, nxpk= 0, iat=1553,1667, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04, &end
#
# 405 ASN H 406 PRO QD 3.75 (#peak 41153 )
&rst
ixpk= 41153, nxpk= 0, iat=1553, -1, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,
igr2=1569,1568,
&end
#
# 341 LEU QQD 394 VAL H 4.55 (#peak 41154 )
&rst
ixpk= 41154, nxpk= 0, iat= -1,1365, r1= 1.30, r2= 1.80, r3= 6.13, r4= 6.63,
igr1= 519, 520, 521, 523, 524, 525,
&end
#
# 324 PHE QD 330 PHE H 6.00 (#peak 41155 )
&rst
ixpk= 41155, nxpk= 0, iat= -1, 331, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1= 250, 258,
&end
#
# 399 GLN H 401 PHE QE 6.00 (#peak 41156 )
&rst
ixpk= 41156, nxpk= 0, iat=1447, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=1498,1502,
&end
#
# 371 ALA H 372 VAL HB 6.00 (#peak 41157 )
&rst
ixpk= 41157, nxpk= 0, iat= 989,1003, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 360 ASP QB 362 HIE H 5.81 (#peak 41158 )
&rst
ixpk= 41158, nxpk= 0, iat= -1, 838, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
igr1= 819, 818,
&end
#
# 330 PHE QD 332 TYR H 4.80 (#peak 41160 )
&rst
ixpk= 41160, nxpk= 0, iat= -1, 367, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr1= 339, 347,
&end
#
# 323 ARG QB 332 TYR H 4.00 (#peak 41161 )
&rst
ixpk= 41161, nxpk= 0, iat= -1, 367, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
igr1= 223, 222,
&end
#
# 365 LEU QQD 367 ASP H 6.00 (#peak 41162 )
&rst
ixpk= 41162, nxpk= 0, iat= -1, 916, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
igr1= 892, 893, 894, 896, 897, 898,
&end
#
# 367 ASP H 384 TYR QE 6.00 (#peak 41163 )
&rst
ixpk= 41163, nxpk= 0, iat= 916, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=1206,1209,
&end
#
# 319 GLU HA 419 THR H 6.00 (#peak 41164 )
&rst
ixpk= 41164, nxpk= 0, iat= 152,1775, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 419 THR H 420 LEU HA 6.00 (#peak 41165 )
&rst
ixpk= 41165, nxpk= 0, iat=1775,1791, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 401 PHE QE 416 SER H 6.00 (#peak 41166 )
&rst
ixpk= 41166, nxpk= 0, iat= -1,1734, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1=1498,1502,
&end
#
# 361 ASP H 365 LEU HB3 6.00 (#peak 41168 )
&rst
ixpk= 41168, nxpk= 0, iat= 826, 887, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 405 ASN QB 407 ASP H 4.43 (#peak 41170 )
&rst
ixpk= 41170, nxpk= 0, iat= -1,1581, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
igr1=1558,1557,
&end
#
# 392 SER H 393 PHE HA 6.00 (#peak 41171 )
&rst
ixpk= 41171, nxpk= 0, iat=1334,1347, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 352 SER H 355 GLU H 6.00 (#peak 41172 )
&rst
ixpk= 41172, nxpk= 0, iat= 681, 724, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 393 PHE H 394 VAL QQG 5.92 (#peak 41174 )
&rst
ixpk= 41174, nxpk= 0, iat=1345, -1, r1= 1.30, r2= 1.80, r3= 7.98, r4= 8.48,
igr2=1371,1372,1373,1375,1376,1377,
&end
#
# 384 TYR QD 398 SER H 6.00 (#peak 41175 )
&rst
ixpk= 41175, nxpk= 0, iat= -1,1436, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1=1204,1211,
&end
#
# 336 ARG HG3 338 THR H 6.00 (#peak 41177 )
&rst
ixpk= 41177, nxpk= 0, iat= 440, 467, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 330 PHE QD 350 GLY H 6.00 (#peak 41178 )
&rst
ixpk= 41178, nxpk= 0, iat= -1, 660, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1= 339, 347,
&end
#
# 324 PHE QB 328 GLY H 6.00 (#peak 41179 )
&rst
ixpk= 41179, nxpk= 0, iat= -1, 302, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1= 247, 246,
&end
#
# 387 ARG QG 391 GLY H 5.58 (#peak 41180 )
&rst
ixpk= 41180, nxpk= 0, iat= -1,1327, r1= 1.30, r2= 1.80, r3= 6.26, r4= 6.76,
igr1=1267,1266,
&end
#
# 405 ASN H 411 LEU H 5.51 (#peak 41181 )
&rst
ixpk= 41181, nxpk= 0, iat=1553,1644, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01, &end
#
# 403 PHE H 415 VAL H 6.00 (#peak 41182 )
&rst
ixpk= 41182, nxpk= 0, iat=1519,1718, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 320 PHE QD 420 LEU H 6.00 (#peak 41184 )
&rst
ixpk= 41184, nxpk= 0, iat= -1,1789, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1= 173, 181,
&end
#
# 324 PHE QB 353 CYS H 6.00 (#peak 41185 )
&rst
ixpk= 41185, nxpk= 0, iat= -1, 692, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1= 247, 246,
&end
#
# 318 THR H 319 GLU QB 4.57 (#peak 41187 )
&rst
ixpk= 41187, nxpk= 0, iat= 136, -1, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
igr2= 155, 154,
&end
#
# 414 ILE H 415 VAL HA 6.00 (#peak 41188 )
&rst
ixpk= 41188, nxpk= 0, iat=1699,1720, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 399 GLN HA 417 VAL H 6.00 (#peak 41189 )
&rst
ixpk= 41189, nxpk= 0, iat=1449,1745, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 416 SER QB 417 VAL H 6.00 (#peak 41190 )
&rst
ixpk= 41190, nxpk= 0, iat= -1,1745, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1=1739,1738,
&end
#
# 361 ASP H 364 ASN HA 5.65 (#peak 41191 )
&rst
ixpk= 41191, nxpk= 0, iat= 826, 871, r1= 1.30, r2= 1.80, r3= 5.65, r4= 6.15, &end
#
# 373 LEU HB3 374 GLN H 3.93 (#peak 41192 )
&rst
ixpk= 41192, nxpk= 0, iat=1019,1034, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43, &end
#
# 389 LYS QE 390 ASP H 4.63 (#peak 41194 )
&rst
ixpk= 41194, nxpk= 0, iat= -1,1315, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
igr1=1307,1306,
&end
#
# 365 LEU H 366 THR H 4.25 (#peak 41196 )
&rst
ixpk= 41196, nxpk= 0, iat= 883, 902, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75, &end
#
# 339 ALA H 341 LEU H 6.00 (#peak 41197 )
&rst
ixpk= 41197, nxpk= 0, iat= 481, 510, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 409 LYS H 410 GLU H 4.11 (#peak 41198 )
&rst
ixpk= 41198, nxpk= 0, iat=1607,1629, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 320 PHE QD 337 ALA H 4.97 (#peak 41199 )
&rst
ixpk= 41199, nxpk= 0, iat= -1, 457, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr1= 173, 181,
&end
#
# 389 LYS H 390 ASP H 4.59 (#peak 41201 )
&rst
ixpk= 41201, nxpk= 0, iat=1293,1315, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 339 ALA QB 340 ILE H 3.55 (#peak 41202 )
&rst
ixpk= 41202, nxpk= 0, iat= -1, 491, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,
igr1= 485, 486, 487,
&end
#
# 343 TYR HB2 388 ALA H 6.00 (#peak 41204 )
&rst
ixpk= 41204, nxpk= 0, iat= 541,1283, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 388 ALA H 394 VAL H 4.99 (#peak 41205 )
&rst
ixpk= 41205, nxpk= 0, iat=1283,1365, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49, &end
#
# 358 HIE HA 387 ARG H 5.81 (#peak 41209 )
&rst
ixpk= 41209, nxpk= 0, iat= 782,1259, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31, &end
#
# 333 VAL H 345 PRO QB 5.46 (#peak 41211 )
&rst
ixpk= 41211, nxpk= 0, iat= 388, -1, r1= 1.30, r2= 1.80, r3= 6.13, r4= 6.63,
igr2= 583, 582,
&end
#
# 414 ILE H 415 VAL H 4.42 (#peak 41212 )
&rst
ixpk= 41212, nxpk= 0, iat=1699,1718, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92, &end
#
# 414 ILE QG2 415 VAL H 4.36 (#peak 41213 )
&rst
ixpk= 41213, nxpk= 0, iat= -1,1718, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr1=1705,1706,1707,
&end
#
# 410 GLU H 411 LEU H 5.60 (#peak 41214 )
&rst
ixpk= 41214, nxpk= 0, iat=1629,1644, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10, &end
#
# 405 ASN H 410 GLU H 4.68 (#peak 41218 )
&rst
ixpk= 41218, nxpk= 0, iat=1553,1629, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18, &end
#
# 399 GLN H 400 TRP H 4.96 (#peak 41219 )
&rst
ixpk= 41219, nxpk= 0, iat=1447,1464, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46, &end
#
# 379 ILE QD1 400 TRP H 4.90 (#peak 41221 )
&rst
ixpk= 41221, nxpk= 0, iat= -1,1464, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
igr1=1134,1135,1136,
&end
#
# 396 LEU H 397 LYS QB 4.61 (#peak 41222 )
&rst
ixpk= 41222, nxpk= 0, iat=1395, -1, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67,
igr2=1419,1418,
&end
#
# 379 ILE HA 380 LEU H 3.37 (#peak 41223 )
&rst
ixpk= 41223, nxpk= 0, iat=1123,1140, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87, &end
#
# 315 VAL HA 316 LYS H 3.22 (#peak 41225 )
&rst
ixpk= 41225, nxpk= 0, iat= 86, 100, r1= 1.30, r2= 1.80, r3= 3.22, r4= 3.72, &end
#
# 411 LEU QQD 412 GLU H 3.63 (#peak 41228 )
&rst
ixpk= 41228, nxpk= 0, iat= -1,1663, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
igr1=1653,1654,1655,1657,1658,1659,
&end
#
# 358 HIE H 385 LYS QB 5.19 (#peak 41230 )
&rst
ixpk= 41230, nxpk= 0, iat= 780, -1, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33,
igr2=1222,1221,
&end
#
# 396 LEU H 397 LYS H 5.88 (#peak 41231 )
&rst
ixpk= 41231, nxpk= 0, iat=1395,1414, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38, &end
#
# 353 CYS H 354 TYR H 4.46 (#peak 41233 )
&rst
ixpk= 41233, nxpk= 0, iat= 692, 703, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, &end
#
# 334 ASP H 336 ARG H 6.00 (#peak 41234 )
&rst
ixpk= 41234, nxpk= 0, iat= 404, 433, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 322 THR HB 334 ASP H 6.00 (#peak 41235 )
&rst
ixpk= 41235, nxpk= 0, iat= 208, 404, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 322 THR QG2 334 ASP H 5.11 (#peak 41236 )
&rst
ixpk= 41236, nxpk= 0, iat= -1, 404, r1= 1.30, r2= 1.80, r3= 6.14, r4= 6.64,
igr1= 212, 213, 214,
&end
#
# 334 ASP H 337 ALA QB 5.84 (#peak 41237 )
&rst
ixpk= 41237, nxpk= 0, iat= 404, -1, r1= 1.30, r2= 1.80, r3= 7.01, r4= 7.51,
igr2= 461, 462, 463,
&end
#
# 319 GLU HA 420 LEU H 4.66 (#peak 41240 )
&rst
ixpk= 41240, nxpk= 0, iat= 152,1789, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16, &end
#
# 419 THR HA 420 LEU H 3.54 (#peak 41241 )
&rst
ixpk= 41241, nxpk= 0, iat=1777,1789, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04, &end
#
# 328 GLY QA 353 CYS H 5.01 (#peak 41242 )
&rst
ixpk= 41242, nxpk= 0, iat= -1, 692, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
igr1= 305, 304,
&end
#
# 379 ILE H 401 PHE HA 4.70 (#peak 41244 )
&rst
ixpk= 41244, nxpk= 0, iat=1121,1490, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 403 PHE H 404 THR H 5.58 (#peak 41245 )
&rst
ixpk= 41245, nxpk= 0, iat=1519,1539, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08, &end
#
# 343 TYR H 344 LEU H 6.00 (#peak 41249 )
&rst
ixpk= 41249, nxpk= 0, iat= 536, 557, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 344 LEU H 346 GLN QG 4.61 (#peak 41251 )
&rst
ixpk= 41251, nxpk= 0, iat= 557, -1, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67,
igr2= 598, 597,
&end
#
# 369 HIE H 370 LYS H 4.65 (#peak 41256 )
&rst
ixpk= 41256, nxpk= 0, iat= 950, 967, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15, &end
#
# 368 LYS QB 369 HIE H 4.38 (#peak 41257 )
&rst
ixpk= 41257, nxpk= 0, iat= -1, 950, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
igr1= 933, 932,
&end
#
# 338 THR H 339 ALA H 3.82 (#peak 41258 )
&rst
ixpk= 41258, nxpk= 0, iat= 467, 481, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32, &end
#
# 339 ALA H 340 ILE HB 4.16 (#peak 41260 )
&rst
ixpk= 41260, nxpk= 0, iat= 481, 495, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66, &end
#
# 402 SER H 403 PHE H 6.00 (#peak 41263 )
&rst
ixpk= 41263, nxpk= 0, iat=1508,1519, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 402 SER QB 403 PHE H 4.16 (#peak 41264 )
&rst
ixpk= 41264, nxpk= 0, iat= -1,1519, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
igr1=1513,1512,
&end
#
# 403 PHE H 411 LEU QQD 4.40 (#peak 41265 )
&rst
ixpk= 41265, nxpk= 0, iat=1519, -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr2=1653,1654,1655,1657,1658,1659,
&end
#
# 367 ASP H 369 HIE H 6.00 (#peak 41266 )
&rst
ixpk= 41266, nxpk= 0, iat= 916, 950, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 367 ASP H 368 LYS H 4.43 (#peak 41267 )
&rst
ixpk= 41267, nxpk= 0, iat= 916, 928, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93, &end
#
# 366 THR QG2 367 ASP H 4.56 (#peak 41268 )
&rst
ixpk= 41268, nxpk= 0, iat= -1, 916, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
igr1= 910, 911, 912,
&end
#
# 332 TYR H 333 VAL H 4.60 (#peak 41269 )
&rst
ixpk= 41269, nxpk= 0, iat= 367, 388, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 329 LYS QG 330 PHE H 5.81 (#peak 41275 )
&rst
ixpk= 41275, nxpk= 0, iat= -1, 331, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
igr1= 317, 316,
&end
#
# 330 PHE H 350 GLY H 6.00 (#peak 41276 )
&rst
ixpk= 41276, nxpk= 0, iat= 331, 660, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 394 VAL HB 395 THR H 4.37 (#peak 41278 )
&rst
ixpk= 41278, nxpk= 0, iat=1369,1381, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87, &end
#
# 313 ILE H 314 ASN H 6.00 (#peak 41279 )
&rst
ixpk= 41279, nxpk= 0, iat= 51, 70, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 387 ARG QD 394 VAL H 4.47 (#peak 41280 )
&rst
ixpk= 41280, nxpk= 0, iat= -1,1365, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
igr1=1270,1269,
&end
#
# 368 LYS H 369 HIE H 5.37 (#peak 41281 )
&rst
ixpk= 41281, nxpk= 0, iat= 928, 950, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87, &end
#
# 315 VAL H 316 LYS H 5.02 (#peak 41284 )
&rst
ixpk= 41284, nxpk= 0, iat= 84, 100, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52, &end
#
# 324 PHE H 414 ILE QG1 4.95 (#peak 41286 )
&rst
ixpk= 41286, nxpk= 0, iat= 242, -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
igr2=1710,1709,
&end
#
# 370 LYS QB 371 ALA H 5.32 (#peak 41288 )
&rst
ixpk= 41288, nxpk= 0, iat= -1, 989, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr1= 972, 971,
&end
#
# 371 ALA H 380 LEU QQD 4.95 (#peak 41289 )
&rst
ixpk= 41289, nxpk= 0, iat= 989, -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
igr2=1149,1150,1151,1153,1154,1155,
&end
#
# 322 THR QG2 416 SER H 5.27 (#peak 41292 )
&rst
ixpk= 41292, nxpk= 0, iat= -1,1734, r1= 1.30, r2= 1.80, r3= 6.33, r4= 6.83,
igr1= 212, 213, 214,
&end
#
# 378 LYS H 379 ILE H 5.97 (#peak 41293 )
&rst
ixpk= 41293, nxpk= 0, iat=1099,1121, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47, &end
#
# 322 THR H 416 SER H 4.52 (#peak 41294 )
&rst
ixpk= 41294, nxpk= 0, iat= 204,1734, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02, &end
#
# 364 ASN H 365 LEU H 4.98 (#peak 41295 )
&rst
ixpk= 41295, nxpk= 0, iat= 869, 883, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48, &end
#
# 329 LYS H 327 ASN QB 3.57 (#peak 41298 )
&rst
ixpk= 41298, nxpk= 0, iat= 309, -1, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,
igr2= 293, 292,
&end
#
# 372 VAL H 373 LEU H 4.30 (#peak 41299 )
&rst
ixpk= 41299, nxpk= 0, iat= 999,1015, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80, &end
#
# 372 VAL H 374 GLN QB 5.45 (#peak 41300 )
&rst
ixpk= 41300, nxpk= 0, iat= 999, -1, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,
igr2=1039,1038,
&end
#
# 371 ALA QB 372 VAL H 3.95 (#peak 41301 )
&rst
ixpk= 41301, nxpk= 0, iat= -1, 999, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr1= 993, 994, 995,
&end
#
# 385 LYS H 386 PHE HB2 6.00 (#peak 41302 )
&rst
ixpk= 41302, nxpk= 0, iat=1217,1244, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 384 TYR QD 385 LYS H 4.63 (#peak 41303 )
&rst
ixpk= 41303, nxpk= 0, iat= -1,1217, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
igr1=1204,1211,
&end
#
# 404 THR QG2 410 GLU H 5.22 (#peak 41305 )
&rst
ixpk= 41305, nxpk= 0, iat= -1,1629, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
igr1=1547,1548,1549,
&end
#
# 401 PHE QB 402 SER H 4.20 (#peak 41307 )
&rst
ixpk= 41307, nxpk= 0, iat= -1,1508, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
igr1=1493,1492,
&end
#
# 407 ASP H 408 THR H 3.22 (#peak 41308 )
&rst
ixpk= 41308, nxpk= 0, iat=1581,1593, r1= 1.30, r2= 1.80, r3= 3.22, r4= 3.72, &end
#
# 406 PRO QG 407 ASP H 4.06 (#peak 41309 )
&rst
ixpk= 41309, nxpk= 0, iat= -1,1581, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
igr1=1577,1576,
&end
#
# 407 ASP H 408 THR QG2 4.84 (#peak 41310 )
&rst
ixpk= 41310, nxpk= 0, iat=1581, -1, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
igr2=1601,1602,1603,
&end
#
# 369 HIE QB 370 LYS H 3.95 (#peak 41311 )
&rst
ixpk= 41311, nxpk= 0, iat= -1, 967, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
igr1= 955, 954,
&end
#
# 336 ARG H 337 ALA H 4.74 (#peak 41312 )
&rst
ixpk= 41312, nxpk= 0, iat= 433, 457, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24, &end
#
# 337 ALA H 338 THR H 4.29 (#peak 41313 )
&rst
ixpk= 41313, nxpk= 0, iat= 457, 467, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79, &end
#
# 335 GLN HA 337 ALA H 4.40 (#peak 41314 )
&rst
ixpk= 41314, nxpk= 0, iat= 418, 457, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 333 VAL QQG 337 ALA H 5.04 (#peak 41315 )
&rst
ixpk= 41315, nxpk= 0, iat= -1, 457, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 394, 395, 396, 398, 399, 400,
&end
#
# 357 PHE H 358 HIE H 5.97 (#peak 41316 )
&rst
ixpk= 41316, nxpk= 0, iat= 760, 780, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47, &end
#
# 357 PHE H 358 HIE HA 5.22 (#peak 41320 )
&rst
ixpk= 41320, nxpk= 0, iat= 760, 782, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72, &end
#
# 392 SER H 393 PHE QB 5.52 (#peak 41322 )
&rst
ixpk= 41322, nxpk= 0, iat=1334, -1, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
igr2=1350,1349,
&end
#
# 388 ALA QB 392 SER H 4.86 (#peak 41323 )
&rst
ixpk= 41323, nxpk= 0, iat= -1,1334, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
igr1=1287,1288,1289,
&end
#
# 383 SER H 384 TYR H 5.89 (#peak 41325 )
&rst
ixpk= 41325, nxpk= 0, iat=1185,1196, r1= 1.30, r2= 1.80, r3= 5.89, r4= 6.39, &end
#
# 325 ALA H 326 VAL H 5.68 (#peak 41327 )
&rst
ixpk= 41327, nxpk= 0, iat= 262, 272, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18, &end
#
# 326 VAL H 327 ASN H 4.56 (#peak 41328 )
&rst
ixpk= 41328, nxpk= 0, iat= 272, 288, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06, &end
#
# 325 ALA QB 326 VAL H 4.06 (#peak 41329 )
&rst
ixpk= 41329, nxpk= 0, iat= -1, 272, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
igr1= 266, 267, 268,
&end
#
# 344 LEU H 347 GLU H 6.00 (#peak 41330 )
&rst
ixpk= 41330, nxpk= 0, iat= 557, 607, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 346 GLN H 347 GLU H 5.20 (#peak 41331 )
&rst
ixpk= 41331, nxpk= 0, iat= 590, 607, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70, &end
#
# 355 GLU H 357 PHE H 4.30 (#peak 41333 )
&rst
ixpk= 41333, nxpk= 0, iat= 724, 760, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80, &end
#
# 329 LYS HA 354 TYR H 5.52 (#peak 41338 )
&rst
ixpk= 41338, nxpk= 0, iat= 311, 703, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02, &end
#
# 366 THR H 367 ASP H 4.52 (#peak 41339 )
&rst
ixpk= 41339, nxpk= 0, iat= 902, 916, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02, &end
#
# 338 THR H 339 ALA QB 5.63 (#peak 41342 )
&rst
ixpk= 41342, nxpk= 0, iat= 467, -1, r1= 1.30, r2= 1.80, r3= 6.76, r4= 7.26,
igr2= 485, 486, 487,
&end
#
# 333 VAL QQG 338 THR H 5.70 (#peak 41343 )
&rst
ixpk= 41343, nxpk= 0, iat= -1, 467, r1= 1.30, r2= 1.80, r3= 7.68, r4= 8.18,
igr1= 394, 395, 396, 398, 399, 400,
&end
#
# 400 TRP HB3 401 PHE H 5.23 (#peak 41344 )
&rst
ixpk= 41344, nxpk= 0, iat=1468,1488, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73, &end
#
# 401 PHE H 415 VAL QQG 4.70 (#peak 41345 )
&rst
ixpk= 41345, nxpk= 0, iat=1488, -1, r1= 1.30, r2= 1.80, r3= 6.34, r4= 6.84,
igr2=1724,1725,1726,1728,1729,1730,
&end
#
# 401 PHE H 414 ILE QG2 4.48 (#peak 41346 )
&rst
ixpk= 41346, nxpk= 0, iat=1488, -1, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
igr2=1705,1706,1707,
&end
#
# 401 PHE H 414 ILE HA 6.00 (#peak 41347 )
&rst
ixpk= 41347, nxpk= 0, iat=1488,1701, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 356 TYR H 357 PHE H 3.63 (#peak 41348 )
&rst
ixpk= 41348, nxpk= 0, iat= 739, 760, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13, &end
#
# 353 CYS HA 356 TYR H 5.31 (#peak 41349 )
&rst
ixpk= 41349, nxpk= 0, iat= 694, 739, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81, &end
#
# 354 TYR HA 356 TYR H 5.64 (#peak 41350 )
&rst
ixpk= 41350, nxpk= 0, iat= 705, 739, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14, &end
#
# 355 GLU H 356 TYR H 4.41 (#peak 41351 )
&rst
ixpk= 41351, nxpk= 0, iat= 724, 739, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, &end
#
# 392 SER QB 393 PHE H 3.76 (#peak 41353 )
&rst
ixpk= 41353, nxpk= 0, iat= -1,1345, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
igr1=1339,1338,
&end
#
# 342 GLY H 343 TYR H 4.77 (#peak 41356 )
&rst
ixpk= 41356, nxpk= 0, iat= 529, 536, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27, &end
#
# 321 ILE HB 322 THR H 6.00 (#peak 41358 )
&rst
ixpk= 41358, nxpk= 0, iat= 189, 204, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 343 TYR H 345 PRO QD 5.03 (#peak 41359 )
&rst
ixpk= 41359, nxpk= 0, iat= 536, -1, r1= 1.30, r2= 1.80, r3= 5.65, r4= 6.15,
igr2= 578, 577,
&end
#
# 352 SER H 355 GLU QG 5.99 (#peak 41361 )
&rst
ixpk= 41361, nxpk= 0, iat= 681, -1, r1= 1.30, r2= 1.80, r3= 6.72, r4= 7.22,
igr2= 732, 731,
&end
#
# 352 SER H 355 GLU QB 6.00 (#peak 41362 )
&rst
ixpk= 41362, nxpk= 0, iat= 681, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2= 729, 728,
&end
#
# 351 THR QG2 352 SER H 4.68 (#peak 41363 )
&rst
ixpk= 41363, nxpk= 0, iat= -1, 681, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
igr1= 675, 676, 677,
&end
#
# 346 GLN QG 348 LEU H 4.66 (#peak 41364 )
&rst
ixpk= 41364, nxpk= 0, iat= -1, 622, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73,
igr1= 598, 597,
&end
#
# 324 PHE HA 331 VAL H 4.49 (#peak 41365 )
&rst
ixpk= 41365, nxpk= 0, iat= 244, 351, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99, &end
#
# 331 VAL H 332 TYR H 4.42 (#peak 41366 )
&rst
ixpk= 41366, nxpk= 0, iat= 351, 367, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92, &end
#
# 397 LYS H 398 SER HA 6.00 (#peak 41367 )
&rst
ixpk= 41367, nxpk= 0, iat=1414,1438, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 373 LEU QQD 374 GLN H 5.08 (#peak 41370 )
&rst
ixpk= 41370, nxpk= 0, iat= -1,1034, r1= 1.30, r2= 1.80, r3= 6.85, r4= 7.35,
igr1=1024,1025,1026,1028,1029,1030,
&end
#
# 380 LEU QB 381 THR H 4.37 (#peak 41373 )
&rst
ixpk= 41373, nxpk= 0, iat= -1,1159, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
igr1=1145,1144,
&end
#
# 341 LEU H 342 GLY H 4.24 (#peak 41374 )
&rst
ixpk= 41374, nxpk= 0, iat= 510, 529, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74, &end
#
# 340 ILE H 341 LEU H 4.33 (#peak 41375 )
&rst
ixpk= 41375, nxpk= 0, iat= 491, 510, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83, &end
#
# 340 ILE HB 341 LEU H 3.82 (#peak 41377 )
&rst
ixpk= 41377, nxpk= 0, iat= 495, 510, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32, &end
#
# 327 ASN H 328 GLY H 4.22 (#peak 41378 )
&rst
ixpk= 41378, nxpk= 0, iat= 288, 302, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 326 VAL HB 327 ASN H 4.97 (#peak 41380 )
&rst
ixpk= 41380, nxpk= 0, iat= 276, 288, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 325 ALA QB 327 ASN H 4.47 (#peak 41381 )
&rst
ixpk= 41381, nxpk= 0, iat= -1, 288, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr1= 266, 267, 268,
&end
#
# 326 VAL QQG 327 ASN H 4.30 (#peak 41382 )
&rst
ixpk= 41382, nxpk= 0, iat= -1, 288, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
igr1= 278, 279, 280, 282, 283, 284,
&end
#
# 341 LEU H 343 TYR H 6.00 (#peak 41383 )
&rst
ixpk= 41383, nxpk= 0, iat= 510, 536, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 320 PHE H 417 VAL HA 5.75 (#peak 41384 )
&rst
ixpk= 41384, nxpk= 0, iat= 165,1747, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25, &end
#
# 375 SER H 374 GLN HB3 4.43 (#peak 41385 )
&rst
ixpk= 41385, nxpk= 0, iat=1051,1038, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93, &end
#
# 343 TYR HA 346 GLN H 6.00 (#peak 41387 )
&rst
ixpk= 41387, nxpk= 0, iat= 538, 590, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 344 LEU QB 346 GLN H 5.81 (#peak 41388 )
&rst
ixpk= 41388, nxpk= 0, iat= -1, 590, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
igr1= 562, 561,
&end
#
# 330 PHE QB 351 THR H 4.88 (#peak 41390 )
&rst
ixpk= 41390, nxpk= 0, iat= -1, 667, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
igr1= 336, 335,
&end
#
# 330 PHE H 351 THR H 5.01 (#peak 41392 )
&rst
ixpk= 41392, nxpk= 0, iat= 331, 667, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51, &end
#
# 350 GLY H 351 THR H 4.50 (#peak 41393 )
&rst
ixpk= 41393, nxpk= 0, iat= 660, 667, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 413 TYR H 414 ILE H 5.96 (#peak 41394 )
&rst
ixpk= 41394, nxpk= 0, iat=1678,1699, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46, &end
#
# 412 GLU H 413 TYR H 3.98 (#peak 41395 )
&rst
ixpk= 41395, nxpk= 0, iat=1663,1678, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48, &end
#
# 413 TYR H 414 ILE QG1 4.82 (#peak 41396 )
&rst
ixpk= 41396, nxpk= 0, iat=1678, -1, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,
igr2=1710,1709,
&end
#
# 411 LEU QQD 413 TYR H 4.30 (#peak 41397 )
&rst
ixpk= 41397, nxpk= 0, iat= -1,1678, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
igr1=1653,1654,1655,1657,1658,1659,
&end
#
# 318 THR H 319 GLU H 4.02 (#peak 41398 )
&rst
ixpk= 41398, nxpk= 0, iat= 136, 150, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52, &end
#
# 318 THR H 420 LEU QQD 5.92 (#peak 41399 )
&rst
ixpk= 41399, nxpk= 0, iat= 136, -1, r1= 1.30, r2= 1.80, r3= 7.98, r4= 8.48,
igr2=1798,1799,1800,1802,1803,1804,
&end
#
# 318 THR H 340 ILE QD1 6.00 (#peak 41400 )
&rst
ixpk= 41400, nxpk= 0, iat= 136, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr2= 504, 505, 506,
&end
#
# 388 ALA QB 391 GLY H 5.12 (#peak 41403 )
&rst
ixpk= 41403, nxpk= 0, iat= -1,1327, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
igr1=1287,1288,1289,
&end
#
# 407 ASP QB 408 THR H 4.00 (#peak 41404 )
&rst
ixpk= 41404, nxpk= 0, iat= -1,1593, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
igr1=1586,1585,
&end
#
# 328 GLY H 329 LYS H 4.00 (#peak 41405 )
&rst
ixpk= 41405, nxpk= 0, iat= 302, 309, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 325 ALA QB 328 GLY H 5.18 (#peak 41406 )
&rst
ixpk= 41406, nxpk= 0, iat= -1, 302, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
igr1= 266, 267, 268,
&end
#
# 330 PHE QB 350 GLY H 4.72 (#peak 41407 )
&rst
ixpk= 41407, nxpk= 0, iat= -1, 660, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr1= 336, 335,
&end
#
# 349 LEU H 350 GLY H 6.00 (#peak 41410 )
&rst
ixpk= 41410, nxpk= 0, iat= 641, 660, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 342 GLY H 388 ALA QB 4.68 (#peak 41413 )
&rst
ixpk= 41413, nxpk= 0, iat= 529, -1, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
igr2=1287,1288,1289,
&end
#
# 349 LEU H 351 THR QG2 3.96 (#peak 41414 )
&rst
ixpk= 41414, nxpk= 0, iat= 641, -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
igr2= 675, 676, 677,
&end
#
# 395 THR HB 396 LEU H 5.01 (#peak 41415 )
&rst
ixpk= 41415, nxpk= 0, iat=1385,1395, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51, &end
#
# 383 SER QB 396 LEU H 5.81 (#peak 41416 )
&rst
ixpk= 41416, nxpk= 0, iat= -1,1395, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
igr1=1190,1189,
&end
#
# 386 PHE H 396 LEU H 6.00 (#peak 41417 )
&rst
ixpk= 41417, nxpk= 0, iat=1239,1395, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 314 ASN HA 316 LYS H 4.60 (#peak 41421 )
&rst
ixpk= 41421, nxpk= 0, iat= 72, 100, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 353 CYS H 355 GLU H 5.55 (#peak 41422 )
&rst
ixpk= 41422, nxpk= 0, iat= 692, 724, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05, &end
#
# 405 ASN H 404 THR QG2 3.44 (#peak 41423 )
&rst
ixpk= 41423, nxpk= 0, iat=1553, -1, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
igr2=1547,1548,1549,
&end
#
# 404 THR H 409 LYS QD 6.00 (#peak 41424 )
&rst
ixpk= 41424, nxpk= 0, iat=1539, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=1618,1617,
&end
#
# 384 TYR H 397 LYS H 6.00 (#peak 41425 )
&rst
ixpk= 41425, nxpk= 0, iat=1196,1414, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 394 VAL H 395 THR HA 5.05 (#peak 41426 )
&rst
ixpk= 41426, nxpk= 0, iat=1365,1383, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55, &end
#
# 386 PHE HB2 394 VAL H 6.00 (#peak 41427 )
&rst
ixpk= 41427, nxpk= 0, iat=1244,1365, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 385 LYS QB 394 VAL H 6.00 (#peak 41428 )
&rst
ixpk= 41428, nxpk= 0, iat= -1,1365, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1=1222,1221,
&end
#
# 324 PHE HA 330 PHE H 5.89 (#peak 41429 )
&rst
ixpk= 41429, nxpk= 0, iat= 244, 331, r1= 1.30, r2= 1.80, r3= 5.89, r4= 6.39, &end
#
# 335 GLN H 337 ALA H 6.00 (#peak 41430 )
&rst
ixpk= 41430, nxpk= 0, iat= 416, 457, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 386 PHE H 395 THR H 6.00 (#peak 41431 )
&rst
ixpk= 41431, nxpk= 0, iat=1239,1381, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 403 PHE H 414 ILE QG2 6.00 (#peak 41432 )
&rst
ixpk= 41432, nxpk= 0, iat=1519, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr2=1705,1706,1707,
&end
#
# 403 PHE H 411 LEU HG 6.00 (#peak 41433 )
&rst
ixpk= 41433, nxpk= 0, iat=1519,1651, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 369 HIE QB 371 ALA H 4.75 (#peak 41435 )
&rst
ixpk= 41435, nxpk= 0, iat= -1, 989, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
igr1= 955, 954,
&end
#
# 337 ALA HA 339 ALA H 6.00 (#peak 41436 )
&rst
ixpk= 41436, nxpk= 0, iat= 459, 481, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 339 ALA H 340 ILE QG2 4.45 (#peak 41437 )
&rst
ixpk= 41437, nxpk= 0, iat= 481, -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr2= 497, 498, 499,
&end
#
# 322 THR HA 332 TYR H 6.00 (#peak 41438 )
&rst
ixpk= 41438, nxpk= 0, iat= 206, 367, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 326 VAL H 414 ILE H 6.00 (#peak 41440 )
&rst
ixpk= 41440, nxpk= 0, iat= 272,1699, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 402 SER H 414 ILE QG2 6.00 (#peak 41442 )
&rst
ixpk= 41442, nxpk= 0, iat=1508, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr2=1705,1706,1707,
&end
#
# 414 ILE QG2 416 SER H 6.00 (#peak 41443 )
&rst
ixpk= 41443, nxpk= 0, iat= -1,1734, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr1=1705,1706,1707,
&end
#
# 361 ASP HA 364 ASN H 4.67 (#peak 41444 )
&rst
ixpk= 41444, nxpk= 0, iat= 828, 869, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, &end
#
# 364 ASN H 365 LEU HB3 4.64 (#peak 41445 )
&rst
ixpk= 41445, nxpk= 0, iat= 869, 887, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14, &end
#
# 361 ASP H 365 LEU H 5.71 (#peak 41447 )
&rst
ixpk= 41447, nxpk= 0, iat= 826, 883, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21, &end
#
# 376 LYS H 377 GLU H 4.75 (#peak 41449 )
&rst
ixpk= 41449, nxpk= 0, iat=1062,1084, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, &end
#
# 388 ALA H 392 SER H 6.00 (#peak 41451 )
&rst
ixpk= 41451, nxpk= 0, iat=1283,1334, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 354 TYR H 355 GLU QB 6.00 (#peak 41453 )
&rst
ixpk= 41453, nxpk= 0, iat= 703, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2= 729, 728,
&end
#
# 354 TYR H 355 GLU QG 6.00 (#peak 41454 )
&rst
ixpk= 41454, nxpk= 0, iat= 703, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2= 732, 731,
&end
#
# 321 ILE H 322 THR H 6.00 (#peak 41456 )
&rst
ixpk= 41456, nxpk= 0, iat= 185, 204, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 325 ALA H 331 VAL H 4.15 (#peak 41457 )
&rst
ixpk= 41457, nxpk= 0, iat= 262, 351, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65, &end
#
# 322 THR HB 323 ARG H 3.86 (#peak 41458 )
&rst
ixpk= 41458, nxpk= 0, iat= 208, 218, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 344 LEU H 346 GLN H 6.00 (#peak 41459 )
&rst
ixpk= 41459, nxpk= 0, iat= 557, 590, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 346 GLN H 348 LEU HB2 5.30 (#peak 41460 )
&rst
ixpk= 41460, nxpk= 0, iat= 590, 627, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80, &end
#
# 319 GLU H 320 PHE H 6.00 (#peak 41461 )
&rst
ixpk= 41461, nxpk= 0, iat= 150, 165, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 320 PHE H 321 ILE H 6.00 (#peak 41462 )
&rst
ixpk= 41462, nxpk= 0, iat= 165, 185, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 400 TRP H 401 PHE H 6.00 (#peak 41463 )
&rst
ixpk= 41463, nxpk= 0, iat=1464,1488, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 388 ALA H 390 ASP H 6.00 (#peak 41464 )
&rst
ixpk= 41464, nxpk= 0, iat=1283,1315, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 325 ALA H 327 ASN H 6.00 (#peak 41465 )
&rst
ixpk= 41465, nxpk= 0, iat= 262, 288, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 374 GLN H 375 SER H 3.06 (#peak 41466 )
&rst
ixpk= 41466, nxpk= 0, iat=1034,1051, r1= 1.30, r2= 1.80, r3= 3.06, r4= 3.56, &end
#
# 336 ARG H 338 THR H 6.00 (#peak 41467 )
&rst
ixpk= 41467, nxpk= 0, iat= 433, 467, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 356 TYR H 357 PHE HA 6.00 (#peak 41469 )
&rst
ixpk= 41469, nxpk= 0, iat= 739, 762, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 356 TYR H 357 PHE QB 6.00 (#peak 41470 )
&rst
ixpk= 41470, nxpk= 0, iat= 739, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2= 765, 764,
&end
#
# 346 GLN H 348 LEU H 6.00 (#peak 41471 )
&rst
ixpk= 41471, nxpk= 0, iat= 590, 622, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 339 ALA H 340 ILE H 3.64 (#peak 41472 )
&rst
ixpk= 41472, nxpk= 0, iat= 481, 491, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14, &end
#
# 318 THR H 319 GLU HA 6.00 (#peak 41474 )
&rst
ixpk= 41474, nxpk= 0, iat= 136, 152, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 388 ALA H 391 GLY H 6.00 (#peak 41475 )
&rst
ixpk= 41475, nxpk= 0, iat=1283,1327, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 341 LEU QQD 342 GLY H 4.84 (#peak 41476 )
&rst
ixpk= 41476, nxpk= 0, iat= -1, 529, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
igr1= 519, 520, 521, 523, 524, 525,
&end
#
# 408 THR H 409 LYS H 3.80 (#peak 41477 )
&rst
ixpk= 41477, nxpk= 0, iat=1593,1607, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30, &end
#
# 387 ARG H 388 ALA H 4.59 (#peak 41481 )
&rst
ixpk= 41481, nxpk= 0, iat=1259,1283, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 394 VAL H 395 THR H 4.62 (#peak 41482 )
&rst
ixpk= 41482, nxpk= 0, iat=1365,1381, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12, &end
#
# 419 THR H 420 LEU H 4.92 (#peak 41483 )
&rst
ixpk= 41483, nxpk= 0, iat=1775,1789, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42, &end
#
# 344 LEU HA 347 GLU H 5.98 (#peak 41484 )
&rst
ixpk= 41484, nxpk= 0, iat= 559, 607, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48, &end
#
# 348 LEU H 349 LEU H 3.65 (#peak 41485 )
&rst
ixpk= 41485, nxpk= 0, iat= 622, 641, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15, &end
#
# 389 LYS QB 390 ASP H 3.93 (#peak 41486 )
&rst
ixpk= 41486, nxpk= 0, iat= -1,1315, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
igr1=1298,1297,
&end
#
# 408 THR H 409 LYS QB 5.19 (#peak 41488 )
&rst
ixpk= 41488, nxpk= 0, iat=1593, -1, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33,
igr2=1612,1611,
&end
#
# 325 ALA H 330 PHE QB 5.81 (#peak 41489 )
&rst
ixpk= 41489, nxpk= 0, iat= 262, -1, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
igr2= 336, 335,
&end
#
# 321 ILE H 334 ASP HB2 4.09 (#peak 41490 )
&rst
ixpk= 41490, nxpk= 0, iat= 185, 409, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59, &end
#
# 344 LEU QB 347 GLU H 4.49 (#peak 41492 )
&rst
ixpk= 41492, nxpk= 0, iat= -1, 607, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr1= 562, 561,
&end
#
# 347 GLU QB 349 LEU H 5.60 (#peak 41493 )
&rst
ixpk= 41493, nxpk= 0, iat= -1, 641, r1= 1.30, r2= 1.80, r3= 6.29, r4= 6.79,
igr1= 612, 611,
&end
#
# 390 ASP QB 391 GLY H 6.00 (#peak 41494 )
&rst
ixpk= 41494, nxpk= 0, iat= -1,1327, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1=1320,1319,
&end
#
# 397 LYS H 418 ASN HA 4.73 (#peak 41495 )
&rst
ixpk= 41495, nxpk= 0, iat=1414,1763, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, &end
#
# 320 PHE H 418 ASN H 3.30 (#peak 41496 )
&rst
ixpk= 41496, nxpk= 0, iat= 165,1761, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80, &end
#
# 320 PHE H 321 ILE HA 4.94 (#peak 41497 )
&rst
ixpk= 41497, nxpk= 0, iat= 165, 187, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44, &end
#
# 323 ARG QG 415 VAL H 6.00 (#peak 41498 )
&rst
ixpk= 41498, nxpk= 0, iat= -1,1718, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1= 226, 225,
&end
#
# 324 PHE HA 414 ILE H 6.00 (#peak 41499 )
&rst
ixpk= 41499, nxpk= 0, iat= 244,1699, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 330 PHE H 350 GLY H 6.00 (#peak 41500 )
&rst
ixpk= 41500, nxpk= 0, iat= 331, 660, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 405 ASN QD2 406 PRO QD 4.08 (#peak 41501 )
&rst
ixpk= 41501, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
igr1=1563,1562,
igr2=1569,1568,
&end
#
# 401 PHE H 402 SER H 5.47 (#peak 41503 )
&rst
ixpk= 41503, nxpk= 0, iat=1488,1508, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97, &end
#
# 397 LYS H 420 LEU HA 5.24 (#peak 41505 )
&rst
ixpk= 41505, nxpk= 0, iat=1414,1791, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74, &end
#
# 369 HIE HA 371 ALA H 5.45 (#peak 41506 )
&rst
ixpk= 41506, nxpk= 0, iat= 952, 989, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95, &end
#
# 340 ILE QG1 342 GLY H 4.52 (#peak 41507 )
&rst
ixpk= 41507, nxpk= 0, iat= -1, 529, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
igr1= 502, 501,
&end
#
# 325 ALA H 330 PHE HA 4.66 (#peak 41508 )
&rst
ixpk= 41508, nxpk= 0, iat= 262, 333, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16, &end
#
# 404 THR H 413 TYR H 5.65 (#peak 41510 )
&rst
ixpk= 41510, nxpk= 0, iat=1539,1678, r1= 1.30, r2= 1.80, r3= 5.65, r4= 6.15, &end
#
# 373 LEU HA 375 SER H 6.00 (#peak 41513 )
&rst
ixpk= 41513, nxpk= 0, iat=1017,1051, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 362 HIE HE2 363 ASN HA 6.00 (#peak 41516 )
&rst
ixpk= 41516, nxpk= 0, iat= 851, 857, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 362 HIE HA 363 ASN H 3.70 (#peak 60001 )
&rst
ixpk= 60001, nxpk= 0, iat= 840, 855, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20, &end
#
# 362 HIE HA 364 ASN H 4.60 (#peak 60002 )
&rst
ixpk= 60002, nxpk= 0, iat= 840, 869, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 362 HIE HA 365 LEU H 3.60 (#peak 60003 )
&rst
ixpk= 60003, nxpk= 0, iat= 840, 883, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10, &end
#
# 362 HIE HA 366 THR H 4.40 (#peak 60004 )
&rst
ixpk= 60004, nxpk= 0, iat= 840, 902, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 362 HIE H 363 ASN H 3.00 (#peak 60005 )
&rst
ixpk= 60005, nxpk= 0, iat= 838, 855, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 362 HIE H 364 ASN H 4.40 (#peak 60006 )
&rst
ixpk= 60006, nxpk= 0, iat= 838, 869, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 363 ASN HA 364 ASN H 3.70 (#peak 60007 )
&rst
ixpk= 60007, nxpk= 0, iat= 857, 869, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20, &end
#
# 363 ASN HA 365 LEU H 4.60 (#peak 60008 )
&rst
ixpk= 60008, nxpk= 0, iat= 857, 883, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 363 ASN HA 366 THR H 3.60 (#peak 60009 )
&rst
ixpk= 60009, nxpk= 0, iat= 857, 902, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10, &end
#
# 363 ASN HA 367 ASP H 4.40 (#peak 60010 )
&rst
ixpk= 60010, nxpk= 0, iat= 857, 916, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 363 ASN H 364 ASN H 3.00 (#peak 60011 )
&rst
ixpk= 60011, nxpk= 0, iat= 855, 869, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 363 ASN H 365 LEU H 4.40 (#peak 60012 )
&rst
ixpk= 60012, nxpk= 0, iat= 855, 883, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 364 ASN HA 365 LEU H 3.70 (#peak 60013 )
&rst
ixpk= 60013, nxpk= 0, iat= 871, 883, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20, &end
#
# 364 ASN HA 366 THR H 4.60 (#peak 60014 )
&rst
ixpk= 60014, nxpk= 0, iat= 871, 902, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 364 ASN HA 367 ASP H 3.60 (#peak 60015 )
&rst
ixpk= 60015, nxpk= 0, iat= 871, 916, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10, &end
#
# 364 ASN HA 368 LYS H 4.40 (#peak 60016 )
&rst
ixpk= 60016, nxpk= 0, iat= 871, 928, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 364 ASN H 365 LEU H 3.00 (#peak 60017 )
&rst
ixpk= 60017, nxpk= 0, iat= 869, 883, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 364 ASN H 366 THR H 4.40 (#peak 60018 )
&rst
ixpk= 60018, nxpk= 0, iat= 869, 902, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 365 LEU HA 366 THR H 3.70 (#peak 60019 )
&rst
ixpk= 60019, nxpk= 0, iat= 885, 902, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20, &end
#
# 365 LEU HA 367 ASP H 4.60 (#peak 60020 )
&rst
ixpk= 60020, nxpk= 0, iat= 885, 916, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 365 LEU HA 368 LYS H 3.60 (#peak 60021 )
&rst
ixpk= 60021, nxpk= 0, iat= 885, 928, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10, &end
#
# 365 LEU HA 369 HIE H 4.40 (#peak 60022 )
&rst
ixpk= 60022, nxpk= 0, iat= 885, 950, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 365 LEU H 366 THR H 3.00 (#peak 60023 )
&rst
ixpk= 60023, nxpk= 0, iat= 883, 902, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 365 LEU H 367 ASP H 4.40 (#peak 60024 )
&rst
ixpk= 60024, nxpk= 0, iat= 883, 916, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 366 THR HA 367 ASP H 3.70 (#peak 60025 )
&rst
ixpk= 60025, nxpk= 0, iat= 904, 916, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20, &end
#
# 366 THR HA 368 LYS H 4.60 (#peak 60026 )
&rst
ixpk= 60026, nxpk= 0, iat= 904, 928, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 366 THR HA 369 HIE H 3.60 (#peak 60027 )
&rst
ixpk= 60027, nxpk= 0, iat= 904, 950, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10, &end
#
# 366 THR HA 370 LYS H 4.40 (#peak 60028 )
&rst
ixpk= 60028, nxpk= 0, iat= 904, 967, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 366 THR H 367 ASP H 3.00 (#peak 60029 )
&rst
ixpk= 60029, nxpk= 0, iat= 902, 916, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 366 THR H 368 LYS H 4.40 (#peak 60030 )
&rst
ixpk= 60030, nxpk= 0, iat= 902, 928, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 367 ASP HA 368 LYS H 3.70 (#peak 60031 )
&rst
ixpk= 60031, nxpk= 0, iat= 918, 928, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20, &end
#
# 367 ASP HA 369 HIE H 4.60 (#peak 60032 )
&rst
ixpk= 60032, nxpk= 0, iat= 918, 950, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 367 ASP HA 370 LYS H 3.60 (#peak 60033 )
&rst
ixpk= 60033, nxpk= 0, iat= 918, 967, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10, &end
#
# 367 ASP HA 371 ALA H 4.40 (#peak 60034 )
&rst
ixpk= 60034, nxpk= 0, iat= 918, 989, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 367 ASP H 368 LYS H 3.00 (#peak 60035 )
&rst
ixpk= 60035, nxpk= 0, iat= 916, 928, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 367 ASP H 369 HIE H 4.40 (#peak 60036 )
&rst
ixpk= 60036, nxpk= 0, iat= 916, 950, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 368 LYS HA 369 HIE H 3.70 (#peak 60037 )
&rst
ixpk= 60037, nxpk= 0, iat= 930, 950, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20, &end
#
# 368 LYS HA 370 LYS H 4.60 (#peak 60038 )
&rst
ixpk= 60038, nxpk= 0, iat= 930, 967, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 368 LYS HA 371 ALA H 3.60 (#peak 60039 )
&rst
ixpk= 60039, nxpk= 0, iat= 930, 989, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10, &end
#
# 368 LYS HA 372 VAL H 4.40 (#peak 60040 )
&rst
ixpk= 60040, nxpk= 0, iat= 930, 999, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 368 LYS H 369 HIE H 3.00 (#peak 60041 )
&rst
ixpk= 60041, nxpk= 0, iat= 928, 950, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 368 LYS H 370 LYS H 4.40 (#peak 60042 )
&rst
ixpk= 60042, nxpk= 0, iat= 928, 967, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 369 HIE HA 370 LYS H 3.70 (#peak 60043 )
&rst
ixpk= 60043, nxpk= 0, iat= 952, 967, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20, &end
#
# 369 HIE HA 371 ALA H 4.60 (#peak 60044 )
&rst
ixpk= 60044, nxpk= 0, iat= 952, 989, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 369 HIE HA 372 VAL H 3.60 (#peak 60045 )
&rst
ixpk= 60045, nxpk= 0, iat= 952, 999, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10, &end
#
# 369 HIE HA 373 LEU H 4.40 (#peak 60046 )
&rst
ixpk= 60046, nxpk= 0, iat= 952,1015, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 369 HIE H 370 LYS H 3.00 (#peak 60047 )
&rst
ixpk= 60047, nxpk= 0, iat= 950, 967, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 369 HIE H 371 ALA H 4.40 (#peak 60048 )
&rst
ixpk= 60048, nxpk= 0, iat= 950, 989, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 370 LYS HA 371 ALA H 3.70 (#peak 60049 )
&rst
ixpk= 60049, nxpk= 0, iat= 969, 989, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20, &end
#
# 370 LYS HA 372 VAL H 4.60 (#peak 60050 )
&rst
ixpk= 60050, nxpk= 0, iat= 969, 999, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 370 LYS HA 373 LEU H 3.60 (#peak 60051 )
&rst
ixpk= 60051, nxpk= 0, iat= 969,1015, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10, &end
#
# 370 LYS HA 374 GLN H 4.40 (#peak 60052 )
&rst
ixpk= 60052, nxpk= 0, iat= 969,1034, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 370 LYS H 371 ALA H 3.00 (#peak 60053 )
&rst
ixpk= 60053, nxpk= 0, iat= 967, 989, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 370 LYS H 372 VAL H 4.40 (#peak 60054 )
&rst
ixpk= 60054, nxpk= 0, iat= 967, 999, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 371 ALA HA 372 VAL H 3.70 (#peak 60055 )
&rst
ixpk= 60055, nxpk= 0, iat= 991, 999, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20, &end
#
# 371 ALA HA 373 LEU H 4.60 (#peak 60056 )
&rst
ixpk= 60056, nxpk= 0, iat= 991,1015, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 371 ALA HA 374 GLN H 3.60 (#peak 60057 )
&rst
ixpk= 60057, nxpk= 0, iat= 991,1034, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10, &end
#
# 371 ALA H 372 VAL H 3.00 (#peak 60058 )
&rst
ixpk= 60058, nxpk= 0, iat= 989, 999, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 371 ALA H 373 LEU H 4.40 (#peak 60059 )
&rst
ixpk= 60059, nxpk= 0, iat= 989,1015, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 372 VAL HA 373 LEU H 3.70 (#peak 60060 )
&rst
ixpk= 60060, nxpk= 0, iat=1001,1015, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20, &end
#
# 372 VAL HA 374 GLN H 4.60 (#peak 60061 )
&rst
ixpk= 60061, nxpk= 0, iat=1001,1034, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 372 VAL H 373 LEU H 3.00 (#peak 60062 )
&rst
ixpk= 60062, nxpk= 0, iat= 999,1015, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 372 VAL H 374 GLN H 4.40 (#peak 60063 )
&rst
ixpk= 60063, nxpk= 0, iat= 999,1034, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 373 LEU HA 374 GLN H 3.70 (#peak 60064 )
&rst
ixpk= 60064, nxpk= 0, iat=1017,1034, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20, &end
#
# 373 LEU H 374 GLN H 3.00 (#peak 60065 )
&rst
ixpk= 60065, nxpk= 0, iat=1015,1034, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 325 ALA H 324 PHE HA 2.50 (#peak 70001 )
&rst
ixpk= 70001, nxpk= 0, iat= 262, 244, r1= 1.30, r2= 1.80, r3= 2.50, r4= 3.00, &end
#
# 332 TYR H 331 VAL HA 3.50 (#peak 70004 )
&rst
ixpk= 70004, nxpk= 0, iat= 367, 353, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 332 TYR H 324 PHE HA 3.50 (#peak 70005 )
&rst
ixpk= 70005, nxpk= 0, iat= 367, 244, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 332 TYR H 323 ARG H 3.80 (#peak 70006 )
&rst
ixpk= 70006, nxpk= 0, iat= 367, 218, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30, &end
#
# 323 ARG H 322 THR HA 2.50 (#peak 70007 )
&rst
ixpk= 70007, nxpk= 0, iat= 218, 206, r1= 1.30, r2= 1.80, r3= 2.50, r4= 3.00, &end
#
# 323 ARG H 333 VAL HA 3.50 (#peak 70008 )
&rst
ixpk= 70008, nxpk= 0, iat= 218, 390, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 333 VAL HA 322 THR HA 2.60 (#peak 70009 )
&rst
ixpk= 70009, nxpk= 0, iat= 390, 206, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10, &end
#
# 334 ASP H 333 VAL HA 2.50 (#peak 70010 )
&rst
ixpk= 70010, nxpk= 0, iat= 404, 390, r1= 1.30, r2= 1.80, r3= 2.50, r4= 3.00, &end
#
# 334 ASP H 322 THR HA 3.50 (#peak 70011 )
&rst
ixpk= 70011, nxpk= 0, iat= 404, 206, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 320 PHE H 319 GLU HA 2.50 (#peak 70012 )
&rst
ixpk= 70012, nxpk= 0, iat= 165, 152, r1= 1.30, r2= 1.80, r3= 2.50, r4= 3.00, &end
#
# 320 PHE H 419 THR HA 3.50 (#peak 70013 )
&rst
ixpk= 70013, nxpk= 0, iat= 165,1777, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 320 PHE H 418 ASN H 3.80 (#peak 70014 )
&rst
ixpk= 70014, nxpk= 0, iat= 165,1761, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30, &end
#
# 418 ASN H 417 VAL HA 2.50 (#peak 70015 )
&rst
ixpk= 70015, nxpk= 0, iat=1761,1747, r1= 1.30, r2= 1.80, r3= 2.50, r4= 3.00, &end
#
# 418 ASN H 321 ILE HA 3.50 (#peak 70016 )
&rst
ixpk= 70016, nxpk= 0, iat=1761, 187, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 321 ILE HA 417 VAL HA 2.60 (#peak 70017 )
&rst
ixpk= 70017, nxpk= 0, iat= 187,1747, r1= 1.30, r2= 1.80, r3= 2.60, r4= 3.10, &end
#
# 322 THR H 321 ILE HA 2.50 (#peak 70018 )
&rst
ixpk= 70018, nxpk= 0, iat= 204, 187, r1= 1.30, r2= 1.80, r3= 2.50, r4= 3.00, &end
#
# 322 THR H 417 VAL HA 3.50 (#peak 70019 )
&rst
ixpk= 70019, nxpk= 0, iat= 204,1747, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 322 THR H 416 SER H 3.80 (#peak 70020 )
&rst
ixpk= 70020, nxpk= 0, iat= 204,1734, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30, &end
#
# 416 SER H 415 VAL HA 2.50 (#peak 70021 )
&rst
ixpk= 70021, nxpk= 0, iat=1734,1720, r1= 1.30, r2= 1.80, r3= 2.50, r4= 3.00, &end
#
# 416 SER H 323 ARG HA 3.40 (#peak 70022 )
&rst
ixpk= 70022, nxpk= 0, iat=1734, 220, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90, &end
#
# 323 ARG HA 415 VAL HA 2.50 (#peak 70023 )
&rst
ixpk= 70023, nxpk= 0, iat= 220,1720, r1= 1.30, r2= 1.80, r3= 2.50, r4= 3.00, &end
#
# 324 PHE H 323 ARG HA 2.40 (#peak 70024 )
&rst
ixpk= 70024, nxpk= 0, iat= 242, 220, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90, &end
#
# 324 PHE H 415 VAL HA 3.40 (#peak 70025 )
&rst
ixpk= 70025, nxpk= 0, iat= 242,1720, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90, &end
#
# 324 PHE H 414 ILE H 3.70 (#peak 70026 )
&rst
ixpk= 70026, nxpk= 0, iat= 242,1699, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20, &end
#
# 414 ILE H 413 TYR HA 2.40 (#peak 70027 )
&rst
ixpk= 70027, nxpk= 0, iat=1699,1680, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90, &end
#
# 414 ILE H 325 ALA HA 3.40 (#peak 70028 )
&rst
ixpk= 70028, nxpk= 0, iat=1699, 264, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90, &end
#
# 326 VAL H 325 ALA HA 2.40 (#peak 70029 )
&rst
ixpk= 70029, nxpk= 0, iat= 272, 264, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90, &end
#
# 397 LYS H 396 LEU HA 2.40 (#peak 70030 )
&rst
ixpk= 70030, nxpk= 0, iat=1414,1397, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90, &end
#
# 397 LYS H 419 THR H 3.70 (#peak 70031 )
&rst
ixpk= 70031, nxpk= 0, iat=1414,1775, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20, &end
#
# 419 THR H 418 ASN HA 2.40 (#peak 70032 )
&rst
ixpk= 70032, nxpk= 0, iat=1775,1763, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90, &end
#
# 419 THR H 398 SER HA 3.40 (#peak 70033 )
&rst
ixpk= 70033, nxpk= 0, iat=1775,1438, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90, &end
#
# 398 SER HA 418 ASN HA 3.50 (#peak 70034 )
&rst
ixpk= 70034, nxpk= 0, iat=1438,1763, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 399 GLN H 398 SER HA 2.40 (#peak 70035 )
&rst
ixpk= 70035, nxpk= 0, iat=1447,1438, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90, &end
#
# 399 GLN H 418 ASN HA 3.40 (#peak 70036 )
&rst
ixpk= 70036, nxpk= 0, iat=1447,1763, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90, &end
#
# 399 GLN H 417 VAL H 3.70 (#peak 70037 )
&rst
ixpk= 70037, nxpk= 0, iat=1447,1745, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20, &end
#
# 417 VAL H 416 SER HA 2.40 (#peak 70038 )
&rst
ixpk= 70038, nxpk= 0, iat=1745,1736, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90, &end
#
# 417 VAL H 400 TRP HA 3.40 (#peak 70039 )
&rst
ixpk= 70039, nxpk= 0, iat=1745,1466, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90, &end
#
# 400 TRP HA 416 SER HA 2.50 (#peak 70040 )
&rst
ixpk= 70040, nxpk= 0, iat=1466,1736, r1= 1.30, r2= 1.80, r3= 2.50, r4= 3.00, &end
#
# 401 PHE H 400 TRP HA 2.40 (#peak 70041 )
&rst
ixpk= 70041, nxpk= 0, iat=1488,1466, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90, &end
#
# 401 PHE H 416 SER HA 3.40 (#peak 70042 )
&rst
ixpk= 70042, nxpk= 0, iat=1488,1736, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90, &end
#
# 401 PHE H 415 VAL H 3.70 (#peak 70043 )
&rst
ixpk= 70043, nxpk= 0, iat=1488,1718, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20, &end
#
# 415 VAL H 414 ILE HA 2.40 (#peak 70044 )
&rst
ixpk= 70044, nxpk= 0, iat=1718,1701, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90, &end
#
# 415 VAL H 402 SER HA 3.40 (#peak 70045 )
&rst
ixpk= 70045, nxpk= 0, iat=1718,1510, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90, &end
#
# 402 SER HA 414 ILE HA 2.50 (#peak 70046 )
&rst
ixpk= 70046, nxpk= 0, iat=1510,1701, r1= 1.30, r2= 1.80, r3= 2.50, r4= 3.00, &end
#
# 403 PHE H 402 SER HA 2.40 (#peak 70047 )
&rst
ixpk= 70047, nxpk= 0, iat=1519,1510, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90, &end
#
# 403 PHE H 414 ILE HA 3.40 (#peak 70048 )
&rst
ixpk= 70048, nxpk= 0, iat=1519,1701, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90, &end
#
# 403 PHE H 413 TYR H 3.70 (#peak 70049 )
&rst
ixpk= 70049, nxpk= 0, iat=1519,1678, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20, &end
#
# 413 TYR H 412 GLU H 3.50 (#peak 70050 )
&rst
ixpk= 70050, nxpk= 0, iat=1678,1663, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 405 ASN H 404 THR HA 2.40 (#peak 70053 )
&rst
ixpk= 70053, nxpk= 0, iat=1553,1541, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90, &end
#
# 394 VAL H 393 PHE HA 2.40 (#peak 70055 )
&rst
ixpk= 70055, nxpk= 0, iat=1365,1347, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90, &end
#
# 394 VAL H 387 ARG HA 3.40 (#peak 70056 )
&rst
ixpk= 70056, nxpk= 0, iat=1365,1261, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90, &end
#
# 394 VAL H 386 PHE H 3.70 (#peak 70057 )
&rst
ixpk= 70057, nxpk= 0, iat=1365,1239, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20, &end
#
# 386 PHE H 385 LYS HA 2.40 (#peak 70058 )
&rst
ixpk= 70058, nxpk= 0, iat=1239,1219, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90, &end
#
# 386 PHE H 395 THR HA 3.40 (#peak 70059 )
&rst
ixpk= 70059, nxpk= 0, iat=1239,1383, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90, &end
#
# 395 THR HA 385 LYS HA 2.50 (#peak 70060 )
&rst
ixpk= 70060, nxpk= 0, iat=1383,1219, r1= 1.30, r2= 1.80, r3= 2.50, r4= 3.00, &end
#
# 396 LEU H 395 THR HA 2.40 (#peak 70061 )
&rst
ixpk= 70061, nxpk= 0, iat=1395,1383, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90, &end
#
# 396 LEU H 385 LYS HA 3.40 (#peak 70062 )
&rst
ixpk= 70062, nxpk= 0, iat=1395,1219, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90, &end
#
# 396 LEU H 384 TYR H 3.70 (#peak 70063 )
&rst
ixpk= 70063, nxpk= 0, iat=1395,1196, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20, &end
#
# 384 TYR H 383 SER HA 2.40 (#peak 70064 )
&rst
ixpk= 70064, nxpk= 0, iat=1196,1187, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90, &end
#
# 398 SER H 397 LYS HA 2.40 (#peak 70065 )
&rst
ixpk= 70065, nxpk= 0, iat=1436,1416, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90, &end
Contact the webmaster for help, if required. Sunday, April 28, 2024 3:30:46 PM GMT (wattos1)