NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
615965 |
5lvf   |
34041 | cing | 1-original | 2 | AMBER | distance | NOE | simple |
# Restraints file 2: Rtt103_CID_pThr4_AMBER_RST.txt
#
# 28 TRP HA 28 TRP HD1 3.47
&rst
ixpk= 0, nxpk= 0, iat= 408, 414, r1= 1.30, r2= 1.80, r3= 3.47, r4= 3.97,
rk2=50, rk3=50, ir6=1, ialtd=0,
/
#
# 28 TRP HB3 28 TRP HE3 4.15
&rst
ixpk= 0, nxpk= 0, iat= 411, 425, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65, /
#
# 8 PHE HE 9 THR HA 5.15
&rst
ixpk= 0, nxpk= 0, iat= -1, 127, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr1= 115, 119,
/
#
# 29 LEU QD1 79 PHE HE 3.53
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr1= 439, 440, 441, 443, 444, 445,
igr2=1307,1311,
/
#
# 29 LEU QD2 79 PHE HE 3.53
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr1= 439, 440, 441, 443, 444, 445,
igr2=1307,1311,
/
#
# 8 PHE HD 8 PHE HZ 3.82
&rst
ixpk= 0, nxpk= 0, iat= -1, 117, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,
igr1= 113, 121,
/
#
# 8 PHE HD 43 TRP HD1 4.72
&rst
ixpk= 0, nxpk= 0, iat= -1, 673, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr1= 113, 121,
/
#
# 8 PHE HD 28 TRP HH2 4.22
&rst
ixpk= 0, nxpk= 0, iat= -1, 421, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr1= 113, 121,
/
#
# 8 PHE HE 12 LEU HG 3.77
&rst
ixpk= 0, nxpk= 0, iat= -1, 182, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,
igr1= 115, 119,
/
#
# 8 PHE HE 43 TRP HA 4.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 667, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
igr1= 115, 119,
/
#
# 8 PHE HD 28 TRP HZ3 3.70
&rst
ixpk= 0, nxpk= 0, iat= -1, 423, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65,
igr1= 113, 121,
/
#
# 28 TRP HB2 28 TRP HE3 4.15
&rst
ixpk= 0, nxpk= 0, iat= 410, 425, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65, /
#
# 28 TRP HZ3 29 LEU HA 4.27
&rst
ixpk= 0, nxpk= 0, iat= 423, 432, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77, /
#
# 8 PHE HB2 28 TRP HH2 4.30
&rst
ixpk= 0, nxpk= 0, iat= 109, 421, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80, /
#
# 28 TRP HE3 29 LEU HB2 3.93
&rst
ixpk= 0, nxpk= 0, iat= 425, 434, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43, /
#
# 7 GLN HB2 28 TRP HZ2 3.95
&rst
ixpk= 0, nxpk= 0, iat= 92, 419, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45, /
#
# 28 TRP HD1 31 LEU QD1 5.46
&rst
ixpk= 0, nxpk= 0, iat= 414, -1, r1= 1.30, r2= 1.80, r3= 7.36, r4= 7.86,
igr2= 477, 478, 479, 481, 482, 483,
/
#
# 28 TRP HD1 31 LEU QD2 5.46
&rst
ixpk= 0, nxpk= 0, iat= 414, -1, r1= 1.30, r2= 1.80, r3= 7.36, r4= 7.86,
igr2= 477, 478, 479, 481, 482, 483,
/
#
# 33 TYR HA 33 TYR HD 3.84
&rst
ixpk= 0, nxpk= 0, iat= 506, -1, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,
igr2= 512, 521,
/
#
# 33 TYR HE 76 ILE QG2 4.25
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23,
igr1= 514, 519,
igr2=1248,1249,1250,
/
#
# 8 PHE HE 43 TRP HD1 4.01
&rst
ixpk= 0, nxpk= 0, iat= -1, 673, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
igr1= 115, 119,
/
#
# 43 TRP HE3 87 ALA HA 5.41
&rst
ixpk= 0, nxpk= 0, iat= 684,1424, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91, /
#
# 43 TRP HH2 90 VAL HB 4.03
&rst
ixpk= 0, nxpk= 0, iat= 680,1461, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53, /
#
# 43 TRP HE3 90 VAL HB 4.87
&rst
ixpk= 0, nxpk= 0, iat= 684,1461, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37, /
#
# 43 TRP HZ2 90 VAL QG1 4.44
&rst
ixpk= 0, nxpk= 0, iat= 678, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2=1463,1464,1465,1467,1468,1469,
/
#
# 8 PHE HE 46 TYR HD 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
igr1= 115, 119,
igr2= 734, 743,
/
#
# 46 TYR HA 46 TYR HD 3.45
&rst
ixpk= 0, nxpk= 0, iat= 728, -1, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,
igr2= 734, 743,
/
#
# 46 TYR HA 46 TYR HE 4.87
&rst
ixpk= 0, nxpk= 0, iat= 728, -1, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,
igr2= 736, 741,
/
#
# 46 TYR HD 49 ARG HB3 4.95
&rst
ixpk= 0, nxpk= 0, iat= -1, 788, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.26,
igr1= 734, 743,
/
#
# 9 THR QG2 46 TYR HD 4.34
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
igr1= 131, 132, 133,
igr2= 734, 743,
/
#
# 46 TYR HE 52 VAL QG1 4.37
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 736, 741,
igr2= 838, 839, 840, 842, 843, 844,
/
#
# 12 LEU HB3 46 TYR HD 4.93
&rst
ixpk= 0, nxpk= 0, iat= 180, -1, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03,
igr2= 734, 743,
/
#
# 12 LEU QD2 46 TYR HE 5.10
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.72, r4= 8.22,
igr1= 184, 185, 186, 188, 189, 190,
igr2= 736, 741,
/
#
# 12 LEU QD2 46 TYR HD 4.69
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.10, r4= 7.60,
igr1= 184, 185, 186, 188, 189, 190,
igr2= 734, 743,
/
#
# 98 PHE HD 98 PHE HZ 4.03
&rst
ixpk= 0, nxpk= 0, iat= -1,1600, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
igr1=1596,1604,
/
#
# 58 LEU HA 98 PHE HZ 3.77
&rst
ixpk= 0, nxpk= 0, iat= 948,1600, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27, /
#
# 58 LEU HB3 98 PHE HZ 4.78
&rst
ixpk= 0, nxpk= 0, iat= 951,1600, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, /
#
# 57 LYS HB2 98 PHE HZ 4.41
&rst
ixpk= 0, nxpk= 0, iat= 928,1600, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, /
#
# 58 LEU HB2 98 PHE HZ 4.57
&rst
ixpk= 0, nxpk= 0, iat= 950,1600, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07, /
#
# 94 ILE HB 98 PHE HZ 4.82
&rst
ixpk= 0, nxpk= 0, iat=1527,1600, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32, /
#
# 58 LEU QD1 98 PHE HZ 5.14
&rst
ixpk= 0, nxpk= 0, iat= -1,1600, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
igr1= 955, 956, 957, 959, 960, 961,
/
#
# 94 ILE QD1 98 PHE HZ 3.81
&rst
ixpk= 0, nxpk= 0, iat= -1,1600, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
igr1=1536,1537,1538,
/
#
# 66 HIS HA 66 HIS HD2 4.13
&rst
ixpk= 0, nxpk= 0, iat=1083,1094, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63, /
#
# 43 TRP HE3 83 PHE HE 4.05
&rst
ixpk= 0, nxpk= 0, iat= 684, -1, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,
igr2=1367,1371,
/
#
# 79 PHE HD 83 PHE HD 3.17
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,
igr1=1305,1313,
igr2=1365,1373,
/
#
# 79 PHE HD 83 PHE HE 3.31
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,
igr1=1305,1313,
igr2=1367,1371,
/
#
# 8 PHE HZ 83 PHE HZ 4.07
&rst
ixpk= 0, nxpk= 0, iat= 117,1369, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57, /
#
# 83 PHE HD 83 PHE HZ 3.88
&rst
ixpk= 0, nxpk= 0, iat= -1,1369, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,
igr1=1365,1373,
/
#
# 83 PHE HA 83 PHE HD 3.57
&rst
ixpk= 0, nxpk= 0, iat=1359, -1, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,
igr2=1365,1373,
/
#
# 43 TRP HB2 83 PHE HE 4.05
&rst
ixpk= 0, nxpk= 0, iat= 669, -1, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,
igr2=1367,1371,
/
#
# 40 ALA HA 83 PHE HZ 4.47
&rst
ixpk= 0, nxpk= 0, iat= 625,1369, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97, /
#
# 40 ALA HA 83 PHE HE 3.96
&rst
ixpk= 0, nxpk= 0, iat= 625, -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
igr2=1367,1371,
/
#
# 43 TRP HB3 83 PHE HE 4.22
&rst
ixpk= 0, nxpk= 0, iat= 670, -1, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr2=1367,1371,
/
#
# 79 PHE HB3 83 PHE HD 3.85
&rst
ixpk= 0, nxpk= 0, iat=1302, -1, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,
igr2=1365,1373,
/
#
# 64 MET HA 83 PHE HE 4.01
&rst
ixpk= 0, nxpk= 0, iat=1052, -1, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
igr2=1367,1371,
/
#
# 64 MET HA 83 PHE HZ 5.02
&rst
ixpk= 0, nxpk= 0, iat=1052,1369, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52, /
#
# 64 MET HG2 83 PHE HE 5.02
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.32, r4= 6.82,
igr1=1057,1058,
igr2=1367,1371,
/
#
# 83 PHE HD 86 VAL QG2 3.81
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
igr1=1365,1373,
igr2=1412,1413,1414,1416,1417,1418,
/
#
# 64 MET HG2 83 PHE HD 4.52
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
igr1=1057,1058,
igr2=1365,1373,
/
#
# 98 PHE HD 102 LEU HB2 4.35
&rst
ixpk= 0, nxpk= 0, iat= -1,1662, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
igr1=1596,1604,
/
#
# 98 PHE HD 103 LYS HA 3.86
&rst
ixpk= 0, nxpk= 0, iat= -1,1679, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,
igr1=1596,1604,
/
#
# 95 ASN HA 98 PHE HD 4.04
&rst
ixpk= 0, nxpk= 0, iat=1544, -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
igr2=1596,1604,
/
#
# 84 GLY HA3 119 PHE HD 3.63
&rst
ixpk= 0, nxpk= 0, iat=1380, -1, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,
igr2=1983,1991,
/
#
# 79 PHE HA 79 PHE HD 3.91
&rst
ixpk= 0, nxpk= 0, iat=1299, -1, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,
igr2=1305,1313,
/
#
# 119 PHE HA 119 PHE HD 3.53
&rst
ixpk= 0, nxpk= 0, iat=1977, -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
igr2=1983,1991,
/
#
# 22 ILE QD1 62 TYR HD 4.73
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.38, r4= 6.88,
igr1= 335, 336, 337,
igr2=1018,1027,
/
#
# 33 TYR HE 78 GLN HB3 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1285, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr1= 514, 519,
/
#
# 43 TRP HA 46 TYR HD 5.02
&rst
ixpk= 0, nxpk= 0, iat= 667, -1, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr2= 734, 743,
/
#
# 46 TYR HE 57 LYS HA 4.73
&rst
ixpk= 0, nxpk= 0, iat= -1, 926, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
igr1= 736, 741,
/
#
# 33 TYR HE 76 ILE QD1 4.17
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
igr1= 514, 519,
igr2=1255,1256,1257,
/
#
# 8 PHE HZ 43 TRP HB2 4.23
&rst
ixpk= 0, nxpk= 0, iat= 117, 669, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73, /
#
# 8 PHE HZ 43 TRP HA 4.65
&rst
ixpk= 0, nxpk= 0, iat= 117, 667, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15, /
#
# 8 PHE HZ 12 LEU HG 4.91
&rst
ixpk= 0, nxpk= 0, iat= 117, 182, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41, /
#
# 8 PHE HZ 12 LEU QD1 4.38
&rst
ixpk= 0, nxpk= 0, iat= 117, -1, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
igr2= 184, 185, 186, 188, 189, 190,
/
#
# 8 PHE HZ 83 PHE HE 4.80
&rst
ixpk= 0, nxpk= 0, iat= 117, -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr2=1367,1371,
/
#
# 8 PHE HE 83 PHE HE 4.58
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,
igr1= 115, 119,
igr2=1367,1371,
/
#
# 7 GLN HB3 28 TRP HZ2 3.95
&rst
ixpk= 0, nxpk= 0, iat= 93, 419, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45, /
#
# 43 TRP HE3 83 PHE HD 3.75
&rst
ixpk= 0, nxpk= 0, iat= 684, -1, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,
igr2=1365,1373,
/
#
# 8 PHE HE 29 LEU HB2 4.54
&rst
ixpk= 0, nxpk= 0, iat= -1, 434, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
igr1= 115, 119,
/
#
# 43 TRP HE1 64 MET H 3.65
&rst
ixpk= 0, nxpk= 0, iat= 675,1050, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15, /
#
# 63 LEU H 64 MET H 3.55
&rst
ixpk= 0, nxpk= 0, iat=1031,1050, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05, /
#
# 28 TRP HE1 32 GLN HNE2 3.91
&rst
ixpk= 0, nxpk= 0, iat= 416, 500, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, /
#
# 28 TRP HE1 29 LEU HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= 416, 432, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20, /
#
# 28 TRP H 28 TRP HB3 3.52
&rst
ixpk= 0, nxpk= 0, iat= 406, 411, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02, /
#
# 28 TRP H 28 TRP HB2 3.52
&rst
ixpk= 0, nxpk= 0, iat= 406, 410, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02, /
#
# 27 LYS HB2 28 TRP H 4.11
&rst
ixpk= 0, nxpk= 0, iat= 388, 406, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, /
#
# 28 TRP HE1 31 LEU HB2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 416, 472, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 63 LEU HG 64 MET H 3.61
&rst
ixpk= 0, nxpk= 0, iat=1038,1050, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11, /
#
# 64 MET H 64 MET HG3 3.34
&rst
ixpk= 0, nxpk= 0, iat=1050, -1, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,
igr2=1057,1058,
/
#
# 64 MET H 64 MET HB2 3.82
&rst
ixpk= 0, nxpk= 0, iat=1050, -1, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,
igr2=1054,1055,
/
#
# 64 MET H 64 MET HB3 3.59
&rst
ixpk= 0, nxpk= 0, iat=1050, -1, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,
igr2=1054,1055,
/
#
# 6 GLU H 8 PHE H 4.34
&rst
ixpk= 0, nxpk= 0, iat= 73, 105, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84, /
#
# 6 GLU H 7 GLN H 3.58
&rst
ixpk= 0, nxpk= 0, iat= 73, 88, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08, /
#
# 6 GLU H 7 GLN HA 4.57
&rst
ixpk= 0, nxpk= 0, iat= 73, 90, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07, /
#
# 6 GLU H 8 PHE HB3 5.00
&rst
ixpk= 0, nxpk= 0, iat= 73, 110, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, /
#
# 6 GLU H 9 THR QG2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 73, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2= 131, 132, 133,
/
#
# 6 GLU H 6 GLU HB3 3.69
&rst
ixpk= 0, nxpk= 0, iat= 73, 78, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19, /
#
# 8 PHE H 8 PHE HB3 3.26
&rst
ixpk= 0, nxpk= 0, iat= 105, 110, r1= 1.30, r2= 1.80, r3= 3.26, r4= 3.76, /
#
# 8 PHE H 8 PHE HB2 3.09
&rst
ixpk= 0, nxpk= 0, iat= 105, 109, r1= 1.30, r2= 1.80, r3= 3.09, r4= 3.59, /
#
# 8 PHE H 10 THR QG2 5.29
&rst
ixpk= 0, nxpk= 0, iat= 105, -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
igr2= 145, 146, 147,
/
#
# 8 PHE H 11 LYS HB2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 105, 157, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 7 GLN HG3 8 PHE H 4.08
&rst
ixpk= 0, nxpk= 0, iat= 96, 105, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58, /
#
# 7 GLN HG2 8 PHE H 4.08
&rst
ixpk= 0, nxpk= 0, iat= 95, 105, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58, /
#
# 3 PHE HA 8 PHE H 5.50
&rst
ixpk= 0, nxpk= 0, iat= 33, 105, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 8 PHE H 28 TRP HH2 3.70
&rst
ixpk= 0, nxpk= 0, iat= 105, 421, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20, /
#
# 8 PHE H 11 LYS H 4.99
&rst
ixpk= 0, nxpk= 0, iat= 105, 153, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49, /
#
# 7 GLN H 8 PHE H 3.47
&rst
ixpk= 0, nxpk= 0, iat= 88, 105, r1= 1.30, r2= 1.80, r3= 3.47, r4= 3.97, /
#
# 9 THR H 9 THR HB 3.29
&rst
ixpk= 0, nxpk= 0, iat= 125, 129, r1= 1.30, r2= 1.80, r3= 3.29, r4= 3.79, /
#
# 8 PHE HB3 9 THR H 3.23
&rst
ixpk= 0, nxpk= 0, iat= 110, 125, r1= 1.30, r2= 1.80, r3= 3.23, r4= 3.73, /
#
# 8 PHE H 9 THR H 3.26
&rst
ixpk= 0, nxpk= 0, iat= 105, 125, r1= 1.30, r2= 1.80, r3= 3.26, r4= 3.76, /
#
# 7 GLN H 9 THR H 4.61
&rst
ixpk= 0, nxpk= 0, iat= 88, 125, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, /
#
# 9 THR H 11 LYS H 4.38
&rst
ixpk= 0, nxpk= 0, iat= 125, 153, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88, /
#
# 8 PHE HD 9 THR H 3.97
&rst
ixpk= 0, nxpk= 0, iat= -1, 125, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
igr1= 113, 121,
/
#
# 9 THR H 28 TRP HH2 5.44
&rst
ixpk= 0, nxpk= 0, iat= 125, 421, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94, /
#
# 6 GLU HA 9 THR H 3.79
&rst
ixpk= 0, nxpk= 0, iat= 75, 125, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29, /
#
# 7 GLN HA 9 THR H 5.04
&rst
ixpk= 0, nxpk= 0, iat= 90, 125, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54, /
#
# 9 THR H 10 THR HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= 125, 141, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 6 GLU QG 9 THR H 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 125, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 80, 81,
/
#
# 9 THR H 11 LYS HB2 5.47
&rst
ixpk= 0, nxpk= 0, iat= 125, 157, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97, /
#
# 9 THR H 10 THR QG2 5.05
&rst
ixpk= 0, nxpk= 0, iat= 125, -1, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
igr2= 145, 146, 147,
/
#
# 9 THR H 12 LEU QD2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 125, -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr2= 184, 185, 186, 188, 189, 190,
/
#
# 9 THR H 10 THR H 3.43
&rst
ixpk= 0, nxpk= 0, iat= 125, 139, r1= 1.30, r2= 1.80, r3= 3.43, r4= 3.93, /
#
# 10 THR H 11 LYS H 3.16
&rst
ixpk= 0, nxpk= 0, iat= 139, 153, r1= 1.30, r2= 1.80, r3= 3.16, r4= 3.66, /
#
# 10 THR H 13 ASN HND2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 139, 204, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 8 PHE HA 10 THR H 5.01
&rst
ixpk= 0, nxpk= 0, iat= 107, 139, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51, /
#
# 9 THR HB 10 THR H 3.33
&rst
ixpk= 0, nxpk= 0, iat= 129, 139, r1= 1.30, r2= 1.80, r3= 3.33, r4= 3.83, /
#
# 7 GLN HA 10 THR H 4.08
&rst
ixpk= 0, nxpk= 0, iat= 90, 139, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58, /
#
# 10 THR H 11 LYS HA 5.46
&rst
ixpk= 0, nxpk= 0, iat= 139, 155, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96, /
#
# 10 THR H 10 THR HB 2.98
&rst
ixpk= 0, nxpk= 0, iat= 139, 143, r1= 1.30, r2= 1.80, r3= 2.98, r4= 3.48, /
#
# 10 THR H 10 THR QG2 3.01
&rst
ixpk= 0, nxpk= 0, iat= 139, -1, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11,
igr2= 145, 146, 147,
/
#
# 10 THR H 11 LYS HB2 5.44
&rst
ixpk= 0, nxpk= 0, iat= 139, 157, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94, /
#
# 6 GLU HB3 10 THR H 5.50
&rst
ixpk= 0, nxpk= 0, iat= 78, 139, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 6 GLU HB2 10 THR H 5.50
&rst
ixpk= 0, nxpk= 0, iat= 77, 139, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 6 GLU QG 10 THR H 3.95
&rst
ixpk= 0, nxpk= 0, iat= -1, 139, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
igr1= 80, 81,
/
#
# 10 THR H 13 ASN QB 5.36
&rst
ixpk= 0, nxpk= 0, iat= 139, -1, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,
igr2= 198, 199,
/
#
# 11 LYS H 12 LEU H 3.21
&rst
ixpk= 0, nxpk= 0, iat= 153, 175, r1= 1.30, r2= 1.80, r3= 3.21, r4= 3.71, /
#
# 11 LYS H 28 TRP HH2 5.27
&rst
ixpk= 0, nxpk= 0, iat= 153, 421, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77, /
#
# 8 PHE HA 11 LYS H 3.95
&rst
ixpk= 0, nxpk= 0, iat= 107, 153, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45, /
#
# 9 THR HB 11 LYS H 4.84
&rst
ixpk= 0, nxpk= 0, iat= 129, 153, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34, /
#
# 10 THR HB 11 LYS H 3.75
&rst
ixpk= 0, nxpk= 0, iat= 143, 153, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25, /
#
# 9 THR HA 11 LYS H 4.24
&rst
ixpk= 0, nxpk= 0, iat= 127, 153, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74, /
#
# 11 LYS H 11 LYS HB2 3.13
&rst
ixpk= 0, nxpk= 0, iat= 153, 157, r1= 1.30, r2= 1.80, r3= 3.13, r4= 3.63, /
#
# 11 LYS H 11 LYS HB3 3.84
&rst
ixpk= 0, nxpk= 0, iat= 153, 158, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34, /
#
# 11 LYS H 11 LYS HG2 3.71
&rst
ixpk= 0, nxpk= 0, iat= 153, 160, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21, /
#
# 10 THR QG2 11 LYS H 3.09
&rst
ixpk= 0, nxpk= 0, iat= -1, 153, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21,
igr1= 145, 146, 147,
/
#
# 11 LYS H 11 LYS HG3 3.71
&rst
ixpk= 0, nxpk= 0, iat= 153, 161, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21, /
#
# 11 LYS H 12 LEU QD1 5.30
&rst
ixpk= 0, nxpk= 0, iat= 153, -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
igr2= 184, 185, 186, 188, 189, 190,
/
#
# 11 LYS H 12 LEU QD2 5.30
&rst
ixpk= 0, nxpk= 0, iat= 153, -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
igr2= 184, 185, 186, 188, 189, 190,
/
#
# 39 VAL H 40 ALA H 3.16
&rst
ixpk= 0, nxpk= 0, iat= 607, 623, r1= 1.30, r2= 1.80, r3= 3.16, r4= 3.66, /
#
# 38 LYS H 40 ALA H 4.29
&rst
ixpk= 0, nxpk= 0, iat= 585, 623, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79, /
#
# 40 ALA H 83 PHE HE 4.94
&rst
ixpk= 0, nxpk= 0, iat= 623, -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
igr2=1367,1371,
/
#
# 37 PRO HA 40 ALA H 3.97
&rst
ixpk= 0, nxpk= 0, iat= 581, 623, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47, /
#
# 12 LEU H 15 LEU HG 4.02
&rst
ixpk= 0, nxpk= 0, iat= 175, 229, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52, /
#
# 39 VAL HB 40 ALA H 3.88
&rst
ixpk= 0, nxpk= 0, iat= 611, 623, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38, /
#
# 11 LYS HB3 12 LEU H 3.63
&rst
ixpk= 0, nxpk= 0, iat= 158, 175, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13, /
#
# 11 LYS HB2 12 LEU H 3.48
&rst
ixpk= 0, nxpk= 0, iat= 157, 175, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98, /
#
# 12 LEU H 12 LEU HG 3.07
&rst
ixpk= 0, nxpk= 0, iat= 175, 182, r1= 1.30, r2= 1.80, r3= 3.07, r4= 3.57, /
#
# 39 VAL QG2 40 ALA H 4.33
&rst
ixpk= 0, nxpk= 0, iat= -1, 623, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
igr1= 613, 614, 615, 617, 618, 619,
/
#
# 13 ASN H 13 ASN QB 2.98
&rst
ixpk= 0, nxpk= 0, iat= 194, -1, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84,
igr2= 198, 199,
/
#
# 13 ASN H 13 ASN HND1 3.65
&rst
ixpk= 0, nxpk= 0, iat= 194, 203, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15, /
#
# 12 LEU H 13 ASN H 3.24
&rst
ixpk= 0, nxpk= 0, iat= 175, 194, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74, /
#
# 13 ASN H 14 THR H 3.51
&rst
ixpk= 0, nxpk= 0, iat= 194, 208, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01, /
#
# 13 ASN H 46 TYR HE 4.79
&rst
ixpk= 0, nxpk= 0, iat= 194, -1, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
igr2= 736, 741,
/
#
# 10 THR HA 13 ASN H 3.98
&rst
ixpk= 0, nxpk= 0, iat= 141, 194, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48, /
#
# 11 LYS HA 13 ASN H 4.84
&rst
ixpk= 0, nxpk= 0, iat= 155, 194, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34, /
#
# 13 ASN H 15 LEU HG 5.05
&rst
ixpk= 0, nxpk= 0, iat= 194, 229, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55, /
#
# 11 LYS HB2 13 ASN H 5.22
&rst
ixpk= 0, nxpk= 0, iat= 157, 194, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72, /
#
# 9 THR QG2 13 ASN H 4.64
&rst
ixpk= 0, nxpk= 0, iat= -1, 194, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
igr1= 131, 132, 133,
/
#
# 12 LEU HB2 13 ASN H 3.38
&rst
ixpk= 0, nxpk= 0, iat= 179, 194, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88, /
#
# 12 LEU HB3 13 ASN H 4.08
&rst
ixpk= 0, nxpk= 0, iat= 180, 194, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58, /
#
# 12 LEU QD2 13 ASN H 4.88
&rst
ixpk= 0, nxpk= 0, iat= -1, 194, r1= 1.30, r2= 1.80, r3= 6.58, r4= 7.08,
igr1= 184, 185, 186, 188, 189, 190,
/
#
# 13 ASN H 13 ASN HND2 3.98
&rst
ixpk= 0, nxpk= 0, iat= 194, 204, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48, /
#
# 53 ASN HA 53 ASN HND2 4.47
&rst
ixpk= 0, nxpk= 0, iat= 850, 858, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97, /
#
# 13 ASN HA 13 ASN HND2 4.67
&rst
ixpk= 0, nxpk= 0, iat= 196, 204, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, /
#
# 10 THR HA 13 ASN HND1 3.98
&rst
ixpk= 0, nxpk= 0, iat= 141, 203, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48, /
#
# 10 THR HA 13 ASN HND2 4.46
&rst
ixpk= 0, nxpk= 0, iat= 141, 204, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, /
#
# 13 ASN QB 13 ASN HND2 3.39
&rst
ixpk= 0, nxpk= 0, iat= -1, 204, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,
igr1= 198, 199,
/
#
# 13 ASN QB 13 ASN HND1 3.25
&rst
ixpk= 0, nxpk= 0, iat= -1, 203, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15,
igr1= 198, 199,
/
#
# 13 ASN HND2 46 TYR HE 4.49
&rst
ixpk= 0, nxpk= 0, iat= 204, -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr2= 736, 741,
/
#
# 12 LEU H 13 ASN HND2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 175, 204, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 12 LEU HB2 13 ASN HND2 4.17
&rst
ixpk= 0, nxpk= 0, iat= 179, 204, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67, /
#
# 10 THR QG2 13 ASN HND1 5.40
&rst
ixpk= 0, nxpk= 0, iat= -1, 203, r1= 1.30, r2= 1.80, r3= 6.99, r4= 7.49,
igr1= 145, 146, 147,
/
#
# 12 LEU HB3 13 ASN HND2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 180, 204, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 12 LEU H 14 THR H 4.54
&rst
ixpk= 0, nxpk= 0, iat= 175, 208, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, /
#
# 11 LYS H 14 THR H 5.17
&rst
ixpk= 0, nxpk= 0, iat= 153, 208, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67, /
#
# 13 ASN HND1 14 THR H 5.39
&rst
ixpk= 0, nxpk= 0, iat= 203, 208, r1= 1.30, r2= 1.80, r3= 6.09, r4= 6.59, /
#
# 14 THR H 15 LEU H 3.24
&rst
ixpk= 0, nxpk= 0, iat= 208, 222, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74, /
#
# 14 THR H 14 THR HB 4.04
&rst
ixpk= 0, nxpk= 0, iat= 208, 212, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, /
#
# 14 THR H 15 LEU HA 4.83
&rst
ixpk= 0, nxpk= 0, iat= 208, 224, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33, /
#
# 10 THR HA 14 THR H 5.12
&rst
ixpk= 0, nxpk= 0, iat= 141, 208, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, /
#
# 11 LYS HA 14 THR H 4.09
&rst
ixpk= 0, nxpk= 0, iat= 155, 208, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59, /
#
# 12 LEU HA 14 THR H 4.20
&rst
ixpk= 0, nxpk= 0, iat= 177, 208, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, /
#
# 13 ASN QB 14 THR H 3.90
&rst
ixpk= 0, nxpk= 0, iat= -1, 208, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
igr1= 198, 199,
/
#
# 14 THR H 15 LEU HG 4.16
&rst
ixpk= 0, nxpk= 0, iat= 208, 229, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66, /
#
# 11 LYS HB3 14 THR H 5.50
&rst
ixpk= 0, nxpk= 0, iat= 158, 208, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 10 THR QG2 14 THR H 4.92
&rst
ixpk= 0, nxpk= 0, iat= -1, 208, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41,
igr1= 145, 146, 147,
/
#
# 14 THR H 15 LEU QD2 4.49
&rst
ixpk= 0, nxpk= 0, iat= 208, -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
igr2= 231, 232, 233, 235, 236, 237,
/
#
# 15 LEU H 15 LEU HG 3.59
&rst
ixpk= 0, nxpk= 0, iat= 222, 229, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09, /
#
# 15 LEU H 15 LEU HB3 3.68
&rst
ixpk= 0, nxpk= 0, iat= 222, 227, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18, /
#
# 15 LEU H 15 LEU HB2 3.68
&rst
ixpk= 0, nxpk= 0, iat= 222, 226, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18, /
#
# 12 LEU HA 15 LEU H 3.77
&rst
ixpk= 0, nxpk= 0, iat= 177, 222, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27, /
#
# 11 LYS HA 15 LEU H 5.14
&rst
ixpk= 0, nxpk= 0, iat= 155, 222, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64, /
#
# 14 THR HB 15 LEU H 4.64
&rst
ixpk= 0, nxpk= 0, iat= 212, 222, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14, /
#
# 20 GLU H 20 GLU HB3 3.71
&rst
ixpk= 0, nxpk= 0, iat= 296, 301, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21, /
#
# 20 GLU H 20 GLU HB2 3.71
&rst
ixpk= 0, nxpk= 0, iat= 296, 300, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21, /
#
# 20 GLU H 20 GLU HG2 4.70
&rst
ixpk= 0, nxpk= 0, iat= 296, 303, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, /
#
# 20 GLU H 20 GLU HG3 4.70
&rst
ixpk= 0, nxpk= 0, iat= 296, 304, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, /
#
# 18 SER HB3 20 GLU H 4.86
&rst
ixpk= 0, nxpk= 0, iat= 273, 296, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36, /
#
# 18 SER HB2 20 GLU H 4.86
&rst
ixpk= 0, nxpk= 0, iat= 272, 296, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36, /
#
# 20 GLU H 21 SER H 4.42
&rst
ixpk= 0, nxpk= 0, iat= 296, 311, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92, /
#
# 19 GLN H 20 GLU H 4.58
&rst
ixpk= 0, nxpk= 0, iat= 279, 296, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08, /
#
# 25 ALA H 25 ALA QB 2.64
&rst
ixpk= 0, nxpk= 0, iat= 363, -1, r1= 1.30, r2= 1.80, r3= 3.17, r4= 3.67,
igr2= 367, 368, 369,
/
#
# 15 LEU QD2 25 ALA H 4.18
&rst
ixpk= 0, nxpk= 0, iat= -1, 363, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr1= 231, 232, 233, 235, 236, 237,
/
#
# 22 ILE HA 25 ALA H 4.08
&rst
ixpk= 0, nxpk= 0, iat= 324, 363, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58, /
#
# 25 ALA H 28 TRP H 5.24
&rst
ixpk= 0, nxpk= 0, iat= 363, 406, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74, /
#
# 25 ALA H 26 SER H 2.93
&rst
ixpk= 0, nxpk= 0, iat= 363, 373, r1= 1.30, r2= 1.80, r3= 2.93, r4= 3.43, /
#
# 30 LEU HB3 31 LEU H 3.31
&rst
ixpk= 0, nxpk= 0, iat= 454, 468, r1= 1.30, r2= 1.80, r3= 3.31, r4= 3.81, /
#
# 31 LEU H 31 LEU HB2 3.39
&rst
ixpk= 0, nxpk= 0, iat= 468, 472, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89, /
#
# 30 LEU HG 31 LEU H 5.16
&rst
ixpk= 0, nxpk= 0, iat= 456, 468, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66, /
#
# 31 LEU H 32 GLN HG2 4.49
&rst
ixpk= 0, nxpk= 0, iat= 468, 494, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99, /
#
# 31 LEU H 31 LEU QD1 4.03
&rst
ixpk= 0, nxpk= 0, iat= 468, -1, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
igr2= 477, 478, 479, 481, 482, 483,
/
#
# 29 LEU QD1 31 LEU H 5.46
&rst
ixpk= 0, nxpk= 0, iat= -1, 468, r1= 1.30, r2= 1.80, r3= 7.36, r4= 7.86,
igr1= 439, 440, 441, 443, 444, 445,
/
#
# 29 LEU QD2 31 LEU H 5.46
&rst
ixpk= 0, nxpk= 0, iat= -1, 468, r1= 1.30, r2= 1.80, r3= 7.36, r4= 7.86,
igr1= 439, 440, 441, 443, 444, 445,
/
#
# 30 LEU QD1 31 LEU H 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 468, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr1= 458, 459, 460, 462, 463, 464,
/
#
# 30 LEU QD2 31 LEU H 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 468, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr1= 458, 459, 460, 462, 463, 464,
/
#
# 29 LEU HA 31 LEU H 4.56
&rst
ixpk= 0, nxpk= 0, iat= 432, 468, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06, /
#
# 31 LEU H 32 GLN H 3.27
&rst
ixpk= 0, nxpk= 0, iat= 468, 487, r1= 1.30, r2= 1.80, r3= 3.27, r4= 3.77, /
#
# 32 GLN H 32 GLN HB3 3.69
&rst
ixpk= 0, nxpk= 0, iat= 487, 492, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19, /
#
# 32 GLN H 32 GLN HG3 3.56
&rst
ixpk= 0, nxpk= 0, iat= 487, 495, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06, /
#
# 31 LEU HB2 32 GLN H 3.64
&rst
ixpk= 0, nxpk= 0, iat= 472, 487, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14, /
#
# 32 GLN H 32 GLN HB2 3.82
&rst
ixpk= 0, nxpk= 0, iat= 487, 491, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32, /
#
# 31 LEU HB3 32 GLN H 3.76
&rst
ixpk= 0, nxpk= 0, iat= 473, 487, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26, /
#
# 32 GLN H 32 GLN HG2 3.54
&rst
ixpk= 0, nxpk= 0, iat= 487, 494, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04, /
#
# 29 LEU QD1 32 GLN H 4.75
&rst
ixpk= 0, nxpk= 0, iat= -1, 487, r1= 1.30, r2= 1.80, r3= 6.40, r4= 6.90,
igr1= 439, 440, 441, 443, 444, 445,
/
#
# 29 LEU QD2 32 GLN H 4.75
&rst
ixpk= 0, nxpk= 0, iat= -1, 487, r1= 1.30, r2= 1.80, r3= 6.40, r4= 6.90,
igr1= 439, 440, 441, 443, 444, 445,
/
#
# 32 GLN H 33 TYR HB3 5.37
&rst
ixpk= 0, nxpk= 0, iat= 487, 509, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87, /
#
# 29 LEU HA 32 GLN H 3.70
&rst
ixpk= 0, nxpk= 0, iat= 432, 487, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20, /
#
# 32 GLN H 32 GLN HNE2 4.09
&rst
ixpk= 0, nxpk= 0, iat= 487, 500, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59, /
#
# 32 GLN H 33 TYR H 3.66
&rst
ixpk= 0, nxpk= 0, iat= 487, 504, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16, /
#
# 32 GLN H 79 PHE HZ 4.71
&rst
ixpk= 0, nxpk= 0, iat= 487,1309, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21, /
#
# 32 GLN H 34 ARG H 5.22
&rst
ixpk= 0, nxpk= 0, iat= 487, 525, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72, /
#
# 30 LEU H 32 GLN H 4.38
&rst
ixpk= 0, nxpk= 0, iat= 449, 487, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88, /
#
# 33 TYR H 33 TYR HB3 3.87
&rst
ixpk= 0, nxpk= 0, iat= 504, 509, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37, /
#
# 30 LEU HA 33 TYR H 5.04
&rst
ixpk= 0, nxpk= 0, iat= 451, 504, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54, /
#
# 31 LEU HA 33 TYR H 4.34
&rst
ixpk= 0, nxpk= 0, iat= 470, 504, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84, /
#
# 33 TYR H 33 TYR HD 3.68
&rst
ixpk= 0, nxpk= 0, iat= 504, -1, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
igr2= 512, 521,
/
#
# 31 LEU H 33 TYR H 5.27
&rst
ixpk= 0, nxpk= 0, iat= 468, 504, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77, /
#
# 34 ARG H 36 ALA H 4.05
&rst
ixpk= 0, nxpk= 0, iat= 525, 561, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55, /
#
# 33 TYR HD 34 ARG H 3.74
&rst
ixpk= 0, nxpk= 0, iat= -1, 525, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
igr1= 512, 521,
/
#
# 33 TYR H 34 ARG H 3.63
&rst
ixpk= 0, nxpk= 0, iat= 504, 525, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13, /
#
# 32 GLN HA 34 ARG H 4.22
&rst
ixpk= 0, nxpk= 0, iat= 489, 525, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, /
#
# 33 TYR HB3 34 ARG H 4.40
&rst
ixpk= 0, nxpk= 0, iat= 509, 525, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, /
#
# 34 ARG H 34 ARG HD3 4.18
&rst
ixpk= 0, nxpk= 0, iat= 525, 536, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68, /
#
# 34 ARG H 34 ARG HD2 4.18
&rst
ixpk= 0, nxpk= 0, iat= 525, 535, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68, /
#
# 34 ARG H 34 ARG HB3 3.89
&rst
ixpk= 0, nxpk= 0, iat= 525, 530, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39, /
#
# 34 ARG H 34 ARG HB2 3.89
&rst
ixpk= 0, nxpk= 0, iat= 525, 529, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39, /
#
# 34 ARG H 36 ALA QB 4.75
&rst
ixpk= 0, nxpk= 0, iat= 525, -1, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr2= 565, 566, 567,
/
#
# 74 GLN H 76 ILE H 5.42
&rst
ixpk= 0, nxpk= 0, iat=1203,1242, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92, /
#
# 35 ASP H 36 ALA H 3.20
&rst
ixpk= 0, nxpk= 0, iat= 549, 561, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, /
#
# 33 TYR HD 35 ASP H 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 549, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 512, 521,
/
#
# 35 ASP H 79 PHE HZ 5.50
&rst
ixpk= 0, nxpk= 0, iat= 549,1309, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 33 TYR H 35 ASP H 4.87
&rst
ixpk= 0, nxpk= 0, iat= 504, 549, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37, /
#
# 32 GLN HA 35 ASP H 4.64
&rst
ixpk= 0, nxpk= 0, iat= 489, 549, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14, /
#
# 70 GLN HA 74 GLN H 4.46
&rst
ixpk= 0, nxpk= 0, iat=1149,1203, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, /
#
# 33 TYR HA 35 ASP H 4.30
&rst
ixpk= 0, nxpk= 0, iat= 506, 549, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80, /
#
# 35 ASP H 35 ASP HB3 3.64
&rst
ixpk= 0, nxpk= 0, iat= 549, 554, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14, /
#
# 35 ASP H 35 ASP HB2 3.64
&rst
ixpk= 0, nxpk= 0, iat= 549, 553, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14, /
#
# 74 GLN H 74 GLN QB 3.60
&rst
ixpk= 0, nxpk= 0, iat=1203, -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
igr2=1207,1208,
/
#
# 74 GLN H 76 ILE HG12 4.98
&rst
ixpk= 0, nxpk= 0, iat=1203,1252, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48, /
#
# 32 GLN HG2 35 ASP H 5.45
&rst
ixpk= 0, nxpk= 0, iat= 494, 549, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95, /
#
# 35 ASP H 36 ALA QB 4.53
&rst
ixpk= 0, nxpk= 0, iat= 549, -1, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
igr2= 565, 566, 567,
/
#
# 36 ALA QB 38 LYS H 4.61
&rst
ixpk= 0, nxpk= 0, iat= -1, 585, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
igr1= 565, 566, 567,
/
#
# 38 LYS H 40 ALA QB 4.87
&rst
ixpk= 0, nxpk= 0, iat= 585, -1, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
igr2= 627, 628, 629,
/
#
# 38 LYS H 38 LYS HG3 4.60
&rst
ixpk= 0, nxpk= 0, iat= 585, 593, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, /
#
# 38 LYS H 38 LYS QB 2.74
&rst
ixpk= 0, nxpk= 0, iat= 585, -1, r1= 1.30, r2= 1.80, r3= 3.08, r4= 3.58,
igr2= 589, 590,
/
#
# 38 LYS H 38 LYS QD 4.60
&rst
ixpk= 0, nxpk= 0, iat= 585, -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
igr2= 595, 596,
/
#
# 37 PRO HB3 38 LYS H 4.09
&rst
ixpk= 0, nxpk= 0, iat= 579, 585, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59, /
#
# 38 LYS H 38 LYS QE 4.36
&rst
ixpk= 0, nxpk= 0, iat= 585, -1, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
igr2= 598, 599,
/
#
# 37 PRO QD 38 LYS H 3.45
&rst
ixpk= 0, nxpk= 0, iat= -1, 585, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,
igr1= 572, 573,
/
#
# 30 LEU H 30 LEU QD2 4.29
&rst
ixpk= 0, nxpk= 0, iat= 449, -1, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr2= 458, 459, 460, 462, 463, 464,
/
#
# 22 ILE QD1 63 LEU H 3.28
&rst
ixpk= 0, nxpk= 0, iat= -1,1031, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,
igr1= 335, 336, 337,
/
#
# 29 LEU HB3 30 LEU H 3.81
&rst
ixpk= 0, nxpk= 0, iat= 435, 449, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31, /
#
# 30 LEU H 30 LEU HB3 3.91
&rst
ixpk= 0, nxpk= 0, iat= 449, 454, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41, /
#
# 30 LEU H 30 LEU HB2 3.28
&rst
ixpk= 0, nxpk= 0, iat= 449, 453, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78, /
#
# 41 GLU QB 42 MET H 3.09
&rst
ixpk= 0, nxpk= 0, iat= -1, 648, r1= 1.30, r2= 1.80, r3= 3.47, r4= 3.97,
igr1= 637, 638,
/
#
# 39 VAL HA 42 MET H 4.46
&rst
ixpk= 0, nxpk= 0, iat= 609, 648, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, /
#
# 62 TYR HB3 63 LEU H 4.69
&rst
ixpk= 0, nxpk= 0, iat=1015,1031, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, /
#
# 30 LEU H 31 LEU H 3.64
&rst
ixpk= 0, nxpk= 0, iat= 449, 468, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14, /
#
# 28 TRP HE3 30 LEU H 4.86
&rst
ixpk= 0, nxpk= 0, iat= 425, 449, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36, /
#
# 41 GLU H 42 MET H 3.39
&rst
ixpk= 0, nxpk= 0, iat= 633, 648, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89, /
#
# 42 MET H 43 TRP H 3.48
&rst
ixpk= 0, nxpk= 0, iat= 648, 665, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98, /
#
# 43 TRP H 44 LYS H 3.33
&rst
ixpk= 0, nxpk= 0, iat= 665, 689, r1= 1.30, r2= 1.80, r3= 3.33, r4= 3.83, /
#
# 44 LYS H 83 PHE HE 5.32
&rst
ixpk= 0, nxpk= 0, iat= 689, -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr2=1367,1371,
/
#
# 43 TRP HD1 44 LYS H 5.50
&rst
ixpk= 0, nxpk= 0, iat= 673, 689, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 8 PHE HE 44 LYS H 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 689, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 115, 119,
/
#
# 43 TRP HE3 44 LYS H 3.48
&rst
ixpk= 0, nxpk= 0, iat= 684, 689, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98, /
#
# 44 LYS H 45 GLU H 3.27
&rst
ixpk= 0, nxpk= 0, iat= 689, 711, r1= 1.30, r2= 1.80, r3= 3.27, r4= 3.77, /
#
# 43 TRP HB2 44 LYS H 3.90
&rst
ixpk= 0, nxpk= 0, iat= 669, 689, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40, /
#
# 41 GLU HA 44 LYS H 4.17
&rst
ixpk= 0, nxpk= 0, iat= 635, 689, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67, /
#
# 43 TRP HB3 44 LYS H 3.32
&rst
ixpk= 0, nxpk= 0, iat= 670, 689, r1= 1.30, r2= 1.80, r3= 3.32, r4= 3.82, /
#
# 44 LYS H 86 VAL HB 4.11
&rst
ixpk= 0, nxpk= 0, iat= 689,1410, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, /
#
# 44 LYS H 44 LYS HB3 3.36
&rst
ixpk= 0, nxpk= 0, iat= 689, 694, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86, /
#
# 44 LYS H 44 LYS HB2 3.27
&rst
ixpk= 0, nxpk= 0, iat= 689, 693, r1= 1.30, r2= 1.80, r3= 3.27, r4= 3.77, /
#
# 44 LYS H 86 VAL QG2 3.62
&rst
ixpk= 0, nxpk= 0, iat= 689, -1, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
igr2=1412,1413,1414,1416,1417,1418,
/
#
# 44 LYS H 90 VAL QG2 4.27
&rst
ixpk= 0, nxpk= 0, iat= 689, -1, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
igr2=1463,1464,1465,1467,1468,1469,
/
#
# 40 ALA QB 44 LYS H 4.95
&rst
ixpk= 0, nxpk= 0, iat= -1, 689, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
igr1= 627, 628, 629,
/
#
# 45 GLU H 48 LEU QD1 5.50
&rst
ixpk= 0, nxpk= 0, iat= 711, -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr2= 773, 774, 775, 777, 778, 779,
/
#
# 45 GLU H 86 VAL QG1 5.09
&rst
ixpk= 0, nxpk= 0, iat= 711, -1, r1= 1.30, r2= 1.80, r3= 6.86, r4= 7.36,
igr2=1412,1413,1414,1416,1417,1418,
/
#
# 45 GLU H 90 VAL QG2 5.45
&rst
ixpk= 0, nxpk= 0, iat= 711, -1, r1= 1.30, r2= 1.80, r3= 7.35, r4= 7.85,
igr2=1463,1464,1465,1467,1468,1469,
/
#
# 44 LYS HG3 45 GLU H 4.43
&rst
ixpk= 0, nxpk= 0, iat= 697, 711, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93, /
#
# 44 LYS HG2 45 GLU H 4.43
&rst
ixpk= 0, nxpk= 0, iat= 696, 711, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93, /
#
# 44 LYS HB3 45 GLU H 3.59
&rst
ixpk= 0, nxpk= 0, iat= 694, 711, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09, /
#
# 45 GLU H 45 GLU HB2 3.02
&rst
ixpk= 0, nxpk= 0, iat= 711, 715, r1= 1.30, r2= 1.80, r3= 3.02, r4= 3.52, /
#
# 45 GLU H 45 GLU HG3 4.12
&rst
ixpk= 0, nxpk= 0, iat= 711, 719, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62, /
#
# 45 GLU H 86 VAL HB 5.31
&rst
ixpk= 0, nxpk= 0, iat= 711,1410, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81, /
#
# 43 TRP HB3 45 GLU H 5.10
&rst
ixpk= 0, nxpk= 0, iat= 670, 711, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, /
#
# 42 MET HA 45 GLU H 3.95
&rst
ixpk= 0, nxpk= 0, iat= 650, 711, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45, /
#
# 45 GLU H 48 LEU H 4.91
&rst
ixpk= 0, nxpk= 0, iat= 711, 764, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41, /
#
# 45 GLU H 46 TYR H 3.24
&rst
ixpk= 0, nxpk= 0, iat= 711, 726, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74, /
#
# 43 TRP H 45 GLU H 4.76
&rst
ixpk= 0, nxpk= 0, iat= 665, 711, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26, /
#
# 46 TYR H 47 MET H 3.60
&rst
ixpk= 0, nxpk= 0, iat= 726, 747, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10, /
#
# 46 TYR HD 47 MET H 3.88
&rst
ixpk= 0, nxpk= 0, iat= -1, 747, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,
igr1= 734, 743,
/
#
# 46 TYR HE 47 MET H 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 747, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 736, 741,
/
#
# 43 TRP HA 47 MET H 4.74
&rst
ixpk= 0, nxpk= 0, iat= 667, 747, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24, /
#
# 44 LYS HA 47 MET H 4.35
&rst
ixpk= 0, nxpk= 0, iat= 691, 747, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85, /
#
# 47 MET H 47 MET QE 4.43
&rst
ixpk= 0, nxpk= 0, iat= 747, -1, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
igr2= 758, 759, 760,
/
#
# 47 MET H 90 VAL QG2 4.17
&rst
ixpk= 0, nxpk= 0, iat= 747, -1, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
igr2=1463,1464,1465,1467,1468,1469,
/
#
# 92 GLY H 92 GLY HA3 2.91
&rst
ixpk= 0, nxpk= 0, iat=1492,1495, r1= 1.30, r2= 1.80, r3= 2.91, r4= 3.41, /
#
# 91 LEU H 92 GLY H 3.31
&rst
ixpk= 0, nxpk= 0, iat=1473,1492, r1= 1.30, r2= 1.80, r3= 3.31, r4= 3.81, /
#
# 92 GLY H 94 ILE H 4.70
&rst
ixpk= 0, nxpk= 0, iat=1492,1523, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, /
#
# 92 GLY H 95 ASN QB 4.39
&rst
ixpk= 0, nxpk= 0, iat=1492, -1, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,
igr2=1546,1547,
/
#
# 90 VAL HB 92 GLY H 5.09
&rst
ixpk= 0, nxpk= 0, iat=1461,1492, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59, /
#
# 91 LEU HB2 92 GLY H 3.36
&rst
ixpk= 0, nxpk= 0, iat=1477,1492, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86, /
#
# 92 GLY H 93 ARG QG 4.82
&rst
ixpk= 0, nxpk= 0, iat=1492, -1, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,
igr2=1506,1507,
/
#
# 92 GLY H 94 ILE HG12 4.53
&rst
ixpk= 0, nxpk= 0, iat=1492,1533, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03, /
#
# 91 LEU HB3 92 GLY H 3.50
&rst
ixpk= 0, nxpk= 0, iat=1478,1492, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, /
#
# 87 ALA QB 92 GLY H 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1492, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1=1426,1427,1428,
/
#
# 91 LEU QD2 92 GLY H 4.97
&rst
ixpk= 0, nxpk= 0, iat= -1,1492, r1= 1.30, r2= 1.80, r3= 6.70, r4= 7.20,
igr1=1482,1483,1484,1486,1487,1488,
/
#
# 91 LEU QD1 92 GLY H 4.97
&rst
ixpk= 0, nxpk= 0, iat= -1,1492, r1= 1.30, r2= 1.80, r3= 6.70, r4= 7.20,
igr1=1482,1483,1484,1486,1487,1488,
/
#
# 92 GLY H 127 ILE QG2 4.71
&rst
ixpk= 0, nxpk= 0, iat=1492, -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr2=2109,2110,2111,
/
#
# 92 GLY H 94 ILE QD1 5.07
&rst
ixpk= 0, nxpk= 0, iat=1492, -1, r1= 1.30, r2= 1.80, r3= 6.09, r4= 6.59,
igr2=1536,1537,1538,
/
#
# 90 VAL QG1 92 GLY H 4.97
&rst
ixpk= 0, nxpk= 0, iat= -1,1492, r1= 1.30, r2= 1.80, r3= 6.70, r4= 7.20,
igr1=1463,1464,1465,1467,1468,1469,
/
#
# 70 GLN HA 73 GLY H 4.32
&rst
ixpk= 0, nxpk= 0, iat=1149,1196, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82, /
#
# 72 LYS HB3 73 GLY H 4.33
&rst
ixpk= 0, nxpk= 0, iat=1179,1196, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83, /
#
# 72 LYS HB2 73 GLY H 4.33
&rst
ixpk= 0, nxpk= 0, iat=1178,1196, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83, /
#
# 71 ALA QB 73 GLY H 4.87
&rst
ixpk= 0, nxpk= 0, iat= -1,1196, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
igr1=1168,1169,1170,
/
#
# 72 LYS QD 73 GLY H 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1,1196, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1=1184,1185,
/
#
# 60 GLY H 61 LEU H 3.36
&rst
ixpk= 0, nxpk= 0, iat= 984, 991, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86, /
#
# 59 LEU H 60 GLY H 3.65
&rst
ixpk= 0, nxpk= 0, iat= 965, 984, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15, /
#
# 43 TRP HZ2 60 GLY H 5.50
&rst
ixpk= 0, nxpk= 0, iat= 678, 984, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 59 LEU HG 60 GLY H 4.46
&rst
ixpk= 0, nxpk= 0, iat= 972, 984, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, /
#
# 84 GLY H 85 LYS H 3.09
&rst
ixpk= 0, nxpk= 0, iat=1377,1384, r1= 1.30, r2= 1.80, r3= 3.09, r4= 3.59, /
#
# 83 PHE HD 84 GLY H 4.70
&rst
ixpk= 0, nxpk= 0, iat= -1,1377, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
igr1=1365,1373,
/
#
# 81 ASP HA 84 GLY H 4.15
&rst
ixpk= 0, nxpk= 0, iat=1336,1377, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65, /
#
# 83 PHE HB2 84 GLY H 3.97
&rst
ixpk= 0, nxpk= 0, iat=1361,1377, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47, /
#
# 83 PHE HB3 84 GLY H 3.91
&rst
ixpk= 0, nxpk= 0, iat=1362,1377, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41, /
#
# 81 ASP QB 84 GLY H 5.47
&rst
ixpk= 0, nxpk= 0, iat= -1,1377, r1= 1.30, r2= 1.80, r3= 6.14, r4= 6.64,
igr1=1338,1339,
/
#
# 84 GLY H 119 PHE HB3 5.50
&rst
ixpk= 0, nxpk= 0, iat=1377,1980, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 64 MET QE 84 GLY H 4.14
&rst
ixpk= 0, nxpk= 0, iat= -1,1377, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
igr1=1061,1062,1063,
/
#
# 84 GLY H 85 LYS HG2 4.47
&rst
ixpk= 0, nxpk= 0, iat=1377,1391, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97, /
#
# 84 GLY H 86 VAL QG2 4.46
&rst
ixpk= 0, nxpk= 0, iat=1377, -1, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51,
igr2=1412,1413,1414,1416,1417,1418,
/
#
# 84 GLY H 87 ALA QB 4.28
&rst
ixpk= 0, nxpk= 0, iat=1377, -1, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
igr2=1426,1427,1428,
/
#
# 40 ALA QB 84 GLY H 4.75
&rst
ixpk= 0, nxpk= 0, iat= -1,1377, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr1= 627, 628, 629,
/
#
# 51 SER H 51 SER HB2 4.07
&rst
ixpk= 0, nxpk= 0, iat= 821, 825, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57, /
#
# 49 ARG H 51 SER H 5.50
&rst
ixpk= 0, nxpk= 0, iat= 783, 821, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 51 SER H 52 VAL H 3.69
&rst
ixpk= 0, nxpk= 0, iat= 821, 832, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19, /
#
# 49 ARG HA 51 SER H 4.34
&rst
ixpk= 0, nxpk= 0, iat= 785, 821, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84, /
#
# 51 SER H 51 SER HB3 4.07
&rst
ixpk= 0, nxpk= 0, iat= 821, 826, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57, /
#
# 49 ARG HD3 51 SER H 4.94
&rst
ixpk= 0, nxpk= 0, iat= 794, 821, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44, /
#
# 49 ARG HD2 51 SER H 4.94
&rst
ixpk= 0, nxpk= 0, iat= 793, 821, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44, /
#
# 50 PRO HB3 51 SER H 4.42
&rst
ixpk= 0, nxpk= 0, iat= 815, 821, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92, /
#
# 49 ARG HB3 51 SER H 4.85
&rst
ixpk= 0, nxpk= 0, iat= 788, 821, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35, /
#
# 50 PRO HG3 51 SER H 5.08
&rst
ixpk= 0, nxpk= 0, iat= 812, 821, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58, /
#
# 49 ARG HB2 51 SER H 3.85
&rst
ixpk= 0, nxpk= 0, iat= 787, 821, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35, /
#
# 49 ARG HG3 51 SER H 3.78
&rst
ixpk= 0, nxpk= 0, iat= 791, 821, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28, /
#
# 86 VAL H 86 VAL HB 3.76
&rst
ixpk= 0, nxpk= 0, iat=1406,1410, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26, /
#
# 86 VAL H 88 ALA H 5.25
&rst
ixpk= 0, nxpk= 0, iat=1406,1432, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75, /
#
# 84 GLY H 86 VAL H 4.73
&rst
ixpk= 0, nxpk= 0, iat=1377,1406, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, /
#
# 83 PHE HA 86 VAL H 3.99
&rst
ixpk= 0, nxpk= 0, iat=1359,1406, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49, /
#
# 85 LYS HB2 86 VAL H 3.36
&rst
ixpk= 0, nxpk= 0, iat=1388,1406, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86, /
#
# 85 LYS HG2 86 VAL H 4.02
&rst
ixpk= 0, nxpk= 0, iat=1391,1406, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52, /
#
# 85 LYS HG3 86 VAL H 4.60
&rst
ixpk= 0, nxpk= 0, iat=1392,1406, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, /
#
# 86 VAL H 86 VAL QG2 2.78
&rst
ixpk= 0, nxpk= 0, iat=1406, -1, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,
igr2=1412,1413,1414,1416,1417,1418,
/
#
# 40 ALA QB 86 VAL H 4.03
&rst
ixpk= 0, nxpk= 0, iat= -1,1406, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
igr1= 627, 628, 629,
/
#
# 54 THR H 55 ARG H 3.41
&rst
ixpk= 0, nxpk= 0, iat= 862, 876, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91, /
#
# 54 THR H 56 ARG H 5.23
&rst
ixpk= 0, nxpk= 0, iat= 862, 900, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73, /
#
# 54 THR H 98 PHE HE 4.81
&rst
ixpk= 0, nxpk= 0, iat= 862, -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr2=1598,1602,
/
#
# 54 THR H 54 THR HB 3.77
&rst
ixpk= 0, nxpk= 0, iat= 862, 866, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27, /
#
# 53 ASN HB3 54 THR H 4.04
&rst
ixpk= 0, nxpk= 0, iat= 853, 862, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, /
#
# 53 ASN HB2 54 THR H 4.04
&rst
ixpk= 0, nxpk= 0, iat= 852, 862, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, /
#
# 54 THR H 55 ARG QB 4.83
&rst
ixpk= 0, nxpk= 0, iat= 862, -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr2= 880, 881,
/
#
# 54 THR H 57 LYS HB2 4.93
&rst
ixpk= 0, nxpk= 0, iat= 862, 928, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43, /
#
# 54 THR H 54 THR QG2 2.94
&rst
ixpk= 0, nxpk= 0, iat= 862, -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
igr2= 868, 869, 870,
/
#
# 68 VAL H 69 GLN H 3.53
&rst
ixpk= 0, nxpk= 0, iat=1114,1130, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03, /
#
# 68 VAL H 83 PHE HD 5.00
&rst
ixpk= 0, nxpk= 0, iat=1114, -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr2=1365,1373,
/
#
# 68 VAL H 83 PHE HE 5.26
&rst
ixpk= 0, nxpk= 0, iat=1114, -1, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
igr2=1367,1371,
/
#
# 65 ASN HA 68 VAL H 4.28
&rst
ixpk= 0, nxpk= 0, iat=1069,1114, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78, /
#
# 68 VAL H 69 GLN HA 5.50
&rst
ixpk= 0, nxpk= 0, iat=1114,1132, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 68 VAL H 83 PHE HB2 5.50
&rst
ixpk= 0, nxpk= 0, iat=1114,1361, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 64 MET HA 68 VAL H 3.99
&rst
ixpk= 0, nxpk= 0, iat=1052,1114, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49, /
#
# 64 MET QE 68 VAL H 4.58
&rst
ixpk= 0, nxpk= 0, iat= -1,1114, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
igr1=1061,1062,1063,
/
#
# 91 LEU H 94 ILE H 5.06
&rst
ixpk= 0, nxpk= 0, iat=1473,1523, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56, /
#
# 94 ILE H 95 ASN H 3.36
&rst
ixpk= 0, nxpk= 0, iat=1523,1542, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86, /
#
# 90 VAL HA 94 ILE H 4.28
&rst
ixpk= 0, nxpk= 0, iat=1459,1523, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78, /
#
# 94 ILE H 95 ASN QB 4.57
&rst
ixpk= 0, nxpk= 0, iat=1523, -1, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
igr2=1546,1547,
/
#
# 93 ARG QB 94 ILE H 3.47
&rst
ixpk= 0, nxpk= 0, iat= -1,1523, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,
igr1=1503,1504,
/
#
# 93 ARG QG 94 ILE H 3.96
&rst
ixpk= 0, nxpk= 0, iat= -1,1523, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
igr1=1506,1507,
/
#
# 94 ILE H 94 ILE HG12 3.35
&rst
ixpk= 0, nxpk= 0, iat=1523,1533, r1= 1.30, r2= 1.80, r3= 3.35, r4= 3.85, /
#
# 94 ILE H 94 ILE HB 3.81
&rst
ixpk= 0, nxpk= 0, iat=1523,1527, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31, /
#
# 94 ILE H 94 ILE QG2 2.92
&rst
ixpk= 0, nxpk= 0, iat=1523, -1, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01,
igr2=1529,1530,1531,
/
#
# 94 ILE H 94 ILE QD1 4.01
&rst
ixpk= 0, nxpk= 0, iat=1523, -1, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
igr2=1536,1537,1538,
/
#
# 90 VAL QG1 94 ILE H 3.85
&rst
ixpk= 0, nxpk= 0, iat= -1,1523, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
igr1=1463,1464,1465,1467,1468,1469,
/
#
# 88 ALA H 127 ILE H 5.16
&rst
ixpk= 0, nxpk= 0, iat=1432,2103, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66, /
#
# 88 ALA H 89 GLU H 3.16
&rst
ixpk= 0, nxpk= 0, iat=1432,1442, r1= 1.30, r2= 1.80, r3= 3.16, r4= 3.66, /
#
# 88 ALA H 92 GLY H 5.50
&rst
ixpk= 0, nxpk= 0, iat=1432,1492, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 85 LYS H 88 ALA H 5.50
&rst
ixpk= 0, nxpk= 0, iat=1384,1432, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 88 ALA H 119 PHE HE 5.50
&rst
ixpk= 0, nxpk= 0, iat=1432, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2=1985,1989,
/
#
# 85 LYS HA 88 ALA H 4.63
&rst
ixpk= 0, nxpk= 0, iat=1386,1432, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, /
#
# 88 ALA H 127 ILE HA 4.50
&rst
ixpk= 0, nxpk= 0, iat=1432,2105, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, /
#
# 88 ALA H 88 ALA QB 2.55
&rst
ixpk= 0, nxpk= 0, iat=1432, -1, r1= 1.30, r2= 1.80, r3= 3.06, r4= 3.56,
igr2=1436,1437,1438,
/
#
# 87 ALA QB 88 ALA H 2.88
&rst
ixpk= 0, nxpk= 0, iat= -1,1432, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96,
igr1=1426,1427,1428,
/
#
# 88 ALA H 127 ILE QG2 4.50
&rst
ixpk= 0, nxpk= 0, iat=1432, -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr2=2109,2110,2111,
/
#
# 88 ALA H 127 ILE QD1 3.53
&rst
ixpk= 0, nxpk= 0, iat=1432, -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
igr2=2116,2117,2118,
/
#
# 88 ALA H 91 LEU H 5.50
&rst
ixpk= 0, nxpk= 0, iat=1432,1473, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 89 GLU H 91 LEU H 4.94
&rst
ixpk= 0, nxpk= 0, iat=1442,1473, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44, /
#
# 90 VAL H 91 LEU H 3.36
&rst
ixpk= 0, nxpk= 0, iat=1457,1473, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86, /
#
# 43 TRP HH2 91 LEU H 4.36
&rst
ixpk= 0, nxpk= 0, iat= 680,1473, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86, /
#
# 87 ALA HA 91 LEU H 3.73
&rst
ixpk= 0, nxpk= 0, iat=1424,1473, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23, /
#
# 90 VAL HB 91 LEU H 3.38
&rst
ixpk= 0, nxpk= 0, iat=1461,1473, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88, /
#
# 91 LEU H 91 LEU HB2 3.03
&rst
ixpk= 0, nxpk= 0, iat=1473,1477, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53, /
#
# 91 LEU H 93 ARG QG 5.50
&rst
ixpk= 0, nxpk= 0, iat=1473, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2=1506,1507,
/
#
# 91 LEU H 94 ILE HG12 4.37
&rst
ixpk= 0, nxpk= 0, iat=1473,1533, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87, /
#
# 91 LEU H 91 LEU HB3 3.72
&rst
ixpk= 0, nxpk= 0, iat=1473,1478, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22, /
#
# 90 VAL QG2 91 LEU H 3.75
&rst
ixpk= 0, nxpk= 0, iat= -1,1473, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
igr1=1463,1464,1465,1467,1468,1469,
/
#
# 91 LEU H 94 ILE QG2 4.21
&rst
ixpk= 0, nxpk= 0, iat=1473, -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
igr2=1529,1530,1531,
/
#
# 91 LEU H 94 ILE QD1 4.14
&rst
ixpk= 0, nxpk= 0, iat=1473, -1, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
igr2=1536,1537,1538,
/
#
# 90 VAL QG1 91 LEU H 3.53
&rst
ixpk= 0, nxpk= 0, iat= -1,1473, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
igr1=1463,1464,1465,1467,1468,1469,
/
#
# 89 GLU H 92 GLY H 4.80
&rst
ixpk= 0, nxpk= 0, iat=1442,1492, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30, /
#
# 89 GLU H 90 VAL H 3.22
&rst
ixpk= 0, nxpk= 0, iat=1442,1457, r1= 1.30, r2= 1.80, r3= 3.22, r4= 3.72, /
#
# 86 VAL H 89 GLU H 5.50
&rst
ixpk= 0, nxpk= 0, iat=1406,1442, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 89 GLU H 89 GLU HA 2.85
&rst
ixpk= 0, nxpk= 0, iat=1442,1444, r1= 1.30, r2= 1.80, r3= 2.85, r4= 3.35, /
#
# 89 GLU H 89 GLU HG3 3.42
&rst
ixpk= 0, nxpk= 0, iat=1442,1450, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92, /
#
# 89 GLU H 89 GLU HB2 2.90
&rst
ixpk= 0, nxpk= 0, iat=1442,1446, r1= 1.30, r2= 1.80, r3= 2.90, r4= 3.40, /
#
# 89 GLU H 89 GLU HG2 3.42
&rst
ixpk= 0, nxpk= 0, iat=1442,1449, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92, /
#
# 88 ALA QB 89 GLU H 2.80
&rst
ixpk= 0, nxpk= 0, iat= -1,1442, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
igr1=1436,1437,1438,
/
#
# 61 LEU H 64 MET H 5.17
&rst
ixpk= 0, nxpk= 0, iat= 991,1050, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67, /
#
# 43 TRP HZ2 61 LEU H 4.28
&rst
ixpk= 0, nxpk= 0, iat= 678, 991, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78, /
#
# 61 LEU H 98 PHE HE 5.50
&rst
ixpk= 0, nxpk= 0, iat= 991, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2=1598,1602,
/
#
# 61 LEU H 62 TYR HD 5.48
&rst
ixpk= 0, nxpk= 0, iat= 991, -1, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
igr2=1018,1027,
/
#
# 58 LEU HA 61 LEU H 3.72
&rst
ixpk= 0, nxpk= 0, iat= 948, 991, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22, /
#
# 61 LEU H 61 LEU HB3 3.31
&rst
ixpk= 0, nxpk= 0, iat= 991, 996, r1= 1.30, r2= 1.80, r3= 3.31, r4= 3.81, /
#
# 61 LEU H 61 LEU HG 4.55
&rst
ixpk= 0, nxpk= 0, iat= 991, 998, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05, /
#
# 57 LYS HB3 61 LEU H 5.50
&rst
ixpk= 0, nxpk= 0, iat= 929, 991, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 61 LEU H 61 LEU HB2 3.31
&rst
ixpk= 0, nxpk= 0, iat= 991, 995, r1= 1.30, r2= 1.80, r3= 3.31, r4= 3.81, /
#
# 61 LEU H 61 LEU QD1 4.36
&rst
ixpk= 0, nxpk= 0, iat= 991, -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
igr2=1000,1001,1002,1004,1005,1006,
/
#
# 61 LEU H 94 ILE QD1 4.27
&rst
ixpk= 0, nxpk= 0, iat= 991, -1, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
igr2=1536,1537,1538,
/
#
# 61 LEU H 90 VAL QG1 4.83
&rst
ixpk= 0, nxpk= 0, iat= 991, -1, r1= 1.30, r2= 1.80, r3= 6.51, r4= 7.01,
igr2=1463,1464,1465,1467,1468,1469,
/
#
# 87 ALA H 88 ALA H 3.28
&rst
ixpk= 0, nxpk= 0, iat=1422,1432, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78, /
#
# 87 ALA H 89 GLU H 4.47
&rst
ixpk= 0, nxpk= 0, iat=1422,1442, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97, /
#
# 84 GLY H 87 ALA H 4.78
&rst
ixpk= 0, nxpk= 0, iat=1377,1422, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, /
#
# 85 LYS H 87 ALA H 3.96
&rst
ixpk= 0, nxpk= 0, iat=1384,1422, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46, /
#
# 86 VAL H 87 ALA H 2.89
&rst
ixpk= 0, nxpk= 0, iat=1406,1422, r1= 1.30, r2= 1.80, r3= 2.89, r4= 3.39, /
#
# 83 PHE HA 87 ALA H 4.34
&rst
ixpk= 0, nxpk= 0, iat=1359,1422, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84, /
#
# 85 LYS HA 87 ALA H 4.15
&rst
ixpk= 0, nxpk= 0, iat=1386,1422, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65, /
#
# 84 GLY HA2 87 ALA H 4.11
&rst
ixpk= 0, nxpk= 0, iat=1379,1422, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, /
#
# 83 PHE HB3 87 ALA H 5.29
&rst
ixpk= 0, nxpk= 0, iat=1362,1422, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79, /
#
# 86 VAL HB 87 ALA H 4.19
&rst
ixpk= 0, nxpk= 0, iat=1410,1422, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69, /
#
# 44 LYS HB2 87 ALA H 5.50
&rst
ixpk= 0, nxpk= 0, iat= 693,1422, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 86 VAL QG2 87 ALA H 2.95
&rst
ixpk= 0, nxpk= 0, iat= -1,1422, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,
igr1=1412,1413,1414,1416,1417,1418,
/
#
# 87 ALA H 87 ALA QB 2.63
&rst
ixpk= 0, nxpk= 0, iat=1422, -1, r1= 1.30, r2= 1.80, r3= 3.16, r4= 3.66,
igr2=1426,1427,1428,
/
#
# 86 VAL QG1 87 ALA H 4.08
&rst
ixpk= 0, nxpk= 0, iat= -1,1422, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
igr1=1412,1413,1414,1416,1417,1418,
/
#
# 52 VAL H 52 VAL QG1 3.87
&rst
ixpk= 0, nxpk= 0, iat= 832, -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
igr2= 838, 839, 840, 842, 843, 844,
/
#
# 52 VAL H 52 VAL QG2 3.87
&rst
ixpk= 0, nxpk= 0, iat= 832, -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
igr2= 838, 839, 840, 842, 843, 844,
/
#
# 49 ARG HB3 52 VAL H 5.23
&rst
ixpk= 0, nxpk= 0, iat= 788, 832, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73, /
#
# 50 PRO HB2 52 VAL H 5.50
&rst
ixpk= 0, nxpk= 0, iat= 814, 832, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 49 ARG HA 52 VAL H 5.05
&rst
ixpk= 0, nxpk= 0, iat= 785, 832, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55, /
#
# 49 ARG HG3 52 VAL H 3.38
&rst
ixpk= 0, nxpk= 0, iat= 791, 832, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88, /
#
# 52 VAL H 52 VAL HB 3.71
&rst
ixpk= 0, nxpk= 0, iat= 832, 836, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21, /
#
# 121 LYS H 121 LYS QE 5.08
&rst
ixpk= 0, nxpk= 0, iat=2006, -1, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr2=2019,2020,
/
#
# 121 LYS H 122 GLN H 3.29
&rst
ixpk= 0, nxpk= 0, iat=2006,2028, r1= 1.30, r2= 1.80, r3= 3.29, r4= 3.79, /
#
# 121 LYS H 123 VAL H 4.79
&rst
ixpk= 0, nxpk= 0, iat=2006,2045, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29, /
#
# 120 SER HA 121 LYS H 2.72
&rst
ixpk= 0, nxpk= 0, iat=1997,2006, r1= 1.30, r2= 1.80, r3= 2.72, r4= 3.22, /
#
# 121 LYS H 122 GLN HG2 4.63
&rst
ixpk= 0, nxpk= 0, iat=2006,2035, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, /
#
# 121 LYS H 121 LYS QB 2.88
&rst
ixpk= 0, nxpk= 0, iat=2006, -1, r1= 1.30, r2= 1.80, r3= 3.23, r4= 3.73,
igr2=2010,2011,
/
#
# 53 ASN H 53 ASN HB2 3.37
&rst
ixpk= 0, nxpk= 0, iat= 848, 852, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87, /
#
# 53 ASN H 53 ASN HB3 3.37
&rst
ixpk= 0, nxpk= 0, iat= 848, 853, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87, /
#
# 53 ASN H 55 ARG H 5.18
&rst
ixpk= 0, nxpk= 0, iat= 848, 876, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68, /
#
# 53 ASN H 53 ASN HND1 4.94
&rst
ixpk= 0, nxpk= 0, iat= 848, 857, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94, /
#
# 52 VAL H 53 ASN H 4.71
&rst
ixpk= 0, nxpk= 0, iat= 832, 848, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21, /
#
# 52 VAL HA 53 ASN H 2.72
&rst
ixpk= 0, nxpk= 0, iat= 834, 848, r1= 1.30, r2= 1.80, r3= 2.72, r4= 3.22, /
#
# 53 ASN H 56 ARG QD 4.19
&rst
ixpk= 0, nxpk= 0, iat= 848, -1, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
igr2= 910, 911,
/
#
# 53 ASN H 56 ARG QB 4.10
&rst
ixpk= 0, nxpk= 0, iat= 848, -1, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
igr2= 904, 905,
/
#
# 53 ASN H 56 ARG QG 3.85
&rst
ixpk= 0, nxpk= 0, iat= 848, -1, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,
igr2= 907, 908,
/
#
# 52 VAL QG2 53 ASN H 3.69
&rst
ixpk= 0, nxpk= 0, iat= -1, 848, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
igr1= 838, 839, 840, 842, 843, 844,
/
#
# 52 VAL QG1 53 ASN H 3.69
&rst
ixpk= 0, nxpk= 0, iat= -1, 848, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
igr1= 838, 839, 840, 842, 843, 844,
/
#
# 103 LYS H 103 LYS QB 3.15
&rst
ixpk= 0, nxpk= 0, iat=1677, -1, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04,
igr2=1681,1682,
/
#
# 103 LYS H 103 LYS QG 3.77
&rst
ixpk= 0, nxpk= 0, iat=1677, -1, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,
igr2=1684,1685,
/
#
# 102 LEU HG 103 LYS H 3.93
&rst
ixpk= 0, nxpk= 0, iat=1665,1677, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43, /
#
# 102 LEU HB3 103 LYS H 3.98
&rst
ixpk= 0, nxpk= 0, iat=1663,1677, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48, /
#
# 102 LEU HB2 103 LYS H 3.73
&rst
ixpk= 0, nxpk= 0, iat=1662,1677, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23, /
#
# 102 LEU QD2 103 LYS H 4.79
&rst
ixpk= 0, nxpk= 0, iat= -1,1677, r1= 1.30, r2= 1.80, r3= 6.46, r4= 6.96,
igr1=1667,1668,1669,1671,1672,1673,
/
#
# 101 ASP HB2 103 LYS H 4.86
&rst
ixpk= 0, nxpk= 0, iat=1650,1677, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36, /
#
# 101 ASP HB3 103 LYS H 5.50
&rst
ixpk= 0, nxpk= 0, iat=1651,1677, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 103 LYS H 103 LYS QE 4.95
&rst
ixpk= 0, nxpk= 0, iat=1677, -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
igr2=1690,1691,
/
#
# 98 PHE HB3 103 LYS H 3.90
&rst
ixpk= 0, nxpk= 0, iat=1593,1677, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40, /
#
# 98 PHE HB2 103 LYS H 4.01
&rst
ixpk= 0, nxpk= 0, iat=1592,1677, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51, /
#
# 100 ARG HA 103 LYS H 4.41
&rst
ixpk= 0, nxpk= 0, iat=1624,1677, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, /
#
# 101 ASP HA 103 LYS H 5.11
&rst
ixpk= 0, nxpk= 0, iat=1648,1677, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61, /
#
# 99 PRO HA 103 LYS H 5.15
&rst
ixpk= 0, nxpk= 0, iat=1618,1677, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65, /
#
# 98 PHE HD 103 LYS H 4.22
&rst
ixpk= 0, nxpk= 0, iat= -1,1677, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr1=1596,1604,
/
#
# 103 LYS H 105 LYS H 4.76
&rst
ixpk= 0, nxpk= 0, iat=1677,1721, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26, /
#
# 103 LYS H 106 LEU H 5.00
&rst
ixpk= 0, nxpk= 0, iat=1677,1743, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, /
#
# 12 LEU QD2 43 TRP H 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 665, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr1= 184, 185, 186, 188, 189, 190,
/
#
# 40 ALA QB 43 TRP H 5.01
&rst
ixpk= 0, nxpk= 0, iat= -1, 665, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,
igr1= 627, 628, 629,
/
#
# 39 VAL QG2 43 TRP H 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 665, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr1= 613, 614, 615, 617, 618, 619,
/
#
# 43 TRP H 86 VAL QG1 5.34
&rst
ixpk= 0, nxpk= 0, iat= 665, -1, r1= 1.30, r2= 1.80, r3= 7.20, r4= 7.70,
igr2=1412,1413,1414,1416,1417,1418,
/
#
# 43 TRP H 86 VAL QG2 5.35
&rst
ixpk= 0, nxpk= 0, iat= 665, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr2=1412,1413,1414,1416,1417,1418,
/
#
# 38 LYS QD 43 TRP H 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 665, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 595, 596,
/
#
# 43 TRP H 44 LYS HB3 5.10
&rst
ixpk= 0, nxpk= 0, iat= 665, 694, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, /
#
# 42 MET HB2 43 TRP H 4.13
&rst
ixpk= 0, nxpk= 0, iat= -1, 665, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
igr1= 652, 653,
/
#
# 42 MET HB3 43 TRP H 4.13
&rst
ixpk= 0, nxpk= 0, iat= -1, 665, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
igr1= 652, 653,
/
#
# 42 MET HG3 43 TRP H 4.68
&rst
ixpk= 0, nxpk= 0, iat= -1, 665, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
igr1= 655, 656,
/
#
# 42 MET HG2 43 TRP H 4.68
&rst
ixpk= 0, nxpk= 0, iat= -1, 665, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
igr1= 655, 656,
/
#
# 43 TRP H 46 TYR QB 5.17
&rst
ixpk= 0, nxpk= 0, iat= 665, -1, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
igr2= 730, 731,
/
#
# 39 VAL HA 43 TRP H 4.34
&rst
ixpk= 0, nxpk= 0, iat= 609, 665, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84, /
#
# 43 TRP H 43 TRP HB3 3.09
&rst
ixpk= 0, nxpk= 0, iat= 665, 670, r1= 1.30, r2= 1.80, r3= 3.09, r4= 3.59, /
#
# 43 TRP H 43 TRP HB2 3.38
&rst
ixpk= 0, nxpk= 0, iat= 665, 669, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88, /
#
# 43 TRP H 43 TRP HD1 4.89
&rst
ixpk= 0, nxpk= 0, iat= 665, 673, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39, /
#
# 8 PHE HE 43 TRP H 4.18
&rst
ixpk= 0, nxpk= 0, iat= -1, 665, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,
igr1= 115, 119,
/
#
# 8 PHE HD 43 TRP H 4.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 665, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
igr1= 113, 121,
/
#
# 40 ALA H 43 TRP H 5.15
&rst
ixpk= 0, nxpk= 0, iat= 623, 665, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65, /
#
# 43 TRP HE1 61 LEU H 4.31
&rst
ixpk= 0, nxpk= 0, iat= 675, 991, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81, /
#
# 43 TRP HE1 60 GLY H 4.64
&rst
ixpk= 0, nxpk= 0, iat= 675, 984, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14, /
#
# 43 TRP HE1 83 PHE HE 4.94
&rst
ixpk= 0, nxpk= 0, iat= 675, -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
igr2=1367,1371,
/
#
# 43 TRP HE1 61 LEU HA 4.46
&rst
ixpk= 0, nxpk= 0, iat= 675, 993, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, /
#
# 43 TRP HE1 60 GLY HA2 4.06
&rst
ixpk= 0, nxpk= 0, iat= 675, 986, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56, /
#
# 43 TRP HB2 43 TRP HE1 5.07
&rst
ixpk= 0, nxpk= 0, iat= 669, 675, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, /
#
# 43 TRP HE1 60 GLY HA3 3.97
&rst
ixpk= 0, nxpk= 0, iat= 675, 987, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47, /
#
# 43 TRP HE1 64 MET HG2 4.71
&rst
ixpk= 0, nxpk= 0, iat= 675, -1, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,
igr2=1057,1058,
/
#
# 43 TRP HE1 47 MET HG3 4.58
&rst
ixpk= 0, nxpk= 0, iat= 675, -1, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
igr2= 754, 755,
/
#
# 43 TRP HE1 64 MET HB3 4.07
&rst
ixpk= 0, nxpk= 0, iat= 675, -1, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,
igr2=1054,1055,
/
#
# 43 TRP HE1 90 VAL QG1 4.75
&rst
ixpk= 0, nxpk= 0, iat= 675, -1, r1= 1.30, r2= 1.80, r3= 6.40, r4= 6.90,
igr2=1463,1464,1465,1467,1468,1469,
/
#
# 101 ASP H 101 ASP HB2 3.15
&rst
ixpk= 0, nxpk= 0, iat=1646,1650, r1= 1.30, r2= 1.80, r3= 3.15, r4= 3.65, /
#
# 101 ASP H 101 ASP HB3 3.72
&rst
ixpk= 0, nxpk= 0, iat=1646,1651, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22, /
#
# 101 ASP H 103 LYS H 4.42
&rst
ixpk= 0, nxpk= 0, iat=1646,1677, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92, /
#
# 101 ASP H 104 LYS H 5.05
&rst
ixpk= 0, nxpk= 0, iat=1646,1699, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55, /
#
# 101 ASP H 102 LEU H 3.25
&rst
ixpk= 0, nxpk= 0, iat=1646,1658, r1= 1.30, r2= 1.80, r3= 3.25, r4= 3.75, /
#
# 99 PRO HA 101 ASP H 5.11
&rst
ixpk= 0, nxpk= 0, iat=1618,1646, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61, /
#
# 100 ARG QD 101 ASP H 4.13
&rst
ixpk= 0, nxpk= 0, iat= -1,1646, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
igr1=1632,1633,
/
#
# 101 ASP H 104 LYS QE 5.50
&rst
ixpk= 0, nxpk= 0, iat=1646, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2=1712,1713,
/
#
# 99 PRO HB3 101 ASP H 4.37
&rst
ixpk= 0, nxpk= 0, iat=1616,1646, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87, /
#
# 99 PRO HG3 101 ASP H 4.85
&rst
ixpk= 0, nxpk= 0, iat=1613,1646, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35, /
#
# 99 PRO HG2 101 ASP H 3.41
&rst
ixpk= 0, nxpk= 0, iat=1612,1646, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91, /
#
# 100 ARG HB3 101 ASP H 4.01
&rst
ixpk= 0, nxpk= 0, iat=1627,1646, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51, /
#
# 100 ARG HG2 101 ASP H 3.88
&rst
ixpk= 0, nxpk= 0, iat=1629,1646, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38, /
#
# 100 ARG HG3 101 ASP H 3.88
&rst
ixpk= 0, nxpk= 0, iat=1630,1646, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38, /
#
# 101 ASP H 102 LEU HB2 5.41
&rst
ixpk= 0, nxpk= 0, iat=1646,1662, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91, /
#
# 128 GLU H 128 GLU HG2 3.52
&rst
ixpk= 0, nxpk= 0, iat=2122,2129, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02, /
#
# 128 GLU H 128 GLU HG3 3.52
&rst
ixpk= 0, nxpk= 0, iat=2122,2130, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02, /
#
# 127 ILE H 128 GLU H 3.35
&rst
ixpk= 0, nxpk= 0, iat=2103,2122, r1= 1.30, r2= 1.80, r3= 3.35, r4= 3.85, /
#
# 128 GLU H 130 SER H 4.35
&rst
ixpk= 0, nxpk= 0, iat=2122,2161, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85, /
#
# 125 ASN HA 128 GLU H 3.83
&rst
ixpk= 0, nxpk= 0, iat=2079,2122, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33, /
#
# 128 GLU H 129 ARG QD 5.50
&rst
ixpk= 0, nxpk= 0, iat=2122, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2=2147,2148,
/
#
# 128 GLU H 128 GLU HB3 3.71
&rst
ixpk= 0, nxpk= 0, iat=2122,2127, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21, /
#
# 128 GLU H 129 ARG QG 4.52
&rst
ixpk= 0, nxpk= 0, iat=2122, -1, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
igr2=2144,2145,
/
#
# 88 ALA QB 128 GLU H 5.11
&rst
ixpk= 0, nxpk= 0, iat= -1,2122, r1= 1.30, r2= 1.80, r3= 6.14, r4= 6.64,
igr1=1436,1437,1438,
/
#
# 127 ILE QG2 128 GLU H 3.65
&rst
ixpk= 0, nxpk= 0, iat= -1,2122, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
igr1=2109,2110,2111,
/
#
# 127 ILE QD1 128 GLU H 4.41
&rst
ixpk= 0, nxpk= 0, iat= -1,2122, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr1=2116,2117,2118,
/
#
# 85 LYS H 85 LYS QE 3.62
&rst
ixpk= 0, nxpk= 0, iat=1384, -1, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,
igr2=1397,1398,
/
#
# 83 PHE HB3 85 LYS H 5.50
&rst
ixpk= 0, nxpk= 0, iat=1362,1384, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 85 LYS H 119 PHE HB3 5.44
&rst
ixpk= 0, nxpk= 0, iat=1384,1980, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94, /
#
# 85 LYS H 87 ALA QB 4.46
&rst
ixpk= 0, nxpk= 0, iat=1384, -1, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
igr2=1426,1427,1428,
/
#
# 85 LYS H 85 LYS HG3 3.67
&rst
ixpk= 0, nxpk= 0, iat=1384,1392, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17, /
#
# 85 LYS H 85 LYS HG2 2.77
&rst
ixpk= 0, nxpk= 0, iat=1384,1391, r1= 1.30, r2= 1.80, r3= 2.77, r4= 3.27, /
#
# 85 LYS H 85 LYS HB2 2.89
&rst
ixpk= 0, nxpk= 0, iat=1384,1388, r1= 1.30, r2= 1.80, r3= 2.89, r4= 3.39, /
#
# 83 PHE HB2 85 LYS H 5.50
&rst
ixpk= 0, nxpk= 0, iat=1361,1384, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 84 GLY HA3 85 LYS H 3.32
&rst
ixpk= 0, nxpk= 0, iat=1380,1384, r1= 1.30, r2= 1.80, r3= 3.32, r4= 3.82, /
#
# 83 PHE HA 85 LYS H 4.66
&rst
ixpk= 0, nxpk= 0, iat=1359,1384, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16, /
#
# 81 ASP HA 85 LYS H 4.84
&rst
ixpk= 0, nxpk= 0, iat=1336,1384, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34, /
#
# 85 LYS H 85 LYS HA 2.84
&rst
ixpk= 0, nxpk= 0, iat=1384,1386, r1= 1.30, r2= 1.80, r3= 2.84, r4= 3.34, /
#
# 85 LYS H 86 VAL H 3.01
&rst
ixpk= 0, nxpk= 0, iat=1384,1406, r1= 1.30, r2= 1.80, r3= 3.01, r4= 3.51, /
#
# 83 PHE H 85 LYS H 4.71
&rst
ixpk= 0, nxpk= 0, iat=1357,1384, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21, /
#
# 94 ILE HG13 97 GLU H 5.35
&rst
ixpk= 0, nxpk= 0, iat=1534,1573, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85, /
#
# 94 ILE HB 97 GLU H 5.07
&rst
ixpk= 0, nxpk= 0, iat=1527,1573, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, /
#
# 54 THR QG2 97 GLU H 5.03
&rst
ixpk= 0, nxpk= 0, iat= -1,1573, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54,
igr1= 868, 869, 870,
/
#
# 97 GLU H 97 GLU HB2 4.00
&rst
ixpk= 0, nxpk= 0, iat=1573,1577, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, /
#
# 96 GLN HB2 97 GLU H 3.38
&rst
ixpk= 0, nxpk= 0, iat=1560,1573, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88, /
#
# 96 GLN HG3 97 GLU H 4.25
&rst
ixpk= 0, nxpk= 0, iat=1564,1573, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75, /
#
# 95 ASN QB 97 GLU H 4.95
&rst
ixpk= 0, nxpk= 0, iat= -1,1573, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
igr1=1546,1547,
/
#
# 97 GLU H 98 PHE HB2 4.03
&rst
ixpk= 0, nxpk= 0, iat=1573,1592, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53, /
#
# 94 ILE HA 97 GLU H 3.55
&rst
ixpk= 0, nxpk= 0, iat=1525,1573, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05, /
#
# 95 ASN H 97 GLU H 4.21
&rst
ixpk= 0, nxpk= 0, iat=1542,1573, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71, /
#
# 97 GLU H 98 PHE H 2.85
&rst
ixpk= 0, nxpk= 0, iat=1573,1588, r1= 1.30, r2= 1.80, r3= 2.85, r4= 3.35, /
#
# 94 ILE H 97 GLU H 5.45
&rst
ixpk= 0, nxpk= 0, iat=1523,1573, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95, /
#
# 105 LYS H 108 ARG H 5.08
&rst
ixpk= 0, nxpk= 0, iat=1721,1773, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58, /
#
# 102 LEU H 105 LYS H 5.12
&rst
ixpk= 0, nxpk= 0, iat=1658,1721, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, /
#
# 102 LEU HA 105 LYS H 3.55
&rst
ixpk= 0, nxpk= 0, iat=1660,1721, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05, /
#
# 101 ASP HA 105 LYS H 4.87
&rst
ixpk= 0, nxpk= 0, iat=1648,1721, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37, /
#
# 105 LYS H 105 LYS QE 4.70
&rst
ixpk= 0, nxpk= 0, iat=1721, -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
igr2=1734,1735,
/
#
# 105 LYS H 105 LYS HG2 3.07
&rst
ixpk= 0, nxpk= 0, iat=1721,1728, r1= 1.30, r2= 1.80, r3= 3.07, r4= 3.57, /
#
# 105 LYS H 105 LYS HG3 3.07
&rst
ixpk= 0, nxpk= 0, iat=1721,1729, r1= 1.30, r2= 1.80, r3= 3.07, r4= 3.57, /
#
# 104 LYS QB 105 LYS H 2.93
&rst
ixpk= 0, nxpk= 0, iat= -1,1721, r1= 1.30, r2= 1.80, r3= 3.29, r4= 3.79,
igr1=1703,1704,
/
#
# 105 LYS H 105 LYS QB 3.04
&rst
ixpk= 0, nxpk= 0, iat=1721, -1, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91,
igr2=1725,1726,
/
#
# 105 LYS H 106 LEU HB3 4.75
&rst
ixpk= 0, nxpk= 0, iat=1721,1748, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, /
#
# 101 ASP HB3 105 LYS H 5.50
&rst
ixpk= 0, nxpk= 0, iat=1651,1721, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 102 LEU HB3 105 LYS H 5.47
&rst
ixpk= 0, nxpk= 0, iat=1663,1721, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97, /
#
# 98 PHE HD 105 LYS H 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1721, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1=1596,1604,
/
#
# 122 GLN HNE2 123 VAL H 5.50
&rst
ixpk= 0, nxpk= 0, iat=2041,2045, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 120 SER HB3 123 VAL H 4.46
&rst
ixpk= 0, nxpk= 0, iat=2000,2045, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, /
#
# 120 SER HB2 123 VAL H 4.46
&rst
ixpk= 0, nxpk= 0, iat=1999,2045, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, /
#
# 85 LYS QE 123 VAL H 4.81
&rst
ixpk= 0, nxpk= 0, iat= -1,2045, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr1=1397,1398,
/
#
# 119 PHE HB3 123 VAL H 4.98
&rst
ixpk= 0, nxpk= 0, iat=1980,2045, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48, /
#
# 122 GLN HG2 123 VAL H 3.76
&rst
ixpk= 0, nxpk= 0, iat=2035,2045, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26, /
#
# 123 VAL H 123 VAL HB 3.04
&rst
ixpk= 0, nxpk= 0, iat=2045,2049, r1= 1.30, r2= 1.80, r3= 3.04, r4= 3.54, /
#
# 122 GLN HB2 123 VAL H 3.62
&rst
ixpk= 0, nxpk= 0, iat=2032,2045, r1= 1.30, r2= 1.80, r3= 3.62, r4= 4.12, /
#
# 85 LYS QD 123 VAL H 4.94
&rst
ixpk= 0, nxpk= 0, iat= -1,2045, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
igr1=1394,1395,
/
#
# 121 LYS HG2 123 VAL H 5.50
&rst
ixpk= 0, nxpk= 0, iat=2013,2045, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 123 VAL H 123 VAL QG2 3.83
&rst
ixpk= 0, nxpk= 0, iat=2045, -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
igr2=2051,2052,2053,2055,2056,2057,
/
#
# 102 LEU H 103 LYS H 3.07
&rst
ixpk= 0, nxpk= 0, iat=1658,1677, r1= 1.30, r2= 1.80, r3= 3.07, r4= 3.57, /
#
# 99 PRO HA 102 LEU H 5.45
&rst
ixpk= 0, nxpk= 0, iat=1618,1658, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95, /
#
# 98 PHE HB3 102 LEU H 4.68
&rst
ixpk= 0, nxpk= 0, iat=1593,1658, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18, /
#
# 101 ASP HB3 102 LEU H 3.66
&rst
ixpk= 0, nxpk= 0, iat=1651,1658, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16, /
#
# 101 ASP HB2 102 LEU H 3.62
&rst
ixpk= 0, nxpk= 0, iat=1650,1658, r1= 1.30, r2= 1.80, r3= 3.62, r4= 4.12, /
#
# 99 PRO HB2 102 LEU H 4.08
&rst
ixpk= 0, nxpk= 0, iat=1615,1658, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58, /
#
# 99 PRO HG3 102 LEU H 4.15
&rst
ixpk= 0, nxpk= 0, iat=1613,1658, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65, /
#
# 99 PRO HG2 102 LEU H 3.23
&rst
ixpk= 0, nxpk= 0, iat=1612,1658, r1= 1.30, r2= 1.80, r3= 3.23, r4= 3.73, /
#
# 102 LEU H 102 LEU HB2 3.30
&rst
ixpk= 0, nxpk= 0, iat=1658,1662, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80, /
#
# 102 LEU H 102 LEU HB3 3.74
&rst
ixpk= 0, nxpk= 0, iat=1658,1663, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24, /
#
# 102 LEU H 102 LEU QD2 4.11
&rst
ixpk= 0, nxpk= 0, iat=1658, -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
igr2=1667,1668,1669,1671,1672,1673,
/
#
# 102 LEU H 102 LEU HG 3.72
&rst
ixpk= 0, nxpk= 0, iat=1658,1665, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22, /
#
# 91 LEU H 93 ARG H 4.85
&rst
ixpk= 0, nxpk= 0, iat=1473,1499, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35, /
#
# 93 ARG H 94 ILE H 3.12
&rst
ixpk= 0, nxpk= 0, iat=1499,1523, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62, /
#
# 92 GLY H 93 ARG H 3.04
&rst
ixpk= 0, nxpk= 0, iat=1492,1499, r1= 1.30, r2= 1.80, r3= 3.04, r4= 3.54, /
#
# 93 ARG H 96 GLN H 5.31
&rst
ixpk= 0, nxpk= 0, iat=1499,1556, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81, /
#
# 92 GLY HA3 93 ARG H 3.15
&rst
ixpk= 0, nxpk= 0, iat=1495,1499, r1= 1.30, r2= 1.80, r3= 3.15, r4= 3.65, /
#
# 90 VAL HA 93 ARG H 4.07
&rst
ixpk= 0, nxpk= 0, iat=1459,1499, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57, /
#
# 93 ARG H 96 GLN HG2 5.44
&rst
ixpk= 0, nxpk= 0, iat=1499,1563, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94, /
#
# 93 ARG H 95 ASN QB 4.61
&rst
ixpk= 0, nxpk= 0, iat=1499, -1, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67,
igr2=1546,1547,
/
#
# 93 ARG H 96 GLN HG3 4.64
&rst
ixpk= 0, nxpk= 0, iat=1499,1564, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14, /
#
# 93 ARG H 93 ARG QB 2.94
&rst
ixpk= 0, nxpk= 0, iat=1499, -1, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80,
igr2=1503,1504,
/
#
# 93 ARG H 93 ARG QG 3.05
&rst
ixpk= 0, nxpk= 0, iat=1499, -1, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92,
igr2=1506,1507,
/
#
# 93 ARG H 94 ILE HG12 4.53
&rst
ixpk= 0, nxpk= 0, iat=1499,1533, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03, /
#
# 66 HIS HA 69 GLN H 4.73
&rst
ixpk= 0, nxpk= 0, iat=1083,1130, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, /
#
# 68 VAL HB 69 GLN H 3.86
&rst
ixpk= 0, nxpk= 0, iat=1118,1130, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, /
#
# 68 VAL QG2 69 GLN H 4.14
&rst
ixpk= 0, nxpk= 0, iat= -1,1130, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr1=1120,1121,1122,1124,1125,1126,
/
#
# 104 LYS H 104 LYS QB 2.66
&rst
ixpk= 0, nxpk= 0, iat=1699, -1, r1= 1.30, r2= 1.80, r3= 2.99, r4= 3.49,
igr2=1703,1704,
/
#
# 104 LYS H 104 LYS QD 3.56
&rst
ixpk= 0, nxpk= 0, iat=1699, -1, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,
igr2=1709,1710,
/
#
# 103 LYS QB 104 LYS H 3.09
&rst
ixpk= 0, nxpk= 0, iat= -1,1699, r1= 1.30, r2= 1.80, r3= 3.47, r4= 3.97,
igr1=1681,1682,
/
#
# 102 LEU HB2 104 LYS H 5.09
&rst
ixpk= 0, nxpk= 0, iat=1662,1699, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59, /
#
# 101 ASP HB2 104 LYS H 5.50
&rst
ixpk= 0, nxpk= 0, iat=1650,1699, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 104 LYS H 104 LYS QE 4.82
&rst
ixpk= 0, nxpk= 0, iat=1699, -1, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,
igr2=1712,1713,
/
#
# 103 LYS QE 104 LYS H 4.56
&rst
ixpk= 0, nxpk= 0, iat= -1,1699, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
igr1=1690,1691,
/
#
# 100 ARG HA 104 LYS H 4.23
&rst
ixpk= 0, nxpk= 0, iat=1624,1699, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73, /
#
# 101 ASP HA 104 LYS H 4.18
&rst
ixpk= 0, nxpk= 0, iat=1648,1699, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68, /
#
# 102 LEU H 104 LYS H 4.62
&rst
ixpk= 0, nxpk= 0, iat=1658,1699, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12, /
#
# 104 LYS H 105 LYS H 3.13
&rst
ixpk= 0, nxpk= 0, iat=1699,1721, r1= 1.30, r2= 1.80, r3= 3.13, r4= 3.63, /
#
# 103 LYS H 104 LYS H 3.33
&rst
ixpk= 0, nxpk= 0, iat=1677,1699, r1= 1.30, r2= 1.80, r3= 3.33, r4= 3.83, /
#
# 109 VAL H 109 VAL QG2 3.86
&rst
ixpk= 0, nxpk= 0, iat=1797, -1, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
igr2=1803,1804,1805,1807,1808,1809,
/
#
# 109 VAL H 112 ILE QD1 4.38
&rst
ixpk= 0, nxpk= 0, iat=1797, -1, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr2=1856,1857,1858,
/
#
# 108 ARG QG 109 VAL H 4.53
&rst
ixpk= 0, nxpk= 0, iat= -1,1797, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
igr1=1780,1781,
/
#
# 108 ARG HB3 109 VAL H 3.75
&rst
ixpk= 0, nxpk= 0, iat=1778,1797, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25, /
#
# 108 ARG HB2 109 VAL H 3.75
&rst
ixpk= 0, nxpk= 0, iat=1777,1797, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25, /
#
# 109 VAL H 109 VAL HB 3.31
&rst
ixpk= 0, nxpk= 0, iat=1797,1801, r1= 1.30, r2= 1.80, r3= 3.31, r4= 3.81, /
#
# 95 ASN H 95 ASN QB 2.93
&rst
ixpk= 0, nxpk= 0, iat=1542, -1, r1= 1.30, r2= 1.80, r3= 3.29, r4= 3.79,
igr2=1546,1547,
/
#
# 93 ARG H 95 ASN H 3.93
&rst
ixpk= 0, nxpk= 0, iat=1499,1542, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43, /
#
# 94 ILE HA 95 ASN H 3.53
&rst
ixpk= 0, nxpk= 0, iat=1525,1542, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03, /
#
# 92 GLY HA2 95 ASN H 4.00
&rst
ixpk= 0, nxpk= 0, iat=1494,1542, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, /
#
# 95 ASN H 98 PHE HB2 4.88
&rst
ixpk= 0, nxpk= 0, iat=1542,1592, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38, /
#
# 94 ILE HG12 95 ASN H 3.51
&rst
ixpk= 0, nxpk= 0, iat=1533,1542, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01, /
#
# 94 ILE HB 95 ASN H 4.24
&rst
ixpk= 0, nxpk= 0, iat=1527,1542, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74, /
#
# 76 ILE QD1 77 ILE H 4.25
&rst
ixpk= 0, nxpk= 0, iat= -1,1261, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
igr1=1255,1256,1257,
/
#
# 77 ILE H 77 ILE QG2 2.81
&rst
ixpk= 0, nxpk= 0, iat=1261, -1, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87,
igr2=1267,1268,1269,
/
#
# 77 ILE H 77 ILE HG13 3.10
&rst
ixpk= 0, nxpk= 0, iat=1261,1272, r1= 1.30, r2= 1.80, r3= 3.10, r4= 3.60, /
#
# 77 ILE H 77 ILE HG12 3.26
&rst
ixpk= 0, nxpk= 0, iat=1261,1271, r1= 1.30, r2= 1.80, r3= 3.26, r4= 3.76, /
#
# 77 ILE H 80 GLN HG2 4.87
&rst
ixpk= 0, nxpk= 0, iat=1261,1324, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37, /
#
# 77 ILE H 81 ASP QB 5.50
&rst
ixpk= 0, nxpk= 0, iat=1261, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2=1338,1339,
/
#
# 76 ILE HA 77 ILE H 2.81
&rst
ixpk= 0, nxpk= 0, iat=1244,1261, r1= 1.30, r2= 1.80, r3= 2.81, r4= 3.31, /
#
# 76 ILE H 77 ILE H 4.04
&rst
ixpk= 0, nxpk= 0, iat=1242,1261, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, /
#
# 77 ILE H 78 GLN HNE1 4.45
&rst
ixpk= 0, nxpk= 0, iat=1261,1292, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95, /
#
# 72 LYS HA 77 ILE H 5.50
&rst
ixpk= 0, nxpk= 0, iat=1176,1261, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 75 LYS HA 77 ILE H 4.75
&rst
ixpk= 0, nxpk= 0, iat=1222,1261, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, /
#
# 72 LYS H 73 GLY H 3.69
&rst
ixpk= 0, nxpk= 0, iat=1174,1196, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19, /
#
# 71 ALA H 72 LYS H 3.85
&rst
ixpk= 0, nxpk= 0, iat=1164,1174, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35, /
#
# 69 GLN HA 72 LYS H 4.18
&rst
ixpk= 0, nxpk= 0, iat=1132,1174, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68, /
#
# 68 VAL HA 72 LYS H 4.72
&rst
ixpk= 0, nxpk= 0, iat=1116,1174, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22, /
#
# 72 LYS H 118 ILE HA 5.50
&rst
ixpk= 0, nxpk= 0, iat=1174,1958, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 72 LYS H 72 LYS HB3 3.57
&rst
ixpk= 0, nxpk= 0, iat=1174,1179, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07, /
#
# 72 LYS H 72 LYS HB2 3.57
&rst
ixpk= 0, nxpk= 0, iat=1174,1178, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07, /
#
# 71 ALA QB 72 LYS H 3.27
&rst
ixpk= 0, nxpk= 0, iat= -1,1174, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
igr1=1168,1169,1170,
/
#
# 72 LYS H 72 LYS QG 3.99
&rst
ixpk= 0, nxpk= 0, iat=1174, -1, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
igr2=1181,1182,
/
#
# 72 LYS H 118 ILE QD1 4.36
&rst
ixpk= 0, nxpk= 0, iat=1174, -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr2=1969,1970,1971,
/
#
# 72 LYS H 118 ILE QG2 4.56
&rst
ixpk= 0, nxpk= 0, iat=1174, -1, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
igr2=1962,1963,1964,
/
#
# 127 ILE H 127 ILE HG13 3.61
&rst
ixpk= 0, nxpk= 0, iat=2103,2114, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11, /
#
# 127 ILE H 127 ILE QG2 3.92
&rst
ixpk= 0, nxpk= 0, iat=2103, -1, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
igr2=2109,2110,2111,
/
#
# 88 ALA QB 127 ILE H 3.41
&rst
ixpk= 0, nxpk= 0, iat= -1,2103, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,
igr1=1436,1437,1438,
/
#
# 127 ILE H 127 ILE HB 3.20
&rst
ixpk= 0, nxpk= 0, iat=2103,2107, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, /
#
# 127 ILE H 127 ILE HG12 3.61
&rst
ixpk= 0, nxpk= 0, iat=2103,2113, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11, /
#
# 126 ASP HB2 127 ILE H 3.71
&rst
ixpk= 0, nxpk= 0, iat=2095,2103, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21, /
#
# 125 ASN HB2 127 ILE H 5.50
&rst
ixpk= 0, nxpk= 0, iat=2081,2103, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 126 ASP HB3 127 ILE H 3.71
&rst
ixpk= 0, nxpk= 0, iat=2096,2103, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21, /
#
# 123 VAL HA 127 ILE H 4.45
&rst
ixpk= 0, nxpk= 0, iat=2047,2103, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95, /
#
# 88 ALA HA 127 ILE H 4.04
&rst
ixpk= 0, nxpk= 0, iat=1434,2103, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, /
#
# 106 LEU H 107 SER H 3.09
&rst
ixpk= 0, nxpk= 0, iat=1743,1762, r1= 1.30, r2= 1.80, r3= 3.09, r4= 3.59, /
#
# 107 SER H 108 ARG H 3.16
&rst
ixpk= 0, nxpk= 0, iat=1762,1773, r1= 1.30, r2= 1.80, r3= 3.16, r4= 3.66, /
#
# 105 LYS H 107 SER H 4.59
&rst
ixpk= 0, nxpk= 0, iat=1721,1762, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, /
#
# 98 PHE HD 107 SER H 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1762, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1=1596,1604,
/
#
# 107 SER H 107 SER HA 2.84
&rst
ixpk= 0, nxpk= 0, iat=1762,1764, r1= 1.30, r2= 1.80, r3= 2.84, r4= 3.34, /
#
# 103 LYS HA 107 SER H 4.31
&rst
ixpk= 0, nxpk= 0, iat=1679,1762, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81, /
#
# 106 LEU HB3 107 SER H 3.37
&rst
ixpk= 0, nxpk= 0, iat=1748,1762, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87, /
#
# 106 LEU HB2 107 SER H 4.11
&rst
ixpk= 0, nxpk= 0, iat=1747,1762, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, /
#
# 106 LEU HG 107 SER H 3.98
&rst
ixpk= 0, nxpk= 0, iat=1750,1762, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48, /
#
# 65 ASN H 65 ASN HB2 3.90
&rst
ixpk= 0, nxpk= 0, iat=1067,1071, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40, /
#
# 65 ASN H 65 ASN HB3 3.90
&rst
ixpk= 0, nxpk= 0, iat=1067,1072, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40, /
#
# 65 ASN H 66 HIS H 3.80
&rst
ixpk= 0, nxpk= 0, iat=1067,1081, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30, /
#
# 64 MET H 65 ASN H 3.50
&rst
ixpk= 0, nxpk= 0, iat=1050,1067, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, /
#
# 43 TRP HZ2 65 ASN H 5.41
&rst
ixpk= 0, nxpk= 0, iat= 678,1067, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91, /
#
# 62 TYR HD 65 ASN H 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1067, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1=1018,1027,
/
#
# 62 TYR HA 65 ASN H 4.45
&rst
ixpk= 0, nxpk= 0, iat=1012,1067, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95, /
#
# 64 MET HG2 65 ASN H 3.95
&rst
ixpk= 0, nxpk= 0, iat= -1,1067, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
igr1=1057,1058,
/
#
# 64 MET QE 65 ASN H 4.66
&rst
ixpk= 0, nxpk= 0, iat= -1,1067, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
igr1=1061,1062,1063,
/
#
# 63 LEU HG 65 ASN H 5.35
&rst
ixpk= 0, nxpk= 0, iat=1038,1067, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85, /
#
# 65 ASN H 109 VAL QG1 5.50
&rst
ixpk= 0, nxpk= 0, iat=1067, -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr2=1803,1804,1805,1807,1808,1809,
/
#
# 64 MET HG3 65 ASN H 3.71
&rst
ixpk= 0, nxpk= 0, iat= -1,1067, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
igr1=1057,1058,
/
#
# 65 ASN H 109 VAL QG2 5.50
&rst
ixpk= 0, nxpk= 0, iat=1067, -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr2=1803,1804,1805,1807,1808,1809,
/
#
# 64 MET HB3 65 ASN H 4.01
&rst
ixpk= 0, nxpk= 0, iat= -1,1067, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
igr1=1054,1055,
/
#
# 22 ILE QG2 65 ASN H 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1067, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 328, 329, 330,
/
#
# 82 SER H 83 PHE H 3.51
&rst
ixpk= 0, nxpk= 0, iat=1346,1357, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01, /
#
# 83 PHE H 84 GLY H 3.34
&rst
ixpk= 0, nxpk= 0, iat=1357,1377, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84, /
#
# 83 PHE H 83 PHE HD 3.58
&rst
ixpk= 0, nxpk= 0, iat=1357, -1, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,
igr2=1365,1373,
/
#
# 83 PHE H 83 PHE HE 5.39
&rst
ixpk= 0, nxpk= 0, iat=1357, -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
igr2=1367,1371,
/
#
# 80 GLN HA 83 PHE H 4.56
&rst
ixpk= 0, nxpk= 0, iat=1319,1357, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06, /
#
# 83 PHE H 83 PHE HB3 3.70
&rst
ixpk= 0, nxpk= 0, iat=1357,1362, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20, /
#
# 83 PHE H 83 PHE HB2 3.51
&rst
ixpk= 0, nxpk= 0, iat=1357,1361, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01, /
#
# 79 PHE HB3 83 PHE H 4.99
&rst
ixpk= 0, nxpk= 0, iat=1302,1357, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49, /
#
# 64 MET QE 83 PHE H 4.88
&rst
ixpk= 0, nxpk= 0, iat= -1,1357, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
igr1=1061,1062,1063,
/
#
# 83 PHE H 85 LYS HG2 5.37
&rst
ixpk= 0, nxpk= 0, iat=1357,1391, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87, /
#
# 83 PHE H 86 VAL QG2 4.09
&rst
ixpk= 0, nxpk= 0, iat=1357, -1, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
igr2=1412,1413,1414,1416,1417,1418,
/
#
# 36 ALA QB 83 PHE H 4.97
&rst
ixpk= 0, nxpk= 0, iat= -1,1357, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr1= 565, 566, 567,
/
#
# 67 VAL H 68 VAL H 3.49
&rst
ixpk= 0, nxpk= 0, iat=1098,1114, r1= 1.30, r2= 1.80, r3= 3.49, r4= 3.99, /
#
# 66 HIS H 67 VAL H 3.97
&rst
ixpk= 0, nxpk= 0, iat=1081,1098, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47, /
#
# 67 VAL H 69 GLN H 4.43
&rst
ixpk= 0, nxpk= 0, iat=1098,1130, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93, /
#
# 66 HIS HD2 67 VAL H 4.90
&rst
ixpk= 0, nxpk= 0, iat=1094,1098, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40, /
#
# 63 LEU HA 67 VAL H 4.50
&rst
ixpk= 0, nxpk= 0, iat=1033,1098, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, /
#
# 65 ASN HA 67 VAL H 5.30
&rst
ixpk= 0, nxpk= 0, iat=1069,1098, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80, /
#
# 66 HIS HB3 67 VAL H 4.15
&rst
ixpk= 0, nxpk= 0, iat=1086,1098, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65, /
#
# 66 HIS HB2 67 VAL H 4.15
&rst
ixpk= 0, nxpk= 0, iat=1085,1098, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65, /
#
# 64 MET HA 67 VAL H 4.15
&rst
ixpk= 0, nxpk= 0, iat=1052,1098, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65, /
#
# 67 VAL H 67 VAL HB 3.28
&rst
ixpk= 0, nxpk= 0, iat=1098,1102, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78, /
#
# 67 VAL H 67 VAL QG1 3.79
&rst
ixpk= 0, nxpk= 0, iat=1098, -1, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,
igr2=1104,1105,1106,1108,1109,1110,
/
#
# 67 VAL H 67 VAL QG2 3.79
&rst
ixpk= 0, nxpk= 0, iat=1098, -1, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,
igr2=1104,1105,1106,1108,1109,1110,
/
#
# 63 LEU HG 67 VAL H 4.79
&rst
ixpk= 0, nxpk= 0, iat=1038,1098, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29, /
#
# 130 SER H 130 SER HB2 3.40
&rst
ixpk= 0, nxpk= 0, iat=2161,2165, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90, /
#
# 130 SER H 130 SER HB3 3.40
&rst
ixpk= 0, nxpk= 0, iat=2161,2166, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90, /
#
# 129 ARG H 130 SER H 2.96
&rst
ixpk= 0, nxpk= 0, iat=2137,2161, r1= 1.30, r2= 1.80, r3= 2.96, r4= 3.46, /
#
# 127 ILE H 130 SER H 4.91
&rst
ixpk= 0, nxpk= 0, iat=2103,2161, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41, /
#
# 130 SER H 133 ALA H 4.93
&rst
ixpk= 0, nxpk= 0, iat=2161,2201, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43, /
#
# 130 SER H 132 ALA H 4.61
&rst
ixpk= 0, nxpk= 0, iat=2161,2191, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, /
#
# 126 ASP HA 130 SER H 4.64
&rst
ixpk= 0, nxpk= 0, iat=2093,2161, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14, /
#
# 129 ARG HA 130 SER H 3.55
&rst
ixpk= 0, nxpk= 0, iat=2139,2161, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05, /
#
# 92 GLY HA2 130 SER H 5.50
&rst
ixpk= 0, nxpk= 0, iat=1494,2161, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 127 ILE HA 130 SER H 3.82
&rst
ixpk= 0, nxpk= 0, iat=2105,2161, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32, /
#
# 129 ARG HB2 130 SER H 2.87
&rst
ixpk= 0, nxpk= 0, iat=2141,2161, r1= 1.30, r2= 1.80, r3= 2.87, r4= 3.37, /
#
# 129 ARG QG 130 SER H 3.73
&rst
ixpk= 0, nxpk= 0, iat= -1,2161, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
igr1=2144,2145,
/
#
# 130 SER H 131 LEU QD2 4.53
&rst
ixpk= 0, nxpk= 0, iat=2161, -1, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
igr2=2181,2182,2183,2185,2186,2187,
/
#
# 130 SER H 131 LEU QD1 4.53
&rst
ixpk= 0, nxpk= 0, iat=2161, -1, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
igr2=2181,2182,2183,2185,2186,2187,
/
#
# 119 PHE H 120 SER H 4.68
&rst
ixpk= 0, nxpk= 0, iat=1975,1995, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18, /
#
# 118 ILE H 119 PHE H 3.25
&rst
ixpk= 0, nxpk= 0, iat=1956,1975, r1= 1.30, r2= 1.80, r3= 3.25, r4= 3.75, /
#
# 119 PHE H 119 PHE HD 3.43
&rst
ixpk= 0, nxpk= 0, iat=1975, -1, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35,
igr2=1983,1991,
/
#
# 117 ASN HA 119 PHE H 4.02
&rst
ixpk= 0, nxpk= 0, iat=1944,1975, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52, /
#
# 119 PHE H 120 SER HA 5.50
&rst
ixpk= 0, nxpk= 0, iat=1975,1997, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 114 LYS HA 119 PHE H 4.70
&rst
ixpk= 0, nxpk= 0, iat=1883,1975, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, /
#
# 119 PHE H 119 PHE HB2 3.52
&rst
ixpk= 0, nxpk= 0, iat=1975,1979, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02, /
#
# 119 PHE H 119 PHE HB3 3.90
&rst
ixpk= 0, nxpk= 0, iat=1975,1980, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40, /
#
# 113 LEU HG 119 PHE H 4.02
&rst
ixpk= 0, nxpk= 0, iat=1869,1975, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52, /
#
# 72 LYS QD 119 PHE H 5.45
&rst
ixpk= 0, nxpk= 0, iat= -1,1975, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,
igr1=1184,1185,
/
#
# 118 ILE HG12 119 PHE H 4.11
&rst
ixpk= 0, nxpk= 0, iat=1966,1975, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, /
#
# 118 ILE HB 119 PHE H 3.40
&rst
ixpk= 0, nxpk= 0, iat=1960,1975, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90, /
#
# 113 LEU QD2 119 PHE H 4.04
&rst
ixpk= 0, nxpk= 0, iat= -1,1975, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,
igr1=1871,1872,1873,1875,1876,1877,
/
#
# 113 LEU QD1 119 PHE H 4.04
&rst
ixpk= 0, nxpk= 0, iat= -1,1975, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,
igr1=1871,1872,1873,1875,1876,1877,
/
#
# 118 ILE QG2 119 PHE H 4.01
&rst
ixpk= 0, nxpk= 0, iat= -1,1975, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
igr1=1962,1963,1964,
/
#
# 111 ASN HND1 112 ILE H 4.79
&rst
ixpk= 0, nxpk= 0, iat=1838,1843, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19, /
#
# 109 VAL HA 112 ILE H 4.14
&rst
ixpk= 0, nxpk= 0, iat=1799,1843, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64, /
#
# 110 VAL HA 112 ILE H 5.27
&rst
ixpk= 0, nxpk= 0, iat=1815,1843, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77, /
#
# 111 ASN HB3 112 ILE H 3.83
&rst
ixpk= 0, nxpk= 0, iat=1834,1843, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33, /
#
# 111 ASN HB2 112 ILE H 3.83
&rst
ixpk= 0, nxpk= 0, iat=1833,1843, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33, /
#
# 112 ILE H 112 ILE HB 3.47
&rst
ixpk= 0, nxpk= 0, iat=1843,1847, r1= 1.30, r2= 1.80, r3= 3.47, r4= 3.97, /
#
# 112 ILE H 112 ILE HG12 4.37
&rst
ixpk= 0, nxpk= 0, iat=1843,1853, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87, /
#
# 112 ILE H 112 ILE HG13 4.37
&rst
ixpk= 0, nxpk= 0, iat=1843,1854, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87, /
#
# 112 ILE H 112 ILE QD1 3.35
&rst
ixpk= 0, nxpk= 0, iat=1843, -1, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,
igr2=1856,1857,1858,
/
#
# 40 ALA H 41 GLU H 3.32
&rst
ixpk= 0, nxpk= 0, iat= 623, 633, r1= 1.30, r2= 1.80, r3= 3.32, r4= 3.82, /
#
# 41 GLU H 44 LYS H 5.29
&rst
ixpk= 0, nxpk= 0, iat= 633, 689, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79, /
#
# 41 GLU H 43 TRP H 4.38
&rst
ixpk= 0, nxpk= 0, iat= 633, 665, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88, /
#
# 38 LYS H 41 GLU H 5.04
&rst
ixpk= 0, nxpk= 0, iat= 585, 633, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54, /
#
# 41 GLU H 41 GLU QB 2.76
&rst
ixpk= 0, nxpk= 0, iat= 633, -1, r1= 1.30, r2= 1.80, r3= 3.10, r4= 3.60,
igr2= 637, 638,
/
#
# 38 LYS QD 41 GLU H 4.56
&rst
ixpk= 0, nxpk= 0, iat= -1, 633, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
igr1= 595, 596,
/
#
# 41 GLU H 86 VAL QG2 5.10
&rst
ixpk= 0, nxpk= 0, iat= 633, -1, r1= 1.30, r2= 1.80, r3= 6.87, r4= 7.37,
igr2=1412,1413,1414,1416,1417,1418,
/
#
# 41 GLU H 86 VAL QG1 4.17
&rst
ixpk= 0, nxpk= 0, iat= 633, -1, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
igr2=1412,1413,1414,1416,1417,1418,
/
#
# 39 VAL QG2 41 GLU H 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 633, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr1= 613, 614, 615, 617, 618, 619,
/
#
# 40 ALA QB 41 GLU H 3.16
&rst
ixpk= 0, nxpk= 0, iat= -1, 633, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,
igr1= 627, 628, 629,
/
#
# 39 VAL QG1 41 GLU H 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 633, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr1= 613, 614, 615, 617, 618, 619,
/
#
# 77 ILE HA 81 ASP H 4.18
&rst
ixpk= 0, nxpk= 0, iat=1263,1334, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68, /
#
# 78 GLN HA 81 ASP H 4.75
&rst
ixpk= 0, nxpk= 0, iat=1282,1334, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, /
#
# 81 ASP H 81 ASP QB 2.97
&rst
ixpk= 0, nxpk= 0, iat=1334, -1, r1= 1.30, r2= 1.80, r3= 3.33, r4= 3.83,
igr2=1338,1339,
/
#
# 80 GLN HG2 81 ASP H 3.48
&rst
ixpk= 0, nxpk= 0, iat=1324,1334, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98, /
#
# 78 GLN HB2 81 ASP H 5.50
&rst
ixpk= 0, nxpk= 0, iat=1284,1334, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 77 ILE QG2 81 ASP H 5.21
&rst
ixpk= 0, nxpk= 0, iat= -1,1334, r1= 1.30, r2= 1.80, r3= 6.26, r4= 6.76,
igr1=1267,1268,1269,
/
#
# 122 GLN H 123 VAL H 3.23
&rst
ixpk= 0, nxpk= 0, iat=2028,2045, r1= 1.30, r2= 1.80, r3= 3.23, r4= 3.73, /
#
# 122 GLN H 122 GLN HNE2 4.81
&rst
ixpk= 0, nxpk= 0, iat=2028,2041, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31, /
#
# 120 SER HB3 122 GLN H 4.01
&rst
ixpk= 0, nxpk= 0, iat=2000,2028, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51, /
#
# 120 SER HB2 122 GLN H 4.01
&rst
ixpk= 0, nxpk= 0, iat=1999,2028, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51, /
#
# 122 GLN H 123 VAL HA 5.50
&rst
ixpk= 0, nxpk= 0, iat=2028,2047, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 121 LYS QE 122 GLN H 5.43
&rst
ixpk= 0, nxpk= 0, iat= -1,2028, r1= 1.30, r2= 1.80, r3= 6.09, r4= 6.59,
igr1=2019,2020,
/
#
# 122 GLN H 122 GLN HG2 3.46
&rst
ixpk= 0, nxpk= 0, iat=2028,2035, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96, /
#
# 122 GLN H 122 GLN HB3 2.88
&rst
ixpk= 0, nxpk= 0, iat=2028,2033, r1= 1.30, r2= 1.80, r3= 2.88, r4= 3.38, /
#
# 121 LYS QD 122 GLN H 4.46
&rst
ixpk= 0, nxpk= 0, iat= -1,2028, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
igr1=2016,2017,
/
#
# 121 LYS HG2 122 GLN H 3.94
&rst
ixpk= 0, nxpk= 0, iat=2013,2028, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44, /
#
# 121 LYS HG3 122 GLN H 4.17
&rst
ixpk= 0, nxpk= 0, iat=2014,2028, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67, /
#
# 115 GLU H 115 GLU HA 2.93
&rst
ixpk= 0, nxpk= 0, iat=1903,1905, r1= 1.30, r2= 1.80, r3= 2.93, r4= 3.43, /
#
# 114 LYS H 115 GLU H 3.14
&rst
ixpk= 0, nxpk= 0, iat=1881,1903, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64, /
#
# 112 ILE H 115 GLU H 5.10
&rst
ixpk= 0, nxpk= 0, iat=1843,1903, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, /
#
# 115 GLU H 116 ARG H 3.01
&rst
ixpk= 0, nxpk= 0, iat=1903,1918, r1= 1.30, r2= 1.80, r3= 3.01, r4= 3.51, /
#
# 112 ILE HA 115 GLU H 3.78
&rst
ixpk= 0, nxpk= 0, iat=1845,1903, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28, /
#
# 114 LYS QE 115 GLU H 4.28
&rst
ixpk= 0, nxpk= 0, iat= -1,1903, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1=1894,1895,
/
#
# 115 GLU H 115 GLU HB3 3.45
&rst
ixpk= 0, nxpk= 0, iat=1903,1908, r1= 1.30, r2= 1.80, r3= 3.45, r4= 3.95, /
#
# 115 GLU H 115 GLU HB2 3.45
&rst
ixpk= 0, nxpk= 0, iat=1903,1907, r1= 1.30, r2= 1.80, r3= 3.45, r4= 3.95, /
#
# 114 LYS HB2 115 GLU H 3.70
&rst
ixpk= 0, nxpk= 0, iat=1885,1903, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40, /
#
# 114 LYS HG2 115 GLU H 3.42
&rst
ixpk= 0, nxpk= 0, iat=1888,1903, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92, /
#
# 76 ILE H 76 ILE HG12 3.73
&rst
ixpk= 0, nxpk= 0, iat=1242,1252, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23, /
#
# 114 LYS HG3 115 GLU H 3.59
&rst
ixpk= 0, nxpk= 0, iat=1889,1903, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09, /
#
# 76 ILE H 77 ILE QG2 4.25
&rst
ixpk= 0, nxpk= 0, iat=1242, -1, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
igr2=1267,1268,1269,
/
#
# 60 GLY H 62 TYR H 5.40
&rst
ixpk= 0, nxpk= 0, iat= 984,1010, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90, /
#
# 62 TYR H 65 ASN H 5.50
&rst
ixpk= 0, nxpk= 0, iat=1010,1067, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 59 LEU H 62 TYR H 5.50
&rst
ixpk= 0, nxpk= 0, iat= 965,1010, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 62 TYR H 64 MET H 5.12
&rst
ixpk= 0, nxpk= 0, iat=1010,1050, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, /
#
# 43 TRP HZ2 62 TYR H 5.50
&rst
ixpk= 0, nxpk= 0, iat= 678,1010, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 62 TYR H 62 TYR HD 3.68
&rst
ixpk= 0, nxpk= 0, iat=1010, -1, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
igr2=1018,1027,
/
#
# 60 GLY HA2 62 TYR H 5.15
&rst
ixpk= 0, nxpk= 0, iat= 986,1010, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65, /
#
# 58 LEU HA 62 TYR H 4.62
&rst
ixpk= 0, nxpk= 0, iat= 948,1010, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12, /
#
# 59 LEU HA 62 TYR H 4.86
&rst
ixpk= 0, nxpk= 0, iat= 967,1010, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36, /
#
# 60 GLY HA3 62 TYR H 5.45
&rst
ixpk= 0, nxpk= 0, iat= 987,1010, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95, /
#
# 62 TYR H 62 TYR HB3 3.81
&rst
ixpk= 0, nxpk= 0, iat=1010,1015, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31, /
#
# 62 TYR H 62 TYR HB2 3.81
&rst
ixpk= 0, nxpk= 0, iat=1010,1014, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31, /
#
# 61 LEU HB3 62 TYR H 3.95
&rst
ixpk= 0, nxpk= 0, iat= 996,1010, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45, /
#
# 61 LEU HG 62 TYR H 3.83
&rst
ixpk= 0, nxpk= 0, iat= 998,1010, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33, /
#
# 61 LEU HB2 62 TYR H 3.95
&rst
ixpk= 0, nxpk= 0, iat= 995,1010, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45, /
#
# 22 ILE QG2 62 TYR H 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1010, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 328, 329, 330,
/
#
# 64 MET H 66 HIS H 5.37
&rst
ixpk= 0, nxpk= 0, iat=1050,1081, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87, /
#
# 66 HIS H 69 GLN H 5.50
&rst
ixpk= 0, nxpk= 0, iat=1081,1130, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 65 ASN HB3 66 HIS H 4.50
&rst
ixpk= 0, nxpk= 0, iat=1072,1081, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, /
#
# 66 HIS H 66 HIS HB2 4.04
&rst
ixpk= 0, nxpk= 0, iat=1081,1085, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, /
#
# 66 HIS H 66 HIS HB3 4.04
&rst
ixpk= 0, nxpk= 0, iat=1081,1086, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, /
#
# 114 LYS H 114 LYS HG3 3.83
&rst
ixpk= 0, nxpk= 0, iat=1881,1889, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33, /
#
# 114 LYS H 114 LYS HB2 3.63
&rst
ixpk= 0, nxpk= 0, iat=1881,1885, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13, /
#
# 114 LYS H 114 LYS HB3 3.12
&rst
ixpk= 0, nxpk= 0, iat=1881,1886, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62, /
#
# 113 LEU HB3 114 LYS H 3.99
&rst
ixpk= 0, nxpk= 0, iat=1867,1881, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49, /
#
# 114 LYS H 114 LYS HG2 3.46
&rst
ixpk= 0, nxpk= 0, iat=1881,1888, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96, /
#
# 113 LEU HB2 114 LYS H 3.99
&rst
ixpk= 0, nxpk= 0, iat=1866,1881, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49, /
#
# 113 LEU QD2 114 LYS H 3.81
&rst
ixpk= 0, nxpk= 0, iat= -1,1881, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
igr1=1871,1872,1873,1875,1876,1877,
/
#
# 113 LEU QD1 114 LYS H 3.81
&rst
ixpk= 0, nxpk= 0, iat= -1,1881, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
igr1=1871,1872,1873,1875,1876,1877,
/
#
# 114 LYS H 114 LYS QE 4.70
&rst
ixpk= 0, nxpk= 0, iat=1881, -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
igr2=1894,1895,
/
#
# 110 VAL HA 114 LYS H 4.69
&rst
ixpk= 0, nxpk= 0, iat=1815,1881, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, /
#
# 112 ILE H 114 LYS H 5.10
&rst
ixpk= 0, nxpk= 0, iat=1843,1881, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, /
#
# 113 LEU H 114 LYS H 3.41
&rst
ixpk= 0, nxpk= 0, iat=1862,1881, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91, /
#
# 125 ASN H 125 ASN HA 2.90
&rst
ixpk= 0, nxpk= 0, iat=2077,2079, r1= 1.30, r2= 1.80, r3= 2.90, r4= 3.40, /
#
# 125 ASN H 127 ILE H 4.74
&rst
ixpk= 0, nxpk= 0, iat=2077,2103, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24, /
#
# 123 VAL H 125 ASN H 4.99
&rst
ixpk= 0, nxpk= 0, iat=2045,2077, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49, /
#
# 121 LYS HA 125 ASN H 4.74
&rst
ixpk= 0, nxpk= 0, iat=2008,2077, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24, /
#
# 123 VAL HA 125 ASN H 5.10
&rst
ixpk= 0, nxpk= 0, iat=2047,2077, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, /
#
# 125 ASN H 125 ASN HB2 2.73
&rst
ixpk= 0, nxpk= 0, iat=2077,2081, r1= 1.30, r2= 1.80, r3= 2.73, r4= 3.23, /
#
# 124 VAL HB 125 ASN H 2.85
&rst
ixpk= 0, nxpk= 0, iat=2065,2077, r1= 1.30, r2= 1.80, r3= 2.85, r4= 3.35, /
#
# 106 LEU HG 110 VAL H 5.07
&rst
ixpk= 0, nxpk= 0, iat=1750,1813, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, /
#
# 121 LYS HG2 125 ASN H 5.50
&rst
ixpk= 0, nxpk= 0, iat=2013,2077, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 121 LYS HG3 125 ASN H 4.65
&rst
ixpk= 0, nxpk= 0, iat=2014,2077, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15, /
#
# 124 VAL QG2 125 ASN H 3.92
&rst
ixpk= 0, nxpk= 0, iat= -1,2077, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
igr1=2067,2068,2069,2071,2072,2073,
/
#
# 110 VAL H 110 VAL QG2 3.31
&rst
ixpk= 0, nxpk= 0, iat=1813, -1, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
igr2=1819,1820,1821,1823,1824,1825,
/
#
# 109 VAL H 111 ASN H 4.61
&rst
ixpk= 0, nxpk= 0, iat=1797,1829, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, /
#
# 108 ARG HA 111 ASN H 3.89
&rst
ixpk= 0, nxpk= 0, iat=1775,1829, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39, /
#
# 109 VAL HA 111 ASN H 5.03
&rst
ixpk= 0, nxpk= 0, iat=1799,1829, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53, /
#
# 110 VAL HB 111 ASN H 3.71
&rst
ixpk= 0, nxpk= 0, iat=1817,1829, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21, /
#
# 110 VAL QG1 111 ASN H 3.96
&rst
ixpk= 0, nxpk= 0, iat= -1,1829, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr1=1819,1820,1821,1823,1824,1825,
/
#
# 110 VAL QG2 111 ASN H 3.96
&rst
ixpk= 0, nxpk= 0, iat= -1,1829, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr1=1819,1820,1821,1823,1824,1825,
/
#
# 111 ASN H 112 ILE QD1 4.73
&rst
ixpk= 0, nxpk= 0, iat=1829, -1, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
igr2=1856,1857,1858,
/
#
# 123 VAL H 124 VAL H 3.11
&rst
ixpk= 0, nxpk= 0, iat=2045,2061, r1= 1.30, r2= 1.80, r3= 3.11, r4= 3.61, /
#
# 127 ILE H 129 ARG H 4.46
&rst
ixpk= 0, nxpk= 0, iat=2103,2137, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, /
#
# 126 ASP HA 129 ARG H 3.93
&rst
ixpk= 0, nxpk= 0, iat=2093,2137, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43, /
#
# 121 LYS HA 124 VAL H 3.94
&rst
ixpk= 0, nxpk= 0, iat=2008,2061, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44, /
#
# 119 PHE HB3 124 VAL H 4.23
&rst
ixpk= 0, nxpk= 0, iat=1980,2061, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73, /
#
# 122 GLN HG2 124 VAL H 4.67
&rst
ixpk= 0, nxpk= 0, iat=2035,2061, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, /
#
# 124 VAL H 124 VAL HB 2.73
&rst
ixpk= 0, nxpk= 0, iat=2061,2065, r1= 1.30, r2= 1.80, r3= 2.73, r4= 3.23, /
#
# 29 LEU H 29 LEU HB2 2.58
&rst
ixpk= 0, nxpk= 0, iat= 430, 434, r1= 1.30, r2= 1.80, r3= 2.58, r4= 3.08, /
#
# 124 VAL H 124 VAL QG1 4.20
&rst
ixpk= 0, nxpk= 0, iat=2061, -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr2=2067,2068,2069,2071,2072,2073,
/
#
# 124 VAL H 124 VAL QG2 4.20
&rst
ixpk= 0, nxpk= 0, iat=2061, -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr2=2067,2068,2069,2071,2072,2073,
/
#
# 123 VAL QG1 124 VAL H 3.67
&rst
ixpk= 0, nxpk= 0, iat= -1,2061, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr1=2051,2052,2053,2055,2056,2057,
/
#
# 128 GLU H 129 ARG H 3.20
&rst
ixpk= 0, nxpk= 0, iat=2122,2137, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, /
#
# 124 VAL H 125 ASN HND1 5.01
&rst
ixpk= 0, nxpk= 0, iat=2061,2086, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51, /
#
# 25 ALA HA 29 LEU H 3.98
&rst
ixpk= 0, nxpk= 0, iat= 365, 430, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48, /
#
# 128 GLU HA 129 ARG H 3.57
&rst
ixpk= 0, nxpk= 0, iat=2124,2137, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07, /
#
# 124 VAL H 125 ASN HB2 5.07
&rst
ixpk= 0, nxpk= 0, iat=2061,2081, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, /
#
# 129 ARG H 132 ALA QB 5.36
&rst
ixpk= 0, nxpk= 0, iat=2137, -1, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,
igr2=2195,2196,2197,
/
#
# 126 ASP H 128 GLU H 4.85
&rst
ixpk= 0, nxpk= 0, iat=2091,2122, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35, /
#
# 126 ASP H 127 ILE H 3.31
&rst
ixpk= 0, nxpk= 0, iat=2091,2103, r1= 1.30, r2= 1.80, r3= 3.31, r4= 3.81, /
#
# 123 VAL H 126 ASP H 5.05
&rst
ixpk= 0, nxpk= 0, iat=2045,2091, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55, /
#
# 122 GLN HA 126 ASP H 4.30
&rst
ixpk= 0, nxpk= 0, iat=2030,2091, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80, /
#
# 123 VAL HA 126 ASP H 3.88
&rst
ixpk= 0, nxpk= 0, iat=2047,2091, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38, /
#
# 126 ASP H 126 ASP HB2 3.50
&rst
ixpk= 0, nxpk= 0, iat=2091,2095, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, /
#
# 126 ASP H 126 ASP HB3 3.50
&rst
ixpk= 0, nxpk= 0, iat=2091,2096, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, /
#
# 125 ASN HB2 126 ASP H 3.04
&rst
ixpk= 0, nxpk= 0, iat=2081,2091, r1= 1.30, r2= 1.80, r3= 3.04, r4= 3.54, /
#
# 106 LEU H 106 LEU HB3 3.25
&rst
ixpk= 0, nxpk= 0, iat=1743,1748, r1= 1.30, r2= 1.80, r3= 3.25, r4= 3.75, /
#
# 103 LYS HA 106 LEU H 3.92
&rst
ixpk= 0, nxpk= 0, iat=1679,1743, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42, /
#
# 105 LYS H 106 LEU H 3.14
&rst
ixpk= 0, nxpk= 0, iat=1721,1743, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64, /
#
# 106 LEU H 108 ARG H 4.73
&rst
ixpk= 0, nxpk= 0, iat=1743,1773, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, /
#
# 104 LYS H 106 LEU H 4.56
&rst
ixpk= 0, nxpk= 0, iat=1699,1743, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06, /
#
# 98 PHE HD 106 LEU H 4.18
&rst
ixpk= 0, nxpk= 0, iat= -1,1743, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,
igr1=1596,1604,
/
#
# 105 LYS QB 106 LEU H 3.41
&rst
ixpk= 0, nxpk= 0, iat= -1,1743, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,
igr1=1725,1726,
/
#
# 106 LEU H 106 LEU HB2 3.06
&rst
ixpk= 0, nxpk= 0, iat=1743,1747, r1= 1.30, r2= 1.80, r3= 3.06, r4= 3.56, /
#
# 102 LEU HB3 106 LEU H 4.71
&rst
ixpk= 0, nxpk= 0, iat=1663,1743, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21, /
#
# 120 SER H 120 SER HB3 3.82
&rst
ixpk= 0, nxpk= 0, iat=1995,2000, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32, /
#
# 119 PHE HA 120 SER H 3.09
&rst
ixpk= 0, nxpk= 0, iat=1977,1995, r1= 1.30, r2= 1.80, r3= 3.09, r4= 3.59, /
#
# 120 SER H 123 VAL QG1 3.63
&rst
ixpk= 0, nxpk= 0, iat=1995, -1, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
igr2=2051,2052,2053,2055,2056,2057,
/
#
# 120 SER H 123 VAL QG2 3.63
&rst
ixpk= 0, nxpk= 0, iat=1995, -1, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
igr2=2051,2052,2053,2055,2056,2057,
/
#
# 120 SER H 123 VAL HB 4.18
&rst
ixpk= 0, nxpk= 0, iat=1995,2049, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68, /
#
# 120 SER H 122 GLN HG3 5.50
&rst
ixpk= 0, nxpk= 0, iat=1995,2036, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 119 PHE HB3 120 SER H 3.40
&rst
ixpk= 0, nxpk= 0, iat=1980,1995, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90, /
#
# 119 PHE HB2 120 SER H 3.31
&rst
ixpk= 0, nxpk= 0, iat=1979,1995, r1= 1.30, r2= 1.80, r3= 3.31, r4= 3.81, /
#
# 120 SER H 124 VAL H 3.96
&rst
ixpk= 0, nxpk= 0, iat=1995,2061, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66, /
#
# 120 SER H 123 VAL H 3.99
&rst
ixpk= 0, nxpk= 0, iat=1995,2045, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49, /
#
# 119 PHE HD 120 SER H 4.17
&rst
ixpk= 0, nxpk= 0, iat= -1,1995, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
igr1=1983,1991,
/
#
# 7 GLN H 9 THR HB 5.50
&rst
ixpk= 0, nxpk= 0, iat= 88, 129, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 5 SER HA 7 GLN H 4.57
&rst
ixpk= 0, nxpk= 0, iat= 64, 88, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07, /
#
# 7 GLN H 7 GLN HNE1 4.70
&rst
ixpk= 0, nxpk= 0, iat= 88, 100, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, /
#
# 7 GLN H 28 TRP HH2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 88, 421, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 7 GLN H 8 PHE HB3 5.38
&rst
ixpk= 0, nxpk= 0, iat= 88, 110, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88, /
#
# 7 GLN H 7 GLN HG3 3.42
&rst
ixpk= 0, nxpk= 0, iat= 88, 96, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92, /
#
# 7 GLN H 7 GLN HG2 3.42
&rst
ixpk= 0, nxpk= 0, iat= 88, 95, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92, /
#
# 17 ASP H 59 LEU QD1 3.92
&rst
ixpk= 0, nxpk= 0, iat= 256, -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
igr2= 974, 975, 976, 978, 979, 980,
/
#
# 17 ASP H 59 LEU QD2 3.92
&rst
ixpk= 0, nxpk= 0, iat= 256, -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
igr2= 974, 975, 976, 978, 979, 980,
/
#
# 16 GLU HB3 17 ASP H 3.63
&rst
ixpk= 0, nxpk= 0, iat= 246, 256, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13, /
#
# 16 GLU HB2 17 ASP H 4.30
&rst
ixpk= 0, nxpk= 0, iat= 245, 256, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80, /
#
# 17 ASP H 17 ASP HB3 3.64
&rst
ixpk= 0, nxpk= 0, iat= 256, 261, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14, /
#
# 17 ASP H 17 ASP HB2 3.64
&rst
ixpk= 0, nxpk= 0, iat= 256, 260, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14, /
#
# 30 LEU QD2 71 ALA H 4.01
&rst
ixpk= 0, nxpk= 0, iat= -1,1164, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,
igr1= 458, 459, 460, 462, 463, 464,
/
#
# 18 SER H 22 ILE QD1 4.26
&rst
ixpk= 0, nxpk= 0, iat= 268, -1, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
igr2= 335, 336, 337,
/
#
# 17 ASP H 18 SER H 3.84
&rst
ixpk= 0, nxpk= 0, iat= 256, 268, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34, /
#
# 18 SER H 21 SER H 4.49
&rst
ixpk= 0, nxpk= 0, iat= 268, 311, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99, /
#
# 18 SER H 22 ILE H 4.13
&rst
ixpk= 0, nxpk= 0, iat= 268, 322, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63, /
#
# 18 SER H 21 SER QB 4.13
&rst
ixpk= 0, nxpk= 0, iat= 268, -1, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
igr2= 315, 316,
/
#
# 18 SER H 22 ILE HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= 268, 324, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 17 ASP HB2 18 SER H 4.70
&rst
ixpk= 0, nxpk= 0, iat= 260, 268, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, /
#
# 17 ASP HB3 18 SER H 4.70
&rst
ixpk= 0, nxpk= 0, iat= 261, 268, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, /
#
# 16 GLU HB2 18 SER H 4.54
&rst
ixpk= 0, nxpk= 0, iat= 245, 268, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, /
#
# 16 GLU HB3 18 SER H 4.21
&rst
ixpk= 0, nxpk= 0, iat= 246, 268, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71, /
#
# 18 SER H 22 ILE HB 4.80
&rst
ixpk= 0, nxpk= 0, iat= 268, 326, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30, /
#
# 18 SER H 22 ILE QG2 5.47
&rst
ixpk= 0, nxpk= 0, iat= 268, -1, r1= 1.30, r2= 1.80, r3= 6.57, r4= 7.07,
igr2= 328, 329, 330,
/
#
# 20 GLU HB2 21 SER H 3.96
&rst
ixpk= 0, nxpk= 0, iat= 300, 311, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46, /
#
# 20 GLU HB3 21 SER H 3.96
&rst
ixpk= 0, nxpk= 0, iat= 301, 311, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46, /
#
# 21 SER H 22 ILE H 4.12
&rst
ixpk= 0, nxpk= 0, iat= 311, 322, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62, /
#
# 21 SER H 23 SER H 4.46
&rst
ixpk= 0, nxpk= 0, iat= 311, 341, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, /
#
# 21 SER H 21 SER QB 3.91
&rst
ixpk= 0, nxpk= 0, iat= 311, -1, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,
igr2= 315, 316,
/
#
# 16 GLU HB3 21 SER H 5.02
&rst
ixpk= 0, nxpk= 0, iat= 246, 311, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52, /
#
# 21 SER H 22 ILE QD1 5.50
&rst
ixpk= 0, nxpk= 0, iat= 311, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2= 335, 336, 337,
/
#
# 118 ILE H 119 PHE HD 5.10
&rst
ixpk= 0, nxpk= 0, iat=1956, -1, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
igr2=1983,1991,
/
#
# 114 LYS HA 118 ILE H 4.36
&rst
ixpk= 0, nxpk= 0, iat=1883,1956, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86, /
#
# 117 ASN HB2 118 ILE H 4.73
&rst
ixpk= 0, nxpk= 0, iat=1946,1956, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, /
#
# 117 ASN HB3 118 ILE H 4.42
&rst
ixpk= 0, nxpk= 0, iat=1947,1956, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92, /
#
# 118 ILE H 118 ILE HB 3.50
&rst
ixpk= 0, nxpk= 0, iat=1956,1960, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, /
#
# 118 ILE H 118 ILE HG12 3.67
&rst
ixpk= 0, nxpk= 0, iat=1956,1966, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17, /
#
# 118 ILE H 118 ILE QD1 3.58
&rst
ixpk= 0, nxpk= 0, iat=1956, -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
igr2=1969,1970,1971,
/
#
# 72 LYS QD 118 ILE H 4.49
&rst
ixpk= 0, nxpk= 0, iat= -1,1956, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr1=1184,1185,
/
#
# 35 ASP HB2 36 ALA H 4.69
&rst
ixpk= 0, nxpk= 0, iat= 553, 561, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, /
#
# 36 ALA H 38 LYS QB 5.02
&rst
ixpk= 0, nxpk= 0, iat= 561, -1, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr2= 589, 590,
/
#
# 32 GLN HB2 36 ALA H 5.50
&rst
ixpk= 0, nxpk= 0, iat= 491, 561, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 36 ALA H 78 GLN HB2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 561,1284, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 29 LEU QD1 36 ALA H 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 561, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr1= 439, 440, 441, 443, 444, 445,
/
#
# 36 ALA H 39 VAL QG2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 561, -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr2= 613, 614, 615, 617, 618, 619,
/
#
# 29 LEU QD2 36 ALA H 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 561, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr1= 439, 440, 441, 443, 444, 445,
/
#
# 36 ALA H 39 VAL QG1 5.50
&rst
ixpk= 0, nxpk= 0, iat= 561, -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr2= 613, 614, 615, 617, 618, 619,
/
#
# 35 ASP HB3 36 ALA H 4.69
&rst
ixpk= 0, nxpk= 0, iat= 554, 561, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, /
#
# 36 ALA H 79 PHE HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= 561,1299, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 132 ALA H 134 ALA H 4.27
&rst
ixpk= 0, nxpk= 0, iat=2191,2211, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77, /
#
# 134 ALA H 134 ALA QB 2.40
&rst
ixpk= 0, nxpk= 0, iat=2211, -1, r1= 1.30, r2= 1.80, r3= 2.88, r4= 3.38,
igr2=2215,2216,2217,
/
#
# 98 PHE H 103 LYS H 5.50
&rst
ixpk= 0, nxpk= 0, iat=1588,1677, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20, /
#
# 95 ASN H 98 PHE H 4.59
&rst
ixpk= 0, nxpk= 0, iat=1542,1588, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, /
#
# 95 ASN HA 98 PHE H 3.34
&rst
ixpk= 0, nxpk= 0, iat=1544,1588, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84, /
#
# 94 ILE HA 98 PHE H 4.16
&rst
ixpk= 0, nxpk= 0, iat=1525,1588, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66, /
#
# 98 PHE H 98 PHE HB3 3.72
&rst
ixpk= 0, nxpk= 0, iat=1588,1593, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22, /
#
# 98 PHE H 98 PHE HB2 3.13
&rst
ixpk= 0, nxpk= 0, iat=1588,1592, r1= 1.30, r2= 1.80, r3= 3.13, r4= 3.63, /
#
# 95 ASN QB 98 PHE H 5.07
&rst
ixpk= 0, nxpk= 0, iat= -1,1588, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
igr1=1546,1547,
/
#
# 98 PHE H 103 LYS QG 4.10
&rst
ixpk= 0, nxpk= 0, iat=1588, -1, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
igr2=1684,1685,
/
#
# 54 THR QG2 98 PHE H 4.16
&rst
ixpk= 0, nxpk= 0, iat= -1,1588, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,
igr1= 868, 869, 870,
/
#
# 39 VAL H 39 VAL HB 3.69
&rst
ixpk= 0, nxpk= 0, iat= 607, 611, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19, /
#
# 39 VAL H 39 VAL QG1 3.55
&rst
ixpk= 0, nxpk= 0, iat= 607, -1, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
igr2= 613, 614, 615, 617, 618, 619,
/
#
# 46 TYR H 46 TYR QB 3.00
&rst
ixpk= 0, nxpk= 0, iat= 726, -1, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87,
igr2= 730, 731,
/
#
# 39 VAL H 39 VAL QG2 3.55
&rst
ixpk= 0, nxpk= 0, iat= 607, -1, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
igr2= 613, 614, 615, 617, 618, 619,
/
#
# 9 THR QG2 46 TYR H 5.22
&rst
ixpk= 0, nxpk= 0, iat= -1, 726, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
igr1= 131, 132, 133,
/
#
# 38 LYS QB 39 VAL H 3.10
&rst
ixpk= 0, nxpk= 0, iat= -1, 607, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98,
igr1= 589, 590,
/
#
# 45 GLU HG3 46 TYR H 4.95
&rst
ixpk= 0, nxpk= 0, iat= 719, 726, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65, /
#
# 38 LYS H 39 VAL H 3.06
&rst
ixpk= 0, nxpk= 0, iat= 585, 607, r1= 1.30, r2= 1.80, r3= 3.06, r4= 3.56, /
#
# 46 TYR H 48 LEU H 4.52
&rst
ixpk= 0, nxpk= 0, iat= 726, 764, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02, /
#
# 44 LYS H 46 TYR H 4.41
&rst
ixpk= 0, nxpk= 0, iat= 689, 726, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, /
#
# 47 MET H 48 LEU H 3.28
&rst
ixpk= 0, nxpk= 0, iat= 747, 764, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78, /
#
# 45 GLU HA 48 LEU H 3.97
&rst
ixpk= 0, nxpk= 0, iat= 713, 764, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47, /
#
# 44 LYS HA 48 LEU H 4.00
&rst
ixpk= 0, nxpk= 0, iat= 691, 764, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, /
#
# 46 TYR QB 48 LEU H 5.03
&rst
ixpk= 0, nxpk= 0, iat= -1, 764, r1= 1.30, r2= 1.80, r3= 5.65, r4= 6.15,
igr1= 730, 731,
/
#
# 47 MET HB3 48 LEU H 3.76
&rst
ixpk= 0, nxpk= 0, iat= -1, 764, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
igr1= 751, 752,
/
#
# 48 LEU H 48 LEU HG 3.27
&rst
ixpk= 0, nxpk= 0, iat= 764, 771, r1= 1.30, r2= 1.80, r3= 3.27, r4= 3.77, /
#
# 48 LEU H 48 LEU HB2 3.21
&rst
ixpk= 0, nxpk= 0, iat= 764, 768, r1= 1.30, r2= 1.80, r3= 3.21, r4= 3.71, /
#
# 48 LEU H 48 LEU HB3 3.66
&rst
ixpk= 0, nxpk= 0, iat= 764, 769, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16, /
#
# 47 MET HG2 48 LEU H 4.02
&rst
ixpk= 0, nxpk= 0, iat= -1, 764, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,
igr1= 754, 755,
/
#
# 48 LEU H 90 VAL QG2 3.90
&rst
ixpk= 0, nxpk= 0, iat= 764, -1, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr2=1463,1464,1465,1467,1468,1469,
/
#
# 48 LEU H 48 LEU QD2 3.76
&rst
ixpk= 0, nxpk= 0, iat= 764, -1, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
igr2= 773, 774, 775, 777, 778, 779,
/
#
# 47 MET HB2 48 LEU H 3.75
&rst
ixpk= 0, nxpk= 0, iat= -1, 764, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,
igr1= 751, 752,
/
#
# 46 TYR H 49 ARG H 4.77
&rst
ixpk= 0, nxpk= 0, iat= 726, 783, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27, /
#
# 47 MET H 49 ARG H 3.93
&rst
ixpk= 0, nxpk= 0, iat= 747, 783, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43, /
#
# 49 ARG H 52 VAL H 5.44
&rst
ixpk= 0, nxpk= 0, iat= 783, 832, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94, /
#
# 46 TYR HD 49 ARG H 5.35
&rst
ixpk= 0, nxpk= 0, iat= -1, 783, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51,
igr1= 734, 743,
/
#
# 48 LEU HA 49 ARG H 3.57
&rst
ixpk= 0, nxpk= 0, iat= 766, 783, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07, /
#
# 47 MET HA 49 ARG H 4.06
&rst
ixpk= 0, nxpk= 0, iat= 749, 783, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56, /
#
# 46 TYR HA 49 ARG H 3.74
&rst
ixpk= 0, nxpk= 0, iat= 728, 783, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24, /
#
# 48 LEU HB2 49 ARG H 3.28
&rst
ixpk= 0, nxpk= 0, iat= 768, 783, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78, /
#
# 49 ARG H 52 VAL HB 4.95
&rst
ixpk= 0, nxpk= 0, iat= 783, 836, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45, /
#
# 49 ARG H 49 ARG HB3 3.03
&rst
ixpk= 0, nxpk= 0, iat= 783, 788, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53, /
#
# 49 ARG H 49 ARG HG2 3.34
&rst
ixpk= 0, nxpk= 0, iat= 783, 790, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84, /
#
# 47 MET HG2 49 ARG H 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 783, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 754, 755,
/
#
# 55 ARG H 55 ARG HA 2.92
&rst
ixpk= 0, nxpk= 0, iat= 876, 878, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42, /
#
# 54 THR HB 55 ARG H 3.85
&rst
ixpk= 0, nxpk= 0, iat= 866, 876, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35, /
#
# 53 ASN HA 55 ARG H 4.78
&rst
ixpk= 0, nxpk= 0, iat= 850, 876, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, /
#
# 55 ARG H 56 ARG H 3.34
&rst
ixpk= 0, nxpk= 0, iat= 876, 900, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84, /
#
# 54 THR QG2 55 ARG H 4.37
&rst
ixpk= 0, nxpk= 0, iat= -1, 876, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
igr1= 868, 869, 870,
/
#
# 55 ARG H 55 ARG HG3 4.17
&rst
ixpk= 0, nxpk= 0, iat= 876, 884, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67, /
#
# 55 ARG H 55 ARG QB 2.57
&rst
ixpk= 0, nxpk= 0, iat= 876, -1, r1= 1.30, r2= 1.80, r3= 2.88, r4= 3.38,
igr2= 880, 881,
/
#
# 55 ARG H 58 LEU HB2 5.39
&rst
ixpk= 0, nxpk= 0, iat= 876, 950, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89, /
#
# 56 ARG H 57 LYS H 2.93
&rst
ixpk= 0, nxpk= 0, iat= 900, 924, r1= 1.30, r2= 1.80, r3= 2.93, r4= 3.43, /
#
# 53 ASN H 56 ARG H 4.15
&rst
ixpk= 0, nxpk= 0, iat= 848, 900, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65, /
#
# 56 ARG H 57 LYS HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= 900, 926, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 56 ARG H 56 ARG QD 3.93
&rst
ixpk= 0, nxpk= 0, iat= 900, -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
igr2= 910, 911,
/
#
# 55 ARG QB 56 ARG H 3.11
&rst
ixpk= 0, nxpk= 0, iat= -1, 900, r1= 1.30, r2= 1.80, r3= 3.49, r4= 3.99,
igr1= 880, 881,
/
#
# 56 ARG H 56 ARG QG 3.41
&rst
ixpk= 0, nxpk= 0, iat= 900, -1, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,
igr2= 907, 908,
/
#
# 56 ARG H 56 ARG QB 3.25
&rst
ixpk= 0, nxpk= 0, iat= 900, -1, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15,
igr2= 904, 905,
/
#
# 56 ARG H 58 LEU H 4.62
&rst
ixpk= 0, nxpk= 0, iat= 900, 946, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12, /
#
# 56 ARG H 59 LEU H 5.38
&rst
ixpk= 0, nxpk= 0, iat= 900, 965, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88, /
#
# 53 ASN HND2 56 ARG H 5.50
&rst
ixpk= 0, nxpk= 0, iat= 858, 900, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 54 THR HA 57 LYS H 3.93
&rst
ixpk= 0, nxpk= 0, iat= 864, 924, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43, /
#
# 56 ARG QB 57 LYS H 3.38
&rst
ixpk= 0, nxpk= 0, iat= -1, 924, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,
igr1= 904, 905,
/
#
# 56 ARG QG 57 LYS H 4.47
&rst
ixpk= 0, nxpk= 0, iat= -1, 924, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
igr1= 907, 908,
/
#
# 57 LYS H 57 LYS HG2 5.01
&rst
ixpk= 0, nxpk= 0, iat= 924, 931, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51, /
#
# 57 LYS H 57 LYS HG3 3.62
&rst
ixpk= 0, nxpk= 0, iat= 924, 932, r1= 1.30, r2= 1.80, r3= 3.62, r4= 4.12, /
#
# 53 ASN H 57 LYS H 4.40
&rst
ixpk= 0, nxpk= 0, iat= 848, 924, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, /
#
# 58 LEU H 60 GLY H 5.08
&rst
ixpk= 0, nxpk= 0, iat= 946, 984, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58, /
#
# 58 LEU H 61 LEU H 5.19
&rst
ixpk= 0, nxpk= 0, iat= 946, 991, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69, /
#
# 57 LYS H 58 LEU H 3.38
&rst
ixpk= 0, nxpk= 0, iat= 924, 946, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88, /
#
# 58 LEU H 59 LEU H 3.41
&rst
ixpk= 0, nxpk= 0, iat= 946, 965, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91, /
#
# 58 LEU H 98 PHE HE 3.88
&rst
ixpk= 0, nxpk= 0, iat= 946, -1, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,
igr2=1598,1602,
/
#
# 58 LEU H 98 PHE HD 5.50
&rst
ixpk= 0, nxpk= 0, iat= 946, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2=1596,1604,
/
#
# 58 LEU H 98 PHE HZ 3.80
&rst
ixpk= 0, nxpk= 0, iat= 946,1600, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30, /
#
# 54 THR HA 58 LEU H 4.32
&rst
ixpk= 0, nxpk= 0, iat= 864, 946, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82, /
#
# 58 LEU H 58 LEU HB3 3.61
&rst
ixpk= 0, nxpk= 0, iat= 946, 951, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11, /
#
# 57 LYS HB3 58 LEU H 3.82
&rst
ixpk= 0, nxpk= 0, iat= 929, 946, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32, /
#
# 57 LYS HB2 58 LEU H 3.66
&rst
ixpk= 0, nxpk= 0, iat= 928, 946, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16, /
#
# 58 LEU H 58 LEU HB2 3.16
&rst
ixpk= 0, nxpk= 0, iat= 946, 950, r1= 1.30, r2= 1.80, r3= 3.16, r4= 3.66, /
#
# 57 LYS HA 59 LEU H 4.56
&rst
ixpk= 0, nxpk= 0, iat= 926, 965, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06, /
#
# 59 LEU H 98 PHE HE 5.50
&rst
ixpk= 0, nxpk= 0, iat= 965, -1, r1= 1.30, r2= 1.80, r3= 6.37, r4= 6.87,
igr2=1598,1602,
/
#
# 59 LEU H 98 PHE HZ 5.05
&rst
ixpk= 0, nxpk= 0, iat= 965,1600, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55, /
#
# 59 LEU H 61 LEU H 4.41
&rst
ixpk= 0, nxpk= 0, iat= 965, 991, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, /
#
# 58 LEU HB3 59 LEU H 3.62
&rst
ixpk= 0, nxpk= 0, iat= 951, 965, r1= 1.30, r2= 1.80, r3= 3.62, r4= 4.12, /
#
# 59 LEU H 59 LEU HG 3.82
&rst
ixpk= 0, nxpk= 0, iat= 965, 972, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32, /
#
# 58 LEU HB2 59 LEU H 3.86
&rst
ixpk= 0, nxpk= 0, iat= 950, 965, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, /
#
# 59 LEU H 59 LEU QD2 3.78
&rst
ixpk= 0, nxpk= 0, iat= 965, -1, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
igr2= 974, 975, 976, 978, 979, 980,
/
#
# 59 LEU H 59 LEU QD1 3.78
&rst
ixpk= 0, nxpk= 0, iat= 965, -1, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
igr2= 974, 975, 976, 978, 979, 980,
/
#
# 72 LYS HA 75 LYS H 3.93
&rst
ixpk= 0, nxpk= 0, iat=1176,1220, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43, /
#
# 74 GLN QB 75 LYS H 3.84
&rst
ixpk= 0, nxpk= 0, iat= -1,1220, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,
igr1=1207,1208,
/
#
# 75 LYS H 76 ILE HG12 4.08
&rst
ixpk= 0, nxpk= 0, iat=1220,1252, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58, /
#
# 76 ILE H 76 ILE QD1 4.23
&rst
ixpk= 0, nxpk= 0, iat=1242, -1, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
igr2=1255,1256,1257,
/
#
# 81 ASP H 82 SER H 3.46
&rst
ixpk= 0, nxpk= 0, iat=1334,1346, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96, /
#
# 82 SER H 83 PHE HB2 4.84
&rst
ixpk= 0, nxpk= 0, iat=1346,1361, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34, /
#
# 81 ASP QB 82 SER H 3.09
&rst
ixpk= 0, nxpk= 0, iat= -1,1346, r1= 1.30, r2= 1.80, r3= 3.47, r4= 3.97,
igr1=1338,1339,
/
#
# 82 SER H 85 LYS HG2 5.02
&rst
ixpk= 0, nxpk= 0, iat=1346,1391, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52, /
#
# 40 ALA QB 82 SER H 4.70
&rst
ixpk= 0, nxpk= 0, iat= -1,1346, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14,
igr1= 627, 628, 629,
/
#
# 36 ALA QB 82 SER H 4.42
&rst
ixpk= 0, nxpk= 0, iat= -1,1346, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
igr1= 565, 566, 567,
/
#
# 44 LYS HB2 90 VAL H 3.86
&rst
ixpk= 0, nxpk= 0, iat= 693,1457, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, /
#
# 90 VAL H 90 VAL HB 2.98
&rst
ixpk= 0, nxpk= 0, iat=1457,1461, r1= 1.30, r2= 1.80, r3= 2.98, r4= 3.48, /
#
# 90 VAL H 90 VAL QG1 3.93
&rst
ixpk= 0, nxpk= 0, iat=1457, -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr2=1463,1464,1465,1467,1468,1469,
/
#
# 90 VAL H 90 VAL QG2 2.90
&rst
ixpk= 0, nxpk= 0, iat=1457, -1, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41,
igr2=1463,1464,1465,1467,1468,1469,
/
#
# 89 GLU HB2 90 VAL H 3.22
&rst
ixpk= 0, nxpk= 0, iat=1446,1457, r1= 1.30, r2= 1.80, r3= 3.22, r4= 3.72, /
#
# 48 LEU HG 90 VAL H 5.50
&rst
ixpk= 0, nxpk= 0, iat= 771,1457, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 90 VAL H 93 ARG QB 5.50
&rst
ixpk= 0, nxpk= 0, iat=1457, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2=1503,1504,
/
#
# 90 VAL H 92 GLY H 4.78
&rst
ixpk= 0, nxpk= 0, iat=1457,1492, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, /
#
# 88 ALA H 90 VAL H 5.25
&rst
ixpk= 0, nxpk= 0, iat=1432,1457, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75, /
#
# 43 TRP HH2 90 VAL H 5.23
&rst
ixpk= 0, nxpk= 0, iat= 680,1457, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73, /
#
# 96 GLN H 96 GLN HB2 2.98
&rst
ixpk= 0, nxpk= 0, iat=1556,1560, r1= 1.30, r2= 1.80, r3= 2.98, r4= 3.48, /
#
# 96 GLN H 96 GLN HG3 3.05
&rst
ixpk= 0, nxpk= 0, iat=1556,1564, r1= 1.30, r2= 1.80, r3= 3.05, r4= 3.55, /
#
# 96 GLN H 96 GLN HG2 2.81
&rst
ixpk= 0, nxpk= 0, iat=1556,1563, r1= 1.30, r2= 1.80, r3= 2.81, r4= 3.31, /
#
# 95 ASN QB 96 GLN H 3.08
&rst
ixpk= 0, nxpk= 0, iat= -1,1556, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96,
igr1=1546,1547,
/
#
# 94 ILE HA 96 GLN H 4.39
&rst
ixpk= 0, nxpk= 0, iat=1525,1556, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89, /
#
# 96 GLN H 97 GLU H 2.81
&rst
ixpk= 0, nxpk= 0, iat=1556,1573, r1= 1.30, r2= 1.80, r3= 2.81, r4= 3.31, /
#
# 96 GLN H 134 ALA QB 4.21
&rst
ixpk= 0, nxpk= 0, iat=1556, -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
igr2=2215,2216,2217,
/
#
# 94 ILE HG12 96 GLN H 5.24
&rst
ixpk= 0, nxpk= 0, iat=1533,1556, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74, /
#
# 95 ASN H 96 GLN H 2.93
&rst
ixpk= 0, nxpk= 0, iat=1542,1556, r1= 1.30, r2= 1.80, r3= 2.93, r4= 3.43, /
#
# 96 GLN H 98 PHE H 4.06
&rst
ixpk= 0, nxpk= 0, iat=1556,1588, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56, /
#
# 94 ILE H 96 GLN H 4.46
&rst
ixpk= 0, nxpk= 0, iat=1523,1556, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, /
#
# 108 ARG H 108 ARG HB2 3.66
&rst
ixpk= 0, nxpk= 0, iat=1773,1777, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16, /
#
# 108 ARG H 108 ARG HB3 3.66
&rst
ixpk= 0, nxpk= 0, iat=1773,1778, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16, /
#
# 108 ARG H 108 ARG QG 3.08
&rst
ixpk= 0, nxpk= 0, iat=1773, -1, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96,
igr2=1780,1781,
/
#
# 108 ARG H 108 ARG HD3 4.69
&rst
ixpk= 0, nxpk= 0, iat=1773,1784, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, /
#
# 108 ARG H 109 VAL HA 5.43
&rst
ixpk= 0, nxpk= 0, iat=1773,1799, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93, /
#
# 107 SER QB 108 ARG H 2.88
&rst
ixpk= 0, nxpk= 0, iat= -1,1773, r1= 1.30, r2= 1.80, r3= 3.23, r4= 3.73,
igr1=1766,1767,
/
#
# 131 LEU H 133 ALA H 4.54
&rst
ixpk= 0, nxpk= 0, iat=2172,2201, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, /
#
# 133 ALA H 134 ALA H 2.83
&rst
ixpk= 0, nxpk= 0, iat=2201,2211, r1= 1.30, r2= 1.80, r3= 2.83, r4= 3.33, /
#
# 113 LEU HA 116 ARG H 4.14
&rst
ixpk= 0, nxpk= 0, iat=1864,1918, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64, /
#
# 116 ARG H 118 ILE H 4.96
&rst
ixpk= 0, nxpk= 0, iat=1918,1956, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46, /
#
# 116 ARG H 117 ASN HA 4.61
&rst
ixpk= 0, nxpk= 0, iat=1918,1944, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, /
#
# 116 ARG H 117 ASN HB2 5.23
&rst
ixpk= 0, nxpk= 0, iat=1918,1946, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73, /
#
# 115 GLU HB3 116 ARG H 4.30
&rst
ixpk= 0, nxpk= 0, iat=1908,1918, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80, /
#
# 115 GLU HB2 116 ARG H 4.30
&rst
ixpk= 0, nxpk= 0, iat=1907,1918, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80, /
#
# 116 ARG H 116 ARG QB 3.90
&rst
ixpk= 0, nxpk= 0, iat=1918, -1, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
igr2=1922,1923,
/
#
# 112 ILE QG2 116 ARG H 4.34
&rst
ixpk= 0, nxpk= 0, iat= -1,1918, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,
igr1=1849,1850,1851,
/
#
# 116 ARG H 118 ILE QD1 4.60
&rst
ixpk= 0, nxpk= 0, iat=1918, -1, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
igr2=1969,1970,1971,
/
#
# 117 ASN H 118 ILE H 3.24
&rst
ixpk= 0, nxpk= 0, iat=1942,1956, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74, /
#
# 117 ASN H 119 PHE H 5.23
&rst
ixpk= 0, nxpk= 0, iat=1942,1975, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73, /
#
# 114 LYS H 117 ASN H 5.09
&rst
ixpk= 0, nxpk= 0, iat=1881,1942, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59, /
#
# 115 GLU H 117 ASN H 4.10
&rst
ixpk= 0, nxpk= 0, iat=1903,1942, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60, /
#
# 117 ASN H 117 ASN HA 2.67
&rst
ixpk= 0, nxpk= 0, iat=1942,1944, r1= 1.30, r2= 1.80, r3= 2.67, r4= 3.17, /
#
# 114 LYS HA 117 ASN H 3.46
&rst
ixpk= 0, nxpk= 0, iat=1883,1942, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96, /
#
# 117 ASN H 118 ILE HA 5.35
&rst
ixpk= 0, nxpk= 0, iat=1942,1958, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85, /
#
# 117 ASN H 117 ASN HB2 3.48
&rst
ixpk= 0, nxpk= 0, iat=1942,1946, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98, /
#
# 117 ASN H 118 ILE HG12 3.78
&rst
ixpk= 0, nxpk= 0, iat=1942,1966, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28, /
#
# 128 GLU H 131 LEU H 5.50
&rst
ixpk= 0, nxpk= 0, iat=2122,2172, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 130 SER H 131 LEU H 3.12
&rst
ixpk= 0, nxpk= 0, iat=2161,2172, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62, /
#
# 131 LEU H 132 ALA H 3.10
&rst
ixpk= 0, nxpk= 0, iat=2172,2191, r1= 1.30, r2= 1.80, r3= 3.10, r4= 3.60, /
#
# 130 SER HB3 131 LEU H 3.46
&rst
ixpk= 0, nxpk= 0, iat=2166,2172, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16, /
#
# 130 SER HB2 131 LEU H 3.46
&rst
ixpk= 0, nxpk= 0, iat=2165,2172, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96, /
#
# 128 GLU HA 131 LEU H 4.10
&rst
ixpk= 0, nxpk= 0, iat=2124,2172, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60, /
#
# 92 GLY HA2 131 LEU H 4.52
&rst
ixpk= 0, nxpk= 0, iat=1494,2172, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02, /
#
# 127 ILE HA 131 LEU H 4.67
&rst
ixpk= 0, nxpk= 0, iat=2105,2172, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, /
#
# 131 LEU H 131 LEU HG 2.80
&rst
ixpk= 0, nxpk= 0, iat=2172,2179, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30, /
#
# 131 LEU H 131 LEU QD1 3.54
&rst
ixpk= 0, nxpk= 0, iat=2172, -1, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
igr2=2181,2182,2183,2185,2186,2187,
/
#
# 131 LEU H 131 LEU QD2 3.54
&rst
ixpk= 0, nxpk= 0, iat=2172, -1, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
igr2=2181,2182,2183,2185,2186,2187,
/
#
# 132 ALA H 132 ALA HA 2.92
&rst
ixpk= 0, nxpk= 0, iat=2191,2193, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42, /
#
# 132 ALA H 133 ALA H 3.08
&rst
ixpk= 0, nxpk= 0, iat=2191,2201, r1= 1.30, r2= 1.80, r3= 3.08, r4= 3.58, /
#
# 129 ARG HA 132 ALA H 4.20
&rst
ixpk= 0, nxpk= 0, iat=2139,2191, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, /
#
# 128 GLU HA 132 ALA H 4.10
&rst
ixpk= 0, nxpk= 0, iat=2124,2191, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60, /
#
# 131 LEU HB2 132 ALA H 3.02
&rst
ixpk= 0, nxpk= 0, iat=2176,2191, r1= 1.30, r2= 1.80, r3= 3.02, r4= 3.52, /
#
# 128 GLU HB3 132 ALA H 5.11
&rst
ixpk= 0, nxpk= 0, iat=2127,2191, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61, /
#
# 131 LEU QD1 132 ALA H 4.47
&rst
ixpk= 0, nxpk= 0, iat= -1,2191, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
igr1=2181,2182,2183,2185,2186,2187,
/
#
# 131 LEU QD2 132 ALA H 4.47
&rst
ixpk= 0, nxpk= 0, iat= -1,2191, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
igr1=2181,2182,2183,2185,2186,2187,
/
#
# 132 ALA H 132 ALA QB 2.40
&rst
ixpk= 0, nxpk= 0, iat=2191, -1, r1= 1.30, r2= 1.80, r3= 2.88, r4= 3.38,
igr2=2195,2196,2197,
/
#
# 32 GLN H 32 GLN HNE1 4.41
&rst
ixpk= 0, nxpk= 0, iat= 487, 499, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, /
#
# 28 TRP HD1 32 GLN HNE1 4.36
&rst
ixpk= 0, nxpk= 0, iat= 414, 499, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86, /
#
# 28 TRP HD1 32 GLN HNE2 4.75
&rst
ixpk= 0, nxpk= 0, iat= 414, 500, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, /
#
# 31 LEU H 32 GLN HNE1 4.14
&rst
ixpk= 0, nxpk= 0, iat= 468, 499, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14, /
#
# 31 LEU H 32 GLN HNE2 4.75
&rst
ixpk= 0, nxpk= 0, iat= 468, 500, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, /
#
# 28 TRP HA 32 GLN HNE2 4.81
&rst
ixpk= 0, nxpk= 0, iat= 408, 500, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31, /
#
# 28 TRP HA 32 GLN HNE1 4.60
&rst
ixpk= 0, nxpk= 0, iat= 408, 499, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, /
#
# 29 LEU HA 32 GLN HNE1 4.03
&rst
ixpk= 0, nxpk= 0, iat= 432, 499, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53, /
#
# 29 LEU HA 32 GLN HNE2 4.21
&rst
ixpk= 0, nxpk= 0, iat= 432, 500, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71, /
#
# 32 GLN HB3 32 GLN HNE1 4.50
&rst
ixpk= 0, nxpk= 0, iat= 492, 499, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, /
#
# 32 GLN HG3 32 GLN HNE1 3.53
&rst
ixpk= 0, nxpk= 0, iat= 495, 499, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53, /
#
# 31 LEU HB2 32 GLN HNE1 3.77
&rst
ixpk= 0, nxpk= 0, iat= 472, 499, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27, /
#
# 31 LEU HB2 32 GLN HNE2 4.13
&rst
ixpk= 0, nxpk= 0, iat= 472, 500, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63, /
#
# 32 GLN HB3 32 GLN HNE2 4.75
&rst
ixpk= 0, nxpk= 0, iat= 492, 500, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, /
#
# 32 GLN HB2 32 GLN HNE2 5.03
&rst
ixpk= 0, nxpk= 0, iat= 491, 500, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53, /
#
# 32 GLN HB2 32 GLN HNE1 4.54
&rst
ixpk= 0, nxpk= 0, iat= 491, 499, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54, /
#
# 31 LEU HB3 32 GLN HNE1 3.93
&rst
ixpk= 0, nxpk= 0, iat= 473, 499, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93, /
#
# 32 GLN HG2 32 GLN HNE2 3.98
&rst
ixpk= 0, nxpk= 0, iat= 494, 500, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48, /
#
# 31 LEU HB3 32 GLN HNE2 4.26
&rst
ixpk= 0, nxpk= 0, iat= 473, 500, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76, /
#
# 31 LEU QD1 32 GLN HNE2 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 500, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr1= 477, 478, 479, 481, 482, 483,
/
#
# 31 LEU QD2 32 GLN HNE2 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 500, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr1= 477, 478, 479, 481, 482, 483,
/
#
# 29 LEU QD2 32 GLN HNE1 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 499, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr1= 439, 440, 441, 443, 444, 445,
/
#
# 29 LEU QD1 32 GLN HNE1 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 499, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr1= 439, 440, 441, 443, 444, 445,
/
#
# 118 ILE H 118 ILE HG13 3.85
&rst
ixpk= 0, nxpk= 0, iat=1956,1967, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35, /
#
# 120 SER H 120 SER HB2 3.82
&rst
ixpk= 0, nxpk= 0, iat=1995,1999, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32, /
#
# 128 GLU H 128 GLU HB2 3.07
&rst
ixpk= 0, nxpk= 0, iat=2122,2126, r1= 1.30, r2= 1.80, r3= 3.07, r4= 3.57, /
#
# 111 ASN HA 111 ASN HND1 3.67
&rst
ixpk= 0, nxpk= 0, iat=1831,1838, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67, /
#
# 107 SER HA 111 ASN HND1 4.42
&rst
ixpk= 0, nxpk= 0, iat=1764,1838, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92, /
#
# 111 ASN H 111 ASN HND1 3.50
&rst
ixpk= 0, nxpk= 0, iat=1829,1838, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, /
#
# 111 ASN HND1 114 LYS QD 5.11
&rst
ixpk= 0, nxpk= 0, iat=1838, -1, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
igr2=1891,1892,
/
#
# 111 ASN HA 111 ASN HND2 3.98
&rst
ixpk= 0, nxpk= 0, iat=1831,1839, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48, /
#
# 86 VAL HB 89 GLU H 5.50
&rst
ixpk= 0, nxpk= 0, iat=1410,1442, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 40 ALA H 40 ALA QB 2.76
&rst
ixpk= 0, nxpk= 0, iat= 623, -1, r1= 1.30, r2= 1.80, r3= 3.31, r4= 3.81,
igr2= 627, 628, 629,
/
#
# 27 LYS H 27 LYS HA 2.93
&rst
ixpk= 0, nxpk= 0, iat= 384, 386, r1= 1.30, r2= 1.80, r3= 2.93, r4= 3.43, /
#
# 78 GLN HA 78 GLN HNE2 4.42
&rst
ixpk= 0, nxpk= 0, iat=1282,1293, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42, /
#
# 78 GLN HA 78 GLN HNE1 4.15
&rst
ixpk= 0, nxpk= 0, iat=1282,1292, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15, /
#
# 78 GLN HG2 78 GLN HNE1 3.53
&rst
ixpk= 0, nxpk= 0, iat=1287,1292, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53, /
#
# 78 GLN HG3 78 GLN HNE1 3.53
&rst
ixpk= 0, nxpk= 0, iat=1288,1292, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.53, /
#
# 78 GLN HB2 78 GLN HNE1 4.44
&rst
ixpk= 0, nxpk= 0, iat=1284,1292, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64, /
#
# 77 ILE QG2 78 GLN HNE1 4.83
&rst
ixpk= 0, nxpk= 0, iat= -1,1292, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
igr1=1267,1268,1269,
/
#
# 77 ILE QD1 78 GLN HNE2 4.18
&rst
ixpk= 0, nxpk= 0, iat= -1,1293, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
igr1=1274,1275,1276,
/
#
# 72 LYS H 72 LYS QE 5.50
&rst
ixpk= 0, nxpk= 0, iat=1174, -1, r1= 1.30, r2= 1.80, r3= 6.37, r4= 6.97,
igr2=1187,1188,
/
#
# 53 ASN HND1 54 THR H 3.87
&rst
ixpk= 0, nxpk= 0, iat= 857, 862, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37, /
#
# 53 ASN HND2 54 THR H 4.01
&rst
ixpk= 0, nxpk= 0, iat= 858, 862, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51, /
#
# 53 ASN HB3 53 ASN HND1 3.47
&rst
ixpk= 0, nxpk= 0, iat= 853, 857, r1= 1.30, r2= 1.80, r3= 3.47, r4= 3.97, /
#
# 53 ASN HB3 53 ASN HND2 4.03
&rst
ixpk= 0, nxpk= 0, iat= 853, 858, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53, /
#
# 53 ASN HB2 53 ASN HND1 3.47
&rst
ixpk= 0, nxpk= 0, iat= 852, 857, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47, /
#
# 53 ASN HB2 53 ASN HND2 4.03
&rst
ixpk= 0, nxpk= 0, iat= 852, 858, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53, /
#
# 53 ASN HND1 56 ARG QG 4.97
&rst
ixpk= 0, nxpk= 0, iat= 857, -1, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr2= 907, 908,
/
#
# 125 ASN H 125 ASN HND1 3.34
&rst
ixpk= 0, nxpk= 0, iat=2077,2086, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84, /
#
# 125 ASN H 125 ASN HND2 4.05
&rst
ixpk= 0, nxpk= 0, iat=2077,2087, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55, /
#
# 125 ASN HA 125 ASN HND1 3.86
&rst
ixpk= 0, nxpk= 0, iat=2079,2086, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, /
#
# 125 ASN HA 125 ASN HND2 4.41
&rst
ixpk= 0, nxpk= 0, iat=2079,2087, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, /
#
# 122 GLN HA 125 ASN HND1 3.89
&rst
ixpk= 0, nxpk= 0, iat=2030,2086, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39, /
#
# 125 ASN HB2 125 ASN HND1 2.93
&rst
ixpk= 0, nxpk= 0, iat=2081,2086, r1= 1.30, r2= 1.80, r3= 2.93, r4= 3.43, /
#
# 125 ASN HB2 125 ASN HND2 3.57
&rst
ixpk= 0, nxpk= 0, iat=2081,2087, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07, /
#
# 121 LYS HG2 125 ASN HND1 3.73
&rst
ixpk= 0, nxpk= 0, iat=2013,2086, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23, /
#
# 121 LYS HG3 125 ASN HND1 3.74
&rst
ixpk= 0, nxpk= 0, iat=2014,2086, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24, /
#
# 121 LYS HG3 125 ASN HND2 3.53
&rst
ixpk= 0, nxpk= 0, iat=2014,2087, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03, /
#
# 124 VAL QG1 125 ASN HND1 5.08
&rst
ixpk= 0, nxpk= 0, iat= -1,2086, r1= 1.30, r2= 1.80, r3= 6.85, r4= 7.35,
igr1=2067,2068,2069,2071,2072,2073,
/
#
# 72 LYS HA 80 GLN HNE1 4.07
&rst
ixpk= 0, nxpk= 0, iat=1176,1329, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57, /
#
# 16 GLU HA 17 ASP H 3.33
&rst
ixpk= 0, nxpk= 0, iat= 243, 256, r1= 1.30, r2= 1.80, r3= 3.33, r4= 3.83, /
#
# 91 LEU H 91 LEU QD1 3.85
&rst
ixpk= 0, nxpk= 0, iat=1473, -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
igr2=1482,1483,1484,1486,1487,1488,
/
#
# 91 LEU H 91 LEU QD2 3.85
&rst
ixpk= 0, nxpk= 0, iat=1473, -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
igr2=1482,1483,1484,1486,1487,1488,
/
#
# 111 ASN HB2 113 LEU H 5.33
&rst
ixpk= 0, nxpk= 0, iat=1833,1862, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83, /
#
# 111 ASN HB3 113 LEU H 5.33
&rst
ixpk= 0, nxpk= 0, iat=1834,1862, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83, /
#
# 112 ILE H 113 LEU H 3.66
&rst
ixpk= 0, nxpk= 0, iat=1843,1862, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16, /
#
# 113 LEU H 115 GLU H 4.30
&rst
ixpk= 0, nxpk= 0, iat=1862,1903, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80, /
#
# 129 ARG H 129 ARG QG 3.42
&rst
ixpk= 0, nxpk= 0, iat=2137, -1, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
igr2=2144,2145,
/
#
# 15 LEU QD2 16 GLU H 3.42
&rst
ixpk= 0, nxpk= 0, iat= -1, 241, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
igr1= 231, 232, 233, 235, 236, 237,
/
#
# 15 LEU HA 16 GLU H 3.44
&rst
ixpk= 0, nxpk= 0, iat= 224, 241, r1= 1.30, r2= 1.80, r3= 3.44, r4= 3.94, /
#
# 16 GLU H 18 SER H 5.00
&rst
ixpk= 0, nxpk= 0, iat= 241, 268, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, /
#
# 16 GLU H 22 ILE H 4.97
&rst
ixpk= 0, nxpk= 0, iat= 241, 322, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, /
#
# 65 ASN HB2 66 HIS H 4.50
&rst
ixpk= 0, nxpk= 0, iat=1071,1081, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, /
#
# 22 ILE QG2 66 HIS H 4.58
&rst
ixpk= 0, nxpk= 0, iat= -1,1081, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
igr1= 328, 329, 330,
/
#
# 66 HIS H 67 VAL HB 5.50
&rst
ixpk= 0, nxpk= 0, iat=1081,1102, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 64 MET HA 66 HIS H 5.27
&rst
ixpk= 0, nxpk= 0, iat=1052,1081, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77, /
#
# 33 TYR H 33 TYR HB2 4.08
&rst
ixpk= 0, nxpk= 0, iat= 504, 508, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58, /
#
# 46 TYR H 46 TYR HD 4.28
&rst
ixpk= 0, nxpk= 0, iat= 726, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2= 734, 743,
/
#
# 8 PHE H 8 PHE HD 4.20
&rst
ixpk= 0, nxpk= 0, iat= 105, -1, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
igr2= 113, 121,
/
#
# 98 PHE H 98 PHE HD 3.13
&rst
ixpk= 0, nxpk= 0, iat=1588, -1, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01,
igr2=1596,1604,
/
#
# 13 ASN HND1 46 TYR HE 4.65
&rst
ixpk= 0, nxpk= 0, iat= 203, -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
igr2= 736, 741,
/
#
# 11 LYS HB2 14 THR H 5.19
&rst
ixpk= 0, nxpk= 0, iat= 157, 208, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69, /
#
# 18 SER HA 21 SER H 5.50
&rst
ixpk= 0, nxpk= 0, iat= 270, 311, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 16 GLU H 21 SER H 5.35
&rst
ixpk= 0, nxpk= 0, iat= 241, 311, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85, /
#
# 22 ILE H 22 ILE HB 3.95
&rst
ixpk= 0, nxpk= 0, iat= 322, 326, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45, /
#
# 22 ILE H 22 ILE QD1 3.70
&rst
ixpk= 0, nxpk= 0, iat= 322, -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
igr2= 335, 336, 337,
/
#
# 22 ILE QG2 23 SER H 4.40
&rst
ixpk= 0, nxpk= 0, iat= -1, 341, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
igr1= 328, 329, 330,
/
#
# 22 ILE QG2 26 SER H 4.93
&rst
ixpk= 0, nxpk= 0, iat= -1, 373, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
igr1= 328, 329, 330,
/
#
# 22 ILE QD1 23 SER H 4.80
&rst
ixpk= 0, nxpk= 0, iat= -1, 341, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
igr1= 335, 336, 337,
/
#
# 25 ALA QB 26 SER H 3.13
&rst
ixpk= 0, nxpk= 0, iat= -1, 373, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,
igr1= 367, 368, 369,
/
#
# 22 ILE HA 26 SER H 4.37
&rst
ixpk= 0, nxpk= 0, iat= 324, 373, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87, /
#
# 20 GLU HA 23 SER H 4.11
&rst
ixpk= 0, nxpk= 0, iat= 298, 341, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, /
#
# 26 SER H 28 TRP H 4.58
&rst
ixpk= 0, nxpk= 0, iat= 373, 406, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08, /
#
# 43 TRP HZ2 64 MET H 4.37
&rst
ixpk= 0, nxpk= 0, iat= 678,1050, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87, /
#
# 4 SER H 8 PHE H 5.50
&rst
ixpk= 0, nxpk= 0, iat= 51, 105, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 3 PHE H 7 GLN HNE1 5.46
&rst
ixpk= 0, nxpk= 0, iat= 31, 100, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96, /
#
# 4 SER H 7 GLN HNE1 5.50
&rst
ixpk= 0, nxpk= 0, iat= 51, 100, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 3 PHE H 3 PHE HD 3.68
&rst
ixpk= 0, nxpk= 0, iat= 31, -1, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
igr2= 39, 47,
/
#
# 28 TRP HE1 32 GLN HNE1 4.37
&rst
ixpk= 0, nxpk= 0, iat= 416, 499, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87, /
#
# 28 TRP HH2 32 GLN HNE2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 421, 500, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 31 LEU HB2 33 TYR H 5.50
&rst
ixpk= 0, nxpk= 0, iat= 472, 504, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 43 TRP H 46 TYR H 5.09
&rst
ixpk= 0, nxpk= 0, iat= 665, 726, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59, /
#
# 22 ILE QG2 63 LEU H 4.49
&rst
ixpk= 0, nxpk= 0, iat= -1,1031, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr1= 328, 329, 330,
/
#
# 42 MET H 45 GLU H 5.13
&rst
ixpk= 0, nxpk= 0, iat= 648, 711, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63, /
#
# 46 TYR QB 47 MET H 3.76
&rst
ixpk= 0, nxpk= 0, iat= -1, 747, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
igr1= 730, 731,
/
#
# 49 ARG HG2 51 SER H 3.93
&rst
ixpk= 0, nxpk= 0, iat= 790, 821, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43, /
#
# 50 PRO HB3 52 VAL H 5.50
&rst
ixpk= 0, nxpk= 0, iat= 815, 832, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 53 ASN H 57 LYS HG3 5.08
&rst
ixpk= 0, nxpk= 0, iat= 848, 932, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58, /
#
# 53 ASN HND2 55 ARG QB 4.22
&rst
ixpk= 0, nxpk= 0, iat= 858, -1, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr2= 880, 881,
/
#
# 53 ASN HND1 55 ARG QB 3.98
&rst
ixpk= 0, nxpk= 0, iat= 857, -1, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
igr2= 880, 881,
/
#
# 53 ASN HND1 55 ARG H 4.49
&rst
ixpk= 0, nxpk= 0, iat= 857, 876, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99, /
#
# 53 ASN HND2 55 ARG H 4.46
&rst
ixpk= 0, nxpk= 0, iat= 858, 876, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, /
#
# 53 ASN HND1 56 ARG H 4.98
&rst
ixpk= 0, nxpk= 0, iat= 857, 900, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48, /
#
# 46 TYR HE 56 ARG H 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 900, r1= 1.30, r2= 1.80, r3= 6.37, r4= 6.87,
igr1= 736, 741,
/
#
# 57 LYS H 98 PHE HE 4.53
&rst
ixpk= 0, nxpk= 0, iat= 924, -1, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
igr2=1598,1602,
/
#
# 17 ASP HA 59 LEU H 5.50
&rst
ixpk= 0, nxpk= 0, iat= 258, 965, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20, /
#
# 60 GLY H 61 LEU HA 5.47
&rst
ixpk= 0, nxpk= 0, iat= 984, 993, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97, /
#
# 61 LEU H 62 TYR HB2 5.33
&rst
ixpk= 0, nxpk= 0, iat= 991,1014, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83, /
#
# 62 TYR HB2 63 LEU H 4.60
&rst
ixpk= 0, nxpk= 0, iat=1014,1031, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, /
#
# 62 TYR HD 63 LEU H 4.81
&rst
ixpk= 0, nxpk= 0, iat= -1,1031, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr1=1018,1027,
/
#
# 62 TYR HB3 65 ASN H 5.50
&rst
ixpk= 0, nxpk= 0, iat=1015,1067, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 67 VAL HA 69 GLN H 4.83
&rst
ixpk= 0, nxpk= 0, iat=1100,1130, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33, /
#
# 30 LEU QD1 71 ALA H 4.01
&rst
ixpk= 0, nxpk= 0, iat= -1,1164, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,
igr1= 458, 459, 460, 462, 463, 464,
/
#
# 71 ALA H 71 ALA QB 3.20
&rst
ixpk= 0, nxpk= 0, iat=1164, -1, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
igr2=1168,1169,1170,
/
#
# 71 ALA H 74 GLN HG2 5.50
&rst
ixpk= 0, nxpk= 0, iat=1164,1210, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 71 ALA H 79 PHE HB3 5.50
&rst
ixpk= 0, nxpk= 0, iat=1164,1302, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 67 VAL HA 71 ALA H 4.85
&rst
ixpk= 0, nxpk= 0, iat=1100,1164, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35, /
#
# 68 VAL HA 71 ALA H 4.23
&rst
ixpk= 0, nxpk= 0, iat=1116,1164, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73, /
#
# 69 GLN H 71 ALA H 4.79
&rst
ixpk= 0, nxpk= 0, iat=1130,1164, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29, /
#
# 71 ALA H 74 GLN HNE1 5.12
&rst
ixpk= 0, nxpk= 0, iat=1164,1215, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, /
#
# 71 ALA H 73 GLY H 4.76
&rst
ixpk= 0, nxpk= 0, iat=1164,1196, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26, /
#
# 69 GLN H 72 LYS H 5.23
&rst
ixpk= 0, nxpk= 0, iat=1130,1174, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73, /
#
# 75 LYS H 76 ILE HA 5.30
&rst
ixpk= 0, nxpk= 0, iat=1220,1244, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80, /
#
# 75 LYS H 76 ILE H 3.56
&rst
ixpk= 0, nxpk= 0, iat=1220,1242, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06, /
#
# 33 TYR HE 78 GLN HNE1 4.74
&rst
ixpk= 0, nxpk= 0, iat= -1,1292, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
igr1= 514, 519,
/
#
# 77 ILE HB 78 GLN HNE1 4.74
&rst
ixpk= 0, nxpk= 0, iat=1265,1292, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24, /
#
# 78 GLN HB3 78 GLN HNE2 4.95
&rst
ixpk= 0, nxpk= 0, iat=1285,1293, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95, /
#
# 77 ILE HG12 78 GLN HNE1 4.68
&rst
ixpk= 0, nxpk= 0, iat=1271,1292, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18, /
#
# 76 ILE QG2 78 GLN HNE1 4.33
&rst
ixpk= 0, nxpk= 0, iat= -1,1292, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
igr1=1248,1249,1250,
/
#
# 76 ILE QG2 78 GLN HNE2 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1293, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1=1248,1249,1250,
/
#
# 82 SER H 85 LYS QE 5.28
&rst
ixpk= 0, nxpk= 0, iat=1346, -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr2=1397,1398,
/
#
# 37 PRO HA 82 SER H 4.70
&rst
ixpk= 0, nxpk= 0, iat= 581,1346, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, /
#
# 82 SER H 83 PHE HD 5.50
&rst
ixpk= 0, nxpk= 0, iat=1346, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2=1365,1373,
/
#
# 83 PHE H 86 VAL QG1 5.21
&rst
ixpk= 0, nxpk= 0, iat=1357, -1, r1= 1.30, r2= 1.80, r3= 7.02, r4= 7.52,
igr2=1412,1413,1414,1416,1417,1418,
/
#
# 44 LYS HB2 86 VAL H 5.49
&rst
ixpk= 0, nxpk= 0, iat= 693,1406, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99, /
#
# 83 PHE H 86 VAL H 5.29
&rst
ixpk= 0, nxpk= 0, iat=1357,1406, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79, /
#
# 90 VAL H 93 ARG H 4.79
&rst
ixpk= 0, nxpk= 0, iat=1457,1499, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29, /
#
# 87 ALA QB 91 LEU H 5.19
&rst
ixpk= 0, nxpk= 0, iat= -1,1473, r1= 1.30, r2= 1.80, r3= 6.23, r4= 6.73,
igr1=1426,1427,1428,
/
#
# 92 GLY HA2 96 GLN H 5.23
&rst
ixpk= 0, nxpk= 0, iat=1494,1556, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73, /
#
# 99 PRO HB2 101 ASP H 4.06
&rst
ixpk= 0, nxpk= 0, iat=1615,1646, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56, /
#
# 103 LYS H 106 LEU HB3 5.02
&rst
ixpk= 0, nxpk= 0, iat=1677,1748, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52, /
#
# 111 ASN H 112 ILE H 3.35
&rst
ixpk= 0, nxpk= 0, iat=1829,1843, r1= 1.30, r2= 1.80, r3= 3.35, r4= 3.85, /
#
# 111 ASN H 111 ASN HND2 4.32
&rst
ixpk= 0, nxpk= 0, iat=1829,1839, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82, /
#
# 111 ASN HA 113 LEU H 4.65
&rst
ixpk= 0, nxpk= 0, iat=1831,1862, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15, /
#
# 112 ILE HB 113 LEU H 3.31
&rst
ixpk= 0, nxpk= 0, iat=1847,1862, r1= 1.30, r2= 1.80, r3= 3.31, r4= 3.81, /
#
# 113 LEU H 114 LYS HG2 4.47
&rst
ixpk= 0, nxpk= 0, iat=1862,1888, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97, /
#
# 114 LYS H 116 ARG H 4.51
&rst
ixpk= 0, nxpk= 0, iat=1881,1918, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01, /
#
# 117 ASN HB3 119 PHE H 5.50
&rst
ixpk= 0, nxpk= 0, iat=1947,1975, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 120 SER H 123 VAL HA 5.50
&rst
ixpk= 0, nxpk= 0, iat=1995,2047, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 85 LYS QE 120 SER H 5.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1995, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
igr1=1397,1398,
/
#
# 108 ARG HA 110 VAL H 4.92
&rst
ixpk= 0, nxpk= 0, iat=1775,1813, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42, /
#
# 109 VAL HB 110 VAL H 3.40
&rst
ixpk= 0, nxpk= 0, iat=1801,1813, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90, /
#
# 109 VAL QG1 110 VAL H 3.76
&rst
ixpk= 0, nxpk= 0, iat= -1,1813, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
igr1=1803,1804,1805,1807,1808,1809,
/
#
# 110 VAL H 110 VAL QG1 3.31
&rst
ixpk= 0, nxpk= 0, iat=1813, -1, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
igr2=1819,1820,1821,1823,1824,1825,
/
#
# 124 VAL QG2 125 ASN HND1 5.08
&rst
ixpk= 0, nxpk= 0, iat= -1,2086, r1= 1.30, r2= 1.80, r3= 6.85, r4= 7.35,
igr1=2067,2068,2069,2071,2072,2073,
/
#
# 121 LYS QE 125 ASN HND2 3.64
&rst
ixpk= 0, nxpk= 0, iat= -1,2087, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59,
igr1=2019,2020,
/
#
# 121 LYS QE 125 ASN HND1 3.91
&rst
ixpk= 0, nxpk= 0, iat= -1,2086, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,
igr1=2019,2020,
/
#
# 95 ASN QB 131 LEU H 4.80
&rst
ixpk= 0, nxpk= 0, iat= -1,2172, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr1=1546,1547,
/
#
# 134 ALA H 136 GLU H 4.10
&rst
ixpk= 0, nxpk= 0, iat=2211,2240, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60, /
#
# 131 LEU H 134 ALA H 5.03
&rst
ixpk= 0, nxpk= 0, iat=2172,2211, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53, /
#
# 135 LEU H 136 GLU H 2.85
&rst
ixpk= 0, nxpk= 0, iat=2221,2240, r1= 1.30, r2= 1.80, r3= 2.85, r4= 3.35, /
#
# 135 LEU H 135 LEU HG 2.40
&rst
ixpk= 0, nxpk= 0, iat=2221,2228, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90, /
#
# 134 ALA QB 135 LEU H 2.67
&rst
ixpk= 0, nxpk= 0, iat= -1,2221, r1= 1.30, r2= 1.80, r3= 3.21, r4= 3.71,
igr1=2215,2216,2217,
/
#
# 135 LEU HG 136 GLU H 3.02
&rst
ixpk= 0, nxpk= 0, iat=2228,2240, r1= 1.30, r2= 1.80, r3= 3.02, r4= 3.52, /
#
# 135 LEU QD2 136 GLU H 4.16
&rst
ixpk= 0, nxpk= 0, iat= -1,2240, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr1=2230,2231,2232,2234,2235,2236,
/
#
# 12 LEU H 12 LEU HB2 3.30
&rst
ixpk= 0, nxpk= 0, iat= 175, 179, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80, /
#
# 13 ASN QB 15 LEU H 5.04
&rst
ixpk= 0, nxpk= 0, iat= -1, 222, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr1= 198, 199,
/
#
# 33 TYR HB2 36 ALA H 4.88
&rst
ixpk= 0, nxpk= 0, iat= 508, 561, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38, /
#
# 42 MET H 42 MET HG2 3.60
&rst
ixpk= 0, nxpk= 0, iat= 648, -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
igr2= 655, 656,
/
#
# 42 MET H 42 MET HG3 3.60
&rst
ixpk= 0, nxpk= 0, iat= 648, -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
igr2= 655, 656,
/
#
# 44 LYS H 47 MET HG3 5.50
&rst
ixpk= 0, nxpk= 0, iat= 689, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 754, 755,
/
#
# 47 MET H 47 MET HG3 3.68
&rst
ixpk= 0, nxpk= 0, iat= 747, -1, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
igr2= 754, 755,
/
#
# 47 MET H 47 MET HG2 3.86
&rst
ixpk= 0, nxpk= 0, iat= 747, -1, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,
igr2= 754, 755,
/
#
# 47 MET H 47 MET HB2 3.55
&rst
ixpk= 0, nxpk= 0, iat= 747, -1, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,
igr2= 751, 752,
/
#
# 86 VAL H 86 VAL QG1 2.98
&rst
ixpk= 0, nxpk= 0, iat=1406, -1, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,
igr2=1412,1413,1414,1416,1417,1418,
/
#
# 135 LEU QD1 136 GLU H 4.16
&rst
ixpk= 0, nxpk= 0, iat= -1,2240, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr1=2230,2231,2232,2234,2235,2236,
/
#
# 122 GLN HG2 122 GLN HNE1 2.59
&rst
ixpk= 0, nxpk= 0, iat=2035,2040, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09, /
#
# 122 GLN HG2 122 GLN HNE2 3.56
&rst
ixpk= 0, nxpk= 0, iat=2035,2041, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06, /
#
# 122 GLN HB2 122 GLN HNE1 4.21
&rst
ixpk= 0, nxpk= 0, iat=2032,2040, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21, /
#
# 122 GLN HB2 122 GLN HNE2 4.97
&rst
ixpk= 0, nxpk= 0, iat=2032,2041, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, /
#
# 47 MET H 47 MET HB3 3.69
&rst
ixpk= 0, nxpk= 0, iat= 747, -1, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,
igr2= 751, 752,
/
#
# 29 LEU H 30 LEU H 3.59
&rst
ixpk= 0, nxpk= 0, iat= 430, 449, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09, /
#
# 28 TRP HE3 29 LEU H 3.72
&rst
ixpk= 0, nxpk= 0, iat= 425, 430, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22, /
#
# 28 TRP H 29 LEU H 3.38
&rst
ixpk= 0, nxpk= 0, iat= 406, 430, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88, /
#
# 29 LEU H 31 LEU H 4.67
&rst
ixpk= 0, nxpk= 0, iat= 430, 468, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, /
#
# 28 TRP HZ3 29 LEU H 4.57
&rst
ixpk= 0, nxpk= 0, iat= 423, 430, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07, /
#
# 28 TRP HB2 29 LEU H 3.96
&rst
ixpk= 0, nxpk= 0, iat= 410, 430, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46, /
#
# 28 TRP HB3 29 LEU H 3.96
&rst
ixpk= 0, nxpk= 0, iat= 411, 430, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46, /
#
# 29 LEU H 29 LEU HB3 3.41
&rst
ixpk= 0, nxpk= 0, iat= 430, 435, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91, /
#
# 25 ALA QB 29 LEU H 4.66
&rst
ixpk= 0, nxpk= 0, iat= -1, 430, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
igr1= 367, 368, 369,
/
#
# 109 VAL H 110 VAL H 3.36
&rst
ixpk= 0, nxpk= 0, iat=1797,1813, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86, /
#
# 110 VAL H 110 VAL HB 3.78
&rst
ixpk= 0, nxpk= 0, iat=1813,1817, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28, /
#
# 116 ARG H 118 ILE HG13 5.47
&rst
ixpk= 0, nxpk= 0, iat=1918,1967, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97, /
#
# 96 GLN HG2 96 GLN HNE1 2.85
&rst
ixpk= 0, nxpk= 0, iat=1563,1568, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15, /
#
# 96 GLN HG3 96 GLN HNE1 3.25
&rst
ixpk= 0, nxpk= 0, iat=1564,1568, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25, /
#
# 96 GLN HNE1 134 ALA QB 3.23
&rst
ixpk= 0, nxpk= 0, iat=1568, -1, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,
igr2=2215,2216,2217,
/
#
# 96 GLN HNE2 134 ALA HA 3.67
&rst
ixpk= 0, nxpk= 0, iat=1569,2213, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17, /
#
# 96 GLN HNE1 134 ALA HA 3.71
&rst
ixpk= 0, nxpk= 0, iat=1568,2213, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21, /
#
# 96 GLN HG3 96 GLN HNE2 3.94
&rst
ixpk= 0, nxpk= 0, iat=1564,1569, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44, /
#
# 96 GLN HG2 96 GLN HNE2 3.58
&rst
ixpk= 0, nxpk= 0, iat=1563,1569, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08, /
#
# 96 GLN HNE2 134 ALA QB 3.38
&rst
ixpk= 0, nxpk= 0, iat=1569, -1, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,
igr2=2215,2216,2217,
/
#
# 95 ASN HND2 131 LEU HA 3.71
&rst
ixpk= 0, nxpk= 0, iat=1552,2174, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21, /
#
# 95 ASN HND1 131 LEU HA 3.71
&rst
ixpk= 0, nxpk= 0, iat=1551,2174, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21, /
#
# 95 ASN HA 95 ASN HND1 4.74
&rst
ixpk= 0, nxpk= 0, iat=1544,1551, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24, /
#
# 95 ASN HA 95 ASN HND2 4.74
&rst
ixpk= 0, nxpk= 0, iat=1544,1552, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24, /
#
# 95 ASN HND1 103 LYS QE 4.43
&rst
ixpk= 0, nxpk= 0, iat=1551, -1, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
igr2=1690,1691,
/
#
# 95 ASN QB 95 ASN HND1 3.37
&rst
ixpk= 0, nxpk= 0, iat= -1,1551, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,
igr1=1546,1547,
/
#
# 95 ASN QB 95 ASN HND2 3.37
&rst
ixpk= 0, nxpk= 0, iat= -1,1552, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,
igr1=1546,1547,
/
#
# 95 ASN HND1 131 LEU HB3 4.12
&rst
ixpk= 0, nxpk= 0, iat=1551,2177, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62, /
#
# 95 ASN HND2 131 LEU HB3 4.12
&rst
ixpk= 0, nxpk= 0, iat=1552,2177, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62, /
#
# 95 ASN HND2 131 LEU HB2 5.39
&rst
ixpk= 0, nxpk= 0, iat=1552,2176, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89, /
#
# 95 ASN HND2 131 LEU HG 5.50
&rst
ixpk= 0, nxpk= 0, iat=1552,2179, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 95 ASN HND1 131 LEU HB2 5.39
&rst
ixpk= 0, nxpk= 0, iat=1551,2176, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89, /
#
# 95 ASN HND1 131 LEU HG 5.50
&rst
ixpk= 0, nxpk= 0, iat=1551,2179, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 30 LEU QD2 74 GLN HNE1 3.84
&rst
ixpk= 0, nxpk= 0, iat= -1,1215, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
igr1= 458, 459, 460, 462, 463, 464,
/
#
# 30 LEU QD2 74 GLN HNE2 3.65
&rst
ixpk= 0, nxpk= 0, iat= -1,1216, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
igr1= 458, 459, 460, 462, 463, 464,
/
#
# 30 LEU QD1 74 GLN HNE1 3.84
&rst
ixpk= 0, nxpk= 0, iat= -1,1215, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
igr1= 458, 459, 460, 462, 463, 464,
/
#
# 30 LEU QD1 74 GLN HNE2 3.65
&rst
ixpk= 0, nxpk= 0, iat= -1,1216, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
igr1= 458, 459, 460, 462, 463, 464,
/
#
# 74 GLN HNE1 76 ILE HG12 4.51
&rst
ixpk= 0, nxpk= 0, iat=1215,1252, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01, /
#
# 74 GLN HNE2 76 ILE HG12 5.13
&rst
ixpk= 0, nxpk= 0, iat=1216,1252, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63, /
#
# 74 GLN QB 74 GLN HNE1 3.57
&rst
ixpk= 0, nxpk= 0, iat= -1,1215, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,
igr1=1207,1208,
/
#
# 74 GLN QB 74 GLN HNE2 3.73
&rst
ixpk= 0, nxpk= 0, iat= -1,1216, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,
igr1=1207,1208,
/
#
# 70 GLN HG3 74 GLN HNE2 3.95
&rst
ixpk= 0, nxpk= 0, iat=1155,1216, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45, /
#
# 74 GLN HG2 74 GLN HNE1 3.06
&rst
ixpk= 0, nxpk= 0, iat=1210,1215, r1= 1.30, r2= 1.80, r3= 3.06, r4= 3.56, /
#
# 74 GLN HG2 74 GLN HNE2 3.78
&rst
ixpk= 0, nxpk= 0, iat=1210,1216, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28, /
#
# 70 GLN HG2 74 GLN HNE2 3.95
&rst
ixpk= 0, nxpk= 0, iat=1154,1216, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45, /
#
# 70 GLN HA 74 GLN HNE1 4.18
&rst
ixpk= 0, nxpk= 0, iat=1149,1215, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68, /
#
# 70 GLN HA 74 GLN HNE2 4.78
&rst
ixpk= 0, nxpk= 0, iat=1149,1216, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, /
#
# 74 GLN HA 74 GLN HNE1 4.68
&rst
ixpk= 0, nxpk= 0, iat=1205,1215, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18, /
#
# 74 GLN H 74 GLN HNE1 4.07
&rst
ixpk= 0, nxpk= 0, iat=1203,1215, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57, /
#
# 132 ALA QB 133 ALA H 2.68
&rst
ixpk= 0, nxpk= 0, iat= -1,2201, r1= 1.30, r2= 1.80, r3= 3.22, r4= 3.72,
igr1=2195,2196,2197,
/
#
# 133 ALA H 133 ALA QB 2.80
&rst
ixpk= 0, nxpk= 0, iat=2201, -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
igr2=2205,2206,2207,
/
#
# 75 LYS H 75 LYS QE 4.71
&rst
ixpk= 0, nxpk= 0, iat=1220, -1, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,
igr2=1233,1234,
/
#
# 75 LYS H 75 LYS HG3 3.99
&rst
ixpk= 0, nxpk= 0, iat=1220,1228, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49, /
#
# 27 LYS H 27 LYS QE 5.08
&rst
ixpk= 0, nxpk= 0, iat= 384, -1, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr2= 397, 398,
/
#
# 117 ASN H 117 ASN HND2 4.29
&rst
ixpk= 0, nxpk= 0, iat=1942,1952, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79, /
#
# 117 ASN H 117 ASN HND1 3.72
&rst
ixpk= 0, nxpk= 0, iat=1942,1951, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22, /
#
# 117 ASN HA 117 ASN HND2 3.99
&rst
ixpk= 0, nxpk= 0, iat=1944,1952, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49, /
#
# 117 ASN HA 117 ASN HND1 3.89
&rst
ixpk= 0, nxpk= 0, iat=1944,1951, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89, /
#
# 114 LYS HA 117 ASN HND2 5.14
&rst
ixpk= 0, nxpk= 0, iat=1883,1952, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64, /
#
# 116 ARG HA 117 ASN HND1 4.46
&rst
ixpk= 0, nxpk= 0, iat=1920,1951, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, /
#
# 114 LYS HA 117 ASN HND1 4.76
&rst
ixpk= 0, nxpk= 0, iat=1883,1951, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26, /
#
# 117 ASN HB2 117 ASN HND1 2.97
&rst
ixpk= 0, nxpk= 0, iat=1946,1951, r1= 1.30, r2= 1.80, r3= 3.47, r4= 3.97, /
#
# 70 GLN HA 70 GLN HNE1 4.22
&rst
ixpk= 0, nxpk= 0, iat=1149,1159, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, /
#
# 70 GLN HA 70 GLN HNE2 4.22
&rst
ixpk= 0, nxpk= 0, iat=1149,1160, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, /
#
# 74 GLN H 74 GLN HG2 3.64
&rst
ixpk= 0, nxpk= 0, iat=1203,1210, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14, /
#
# 82 SER H 82 SER HB3 3.62
&rst
ixpk= 0, nxpk= 0, iat=1346,1351, r1= 1.30, r2= 1.80, r3= 3.62, r4= 4.12, /
#
# 82 SER H 82 SER HB2 3.62
&rst
ixpk= 0, nxpk= 0, iat=1346,1350, r1= 1.30, r2= 1.80, r3= 3.62, r4= 4.12, /
#
# 107 SER H 107 SER QB 2.78
&rst
ixpk= 0, nxpk= 0, iat=1762, -1, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,
igr2=1766,1767,
/
#
# 39 VAL QG1 43 TRP H 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 665, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr1= 613, 614, 615, 617, 618, 619,
/
#
# 12 LEU QD1 43 TRP H 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 665, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr1= 184, 185, 186, 188, 189, 190,
/
#
# 96 GLN HB3 96 GLN HNE1 4.19
&rst
ixpk= 0, nxpk= 0, iat=1561,1568, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, /
#
# 96 GLN HB3 96 GLN HNE2 4.30
&rst
ixpk= 0, nxpk= 0, iat=1561,1569, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80, /
#
# 7 GLN HNE1 8 PHE H 4.46
&rst
ixpk= 0, nxpk= 0, iat= 100, 105, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, /
#
# 79 PHE HD 83 PHE H 4.70
&rst
ixpk= 0, nxpk= 0, iat= -1,1357, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
igr1=1305,1313,
/
#
# 57 LYS H 98 PHE HZ 4.62
&rst
ixpk= 0, nxpk= 0, iat= 924,1600, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12, /
#
# 57 LYS H 59 LEU H 4.47
&rst
ixpk= 0, nxpk= 0, iat= 924, 965, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97, /
#
# 62 TYR HA 66 HIS H 5.14
&rst
ixpk= 0, nxpk= 0, iat=1012,1081, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64, /
#
# 62 TYR H 62 TYR HE 4.82
&rst
ixpk= 0, nxpk= 0, iat=1010, -1, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,
igr2=1020,1025,
/
#
# 116 ARG H 116 ARG HE 5.50
&rst
ixpk= 0, nxpk= 0, iat=1918,1931, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 116 ARG HA 116 ARG HE 5.50
&rst
ixpk= 0, nxpk= 0, iat=1920,1931, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 112 ILE QG2 116 ARG HE 4.58
&rst
ixpk= 0, nxpk= 0, iat= -1,1931, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
igr1=1849,1850,1851,
/
#
# 116 ARG HE 118 ILE QD1 5.15
&rst
ixpk= 0, nxpk= 0, iat=1931, -1, r1= 1.30, r2= 1.80, r3= 6.18, r4= 6.68,
igr2=1969,1970,1971,
/
#
# 116 ARG QB 116 ARG HE 5.13
&rst
ixpk= 0, nxpk= 0, iat= -1,1931, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
igr1=1922,1923,
/
#
# 5 SER H 6 GLU HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= 62, 75, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 5 SER H 6 GLU H 5.50
&rst
ixpk= 0, nxpk= 0, iat= 62, 73, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 100 ARG H 100 ARG QD 5.31
&rst
ixpk= 0, nxpk= 0, iat=1622, -1, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
igr2=1632,1633,
/
#
# 100 ARG H 101 ASP HA 5.50
&rst
ixpk= 0, nxpk= 0, iat=1622,1648, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 100 ARG H 101 ASP H 5.50
&rst
ixpk= 0, nxpk= 0, iat=1622,1646, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 9 THR H 12 LEU QD1 5.50
&rst
ixpk= 0, nxpk= 0, iat= 125, -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr2= 184, 185, 186, 188, 189, 190,
/
#
# 13 ASN H 15 LEU H 4.34
&rst
ixpk= 0, nxpk= 0, iat= 194, 222, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84, /
#
# 15 LEU H 16 GLU H 4.71
&rst
ixpk= 0, nxpk= 0, iat= 222, 241, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21, /
#
# 22 ILE H 22 ILE QG2 4.35
&rst
ixpk= 0, nxpk= 0, iat= 322, -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
igr2= 328, 329, 330,
/
#
# 27 LYS H 28 TRP H 5.16
&rst
ixpk= 0, nxpk= 0, iat= 384, 406, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66, /
#
# 33 TYR HB2 34 ARG H 4.53
&rst
ixpk= 0, nxpk= 0, iat= 508, 525, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03, /
#
# 44 LYS H 46 TYR QB 5.24
&rst
ixpk= 0, nxpk= 0, iat= 689, -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
igr2= 730, 731,
/
#
# 55 ARG H 58 LEU H 4.83
&rst
ixpk= 0, nxpk= 0, iat= 876, 946, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33, /
#
# 68 VAL H 71 ALA H 4.88
&rst
ixpk= 0, nxpk= 0, iat=1114,1164, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38, /
#
# 16 GLU HA 16 GLU HG2 3.57
&rst
ixpk= 0, nxpk= 0, iat= 243, 248, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07, /
#
# 37 PRO QD 38 LYS QB 5.07
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.39, r4= 6.89,
igr1= 572, 573,
igr2= 589, 590,
/
#
# 55 ARG HA 55 ARG HG2 3.91
&rst
ixpk= 0, nxpk= 0, iat= 878, 883, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41, /
#
# 64 MET HA 64 MET HG3 4.10
&rst
ixpk= 0, nxpk= 0, iat=1052, -1, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
igr2=1057,1058,
/
#
# 39 VAL HA 39 VAL QG2 3.36
&rst
ixpk= 0, nxpk= 0, iat= 609, -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
igr2= 613, 614, 615, 617, 618, 619,
/
#
# 67 VAL HA 67 VAL QG1 3.59
&rst
ixpk= 0, nxpk= 0, iat=1100, -1, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
igr2=1104,1105,1106,1108,1109,1110,
/
#
# 16 GLU HA 16 GLU HG3 3.57
&rst
ixpk= 0, nxpk= 0, iat= 243, 249, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07, /
#
# 49 ARG HA 49 ARG HG2 4.08
&rst
ixpk= 0, nxpk= 0, iat= 785, 790, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58, /
#
# 108 ARG HA 108 ARG HD2 3.70
&rst
ixpk= 0, nxpk= 0, iat=1775,1783, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20, /
#
# 108 ARG HA 108 ARG HD3 3.70
&rst
ixpk= 0, nxpk= 0, iat=1775,1784, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20, /
#
# 77 ILE QD1 78 GLN HA 3.46
&rst
ixpk= 0, nxpk= 0, iat= -1,1282, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
igr1=1274,1275,1276,
/
#
# 77 ILE HG13 78 GLN HA 4.54
&rst
ixpk= 0, nxpk= 0, iat=1272,1282, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, /
#
# 85 LYS HA 85 LYS HG3 3.88
&rst
ixpk= 0, nxpk= 0, iat=1386,1392, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38, /
#
# 93 ARG HA 93 ARG HD3 3.63
&rst
ixpk= 0, nxpk= 0, iat=1501,1510, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13, /
#
# 38 LYS HA 38 LYS QD 3.38
&rst
ixpk= 0, nxpk= 0, iat= 587, -1, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,
igr2= 595, 596,
/
#
# 38 LYS HA 38 LYS HG2 3.92
&rst
ixpk= 0, nxpk= 0, iat= 587, 592, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42, /
#
# 63 LEU HA 63 LEU QD1 4.01
&rst
ixpk= 0, nxpk= 0, iat=1033, -1, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,
igr2=1040,1041,1042,1044,1045,1046,
/
#
# 41 GLU HA 41 GLU HG2 3.78
&rst
ixpk= 0, nxpk= 0, iat= 635, 640, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28, /
#
# 41 GLU HA 41 GLU HG3 3.78
&rst
ixpk= 0, nxpk= 0, iat= 635, 641, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28, /
#
# 70 GLN HA 70 GLN HG3 3.99
&rst
ixpk= 0, nxpk= 0, iat=1149,1155, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49, /
#
# 15 LEU HA 15 LEU QD1 3.76
&rst
ixpk= 0, nxpk= 0, iat= 224, -1, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
igr2= 231, 232, 233, 235, 236, 237,
/
#
# 64 MET QE 87 ALA HA 3.58
&rst
ixpk= 0, nxpk= 0, iat= -1,1424, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
igr1=1061,1062,1063,
/
#
# 7 GLN HA 7 GLN HG2 3.94
&rst
ixpk= 0, nxpk= 0, iat= 90, 95, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44, /
#
# 6 GLU QG 7 GLN HA 3.89
&rst
ixpk= 0, nxpk= 0, iat= -1, 90, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
igr1= 80, 81,
/
#
# 75 LYS HA 75 LYS HG3 3.94
&rst
ixpk= 0, nxpk= 0, iat=1222,1228, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44, /
#
# 75 LYS HA 75 LYS HG2 3.94
&rst
ixpk= 0, nxpk= 0, iat=1222,1227, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44, /
#
# 75 LYS HA 75 LYS QE 3.86
&rst
ixpk= 0, nxpk= 0, iat=1222, -1, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13,
igr2=1233,1234,
/
#
# 91 LEU HA 91 LEU HG 3.72
&rst
ixpk= 0, nxpk= 0, iat=1475,1480, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22, /
#
# 91 LEU HA 94 ILE QD1 3.10
&rst
ixpk= 0, nxpk= 0, iat=1475, -1, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,
igr2=1536,1537,1538,
/
#
# 94 ILE HA 94 ILE QG2 2.86
&rst
ixpk= 0, nxpk= 0, iat=1525, -1, r1= 1.30, r2= 1.80, r3= 3.43, r4= 3.93,
igr2=1529,1530,1531,
/
#
# 45 GLU HA 45 GLU HG3 3.39
&rst
ixpk= 0, nxpk= 0, iat= 713, 719, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09, /
#
# 29 LEU HA 29 LEU QD2 3.45
&rst
ixpk= 0, nxpk= 0, iat= 432, -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
igr2= 439, 440, 441, 443, 444, 445,
/
#
# 9 THR HA 9 THR QG2 2.84
&rst
ixpk= 0, nxpk= 0, iat= 127, -1, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91,
igr2= 131, 132, 133,
/
#
# 90 VAL HA 90 VAL QG1 3.26
&rst
ixpk= 0, nxpk= 0, iat=1459, -1, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,
igr2=1463,1464,1465,1467,1468,1469,
/
#
# 100 ARG HG3 100 ARG QD 2.70
&rst
ixpk= 0, nxpk= 0, iat=1630, -1, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53,
igr2=1632,1633,
/
#
# 10 THR HA 10 THR QG2 3.19
&rst
ixpk= 0, nxpk= 0, iat= 141, -1, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,
igr2= 145, 146, 147,
/
#
# 54 THR HA 54 THR QG2 2.80
&rst
ixpk= 0, nxpk= 0, iat= 864, -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
igr2= 868, 869, 870,
/
#
# 54 THR QG2 98 PHE HA 3.23
&rst
ixpk= 0, nxpk= 0, iat= -1,1590, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,
igr1= 868, 869, 870,
/
#
# 119 PHE HA 119 PHE HE 4.55
&rst
ixpk= 0, nxpk= 0, iat=1977, -1, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,
igr2=1985,1989,
/
#
# 6 GLU H 6 GLU QG 4.33
&rst
ixpk= 0, nxpk= 0, iat= 73, -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
igr2= 80, 81,
/
#
# 113 LEU H 113 LEU HG 4.65
&rst
ixpk= 0, nxpk= 0, iat=1862,1869, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15, /
#
# 125 ASN H 125 ASN HB3 3.68
&rst
ixpk= 0, nxpk= 0, iat=2077,2082, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18, /
#
# 103 LYS HA 103 LYS QG 3.46
&rst
ixpk= 0, nxpk= 0, iat=1679, -1, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,
igr2=1684,1685,
/
#
# 91 LEU H 91 LEU HG 4.14
&rst
ixpk= 0, nxpk= 0, iat=1473,1480, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64, /
#
# 85 LYS H 85 LYS HB3 3.79
&rst
ixpk= 0, nxpk= 0, iat=1384,1389, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29, /
#
# 96 GLN H 96 GLN HB3 3.76
&rst
ixpk= 0, nxpk= 0, iat=1556,1561, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26, /
#
# 94 ILE QG2 95 ASN H 4.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1542, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
igr1=1529,1530,1531,
/
#
# 31 LEU H 31 LEU QD2 4.03
&rst
ixpk= 0, nxpk= 0, iat= 468, -1, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
igr2= 477, 478, 479, 481, 482, 483,
/
#
# 131 LEU HA 131 LEU HG 3.94
&rst
ixpk= 0, nxpk= 0, iat=2174,2179, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44, /
#
# 15 LEU H 15 LEU QD2 3.71
&rst
ixpk= 0, nxpk= 0, iat= 222, -1, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,
igr2= 231, 232, 233, 235, 236, 237,
/
#
# 14 THR H 14 THR QG2 3.13
&rst
ixpk= 0, nxpk= 0, iat= 208, -1, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,
igr2= 214, 215, 216,
/
#
# 7 GLN HA 7 GLN HNE1 4.88
&rst
ixpk= 0, nxpk= 0, iat= 90, 100, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38, /
#
# 7 GLN HA 28 TRP HZ2 5.34
&rst
ixpk= 0, nxpk= 0, iat= 90, 419, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84, /
#
# 77 ILE H 77 ILE HB 3.72
&rst
ixpk= 0, nxpk= 0, iat=1261,1265, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22, /
#
# 6 GLU H 6 GLU HB2 3.69
&rst
ixpk= 0, nxpk= 0, iat= 73, 77, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19, /
#
# 15 LEU H 15 LEU QD1 4.36
&rst
ixpk= 0, nxpk= 0, iat= 222, -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
igr2= 231, 232, 233, 235, 236, 237,
/
#
# 42 MET HG2 42 MET QE 3.39
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,
igr1= 655, 656,
igr2= 659, 660, 661,
/
#
# 123 VAL H 123 VAL QG1 3.83
&rst
ixpk= 0, nxpk= 0, iat=2045, -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
igr2=2051,2052,2053,2055,2056,2057,
/
#
# 124 VAL QG1 125 ASN H 3.92
&rst
ixpk= 0, nxpk= 0, iat= -1,2077, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
igr1=2067,2068,2069,2071,2072,2073,
/
#
# 129 ARG H 129 ARG HB2 3.61
&rst
ixpk= 0, nxpk= 0, iat=2137,2141, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11, /
#
# 129 ARG H 129 ARG HB3 3.67
&rst
ixpk= 0, nxpk= 0, iat=2137,2142, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17, /
#
# 129 ARG H 129 ARG QD 4.09
&rst
ixpk= 0, nxpk= 0, iat=2137, -1, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
igr2=2147,2148,
/
#
# 48 LEU H 48 LEU QD1 3.76
&rst
ixpk= 0, nxpk= 0, iat= 764, -1, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
igr2= 773, 774, 775, 777, 778, 779,
/
#
# 81 ASP HA 82 SER HA 4.99
&rst
ixpk= 0, nxpk= 0, iat=1336,1348, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49, /
#
# 80 GLN HA 80 GLN HG2 4.05
&rst
ixpk= 0, nxpk= 0, iat=1319,1324, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55, /
#
# 58 LEU QD2 98 PHE HZ 5.14
&rst
ixpk= 0, nxpk= 0, iat= -1,1600, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
igr1= 955, 956, 957, 959, 960, 961,
/
#
# 59 LEU HA 62 TYR HB3 5.50
&rst
ixpk= 0, nxpk= 0, iat= 967,1015, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 64 MET HA 64 MET QE 4.37
&rst
ixpk= 0, nxpk= 0, iat=1052, -1, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
igr2=1061,1062,1063,
/
#
# 38 LYS HA 38 LYS QE 4.03
&rst
ixpk= 0, nxpk= 0, iat= 587, -1, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
igr2= 598, 599,
/
#
# 2 ALA QB 3 PHE HA 4.66
&rst
ixpk= 0, nxpk= 0, iat= -1, 33, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
igr1= 25, 26, 27,
/
#
# 3 PHE HA 3 PHE HD 3.85
&rst
ixpk= 0, nxpk= 0, iat= 33, -1, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,
igr2= 39, 47,
/
#
# 3 PHE HA 4 SER H 3.22
&rst
ixpk= 0, nxpk= 0, iat= 33, 51, r1= 1.30, r2= 1.80, r3= 3.22, r4= 3.72, /
#
# 3 PHE HA 7 GLN HNE1 4.27
&rst
ixpk= 0, nxpk= 0, iat= 33, 100, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77, /
#
# 80 GLN HA 84 GLY H 4.15
&rst
ixpk= 0, nxpk= 0, iat=1319,1377, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65, /
#
# 6 GLU QG 7 GLN H 3.52
&rst
ixpk= 0, nxpk= 0, iat= -1, 88, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95,
igr1= 80, 81,
/
#
# 6 GLU HA 9 THR HB 3.57
&rst
ixpk= 0, nxpk= 0, iat= 75, 129, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07, /
#
# 6 GLU HA 6 GLU QG 2.84
&rst
ixpk= 0, nxpk= 0, iat= 75, -1, r1= 1.30, r2= 1.80, r3= 3.19, r4= 3.69,
igr2= 80, 81,
/
#
# 6 GLU HB2 6 GLU QG 2.71
&rst
ixpk= 0, nxpk= 0, iat= 77, -1, r1= 1.30, r2= 1.80, r3= 3.04, r4= 3.54,
igr2= 80, 81,
/
#
# 6 GLU HB3 6 GLU QG 2.71
&rst
ixpk= 0, nxpk= 0, iat= 78, -1, r1= 1.30, r2= 1.80, r3= 3.04, r4= 3.54,
igr2= 80, 81,
/
#
# 6 GLU QG 9 THR QG2 4.35
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
igr1= 80, 81,
igr2= 131, 132, 133,
/
#
# 89 GLU HB2 90 VAL QG2 4.06
&rst
ixpk= 0, nxpk= 0, iat=1446, -1, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,
igr2=1463,1464,1465,1467,1468,1469,
/
#
# 91 LEU HG 94 ILE QD1 4.53
&rst
ixpk= 0, nxpk= 0, iat=1480, -1, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
igr2=1536,1537,1538,
/
#
# 68 VAL QG2 80 GLN HA 4.24
&rst
ixpk= 0, nxpk= 0, iat= -1,1319, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
igr1=1120,1121,1122,1124,1125,1126,
/
#
# 42 MET HA 45 GLU HB2 3.91
&rst
ixpk= 0, nxpk= 0, iat= 650, 715, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41, /
#
# 7 GLN HA 7 GLN HG3 3.94
&rst
ixpk= 0, nxpk= 0, iat= 90, 96, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44, /
#
# 74 GLN HA 74 GLN HG3 4.00
&rst
ixpk= 0, nxpk= 0, iat=1205,1211, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, /
#
# 7 GLN HA 7 GLN HB3 3.00
&rst
ixpk= 0, nxpk= 0, iat= 90, 93, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, /
#
# 122 GLN HA 122 GLN HG3 4.06
&rst
ixpk= 0, nxpk= 0, iat=2030,2036, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56, /
#
# 114 LYS QE 115 GLU HA 4.08
&rst
ixpk= 0, nxpk= 0, iat= -1,1905, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
igr1=1894,1895,
/
#
# 122 GLN HA 125 ASN HB2 3.52
&rst
ixpk= 0, nxpk= 0, iat=2030,2081, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02, /
#
# 7 GLN HA 7 GLN HB2 3.00
&rst
ixpk= 0, nxpk= 0, iat= 90, 92, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, /
#
# 114 LYS HG3 115 GLU HA 3.83
&rst
ixpk= 0, nxpk= 0, iat=1889,1905, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33, /
#
# 8 PHE HB2 9 THR H 5.11
&rst
ixpk= 0, nxpk= 0, iat= 109, 125, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61, /
#
# 8 PHE HA 8 PHE HD 4.23
&rst
ixpk= 0, nxpk= 0, iat= 107, -1, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25,
igr2= 113, 121,
/
#
# 8 PHE HA 28 TRP HH2 4.58
&rst
ixpk= 0, nxpk= 0, iat= 107, 421, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08, /
#
# 8 PHE HA 28 TRP HZ3 4.59
&rst
ixpk= 0, nxpk= 0, iat= 107, 423, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, /
#
# 5 SER HA 8 PHE HB3 5.50
&rst
ixpk= 0, nxpk= 0, iat= 64, 110, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 8 PHE HA 12 LEU HG 5.50
&rst
ixpk= 0, nxpk= 0, iat= 107, 182, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 8 PHE HB3 12 LEU HG 5.50
&rst
ixpk= 0, nxpk= 0, iat= 110, 182, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 9 THR H 9 THR QG2 3.74
&rst
ixpk= 0, nxpk= 0, iat= 125, -1, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
igr2= 131, 132, 133,
/
#
# 109 VAL HA 113 LEU H 4.97
&rst
ixpk= 0, nxpk= 0, iat=1799,1862, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, /
#
# 9 THR HA 13 ASN H 4.75
&rst
ixpk= 0, nxpk= 0, iat= 127, 194, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, /
#
# 9 THR HA 12 LEU H 4.21
&rst
ixpk= 0, nxpk= 0, iat= 127, 175, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71, /
#
# 9 THR QG2 10 THR H 3.84
&rst
ixpk= 0, nxpk= 0, iat= -1, 139, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
igr1= 131, 132, 133,
/
#
# 9 THR HB 13 ASN HND1 5.50
&rst
ixpk= 0, nxpk= 0, iat= 129, 203, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 9 THR QG2 13 ASN HND1 3.10
&rst
ixpk= 0, nxpk= 0, iat= -1, 203, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,
igr1= 131, 132, 133,
/
#
# 9 THR QG2 13 ASN HND2 3.02
&rst
ixpk= 0, nxpk= 0, iat= -1, 204, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
igr1= 131, 132, 133,
/
#
# 9 THR QG2 12 LEU H 4.94
&rst
ixpk= 0, nxpk= 0, iat= -1, 175, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr1= 131, 132, 133,
/
#
# 9 THR QG2 46 TYR HE 4.42
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
igr1= 131, 132, 133,
igr2= 736, 741,
/
#
# 6 GLU HA 9 THR QG2 3.86
&rst
ixpk= 0, nxpk= 0, iat= 75, -1, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
igr2= 131, 132, 133,
/
#
# 6 GLU HA 9 THR HA 5.41
&rst
ixpk= 0, nxpk= 0, iat= 75, 127, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91, /
#
# 9 THR QG2 10 THR HA 4.26
&rst
ixpk= 0, nxpk= 0, iat= -1, 141, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
igr1= 131, 132, 133,
/
#
# 9 THR QG2 46 TYR HA 4.93
&rst
ixpk= 0, nxpk= 0, iat= -1, 728, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
igr1= 131, 132, 133,
/
#
# 9 THR QG2 42 MET QE 4.37
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
igr1= 131, 132, 133,
igr2= 659, 660, 661,
/
#
# 9 THR HA 42 MET QE 4.85
&rst
ixpk= 0, nxpk= 0, iat= 127, -1, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32,
igr2= 659, 660, 661,
/
#
# 109 VAL HA 112 ILE HB 4.17
&rst
ixpk= 0, nxpk= 0, iat=1799,1847, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67, /
#
# 9 THR HA 12 LEU HB2 3.85
&rst
ixpk= 0, nxpk= 0, iat= 127, 179, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35, /
#
# 9 THR HB 10 THR QG2 5.05
&rst
ixpk= 0, nxpk= 0, iat= 129, -1, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
igr2= 145, 146, 147,
/
#
# 9 THR HA 12 LEU HG 4.44
&rst
ixpk= 0, nxpk= 0, iat= 127, 182, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94, /
#
# 109 VAL HA 112 ILE QD1 3.63
&rst
ixpk= 0, nxpk= 0, iat=1799, -1, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,
igr2=1856,1857,1858,
/
#
# 6 GLU QG 10 THR HB 4.67
&rst
ixpk= 0, nxpk= 0, iat= -1, 143, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr1= 80, 81,
/
#
# 6 GLU QG 10 THR QG2 4.25
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23,
igr1= 80, 81,
igr2= 145, 146, 147,
/
#
# 10 THR HA 13 ASN QB 3.77
&rst
ixpk= 0, nxpk= 0, iat= 141, -1, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,
igr2= 198, 199,
/
#
# 10 THR QG2 13 ASN QB 4.68
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.31, r4= 6.81,
igr1= 145, 146, 147,
igr2= 198, 199,
/
#
# 7 GLN HA 10 THR HB 3.76
&rst
ixpk= 0, nxpk= 0, iat= 90, 143, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26, /
#
# 7 GLN HA 10 THR QG2 3.51
&rst
ixpk= 0, nxpk= 0, iat= 90, -1, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
igr2= 145, 146, 147,
/
#
# 10 THR QG2 11 LYS HA 3.75
&rst
ixpk= 0, nxpk= 0, iat= -1, 155, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
igr1= 145, 146, 147,
/
#
# 8 PHE HA 10 THR QG2 4.52
&rst
ixpk= 0, nxpk= 0, iat= 107, -1, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
igr2= 145, 146, 147,
/
#
# 11 LYS HB2 11 LYS HD3 4.23
&rst
ixpk= 0, nxpk= 0, iat= 157, 164, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73, /
#
# 11 LYS HA 11 LYS HD2 4.04
&rst
ixpk= 0, nxpk= 0, iat= 155, 163, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, /
#
# 8 PHE HA 11 LYS HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= 107, 155, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 8 PHE HA 11 LYS HB2 4.35
&rst
ixpk= 0, nxpk= 0, iat= 107, 157, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85, /
#
# 10 THR HA 11 LYS HA 5.10
&rst
ixpk= 0, nxpk= 0, iat= 141, 155, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, /
#
# 11 LYS HB2 11 LYS HD2 4.23
&rst
ixpk= 0, nxpk= 0, iat= 157, 163, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73, /
#
# 11 LYS HB2 12 LEU HG 4.46
&rst
ixpk= 0, nxpk= 0, iat= 157, 182, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, /
#
# 11 LYS HA 11 LYS HD3 4.04
&rst
ixpk= 0, nxpk= 0, iat= 155, 164, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, /
#
# 11 LYS HA 11 LYS HG3 4.01
&rst
ixpk= 0, nxpk= 0, iat= 155, 161, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51, /
#
# 11 LYS HA 11 LYS HG2 4.01
&rst
ixpk= 0, nxpk= 0, iat= 155, 160, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51, /
#
# 10 THR QG2 11 LYS HB2 4.99
&rst
ixpk= 0, nxpk= 0, iat= -1, 157, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1= 145, 146, 147,
/
#
# 12 LEU HA 12 LEU QD2 4.10
&rst
ixpk= 0, nxpk= 0, iat= 177, -1, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03,
igr2= 184, 185, 186, 188, 189, 190,
/
#
# 12 LEU HA 15 LEU QD2 3.92
&rst
ixpk= 0, nxpk= 0, iat= 177, -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
igr2= 231, 232, 233, 235, 236, 237,
/
#
# 12 LEU HA 15 LEU QD1 3.52
&rst
ixpk= 0, nxpk= 0, iat= 177, -1, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr2= 231, 232, 233, 235, 236, 237,
/
#
# 12 LEU HB3 12 LEU QD1 3.23
&rst
ixpk= 0, nxpk= 0, iat= 180, -1, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,
igr2= 184, 185, 186, 188, 189, 190,
/
#
# 12 LEU HB3 12 LEU QD2 3.23
&rst
ixpk= 0, nxpk= 0, iat= 180, -1, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,
igr2= 184, 185, 186, 188, 189, 190,
/
#
# 11 LYS HB2 12 LEU HA 4.51
&rst
ixpk= 0, nxpk= 0, iat= 157, 177, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01, /
#
# 11 LYS HB2 12 LEU QD1 4.63
&rst
ixpk= 0, nxpk= 0, iat= 157, -1, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
igr2= 184, 185, 186, 188, 189, 190,
/
#
# 11 LYS HB2 12 LEU QD2 4.63
&rst
ixpk= 0, nxpk= 0, iat= 157, -1, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
igr2= 184, 185, 186, 188, 189, 190,
/
#
# 11 LYS HB3 12 LEU HA 4.92
&rst
ixpk= 0, nxpk= 0, iat= 158, 177, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42, /
#
# 12 LEU HA 15 LEU HG 3.84
&rst
ixpk= 0, nxpk= 0, iat= 177, 229, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34, /
#
# 12 LEU HA 12 LEU QD1 4.10
&rst
ixpk= 0, nxpk= 0, iat= 177, -1, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03,
igr2= 184, 185, 186, 188, 189, 190,
/
#
# 9 THR HA 12 LEU QD2 4.48
&rst
ixpk= 0, nxpk= 0, iat= 127, -1, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54,
igr2= 184, 185, 186, 188, 189, 190,
/
#
# 9 THR HA 12 LEU QD1 4.48
&rst
ixpk= 0, nxpk= 0, iat= 127, -1, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54,
igr2= 184, 185, 186, 188, 189, 190,
/
#
# 12 LEU QD2 43 TRP HA 4.36
&rst
ixpk= 0, nxpk= 0, iat= -1, 667, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
igr1= 184, 185, 186, 188, 189, 190,
/
#
# 12 LEU QD1 46 TYR HE 5.10
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.72, r4= 8.22,
igr1= 184, 185, 186, 188, 189, 190,
igr2= 736, 741,
/
#
# 12 LEU QD1 46 TYR HD 4.69
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.10, r4= 7.60,
igr1= 184, 185, 186, 188, 189, 190,
igr2= 734, 743,
/
#
# 12 LEU QD1 43 TRP HD1 4.03
&rst
ixpk= 0, nxpk= 0, iat= -1, 673, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
igr1= 184, 185, 186, 188, 189, 190,
/
#
# 12 LEU QD2 43 TRP HD1 4.03
&rst
ixpk= 0, nxpk= 0, iat= -1, 673, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
igr1= 184, 185, 186, 188, 189, 190,
/
#
# 8 PHE HZ 12 LEU QD2 4.38
&rst
ixpk= 0, nxpk= 0, iat= 117, -1, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
igr2= 184, 185, 186, 188, 189, 190,
/
#
# 8 PHE HE 12 LEU QD1 3.93
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.95, r4= 6.45,
igr1= 115, 119,
igr2= 184, 185, 186, 188, 189, 190,
/
#
# 8 PHE HE 12 LEU QD2 3.93
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.95, r4= 6.45,
igr1= 115, 119,
igr2= 184, 185, 186, 188, 189, 190,
/
#
# 12 LEU QD2 13 ASN HND1 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 203, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr1= 184, 185, 186, 188, 189, 190,
/
#
# 12 LEU QD1 13 ASN HND1 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 203, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr1= 184, 185, 186, 188, 189, 190,
/
#
# 12 LEU H 12 LEU QD1 3.52
&rst
ixpk= 0, nxpk= 0, iat= 175, -1, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr2= 184, 185, 186, 188, 189, 190,
/
#
# 12 LEU H 12 LEU QD2 3.52
&rst
ixpk= 0, nxpk= 0, iat= 175, -1, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr2= 184, 185, 186, 188, 189, 190,
/
#
# 12 LEU QD1 13 ASN H 4.88
&rst
ixpk= 0, nxpk= 0, iat= -1, 194, r1= 1.30, r2= 1.80, r3= 6.58, r4= 7.08,
igr1= 184, 185, 186, 188, 189, 190,
/
#
# 12 LEU HG 13 ASN H 4.80
&rst
ixpk= 0, nxpk= 0, iat= 182, 194, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30, /
#
# 12 LEU H 13 ASN HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= 175, 196, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 13 ASN HA 13 ASN HND1 4.61
&rst
ixpk= 0, nxpk= 0, iat= 196, 203, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, /
#
# 125 ASN HB3 128 GLU HB2 5.10
&rst
ixpk= 0, nxpk= 0, iat=2082,2126, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, /
#
# 13 ASN HA 14 THR QG2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 196, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2= 214, 215, 216,
/
#
# 14 THR QG2 15 LEU QD2 4.12
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
igr1= 214, 215, 216,
igr2= 231, 232, 233, 235, 236, 237,
/
#
# 11 LYS HB3 14 THR QG2 4.39
&rst
ixpk= 0, nxpk= 0, iat= 158, -1, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77,
igr2= 214, 215, 216,
/
#
# 13 ASN QB 14 THR HA 4.76
&rst
ixpk= 0, nxpk= 0, iat= -1, 210, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr1= 198, 199,
/
#
# 13 ASN QB 14 THR QG2 4.08
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
igr1= 198, 199,
igr2= 214, 215, 216,
/
#
# 12 LEU HA 14 THR QG2 4.89
&rst
ixpk= 0, nxpk= 0, iat= 177, -1, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,
igr2= 214, 215, 216,
/
#
# 10 THR HA 14 THR QG2 4.68
&rst
ixpk= 0, nxpk= 0, iat= 141, -1, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
igr2= 214, 215, 216,
/
#
# 14 THR HA 14 THR QG2 3.24
&rst
ixpk= 0, nxpk= 0, iat= 210, -1, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,
igr2= 214, 215, 216,
/
#
# 14 THR QG2 15 LEU H 3.83
&rst
ixpk= 0, nxpk= 0, iat= -1, 222, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
igr1= 214, 215, 216,
/
#
# 11 LYS H 14 THR QG2 4.07
&rst
ixpk= 0, nxpk= 0, iat= 153, -1, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
igr2= 214, 215, 216,
/
#
# 13 ASN H 14 THR QG2 4.34
&rst
ixpk= 0, nxpk= 0, iat= 194, -1, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,
igr2= 214, 215, 216,
/
#
# 12 LEU H 14 THR QG2 4.48
&rst
ixpk= 0, nxpk= 0, iat= 175, -1, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
igr2= 214, 215, 216,
/
#
# 15 LEU HA 25 ALA QB 4.87
&rst
ixpk= 0, nxpk= 0, iat= 224, -1, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
igr2= 367, 368, 369,
/
#
# 15 LEU HA 16 GLU HB2 4.61
&rst
ixpk= 0, nxpk= 0, iat= 224, 245, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, /
#
# 15 LEU HA 15 LEU QD2 3.29
&rst
ixpk= 0, nxpk= 0, iat= 224, -1, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
igr2= 231, 232, 233, 235, 236, 237,
/
#
# 15 LEU QD1 16 GLU H 4.18
&rst
ixpk= 0, nxpk= 0, iat= -1, 241, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr1= 231, 232, 233, 235, 236, 237,
/
#
# 16 GLU HA 59 LEU QD1 3.90
&rst
ixpk= 0, nxpk= 0, iat= 243, -1, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr2= 974, 975, 976, 978, 979, 980,
/
#
# 15 LEU HA 16 GLU HA 4.67
&rst
ixpk= 0, nxpk= 0, iat= 224, 243, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, /
#
# 16 GLU HA 21 SER QB 4.55
&rst
ixpk= 0, nxpk= 0, iat= 243, -1, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,
igr2= 315, 316,
/
#
# 100 ARG HA 103 LYS QB 4.43
&rst
ixpk= 0, nxpk= 0, iat=1624, -1, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
igr2=1681,1682,
/
#
# 16 GLU H 16 GLU HB2 3.92
&rst
ixpk= 0, nxpk= 0, iat= 241, 245, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42, /
#
# 17 ASP HA 18 SER H 3.54
&rst
ixpk= 0, nxpk= 0, iat= 258, 268, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04, /
#
# 16 GLU HB2 17 ASP HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= 245, 258, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30, /
#
# 18 SER HB3 19 GLN H 4.99
&rst
ixpk= 0, nxpk= 0, iat= 273, 279, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49, /
#
# 18 SER HB2 19 GLN H 4.99
&rst
ixpk= 0, nxpk= 0, iat= 272, 279, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49, /
#
# 53 ASN HND1 54 THR HA 5.16
&rst
ixpk= 0, nxpk= 0, iat= 857, 864, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86, /
#
# 54 THR HA 98 PHE HE 4.54
&rst
ixpk= 0, nxpk= 0, iat= 864, -1, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
igr2=1598,1602,
/
#
# 53 ASN HA 54 THR HA 4.51
&rst
ixpk= 0, nxpk= 0, iat= 850, 864, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01, /
#
# 54 THR HA 57 LYS HB3 4.28
&rst
ixpk= 0, nxpk= 0, iat= 864, 929, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78, /
#
# 54 THR HA 55 ARG QB 5.50
&rst
ixpk= 0, nxpk= 0, iat= 864, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 880, 881,
/
#
# 54 THR HA 57 LYS HB2 3.98
&rst
ixpk= 0, nxpk= 0, iat= 864, 928, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48, /
#
# 54 THR HA 57 LYS HG3 4.73
&rst
ixpk= 0, nxpk= 0, iat= 864, 932, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, /
#
# 54 THR HA 94 ILE QG2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 864, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2=1529,1530,1531,
/
#
# 41 GLU HA 45 GLU H 4.49
&rst
ixpk= 0, nxpk= 0, iat= 635, 711, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99, /
#
# 106 LEU HA 108 ARG H 4.59
&rst
ixpk= 0, nxpk= 0, iat=1745,1773, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, /
#
# 129 ARG HA 133 ALA H 4.04
&rst
ixpk= 0, nxpk= 0, iat=2139,2201, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, /
#
# 70 GLN HA 70 GLN HG2 3.99
&rst
ixpk= 0, nxpk= 0, iat=1149,1154, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49, /
#
# 129 ARG HA 129 ARG HB3 3.01
&rst
ixpk= 0, nxpk= 0, iat=2139,2142, r1= 1.30, r2= 1.80, r3= 3.01, r4= 3.51, /
#
# 72 LYS HA 72 LYS QG 3.09
&rst
ixpk= 0, nxpk= 0, iat=1176, -1, r1= 1.30, r2= 1.80, r3= 3.47, r4= 3.97,
igr2=1181,1182,
/
#
# 129 ARG HA 132 ALA QB 3.53
&rst
ixpk= 0, nxpk= 0, iat=2139, -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
igr2=2195,2196,2197,
/
#
# 40 ALA QB 41 GLU HA 4.01
&rst
ixpk= 0, nxpk= 0, iat= -1, 635, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
igr1= 627, 628, 629,
/
#
# 122 GLN H 122 GLN HG3 3.83
&rst
ixpk= 0, nxpk= 0, iat=2028,2036, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33, /
#
# 122 GLN HA 122 GLN HG2 3.79
&rst
ixpk= 0, nxpk= 0, iat=2030,2035, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29, /
#
# 95 ASN QB 96 GLN HG3 4.62
&rst
ixpk= 0, nxpk= 0, iat= -1,1564, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
igr1=1546,1547,
/
#
# 85 LYS QE 122 GLN HG2 4.59
&rst
ixpk= 0, nxpk= 0, iat= -1,2035, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
igr1=1397,1398,
/
#
# 122 GLN HG3 123 VAL HA 4.56
&rst
ixpk= 0, nxpk= 0, iat=2036,2047, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06, /
#
# 122 GLN HG2 123 VAL HA 4.48
&rst
ixpk= 0, nxpk= 0, iat=2035,2047, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98, /
#
# 93 ARG QB 96 GLN HG3 4.35
&rst
ixpk= 0, nxpk= 0, iat= -1,1564, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
igr1=1503,1504,
/
#
# 122 GLN HB3 123 VAL H 4.11
&rst
ixpk= 0, nxpk= 0, iat=2033,2045, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, /
#
# 122 GLN H 122 GLN HB2 3.65
&rst
ixpk= 0, nxpk= 0, iat=2028,2032, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15, /
#
# 21 SER HA 22 ILE QD1 5.50
&rst
ixpk= 0, nxpk= 0, iat= 313, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2= 335, 336, 337,
/
#
# 21 SER HA 25 ALA QB 4.76
&rst
ixpk= 0, nxpk= 0, iat= 313, -1, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
igr2= 367, 368, 369,
/
#
# 16 GLU HB2 21 SER HA 5.24
&rst
ixpk= 0, nxpk= 0, iat= 245, 313, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74, /
#
# 16 GLU H 21 SER HA 5.39
&rst
ixpk= 0, nxpk= 0, iat= 241, 313, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89, /
#
# 22 ILE HA 22 ILE QG2 3.77
&rst
ixpk= 0, nxpk= 0, iat= 324, -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
igr2= 328, 329, 330,
/
#
# 22 ILE QG2 22 ILE QD1 3.38
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,
igr1= 328, 329, 330,
igr2= 335, 336, 337,
/
#
# 22 ILE HA 22 ILE QD1 3.38
&rst
ixpk= 0, nxpk= 0, iat= 324, -1, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,
igr2= 335, 336, 337,
/
#
# 15 LEU QD1 22 ILE HA 4.08
&rst
ixpk= 0, nxpk= 0, iat= -1, 324, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
igr1= 231, 232, 233, 235, 236, 237,
/
#
# 15 LEU QD1 22 ILE QG2 4.29
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.94, r4= 7.44,
igr1= 231, 232, 233, 235, 236, 237,
igr2= 328, 329, 330,
/
#
# 22 ILE QD1 25 ALA QB 3.99
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
igr1= 335, 336, 337,
igr2= 367, 368, 369,
/
#
# 22 ILE QG2 25 ALA QB 4.55
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.56, r4= 7.06,
igr1= 328, 329, 330,
igr2= 367, 368, 369,
/
#
# 22 ILE QG2 63 LEU HG 4.86
&rst
ixpk= 0, nxpk= 0, iat= -1,1038, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
igr1= 328, 329, 330,
/
#
# 22 ILE HB 22 ILE QD1 3.97
&rst
ixpk= 0, nxpk= 0, iat= 326, -1, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
igr2= 335, 336, 337,
/
#
# 22 ILE QG2 66 HIS HB2 4.35
&rst
ixpk= 0, nxpk= 0, iat= -1,1085, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
igr1= 328, 329, 330,
/
#
# 22 ILE QG2 66 HIS HB3 4.35
&rst
ixpk= 0, nxpk= 0, iat= -1,1086, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
igr1= 328, 329, 330,
/
#
# 21 SER QB 22 ILE HA 3.99
&rst
ixpk= 0, nxpk= 0, iat= -1, 324, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
igr1= 315, 316,
/
#
# 22 ILE HA 63 LEU HA 4.71
&rst
ixpk= 0, nxpk= 0, iat= 324,1033, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21, /
#
# 22 ILE QD1 59 LEU HA 3.92
&rst
ixpk= 0, nxpk= 0, iat= -1, 967, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
igr1= 335, 336, 337,
/
#
# 22 ILE QG2 63 LEU HA 3.78
&rst
ixpk= 0, nxpk= 0, iat= -1,1033, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
igr1= 328, 329, 330,
/
#
# 21 SER QB 22 ILE QG2 5.36
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.23, r4= 7.73,
igr1= 315, 316,
igr2= 328, 329, 330,
/
#
# 21 SER H 22 ILE HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= 311, 324, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 22 ILE QG2 27 LYS H 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 384, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 328, 329, 330,
/
#
# 15 LEU QD2 25 ALA HA 4.64
&rst
ixpk= 0, nxpk= 0, iat= -1, 365, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75,
igr1= 231, 232, 233, 235, 236, 237,
/
#
# 15 LEU QD2 25 ALA QB 2.94
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
igr1= 231, 232, 233, 235, 236, 237,
igr2= 367, 368, 369,
/
#
# 15 LEU QD1 25 ALA QB 3.33
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr1= 231, 232, 233, 235, 236, 237,
igr2= 367, 368, 369,
/
#
# 74 GLN HA 74 GLN HG2 3.77
&rst
ixpk= 0, nxpk= 0, iat=1205,1210, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27, /
#
# 25 ALA HA 28 TRP HB2 4.26
&rst
ixpk= 0, nxpk= 0, iat= 365, 410, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76, /
#
# 25 ALA HA 28 TRP HB3 4.26
&rst
ixpk= 0, nxpk= 0, iat= 365, 411, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76, /
#
# 22 ILE HA 25 ALA QB 3.63
&rst
ixpk= 0, nxpk= 0, iat= 324, -1, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,
igr2= 367, 368, 369,
/
#
# 21 SER QB 25 ALA QB 4.29
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr1= 315, 316,
igr2= 367, 368, 369,
/
#
# 25 ALA HA 28 TRP HE3 4.26
&rst
ixpk= 0, nxpk= 0, iat= 365, 425, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76, /
#
# 25 ALA HA 28 TRP H 4.31
&rst
ixpk= 0, nxpk= 0, iat= 365, 406, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81, /
#
# 27 LYS HA 30 LEU HB3 3.59
&rst
ixpk= 0, nxpk= 0, iat= 386, 454, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09, /
#
# 27 LYS HG3 27 LYS QE 3.35
&rst
ixpk= 0, nxpk= 0, iat= 392, -1, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,
igr2= 397, 398,
/
#
# 104 LYS HG2 104 LYS QE 3.34
&rst
ixpk= 0, nxpk= 0, iat=1706, -1, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,
igr2=1712,1713,
/
#
# 27 LYS HB3 27 LYS QE 4.78
&rst
ixpk= 0, nxpk= 0, iat= 389, -1, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr2= 397, 398,
/
#
# 27 LYS HB2 27 LYS QE 4.78
&rst
ixpk= 0, nxpk= 0, iat= 388, -1, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr2= 397, 398,
/
#
# 105 LYS QB 105 LYS QE 4.85
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
igr1=1725,1726,
igr2=1734,1735,
/
#
# 27 LYS HA 31 LEU H 4.74
&rst
ixpk= 0, nxpk= 0, iat= 386, 468, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24, /
#
# 27 LYS HB3 28 TRP H 4.11
&rst
ixpk= 0, nxpk= 0, iat= 389, 406, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, /
#
# 27 LYS QD 28 TRP H 4.10
&rst
ixpk= 0, nxpk= 0, iat= -1, 406, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
igr1= 394, 395,
/
#
# 27 LYS HA 30 LEU H 4.08
&rst
ixpk= 0, nxpk= 0, iat= 386, 449, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58, /
#
# 28 TRP HA 28 TRP HE3 4.88
&rst
ixpk= 0, nxpk= 0, iat= 408, 425, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38, /
#
# 28 TRP HA 31 LEU HG 4.84
&rst
ixpk= 0, nxpk= 0, iat= 408, 475, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34, /
#
# 27 LYS QD 28 TRP HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 408, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 394, 395,
/
#
# 94 ILE QD1 106 LEU QD2 4.01
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
igr1=1536,1537,1538,
igr2=1752,1753,1754,1756,1757,1758,
/
#
# 29 LEU HB2 29 LEU QD1 3.73
&rst
ixpk= 0, nxpk= 0, iat= 434, -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
igr2= 439, 440, 441, 443, 444, 445,
/
#
# 29 LEU HA 32 GLN HG2 4.50
&rst
ixpk= 0, nxpk= 0, iat= 432, 494, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, /
#
# 29 LEU HA 32 GLN HB2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 432, 491, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 106 LEU HB2 106 LEU QD2 3.86
&rst
ixpk= 0, nxpk= 0, iat=1747, -1, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
igr2=1752,1753,1754,1756,1757,1758,
/
#
# 29 LEU HA 32 GLN HG3 4.02
&rst
ixpk= 0, nxpk= 0, iat= 432, 495, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52, /
#
# 29 LEU HB2 29 LEU QD2 3.73
&rst
ixpk= 0, nxpk= 0, iat= 434, -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
igr2= 439, 440, 441, 443, 444, 445,
/
#
# 106 LEU HB3 106 LEU QD2 3.59
&rst
ixpk= 0, nxpk= 0, iat=1748, -1, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
igr2=1752,1753,1754,1756,1757,1758,
/
#
# 95 ASN QB 106 LEU QD2 4.06
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.14, r4= 6.64,
igr1=1546,1547,
igr2=1752,1753,1754,1756,1757,1758,
/
#
# 29 LEU HA 29 LEU HG 3.93
&rst
ixpk= 0, nxpk= 0, iat= 432, 437, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43, /
#
# 29 LEU HA 29 LEU QD1 3.45
&rst
ixpk= 0, nxpk= 0, iat= 432, -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
igr2= 439, 440, 441, 443, 444, 445,
/
#
# 29 LEU HA 30 LEU HA 5.05
&rst
ixpk= 0, nxpk= 0, iat= 432, 451, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55, /
#
# 28 TRP HZ3 29 LEU HG 4.69
&rst
ixpk= 0, nxpk= 0, iat= 423, 437, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, /
#
# 94 ILE HG13 98 PHE HE 3.99
&rst
ixpk= 0, nxpk= 0, iat=1534, -1, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
igr2=1598,1602,
/
#
# 28 TRP H 29 LEU HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= 406, 432, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 28 TRP HD1 29 LEU HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= 414, 432, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 28 TRP HE3 29 LEU HA 4.70
&rst
ixpk= 0, nxpk= 0, iat= 425, 432, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, /
#
# 8 PHE HD 29 LEU HG 4.08
&rst
ixpk= 0, nxpk= 0, iat= -1, 437, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
igr1= 113, 121,
/
#
# 8 PHE HD 29 LEU QD2 4.30
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.51, r4= 7.01,
igr1= 113, 121,
igr2= 439, 440, 441, 443, 444, 445,
/
#
# 8 PHE HD 29 LEU QD1 4.30
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.51, r4= 7.01,
igr1= 113, 121,
igr2= 439, 440, 441, 443, 444, 445,
/
#
# 29 LEU H 29 LEU HG 4.72
&rst
ixpk= 0, nxpk= 0, iat= 430, 437, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22, /
#
# 29 LEU HG 30 LEU H 5.27
&rst
ixpk= 0, nxpk= 0, iat= 437, 449, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77, /
#
# 30 LEU HA 79 PHE HD 4.46
&rst
ixpk= 0, nxpk= 0, iat= 451, -1, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
igr2=1305,1313,
/
#
# 113 LEU H 113 LEU QD2 4.48
&rst
ixpk= 0, nxpk= 0, iat=1862, -1, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54,
igr2=1871,1872,1873,1875,1876,1877,
/
#
# 30 LEU H 30 LEU HG 4.83
&rst
ixpk= 0, nxpk= 0, iat= 449, 456, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33, /
#
# 30 LEU H 30 LEU QD1 4.29
&rst
ixpk= 0, nxpk= 0, iat= 449, -1, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr2= 458, 459, 460, 462, 463, 464,
/
#
# 27 LYS HA 30 LEU HB2 4.37
&rst
ixpk= 0, nxpk= 0, iat= 386, 453, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87, /
#
# 30 LEU HA 30 LEU HG 3.57
&rst
ixpk= 0, nxpk= 0, iat= 451, 456, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07, /
#
# 30 LEU HA 30 LEU QD2 3.91
&rst
ixpk= 0, nxpk= 0, iat= 451, -1, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77,
igr2= 458, 459, 460, 462, 463, 464,
/
#
# 30 LEU QD1 71 ALA HA 4.09
&rst
ixpk= 0, nxpk= 0, iat= -1,1166, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
igr1= 458, 459, 460, 462, 463, 464,
/
#
# 30 LEU HA 67 VAL HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= 451,1100, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 30 LEU HA 33 TYR HB2 5.34
&rst
ixpk= 0, nxpk= 0, iat= 451, 508, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84, /
#
# 29 LEU HB3 30 LEU HB2 4.61
&rst
ixpk= 0, nxpk= 0, iat= 435, 453, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, /
#
# 29 LEU HB3 30 LEU HA 4.55
&rst
ixpk= 0, nxpk= 0, iat= 435, 451, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05, /
#
# 30 LEU HA 30 LEU QD1 3.91
&rst
ixpk= 0, nxpk= 0, iat= 451, -1, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77,
igr2= 458, 459, 460, 462, 463, 464,
/
#
# 30 LEU HB2 30 LEU QD2 4.15
&rst
ixpk= 0, nxpk= 0, iat= 453, -1, r1= 1.30, r2= 1.80, r3= 5.59, r4= 6.09,
igr2= 458, 459, 460, 462, 463, 464,
/
#
# 30 LEU HB2 30 LEU QD1 4.15
&rst
ixpk= 0, nxpk= 0, iat= 453, -1, r1= 1.30, r2= 1.80, r3= 5.59, r4= 6.09,
igr2= 458, 459, 460, 462, 463, 464,
/
#
# 31 LEU HA 31 LEU HG 3.66
&rst
ixpk= 0, nxpk= 0, iat= 470, 475, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16, /
#
# 30 LEU HA 31 LEU HA 5.06
&rst
ixpk= 0, nxpk= 0, iat= 451, 470, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56, /
#
# 56 ARG HA 59 LEU HG 5.21
&rst
ixpk= 0, nxpk= 0, iat= 902, 972, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71, /
#
# 31 LEU HG 32 GLN H 5.50
&rst
ixpk= 0, nxpk= 0, iat= 475, 487, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 58 LEU H 59 LEU HG 5.50
&rst
ixpk= 0, nxpk= 0, iat= 946, 972, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 32 GLN HA 32 GLN HNE2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 489, 500, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 32 GLN HA 33 TYR HA 4.84
&rst
ixpk= 0, nxpk= 0, iat= 489, 506, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34, /
#
# 32 GLN HA 32 GLN HG3 4.21
&rst
ixpk= 0, nxpk= 0, iat= 489, 495, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71, /
#
# 29 LEU HB2 32 GLN HG2 5.21
&rst
ixpk= 0, nxpk= 0, iat= 434, 494, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71, /
#
# 113 LEU HG 118 ILE HG13 5.50
&rst
ixpk= 0, nxpk= 0, iat=1869,1967, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 33 TYR HA 36 ALA QB 4.51
&rst
ixpk= 0, nxpk= 0, iat= 506, -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr2= 565, 566, 567,
/
#
# 33 TYR HA 36 ALA H 4.64
&rst
ixpk= 0, nxpk= 0, iat= 506, 561, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14, /
#
# 33 TYR HA 79 PHE HD 4.70
&rst
ixpk= 0, nxpk= 0, iat= 506, -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
igr2=1305,1313,
/
#
# 34 ARG HA 36 ALA QB 4.83
&rst
ixpk= 0, nxpk= 0, iat= 527, -1, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
igr2= 565, 566, 567,
/
#
# 33 TYR HB2 34 ARG HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= 508, 527, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 34 ARG HA 34 ARG HD3 4.94
&rst
ixpk= 0, nxpk= 0, iat= 527, 536, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44, /
#
# 34 ARG HA 34 ARG HD2 4.94
&rst
ixpk= 0, nxpk= 0, iat= 527, 535, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44, /
#
# 33 TYR HE 34 ARG HA 4.89
&rst
ixpk= 0, nxpk= 0, iat= -1, 527, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
igr1= 514, 519,
/
#
# 34 ARG HA 36 ALA H 4.57
&rst
ixpk= 0, nxpk= 0, iat= 527, 561, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07, /
#
# 33 TYR HD 34 ARG HA 5.13
&rst
ixpk= 0, nxpk= 0, iat= -1, 527, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
igr1= 512, 521,
/
#
# 35 ASP HA 38 LYS H 4.21
&rst
ixpk= 0, nxpk= 0, iat= 551, 585, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71, /
#
# 35 ASP HA 37 PRO QD 3.67
&rst
ixpk= 0, nxpk= 0, iat= 551, -1, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
igr2= 572, 573,
/
#
# 35 ASP HA 38 LYS QB 3.87
&rst
ixpk= 0, nxpk= 0, iat= 551, -1, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,
igr2= 589, 590,
/
#
# 35 ASP HB2 38 LYS QB 4.90
&rst
ixpk= 0, nxpk= 0, iat= 553, -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
igr2= 589, 590,
/
#
# 35 ASP HB3 38 LYS QB 4.90
&rst
ixpk= 0, nxpk= 0, iat= 554, -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
igr2= 589, 590,
/
#
# 35 ASP HA 36 ALA QB 4.68
&rst
ixpk= 0, nxpk= 0, iat= 551, -1, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
igr2= 565, 566, 567,
/
#
# 36 ALA HA 39 VAL QG1 3.63
&rst
ixpk= 0, nxpk= 0, iat= 563, -1, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
igr2= 613, 614, 615, 617, 618, 619,
/
#
# 36 ALA QB 76 ILE QG2 4.09
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
igr1= 565, 566, 567,
igr2=1248,1249,1250,
/
#
# 36 ALA QB 78 GLN HB2 3.48
&rst
ixpk= 0, nxpk= 0, iat= -1,1284, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
igr1= 565, 566, 567,
/
#
# 36 ALA QB 78 GLN HB3 3.46
&rst
ixpk= 0, nxpk= 0, iat= -1,1285, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
igr1= 565, 566, 567,
/
#
# 36 ALA HA 39 VAL HB 3.69
&rst
ixpk= 0, nxpk= 0, iat= 563, 611, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19, /
#
# 36 ALA QB 37 PRO HB3 4.35
&rst
ixpk= 0, nxpk= 0, iat= -1, 579, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
igr1= 565, 566, 567,
/
#
# 36 ALA QB 78 GLN HG2 4.51
&rst
ixpk= 0, nxpk= 0, iat= -1,1287, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr1= 565, 566, 567,
/
#
# 33 TYR HB2 36 ALA QB 3.87
&rst
ixpk= 0, nxpk= 0, iat= 508, -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
igr2= 565, 566, 567,
/
#
# 36 ALA QB 78 GLN HG3 4.51
&rst
ixpk= 0, nxpk= 0, iat= -1,1288, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr1= 565, 566, 567,
/
#
# 36 ALA QB 79 PHE HB3 4.64
&rst
ixpk= 0, nxpk= 0, iat= -1,1302, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
igr1= 565, 566, 567,
/
#
# 33 TYR HB3 36 ALA QB 4.94
&rst
ixpk= 0, nxpk= 0, iat= 509, -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr2= 565, 566, 567,
/
#
# 36 ALA QB 78 GLN HA 3.95
&rst
ixpk= 0, nxpk= 0, iat= -1,1282, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr1= 565, 566, 567,
/
#
# 36 ALA QB 79 PHE HA 3.53
&rst
ixpk= 0, nxpk= 0, iat= -1,1299, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
igr1= 565, 566, 567,
/
#
# 35 ASP HA 36 ALA HA 5.28
&rst
ixpk= 0, nxpk= 0, iat= 551, 563, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, /
#
# 36 ALA H 36 ALA QB 3.04
&rst
ixpk= 0, nxpk= 0, iat= 561, -1, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15,
igr2= 565, 566, 567,
/
#
# 36 ALA HA 39 VAL H 4.60
&rst
ixpk= 0, nxpk= 0, iat= 563, 607, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, /
#
# 36 ALA HA 40 ALA H 4.39
&rst
ixpk= 0, nxpk= 0, iat= 563, 623, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89, /
#
# 36 ALA QB 40 ALA H 5.14
&rst
ixpk= 0, nxpk= 0, iat= -1, 623, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 565, 566, 567,
/
#
# 36 ALA H 37 PRO QD 4.78
&rst
ixpk= 0, nxpk= 0, iat= 561, -1, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr2= 572, 573,
/
#
# 36 ALA QB 37 PRO QD 4.48
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54,
igr1= 565, 566, 567,
igr2= 572, 573,
/
#
# 38 LYS HA 40 ALA QB 5.04
&rst
ixpk= 0, nxpk= 0, iat= 587, -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
igr2= 627, 628, 629,
/
#
# 44 LYS HE3 86 VAL QG1 3.86
&rst
ixpk= 0, nxpk= 0, iat= 703, -1, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
igr2=1412,1413,1414,1416,1417,1418,
/
#
# 38 LYS HA 38 LYS HG3 3.92
&rst
ixpk= 0, nxpk= 0, iat= 587, 593, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42, /
#
# 38 LYS HG3 38 LYS QD 2.86
&rst
ixpk= 0, nxpk= 0, iat= 593, -1, r1= 1.30, r2= 1.80, r3= 3.21, r4= 3.71,
igr2= 595, 596,
/
#
# 38 LYS HG2 38 LYS QE 3.66
&rst
ixpk= 0, nxpk= 0, iat= 592, -1, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
igr2= 598, 599,
/
#
# 38 LYS HG2 38 LYS QD 2.86
&rst
ixpk= 0, nxpk= 0, iat= 592, -1, r1= 1.30, r2= 1.80, r3= 3.21, r4= 3.71,
igr2= 595, 596,
/
#
# 38 LYS HA 41 GLU QB 3.32
&rst
ixpk= 0, nxpk= 0, iat= 587, -1, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23,
igr2= 637, 638,
/
#
# 38 LYS QD 41 GLU QB 3.73
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
igr1= 595, 596,
igr2= 637, 638,
/
#
# 38 LYS HG3 42 MET QE 3.80
&rst
ixpk= 0, nxpk= 0, iat= 593, -1, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
igr2= 659, 660, 661,
/
#
# 38 LYS QD 38 LYS QE 2.75
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96,
igr1= 595, 596,
igr2= 598, 599,
/
#
# 38 LYS HG3 38 LYS QE 3.66
&rst
ixpk= 0, nxpk= 0, iat= 593, -1, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
igr2= 598, 599,
/
#
# 38 LYS H 38 LYS HG2 4.60
&rst
ixpk= 0, nxpk= 0, iat= 585, 592, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, /
#
# 38 LYS HA 41 GLU H 4.41
&rst
ixpk= 0, nxpk= 0, iat= 587, 633, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, /
#
# 39 VAL QG1 40 ALA H 4.33
&rst
ixpk= 0, nxpk= 0, iat= -1, 623, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
igr1= 613, 614, 615, 617, 618, 619,
/
#
# 124 VAL HB 125 ASN HA 5.08
&rst
ixpk= 0, nxpk= 0, iat=2065,2079, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58, /
#
# 36 ALA HA 39 VAL QG2 3.63
&rst
ixpk= 0, nxpk= 0, iat= 563, -1, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
igr2= 613, 614, 615, 617, 618, 619,
/
#
# 8 PHE HB2 39 VAL HB 4.29
&rst
ixpk= 0, nxpk= 0, iat= 109, 611, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, /
#
# 39 VAL HA 39 VAL QG1 3.36
&rst
ixpk= 0, nxpk= 0, iat= 609, -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
igr2= 613, 614, 615, 617, 618, 619,
/
#
# 29 LEU HG 39 VAL QG1 4.12
&rst
ixpk= 0, nxpk= 0, iat= 437, -1, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,
igr2= 613, 614, 615, 617, 618, 619,
/
#
# 29 LEU HG 39 VAL QG2 4.12
&rst
ixpk= 0, nxpk= 0, iat= 437, -1, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,
igr2= 613, 614, 615, 617, 618, 619,
/
#
# 39 VAL HB 40 ALA QB 5.50
&rst
ixpk= 0, nxpk= 0, iat= 611, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2= 627, 628, 629,
/
#
# 39 VAL HB 40 ALA HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= 611, 625, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 40 ALA HA 41 GLU QB 5.50
&rst
ixpk= 0, nxpk= 0, iat= 625, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 637, 638,
/
#
# 40 ALA QB 41 GLU QB 3.96
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr1= 627, 628, 629,
igr2= 637, 638,
/
#
# 40 ALA HA 43 TRP HB2 4.01
&rst
ixpk= 0, nxpk= 0, iat= 625, 669, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51, /
#
# 40 ALA HA 43 TRP HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= 625, 667, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 37 PRO HA 40 ALA QB 3.57
&rst
ixpk= 0, nxpk= 0, iat= 581, -1, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,
igr2= 627, 628, 629,
/
#
# 40 ALA QB 82 SER HA 3.91
&rst
ixpk= 0, nxpk= 0, iat= -1,1348, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
igr1= 627, 628, 629,
/
#
# 40 ALA QB 83 PHE HA 3.63
&rst
ixpk= 0, nxpk= 0, iat= -1,1359, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,
igr1= 627, 628, 629,
/
#
# 40 ALA QB 83 PHE HE 4.19
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.65, r4= 6.15,
igr1= 627, 628, 629,
igr2=1367,1371,
/
#
# 40 ALA HA 43 TRP HE3 4.76
&rst
ixpk= 0, nxpk= 0, iat= 625, 684, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26, /
#
# 40 ALA HA 44 LYS H 4.63
&rst
ixpk= 0, nxpk= 0, iat= 625, 689, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, /
#
# 40 ALA HA 43 TRP H 4.23
&rst
ixpk= 0, nxpk= 0, iat= 625, 665, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73, /
#
# 72 LYS HA 76 ILE H 3.97
&rst
ixpk= 0, nxpk= 0, iat=1176,1242, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47, /
#
# 40 ALA H 41 GLU QB 4.64
&rst
ixpk= 0, nxpk= 0, iat= 623, -1, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,
igr2= 637, 638,
/
#
# 72 LYS HA 80 GLN HNE2 4.07
&rst
ixpk= 0, nxpk= 0, iat=1176,1330, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57, /
#
# 112 ILE HA 115 GLU HB3 3.95
&rst
ixpk= 0, nxpk= 0, iat=1845,1908, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45, /
#
# 72 LYS HA 72 LYS QE 4.13
&rst
ixpk= 0, nxpk= 0, iat=1176, -1, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
igr2=1187,1188,
/
#
# 41 GLU HA 41 GLU QB 3.00
&rst
ixpk= 0, nxpk= 0, iat= 635, -1, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87,
igr2= 637, 638,
/
#
# 9 THR QG2 42 MET HA 5.28
&rst
ixpk= 0, nxpk= 0, iat= -1, 650, r1= 1.30, r2= 1.80, r3= 6.34, r4= 6.84,
igr1= 131, 132, 133,
/
#
# 38 LYS HG2 42 MET QE 3.80
&rst
ixpk= 0, nxpk= 0, iat= 592, -1, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
igr2= 659, 660, 661,
/
#
# 38 LYS QD 42 MET HG2 5.09
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.41, r4= 6.91,
igr1= 595, 596,
igr2= 655, 656,
/
#
# 38 LYS QD 42 MET HG3 5.09
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.41, r4= 6.91,
igr1= 595, 596,
igr2= 655, 656,
/
#
# 38 LYS QD 42 MET QE 3.43
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
igr1= 595, 596,
igr2= 659, 660, 661,
/
#
# 38 LYS QB 42 MET QE 4.26
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
igr1= 589, 590,
igr2= 659, 660, 661,
/
#
# 41 GLU HG2 42 MET HA 5.21
&rst
ixpk= 0, nxpk= 0, iat= 640, 650, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71, /
#
# 41 GLU HG3 42 MET HA 5.21
&rst
ixpk= 0, nxpk= 0, iat= 641, 650, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71, /
#
# 42 MET HA 42 MET HG3 4.03
&rst
ixpk= 0, nxpk= 0, iat= 650, -1, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
igr2= 655, 656,
/
#
# 42 MET HG3 42 MET QE 3.39
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,
igr1= 655, 656,
igr2= 659, 660, 661,
/
#
# 42 MET HA 42 MET HG2 4.03
&rst
ixpk= 0, nxpk= 0, iat= 650, -1, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
igr2= 655, 656,
/
#
# 39 VAL HA 42 MET QE 3.77
&rst
ixpk= 0, nxpk= 0, iat= 609, -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
igr2= 659, 660, 661,
/
#
# 8 PHE HB3 42 MET QE 3.51
&rst
ixpk= 0, nxpk= 0, iat= 110, -1, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
igr2= 659, 660, 661,
/
#
# 39 VAL HA 42 MET HG2 5.29
&rst
ixpk= 0, nxpk= 0, iat= 609, -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
igr2= 655, 656,
/
#
# 39 VAL HA 42 MET HG3 5.29
&rst
ixpk= 0, nxpk= 0, iat= 609, -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
igr2= 655, 656,
/
#
# 41 GLU HA 42 MET HA 4.81
&rst
ixpk= 0, nxpk= 0, iat= 635, 650, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31, /
#
# 6 GLU HA 42 MET QE 3.86
&rst
ixpk= 0, nxpk= 0, iat= 75, -1, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
igr2= 659, 660, 661,
/
#
# 8 PHE HA 42 MET QE 4.84
&rst
ixpk= 0, nxpk= 0, iat= 107, -1, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
igr2= 659, 660, 661,
/
#
# 8 PHE HD 42 MET QE 3.67
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr1= 113, 121,
igr2= 659, 660, 661,
/
#
# 39 VAL H 42 MET QE 4.42
&rst
ixpk= 0, nxpk= 0, iat= 607, -1, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
igr2= 659, 660, 661,
/
#
# 42 MET HA 46 TYR H 4.12
&rst
ixpk= 0, nxpk= 0, iat= 650, 726, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62, /
#
# 8 PHE H 42 MET QE 4.04
&rst
ixpk= 0, nxpk= 0, iat= 105, -1, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
igr2= 659, 660, 661,
/
#
# 9 THR H 42 MET QE 3.72
&rst
ixpk= 0, nxpk= 0, iat= 125, -1, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
igr2= 659, 660, 661,
/
#
# 43 TRP HA 43 TRP HD1 4.01
&rst
ixpk= 0, nxpk= 0, iat= 667, 673, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51, /
#
# 43 TRP HB3 83 PHE HD 5.36
&rst
ixpk= 0, nxpk= 0, iat= 670, -1, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,
igr2=1365,1373,
/
#
# 43 TRP HA 46 TYR QB 4.08
&rst
ixpk= 0, nxpk= 0, iat= 667, -1, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
igr2= 730, 731,
/
#
# 82 SER HA 85 LYS HG2 4.00
&rst
ixpk= 0, nxpk= 0, iat=1348,1391, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, /
#
# 77 ILE HA 77 ILE HG12 4.12
&rst
ixpk= 0, nxpk= 0, iat=1263,1271, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62, /
#
# 77 ILE HA 77 ILE HG13 4.04
&rst
ixpk= 0, nxpk= 0, iat=1263,1272, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, /
#
# 76 ILE QG2 77 ILE HA 4.58
&rst
ixpk= 0, nxpk= 0, iat= -1,1263, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
igr1=1248,1249,1250,
/
#
# 12 LEU QD1 43 TRP HA 4.36
&rst
ixpk= 0, nxpk= 0, iat= -1, 667, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
igr1= 184, 185, 186, 188, 189, 190,
/
#
# 44 LYS HA 47 MET HB2 4.16
&rst
ixpk= 0, nxpk= 0, iat= 691, -1, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
igr2= 751, 752,
/
#
# 44 LYS HA 90 VAL QG1 4.80
&rst
ixpk= 0, nxpk= 0, iat= 691, -1, r1= 1.30, r2= 1.80, r3= 6.47, r4= 6.97,
igr2=1463,1464,1465,1467,1468,1469,
/
#
# 44 LYS HA 48 LEU QD2 4.64
&rst
ixpk= 0, nxpk= 0, iat= 691, -1, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75,
igr2= 773, 774, 775, 777, 778, 779,
/
#
# 44 LYS HA 47 MET HG2 4.65
&rst
ixpk= 0, nxpk= 0, iat= 691, -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
igr2= 754, 755,
/
#
# 44 LYS HE2 86 VAL QG1 3.86
&rst
ixpk= 0, nxpk= 0, iat= 702, -1, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
igr2=1412,1413,1414,1416,1417,1418,
/
#
# 44 LYS HA 47 MET HG3 4.59
&rst
ixpk= 0, nxpk= 0, iat= 691, -1, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
igr2= 754, 755,
/
#
# 44 LYS HA 48 LEU HB2 5.41
&rst
ixpk= 0, nxpk= 0, iat= 691, 768, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91, /
#
# 44 LYS HA 47 MET HB3 4.72
&rst
ixpk= 0, nxpk= 0, iat= 691, -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr2= 751, 752,
/
#
# 44 LYS HA 86 VAL HB 5.20
&rst
ixpk= 0, nxpk= 0, iat= 691,1410, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70, /
#
# 44 LYS HA 44 LYS HE2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 691, 702, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30, /
#
# 44 LYS HA 44 LYS HE3 5.50
&rst
ixpk= 0, nxpk= 0, iat= 691, 703, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 44 LYS HA 46 TYR QB 5.25
&rst
ixpk= 0, nxpk= 0, iat= 691, -1, r1= 1.30, r2= 1.80, r3= 5.89, r4= 6.39,
igr2= 730, 731,
/
#
# 44 LYS HA 45 GLU HA 4.95
&rst
ixpk= 0, nxpk= 0, iat= 691, 713, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45, /
#
# 43 TRP HA 44 LYS HA 5.17
&rst
ixpk= 0, nxpk= 0, iat= 667, 691, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67, /
#
# 43 TRP HH2 44 LYS HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= 680, 691, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 44 LYS HA 90 VAL H 5.00
&rst
ixpk= 0, nxpk= 0, iat= 691,1457, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, /
#
# 43 TRP HE3 44 LYS HA 4.67
&rst
ixpk= 0, nxpk= 0, iat= 684, 691, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, /
#
# 44 LYS H 44 LYS HE2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 689, 702, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 44 LYS H 44 LYS HE3 5.50
&rst
ixpk= 0, nxpk= 0, iat= 689, 703, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 45 GLU HA 90 VAL QG2 5.35
&rst
ixpk= 0, nxpk= 0, iat= 713, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr2=1463,1464,1465,1467,1468,1469,
/
#
# 45 GLU HA 48 LEU HB2 4.01
&rst
ixpk= 0, nxpk= 0, iat= 713, 768, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51, /
#
# 45 GLU HA 45 GLU HG2 3.39
&rst
ixpk= 0, nxpk= 0, iat= 713, 718, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89, /
#
# 42 MET HA 45 GLU HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= 650, 713, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 45 GLU HA 48 LEU HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= 713, 766, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 45 GLU H 45 GLU HB3 3.77
&rst
ixpk= 0, nxpk= 0, iat= 711, 716, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27, /
#
# 45 GLU H 45 GLU HG2 4.12
&rst
ixpk= 0, nxpk= 0, iat= 711, 718, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62, /
#
# 45 GLU HG2 46 TYR H 4.95
&rst
ixpk= 0, nxpk= 0, iat= 718, 726, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45, /
#
# 44 LYS H 45 GLU HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= 689, 713, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 45 GLU HB3 46 TYR HA 4.62
&rst
ixpk= 0, nxpk= 0, iat= 716, 728, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12, /
#
# 45 GLU HB2 46 TYR HA 4.68
&rst
ixpk= 0, nxpk= 0, iat= 715, 728, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18, /
#
# 46 TYR HA 49 ARG HB3 4.20
&rst
ixpk= 0, nxpk= 0, iat= 728, 788, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, /
#
# 46 TYR HA 49 ARG HB2 4.42
&rst
ixpk= 0, nxpk= 0, iat= 728, 787, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92, /
#
# 46 TYR HA 49 ARG HG3 5.08
&rst
ixpk= 0, nxpk= 0, iat= 728, 791, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58, /
#
# 46 TYR HA 52 VAL QG1 5.50
&rst
ixpk= 0, nxpk= 0, iat= 728, -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr2= 838, 839, 840, 842, 843, 844,
/
#
# 46 TYR HA 52 VAL QG2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 728, -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr2= 838, 839, 840, 842, 843, 844,
/
#
# 47 MET HA 52 VAL QG2 4.64
&rst
ixpk= 0, nxpk= 0, iat= 749, -1, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75,
igr2= 838, 839, 840, 842, 843, 844,
/
#
# 47 MET HA 52 VAL QG1 4.64
&rst
ixpk= 0, nxpk= 0, iat= 749, -1, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75,
igr2= 838, 839, 840, 842, 843, 844,
/
#
# 47 MET HA 47 MET HG2 4.07
&rst
ixpk= 0, nxpk= 0, iat= 749, -1, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,
igr2= 754, 755,
/
#
# 47 MET HA 47 MET HG3 4.23
&rst
ixpk= 0, nxpk= 0, iat= 749, -1, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25,
igr2= 754, 755,
/
#
# 47 MET HA 57 LYS HG2 4.34
&rst
ixpk= 0, nxpk= 0, iat= 749, 931, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84, /
#
# 44 LYS HA 47 MET HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= 691, 749, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 47 MET HA 48 LEU HA 4.92
&rst
ixpk= 0, nxpk= 0, iat= 749, 766, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42, /
#
# 46 TYR HD 47 MET HA 4.99
&rst
ixpk= 0, nxpk= 0, iat= -1, 749, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
igr1= 734, 743,
/
#
# 46 TYR HE 47 MET HA 5.18
&rst
ixpk= 0, nxpk= 0, iat= -1, 749, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
igr1= 736, 741,
/
#
# 31 LEU H 31 LEU HG 4.19
&rst
ixpk= 0, nxpk= 0, iat= 468, 475, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69, /
#
# 45 GLU H 48 LEU QD2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 711, -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr2= 773, 774, 775, 777, 778, 779,
/
#
# 48 LEU HA 48 LEU QD2 3.86
&rst
ixpk= 0, nxpk= 0, iat= 766, -1, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
igr2= 773, 774, 775, 777, 778, 779,
/
#
# 48 LEU HA 48 LEU QD1 3.86
&rst
ixpk= 0, nxpk= 0, iat= 766, -1, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
igr2= 773, 774, 775, 777, 778, 779,
/
#
# 44 LYS HA 48 LEU QD1 4.64
&rst
ixpk= 0, nxpk= 0, iat= 691, -1, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75,
igr2= 773, 774, 775, 777, 778, 779,
/
#
# 48 LEU HA 90 VAL HA 4.84
&rst
ixpk= 0, nxpk= 0, iat= 766,1459, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34, /
#
# 48 LEU QD1 86 VAL HB 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1410, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr1= 773, 774, 775, 777, 778, 779,
/
#
# 48 LEU HA 48 LEU HG 4.10
&rst
ixpk= 0, nxpk= 0, iat= 766, 771, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60, /
#
# 48 LEU HA 93 ARG QB 4.66
&rst
ixpk= 0, nxpk= 0, iat= 766, -1, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73,
igr2=1503,1504,
/
#
# 48 LEU HB2 48 LEU QD1 3.66
&rst
ixpk= 0, nxpk= 0, iat= 768, -1, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,
igr2= 773, 774, 775, 777, 778, 779,
/
#
# 48 LEU HB2 48 LEU QD2 3.66
&rst
ixpk= 0, nxpk= 0, iat= 768, -1, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,
igr2= 773, 774, 775, 777, 778, 779,
/
#
# 131 LEU HB3 131 LEU QD1 3.26
&rst
ixpk= 0, nxpk= 0, iat=2177, -1, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,
igr2=2181,2182,2183,2185,2186,2187,
/
#
# 48 LEU HA 90 VAL QG2 5.14
&rst
ixpk= 0, nxpk= 0, iat= 766, -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
igr2=1463,1464,1465,1467,1468,1469,
/
#
# 48 LEU QD1 90 VAL QG2 3.62
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.58, r4= 7.08,
igr1= 773, 774, 775, 777, 778, 779,
igr2=1463,1464,1465,1467,1468,1469,
/
#
# 48 LEU QD2 90 VAL QG2 3.62
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.58, r4= 7.08,
igr1= 773, 774, 775, 777, 778, 779,
igr2=1463,1464,1465,1467,1468,1469,
/
#
# 91 LEU HB3 131 LEU QD1 4.13
&rst
ixpk= 0, nxpk= 0, iat=1478, -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
igr2=2181,2182,2183,2185,2186,2187,
/
#
# 48 LEU HA 90 VAL QG1 5.50
&rst
ixpk= 0, nxpk= 0, iat= 766, -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr2=1463,1464,1465,1467,1468,1469,
/
#
# 49 ARG HA 49 ARG HG3 3.82
&rst
ixpk= 0, nxpk= 0, iat= 785, 791, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32, /
#
# 49 ARG HA 49 ARG HD2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 785, 793, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 49 ARG HA 49 ARG HD3 5.50
&rst
ixpk= 0, nxpk= 0, iat= 785, 794, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 46 TYR HA 49 ARG HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= 728, 785, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 49 ARG HA 50 PRO HD2 3.39
&rst
ixpk= 0, nxpk= 0, iat= 785, 808, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89, /
#
# 49 ARG HA 50 PRO HD3 3.39
&rst
ixpk= 0, nxpk= 0, iat= 785, 809, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89, /
#
# 46 TYR HA 49 ARG HG2 4.24
&rst
ixpk= 0, nxpk= 0, iat= 728, 790, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74, /
#
# 49 ARG HG2 51 SER HB2 5.27
&rst
ixpk= 0, nxpk= 0, iat= 790, 825, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77, /
#
# 46 TYR HA 49 ARG HD2 5.12
&rst
ixpk= 0, nxpk= 0, iat= 728, 793, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, /
#
# 46 TYR HA 49 ARG HD3 5.12
&rst
ixpk= 0, nxpk= 0, iat= 728, 794, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, /
#
# 47 MET HA 49 ARG HG2 4.73
&rst
ixpk= 0, nxpk= 0, iat= 749, 790, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, /
#
# 49 ARG HG2 51 SER HB3 5.27
&rst
ixpk= 0, nxpk= 0, iat= 790, 826, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77, /
#
# 49 ARG HG2 51 SER HA 5.42
&rst
ixpk= 0, nxpk= 0, iat= 790, 823, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92, /
#
# 49 ARG H 49 ARG HB2 3.93
&rst
ixpk= 0, nxpk= 0, iat= 783, 787, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43, /
#
# 49 ARG H 49 ARG HG3 4.42
&rst
ixpk= 0, nxpk= 0, iat= 783, 791, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92, /
#
# 50 PRO HA 52 VAL H 4.42
&rst
ixpk= 0, nxpk= 0, iat= 817, 832, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92, /
#
# 49 ARG HA 50 PRO HG2 4.45
&rst
ixpk= 0, nxpk= 0, iat= 785, 811, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95, /
#
# 49 ARG HA 50 PRO HG3 4.56
&rst
ixpk= 0, nxpk= 0, iat= 785, 812, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06, /
#
# 50 PRO HA 51 SER HA 4.82
&rst
ixpk= 0, nxpk= 0, iat= 817, 823, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32, /
#
# 49 ARG HA 50 PRO HA 4.55
&rst
ixpk= 0, nxpk= 0, iat= 785, 817, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05, /
#
# 49 ARG HB2 50 PRO HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= 787, 817, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 51 SER HA 52 VAL HB 5.50
&rst
ixpk= 0, nxpk= 0, iat= 823, 836, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 50 PRO HB2 51 SER HA 4.36
&rst
ixpk= 0, nxpk= 0, iat= 814, 823, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86, /
#
# 50 PRO HG2 51 SER HA 4.42
&rst
ixpk= 0, nxpk= 0, iat= 811, 823, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92, /
#
# 50 PRO HB3 51 SER HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= 815, 823, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20, /
#
# 46 TYR HE 52 VAL QG2 4.37
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 736, 741,
igr2= 838, 839, 840, 842, 843, 844,
/
#
# 49 ARG H 52 VAL QG1 5.24
&rst
ixpk= 0, nxpk= 0, iat= 783, -1, r1= 1.30, r2= 1.80, r3= 7.06, r4= 7.56,
igr2= 838, 839, 840, 842, 843, 844,
/
#
# 49 ARG H 52 VAL QG2 5.24
&rst
ixpk= 0, nxpk= 0, iat= 783, -1, r1= 1.30, r2= 1.80, r3= 7.06, r4= 7.56,
igr2= 838, 839, 840, 842, 843, 844,
/
#
# 52 VAL HB 53 ASN H 4.83
&rst
ixpk= 0, nxpk= 0, iat= 836, 848, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33, /
#
# 52 VAL QG1 53 ASN HA 5.42
&rst
ixpk= 0, nxpk= 0, iat= -1, 850, r1= 1.30, r2= 1.80, r3= 7.31, r4= 7.81,
igr1= 838, 839, 840, 842, 843, 844,
/
#
# 52 VAL QG1 57 LYS HA 5.30
&rst
ixpk= 0, nxpk= 0, iat= -1, 926, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
igr1= 838, 839, 840, 842, 843, 844,
/
#
# 52 VAL HA 52 VAL QG1 3.27
&rst
ixpk= 0, nxpk= 0, iat= 834, -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
igr2= 838, 839, 840, 842, 843, 844,
/
#
# 52 VAL HA 52 VAL QG2 3.27
&rst
ixpk= 0, nxpk= 0, iat= 834, -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
igr2= 838, 839, 840, 842, 843, 844,
/
#
# 52 VAL HA 53 ASN HB3 4.91
&rst
ixpk= 0, nxpk= 0, iat= 834, 853, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41, /
#
# 52 VAL QG1 57 LYS HE3 4.74
&rst
ixpk= 0, nxpk= 0, iat= -1, 938, r1= 1.30, r2= 1.80, r3= 6.39, r4= 6.89,
igr1= 838, 839, 840, 842, 843, 844,
/
#
# 52 VAL QG2 57 LYS HE3 4.74
&rst
ixpk= 0, nxpk= 0, iat= -1, 938, r1= 1.30, r2= 1.80, r3= 6.39, r4= 6.89,
igr1= 838, 839, 840, 842, 843, 844,
/
#
# 52 VAL QG1 57 LYS HE2 4.74
&rst
ixpk= 0, nxpk= 0, iat= -1, 937, r1= 1.30, r2= 1.80, r3= 6.39, r4= 6.89,
igr1= 838, 839, 840, 842, 843, 844,
/
#
# 52 VAL QG2 57 LYS HE2 4.74
&rst
ixpk= 0, nxpk= 0, iat= -1, 937, r1= 1.30, r2= 1.80, r3= 6.39, r4= 6.89,
igr1= 838, 839, 840, 842, 843, 844,
/
#
# 52 VAL HA 53 ASN HB2 4.91
&rst
ixpk= 0, nxpk= 0, iat= 834, 852, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41, /
#
# 52 VAL QG2 53 ASN HA 5.42
&rst
ixpk= 0, nxpk= 0, iat= -1, 850, r1= 1.30, r2= 1.80, r3= 7.31, r4= 7.81,
igr1= 838, 839, 840, 842, 843, 844,
/
#
# 52 VAL QG2 53 ASN HB2 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 852, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr1= 838, 839, 840, 842, 843, 844,
/
#
# 52 VAL QG2 53 ASN HB3 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 853, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr1= 838, 839, 840, 842, 843, 844,
/
#
# 52 VAL QG1 53 ASN HB2 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 852, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr1= 838, 839, 840, 842, 843, 844,
/
#
# 52 VAL QG1 53 ASN HB3 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 853, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr1= 838, 839, 840, 842, 843, 844,
/
#
# 53 ASN HB2 54 THR QG2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 852, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2= 868, 869, 870,
/
#
# 53 ASN HB3 54 THR QG2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 853, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2= 868, 869, 870,
/
#
# 52 VAL HA 53 ASN HA 4.59
&rst
ixpk= 0, nxpk= 0, iat= 834, 850, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, /
#
# 53 ASN HA 53 ASN HND1 4.66
&rst
ixpk= 0, nxpk= 0, iat= 850, 857, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66, /
#
# 53 ASN HA 54 THR H 3.14
&rst
ixpk= 0, nxpk= 0, iat= 850, 862, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64, /
#
# 54 THR HB 58 LEU H 4.99
&rst
ixpk= 0, nxpk= 0, iat= 866, 946, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49, /
#
# 54 THR HB 98 PHE HE 4.15
&rst
ixpk= 0, nxpk= 0, iat= 866, -1, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
igr2=1598,1602,
/
#
# 53 ASN HND1 54 THR HB 5.15
&rst
ixpk= 0, nxpk= 0, iat= 857, 866, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65, /
#
# 54 THR HB 98 PHE HD 4.09
&rst
ixpk= 0, nxpk= 0, iat= 866, -1, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
igr2=1596,1604,
/
#
# 54 THR QG2 98 PHE HD 3.25
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
igr1= 868, 869, 870,
igr2=1596,1604,
/
#
# 54 THR QG2 98 PHE HE 3.55
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
igr1= 868, 869, 870,
igr2=1598,1602,
/
#
# 54 THR QG2 98 PHE HZ 5.19
&rst
ixpk= 0, nxpk= 0, iat= -1,1600, r1= 1.30, r2= 1.80, r3= 6.23, r4= 6.73,
igr1= 868, 869, 870,
/
#
# 54 THR HB 98 PHE HA 4.34
&rst
ixpk= 0, nxpk= 0, iat= 866,1590, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84, /
#
# 53 ASN HA 54 THR QG2 4.08
&rst
ixpk= 0, nxpk= 0, iat= 850, -1, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,
igr2= 868, 869, 870,
/
#
# 54 THR QG2 99 PRO HG3 4.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1613, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
igr1= 868, 869, 870,
/
#
# 54 THR HB 57 LYS HB3 5.50
&rst
ixpk= 0, nxpk= 0, iat= 866, 929, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 54 THR HB 99 PRO HG2 5.21
&rst
ixpk= 0, nxpk= 0, iat= 866,1612, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71, /
#
# 54 THR HB 57 LYS HB2 4.47
&rst
ixpk= 0, nxpk= 0, iat= 866, 928, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97, /
#
# 54 THR HB 58 LEU HB2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 866, 950, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 54 THR HB 102 LEU HB2 4.84
&rst
ixpk= 0, nxpk= 0, iat= 866,1662, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34, /
#
# 54 THR QG2 102 LEU HB2 4.81
&rst
ixpk= 0, nxpk= 0, iat= -1,1662, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr1= 868, 869, 870,
/
#
# 90 VAL QG1 93 ARG QB 4.34
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.57, r4= 7.07,
igr1=1463,1464,1465,1467,1468,1469,
igr2=1503,1504,
/
#
# 55 ARG HA 58 LEU HB2 4.03
&rst
ixpk= 0, nxpk= 0, iat= 878, 950, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53, /
#
# 55 ARG HA 55 ARG HG3 3.91
&rst
ixpk= 0, nxpk= 0, iat= 878, 884, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41, /
#
# 129 ARG QG 129 ARG QD 2.62
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80,
igr1=2144,2145,
igr2=2147,2148,
/
#
# 129 ARG HB2 129 ARG QD 3.74
&rst
ixpk= 0, nxpk= 0, iat=2141, -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
igr2=2147,2148,
/
#
# 55 ARG QB 55 ARG HD2 3.78
&rst
ixpk= 0, nxpk= 0, iat= -1, 886, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
igr1= 880, 881,
/
#
# 55 ARG QB 55 ARG HD3 3.78
&rst
ixpk= 0, nxpk= 0, iat= -1, 887, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
igr1= 880, 881,
/
#
# 55 ARG HA 58 LEU H 3.97
&rst
ixpk= 0, nxpk= 0, iat= 878, 946, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47, /
#
# 55 ARG H 55 ARG HG2 4.17
&rst
ixpk= 0, nxpk= 0, iat= 876, 883, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67, /
#
# 54 THR H 55 ARG HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= 862, 878, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 56 ARG HA 56 ARG QD 4.19
&rst
ixpk= 0, nxpk= 0, iat= 902, -1, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
igr2= 910, 911,
/
#
# 55 ARG H 56 ARG QD 4.92
&rst
ixpk= 0, nxpk= 0, iat= 876, -1, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
igr2= 910, 911,
/
#
# 53 ASN HND1 56 ARG QD 4.63
&rst
ixpk= 0, nxpk= 0, iat= 857, -1, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr2= 910, 911,
/
#
# 52 VAL H 56 ARG QD 5.50
&rst
ixpk= 0, nxpk= 0, iat= 832, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 910, 911,
/
#
# 46 TYR HE 56 ARG QD 4.91
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.19, r4= 6.69,
igr1= 736, 741,
igr2= 910, 911,
/
#
# 56 ARG QB 56 ARG QD 3.51
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
igr1= 904, 905,
igr2= 910, 911,
/
#
# 52 VAL QG1 56 ARG QD 4.72
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
igr1= 838, 839, 840, 842, 843, 844,
igr2= 910, 911,
/
#
# 52 VAL QG2 56 ARG QD 4.72
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
igr1= 838, 839, 840, 842, 843, 844,
igr2= 910, 911,
/
#
# 56 ARG QD 57 LYS HG3 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 932, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 910, 911,
/
#
# 52 VAL QG2 57 LYS HA 5.30
&rst
ixpk= 0, nxpk= 0, iat= -1, 926, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
igr1= 838, 839, 840, 842, 843, 844,
/
#
# 57 LYS HA 90 VAL QG1 5.50
&rst
ixpk= 0, nxpk= 0, iat= 926, -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr2=1463,1464,1465,1467,1468,1469,
/
#
# 57 LYS HA 94 ILE QG2 4.83
&rst
ixpk= 0, nxpk= 0, iat= 926, -1, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
igr2=1529,1530,1531,
/
#
# 57 LYS HA 57 LYS HG3 4.04
&rst
ixpk= 0, nxpk= 0, iat= 926, 932, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, /
#
# 57 LYS HA 57 LYS HG2 3.95
&rst
ixpk= 0, nxpk= 0, iat= 926, 931, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45, /
#
# 119 PHE HB3 123 VAL HB 4.94
&rst
ixpk= 0, nxpk= 0, iat=1980,2049, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44, /
#
# 54 THR HA 57 LYS HA 5.48
&rst
ixpk= 0, nxpk= 0, iat= 864, 926, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98, /
#
# 57 LYS HA 60 GLY H 4.63
&rst
ixpk= 0, nxpk= 0, iat= 926, 984, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, /
#
# 131 LEU HB3 131 LEU QD2 3.26
&rst
ixpk= 0, nxpk= 0, iat=2177, -1, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,
igr2=2181,2182,2183,2185,2186,2187,
/
#
# 59 LEU HA 63 LEU H 4.90
&rst
ixpk= 0, nxpk= 0, iat= 967,1031, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40, /
#
# 58 LEU HB3 61 LEU H 5.50
&rst
ixpk= 0, nxpk= 0, iat= 951, 991, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 131 LEU HA 131 LEU QD2 4.06
&rst
ixpk= 0, nxpk= 0, iat=2174, -1, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,
igr2=2181,2182,2183,2185,2186,2187,
/
#
# 58 LEU HA 58 LEU QD2 4.04
&rst
ixpk= 0, nxpk= 0, iat= 948, -1, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,
igr2= 955, 956, 957, 959, 960, 961,
/
#
# 128 GLU HA 131 LEU QD2 4.69
&rst
ixpk= 0, nxpk= 0, iat=2124, -1, r1= 1.30, r2= 1.80, r3= 6.32, r4= 6.82,
igr2=2181,2182,2183,2185,2186,2187,
/
#
# 58 LEU HA 61 LEU HB3 4.43
&rst
ixpk= 0, nxpk= 0, iat= 948, 996, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93, /
#
# 58 LEU HA 61 LEU HB2 4.43
&rst
ixpk= 0, nxpk= 0, iat= 948, 995, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93, /
#
# 91 LEU HB3 131 LEU QD2 4.13
&rst
ixpk= 0, nxpk= 0, iat=1478, -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
igr2=2181,2182,2183,2185,2186,2187,
/
#
# 58 LEU HB2 58 LEU QD1 3.34
&rst
ixpk= 0, nxpk= 0, iat= 950, -1, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
igr2= 955, 956, 957, 959, 960, 961,
/
#
# 58 LEU HB2 58 LEU QD2 3.34
&rst
ixpk= 0, nxpk= 0, iat= 950, -1, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
igr2= 955, 956, 957, 959, 960, 961,
/
#
# 110 VAL QG1 131 LEU QD2 4.03
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.32, r4= 7.82,
igr1=1819,1820,1821,1823,1824,1825,
igr2=2181,2182,2183,2185,2186,2187,
/
#
# 58 LEU HA 58 LEU QD1 4.04
&rst
ixpk= 0, nxpk= 0, iat= 948, -1, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,
igr2= 955, 956, 957, 959, 960, 961,
/
#
# 58 LEU QD2 102 LEU QD1 4.05
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.36, r4= 7.86,
igr1= 955, 956, 957, 959, 960, 961,
igr2=1667,1668,1669,1671,1672,1673,
/
#
# 58 LEU QD2 102 LEU QD2 4.05
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.36, r4= 7.86,
igr1= 955, 956, 957, 959, 960, 961,
igr2=1667,1668,1669,1671,1672,1673,
/
#
# 59 LEU HA 60 GLY HA2 4.93
&rst
ixpk= 0, nxpk= 0, iat= 967, 986, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43, /
#
# 17 ASP HA 59 LEU QD2 4.44
&rst
ixpk= 0, nxpk= 0, iat= 258, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2= 974, 975, 976, 978, 979, 980,
/
#
# 17 ASP HA 59 LEU QD1 4.44
&rst
ixpk= 0, nxpk= 0, iat= 258, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2= 974, 975, 976, 978, 979, 980,
/
#
# 16 GLU HA 59 LEU QD2 3.90
&rst
ixpk= 0, nxpk= 0, iat= 243, -1, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr2= 974, 975, 976, 978, 979, 980,
/
#
# 63 LEU H 63 LEU QD1 5.03
&rst
ixpk= 0, nxpk= 0, iat=1031, -1, r1= 1.30, r2= 1.80, r3= 6.78, r4= 7.28,
igr2=1040,1041,1042,1044,1045,1046,
/
#
# 61 LEU H 61 LEU QD2 4.36
&rst
ixpk= 0, nxpk= 0, iat= 991, -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
igr2=1000,1001,1002,1004,1005,1006,
/
#
# 61 LEU QD1 98 PHE HE 5.01
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.58, r4= 8.08,
igr1=1000,1001,1002,1004,1005,1006,
igr2=1598,1602,
/
#
# 61 LEU QD2 98 PHE HE 5.01
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.58, r4= 8.08,
igr1=1000,1001,1002,1004,1005,1006,
igr2=1598,1602,
/
#
# 61 LEU HA 64 MET H 4.78
&rst
ixpk= 0, nxpk= 0, iat= 993,1050, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, /
#
# 61 LEU HA 61 LEU QD2 4.26
&rst
ixpk= 0, nxpk= 0, iat= 993, -1, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
igr2=1000,1001,1002,1004,1005,1006,
/
#
# 61 LEU HA 61 LEU QD1 4.26
&rst
ixpk= 0, nxpk= 0, iat= 993, -1, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
igr2=1000,1001,1002,1004,1005,1006,
/
#
# 60 GLY HA2 61 LEU HA 4.88
&rst
ixpk= 0, nxpk= 0, iat= 986, 993, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38, /
#
# 58 LEU HA 61 LEU HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= 948, 993, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 61 LEU QD1 109 VAL HB 3.95
&rst
ixpk= 0, nxpk= 0, iat= -1,1801, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
igr1=1000,1001,1002,1004,1005,1006,
/
#
# 61 LEU QD2 109 VAL HB 3.95
&rst
ixpk= 0, nxpk= 0, iat= -1,1801, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
igr1=1000,1001,1002,1004,1005,1006,
/
#
# 61 LEU QD1 91 LEU HG 3.65
&rst
ixpk= 0, nxpk= 0, iat= -1,1480, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
igr1=1000,1001,1002,1004,1005,1006,
/
#
# 61 LEU QD2 91 LEU HG 3.65
&rst
ixpk= 0, nxpk= 0, iat= -1,1480, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
igr1=1000,1001,1002,1004,1005,1006,
/
#
# 61 LEU QD1 106 LEU HG 3.57
&rst
ixpk= 0, nxpk= 0, iat= -1,1750, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31,
igr1=1000,1001,1002,1004,1005,1006,
/
#
# 61 LEU QD2 106 LEU HG 3.57
&rst
ixpk= 0, nxpk= 0, iat= -1,1750, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31,
igr1=1000,1001,1002,1004,1005,1006,
/
#
# 61 LEU HG 94 ILE QD1 5.50
&rst
ixpk= 0, nxpk= 0, iat= 998, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2=1536,1537,1538,
/
#
# 61 LEU HA 91 LEU QD2 5.13
&rst
ixpk= 0, nxpk= 0, iat= 993, -1, r1= 1.30, r2= 1.80, r3= 6.92, r4= 7.42,
igr2=1482,1483,1484,1486,1487,1488,
/
#
# 61 LEU HA 91 LEU QD1 5.13
&rst
ixpk= 0, nxpk= 0, iat= 993, -1, r1= 1.30, r2= 1.80, r3= 6.92, r4= 7.42,
igr2=1482,1483,1484,1486,1487,1488,
/
#
# 61 LEU QD1 90 VAL QG1 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
igr1=1000,1001,1002,1004,1005,1006,
igr2=1463,1464,1465,1467,1468,1469,
/
#
# 61 LEU QD2 90 VAL QG1 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
igr1=1000,1001,1002,1004,1005,1006,
igr2=1463,1464,1465,1467,1468,1469,
/
#
# 22 ILE QG2 62 TYR HA 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1012, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr1= 328, 329, 330,
/
#
# 22 ILE QD1 62 TYR HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1012, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 335, 336, 337,
/
#
# 22 ILE QD1 62 TYR HB3 4.93
&rst
ixpk= 0, nxpk= 0, iat= -1,1015, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
igr1= 335, 336, 337,
/
#
# 81 ASP HA 85 LYS HG2 4.90
&rst
ixpk= 0, nxpk= 0, iat=1336,1391, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40, /
#
# 80 GLN HG3 81 ASP HA 4.39
&rst
ixpk= 0, nxpk= 0, iat=1325,1336, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89, /
#
# 81 ASP HA 81 ASP QB 2.94
&rst
ixpk= 0, nxpk= 0, iat=1336, -1, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80,
igr2=1338,1339,
/
#
# 62 TYR HA 63 LEU HA 5.09
&rst
ixpk= 0, nxpk= 0, iat=1012,1033, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59, /
#
# 81 ASP HA 84 GLY HA3 4.33
&rst
ixpk= 0, nxpk= 0, iat=1336,1380, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83, /
#
# 77 ILE HA 81 ASP HA 5.50
&rst
ixpk= 0, nxpk= 0, iat=1263,1336, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 62 TYR HA 62 TYR HD 4.31
&rst
ixpk= 0, nxpk= 0, iat=1012, -1, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
igr2=1018,1027,
/
#
# 62 TYR HA 62 TYR HE 4.60
&rst
ixpk= 0, nxpk= 0, iat=1012, -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
igr2=1020,1025,
/
#
# 63 LEU H 63 LEU QD2 5.03
&rst
ixpk= 0, nxpk= 0, iat=1031, -1, r1= 1.30, r2= 1.80, r3= 6.78, r4= 7.28,
igr2=1040,1041,1042,1044,1045,1046,
/
#
# 8 PHE HE 63 LEU QD2 4.19
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.34, r4= 6.84,
igr1= 115, 119,
igr2=1040,1041,1042,1044,1045,1046,
/
#
# 8 PHE HE 63 LEU QD1 4.19
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.34, r4= 6.84,
igr1= 115, 119,
igr2=1040,1041,1042,1044,1045,1046,
/
#
# 60 GLY HA2 63 LEU QD1 4.54
&rst
ixpk= 0, nxpk= 0, iat= 986, -1, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,
igr2=1040,1041,1042,1044,1045,1046,
/
#
# 60 GLY HA2 63 LEU QD2 4.54
&rst
ixpk= 0, nxpk= 0, iat= 986, -1, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,
igr2=1040,1041,1042,1044,1045,1046,
/
#
# 63 LEU HA 63 LEU QD2 4.01
&rst
ixpk= 0, nxpk= 0, iat=1033, -1, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,
igr2=1040,1041,1042,1044,1045,1046,
/
#
# 110 VAL HA 110 VAL QG1 3.28
&rst
ixpk= 0, nxpk= 0, iat=1815, -1, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
igr2=1819,1820,1821,1823,1824,1825,
/
#
# 110 VAL QG1 131 LEU QD1 4.03
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.32, r4= 7.82,
igr1=1819,1820,1821,1823,1824,1825,
igr2=2181,2182,2183,2185,2186,2187,
/
#
# 64 MET QE 87 ALA QB 2.55
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18,
igr1=1061,1062,1063,
igr2=1426,1427,1428,
/
#
# 64 MET QE 86 VAL QG2 3.29
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
igr1=1061,1062,1063,
igr2=1412,1413,1414,1416,1417,1418,
/
#
# 64 MET HG2 64 MET QE 2.74
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19,
igr1=1057,1058,
igr2=1061,1062,1063,
/
#
# 64 MET QE 83 PHE HB3 3.08
&rst
ixpk= 0, nxpk= 0, iat= -1,1362, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,
igr1=1061,1062,1063,
/
#
# 64 MET QE 84 GLY HA2 4.04
&rst
ixpk= 0, nxpk= 0, iat= -1,1379, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
igr1=1061,1062,1063,
/
#
# 64 MET QE 83 PHE HB2 3.79
&rst
ixpk= 0, nxpk= 0, iat= -1,1361, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,
igr1=1061,1062,1063,
/
#
# 64 MET QE 83 PHE HA 4.10
&rst
ixpk= 0, nxpk= 0, iat= -1,1359, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
igr1=1061,1062,1063,
/
#
# 64 MET QE 83 PHE HE 3.97
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,
igr1=1061,1062,1063,
igr2=1367,1371,
/
#
# 43 TRP HH2 64 MET QE 3.59
&rst
ixpk= 0, nxpk= 0, iat= 680, -1, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,
igr2=1061,1062,1063,
/
#
# 64 MET QE 87 ALA H 3.88
&rst
ixpk= 0, nxpk= 0, iat= -1,1422, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
igr1=1061,1062,1063,
/
#
# 43 TRP HE3 64 MET QE 4.48
&rst
ixpk= 0, nxpk= 0, iat= 684, -1, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
igr2=1061,1062,1063,
/
#
# 87 ALA HA 90 VAL H 4.25
&rst
ixpk= 0, nxpk= 0, iat=1424,1457, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75, /
#
# 43 TRP HH2 87 ALA HA 3.67
&rst
ixpk= 0, nxpk= 0, iat= 680,1424, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17, /
#
# 86 VAL HB 87 ALA HA 4.90
&rst
ixpk= 0, nxpk= 0, iat=1410,1424, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40, /
#
# 87 ALA HA 90 VAL HB 3.79
&rst
ixpk= 0, nxpk= 0, iat=1424,1461, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29, /
#
# 87 ALA HA 90 VAL QG1 4.71
&rst
ixpk= 0, nxpk= 0, iat=1424, -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
igr2=1463,1464,1465,1467,1468,1469,
/
#
# 65 ASN H 66 HIS HA 5.50
&rst
ixpk= 0, nxpk= 0, iat=1067,1083, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 66 HIS HA 68 VAL H 5.50
&rst
ixpk= 0, nxpk= 0, iat=1083,1114, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 67 VAL HA 67 VAL QG2 3.59
&rst
ixpk= 0, nxpk= 0, iat=1100, -1, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
igr2=1104,1105,1106,1108,1109,1110,
/
#
# 64 MET QE 68 VAL QG1 3.74
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
igr1=1061,1062,1063,
igr2=1120,1121,1122,1124,1125,1126,
/
#
# 64 MET HA 67 VAL HA 5.50
&rst
ixpk= 0, nxpk= 0, iat=1052,1100, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 64 MET HA 67 VAL HB 4.30
&rst
ixpk= 0, nxpk= 0, iat=1052,1102, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80, /
#
# 68 VAL QG1 83 PHE HB3 4.86
&rst
ixpk= 0, nxpk= 0, iat= -1,1362, r1= 1.30, r2= 1.80, r3= 6.55, r4= 7.05,
igr1=1120,1121,1122,1124,1125,1126,
/
#
# 66 HIS HA 67 VAL HA 5.30
&rst
ixpk= 0, nxpk= 0, iat=1083,1100, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80, /
#
# 68 VAL HA 68 VAL QG1 3.44
&rst
ixpk= 0, nxpk= 0, iat=1116, -1, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
igr2=1120,1121,1122,1124,1125,1126,
/
#
# 68 VAL QG1 69 GLN H 4.14
&rst
ixpk= 0, nxpk= 0, iat= -1,1130, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr1=1120,1121,1122,1124,1125,1126,
/
#
# 67 VAL HB 68 VAL H 3.89
&rst
ixpk= 0, nxpk= 0, iat=1102,1114, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39, /
#
# 68 VAL H 68 VAL QG1 3.33
&rst
ixpk= 0, nxpk= 0, iat=1114, -1, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
igr2=1120,1121,1122,1124,1125,1126,
/
#
# 68 VAL HA 119 PHE HE 5.16
&rst
ixpk= 0, nxpk= 0, iat=1116, -1, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,
igr2=1985,1989,
/
#
# 68 VAL QG1 119 PHE HE 3.86
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
igr1=1120,1121,1122,1124,1125,1126,
igr2=1985,1989,
/
#
# 68 VAL HA 80 GLN HA 4.85
&rst
ixpk= 0, nxpk= 0, iat=1116,1319, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35, /
#
# 67 VAL HA 68 VAL HA 4.92
&rst
ixpk= 0, nxpk= 0, iat=1100,1116, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42, /
#
# 68 VAL QG2 83 PHE HB3 4.86
&rst
ixpk= 0, nxpk= 0, iat= -1,1362, r1= 1.30, r2= 1.80, r3= 6.55, r4= 7.05,
igr1=1120,1121,1122,1124,1125,1126,
/
#
# 68 VAL HA 83 PHE HB3 5.28
&rst
ixpk= 0, nxpk= 0, iat=1116,1362, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, /
#
# 68 VAL HA 68 VAL QG2 3.44
&rst
ixpk= 0, nxpk= 0, iat=1116, -1, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
igr2=1120,1121,1122,1124,1125,1126,
/
#
# 64 MET QE 68 VAL QG2 3.74
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
igr1=1061,1062,1063,
igr2=1120,1121,1122,1124,1125,1126,
/
#
# 64 MET QE 68 VAL HA 5.15
&rst
ixpk= 0, nxpk= 0, iat= -1,1116, r1= 1.30, r2= 1.80, r3= 6.18, r4= 6.68,
igr1=1061,1062,1063,
/
#
# 68 VAL QG2 118 ILE QG2 3.72
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,
igr1=1120,1121,1122,1124,1125,1126,
igr2=1962,1963,1964,
/
#
# 68 VAL HA 83 PHE HD 5.44
&rst
ixpk= 0, nxpk= 0, iat=1116, -1, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
igr2=1365,1373,
/
#
# 68 VAL QG2 119 PHE HE 3.86
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
igr1=1120,1121,1122,1124,1125,1126,
igr2=1985,1989,
/
#
# 68 VAL H 68 VAL QG2 3.33
&rst
ixpk= 0, nxpk= 0, iat=1114, -1, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
igr2=1120,1121,1122,1124,1125,1126,
/
#
# 47 MET QE 60 GLY H 3.91
&rst
ixpk= 0, nxpk= 0, iat= -1, 984, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
igr1= 758, 759, 760,
/
#
# 71 ALA HA 73 GLY H 4.53
&rst
ixpk= 0, nxpk= 0, iat=1166,1196, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03, /
#
# 71 ALA HA 74 GLN HNE1 5.07
&rst
ixpk= 0, nxpk= 0, iat=1166,1215, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, /
#
# 71 ALA QB 79 PHE HD 3.91
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77,
igr1=1168,1169,1170,
igr2=1305,1313,
/
#
# 70 GLN HA 71 ALA HA 5.05
&rst
ixpk= 0, nxpk= 0, iat=1149,1166, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55, /
#
# 71 ALA QB 72 LYS HA 3.79
&rst
ixpk= 0, nxpk= 0, iat= -1,1176, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,
igr1=1168,1169,1170,
/
#
# 68 VAL HA 71 ALA HA 5.46
&rst
ixpk= 0, nxpk= 0, iat=1116,1166, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96, /
#
# 68 VAL HA 71 ALA QB 3.41
&rst
ixpk= 0, nxpk= 0, iat=1116, -1, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,
igr2=1168,1169,1170,
/
#
# 71 ALA QB 79 PHE HB3 3.77
&rst
ixpk= 0, nxpk= 0, iat= -1,1302, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
igr1=1168,1169,1170,
/
#
# 71 ALA HA 79 PHE HB3 5.50
&rst
ixpk= 0, nxpk= 0, iat=1166,1302, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 71 ALA QB 79 PHE HB2 3.63
&rst
ixpk= 0, nxpk= 0, iat= -1,1301, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,
igr1=1168,1169,1170,
/
#
# 71 ALA HA 79 PHE HB2 5.17
&rst
ixpk= 0, nxpk= 0, iat=1166,1301, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67, /
#
# 71 ALA HA 74 GLN HG3 4.51
&rst
ixpk= 0, nxpk= 0, iat=1166,1211, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01, /
#
# 71 ALA QB 74 GLN HG2 4.43
&rst
ixpk= 0, nxpk= 0, iat= -1,1210, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
igr1=1168,1169,1170,
/
#
# 71 ALA HA 76 ILE HB 3.72
&rst
ixpk= 0, nxpk= 0, iat=1166,1246, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22, /
#
# 71 ALA QB 76 ILE HB 3.24
&rst
ixpk= 0, nxpk= 0, iat= -1,1246, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,
igr1=1168,1169,1170,
/
#
# 71 ALA HA 76 ILE HG12 4.26
&rst
ixpk= 0, nxpk= 0, iat=1166,1252, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76, /
#
# 71 ALA QB 76 ILE QG2 3.46
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,
igr1=1168,1169,1170,
igr2=1248,1249,1250,
/
#
# 30 LEU QD2 71 ALA HA 4.09
&rst
ixpk= 0, nxpk= 0, iat= -1,1166, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
igr1= 458, 459, 460, 462, 463, 464,
/
#
# 72 LYS HA 118 ILE QG2 4.62
&rst
ixpk= 0, nxpk= 0, iat=1176, -1, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,
igr2=1962,1963,1964,
/
#
# 72 LYS QG 72 LYS QE 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,
igr1=1181,1182,
igr2=1187,1188,
/
#
# 106 LEU HA 106 LEU HG 3.93
&rst
ixpk= 0, nxpk= 0, iat=1745,1750, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43, /
#
# 72 LYS QD 72 LYS QE 2.95
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,
igr1=1184,1185,
igr2=1187,1188,
/
#
# 103 LYS QB 103 LYS QE 3.68
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
igr1=1681,1682,
igr2=1690,1691,
/
#
# 103 LYS QB 103 LYS QD 3.88
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
igr1=1681,1682,
igr2=1687,1688,
/
#
# 100 ARG HA 103 LYS QE 4.02
&rst
ixpk= 0, nxpk= 0, iat=1624, -1, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,
igr2=1690,1691,
/
#
# 100 ARG HA 103 LYS QD 3.81
&rst
ixpk= 0, nxpk= 0, iat=1624, -1, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,
igr2=1687,1688,
/
#
# 72 LYS HA 72 LYS QD 4.22
&rst
ixpk= 0, nxpk= 0, iat=1176, -1, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr2=1184,1185,
/
#
# 74 GLN HG3 76 ILE QD1 4.38
&rst
ixpk= 0, nxpk= 0, iat=1211, -1, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr2=1255,1256,1257,
/
#
# 104 LYS QD 104 LYS QE 2.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.15, r4= 3.65,
igr1=1709,1710,
igr2=1712,1713,
/
#
# 75 LYS HG3 75 LYS QE 3.78
&rst
ixpk= 0, nxpk= 0, iat=1228, -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
igr2=1233,1234,
/
#
# 75 LYS HG2 75 LYS QE 3.78
&rst
ixpk= 0, nxpk= 0, iat=1227, -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
igr2=1233,1234,
/
#
# 114 LYS HG3 114 LYS QE 3.71
&rst
ixpk= 0, nxpk= 0, iat=1889, -1, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
igr2=1894,1895,
/
#
# 75 LYS HA 75 LYS QD 3.99
&rst
ixpk= 0, nxpk= 0, iat=1222, -1, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
igr2=1230,1231,
/
#
# 114 LYS HA 114 LYS HG3 3.95
&rst
ixpk= 0, nxpk= 0, iat=1883,1889, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45, /
#
# 72 LYS HA 75 LYS HA 4.21
&rst
ixpk= 0, nxpk= 0, iat=1176,1222, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71, /
#
# 75 LYS HA 76 ILE HA 4.60
&rst
ixpk= 0, nxpk= 0, iat=1222,1244, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, /
#
# 111 ASN HA 114 LYS HG3 4.77
&rst
ixpk= 0, nxpk= 0, iat=1831,1889, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27, /
#
# 75 LYS H 75 LYS HG2 3.99
&rst
ixpk= 0, nxpk= 0, iat=1220,1227, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49, /
#
# 76 ILE H 76 ILE QG2 3.96
&rst
ixpk= 0, nxpk= 0, iat=1242, -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
igr2=1248,1249,1250,
/
#
# 76 ILE QG2 77 ILE H 3.76
&rst
ixpk= 0, nxpk= 0, iat= -1,1261, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
igr1=1248,1249,1250,
/
#
# 76 ILE QG2 79 PHE HD 3.41
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
igr1=1248,1249,1250,
igr2=1305,1313,
/
#
# 33 TYR HD 76 ILE QG2 3.84
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
igr1= 512, 521,
igr2=1248,1249,1250,
/
#
# 33 TYR HD 76 ILE QD1 4.06
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,
igr1= 512, 521,
igr2=1255,1256,1257,
/
#
# 76 ILE HA 76 ILE QG2 3.24
&rst
ixpk= 0, nxpk= 0, iat=1244, -1, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,
igr2=1248,1249,1250,
/
#
# 76 ILE HA 76 ILE QD1 3.46
&rst
ixpk= 0, nxpk= 0, iat=1244, -1, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
igr2=1255,1256,1257,
/
#
# 76 ILE HA 77 ILE HA 4.73
&rst
ixpk= 0, nxpk= 0, iat=1244,1263, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, /
#
# 71 ALA HA 76 ILE QG2 4.18
&rst
ixpk= 0, nxpk= 0, iat=1166, -1, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
igr2=1248,1249,1250,
/
#
# 33 TYR HA 76 ILE QG2 4.26
&rst
ixpk= 0, nxpk= 0, iat= 506, -1, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
igr2=1248,1249,1250,
/
#
# 33 TYR HB3 76 ILE QG2 3.68
&rst
ixpk= 0, nxpk= 0, iat= 509, -1, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
igr2=1248,1249,1250,
/
#
# 76 ILE QG2 79 PHE HB2 4.04
&rst
ixpk= 0, nxpk= 0, iat= -1,1301, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
igr1=1248,1249,1250,
/
#
# 33 TYR HB2 76 ILE QG2 3.56
&rst
ixpk= 0, nxpk= 0, iat= 508, -1, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,
igr2=1248,1249,1250,
/
#
# 74 GLN HG3 76 ILE QG2 4.75
&rst
ixpk= 0, nxpk= 0, iat=1211, -1, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr2=1248,1249,1250,
/
#
# 76 ILE HB 76 ILE QD1 3.27
&rst
ixpk= 0, nxpk= 0, iat=1246, -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
igr2=1255,1256,1257,
/
#
# 76 ILE QG2 78 GLN HB2 3.83
&rst
ixpk= 0, nxpk= 0, iat= -1,1284, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
igr1=1248,1249,1250,
/
#
# 76 ILE QG2 76 ILE HG12 3.46
&rst
ixpk= 0, nxpk= 0, iat= -1,1252, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
igr1=1248,1249,1250,
/
#
# 71 ALA QB 76 ILE HA 4.99
&rst
ixpk= 0, nxpk= 0, iat= -1,1244, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1=1168,1169,1170,
/
#
# 76 ILE HA 78 GLN HB2 5.38
&rst
ixpk= 0, nxpk= 0, iat=1244,1284, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88, /
#
# 76 ILE HA 76 ILE HG12 4.21
&rst
ixpk= 0, nxpk= 0, iat=1244,1252, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71, /
#
# 76 ILE HA 77 ILE HG13 4.30
&rst
ixpk= 0, nxpk= 0, iat=1244,1272, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80, /
#
# 76 ILE HA 77 ILE QG2 4.61
&rst
ixpk= 0, nxpk= 0, iat=1244, -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
igr2=1267,1268,1269,
/
#
# 76 ILE QG2 76 ILE QD1 2.73
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,
igr1=1248,1249,1250,
igr2=1255,1256,1257,
/
#
# 77 ILE QG2 77 ILE HG12 2.89
&rst
ixpk= 0, nxpk= 0, iat= -1,1271, r1= 1.30, r2= 1.80, r3= 3.47, r4= 3.97,
igr1=1267,1268,1269,
/
#
# 77 ILE QG2 77 ILE HG13 3.12
&rst
ixpk= 0, nxpk= 0, iat= -1,1272, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,
igr1=1267,1268,1269,
/
#
# 77 ILE HB 77 ILE QD1 2.84
&rst
ixpk= 0, nxpk= 0, iat=1265, -1, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91,
igr2=1274,1275,1276,
/
#
# 77 ILE HB 80 GLN HG3 4.36
&rst
ixpk= 0, nxpk= 0, iat=1265,1325, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86, /
#
# 77 ILE HG13 80 GLN HG2 5.26
&rst
ixpk= 0, nxpk= 0, iat=1272,1324, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76, /
#
# 77 ILE QG2 80 GLN HG2 4.04
&rst
ixpk= 0, nxpk= 0, iat= -1,1324, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
igr1=1267,1268,1269,
/
#
# 77 ILE HA 81 ASP QB 4.38
&rst
ixpk= 0, nxpk= 0, iat=1263, -1, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
igr2=1338,1339,
/
#
# 77 ILE HB 81 ASP QB 4.34
&rst
ixpk= 0, nxpk= 0, iat=1265, -1, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,
igr2=1338,1339,
/
#
# 77 ILE HG13 81 ASP QB 4.87
&rst
ixpk= 0, nxpk= 0, iat=1272, -1, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,
igr2=1338,1339,
/
#
# 77 ILE QD1 81 ASP QB 3.75
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
igr1=1274,1275,1276,
igr2=1338,1339,
/
#
# 77 ILE QG2 81 ASP QB 4.53
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
igr1=1267,1268,1269,
igr2=1338,1339,
/
#
# 77 ILE HA 77 ILE QG2 2.80
&rst
ixpk= 0, nxpk= 0, iat=1263, -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
igr2=1267,1268,1269,
/
#
# 75 LYS HA 77 ILE QG2 4.58
&rst
ixpk= 0, nxpk= 0, iat=1222, -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
igr2=1267,1268,1269,
/
#
# 77 ILE H 77 ILE QD1 3.89
&rst
ixpk= 0, nxpk= 0, iat=1261, -1, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
igr2=1274,1275,1276,
/
#
# 77 ILE QG2 78 GLN HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1282, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1=1267,1268,1269,
/
#
# 76 ILE QG2 78 GLN HG3 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1,1288, r1= 1.30, r2= 1.80, r3= 6.41, r4= 6.91,
igr1=1248,1249,1250,
/
#
# 76 ILE QG2 78 GLN HG2 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1,1287, r1= 1.30, r2= 1.80, r3= 6.41, r4= 6.91,
igr1=1248,1249,1250,
/
#
# 76 ILE QG2 79 PHE HA 5.09
&rst
ixpk= 0, nxpk= 0, iat= -1,1299, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
igr1=1248,1249,1250,
/
#
# 71 ALA QB 79 PHE HA 5.39
&rst
ixpk= 0, nxpk= 0, iat= -1,1299, r1= 1.30, r2= 1.80, r3= 6.47, r4= 6.97,
igr1=1168,1169,1170,
/
#
# 78 GLN HB2 79 PHE HA 5.50
&rst
ixpk= 0, nxpk= 0, iat=1284,1299, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 36 ALA HA 79 PHE HA 4.97
&rst
ixpk= 0, nxpk= 0, iat= 563,1299, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, /
#
# 79 PHE HA 82 SER H 4.66
&rst
ixpk= 0, nxpk= 0, iat=1299,1346, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16, /
#
# 79 PHE HA 81 ASP H 5.29
&rst
ixpk= 0, nxpk= 0, iat=1299,1334, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79, /
#
# 80 GLN HA 119 PHE HA 4.89
&rst
ixpk= 0, nxpk= 0, iat=1319,1977, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39, /
#
# 80 GLN HA 83 PHE HD 4.92
&rst
ixpk= 0, nxpk= 0, iat=1319, -1, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
igr2=1365,1373,
/
#
# 68 VAL QG1 80 GLN HA 4.24
&rst
ixpk= 0, nxpk= 0, iat= -1,1319, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
igr1=1120,1121,1122,1124,1125,1126,
/
#
# 36 ALA QB 81 ASP QB 4.57
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
igr1= 565, 566, 567,
igr2=1338,1339,
/
#
# 78 GLN HB2 81 ASP QB 5.49
&rst
ixpk= 0, nxpk= 0, iat=1284, -1, r1= 1.30, r2= 1.80, r3= 6.16, r4= 6.66,
igr2=1338,1339,
/
#
# 81 ASP QB 85 LYS HG2 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1391, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1=1338,1339,
/
#
# 78 GLN HB3 81 ASP QB 4.85
&rst
ixpk= 0, nxpk= 0, iat=1285, -1, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
igr2=1338,1339,
/
#
# 80 GLN HG3 81 ASP QB 4.05
&rst
ixpk= 0, nxpk= 0, iat=1325, -1, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,
igr2=1338,1339,
/
#
# 81 ASP QB 85 LYS QE 4.81
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
igr1=1338,1339,
igr2=1397,1398,
/
#
# 78 GLN HA 81 ASP QB 3.55
&rst
ixpk= 0, nxpk= 0, iat=1282, -1, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,
igr2=1338,1339,
/
#
# 78 GLN HNE1 81 ASP QB 5.50
&rst
ixpk= 0, nxpk= 0, iat=1292, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2=1338,1339,
/
#
# 81 ASP QB 83 PHE H 4.69
&rst
ixpk= 0, nxpk= 0, iat= -1,1357, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr1=1338,1339,
/
#
# 83 PHE HA 86 VAL QG1 4.19
&rst
ixpk= 0, nxpk= 0, iat=1359, -1, r1= 1.30, r2= 1.80, r3= 5.65, r4= 6.15,
igr2=1412,1413,1414,1416,1417,1418,
/
#
# 83 PHE HA 87 ALA QB 4.74
&rst
ixpk= 0, nxpk= 0, iat=1359, -1, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
igr2=1426,1427,1428,
/
#
# 83 PHE HA 86 VAL HB 4.90
&rst
ixpk= 0, nxpk= 0, iat=1359,1410, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40, /
#
# 40 ALA HA 83 PHE HA 4.71
&rst
ixpk= 0, nxpk= 0, iat= 625,1359, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21, /
#
# 83 PHE HA 84 GLY HA3 5.50
&rst
ixpk= 0, nxpk= 0, iat=1359,1380, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 83 PHE HA 87 ALA HA 5.50
&rst
ixpk= 0, nxpk= 0, iat=1359,1424, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 84 GLY HA3 86 VAL H 5.40
&rst
ixpk= 0, nxpk= 0, iat=1380,1406, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90, /
#
# 85 LYS HG3 85 LYS QD 2.58
&rst
ixpk= 0, nxpk= 0, iat=1392, -1, r1= 1.30, r2= 1.80, r3= 2.90, r4= 3.40,
igr2=1394,1395,
/
#
# 104 LYS QB 104 LYS QD 2.64
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.33, r4= 3.83,
igr1=1703,1704,
igr2=1709,1710,
/
#
# 93 ARG HA 96 GLN H 4.73
&rst
ixpk= 0, nxpk= 0, iat=1501,1556, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, /
#
# 85 LYS HB3 86 VAL H 4.40
&rst
ixpk= 0, nxpk= 0, iat=1389,1406, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, /
#
# 85 LYS HA 85 LYS QE 4.29
&rst
ixpk= 0, nxpk= 0, iat=1386, -1, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
igr2=1397,1398,
/
#
# 85 LYS HB2 85 LYS QE 4.67
&rst
ixpk= 0, nxpk= 0, iat=1388, -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr2=1397,1398,
/
#
# 85 LYS HG2 85 LYS QE 3.25
&rst
ixpk= 0, nxpk= 0, iat=1391, -1, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15,
igr2=1397,1398,
/
#
# 85 LYS HA 85 LYS QD 3.26
&rst
ixpk= 0, nxpk= 0, iat=1386, -1, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,
igr2=1394,1395,
/
#
# 85 LYS HB3 85 LYS QD 3.40
&rst
ixpk= 0, nxpk= 0, iat=1389, -1, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,
igr2=1394,1395,
/
#
# 85 LYS HA 86 VAL QG1 5.22
&rst
ixpk= 0, nxpk= 0, iat=1386, -1, r1= 1.30, r2= 1.80, r3= 7.04, r4= 7.54,
igr2=1412,1413,1414,1416,1417,1418,
/
#
# 85 LYS HB2 86 VAL QG1 3.99
&rst
ixpk= 0, nxpk= 0, iat=1388, -1, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
igr2=1412,1413,1414,1416,1417,1418,
/
#
# 85 LYS HB3 86 VAL QG1 4.19
&rst
ixpk= 0, nxpk= 0, iat=1389, -1, r1= 1.30, r2= 1.80, r3= 5.65, r4= 6.15,
igr2=1412,1413,1414,1416,1417,1418,
/
#
# 85 LYS HG3 85 LYS QE 2.90
&rst
ixpk= 0, nxpk= 0, iat=1392, -1, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96,
igr2=1397,1398,
/
#
# 40 ALA QB 86 VAL QG1 3.17
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
igr1= 627, 628, 629,
igr2=1412,1413,1414,1416,1417,1418,
/
#
# 40 ALA QB 86 VAL QG2 3.06
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr1= 627, 628, 629,
igr2=1412,1413,1414,1416,1417,1418,
/
#
# 86 VAL QG2 90 VAL QG1 5.25
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.54, r4=10.04,
igr1=1412,1413,1414,1416,1417,1418,
igr2=1463,1464,1465,1467,1468,1469,
/
#
# 48 LEU QD2 86 VAL HB 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1410, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr1= 773, 774, 775, 777, 778, 779,
/
#
# 86 VAL QG2 87 ALA QB 3.44
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
igr1=1412,1413,1414,1416,1417,1418,
igr2=1426,1427,1428,
/
#
# 86 VAL HA 89 GLU HB2 4.30
&rst
ixpk= 0, nxpk= 0, iat=1408,1446, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80, /
#
# 44 LYS HB3 86 VAL HB 4.50
&rst
ixpk= 0, nxpk= 0, iat= 694,1410, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, /
#
# 44 LYS HB3 86 VAL QG1 3.59
&rst
ixpk= 0, nxpk= 0, iat= 694, -1, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
igr2=1412,1413,1414,1416,1417,1418,
/
#
# 44 LYS HB3 86 VAL QG2 3.95
&rst
ixpk= 0, nxpk= 0, iat= 694, -1, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
igr2=1412,1413,1414,1416,1417,1418,
/
#
# 44 LYS HB2 86 VAL HA 5.15
&rst
ixpk= 0, nxpk= 0, iat= 693,1408, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65, /
#
# 41 GLU QB 86 VAL QG1 4.17
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.31, r4= 6.81,
igr1= 637, 638,
igr2=1412,1413,1414,1416,1417,1418,
/
#
# 86 VAL QG2 90 VAL HB 4.53
&rst
ixpk= 0, nxpk= 0, iat= -1,1461, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
igr1=1412,1413,1414,1416,1417,1418,
/
#
# 44 LYS HB2 86 VAL QG2 3.99
&rst
ixpk= 0, nxpk= 0, iat= 693, -1, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
igr2=1412,1413,1414,1416,1417,1418,
/
#
# 83 PHE HB3 86 VAL QG2 3.89
&rst
ixpk= 0, nxpk= 0, iat=1362, -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr2=1412,1413,1414,1416,1417,1418,
/
#
# 83 PHE HB2 86 VAL QG2 4.53
&rst
ixpk= 0, nxpk= 0, iat=1361, -1, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
igr2=1412,1413,1414,1416,1417,1418,
/
#
# 44 LYS HA 86 VAL QG2 4.66
&rst
ixpk= 0, nxpk= 0, iat= 691, -1, r1= 1.30, r2= 1.80, r3= 6.28, r4= 6.78,
igr2=1412,1413,1414,1416,1417,1418,
/
#
# 40 ALA HA 86 VAL QG2 3.93
&rst
ixpk= 0, nxpk= 0, iat= 625, -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr2=1412,1413,1414,1416,1417,1418,
/
#
# 43 TRP HB3 86 VAL QG2 4.45
&rst
ixpk= 0, nxpk= 0, iat= 670, -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr2=1412,1413,1414,1416,1417,1418,
/
#
# 44 LYS HA 86 VAL QG1 4.88
&rst
ixpk= 0, nxpk= 0, iat= 691, -1, r1= 1.30, r2= 1.80, r3= 6.58, r4= 7.08,
igr2=1412,1413,1414,1416,1417,1418,
/
#
# 40 ALA HA 86 VAL QG1 4.09
&rst
ixpk= 0, nxpk= 0, iat= 625, -1, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
igr2=1412,1413,1414,1416,1417,1418,
/
#
# 44 LYS HA 86 VAL HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= 691,1408, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30, /
#
# 86 VAL HA 87 ALA HA 5.02
&rst
ixpk= 0, nxpk= 0, iat=1408,1424, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52, /
#
# 85 LYS HA 86 VAL HA 4.94
&rst
ixpk= 0, nxpk= 0, iat=1386,1408, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44, /
#
# 41 GLU HA 86 VAL QG1 3.65
&rst
ixpk= 0, nxpk= 0, iat= 635, -1, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
igr2=1412,1413,1414,1416,1417,1418,
/
#
# 86 VAL QG2 87 ALA HA 3.58
&rst
ixpk= 0, nxpk= 0, iat= -1,1424, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
igr1=1412,1413,1414,1416,1417,1418,
/
#
# 83 PHE HA 86 VAL QG2 3.13
&rst
ixpk= 0, nxpk= 0, iat=1359, -1, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
igr2=1412,1413,1414,1416,1417,1418,
/
#
# 86 VAL HA 86 VAL QG1 2.85
&rst
ixpk= 0, nxpk= 0, iat=1408, -1, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
igr2=1412,1413,1414,1416,1417,1418,
/
#
# 86 VAL HA 86 VAL QG2 3.34
&rst
ixpk= 0, nxpk= 0, iat=1408, -1, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
igr2=1412,1413,1414,1416,1417,1418,
/
#
# 85 LYS H 86 VAL HA 5.50
&rst
ixpk= 0, nxpk= 0, iat=1384,1408, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 85 LYS H 86 VAL QG1 4.65
&rst
ixpk= 0, nxpk= 0, iat=1384, -1, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
igr2=1412,1413,1414,1416,1417,1418,
/
#
# 85 LYS H 86 VAL QG2 4.22
&rst
ixpk= 0, nxpk= 0, iat=1384, -1, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
igr2=1412,1413,1414,1416,1417,1418,
/
#
# 86 VAL HA 90 VAL H 4.75
&rst
ixpk= 0, nxpk= 0, iat=1408,1457, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, /
#
# 86 VAL QG2 90 VAL H 4.76
&rst
ixpk= 0, nxpk= 0, iat= -1,1457, r1= 1.30, r2= 1.80, r3= 6.42, r4= 6.92,
igr1=1412,1413,1414,1416,1417,1418,
/
#
# 43 TRP HE3 86 VAL QG2 3.64
&rst
ixpk= 0, nxpk= 0, iat= 684, -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
igr2=1412,1413,1414,1416,1417,1418,
/
#
# 43 TRP HE3 86 VAL QG1 4.52
&rst
ixpk= 0, nxpk= 0, iat= 684, -1, r1= 1.30, r2= 1.80, r3= 6.09, r4= 6.59,
igr2=1412,1413,1414,1416,1417,1418,
/
#
# 40 ALA H 86 VAL QG2 5.08
&rst
ixpk= 0, nxpk= 0, iat= 623, -1, r1= 1.30, r2= 1.80, r3= 6.85, r4= 7.35,
igr2=1412,1413,1414,1416,1417,1418,
/
#
# 44 LYS H 86 VAL QG1 3.89
&rst
ixpk= 0, nxpk= 0, iat= 689, -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr2=1412,1413,1414,1416,1417,1418,
/
#
# 86 VAL HA 89 GLU H 4.43
&rst
ixpk= 0, nxpk= 0, iat=1408,1442, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93, /
#
# 86 VAL HA 88 ALA H 5.14
&rst
ixpk= 0, nxpk= 0, iat=1408,1432, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64, /
#
# 87 ALA HA 89 GLU H 4.79
&rst
ixpk= 0, nxpk= 0, iat=1424,1442, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29, /
#
# 87 ALA QB 89 GLU H 4.58
&rst
ixpk= 0, nxpk= 0, iat= -1,1442, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
igr1=1426,1427,1428,
/
#
# 87 ALA QB 119 PHE HE 3.81
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
igr1=1426,1427,1428,
igr2=1985,1989,
/
#
# 43 TRP HH2 87 ALA QB 4.02
&rst
ixpk= 0, nxpk= 0, iat= 680, -1, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
igr2=1426,1427,1428,
/
#
# 84 GLY HA2 87 ALA QB 3.78
&rst
ixpk= 0, nxpk= 0, iat=1379, -1, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
igr2=1426,1427,1428,
/
#
# 87 ALA QB 88 ALA QB 3.68
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
igr1=1426,1427,1428,
igr2=1436,1437,1438,
/
#
# 87 ALA QB 91 LEU QD2 4.05
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.56, r4= 7.06,
igr1=1426,1427,1428,
igr2=1482,1483,1484,1486,1487,1488,
/
#
# 87 ALA QB 91 LEU QD1 4.05
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.56, r4= 7.06,
igr1=1426,1427,1428,
igr2=1482,1483,1484,1486,1487,1488,
/
#
# 87 ALA QB 127 ILE QD1 2.96
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,
igr1=1426,1427,1428,
igr2=2116,2117,2118,
/
#
# 88 ALA HA 127 ILE HG13 3.98
&rst
ixpk= 0, nxpk= 0, iat=1434,2114, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48, /
#
# 88 ALA QB 127 ILE HG13 3.38
&rst
ixpk= 0, nxpk= 0, iat= -1,2114, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,
igr1=1436,1437,1438,
/
#
# 88 ALA QB 127 ILE QD1 3.47
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,
igr1=1436,1437,1438,
igr2=2116,2117,2118,
/
#
# 88 ALA QB 127 ILE QG2 3.70
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr1=1436,1437,1438,
igr2=2109,2110,2111,
/
#
# 87 ALA QB 88 ALA HA 4.06
&rst
ixpk= 0, nxpk= 0, iat= -1,1434, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
igr1=1426,1427,1428,
/
#
# 88 ALA HA 91 LEU HB2 4.12
&rst
ixpk= 0, nxpk= 0, iat=1434,1477, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62, /
#
# 88 ALA HA 127 ILE HG12 3.98
&rst
ixpk= 0, nxpk= 0, iat=1434,2113, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48, /
#
# 88 ALA QB 127 ILE HG12 3.38
&rst
ixpk= 0, nxpk= 0, iat= -1,2113, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,
igr1=1436,1437,1438,
/
#
# 88 ALA QB 126 ASP HB2 3.32
&rst
ixpk= 0, nxpk= 0, iat= -1,2095, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,
igr1=1436,1437,1438,
/
#
# 88 ALA QB 126 ASP HB3 3.32
&rst
ixpk= 0, nxpk= 0, iat= -1,2096, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,
igr1=1436,1437,1438,
/
#
# 88 ALA HA 127 ILE HA 3.75
&rst
ixpk= 0, nxpk= 0, iat=1434,2105, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25, /
#
# 88 ALA QB 127 ILE HA 3.06
&rst
ixpk= 0, nxpk= 0, iat= -1,2105, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,
igr1=1436,1437,1438,
/
#
# 88 ALA QB 89 GLU HA 3.82
&rst
ixpk= 0, nxpk= 0, iat= -1,1444, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
igr1=1436,1437,1438,
/
#
# 88 ALA QB 126 ASP HA 4.26
&rst
ixpk= 0, nxpk= 0, iat= -1,2093, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
igr1=1436,1437,1438,
/
#
# 86 VAL HA 88 ALA QB 5.01
&rst
ixpk= 0, nxpk= 0, iat=1408, -1, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,
igr2=1436,1437,1438,
/
#
# 86 VAL H 88 ALA QB 5.50
&rst
ixpk= 0, nxpk= 0, iat=1406, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2=1436,1437,1438,
/
#
# 87 ALA H 88 ALA QB 4.63
&rst
ixpk= 0, nxpk= 0, iat=1422, -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
igr2=1436,1437,1438,
/
#
# 88 ALA QB 90 VAL H 5.20
&rst
ixpk= 0, nxpk= 0, iat= -1,1457, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
igr1=1436,1437,1438,
/
#
# 88 ALA QB 130 SER H 4.44
&rst
ixpk= 0, nxpk= 0, iat= -1,2161, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
igr1=1436,1437,1438,
/
#
# 88 ALA QB 126 ASP H 4.82
&rst
ixpk= 0, nxpk= 0, iat= -1,2091, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,
igr1=1436,1437,1438,
/
#
# 88 ALA HA 91 LEU H 4.82
&rst
ixpk= 0, nxpk= 0, iat=1434,1473, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32, /
#
# 41 GLU QB 41 GLU HG2 2.57
&rst
ixpk= 0, nxpk= 0, iat= -1, 640, r1= 1.30, r2= 1.80, r3= 2.88, r4= 3.38,
igr1= 637, 638,
/
#
# 41 GLU QB 41 GLU HG3 2.57
&rst
ixpk= 0, nxpk= 0, iat= -1, 641, r1= 1.30, r2= 1.80, r3= 2.88, r4= 3.38,
igr1= 637, 638,
/
#
# 48 LEU H 90 VAL QG1 4.62
&rst
ixpk= 0, nxpk= 0, iat= 764, -1, r1= 1.30, r2= 1.80, r3= 6.23, r4= 6.73,
igr2=1463,1464,1465,1467,1468,1469,
/
#
# 43 TRP HH2 90 VAL QG1 3.79
&rst
ixpk= 0, nxpk= 0, iat= 680, -1, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,
igr2=1463,1464,1465,1467,1468,1469,
/
#
# 87 ALA HA 90 VAL QG2 3.98
&rst
ixpk= 0, nxpk= 0, iat=1424, -1, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr2=1463,1464,1465,1467,1468,1469,
/
#
# 90 VAL QG1 91 LEU HA 3.71
&rst
ixpk= 0, nxpk= 0, iat= -1,1475, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,
igr1=1463,1464,1465,1467,1468,1469,
/
#
# 47 MET HA 90 VAL QG2 4.90
&rst
ixpk= 0, nxpk= 0, iat= 749, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2=1463,1464,1465,1467,1468,1469,
/
#
# 44 LYS HA 90 VAL QG2 3.09
&rst
ixpk= 0, nxpk= 0, iat= 691, -1, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,
igr2=1463,1464,1465,1467,1468,1469,
/
#
# 44 LYS HB2 90 VAL HA 5.33
&rst
ixpk= 0, nxpk= 0, iat= 693,1459, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83, /
#
# 44 LYS HB2 90 VAL QG2 3.55
&rst
ixpk= 0, nxpk= 0, iat= 693, -1, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
igr2=1463,1464,1465,1467,1468,1469,
/
#
# 47 MET HB3 90 VAL QG2 3.87
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
igr1= 751, 752,
igr2=1463,1464,1465,1467,1468,1469,
/
#
# 47 MET HB3 90 VAL QG1 3.06
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13,
igr1= 751, 752,
igr2=1463,1464,1465,1467,1468,1469,
/
#
# 44 LYS HB3 90 VAL QG2 3.98
&rst
ixpk= 0, nxpk= 0, iat= 694, -1, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr2=1463,1464,1465,1467,1468,1469,
/
#
# 48 LEU HG 90 VAL QG2 4.38
&rst
ixpk= 0, nxpk= 0, iat= 771, -1, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
igr2=1463,1464,1465,1467,1468,1469,
/
#
# 90 VAL HA 93 ARG QB 4.26
&rst
ixpk= 0, nxpk= 0, iat=1459, -1, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
igr2=1503,1504,
/
#
# 90 VAL HA 93 ARG QG 4.44
&rst
ixpk= 0, nxpk= 0, iat=1459, -1, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
igr2=1506,1507,
/
#
# 47 MET HG3 90 VAL QG1 3.57
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr1= 754, 755,
igr2=1463,1464,1465,1467,1468,1469,
/
#
# 47 MET HG3 90 VAL HA 4.74
&rst
ixpk= 0, nxpk= 0, iat= -1,1459, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
igr1= 754, 755,
/
#
# 90 VAL HB 91 LEU HB3 5.50
&rst
ixpk= 0, nxpk= 0, iat=1461,1478, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 47 MET HG2 90 VAL QG1 3.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr1= 754, 755,
igr2=1463,1464,1465,1467,1468,1469,
/
#
# 90 VAL QG1 94 ILE HB 4.98
&rst
ixpk= 0, nxpk= 0, iat= -1,1527, r1= 1.30, r2= 1.80, r3= 6.71, r4= 7.21,
igr1=1463,1464,1465,1467,1468,1469,
/
#
# 90 VAL HA 90 VAL QG2 3.68
&rst
ixpk= 0, nxpk= 0, iat=1459, -1, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
igr2=1463,1464,1465,1467,1468,1469,
/
#
# 90 VAL HB 94 ILE QG2 4.68
&rst
ixpk= 0, nxpk= 0, iat=1461, -1, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
igr2=1529,1530,1531,
/
#
# 90 VAL QG1 94 ILE QG2 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
igr1=1463,1464,1465,1467,1468,1469,
igr2=1529,1530,1531,
/
#
# 47 MET HB2 90 VAL QG2 3.28
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
igr1= 751, 752,
igr2=1463,1464,1465,1467,1468,1469,
/
#
# 90 VAL QG2 94 ILE QD1 4.78
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.74, r4= 8.24,
igr1=1463,1464,1465,1467,1468,1469,
igr2=1536,1537,1538,
/
#
# 91 LEU HA 94 ILE QG2 4.05
&rst
ixpk= 0, nxpk= 0, iat=1475, -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
igr2=1529,1530,1531,
/
#
# 90 VAL QG1 91 LEU HG 4.87
&rst
ixpk= 0, nxpk= 0, iat= -1,1480, r1= 1.30, r2= 1.80, r3= 6.56, r4= 7.06,
igr1=1463,1464,1465,1467,1468,1469,
/
#
# 91 LEU HB2 127 ILE QG2 4.39
&rst
ixpk= 0, nxpk= 0, iat=1477, -1, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77,
igr2=2109,2110,2111,
/
#
# 91 LEU HB3 91 LEU QD1 3.20
&rst
ixpk= 0, nxpk= 0, iat=1478, -1, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,
igr2=1482,1483,1484,1486,1487,1488,
/
#
# 91 LEU HB3 91 LEU QD2 3.20
&rst
ixpk= 0, nxpk= 0, iat=1478, -1, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,
igr2=1482,1483,1484,1486,1487,1488,
/
#
# 91 LEU HA 94 ILE HG12 4.02
&rst
ixpk= 0, nxpk= 0, iat=1475,1533, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52, /
#
# 61 LEU QD2 91 LEU HA 4.94
&rst
ixpk= 0, nxpk= 0, iat= -1,1475, r1= 1.30, r2= 1.80, r3= 6.66, r4= 7.16,
igr1=1000,1001,1002,1004,1005,1006,
/
#
# 61 LEU QD1 91 LEU HA 4.94
&rst
ixpk= 0, nxpk= 0, iat= -1,1475, r1= 1.30, r2= 1.80, r3= 6.66, r4= 7.16,
igr1=1000,1001,1002,1004,1005,1006,
/
#
# 87 ALA HA 91 LEU QD1 3.80
&rst
ixpk= 0, nxpk= 0, iat=1424, -1, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
igr2=1482,1483,1484,1486,1487,1488,
/
#
# 87 ALA HA 91 LEU QD2 3.80
&rst
ixpk= 0, nxpk= 0, iat=1424, -1, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
igr2=1482,1483,1484,1486,1487,1488,
/
#
# 43 TRP HH2 91 LEU QD2 4.23
&rst
ixpk= 0, nxpk= 0, iat= 680, -1, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr2=1482,1483,1484,1486,1487,1488,
/
#
# 43 TRP HH2 91 LEU QD1 4.23
&rst
ixpk= 0, nxpk= 0, iat= 680, -1, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr2=1482,1483,1484,1486,1487,1488,
/
#
# 91 LEU HA 94 ILE H 4.67
&rst
ixpk= 0, nxpk= 0, iat=1475,1523, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, /
#
# 91 LEU HA 95 ASN H 4.98
&rst
ixpk= 0, nxpk= 0, iat=1475,1542, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48, /
#
# 91 LEU HA 93 ARG H 5.23
&rst
ixpk= 0, nxpk= 0, iat=1475,1499, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73, /
#
# 92 GLY HA3 95 ASN H 5.27
&rst
ixpk= 0, nxpk= 0, iat=1495,1542, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77, /
#
# 92 GLY HA2 131 LEU HA 4.65
&rst
ixpk= 0, nxpk= 0, iat=1494,2174, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15, /
#
# 92 GLY HA3 93 ARG HA 4.95
&rst
ixpk= 0, nxpk= 0, iat=1495,1501, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45, /
#
# 91 LEU HB2 92 GLY HA2 5.03
&rst
ixpk= 0, nxpk= 0, iat=1477,1494, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53, /
#
# 92 GLY HA3 127 ILE QG2 5.50
&rst
ixpk= 0, nxpk= 0, iat=1495, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2=2109,2110,2111,
/
#
# 54 THR QG2 94 ILE HB 5.12
&rst
ixpk= 0, nxpk= 0, iat= -1,1527, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
igr1= 868, 869, 870,
/
#
# 93 ARG HA 96 GLN HB2 4.25
&rst
ixpk= 0, nxpk= 0, iat=1501,1560, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75, /
#
# 93 ARG HA 96 GLN HG2 4.28
&rst
ixpk= 0, nxpk= 0, iat=1501,1563, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78, /
#
# 93 ARG HA 93 ARG HD2 3.63
&rst
ixpk= 0, nxpk= 0, iat=1501,1509, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13, /
#
# 93 ARG HA 93 ARG QG 3.68
&rst
ixpk= 0, nxpk= 0, iat=1501, -1, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
igr2=1506,1507,
/
#
# 93 ARG HA 96 GLN HNE1 4.40
&rst
ixpk= 0, nxpk= 0, iat=1501,1568, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, /
#
# 84 GLY H 85 LYS HA 5.50
&rst
ixpk= 0, nxpk= 0, iat=1377,1386, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 92 GLY H 93 ARG HA 5.50
&rst
ixpk= 0, nxpk= 0, iat=1492,1501, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 94 ILE QD1 106 LEU H 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1743, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1=1536,1537,1538,
/
#
# 94 ILE QD1 95 ASN H 4.18
&rst
ixpk= 0, nxpk= 0, iat= -1,1542, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
igr1=1536,1537,1538,
/
#
# 94 ILE HA 98 PHE HD 5.22
&rst
ixpk= 0, nxpk= 0, iat=1525, -1, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
igr2=1596,1604,
/
#
# 94 ILE QD1 98 PHE HD 4.01
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,
igr1=1536,1537,1538,
igr2=1596,1604,
/
#
# 94 ILE QD1 98 PHE HE 4.04
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,
igr1=1536,1537,1538,
igr2=1598,1602,
/
#
# 61 LEU HA 94 ILE QD1 4.38
&rst
ixpk= 0, nxpk= 0, iat= 993, -1, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr2=1536,1537,1538,
/
#
# 48 LEU HA 94 ILE QG2 4.69
&rst
ixpk= 0, nxpk= 0, iat= 766, -1, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr2=1529,1530,1531,
/
#
# 57 LYS HA 94 ILE QD1 4.67
&rst
ixpk= 0, nxpk= 0, iat= 926, -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr2=1536,1537,1538,
/
#
# 94 ILE QD1 95 ASN HA 5.08
&rst
ixpk= 0, nxpk= 0, iat= -1,1544, r1= 1.30, r2= 1.80, r3= 6.10, r4= 6.60,
igr1=1536,1537,1538,
/
#
# 94 ILE QD1 106 LEU HA 5.49
&rst
ixpk= 0, nxpk= 0, iat= -1,1745, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
igr1=1536,1537,1538,
/
#
# 90 VAL HA 94 ILE QG2 4.12
&rst
ixpk= 0, nxpk= 0, iat=1459, -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr2=1529,1530,1531,
/
#
# 94 ILE QD1 98 PHE HB3 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1593, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1=1536,1537,1538,
/
#
# 57 LYS HE3 94 ILE QG2 4.65
&rst
ixpk= 0, nxpk= 0, iat= 938, -1, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr2=1529,1530,1531,
/
#
# 57 LYS HE2 94 ILE QG2 4.65
&rst
ixpk= 0, nxpk= 0, iat= 937, -1, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr2=1529,1530,1531,
/
#
# 94 ILE QG2 95 ASN QB 5.31
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.16, r4= 7.66,
igr1=1529,1530,1531,
igr2=1546,1547,
/
#
# 57 LYS HB3 94 ILE QD1 3.95
&rst
ixpk= 0, nxpk= 0, iat= 929, -1, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr2=1536,1537,1538,
/
#
# 47 MET HB3 94 ILE QG2 2.96
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,
igr1= 751, 752,
igr2=1529,1530,1531,
/
#
# 94 ILE HA 97 GLU HB2 4.67
&rst
ixpk= 0, nxpk= 0, iat=1525,1577, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, /
#
# 94 ILE QD1 106 LEU HB2 3.66
&rst
ixpk= 0, nxpk= 0, iat= -1,1747, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,
igr1=1536,1537,1538,
/
#
# 47 MET HG3 94 ILE QG2 4.04
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,
igr1= 754, 755,
igr2=1529,1530,1531,
/
#
# 91 LEU HB3 94 ILE QD1 4.41
&rst
ixpk= 0, nxpk= 0, iat=1478, -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr2=1536,1537,1538,
/
#
# 94 ILE HB 94 ILE QD1 2.87
&rst
ixpk= 0, nxpk= 0, iat=1527, -1, r1= 1.30, r2= 1.80, r3= 3.45, r4= 3.95,
igr2=1536,1537,1538,
/
#
# 94 ILE QD1 106 LEU QD1 4.01
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
igr1=1536,1537,1538,
igr2=1752,1753,1754,1756,1757,1758,
/
#
# 94 ILE HA 94 ILE QD1 4.28
&rst
ixpk= 0, nxpk= 0, iat=1525, -1, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
igr2=1536,1537,1538,
/
#
# 90 VAL QG1 94 ILE HA 5.23
&rst
ixpk= 0, nxpk= 0, iat= -1,1525, r1= 1.30, r2= 1.80, r3= 7.05, r4= 7.55,
igr1=1463,1464,1465,1467,1468,1469,
/
#
# 94 ILE QG2 94 ILE QD1 2.65
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,
igr1=1529,1530,1531,
igr2=1536,1537,1538,
/
#
# 90 VAL QG1 94 ILE QD1 2.94
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
igr1=1463,1464,1465,1467,1468,1469,
igr2=1536,1537,1538,
/
#
# 95 ASN QB 96 GLN HB2 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1560, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1=1546,1547,
/
#
# 95 ASN QB 131 LEU HG 5.23
&rst
ixpk= 0, nxpk= 0, iat= -1,2179, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,
igr1=1546,1547,
/
#
# 95 ASN H 96 GLN HG3 4.26
&rst
ixpk= 0, nxpk= 0, iat=1542,1564, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76, /
#
# 95 ASN H 96 GLN HG2 4.51
&rst
ixpk= 0, nxpk= 0, iat=1542,1563, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01, /
#
# 96 GLN HG2 97 GLU H 4.48
&rst
ixpk= 0, nxpk= 0, iat=1563,1573, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98, /
#
# 96 GLN HA 96 GLN HG2 3.45
&rst
ixpk= 0, nxpk= 0, iat=1558,1563, r1= 1.30, r2= 1.80, r3= 3.45, r4= 3.95, /
#
# 92 GLY HA2 96 GLN HG2 5.29
&rst
ixpk= 0, nxpk= 0, iat=1494,1563, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79, /
#
# 96 GLN HA 96 GLN HG3 3.88
&rst
ixpk= 0, nxpk= 0, iat=1558,1564, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38, /
#
# 93 ARG QB 96 GLN HG2 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1563, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1=1503,1504,
/
#
# 96 GLN HG2 134 ALA QB 3.79
&rst
ixpk= 0, nxpk= 0, iat=1563, -1, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,
igr2=2215,2216,2217,
/
#
# 54 THR QG2 97 GLU HA 4.43
&rst
ixpk= 0, nxpk= 0, iat= -1,1575, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
igr1= 868, 869, 870,
/
#
# 97 GLU HA 97 GLU HG3 3.86
&rst
ixpk= 0, nxpk= 0, iat=1575,1581, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, /
#
# 97 GLU HA 97 GLU HG2 3.86
&rst
ixpk= 0, nxpk= 0, iat=1575,1580, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, /
#
# 96 GLN HA 97 GLU HA 4.82
&rst
ixpk= 0, nxpk= 0, iat=1558,1575, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32, /
#
# 94 ILE HA 97 GLU HB3 4.67
&rst
ixpk= 0, nxpk= 0, iat=1525,1578, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, /
#
# 96 GLN H 97 GLU HA 5.50
&rst
ixpk= 0, nxpk= 0, iat=1556,1575, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 97 GLU HA 98 PHE HD 5.50
&rst
ixpk= 0, nxpk= 0, iat=1575, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2=1596,1604,
/
#
# 97 GLU H 97 GLU HB3 4.00
&rst
ixpk= 0, nxpk= 0, iat=1573,1578, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, /
#
# 98 PHE HA 98 PHE HD 3.99
&rst
ixpk= 0, nxpk= 0, iat=1590, -1, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
igr2=1596,1604,
/
#
# 98 PHE HA 99 PRO HD3 3.76
&rst
ixpk= 0, nxpk= 0, iat=1590,1610, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26, /
#
# 98 PHE HB3 102 LEU HA 5.50
&rst
ixpk= 0, nxpk= 0, iat=1593,1660, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 95 ASN HA 98 PHE HB2 5.14
&rst
ixpk= 0, nxpk= 0, iat=1544,1592, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64, /
#
# 98 PHE HA 99 PRO HD2 3.76
&rst
ixpk= 0, nxpk= 0, iat=1590,1609, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26, /
#
# 98 PHE HB3 103 LYS QG 5.01
&rst
ixpk= 0, nxpk= 0, iat=1593, -1, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
igr2=1684,1685,
/
#
# 98 PHE HB2 103 LYS QG 5.14
&rst
ixpk= 0, nxpk= 0, iat=1592, -1, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,
igr2=1684,1685,
/
#
# 98 PHE HA 102 LEU HB2 4.42
&rst
ixpk= 0, nxpk= 0, iat=1590,1662, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92, /
#
# 98 PHE HA 102 LEU HB3 4.55
&rst
ixpk= 0, nxpk= 0, iat=1590,1663, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05, /
#
# 99 PRO HB2 102 LEU QD1 5.50
&rst
ixpk= 0, nxpk= 0, iat=1615, -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr2=1667,1668,1669,1671,1672,1673,
/
#
# 99 PRO HB3 102 LEU QD1 5.50
&rst
ixpk= 0, nxpk= 0, iat=1616, -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr2=1667,1668,1669,1671,1672,1673,
/
#
# 99 PRO HB3 102 LEU QD2 5.50
&rst
ixpk= 0, nxpk= 0, iat=1616, -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr2=1667,1668,1669,1671,1672,1673,
/
#
# 99 PRO HG2 102 LEU HG 4.77
&rst
ixpk= 0, nxpk= 0, iat=1612,1665, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27, /
#
# 99 PRO HD3 102 LEU QD2 5.29
&rst
ixpk= 0, nxpk= 0, iat=1610, -1, r1= 1.30, r2= 1.80, r3= 7.13, r4= 7.63,
igr2=1667,1668,1669,1671,1672,1673,
/
#
# 99 PRO HG3 102 LEU HG 4.69
&rst
ixpk= 0, nxpk= 0, iat=1613,1665, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, /
#
# 99 PRO HB2 102 LEU HG 5.50
&rst
ixpk= 0, nxpk= 0, iat=1615,1665, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 99 PRO HA 100 ARG HA 4.34
&rst
ixpk= 0, nxpk= 0, iat=1618,1624, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84, /
#
# 99 PRO HA 100 ARG HB3 4.83
&rst
ixpk= 0, nxpk= 0, iat=1618,1627, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33, /
#
# 99 PRO HA 100 ARG QD 3.90
&rst
ixpk= 0, nxpk= 0, iat=1618, -1, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
igr2=1632,1633,
/
#
# 100 ARG HA 101 ASP HA 4.99
&rst
ixpk= 0, nxpk= 0, iat=1624,1648, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49, /
#
# 126 ASP HA 129 ARG HB3 4.53
&rst
ixpk= 0, nxpk= 0, iat=2093,2142, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03, /
#
# 100 ARG QD 101 ASP HA 4.52
&rst
ixpk= 0, nxpk= 0, iat= -1,1648, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
igr1=1632,1633,
/
#
# 126 ASP HA 129 ARG QD 4.12
&rst
ixpk= 0, nxpk= 0, iat=2093, -1, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
igr2=2147,2148,
/
#
# 100 ARG HA 100 ARG QD 3.90
&rst
ixpk= 0, nxpk= 0, iat=1624, -1, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
igr2=1632,1633,
/
#
# 129 ARG HB3 129 ARG QD 3.50
&rst
ixpk= 0, nxpk= 0, iat=2142, -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
igr2=2147,2148,
/
#
# 128 GLU HA 128 GLU HG3 3.91
&rst
ixpk= 0, nxpk= 0, iat=2124,2130, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41, /
#
# 99 PRO HB2 100 ARG HA 4.99
&rst
ixpk= 0, nxpk= 0, iat=1615,1624, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49, /
#
# 99 PRO HB2 100 ARG HB3 4.75
&rst
ixpk= 0, nxpk= 0, iat=1615,1627, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, /
#
# 100 ARG HB2 100 ARG QD 3.68
&rst
ixpk= 0, nxpk= 0, iat=1626, -1, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
igr2=1632,1633,
/
#
# 100 ARG HB3 100 ARG QD 2.94
&rst
ixpk= 0, nxpk= 0, iat=1627, -1, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80,
igr2=1632,1633,
/
#
# 100 ARG HG2 100 ARG QD 2.70
&rst
ixpk= 0, nxpk= 0, iat=1629, -1, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53,
igr2=1632,1633,
/
#
# 128 GLU HA 131 LEU HB2 3.99
&rst
ixpk= 0, nxpk= 0, iat=2124,2176, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49, /
#
# 128 GLU HA 131 LEU HB3 5.31
&rst
ixpk= 0, nxpk= 0, iat=2124,2177, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81, /
#
# 128 GLU HA 131 LEU QD1 4.69
&rst
ixpk= 0, nxpk= 0, iat=2124, -1, r1= 1.30, r2= 1.80, r3= 6.32, r4= 6.82,
igr2=2181,2182,2183,2185,2186,2187,
/
#
# 101 ASP HB2 102 LEU QD1 5.25
&rst
ixpk= 0, nxpk= 0, iat=1650, -1, r1= 1.30, r2= 1.80, r3= 7.08, r4= 7.58,
igr2=1667,1668,1669,1671,1672,1673,
/
#
# 101 ASP HB3 102 LEU HG 5.05
&rst
ixpk= 0, nxpk= 0, iat=1651,1665, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55, /
#
# 101 ASP HB2 102 LEU HG 5.16
&rst
ixpk= 0, nxpk= 0, iat=1650,1665, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66, /
#
# 101 ASP HA 104 LYS QD 3.58
&rst
ixpk= 0, nxpk= 0, iat=1648, -1, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,
igr2=1709,1710,
/
#
# 101 ASP HB2 104 LYS QD 5.50
&rst
ixpk= 0, nxpk= 0, iat=1650, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2=1709,1710,
/
#
# 101 ASP HB3 104 LYS QD 5.26
&rst
ixpk= 0, nxpk= 0, iat=1651, -1, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
igr2=1709,1710,
/
#
# 126 ASP HA 129 ARG HB2 3.64
&rst
ixpk= 0, nxpk= 0, iat=2093,2141, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14, /
#
# 101 ASP HB2 104 LYS QB 5.50
&rst
ixpk= 0, nxpk= 0, iat=1650, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2=1703,1704,
/
#
# 101 ASP HB3 104 LYS QB 5.14
&rst
ixpk= 0, nxpk= 0, iat=1651, -1, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,
igr2=1703,1704,
/
#
# 101 ASP HB3 105 LYS QE 4.42
&rst
ixpk= 0, nxpk= 0, iat=1651, -1, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
igr2=1734,1735,
/
#
# 102 LEU HA 102 LEU QD1 3.82
&rst
ixpk= 0, nxpk= 0, iat=1660, -1, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
igr2=1667,1668,1669,1671,1672,1673,
/
#
# 58 LEU QD1 102 LEU QD1 4.05
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.36, r4= 7.86,
igr1= 955, 956, 957, 959, 960, 961,
igr2=1667,1668,1669,1671,1672,1673,
/
#
# 58 LEU QD1 102 LEU QD2 4.05
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.36, r4= 7.86,
igr1= 955, 956, 957, 959, 960, 961,
igr2=1667,1668,1669,1671,1672,1673,
/
#
# 102 LEU HB3 102 LEU QD1 3.85
&rst
ixpk= 0, nxpk= 0, iat=1663, -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
igr2=1667,1668,1669,1671,1672,1673,
/
#
# 102 LEU HB3 102 LEU QD2 3.85
&rst
ixpk= 0, nxpk= 0, iat=1663, -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
igr2=1667,1668,1669,1671,1672,1673,
/
#
# 99 PRO HG2 102 LEU QD1 4.28
&rst
ixpk= 0, nxpk= 0, iat=1612, -1, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,
igr2=1667,1668,1669,1671,1672,1673,
/
#
# 99 PRO HG2 102 LEU QD2 4.28
&rst
ixpk= 0, nxpk= 0, iat=1612, -1, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,
igr2=1667,1668,1669,1671,1672,1673,
/
#
# 99 PRO HG3 102 LEU QD1 4.11
&rst
ixpk= 0, nxpk= 0, iat=1613, -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
igr2=1667,1668,1669,1671,1672,1673,
/
#
# 99 PRO HG3 102 LEU QD2 4.11
&rst
ixpk= 0, nxpk= 0, iat=1613, -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
igr2=1667,1668,1669,1671,1672,1673,
/
#
# 99 PRO HB2 102 LEU QD2 5.50
&rst
ixpk= 0, nxpk= 0, iat=1615, -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr2=1667,1668,1669,1671,1672,1673,
/
#
# 101 ASP HB2 102 LEU QD2 5.25
&rst
ixpk= 0, nxpk= 0, iat=1650, -1, r1= 1.30, r2= 1.80, r3= 7.08, r4= 7.58,
igr2=1667,1668,1669,1671,1672,1673,
/
#
# 99 PRO HD2 102 LEU QD1 5.29
&rst
ixpk= 0, nxpk= 0, iat=1609, -1, r1= 1.30, r2= 1.80, r3= 7.13, r4= 7.63,
igr2=1667,1668,1669,1671,1672,1673,
/
#
# 99 PRO HD2 102 LEU QD2 5.29
&rst
ixpk= 0, nxpk= 0, iat=1609, -1, r1= 1.30, r2= 1.80, r3= 7.13, r4= 7.63,
igr2=1667,1668,1669,1671,1672,1673,
/
#
# 99 PRO HD3 102 LEU QD1 5.29
&rst
ixpk= 0, nxpk= 0, iat=1610, -1, r1= 1.30, r2= 1.80, r3= 7.13, r4= 7.63,
igr2=1667,1668,1669,1671,1672,1673,
/
#
# 102 LEU HA 102 LEU QD2 3.82
&rst
ixpk= 0, nxpk= 0, iat=1660, -1, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
igr2=1667,1668,1669,1671,1672,1673,
/
#
# 102 LEU H 102 LEU QD1 4.11
&rst
ixpk= 0, nxpk= 0, iat=1658, -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
igr2=1667,1668,1669,1671,1672,1673,
/
#
# 102 LEU QD1 103 LYS H 4.79
&rst
ixpk= 0, nxpk= 0, iat= -1,1677, r1= 1.30, r2= 1.80, r3= 6.46, r4= 6.96,
igr1=1667,1668,1669,1671,1672,1673,
/
#
# 95 ASN HND2 103 LYS QE 4.43
&rst
ixpk= 0, nxpk= 0, iat=1552, -1, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
igr2=1690,1691,
/
#
# 103 LYS HA 105 LYS H 4.87
&rst
ixpk= 0, nxpk= 0, iat=1679,1721, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37, /
#
# 103 LYS HA 106 LEU QD1 4.47
&rst
ixpk= 0, nxpk= 0, iat=1679, -1, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
igr2=1752,1753,1754,1756,1757,1758,
/
#
# 103 LYS HA 106 LEU QD2 4.47
&rst
ixpk= 0, nxpk= 0, iat=1679, -1, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
igr2=1752,1753,1754,1756,1757,1758,
/
#
# 27 LYS HG2 27 LYS QE 3.35
&rst
ixpk= 0, nxpk= 0, iat= 391, -1, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,
igr2= 397, 398,
/
#
# 121 LYS HG3 121 LYS QE 3.48
&rst
ixpk= 0, nxpk= 0, iat=2014, -1, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41,
igr2=2019,2020,
/
#
# 104 LYS HA 104 LYS HG2 3.70
&rst
ixpk= 0, nxpk= 0, iat=1701,1706, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20, /
#
# 108 ARG HA 108 ARG QG 3.22
&rst
ixpk= 0, nxpk= 0, iat=1775, -1, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11,
igr2=1780,1781,
/
#
# 75 LYS QD 75 LYS QE 2.57
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,
igr1=1230,1231,
igr2=1233,1234,
/
#
# 121 LYS QD 121 LYS QE 2.77
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.49, r4= 3.99,
igr1=2016,2017,
igr2=2019,2020,
/
#
# 104 LYS HA 104 LYS QB 2.94
&rst
ixpk= 0, nxpk= 0, iat=1701, -1, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80,
igr2=1703,1704,
/
#
# 104 LYS QB 104 LYS QE 3.66
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
igr1=1703,1704,
igr2=1712,1713,
/
#
# 104 LYS HG3 104 LYS QE 3.34
&rst
ixpk= 0, nxpk= 0, iat=1707, -1, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,
igr2=1712,1713,
/
#
# 104 LYS HA 104 LYS HG3 3.70
&rst
ixpk= 0, nxpk= 0, iat=1701,1707, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20, /
#
# 101 ASP HA 104 LYS QB 3.84
&rst
ixpk= 0, nxpk= 0, iat=1648, -1, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,
igr2=1703,1704,
/
#
# 108 ARG HA 111 ASN HND1 4.30
&rst
ixpk= 0, nxpk= 0, iat=1775,1838, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80, /
#
# 104 LYS HA 107 SER H 4.14
&rst
ixpk= 0, nxpk= 0, iat=1701,1762, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64, /
#
# 106 LEU HA 106 LEU QD2 3.99
&rst
ixpk= 0, nxpk= 0, iat=1745, -1, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
igr2=1752,1753,1754,1756,1757,1758,
/
#
# 121 LYS HA 124 VAL QG1 4.13
&rst
ixpk= 0, nxpk= 0, iat=2008, -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
igr2=2067,2068,2069,2071,2072,2073,
/
#
# 121 LYS HA 124 VAL HB 3.19
&rst
ixpk= 0, nxpk= 0, iat=2008,2065, r1= 1.30, r2= 1.80, r3= 3.19, r4= 3.69, /
#
# 121 LYS HA 121 LYS QE 4.37
&rst
ixpk= 0, nxpk= 0, iat=2008, -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
igr2=2019,2020,
/
#
# 57 LYS HG2 94 ILE QG2 4.23
&rst
ixpk= 0, nxpk= 0, iat= 931, -1, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
igr2=1529,1530,1531,
/
#
# 91 LEU HB3 106 LEU HG 4.78
&rst
ixpk= 0, nxpk= 0, iat=1478,1750, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, /
#
# 91 LEU HB3 106 LEU QD1 3.63
&rst
ixpk= 0, nxpk= 0, iat=1478, -1, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
igr2=1752,1753,1754,1756,1757,1758,
/
#
# 91 LEU HB3 106 LEU QD2 3.63
&rst
ixpk= 0, nxpk= 0, iat=1478, -1, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
igr2=1752,1753,1754,1756,1757,1758,
/
#
# 106 LEU HB2 106 LEU QD1 3.86
&rst
ixpk= 0, nxpk= 0, iat=1747, -1, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
igr2=1752,1753,1754,1756,1757,1758,
/
#
# 106 LEU HB3 106 LEU QD1 3.59
&rst
ixpk= 0, nxpk= 0, iat=1748, -1, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
igr2=1752,1753,1754,1756,1757,1758,
/
#
# 95 ASN QB 106 LEU QD1 4.06
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.14, r4= 6.64,
igr1=1546,1547,
igr2=1752,1753,1754,1756,1757,1758,
/
#
# 106 LEU HG 107 SER HA 4.11
&rst
ixpk= 0, nxpk= 0, iat=1750,1764, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, /
#
# 106 LEU HA 106 LEU QD1 3.99
&rst
ixpk= 0, nxpk= 0, iat=1745, -1, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
igr2=1752,1753,1754,1756,1757,1758,
/
#
# 91 LEU HA 106 LEU QD1 4.36
&rst
ixpk= 0, nxpk= 0, iat=1475, -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
igr2=1752,1753,1754,1756,1757,1758,
/
#
# 91 LEU HA 106 LEU QD2 4.36
&rst
ixpk= 0, nxpk= 0, iat=1475, -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
igr2=1752,1753,1754,1756,1757,1758,
/
#
# 57 LYS HG2 98 PHE HE 4.31
&rst
ixpk= 0, nxpk= 0, iat= 931, -1, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
igr2=1598,1602,
/
#
# 98 PHE HD 106 LEU HG 5.18
&rst
ixpk= 0, nxpk= 0, iat= -1,1750, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51,
igr1=1596,1604,
/
#
# 106 LEU H 106 LEU HG 4.94
&rst
ixpk= 0, nxpk= 0, iat=1743,1750, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44, /
#
# 107 SER HA 110 VAL H 3.91
&rst
ixpk= 0, nxpk= 0, iat=1764,1813, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41, /
#
# 106 LEU H 107 SER QB 4.72
&rst
ixpk= 0, nxpk= 0, iat=1743, -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr2=1766,1767,
/
#
# 107 SER HA 107 SER QB 2.50
&rst
ixpk= 0, nxpk= 0, iat=1764, -1, r1= 1.30, r2= 1.80, r3= 2.81, r4= 3.31,
igr2=1766,1767,
/
#
# 107 SER HA 110 VAL QG1 3.64
&rst
ixpk= 0, nxpk= 0, iat=1764, -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
igr2=1819,1820,1821,1823,1824,1825,
/
#
# 108 ARG HA 112 ILE QD1 4.63
&rst
ixpk= 0, nxpk= 0, iat=1775, -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
igr2=1856,1857,1858,
/
#
# 108 ARG HA 111 ASN HND2 5.43
&rst
ixpk= 0, nxpk= 0, iat=1775,1839, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93, /
#
# 108 ARG H 108 ARG HD2 4.69
&rst
ixpk= 0, nxpk= 0, iat=1773,1783, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, /
#
# 109 VAL QG2 110 VAL H 3.76
&rst
ixpk= 0, nxpk= 0, iat= -1,1813, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
igr1=1803,1804,1805,1807,1808,1809,
/
#
# 109 VAL H 109 VAL QG1 3.86
&rst
ixpk= 0, nxpk= 0, iat=1797, -1, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
igr2=1803,1804,1805,1807,1808,1809,
/
#
# 109 VAL HA 109 VAL QG1 3.45
&rst
ixpk= 0, nxpk= 0, iat=1799, -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
igr2=1803,1804,1805,1807,1808,1809,
/
#
# 109 VAL HA 109 VAL QG2 3.45
&rst
ixpk= 0, nxpk= 0, iat=1799, -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
igr2=1803,1804,1805,1807,1808,1809,
/
#
# 109 VAL HB 110 VAL HB 5.50
&rst
ixpk= 0, nxpk= 0, iat=1801,1817, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 61 LEU HG 109 VAL QG2 4.57
&rst
ixpk= 0, nxpk= 0, iat= 998, -1, r1= 1.30, r2= 1.80, r3= 6.16, r4= 6.66,
igr2=1803,1804,1805,1807,1808,1809,
/
#
# 61 LEU HG 109 VAL QG1 4.57
&rst
ixpk= 0, nxpk= 0, iat= 998, -1, r1= 1.30, r2= 1.80, r3= 6.16, r4= 6.66,
igr2=1803,1804,1805,1807,1808,1809,
/
#
# 106 LEU HB2 109 VAL HB 5.50
&rst
ixpk= 0, nxpk= 0, iat=1747,1801, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 109 VAL HB 112 ILE QD1 5.50
&rst
ixpk= 0, nxpk= 0, iat=1801, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2=1856,1857,1858,
/
#
# 110 VAL HB 131 LEU QD1 4.91
&rst
ixpk= 0, nxpk= 0, iat=1817, -1, r1= 1.30, r2= 1.80, r3= 6.62, r4= 7.12,
igr2=2181,2182,2183,2185,2186,2187,
/
#
# 110 VAL HA 127 ILE QG2 3.93
&rst
ixpk= 0, nxpk= 0, iat=1815, -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
igr2=2109,2110,2111,
/
#
# 110 VAL HB 127 ILE QG2 4.26
&rst
ixpk= 0, nxpk= 0, iat=1817, -1, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
igr2=2109,2110,2111,
/
#
# 110 VAL HB 131 LEU QD2 4.91
&rst
ixpk= 0, nxpk= 0, iat=1817, -1, r1= 1.30, r2= 1.80, r3= 6.62, r4= 7.12,
igr2=2181,2182,2183,2185,2186,2187,
/
#
# 110 VAL QG2 131 LEU QD2 4.03
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.32, r4= 7.82,
igr1=1819,1820,1821,1823,1824,1825,
igr2=2181,2182,2183,2185,2186,2187,
/
#
# 110 VAL QG2 131 LEU QD1 4.03
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.32, r4= 7.82,
igr1=1819,1820,1821,1823,1824,1825,
igr2=2181,2182,2183,2185,2186,2187,
/
#
# 88 ALA QB 124 VAL HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2063, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1=1436,1437,1438,
/
#
# 110 VAL HA 114 LYS HG2 5.36
&rst
ixpk= 0, nxpk= 0, iat=1815,1888, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86, /
#
# 114 LYS HG2 124 VAL HA 5.50
&rst
ixpk= 0, nxpk= 0, iat=1888,2063, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20, /
#
# 124 VAL HA 127 ILE HB 4.11
&rst
ixpk= 0, nxpk= 0, iat=2063,2107, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, /
#
# 109 VAL HB 110 VAL HA 4.78
&rst
ixpk= 0, nxpk= 0, iat=1801,1815, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, /
#
# 110 VAL HA 110 VAL QG2 3.28
&rst
ixpk= 0, nxpk= 0, iat=1815, -1, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
igr2=1819,1820,1821,1823,1824,1825,
/
#
# 123 VAL HA 124 VAL HA 4.91
&rst
ixpk= 0, nxpk= 0, iat=2047,2063, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41, /
#
# 121 LYS HA 124 VAL HA 5.50
&rst
ixpk= 0, nxpk= 0, iat=2008,2063, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 107 SER HA 110 VAL HB 3.64
&rst
ixpk= 0, nxpk= 0, iat=1764,1817, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14, /
#
# 107 SER HA 110 VAL QG2 3.64
&rst
ixpk= 0, nxpk= 0, iat=1764, -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
igr2=1819,1820,1821,1823,1824,1825,
/
#
# 110 VAL HA 111 ASN HA 5.25
&rst
ixpk= 0, nxpk= 0, iat=1815,1831, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75, /
#
# 124 VAL HA 125 ASN HA 5.50
&rst
ixpk= 0, nxpk= 0, iat=2063,2079, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 124 VAL HA 128 GLU H 4.77
&rst
ixpk= 0, nxpk= 0, iat=2063,2122, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27, /
#
# 124 VAL HA 127 ILE H 4.28
&rst
ixpk= 0, nxpk= 0, iat=2063,2103, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78, /
#
# 111 ASN HA 114 LYS H 4.22
&rst
ixpk= 0, nxpk= 0, iat=1831,1881, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, /
#
# 111 ASN HA 114 LYS HG2 3.88
&rst
ixpk= 0, nxpk= 0, iat=1831,1888, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38, /
#
# 111 ASN HA 114 LYS QD 4.13
&rst
ixpk= 0, nxpk= 0, iat=1831, -1, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
igr2=1891,1892,
/
#
# 112 ILE HA 112 ILE HG13 4.19
&rst
ixpk= 0, nxpk= 0, iat=1845,1854, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69, /
#
# 112 ILE HA 116 ARG QB 5.50
&rst
ixpk= 0, nxpk= 0, iat=1845, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2=1922,1923,
/
#
# 112 ILE QG2 112 ILE HG13 3.71
&rst
ixpk= 0, nxpk= 0, iat= -1,1854, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
igr1=1849,1850,1851,
/
#
# 112 ILE QG2 116 ARG QB 3.74
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr1=1849,1850,1851,
igr2=1922,1923,
/
#
# 112 ILE QG2 112 ILE HG12 3.71
&rst
ixpk= 0, nxpk= 0, iat= -1,1853, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
igr1=1849,1850,1851,
/
#
# 112 ILE HA 112 ILE HG12 4.19
&rst
ixpk= 0, nxpk= 0, iat=1845,1853, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69, /
#
# 112 ILE HB 112 ILE QD1 3.44
&rst
ixpk= 0, nxpk= 0, iat=1847, -1, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
igr2=1856,1857,1858,
/
#
# 111 ASN HB2 112 ILE HA 5.35
&rst
ixpk= 0, nxpk= 0, iat=1833,1845, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85, /
#
# 111 ASN HB3 112 ILE HA 5.35
&rst
ixpk= 0, nxpk= 0, iat=1834,1845, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85, /
#
# 109 VAL HA 112 ILE QG2 4.35
&rst
ixpk= 0, nxpk= 0, iat=1799, -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
igr2=1849,1850,1851,
/
#
# 112 ILE HA 112 ILE QG2 3.39
&rst
ixpk= 0, nxpk= 0, iat=1845, -1, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,
igr2=1849,1850,1851,
/
#
# 112 ILE HA 112 ILE QD1 4.01
&rst
ixpk= 0, nxpk= 0, iat=1845, -1, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
igr2=1856,1857,1858,
/
#
# 112 ILE H 112 ILE QG2 3.87
&rst
ixpk= 0, nxpk= 0, iat=1843, -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
igr2=1849,1850,1851,
/
#
# 112 ILE QG2 113 LEU H 3.84
&rst
ixpk= 0, nxpk= 0, iat= -1,1862, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
igr1=1849,1850,1851,
/
#
# 112 ILE QD1 113 LEU H 5.36
&rst
ixpk= 0, nxpk= 0, iat= -1,1862, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,
igr1=1856,1857,1858,
/
#
# 112 ILE HA 114 LYS H 5.06
&rst
ixpk= 0, nxpk= 0, iat=1845,1881, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56, /
#
# 112 ILE H 113 LEU HA 5.50
&rst
ixpk= 0, nxpk= 0, iat=1843,1864, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 113 LEU HA 119 PHE H 5.50
&rst
ixpk= 0, nxpk= 0, iat=1864,1975, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 113 LEU H 113 LEU QD1 4.48
&rst
ixpk= 0, nxpk= 0, iat=1862, -1, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54,
igr2=1871,1872,1873,1875,1876,1877,
/
#
# 113 LEU HA 118 ILE H 4.82
&rst
ixpk= 0, nxpk= 0, iat=1864,1956, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32, /
#
# 131 LEU HA 131 LEU QD1 4.06
&rst
ixpk= 0, nxpk= 0, iat=2174, -1, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,
igr2=2181,2182,2183,2185,2186,2187,
/
#
# 110 VAL HA 113 LEU HA 5.42
&rst
ixpk= 0, nxpk= 0, iat=1815,1864, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92, /
#
# 113 LEU HA 113 LEU QD1 4.02
&rst
ixpk= 0, nxpk= 0, iat=1864, -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr2=1871,1872,1873,1875,1876,1877,
/
#
# 113 LEU HA 118 ILE HG12 4.38
&rst
ixpk= 0, nxpk= 0, iat=1864,1966, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88, /
#
# 113 LEU HA 118 ILE HB 4.68
&rst
ixpk= 0, nxpk= 0, iat=1864,1960, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18, /
#
# 113 LEU HA 113 LEU QD2 4.02
&rst
ixpk= 0, nxpk= 0, iat=1864, -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr2=1871,1872,1873,1875,1876,1877,
/
#
# 113 LEU HA 118 ILE QD1 4.46
&rst
ixpk= 0, nxpk= 0, iat=1864, -1, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
igr2=1969,1970,1971,
/
#
# 114 LYS HA 117 ASN HA 4.13
&rst
ixpk= 0, nxpk= 0, iat=1883,1944, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63, /
#
# 121 LYS HA 121 LYS HG2 3.61
&rst
ixpk= 0, nxpk= 0, iat=2008,2013, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11, /
#
# 121 LYS HG2 121 LYS QD 2.57
&rst
ixpk= 0, nxpk= 0, iat=2013, -1, r1= 1.30, r2= 1.80, r3= 2.88, r4= 3.38,
igr2=2016,2017,
/
#
# 114 LYS HB3 124 VAL QG1 4.63
&rst
ixpk= 0, nxpk= 0, iat=1886, -1, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
igr2=2067,2068,2069,2071,2072,2073,
/
#
# 114 LYS HB2 124 VAL QG2 4.61
&rst
ixpk= 0, nxpk= 0, iat=1885, -1, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,
igr2=2067,2068,2069,2071,2072,2073,
/
#
# 114 LYS HB3 124 VAL QG2 4.63
&rst
ixpk= 0, nxpk= 0, iat=1886, -1, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
igr2=2067,2068,2069,2071,2072,2073,
/
#
# 111 ASN HA 114 LYS HB3 5.34
&rst
ixpk= 0, nxpk= 0, iat=1831,1886, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84, /
#
# 115 GLU HA 116 ARG H 3.56
&rst
ixpk= 0, nxpk= 0, iat=1905,1918, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06, /
#
# 112 ILE HA 115 GLU HA 5.24
&rst
ixpk= 0, nxpk= 0, iat=1845,1905, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74, /
#
# 112 ILE HA 115 GLU HB2 3.95
&rst
ixpk= 0, nxpk= 0, iat=1845,1907, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45, /
#
# 112 ILE HA 115 GLU HG3 4.06
&rst
ixpk= 0, nxpk= 0, iat=1845,1911, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56, /
#
# 112 ILE HA 115 GLU HG2 4.06
&rst
ixpk= 0, nxpk= 0, iat=1845,1910, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56, /
#
# 121 LYS HG3 122 GLN HA 4.46
&rst
ixpk= 0, nxpk= 0, iat=2014,2030, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, /
#
# 116 ARG HA 118 ILE QD1 4.57
&rst
ixpk= 0, nxpk= 0, iat=1920, -1, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
igr2=1969,1970,1971,
/
#
# 117 ASN HB2 118 ILE QD1 5.05
&rst
ixpk= 0, nxpk= 0, iat=1946, -1, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
igr2=1969,1970,1971,
/
#
# 117 ASN HA 118 ILE HG12 5.07
&rst
ixpk= 0, nxpk= 0, iat=1944,1966, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, /
#
# 117 ASN HB2 118 ILE HG12 5.50
&rst
ixpk= 0, nxpk= 0, iat=1946,1966, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20, /
#
# 72 LYS QD 117 ASN HB2 4.93
&rst
ixpk= 0, nxpk= 0, iat= -1,1946, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03,
igr1=1184,1185,
/
#
# 72 LYS QD 117 ASN HA 5.31
&rst
ixpk= 0, nxpk= 0, iat= -1,1944, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
igr1=1184,1185,
/
#
# 114 LYS HB3 117 ASN HA 5.50
&rst
ixpk= 0, nxpk= 0, iat=1886,1944, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 117 ASN HA 118 ILE HA 4.88
&rst
ixpk= 0, nxpk= 0, iat=1944,1958, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38, /
#
# 117 ASN HB2 117 ASN HND2 3.86
&rst
ixpk= 0, nxpk= 0, iat=1946,1952, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, /
#
# 118 ILE QG2 118 ILE QD1 3.03
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
igr1=1962,1963,1964,
igr2=1969,1970,1971,
/
#
# 68 VAL QG1 118 ILE QG2 3.72
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,
igr1=1120,1121,1122,1124,1125,1126,
igr2=1962,1963,1964,
/
#
# 118 ILE QG2 118 ILE HG13 3.53
&rst
ixpk= 0, nxpk= 0, iat= -1,1967, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
igr1=1962,1963,1964,
/
#
# 72 LYS QD 118 ILE HA 3.99
&rst
ixpk= 0, nxpk= 0, iat= -1,1958, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
igr1=1184,1185,
/
#
# 72 LYS QE 118 ILE HA 4.54
&rst
ixpk= 0, nxpk= 0, iat= -1,1958, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
igr1=1187,1188,
/
#
# 117 ASN HB3 118 ILE HA 5.00
&rst
ixpk= 0, nxpk= 0, iat=1947,1958, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, /
#
# 118 ILE QG2 118 ILE HG12 3.43
&rst
ixpk= 0, nxpk= 0, iat= -1,1966, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
igr1=1962,1963,1964,
/
#
# 68 VAL HB 118 ILE QG2 3.62
&rst
ixpk= 0, nxpk= 0, iat=1118, -1, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,
igr2=1962,1963,1964,
/
#
# 72 LYS QD 118 ILE QG2 3.95
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
igr1=1184,1185,
igr2=1962,1963,1964,
/
#
# 118 ILE HB 118 ILE QD1 3.58
&rst
ixpk= 0, nxpk= 0, iat=1960, -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
igr2=1969,1970,1971,
/
#
# 72 LYS QD 118 ILE QD1 3.24
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
igr1=1184,1185,
igr2=1969,1970,1971,
/
#
# 72 LYS QE 118 ILE QD1 3.97
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,
igr1=1187,1188,
igr2=1969,1970,1971,
/
#
# 72 LYS QE 118 ILE QG2 5.04
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1=1187,1188,
igr2=1962,1963,1964,
/
#
# 118 ILE HA 118 ILE QG2 3.31
&rst
ixpk= 0, nxpk= 0, iat=1958, -1, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,
igr2=1962,1963,1964,
/
#
# 118 ILE HA 118 ILE QD1 3.26
&rst
ixpk= 0, nxpk= 0, iat=1958, -1, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
igr2=1969,1970,1971,
/
#
# 68 VAL HA 118 ILE QG2 4.19
&rst
ixpk= 0, nxpk= 0, iat=1116, -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
igr2=1962,1963,1964,
/
#
# 69 GLN HA 118 ILE QG2 3.95
&rst
ixpk= 0, nxpk= 0, iat=1132, -1, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr2=1962,1963,1964,
/
#
# 69 GLN HA 118 ILE QD1 3.55
&rst
ixpk= 0, nxpk= 0, iat=1132, -1, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,
igr2=1969,1970,1971,
/
#
# 72 LYS HA 118 ILE QD1 5.02
&rst
ixpk= 0, nxpk= 0, iat=1176, -1, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
igr2=1969,1970,1971,
/
#
# 80 GLN HA 118 ILE QG2 4.17
&rst
ixpk= 0, nxpk= 0, iat=1319, -1, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
igr2=1962,1963,1964,
/
#
# 69 GLN HA 118 ILE HA 5.31
&rst
ixpk= 0, nxpk= 0, iat=1132,1958, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81, /
#
# 72 LYS HA 118 ILE HA 5.50
&rst
ixpk= 0, nxpk= 0, iat=1176,1958, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 117 ASN HA 118 ILE QD1 4.71
&rst
ixpk= 0, nxpk= 0, iat=1944, -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr2=1969,1970,1971,
/
#
# 118 ILE QG2 119 PHE HA 4.58
&rst
ixpk= 0, nxpk= 0, iat= -1,1977, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
igr1=1962,1963,1964,
/
#
# 80 GLN HNE1 118 ILE HA 4.92
&rst
ixpk= 0, nxpk= 0, iat=1329,1958, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42, /
#
# 80 GLN HNE2 118 ILE HA 4.92
&rst
ixpk= 0, nxpk= 0, iat=1330,1958, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42, /
#
# 80 GLN HNE1 118 ILE QG2 4.25
&rst
ixpk= 0, nxpk= 0, iat=1329, -1, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
igr2=1962,1963,1964,
/
#
# 118 ILE QG2 119 PHE HD 4.20
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr1=1962,1963,1964,
igr2=1983,1991,
/
#
# 69 GLN H 118 ILE QG2 4.29
&rst
ixpk= 0, nxpk= 0, iat=1130, -1, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
igr2=1962,1963,1964,
/
#
# 69 GLN H 118 ILE QD1 5.05
&rst
ixpk= 0, nxpk= 0, iat=1130, -1, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
igr2=1969,1970,1971,
/
#
# 118 ILE H 118 ILE QG2 3.92
&rst
ixpk= 0, nxpk= 0, iat=1956, -1, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
igr2=1962,1963,1964,
/
#
# 80 GLN HNE2 118 ILE QG2 4.25
&rst
ixpk= 0, nxpk= 0, iat=1330, -1, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
igr2=1962,1963,1964,
/
#
# 117 ASN H 118 ILE QD1 4.04
&rst
ixpk= 0, nxpk= 0, iat=1942, -1, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
igr2=1969,1970,1971,
/
#
# 118 ILE QD1 119 PHE H 4.53
&rst
ixpk= 0, nxpk= 0, iat= -1,1975, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
igr1=1969,1970,1971,
/
#
# 118 ILE QG2 119 PHE HZ 4.40
&rst
ixpk= 0, nxpk= 0, iat= -1,1987, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
igr1=1962,1963,1964,
/
#
# 119 PHE HA 120 SER HA 4.67
&rst
ixpk= 0, nxpk= 0, iat=1977,1997, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, /
#
# 119 PHE HA 123 VAL HB 5.50
&rst
ixpk= 0, nxpk= 0, iat=1977,2049, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 119 PHE HB2 123 VAL HB 5.10
&rst
ixpk= 0, nxpk= 0, iat=1979,2049, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, /
#
# 119 PHE HA 123 VAL QG2 4.70
&rst
ixpk= 0, nxpk= 0, iat=1977, -1, r1= 1.30, r2= 1.80, r3= 6.34, r4= 6.84,
igr2=2051,2052,2053,2055,2056,2057,
/
#
# 119 PHE HA 123 VAL QG1 4.70
&rst
ixpk= 0, nxpk= 0, iat=1977, -1, r1= 1.30, r2= 1.80, r3= 6.34, r4= 6.84,
igr2=2051,2052,2053,2055,2056,2057,
/
#
# 120 SER HA 121 LYS HA 4.35
&rst
ixpk= 0, nxpk= 0, iat=1997,2008, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85, /
#
# 121 LYS QB 122 GLN HB3 4.93
&rst
ixpk= 0, nxpk= 0, iat= -1,2033, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03,
igr1=2010,2011,
/
#
# 121 LYS QB 124 VAL HB 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2065, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1=2010,2011,
/
#
# 121 LYS HG2 121 LYS QE 3.47
&rst
ixpk= 0, nxpk= 0, iat=2013, -1, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,
igr2=2019,2020,
/
#
# 121 LYS QB 121 LYS QE 4.45
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr1=2010,2011,
igr2=2019,2020,
/
#
# 121 LYS HA 121 LYS HG3 3.49
&rst
ixpk= 0, nxpk= 0, iat=2008,2014, r1= 1.30, r2= 1.80, r3= 3.49, r4= 3.99, /
#
# 120 SER HA 121 LYS QB 4.78
&rst
ixpk= 0, nxpk= 0, iat=1997, -1, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr2=2010,2011,
/
#
# 121 LYS QB 122 GLN H 3.78
&rst
ixpk= 0, nxpk= 0, iat= -1,2028, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
igr1=2010,2011,
/
#
# 121 LYS H 121 LYS HG2 4.46
&rst
ixpk= 0, nxpk= 0, iat=2006,2013, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, /
#
# 121 LYS HG2 122 GLN HB3 4.48
&rst
ixpk= 0, nxpk= 0, iat=2013,2033, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98, /
#
# 88 ALA QB 123 VAL HA 4.51
&rst
ixpk= 0, nxpk= 0, iat= -1,2047, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr1=1436,1437,1438,
/
#
# 123 VAL HA 126 ASP HB2 4.09
&rst
ixpk= 0, nxpk= 0, iat=2047,2095, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59, /
#
# 123 VAL HA 126 ASP HB3 4.09
&rst
ixpk= 0, nxpk= 0, iat=2047,2096, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59, /
#
# 119 PHE HB2 123 VAL HA 5.50
&rst
ixpk= 0, nxpk= 0, iat=1979,2047, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 123 VAL HA 123 VAL QG1 3.26
&rst
ixpk= 0, nxpk= 0, iat=2047, -1, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,
igr2=2051,2052,2053,2055,2056,2057,
/
#
# 123 VAL HA 123 VAL QG2 3.26
&rst
ixpk= 0, nxpk= 0, iat=2047, -1, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,
igr2=2051,2052,2053,2055,2056,2057,
/
#
# 84 GLY HA3 123 VAL QG1 3.63
&rst
ixpk= 0, nxpk= 0, iat=1380, -1, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
igr2=2051,2052,2053,2055,2056,2057,
/
#
# 84 GLY HA3 123 VAL QG2 3.63
&rst
ixpk= 0, nxpk= 0, iat=1380, -1, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
igr2=2051,2052,2053,2055,2056,2057,
/
#
# 123 VAL QG2 124 VAL H 3.67
&rst
ixpk= 0, nxpk= 0, iat= -1,2061, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr1=2051,2052,2053,2055,2056,2057,
/
#
# 114 LYS H 124 VAL QG1 4.58
&rst
ixpk= 0, nxpk= 0, iat=1881, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2=2067,2068,2069,2071,2072,2073,
/
#
# 114 LYS H 124 VAL QG2 4.58
&rst
ixpk= 0, nxpk= 0, iat=1881, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2=2067,2068,2069,2071,2072,2073,
/
#
# 123 VAL H 124 VAL HA 5.50
&rst
ixpk= 0, nxpk= 0, iat=2045,2063, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 114 LYS HA 124 VAL QG1 3.69
&rst
ixpk= 0, nxpk= 0, iat=1883, -1, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
igr2=2067,2068,2069,2071,2072,2073,
/
#
# 121 LYS HA 124 VAL QG2 4.13
&rst
ixpk= 0, nxpk= 0, iat=2008, -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
igr2=2067,2068,2069,2071,2072,2073,
/
#
# 114 LYS HA 124 VAL QG2 3.69
&rst
ixpk= 0, nxpk= 0, iat=1883, -1, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
igr2=2067,2068,2069,2071,2072,2073,
/
#
# 114 LYS HA 124 VAL HB 5.40
&rst
ixpk= 0, nxpk= 0, iat=1883,2065, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90, /
#
# 124 VAL HA 124 VAL QG1 3.12
&rst
ixpk= 0, nxpk= 0, iat=2063, -1, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,
igr2=2067,2068,2069,2071,2072,2073,
/
#
# 124 VAL HA 124 VAL QG2 3.12
&rst
ixpk= 0, nxpk= 0, iat=2063, -1, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,
igr2=2067,2068,2069,2071,2072,2073,
/
#
# 114 LYS QE 124 VAL HB 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2065, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1=1894,1895,
/
#
# 114 LYS QE 124 VAL QG1 4.71
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.13, r4= 7.63,
igr1=1894,1895,
igr2=2067,2068,2069,2071,2072,2073,
/
#
# 114 LYS QE 124 VAL QG2 4.71
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.13, r4= 7.63,
igr1=1894,1895,
igr2=2067,2068,2069,2071,2072,2073,
/
#
# 114 LYS HB2 124 VAL QG1 4.61
&rst
ixpk= 0, nxpk= 0, iat=1885, -1, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,
igr2=2067,2068,2069,2071,2072,2073,
/
#
# 124 VAL QG1 127 ILE QD1 4.34
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.03, r4= 7.53,
igr1=2067,2068,2069,2071,2072,2073,
igr2=2116,2117,2118,
/
#
# 124 VAL QG2 127 ILE QD1 4.34
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.03, r4= 7.53,
igr1=2067,2068,2069,2071,2072,2073,
igr2=2116,2117,2118,
/
#
# 125 ASN HA 128 GLU HB2 3.67
&rst
ixpk= 0, nxpk= 0, iat=2079,2126, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17, /
#
# 124 VAL HB 125 ASN HB2 5.48
&rst
ixpk= 0, nxpk= 0, iat=2065,2081, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98, /
#
# 125 ASN HA 127 ILE H 4.82
&rst
ixpk= 0, nxpk= 0, iat=2079,2103, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32, /
#
# 127 ILE H 127 ILE QD1 3.49
&rst
ixpk= 0, nxpk= 0, iat=2103, -1, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,
igr2=2116,2117,2118,
/
#
# 127 ILE HB 128 GLU H 4.74
&rst
ixpk= 0, nxpk= 0, iat=2107,2122, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24, /
#
# 110 VAL H 127 ILE QG2 4.94
&rst
ixpk= 0, nxpk= 0, iat=1813, -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr2=2109,2110,2111,
/
#
# 124 VAL H 127 ILE QD1 4.44
&rst
ixpk= 0, nxpk= 0, iat=2061, -1, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
igr2=2116,2117,2118,
/
#
# 119 PHE HE 127 ILE QD1 3.89
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr1=1985,1989,
igr2=2116,2117,2118,
/
#
# 119 PHE HD 127 ILE QD1 4.03
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
igr1=1983,1991,
igr2=2116,2117,2118,
/
#
# 119 PHE HZ 127 ILE QD1 4.90
&rst
ixpk= 0, nxpk= 0, iat=1987, -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
igr2=2116,2117,2118,
/
#
# 127 ILE HA 130 SER HB3 4.32
&rst
ixpk= 0, nxpk= 0, iat=2105,2166, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82, /
#
# 88 ALA HA 127 ILE QG2 3.42
&rst
ixpk= 0, nxpk= 0, iat=1434, -1, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
igr2=2109,2110,2111,
/
#
# 88 ALA HA 127 ILE QD1 3.83
&rst
ixpk= 0, nxpk= 0, iat=1434, -1, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
igr2=2116,2117,2118,
/
#
# 127 ILE HA 127 ILE QG2 3.18
&rst
ixpk= 0, nxpk= 0, iat=2105, -1, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,
igr2=2109,2110,2111,
/
#
# 124 VAL HA 127 ILE QD1 2.96
&rst
ixpk= 0, nxpk= 0, iat=2063, -1, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05,
igr2=2116,2117,2118,
/
#
# 127 ILE QG2 128 GLU HG3 4.75
&rst
ixpk= 0, nxpk= 0, iat= -1,2130, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr1=2109,2110,2111,
/
#
# 127 ILE HA 127 ILE HG12 3.94
&rst
ixpk= 0, nxpk= 0, iat=2105,2113, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44, /
#
# 127 ILE HB 127 ILE QD1 3.07
&rst
ixpk= 0, nxpk= 0, iat=2107, -1, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19,
igr2=2116,2117,2118,
/
#
# 127 ILE QG2 131 LEU HG 4.02
&rst
ixpk= 0, nxpk= 0, iat= -1,2179, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
igr1=2109,2110,2111,
/
#
# 127 ILE HA 127 ILE QD1 3.97
&rst
ixpk= 0, nxpk= 0, iat=2105, -1, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
igr2=2116,2117,2118,
/
#
# 127 ILE HA 127 ILE HG13 3.94
&rst
ixpk= 0, nxpk= 0, iat=2105,2114, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44, /
#
# 127 ILE QG2 127 ILE QD1 2.79
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,
igr1=2109,2110,2111,
igr2=2116,2117,2118,
/
#
# 110 VAL QG1 127 ILE QG2 3.12
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
igr1=1819,1820,1821,1823,1824,1825,
igr2=2109,2110,2111,
/
#
# 110 VAL QG2 127 ILE QG2 3.12
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
igr1=1819,1820,1821,1823,1824,1825,
igr2=2109,2110,2111,
/
#
# 91 LEU HB3 127 ILE QG2 3.98
&rst
ixpk= 0, nxpk= 0, iat=1478, -1, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
igr2=2109,2110,2111,
/
#
# 87 ALA QB 127 ILE QG2 3.85
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,
igr1=1426,1427,1428,
igr2=2109,2110,2111,
/
#
# 127 ILE QG2 128 GLU HG2 4.75
&rst
ixpk= 0, nxpk= 0, iat= -1,2129, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr1=2109,2110,2111,
/
#
# 128 GLU HA 128 GLU HG2 3.91
&rst
ixpk= 0, nxpk= 0, iat=2124,2129, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41, /
#
# 128 GLU HG3 129 ARG H 5.10
&rst
ixpk= 0, nxpk= 0, iat=2130,2137, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, /
#
# 128 GLU HG2 129 ARG H 5.10
&rst
ixpk= 0, nxpk= 0, iat=2129,2137, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, /
#
# 129 ARG HA 129 ARG QG 3.46
&rst
ixpk= 0, nxpk= 0, iat=2139, -1, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,
igr2=2144,2145,
/
#
# 129 ARG HA 129 ARG QD 4.13
&rst
ixpk= 0, nxpk= 0, iat=2139, -1, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
igr2=2147,2148,
/
#
# 88 ALA QB 130 SER HB3 4.69
&rst
ixpk= 0, nxpk= 0, iat= -1,2166, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr1=1436,1437,1438,
/
#
# 88 ALA QB 130 SER HB2 4.69
&rst
ixpk= 0, nxpk= 0, iat= -1,2165, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr1=1436,1437,1438,
/
#
# 88 ALA QB 130 SER HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2163, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1=1436,1437,1438,
/
#
# 130 SER HA 133 ALA QB 3.26
&rst
ixpk= 0, nxpk= 0, iat=2163, -1, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
igr2=2205,2206,2207,
/
#
# 130 SER HB2 133 ALA QB 5.50
&rst
ixpk= 0, nxpk= 0, iat=2165, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2=2205,2206,2207,
/
#
# 130 SER HB3 133 ALA QB 5.50
&rst
ixpk= 0, nxpk= 0, iat=2166, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2=2205,2206,2207,
/
#
# 129 ARG QG 130 SER HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2163, r1= 1.30, r2= 1.80, r3= 6.37, r4= 6.87,
igr1=2144,2145,
/
#
# 129 ARG HB2 130 SER HA 4.20
&rst
ixpk= 0, nxpk= 0, iat=2141,2163, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, /
#
# 127 ILE HA 130 SER HB2 4.32
&rst
ixpk= 0, nxpk= 0, iat=2105,2165, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82, /
#
# 130 SER HA 133 ALA H 4.10
&rst
ixpk= 0, nxpk= 0, iat=2163,2201, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60, /
#
# 130 SER HA 134 ALA H 4.67
&rst
ixpk= 0, nxpk= 0, iat=2163,2211, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, /
#
# 92 GLY HA3 131 LEU HA 5.04
&rst
ixpk= 0, nxpk= 0, iat=1495,2174, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54, /
#
# 131 LEU HB2 131 LEU QD1 4.17
&rst
ixpk= 0, nxpk= 0, iat=2176, -1, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
igr2=2181,2182,2183,2185,2186,2187,
/
#
# 131 LEU HB2 131 LEU QD2 4.17
&rst
ixpk= 0, nxpk= 0, iat=2176, -1, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
igr2=2181,2182,2183,2185,2186,2187,
/
#
# 132 ALA HA 135 LEU HG 3.43
&rst
ixpk= 0, nxpk= 0, iat=2193,2228, r1= 1.30, r2= 1.80, r3= 3.43, r4= 3.93, /
#
# 128 GLU HA 132 ALA QB 4.38
&rst
ixpk= 0, nxpk= 0, iat=2124, -1, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr2=2195,2196,2197,
/
#
# 133 ALA H 133 ALA HA 2.91
&rst
ixpk= 0, nxpk= 0, iat=2201,2203, r1= 1.30, r2= 1.80, r3= 2.91, r4= 3.41, /
#
# 132 ALA HA 136 GLU H 4.72
&rst
ixpk= 0, nxpk= 0, iat=2193,2240, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22, /
#
# 133 ALA HA 136 GLU H 4.89
&rst
ixpk= 0, nxpk= 0, iat=2203,2240, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39, /
#
# 134 ALA HA 136 GLU H 4.68
&rst
ixpk= 0, nxpk= 0, iat=2213,2240, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18, /
#
# 134 ALA H 134 ALA HA 2.83
&rst
ixpk= 0, nxpk= 0, iat=2211,2213, r1= 1.30, r2= 1.80, r3= 2.83, r4= 3.33, /
#
# 96 GLN HG2 134 ALA HA 4.52
&rst
ixpk= 0, nxpk= 0, iat=1563,2213, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02, /
#
# 96 GLN HG3 134 ALA QB 4.26
&rst
ixpk= 0, nxpk= 0, iat=1564, -1, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
igr2=2215,2216,2217,
/
#
# 96 GLN HB3 134 ALA HA 4.46
&rst
ixpk= 0, nxpk= 0, iat=1561,2213, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, /
#
# 134 ALA QB 135 LEU HB3 4.19
&rst
ixpk= 0, nxpk= 0, iat= -1,2226, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
igr1=2215,2216,2217,
/
#
# 134 ALA QB 135 LEU HG 4.48
&rst
ixpk= 0, nxpk= 0, iat= -1,2228, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
igr1=2215,2216,2217,
/
#
# 96 GLN HB3 134 ALA QB 3.64
&rst
ixpk= 0, nxpk= 0, iat=1561, -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
igr2=2215,2216,2217,
/
#
# 135 LEU HB3 135 LEU QD2 3.38
&rst
ixpk= 0, nxpk= 0, iat=2226, -1, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
igr2=2230,2231,2232,2234,2235,2236,
/
#
# 135 LEU HB3 135 LEU QD1 3.38
&rst
ixpk= 0, nxpk= 0, iat=2226, -1, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
igr2=2230,2231,2232,2234,2235,2236,
/
#
# 135 LEU HA 135 LEU HB2 2.75
&rst
ixpk= 0, nxpk= 0, iat=2223,2225, r1= 1.30, r2= 1.80, r3= 2.75, r4= 3.25, /
#
# 135 LEU HA 135 LEU HB3 2.72
&rst
ixpk= 0, nxpk= 0, iat=2223,2226, r1= 1.30, r2= 1.80, r3= 2.72, r4= 3.22, /
#
# 135 LEU HA 135 LEU HG 3.75
&rst
ixpk= 0, nxpk= 0, iat=2223,2228, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25, /
#
# 135 LEU H 135 LEU HB3 3.35
&rst
ixpk= 0, nxpk= 0, iat=2221,2226, r1= 1.30, r2= 1.80, r3= 3.35, r4= 3.85, /
#
# 135 LEU H 135 LEU HB2 3.67
&rst
ixpk= 0, nxpk= 0, iat=2221,2225, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17, /
#
# 135 LEU HB3 136 GLU H 4.45
&rst
ixpk= 0, nxpk= 0, iat=2226,2240, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95, /
#
# 135 LEU HB2 136 GLU H 4.29
&rst
ixpk= 0, nxpk= 0, iat=2225,2240, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79, /
#
# 103 LYS HA 106 LEU HB3 4.36
&rst
ixpk= 0, nxpk= 0, iat=1679,1748, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86, /
#
# 98 PHE HB2 103 LYS QB 5.50
&rst
ixpk= 0, nxpk= 0, iat=1592, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2=1681,1682,
/
#
# 98 PHE HB2 102 LEU HB3 5.50
&rst
ixpk= 0, nxpk= 0, iat=1592,1663, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 98 PHE HB2 102 LEU HB2 5.50
&rst
ixpk= 0, nxpk= 0, iat=1592,1662, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 19 GLN H 19 GLN HG2 4.92
&rst
ixpk= 0, nxpk= 0, iat= 279, 286, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42, /
#
# 19 GLN H 19 GLN HG3 4.92
&rst
ixpk= 0, nxpk= 0, iat= 279, 287, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42, /
#
# 2 ALA HA 3 PHE QB 5.00
&rst
ixpk= 0, nxpk= 0, iat= 23, -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr2= 35, 36,
/
#
# 3 PHE HA 7 GLN QB 4.79
&rst
ixpk= 0, nxpk= 0, iat= 33, -1, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
igr2= 92, 93,
/
#
# 3 PHE HA 7 GLN QG 5.00
&rst
ixpk= 0, nxpk= 0, iat= 33, -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr2= 95, 96,
/
#
# 4 SER H 7 GLN QG 3.83
&rst
ixpk= 0, nxpk= 0, iat= 51, -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
igr2= 95, 96,
/
#
# 5 SER H 6 GLU QB 5.19
&rst
ixpk= 0, nxpk= 0, iat= 62, -1, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33,
igr2= 77, 78,
/
#
# 6 GLU H 6 GLU QB 2.97
&rst
ixpk= 0, nxpk= 0, iat= 73, -1, r1= 1.30, r2= 1.80, r3= 3.33, r4= 3.83,
igr2= 77, 78,
/
#
# 6 GLU H 7 GLN QG 3.10
&rst
ixpk= 0, nxpk= 0, iat= 73, -1, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98,
igr2= 95, 96,
/
#
# 6 GLU HA 7 GLN QG 5.31
&rst
ixpk= 0, nxpk= 0, iat= 75, -1, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
igr2= 95, 96,
/
#
# 6 GLU QB 7 GLN H 3.24
&rst
ixpk= 0, nxpk= 0, iat= -1, 88, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
igr1= 77, 78,
/
#
# 7 GLN H 7 GLN QB 3.66
&rst
ixpk= 0, nxpk= 0, iat= 88, -1, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
igr2= 92, 93,
/
#
# 7 GLN H 7 GLN QG 2.87
&rst
ixpk= 0, nxpk= 0, iat= 88, -1, r1= 1.30, r2= 1.80, r3= 3.22, r4= 3.72,
igr2= 95, 96,
/
#
# 7 GLN HA 7 GLN QG 3.39
&rst
ixpk= 0, nxpk= 0, iat= 90, -1, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,
igr2= 95, 96,
/
#
# 7 GLN QB 7 GLN HNE1 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 100, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,
igr1= 92, 93,
/
#
# 7 GLN QB 7 GLN HNE2 3.46
&rst
ixpk= 0, nxpk= 0, iat= -1, 101, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
igr1= 92, 93,
/
#
# 7 GLN QB 8 PHE H 3.70
&rst
ixpk= 0, nxpk= 0, iat= -1, 105, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65,
igr1= 92, 93,
/
#
# 7 GLN QB 28 TRP HZ2 3.47
&rst
ixpk= 0, nxpk= 0, iat= -1, 419, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,
igr1= 92, 93,
/
#
# 7 GLN QG 7 GLN HNE1 2.90
&rst
ixpk= 0, nxpk= 0, iat= -1, 100, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,
igr1= 95, 96,
/
#
# 7 GLN QG 7 GLN HNE2 3.49
&rst
ixpk= 0, nxpk= 0, iat= -1, 101, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
igr1= 95, 96,
/
#
# 7 GLN QG 8 PHE H 3.56
&rst
ixpk= 0, nxpk= 0, iat= -1, 105, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,
igr1= 95, 96,
/
#
# 7 GLN QG 9 THR H 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, 125, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1= 95, 96,
/
#
# 7 GLN QG 42 MET QE 4.56
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
igr1= 95, 96,
igr2= 659, 660, 661,
/
#
# 8 PHE H 11 LYS QE 4.58
&rst
ixpk= 0, nxpk= 0, iat= 105, -1, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
igr2= 166, 167,
/
#
# 8 PHE H 29 LEU QQD 6.89
&rst
ixpk= 0, nxpk= 0, iat= 105, -1, r1= 1.30, r2= 1.80, r3= 9.29, r4= 9.79,
igr2= 439, 440, 441, 443, 444, 445,
/
#
# 8 PHE HA 11 LYS QD 5.04
&rst
ixpk= 0, nxpk= 0, iat= 107, -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr2= 163, 164,
/
#
# 8 PHE HA 11 LYS QE 4.50
&rst
ixpk= 0, nxpk= 0, iat= 107, -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
igr2= 166, 167,
/
#
# 8 PHE HB2 39 VAL QQG 3.38
&rst
ixpk= 0, nxpk= 0, iat= 109, -1, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
igr2= 613, 614, 615, 617, 618, 619,
/
#
# 8 PHE HD 11 LYS QG 4.27
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
igr1= 113, 121,
igr2= 160, 161,
/
#
# 8 PHE HD 12 LEU QQD 6.3
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.53, r4=10.03,
igr1= 113, 121,
igr2= 184, 185, 186, 188, 189, 190,
/
#
# 8 PHE HD 29 LEU QQD 5.59
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.46, r4= 8.96,
igr1= 113, 121,
igr2= 439, 440, 441, 443, 444, 445,
/
#
# 8 PHE HD 42 MET QB 4.02
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
igr1= 113, 121,
igr2= 652, 653,
/
#
# 8 PHE HE 12 LEU QQD 5.62
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.50, r4= 9.00,
igr1= 115, 119,
igr2= 184, 185, 186, 188, 189, 190,
/
#
# 8 PHE HE 29 LEU QQD 6.36
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.62, r4=10.12,
igr1= 115, 119,
igr2= 439, 440, 441, 443, 444, 445,
/
#
# 8 PHE HE 63 LEU QQD 5.88
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
igr1= 115, 119,
igr2=1040,1041,1042,1044,1045,1046,
/
#
# 8 PHE HZ 12 LEU QQD 5.94
&rst
ixpk= 0, nxpk= 0, iat= 117, -1, r1= 1.30, r2= 1.80, r3= 8.01, r4= 8.51,
igr2= 184, 185, 186, 188, 189, 190,
/
#
# 8 PHE HZ 39 VAL QQG 5.22
&rst
ixpk= 0, nxpk= 0, iat= 117, -1, r1= 1.30, r2= 1.80, r3= 7.04, r4= 7.54,
igr2= 613, 614, 615, 617, 618, 619,
/
#
# 9 THR H 11 LYS QE 5.34
&rst
ixpk= 0, nxpk= 0, iat= 125, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2= 166, 167,
/
#
# 9 THR H 12 LEU QQD 6.43
&rst
ixpk= 0, nxpk= 0, iat= 125, -1, r1= 1.30, r2= 1.80, r3= 8.67, r4= 9.17,
igr2= 184, 185, 186, 188, 189, 190,
/
#
# 9 THR HA 12 LEU QQD 5.36
&rst
ixpk= 0, nxpk= 0, iat= 127, -1, r1= 1.30, r2= 1.80, r3= 7.23, r4= 7.73,
igr2= 184, 185, 186, 188, 189, 190,
/
#
# 9 THR HB 12 LEU QQD 6.91
&rst
ixpk= 0, nxpk= 0, iat= 129, -1, r1= 1.30, r2= 1.80, r3= 9.31, r4= 9.81,
igr2= 184, 185, 186, 188, 189, 190,
/
#
# 9 THR QG2 12 LEU QQD 5.78
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.36, r4= 9.86,
igr1= 131, 132, 133,
igr2= 184, 185, 186, 188, 189, 190,
/
#
# 9 THR QG2 42 MET QB 4.06
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,
igr1= 131, 132, 133,
igr2= 652, 653,
/
#
# 10 THR H 11 LYS QG 4.00
&rst
ixpk= 0, nxpk= 0, iat= 139, -1, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
igr2= 160, 161,
/
#
# 10 THR H 11 LYS QE 5.14
&rst
ixpk= 0, nxpk= 0, iat= 139, -1, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,
igr2= 166, 167,
/
#
# 10 THR H 12 LEU QQD 7.47
&rst
ixpk= 0, nxpk= 0, iat= 139, -1, r1= 1.30, r2= 1.80, r3=10.07, r4=10.57,
igr2= 184, 185, 186, 188, 189, 190,
/
#
# 10 THR QG2 11 LYS QE 4.32
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32,
igr1= 145, 146, 147,
igr2= 166, 167,
/
#
# 11 LYS H 11 LYS QG 3.16
&rst
ixpk= 0, nxpk= 0, iat= 153, -1, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05,
igr2= 160, 161,
/
#
# 11 LYS H 11 LYS QE 4.07
&rst
ixpk= 0, nxpk= 0, iat= 153, -1, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,
igr2= 166, 167,
/
#
# 11 LYS H 12 LEU QQD 6.77
&rst
ixpk= 0, nxpk= 0, iat= 153, -1, r1= 1.30, r2= 1.80, r3= 9.13, r4= 9.63,
igr2= 184, 185, 186, 188, 189, 190,
/
#
# 11 LYS HA 11 LYS QG 3.49
&rst
ixpk= 0, nxpk= 0, iat= 155, -1, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
igr2= 160, 161,
/
#
# 11 LYS HA 11 LYS QD 3.35
&rst
ixpk= 0, nxpk= 0, iat= 155, -1, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,
igr2= 163, 164,
/
#
# 11 LYS HB2 11 LYS QE 4.72
&rst
ixpk= 0, nxpk= 0, iat= 157, -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr2= 166, 167,
/
#
# 11 LYS HB2 12 LEU QQD 5.8
&rst
ixpk= 0, nxpk= 0, iat= 157, -1, r1= 1.30, r2= 1.80, r3= 7.82, r4= 8.32,
igr2= 184, 185, 186, 188, 189, 190,
/
#
# 11 LYS HB3 12 LEU QQD 6.91
&rst
ixpk= 0, nxpk= 0, iat= 158, -1, r1= 1.30, r2= 1.80, r3= 9.31, r4= 9.81,
igr2= 184, 185, 186, 188, 189, 190,
/
#
# 11 LYS QG 11 LYS QE 3.31
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,
igr1= 160, 161,
igr2= 166, 167,
/
#
# 11 LYS QG 28 TRP HH2 4.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 421, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
igr1= 160, 161,
/
#
# 11 LYS QE 28 TRP HZ2 4.88
&rst
ixpk= 0, nxpk= 0, iat= -1, 419, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
igr1= 166, 167,
/
#
# 12 LEU HA 12 LEU QQD 5.15
&rst
ixpk= 0, nxpk= 0, iat= 177, -1, r1= 1.30, r2= 1.80, r3= 6.94, r4= 7.44,
igr2= 184, 185, 186, 188, 189, 190,
/
#
# 12 LEU HA 63 LEU QQD 7.05
&rst
ixpk= 0, nxpk= 0, iat= 177, -1, r1= 1.30, r2= 1.80, r3= 9.50, r4=10.00,
igr2=1040,1041,1042,1044,1045,1046,
/
#
# 12 LEU HB2 12 LEU QQD 5.34
&rst
ixpk= 0, nxpk= 0, iat= 179, -1, r1= 1.30, r2= 1.80, r3= 7.20, r4= 7.70,
igr2= 184, 185, 186, 188, 189, 190,
/
#
# 12 LEU QQD 13 ASN H 3.97
&rst
ixpk= 0, nxpk= 0, iat= -1, 194, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,
igr1= 184, 185, 186, 188, 189, 190,
/
#
# 12 LEU QQD 13 ASN HND1 4.16
&rst
ixpk= 0, nxpk= 0, iat= -1, 203, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr1= 184, 185, 186, 188, 189, 190,
/
#
# 12 LEU QQD 15 LEU H 7.55
&rst
ixpk= 0, nxpk= 0, iat= -1, 222, r1= 1.30, r2= 1.80, r3=10.18, r4=10.68,
igr1= 184, 185, 186, 188, 189, 190,
/
#
# 12 LEU QQD 15 LEU QB 6.38
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.65, r4=10.15,
igr1= 184, 185, 186, 188, 189, 190,
igr2= 226, 227,
/
#
# 12 LEU QQD 15 LEU HG 6.09
&rst
ixpk= 0, nxpk= 0, iat= -1, 229, r1= 1.30, r2= 1.80, r3= 8.21, r4= 8.71,
igr1= 184, 185, 186, 188, 189, 190,
/
#
# 12 LEU QQD 15 LEU QD2 6.37
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3=11.58, r4=12.08,
igr1= 184, 185, 186, 188, 189, 190,
igr2= 231, 232, 233, 235, 236, 237,
/
#
# 12 LEU QQD 42 MET QB 4.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
igr1= 184, 185, 186, 188, 189, 190,
igr2= 652, 653,
/
#
# 12 LEU QQD 43 TRP H 4.66
&rst
ixpk= 0, nxpk= 0, iat= -1, 665, r1= 1.30, r2= 1.80, r3= 6.28, r4= 6.78,
igr1= 184, 185, 186, 188, 189, 190,
/
#
# 12 LEU QQD 43 TRP HA 3.58
&rst
ixpk= 0, nxpk= 0, iat= -1, 667, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
igr1= 184, 185, 186, 188, 189, 190,
/
#
# 12 LEU QQD 43 TRP HB2 5.22
&rst
ixpk= 0, nxpk= 0, iat= -1, 669, r1= 1.30, r2= 1.80, r3= 7.04, r4= 7.54,
igr1= 184, 185, 186, 188, 189, 190,
/
#
# 12 LEU QQD 43 TRP HD1 3.37
&rst
ixpk= 0, nxpk= 0, iat= -1, 673, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
igr1= 184, 185, 186, 188, 189, 190,
/
#
# 12 LEU QQD 43 TRP HE1 3.71
&rst
ixpk= 0, nxpk= 0, iat= -1, 675, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,
igr1= 184, 185, 186, 188, 189, 190,
/
#
# 12 LEU QQD 46 TYR HA 5.44
&rst
ixpk= 0, nxpk= 0, iat= -1, 728, r1= 1.30, r2= 1.80, r3= 7.33, r4= 7.83,
igr1= 184, 185, 186, 188, 189, 190,
/
#
# 12 LEU QQD 46 TYR QB 3.61
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
igr1= 184, 185, 186, 188, 189, 190,
igr2= 730, 731,
/
#
# 12 LEU QQD 46 TYR HD 4.01
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
igr1= 184, 185, 186, 188, 189, 190,
igr2= 734, 743,
/
#
# 12 LEU QQD 46 TYR HE 4.28
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.48, r4= 6.98,
igr1= 184, 185, 186, 188, 189, 190,
igr2= 736, 741,
/
#
# 12 LEU QQD 47 MET QE 4.44
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
igr1= 184, 185, 186, 188, 189, 190,
igr2= 758, 759, 760,
/
#
# 12 LEU QQD 60 GLY H 4.14
&rst
ixpk= 0, nxpk= 0, iat= -1, 984, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr1= 184, 185, 186, 188, 189, 190,
/
#
# 12 LEU QQD 60 GLY HA3 3.72
&rst
ixpk= 0, nxpk= 0, iat= -1, 987, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
igr1= 184, 185, 186, 188, 189, 190,
/
#
# 12 LEU QQD 61 LEU H 7.64
&rst
ixpk= 0, nxpk= 0, iat= -1, 991, r1= 1.30, r2= 1.80, r3=10.30, r4=10.80,
igr1= 184, 185, 186, 188, 189, 190,
/
#
# 12 LEU QQD 63 LEU QB 6.38
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.65, r4=10.15,
igr1= 184, 185, 186, 188, 189, 190,
igr2=1035,1036,
/
#
# 12 LEU QQD 63 LEU QQD 7.16
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3=13.01, r4=13.51,
igr1= 184, 185, 186, 188, 189, 190,
igr2=1040,1041,1042,1044,1045,1046,
/
#
# 12 LEU QQD 83 PHE HE 5.33
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.06, r4= 8.56,
igr1= 184, 185, 186, 188, 189, 190,
igr2=1367,1371,
/
#
# 14 THR H 15 LEU QB 5.34
&rst
ixpk= 0, nxpk= 0, iat= 208, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2= 226, 227,
/
#
# 15 LEU QB 15 LEU QD2 3.28
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
igr1= 226, 227,
igr2= 231, 232, 233, 235, 236, 237,
/
#
# 15 LEU QB 16 GLU H 3.57
&rst
ixpk= 0, nxpk= 0, iat= -1, 241, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,
igr1= 226, 227,
/
#
# 15 LEU QB 59 LEU QQD 5.36
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.11, r4= 8.61,
igr1= 226, 227,
igr2= 974, 975, 976, 978, 979, 980,
/
#
# 15 LEU QD1 59 LEU QB 4.12
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.23, r4= 6.73,
igr1= 231, 232, 233, 235, 236, 237,
igr2= 969, 970,
/
#
# 16 GLU H 16 GLU QG 4.23
&rst
ixpk= 0, nxpk= 0, iat= 241, -1, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25,
igr2= 248, 249,
/
#
# 16 GLU H 59 LEU QB 4.81
&rst
ixpk= 0, nxpk= 0, iat= 241, -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr2= 969, 970,
/
#
# 16 GLU H 59 LEU QQD 6.2
&rst
ixpk= 0, nxpk= 0, iat= 241, -1, r1= 1.30, r2= 1.80, r3= 8.36, r4= 8.86,
igr2= 974, 975, 976, 978, 979, 980,
/
#
# 16 GLU HA 17 ASP QB 4.66
&rst
ixpk= 0, nxpk= 0, iat= 243, -1, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73,
igr2= 260, 261,
/
#
# 16 GLU HA 59 LEU QQD 5.43
&rst
ixpk= 0, nxpk= 0, iat= 243, -1, r1= 1.30, r2= 1.80, r3= 7.32, r4= 7.82,
igr2= 974, 975, 976, 978, 979, 980,
/
#
# 16 GLU HB3 18 SER QB 4.73
&rst
ixpk= 0, nxpk= 0, iat= 246, -1, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
igr2= 272, 273,
/
#
# 16 GLU QG 17 ASP H 3.80
&rst
ixpk= 0, nxpk= 0, iat= -1, 256, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,
igr1= 248, 249,
/
#
# 16 GLU QG 59 LEU QQD 6.55
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.91, r4=10.41,
igr1= 248, 249,
igr2= 974, 975, 976, 978, 979, 980,
/
#
# 17 ASP H 17 ASP QB 3.07
&rst
ixpk= 0, nxpk= 0, iat= 256, -1, r1= 1.30, r2= 1.80, r3= 3.45, r4= 3.95,
igr2= 260, 261,
/
#
# 17 ASP H 59 LEU QQD 5.42
&rst
ixpk= 0, nxpk= 0, iat= 256, -1, r1= 1.30, r2= 1.80, r3= 7.31, r4= 7.81,
igr2= 974, 975, 976, 978, 979, 980,
/
#
# 17 ASP HA 59 LEU QQD 5.48
&rst
ixpk= 0, nxpk= 0, iat= 258, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2= 974, 975, 976, 978, 979, 980,
/
#
# 17 ASP QB 18 SER H 4.12
&rst
ixpk= 0, nxpk= 0, iat= -1, 268, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
igr1= 260, 261,
/
#
# 17 ASP QB 59 LEU QQD 5.26
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.96, r4= 8.46,
igr1= 260, 261,
igr2= 974, 975, 976, 978, 979, 980,
/
#
# 18 SER H 22 ILE QG1 3.83
&rst
ixpk= 0, nxpk= 0, iat= 268, -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
igr2= 332, 333,
/
#
# 18 SER H 59 LEU QQD 6.31
&rst
ixpk= 0, nxpk= 0, iat= 268, -1, r1= 1.30, r2= 1.80, r3= 8.51, r4= 9.01,
igr2= 974, 975, 976, 978, 979, 980,
/
#
# 18 SER QB 19 GLN H 4.27
&rst
ixpk= 0, nxpk= 0, iat= -1, 279, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
igr1= 272, 273,
/
#
# 18 SER QB 20 GLU H 4.22
&rst
ixpk= 0, nxpk= 0, iat= -1, 296, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr1= 272, 273,
/
#
# 18 SER QB 20 GLU QB 5.01
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.31, r4= 6.81,
igr1= 272, 273,
igr2= 300, 301,
/
#
# 18 SER QB 21 SER H 4.17
&rst
ixpk= 0, nxpk= 0, iat= -1, 311, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
igr1= 272, 273,
/
#
# 19 GLN H 19 GLN QG 4.29
&rst
ixpk= 0, nxpk= 0, iat= 279, -1, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
igr2= 286, 287,
/
#
# 19 GLN H 20 GLU QB 5.06
&rst
ixpk= 0, nxpk= 0, iat= 279, -1, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
igr2= 300, 301,
/
#
# 19 GLN HA 19 GLN QE2 4.64
&rst
ixpk= 0, nxpk= 0, iat= 281, -1, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,
igr2= 291, 292,
/
#
# 19 GLN QG 20 GLU H 4.39
&rst
ixpk= 0, nxpk= 0, iat= -1, 296, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,
igr1= 286, 287,
/
#
# 20 GLU H 20 GLU QG 4.09
&rst
ixpk= 0, nxpk= 0, iat= 296, -1, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
igr2= 303, 304,
/
#
# 20 GLU HA 20 GLU QG 3.02
&rst
ixpk= 0, nxpk= 0, iat= 298, -1, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89,
igr2= 303, 304,
/
#
# 20 GLU QB 20 GLU QG 2.36
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47,
igr1= 300, 301,
igr2= 303, 304,
/
#
# 20 GLU QB 21 SER HA 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, 313, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1= 300, 301,
/
#
# 20 GLU QB 23 SER H 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, 341, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1= 300, 301,
/
#
# 20 GLU QG 21 SER H 3.77
&rst
ixpk= 0, nxpk= 0, iat= -1, 311, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
igr1= 303, 304,
/
#
# 22 ILE HA 63 LEU QQD 5.95
&rst
ixpk= 0, nxpk= 0, iat= 324, -1, r1= 1.30, r2= 1.80, r3= 8.02, r4= 8.52,
igr2=1040,1041,1042,1044,1045,1046,
/
#
# 22 ILE QG2 63 LEU QQD 5.62
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.10, r4= 9.60,
igr1= 328, 329, 330,
igr2=1040,1041,1042,1044,1045,1046,
/
#
# 22 ILE QG1 23 SER H 4.35
&rst
ixpk= 0, nxpk= 0, iat= -1, 341, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
igr1= 332, 333,
/
#
# 22 ILE QD1 59 LEU QB 4.03
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
igr1= 335, 336, 337,
igr2= 969, 970,
/
#
# 25 ALA H 27 LYS QG 4.82
&rst
ixpk= 0, nxpk= 0, iat= 363, -1, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,
igr2= 391, 392,
/
#
# 25 ALA H 63 LEU QQD 6.54
&rst
ixpk= 0, nxpk= 0, iat= 363, -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
igr2=1040,1041,1042,1044,1045,1046,
/
#
# 25 ALA HA 28 TRP QB 3.70
&rst
ixpk= 0, nxpk= 0, iat= 365, -1, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65,
igr2= 410, 411,
/
#
# 25 ALA HA 63 LEU QQD 6.49
&rst
ixpk= 0, nxpk= 0, iat= 365, -1, r1= 1.30, r2= 1.80, r3= 8.75, r4= 9.25,
igr2=1040,1041,1042,1044,1045,1046,
/
#
# 25 ALA QB 28 TRP QB 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.20, r4= 7.70,
igr1= 367, 368, 369,
igr2= 410, 411,
/
#
# 25 ALA QB 63 LEU QQD 5.08
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.22, r4= 8.72,
igr1= 367, 368, 369,
igr2=1040,1041,1042,1044,1045,1046,
/
#
# 26 SER H 27 LYS QG 4.00
&rst
ixpk= 0, nxpk= 0, iat= 373, -1, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
igr2= 391, 392,
/
#
# 26 SER H 63 LEU QQD 5.58
&rst
ixpk= 0, nxpk= 0, iat= 373, -1, r1= 1.30, r2= 1.80, r3= 7.52, r4= 8.02,
igr2=1040,1041,1042,1044,1045,1046,
/
#
# 26 SER H 66 HIS QB 5.34
&rst
ixpk= 0, nxpk= 0, iat= 373, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2=1085,1086,
/
#
# 27 LYS HA 27 LYS QG 3.53
&rst
ixpk= 0, nxpk= 0, iat= 386, -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
igr2= 391, 392,
/
#
# 27 LYS HA 30 LEU QQD 5.09
&rst
ixpk= 0, nxpk= 0, iat= 386, -1, r1= 1.30, r2= 1.80, r3= 6.86, r4= 7.36,
igr2= 458, 459, 460, 462, 463, 464,
/
#
# 27 LYS HA 31 LEU QQD 6.41
&rst
ixpk= 0, nxpk= 0, iat= 386, -1, r1= 1.30, r2= 1.80, r3= 8.64, r4= 9.14,
igr2= 477, 478, 479, 481, 482, 483,
/
#
# 27 LYS QB 27 LYS QE 4.12
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
igr1= 388, 389,
igr2= 397, 398,
/
#
# 27 LYS QB 28 TRP H 3.30
&rst
ixpk= 0, nxpk= 0, iat= -1, 406, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40,
igr1= 388, 389,
/
#
# 27 LYS QB 30 LEU QQD 6.76
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3=10.23, r4=10.73,
igr1= 388, 389,
igr2= 458, 459, 460, 462, 463, 464,
/
#
# 27 LYS QG 28 TRP H 3.80
&rst
ixpk= 0, nxpk= 0, iat= -1, 406, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,
igr1= 391, 392,
/
#
# 27 LYS QG 28 TRP HA 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, 408, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1= 391, 392,
/
#
# 27 LYS QD 31 LEU QQD 6.76
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3=10.23, r4=10.73,
igr1= 394, 395,
igr2= 477, 478, 479, 481, 482, 483,
/
#
# 28 TRP HA 31 LEU QQD 5.61
&rst
ixpk= 0, nxpk= 0, iat= 408, -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
igr2= 477, 478, 479, 481, 482, 483,
/
#
# 28 TRP QB 28 TRP HD1 3.35
&rst
ixpk= 0, nxpk= 0, iat= -1, 414, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,
igr1= 410, 411,
/
#
# 28 TRP QB 28 TRP HE3 3.58
&rst
ixpk= 0, nxpk= 0, iat= -1, 425, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,
igr1= 410, 411,
/
#
# 28 TRP QB 28 TRP HE1 4.57
&rst
ixpk= 0, nxpk= 0, iat= -1, 416, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
igr1= 410, 411,
/
#
# 28 TRP QB 29 LEU H 3.17
&rst
ixpk= 0, nxpk= 0, iat= -1, 430, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06,
igr1= 410, 411,
/
#
# 28 TRP QB 31 LEU HB2 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, 472, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1= 410, 411,
/
#
# 28 TRP QB 31 LEU QQD 7.4
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3=11.20, r4=11.70,
igr1= 410, 411,
igr2= 477, 478, 479, 481, 482, 483,
/
#
# 28 TRP HD1 31 LEU QQD 6.85
&rst
ixpk= 0, nxpk= 0, iat= 414, -1, r1= 1.30, r2= 1.80, r3= 9.23, r4= 9.73,
igr2= 477, 478, 479, 481, 482, 483,
/
#
# 28 TRP HE3 29 LEU QQD 6.23
&rst
ixpk= 0, nxpk= 0, iat= 425, -1, r1= 1.30, r2= 1.80, r3= 8.40, r4= 8.90,
igr2= 439, 440, 441, 443, 444, 445,
/
#
# 28 TRP HZ3 29 LEU QQD 5.84
&rst
ixpk= 0, nxpk= 0, iat= 423, -1, r1= 1.30, r2= 1.80, r3= 7.87, r4= 8.37,
igr2= 439, 440, 441, 443, 444, 445,
/
#
# 29 LEU H 29 LEU QQD 6.3
&rst
ixpk= 0, nxpk= 0, iat= 430, -1, r1= 1.30, r2= 1.80, r3= 8.49, r4= 8.99,
igr2= 439, 440, 441, 443, 444, 445,
/
#
# 29 LEU H 31 LEU QQD 7.04
&rst
ixpk= 0, nxpk= 0, iat= 430, -1, r1= 1.30, r2= 1.80, r3= 9.49, r4= 9.99,
igr2= 477, 478, 479, 481, 482, 483,
/
#
# 29 LEU H 67 VAL QQG 5.44
&rst
ixpk= 0, nxpk= 0, iat= 430, -1, r1= 1.30, r2= 1.80, r3= 7.33, r4= 7.83,
igr2=1104,1105,1106,1108,1109,1110,
/
#
# 29 LEU HA 29 LEU QQD 5.12
&rst
ixpk= 0, nxpk= 0, iat= 432, -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr2= 439, 440, 441, 443, 444, 445,
/
#
# 29 LEU HA 31 LEU QQD 7.64
&rst
ixpk= 0, nxpk= 0, iat= 432, -1, r1= 1.30, r2= 1.80, r3=10.30, r4=10.80,
igr2= 477, 478, 479, 481, 482, 483,
/
#
# 29 LEU HB2 63 LEU QQD 7.19
&rst
ixpk= 0, nxpk= 0, iat= 434, -1, r1= 1.30, r2= 1.80, r3= 9.69, r4=10.19,
igr2=1040,1041,1042,1044,1045,1046,
/
#
# 29 LEU HB3 29 LEU QQD 5.29
&rst
ixpk= 0, nxpk= 0, iat= 435, -1, r1= 1.30, r2= 1.80, r3= 7.13, r4= 7.63,
igr2= 439, 440, 441, 443, 444, 445,
/
#
# 29 LEU HB3 39 VAL QQG 5.44
&rst
ixpk= 0, nxpk= 0, iat= 435, -1, r1= 1.30, r2= 1.80, r3= 7.33, r4= 7.83,
igr2= 613, 614, 615, 617, 618, 619,
/
#
# 29 LEU HG 39 VAL QQG 3.57
&rst
ixpk= 0, nxpk= 0, iat= 437, -1, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31,
igr2= 613, 614, 615, 617, 618, 619,
/
#
# 29 LEU HG 67 VAL QQG 4.48
&rst
ixpk= 0, nxpk= 0, iat= 437, -1, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54,
igr2=1104,1105,1106,1108,1109,1110,
/
#
# 29 LEU QQD 30 LEU H 5.78
&rst
ixpk= 0, nxpk= 0, iat= -1, 449, r1= 1.30, r2= 1.80, r3= 7.79, r4= 8.29,
igr1= 439, 440, 441, 443, 444, 445,
/
#
# 29 LEU QQD 30 LEU HA 5.48
&rst
ixpk= 0, nxpk= 0, iat= -1, 451, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1= 439, 440, 441, 443, 444, 445,
/
#
# 29 LEU QQD 30 LEU HB2 6.8
&rst
ixpk= 0, nxpk= 0, iat= -1, 453, r1= 1.30, r2= 1.80, r3= 9.17, r4= 9.67,
igr1= 439, 440, 441, 443, 444, 445,
/
#
# 29 LEU QQD 31 LEU H 6.87
&rst
ixpk= 0, nxpk= 0, iat= -1, 468, r1= 1.30, r2= 1.80, r3= 9.26, r4= 9.76,
igr1= 439, 440, 441, 443, 444, 445,
/
#
# 29 LEU QQD 32 GLN H 3.98
&rst
ixpk= 0, nxpk= 0, iat= -1, 487, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr1= 439, 440, 441, 443, 444, 445,
/
#
# 29 LEU QQD 32 GLN HB2 4.25
&rst
ixpk= 0, nxpk= 0, iat= -1, 491, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23,
igr1= 439, 440, 441, 443, 444, 445,
/
#
# 29 LEU QQD 32 GLN HG2 3.39
&rst
ixpk= 0, nxpk= 0, iat= -1, 494, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,
igr1= 439, 440, 441, 443, 444, 445,
/
#
# 29 LEU QQD 32 GLN HNE1 4.46
&rst
ixpk= 0, nxpk= 0, iat= -1, 499, r1= 1.30, r2= 1.80, r3= 6.51, r4= 7.01,
igr1= 439, 440, 441, 443, 444, 445,
/
#
# 29 LEU QQD 32 GLN HNE2 4.88
&rst
ixpk= 0, nxpk= 0, iat= -1, 500, r1= 1.30, r2= 1.80, r3= 6.58, r4= 7.08,
igr1= 439, 440, 441, 443, 444, 445,
/
#
# 29 LEU QQD 35 ASP H 4.81
&rst
ixpk= 0, nxpk= 0, iat= -1, 549, r1= 1.30, r2= 1.80, r3= 6.48, r4= 6.98,
igr1= 439, 440, 441, 443, 444, 445,
/
#
# 29 LEU QQD 35 ASP QB 4.21
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.37, r4= 6.87,
igr1= 439, 440, 441, 443, 444, 445,
igr2= 553, 554,
/
#
# 29 LEU QQD 36 ALA H 4.65
&rst
ixpk= 0, nxpk= 0, iat= -1, 561, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
igr1= 439, 440, 441, 443, 444, 445,
/
#
# 29 LEU QQD 36 ALA QB 4.72
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
igr1= 439, 440, 441, 443, 444, 445,
igr2= 565, 566, 567,
/
#
# 29 LEU QQD 39 VAL HB 4.55
&rst
ixpk= 0, nxpk= 0, iat= -1, 611, r1= 1.30, r2= 1.80, r3= 6.13, r4= 6.63,
igr1= 439, 440, 441, 443, 444, 445,
/
#
# 29 LEU QQD 39 VAL QQG 2.63
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
igr1= 439, 440, 441, 443, 444, 445,
igr2= 613, 614, 615, 617, 618, 619,
/
#
# 29 LEU QQD 42 MET QE 5.12
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.29, r4= 8.79,
igr1= 439, 440, 441, 443, 444, 445,
igr2= 659, 660, 661,
/
#
# 29 LEU QQD 67 VAL HB 3.71
&rst
ixpk= 0, nxpk= 0, iat= -1,1102, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,
igr1= 439, 440, 441, 443, 444, 445,
/
#
# 29 LEU QQD 67 VAL QQG 3.34
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
igr1= 439, 440, 441, 443, 444, 445,
igr2=1104,1105,1106,1108,1109,1110,
/
#
# 29 LEU QQD 79 PHE HD 3.74
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr1= 439, 440, 441, 443, 444, 445,
igr2=1305,1313,
/
#
# 29 LEU QQD 79 PHE HE 3.09
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
igr1= 439, 440, 441, 443, 444, 445,
igr2=1307,1311,
/
#
# 29 LEU QQD 79 PHE HZ 3.52
&rst
ixpk= 0, nxpk= 0, iat= -1,1309, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr1= 439, 440, 441, 443, 444, 445,
/
#
# 29 LEU QQD 83 PHE HE 3.52
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
igr1= 439, 440, 441, 443, 444, 445,
igr2=1367,1371,
/
#
# 30 LEU H 67 VAL QQG 5.03
&rst
ixpk= 0, nxpk= 0, iat= 449, -1, r1= 1.30, r2= 1.80, r3= 6.78, r4= 7.28,
igr2=1104,1105,1106,1108,1109,1110,
/
#
# 30 LEU HA 30 LEU QQD 5.16
&rst
ixpk= 0, nxpk= 0, iat= 451, -1, r1= 1.30, r2= 1.80, r3= 6.96, r4= 7.46,
igr2= 458, 459, 460, 462, 463, 464,
/
#
# 30 LEU HA 67 VAL QQG 4.66
&rst
ixpk= 0, nxpk= 0, iat= 451, -1, r1= 1.30, r2= 1.80, r3= 6.28, r4= 6.78,
igr2=1104,1105,1106,1108,1109,1110,
/
#
# 30 LEU HB2 67 VAL QQG 5.29
&rst
ixpk= 0, nxpk= 0, iat= 453, -1, r1= 1.30, r2= 1.80, r3= 7.13, r4= 7.63,
igr2=1104,1105,1106,1108,1109,1110,
/
#
# 30 LEU HB3 30 LEU QQD 5.12
&rst
ixpk= 0, nxpk= 0, iat= 454, -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr2= 458, 459, 460, 462, 463, 464,
/
#
# 30 LEU HB3 31 LEU QQD 5.27
&rst
ixpk= 0, nxpk= 0, iat= 454, -1, r1= 1.30, r2= 1.80, r3= 7.10, r4= 7.60,
igr2= 477, 478, 479, 481, 482, 483,
/
#
# 30 LEU HG 67 VAL QQG 4.75
&rst
ixpk= 0, nxpk= 0, iat= 456, -1, r1= 1.30, r2= 1.80, r3= 6.40, r4= 6.90,
igr2=1104,1105,1106,1108,1109,1110,
/
#
# 30 LEU QQD 31 LEU H 6.64
&rst
ixpk= 0, nxpk= 0, iat= -1, 468, r1= 1.30, r2= 1.80, r3= 8.95, r4= 9.45,
igr1= 458, 459, 460, 462, 463, 464,
/
#
# 30 LEU QQD 31 LEU QQD 8.53
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3=15.50, r4=16.00,
igr1= 458, 459, 460, 462, 463, 464,
igr2= 477, 478, 479, 481, 482, 483,
/
#
# 30 LEU QQD 33 TYR H 5.28
&rst
ixpk= 0, nxpk= 0, iat= -1, 504, r1= 1.30, r2= 1.80, r3= 7.12, r4= 7.62,
igr1= 458, 459, 460, 462, 463, 464,
/
#
# 30 LEU QQD 67 VAL HA 3.73
&rst
ixpk= 0, nxpk= 0, iat= -1,1100, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
igr1= 458, 459, 460, 462, 463, 464,
/
#
# 30 LEU QQD 67 VAL QQG 3.36
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
igr1= 458, 459, 460, 462, 463, 464,
igr2=1104,1105,1106,1108,1109,1110,
/
#
# 30 LEU QQD 70 GLN QB 3.33
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr1= 458, 459, 460, 462, 463, 464,
igr2=1151,1152,
/
#
# 30 LEU QQD 70 GLN QG 4.08
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 458, 459, 460, 462, 463, 464,
igr2=1154,1155,
/
#
# 30 LEU QQD 70 GLN QE2 3.93
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.95, r4= 6.45,
igr1= 458, 459, 460, 462, 463, 464,
igr2=1159,1160,
/
#
# 30 LEU QQD 71 ALA HA 3.53
&rst
ixpk= 0, nxpk= 0, iat= -1,1166, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
igr1= 458, 459, 460, 462, 463, 464,
/
#
# 30 LEU QQD 71 ALA QB 3.22
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,
igr1= 458, 459, 460, 462, 463, 464,
igr2=1168,1169,1170,
/
#
# 30 LEU QQD 74 GLN HNE1 3.29
&rst
ixpk= 0, nxpk= 0, iat= -1,1215, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
igr1= 458, 459, 460, 462, 463, 464,
/
#
# 30 LEU QQD 74 GLN HNE2 2.84
&rst
ixpk= 0, nxpk= 0, iat= -1,1216, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,
igr1= 458, 459, 460, 462, 463, 464,
/
#
# 30 LEU QQD 76 ILE QG2 3.94
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.38, r4= 6.88,
igr1= 458, 459, 460, 462, 463, 464,
igr2=1248,1249,1250,
/
#
# 31 LEU H 31 LEU QQD 5.17
&rst
ixpk= 0, nxpk= 0, iat= 468, -1, r1= 1.30, r2= 1.80, r3= 6.97, r4= 7.47,
igr2= 477, 478, 479, 481, 482, 483,
/
#
# 31 LEU HA 31 LEU QQD 4.92
&rst
ixpk= 0, nxpk= 0, iat= 470, -1, r1= 1.30, r2= 1.80, r3= 6.63, r4= 7.13,
igr2= 477, 478, 479, 481, 482, 483,
/
#
# 31 LEU HB3 31 LEU QQD 5.08
&rst
ixpk= 0, nxpk= 0, iat= 473, -1, r1= 1.30, r2= 1.80, r3= 6.85, r4= 7.35,
igr2= 477, 478, 479, 481, 482, 483,
/
#
# 31 LEU QQD 32 GLN H 4.21
&rst
ixpk= 0, nxpk= 0, iat= -1, 487, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
igr1= 477, 478, 479, 481, 482, 483,
/
#
# 31 LEU QQD 32 GLN HNE1 4.16
&rst
ixpk= 0, nxpk= 0, iat= -1, 499, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr1= 477, 478, 479, 481, 482, 483,
/
#
# 31 LEU QQD 32 GLN HNE2 4.69
&rst
ixpk= 0, nxpk= 0, iat= -1, 500, r1= 1.30, r2= 1.80, r3= 6.32, r4= 6.82,
igr1= 477, 478, 479, 481, 482, 483,
/
#
# 33 TYR HD 78 GLN QG 3.89
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,
igr1= 512, 521,
igr2=1287,1288,
/
#
# 34 ARG H 34 ARG QB 3.41
&rst
ixpk= 0, nxpk= 0, iat= 525, -1, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,
igr2= 529, 530,
/
#
# 34 ARG H 34 ARG QG 3.17
&rst
ixpk= 0, nxpk= 0, iat= 525, -1, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06,
igr2= 532, 533,
/
#
# 34 ARG H 34 ARG QD 3.54
&rst
ixpk= 0, nxpk= 0, iat= 525, -1, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47,
igr2= 535, 536,
/
#
# 34 ARG H 35 ASP QB 5.17
&rst
ixpk= 0, nxpk= 0, iat= 525, -1, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
igr2= 553, 554,
/
#
# 34 ARG HA 34 ARG QG 3.69
&rst
ixpk= 0, nxpk= 0, iat= 527, -1, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,
igr2= 532, 533,
/
#
# 34 ARG HA 34 ARG QD 4.16
&rst
ixpk= 0, nxpk= 0, iat= 527, -1, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
igr2= 535, 536,
/
#
# 34 ARG HA 78 GLN QG 5.34
&rst
ixpk= 0, nxpk= 0, iat= 527, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2=1287,1288,
/
#
# 34 ARG QB 34 ARG QD 3.03
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,
igr1= 529, 530,
igr2= 535, 536,
/
#
# 34 ARG QB 35 ASP H 3.71
&rst
ixpk= 0, nxpk= 0, iat= -1, 549, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
igr1= 529, 530,
/
#
# 34 ARG QB 35 ASP HA 4.34
&rst
ixpk= 0, nxpk= 0, iat= -1, 551, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,
igr1= 529, 530,
/
#
# 35 ASP H 35 ASP QB 3.07
&rst
ixpk= 0, nxpk= 0, iat= 549, -1, r1= 1.30, r2= 1.80, r3= 3.45, r4= 3.95,
igr2= 553, 554,
/
#
# 35 ASP H 39 VAL QQG 4.92
&rst
ixpk= 0, nxpk= 0, iat= 549, -1, r1= 1.30, r2= 1.80, r3= 6.63, r4= 7.13,
igr2= 613, 614, 615, 617, 618, 619,
/
#
# 35 ASP HA 39 VAL QQG 4.56
&rst
ixpk= 0, nxpk= 0, iat= 551, -1, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
igr2= 613, 614, 615, 617, 618, 619,
/
#
# 35 ASP QB 36 ALA H 3.97
&rst
ixpk= 0, nxpk= 0, iat= -1, 561, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
igr1= 553, 554,
/
#
# 35 ASP QB 36 ALA HA 5.02
&rst
ixpk= 0, nxpk= 0, iat= -1, 563, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr1= 553, 554,
/
#
# 35 ASP QB 38 LYS H 4.29
&rst
ixpk= 0, nxpk= 0, iat= -1, 585, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
igr1= 553, 554,
/
#
# 35 ASP QB 38 LYS QB 4.03
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
igr1= 553, 554,
igr2= 589, 590,
/
#
# 35 ASP QB 39 VAL H 3.86
&rst
ixpk= 0, nxpk= 0, iat= -1, 607, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,
igr1= 553, 554,
/
#
# 35 ASP QB 39 VAL QQG 4.12
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.23, r4= 6.73,
igr1= 553, 554,
igr2= 613, 614, 615, 617, 618, 619,
/
#
# 36 ALA H 39 VAL QQG 4.62
&rst
ixpk= 0, nxpk= 0, iat= 561, -1, r1= 1.30, r2= 1.80, r3= 6.23, r4= 6.73,
igr2= 613, 614, 615, 617, 618, 619,
/
#
# 36 ALA QB 37 PRO QG 4.04
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,
igr1= 565, 566, 567,
igr2= 575, 576,
/
#
# 36 ALA QB 78 GLN QG 3.88
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73,
igr1= 565, 566, 567,
igr2=1287,1288,
/
#
# 37 PRO QG 38 LYS H 3.66
&rst
ixpk= 0, nxpk= 0, iat= -1, 585, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
igr1= 575, 576,
/
#
# 38 LYS H 38 LYS QG 4.01
&rst
ixpk= 0, nxpk= 0, iat= 585, -1, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
igr2= 592, 593,
/
#
# 38 LYS H 39 VAL QQG 4.26
&rst
ixpk= 0, nxpk= 0, iat= 585, -1, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
igr2= 613, 614, 615, 617, 618, 619,
/
#
# 38 LYS HA 38 LYS QG 3.28
&rst
ixpk= 0, nxpk= 0, iat= 587, -1, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18,
igr2= 592, 593,
/
#
# 38 LYS HA 41 GLU QG 4.36
&rst
ixpk= 0, nxpk= 0, iat= 587, -1, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
igr2= 640, 641,
/
#
# 38 LYS HA 42 MET QG 5.26
&rst
ixpk= 0, nxpk= 0, iat= 587, -1, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
igr2= 655, 656,
/
#
# 38 LYS QB 39 VAL QQG 4.46
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.75, r4= 7.25,
igr1= 589, 590,
igr2= 613, 614, 615, 617, 618, 619,
/
#
# 38 LYS QG 38 LYS QE 3.09
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,
igr1= 592, 593,
igr2= 598, 599,
/
#
# 38 LYS QG 39 VAL QQG 5.28
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.99, r4= 8.49,
igr1= 592, 593,
igr2= 613, 614, 615, 617, 618, 619,
/
#
# 38 LYS QG 42 MET QG 4.10
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67,
igr1= 592, 593,
igr2= 655, 656,
/
#
# 38 LYS QG 42 MET QE 3.32
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
igr1= 592, 593,
igr2= 659, 660, 661,
/
#
# 39 VAL H 39 VAL QQG 5.15
&rst
ixpk= 0, nxpk= 0, iat= 607, -1, r1= 1.30, r2= 1.80, r3= 6.94, r4= 7.44,
igr2= 613, 614, 615, 617, 618, 619,
/
#
# 39 VAL H 42 MET QG 4.60
&rst
ixpk= 0, nxpk= 0, iat= 607, -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
igr2= 655, 656,
/
#
# 39 VAL HA 39 VAL QQG 5.14
&rst
ixpk= 0, nxpk= 0, iat= 609, -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
igr2= 613, 614, 615, 617, 618, 619,
/
#
# 39 VAL HA 42 MET QG 4.55
&rst
ixpk= 0, nxpk= 0, iat= 609, -1, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,
igr2= 655, 656,
/
#
# 39 VAL QQG 40 ALA H 5.42
&rst
ixpk= 0, nxpk= 0, iat= -1, 623, r1= 1.30, r2= 1.80, r3= 7.31, r4= 7.81,
igr1= 613, 614, 615, 617, 618, 619,
/
#
# 39 VAL QQG 40 ALA HA 5.98
&rst
ixpk= 0, nxpk= 0, iat= -1, 625, r1= 1.30, r2= 1.80, r3= 8.06, r4= 8.56,
igr1= 613, 614, 615, 617, 618, 619,
/
#
# 39 VAL QQG 41 GLU H 6.62
&rst
ixpk= 0, nxpk= 0, iat= -1, 633, r1= 1.30, r2= 1.80, r3= 8.92, r4= 9.42,
igr1= 613, 614, 615, 617, 618, 619,
/
#
# 39 VAL QQG 42 MET H 7.64
&rst
ixpk= 0, nxpk= 0, iat= -1, 648, r1= 1.30, r2= 1.80, r3=10.30, r4=10.80,
igr1= 613, 614, 615, 617, 618, 619,
/
#
# 39 VAL QQG 42 MET QE 6.11
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.89, r4=10.39,
igr1= 613, 614, 615, 617, 618, 619,
igr2= 659, 660, 661,
/
#
# 39 VAL QQG 43 TRP H 6.76
&rst
ixpk= 0, nxpk= 0, iat= -1, 665, r1= 1.30, r2= 1.80, r3= 9.11, r4= 9.61,
igr1= 613, 614, 615, 617, 618, 619,
/
#
# 39 VAL QQG 79 PHE HD 6.2
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.38, r4= 9.88,
igr1= 613, 614, 615, 617, 618, 619,
igr2=1305,1313,
/
#
# 39 VAL QQG 79 PHE HE 5.71
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.64, r4= 9.14,
igr1= 613, 614, 615, 617, 618, 619,
igr2=1307,1311,
/
#
# 39 VAL QQG 83 PHE H 7.4
&rst
ixpk= 0, nxpk= 0, iat= -1,1357, r1= 1.30, r2= 1.80, r3= 9.98, r4=10.48,
igr1= 613, 614, 615, 617, 618, 619,
/
#
# 39 VAL QQG 83 PHE HE 5.72
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.65, r4= 9.15,
igr1= 613, 614, 615, 617, 618, 619,
igr2=1367,1371,
/
#
# 39 VAL QQG 83 PHE HZ 5.58
&rst
ixpk= 0, nxpk= 0, iat= -1,1369, r1= 1.30, r2= 1.80, r3= 7.52, r4= 8.02,
igr1= 613, 614, 615, 617, 618, 619,
/
#
# 40 ALA QB 82 SER QB 3.36
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
igr1= 627, 628, 629,
igr2=1350,1351,
/
#
# 41 GLU H 42 MET QG 4.47
&rst
ixpk= 0, nxpk= 0, iat= 633, -1, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
igr2= 655, 656,
/
#
# 41 GLU HA 41 GLU QG 3.05
&rst
ixpk= 0, nxpk= 0, iat= 635, -1, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92,
igr2= 640, 641,
/
#
# 41 GLU HA 42 MET QG 5.34
&rst
ixpk= 0, nxpk= 0, iat= 635, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2= 655, 656,
/
#
# 41 GLU HA 44 LYS QE 3.91
&rst
ixpk= 0, nxpk= 0, iat= 635, -1, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,
igr2= 702, 703,
/
#
# 41 GLU HA 45 GLU QG 4.84
&rst
ixpk= 0, nxpk= 0, iat= 635, -1, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
igr2= 718, 719,
/
#
# 41 GLU QB 42 MET QG 4.12
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
igr1= 637, 638,
igr2= 655, 656,
/
#
# 41 GLU QG 42 MET H 3.39
&rst
ixpk= 0, nxpk= 0, iat= -1, 648, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,
igr1= 640, 641,
/
#
# 41 GLU QG 42 MET HA 4.49
&rst
ixpk= 0, nxpk= 0, iat= -1, 650, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr1= 640, 641,
/
#
# 41 GLU QG 42 MET QG 4.65
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
igr1= 640, 641,
igr2= 655, 656,
/
#
# 42 MET H 42 MET QB 3.32
&rst
ixpk= 0, nxpk= 0, iat= 648, -1, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23,
igr2= 652, 653,
/
#
# 42 MET H 42 MET QG 3.13
&rst
ixpk= 0, nxpk= 0, iat= 648, -1, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01,
igr2= 655, 656,
/
#
# 42 MET HA 42 MET QG 3.49
&rst
ixpk= 0, nxpk= 0, iat= 650, -1, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
igr2= 655, 656,
/
#
# 42 MET HA 45 GLU QG 4.03
&rst
ixpk= 0, nxpk= 0, iat= 650, -1, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
igr2= 718, 719,
/
#
# 42 MET QB 43 TRP H 3.54
&rst
ixpk= 0, nxpk= 0, iat= -1, 665, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47,
igr1= 652, 653,
/
#
# 42 MET QB 45 GLU QG 5.18
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.53, r4= 7.03,
igr1= 652, 653,
igr2= 718, 719,
/
#
# 42 MET QG 42 MET QE 2.93
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
igr1= 655, 656,
igr2= 659, 660, 661,
/
#
# 42 MET QG 43 TRP H 4.01
&rst
ixpk= 0, nxpk= 0, iat= -1, 665, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
igr1= 655, 656,
/
#
# 43 TRP HZ2 61 LEU QQD 6.2
&rst
ixpk= 0, nxpk= 0, iat= 678, -1, r1= 1.30, r2= 1.80, r3= 8.36, r4= 8.86,
igr2=1000,1001,1002,1004,1005,1006,
/
#
# 43 TRP HH2 61 LEU QQD 6.54
&rst
ixpk= 0, nxpk= 0, iat= 680, -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
igr2=1000,1001,1002,1004,1005,1006,
/
#
# 43 TRP HH2 91 LEU QQD 5.71
&rst
ixpk= 0, nxpk= 0, iat= 680, -1, r1= 1.30, r2= 1.80, r3= 7.70, r4= 8.20,
igr2=1482,1483,1484,1486,1487,1488,
/
#
# 44 LYS H 44 LYS QG 4.40
&rst
ixpk= 0, nxpk= 0, iat= 689, -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
igr2= 696, 697,
/
#
# 44 LYS H 44 LYS QE 4.66
&rst
ixpk= 0, nxpk= 0, iat= 689, -1, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73,
igr2= 702, 703,
/
#
# 44 LYS H 45 GLU QG 4.78
&rst
ixpk= 0, nxpk= 0, iat= 689, -1, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr2= 718, 719,
/
#
# 44 LYS HA 44 LYS QG 3.73
&rst
ixpk= 0, nxpk= 0, iat= 691, -1, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,
igr2= 696, 697,
/
#
# 44 LYS HA 44 LYS QD 4.33
&rst
ixpk= 0, nxpk= 0, iat= 691, -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
igr2= 699, 700,
/
#
# 44 LYS HA 48 LEU QQD 6.18
&rst
ixpk= 0, nxpk= 0, iat= 691, -1, r1= 1.30, r2= 1.80, r3= 8.33, r4= 8.83,
igr2= 773, 774, 775, 777, 778, 779,
/
#
# 44 LYS HB2 44 LYS QE 4.15
&rst
ixpk= 0, nxpk= 0, iat= 693, -1, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
igr2= 702, 703,
/
#
# 44 LYS HB2 48 LEU QQD 6.5
&rst
ixpk= 0, nxpk= 0, iat= 693, -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
igr2= 773, 774, 775, 777, 778, 779,
/
#
# 44 LYS HB3 44 LYS QE 4.30
&rst
ixpk= 0, nxpk= 0, iat= 694, -1, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
igr2= 702, 703,
/
#
# 44 LYS HB3 45 GLU QG 4.73
&rst
ixpk= 0, nxpk= 0, iat= 694, -1, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
igr2= 718, 719,
/
#
# 44 LYS QG 44 LYS QE 3.32
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
igr1= 696, 697,
igr2= 702, 703,
/
#
# 44 LYS QG 45 GLU H 3.57
&rst
ixpk= 0, nxpk= 0, iat= -1, 711, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,
igr1= 696, 697,
/
#
# 44 LYS QG 45 GLU HA 4.14
&rst
ixpk= 0, nxpk= 0, iat= -1, 713, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
igr1= 696, 697,
/
#
# 44 LYS QG 45 GLU QG 4.76
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr1= 696, 697,
igr2= 718, 719,
/
#
# 44 LYS QG 47 MET H 5.02
&rst
ixpk= 0, nxpk= 0, iat= -1, 747, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr1= 696, 697,
/
#
# 44 LYS QG 48 LEU H 4.21
&rst
ixpk= 0, nxpk= 0, iat= -1, 764, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
igr1= 696, 697,
/
#
# 44 LYS QG 48 LEU HG 4.84
&rst
ixpk= 0, nxpk= 0, iat= -1, 771, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
igr1= 696, 697,
/
#
# 44 LYS QG 48 LEU QQD 5.17
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.82, r4= 8.32,
igr1= 696, 697,
igr2= 773, 774, 775, 777, 778, 779,
/
#
# 44 LYS QG 49 ARG H 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, 783, r1= 1.30, r2= 1.80, r3= 6.19, r4= 6.69,
igr1= 696, 697,
/
#
# 44 LYS QG 86 VAL HA 5.12
&rst
ixpk= 0, nxpk= 0, iat= -1,1408, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
igr1= 696, 697,
/
#
# 44 LYS QG 86 VAL HB 4.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1410, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
igr1= 696, 697,
/
#
# 44 LYS QG 90 VAL HA 5.18
&rst
ixpk= 0, nxpk= 0, iat= -1,1459, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
igr1= 696, 697,
/
#
# 44 LYS QD 45 GLU H 4.54
&rst
ixpk= 0, nxpk= 0, iat= -1, 711, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
igr1= 699, 700,
/
#
# 44 LYS QD 45 GLU QG 4.76
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr1= 699, 700,
igr2= 718, 719,
/
#
# 44 LYS QD 48 LEU QQD 5.52
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.35, r4= 8.85,
igr1= 699, 700,
igr2= 773, 774, 775, 777, 778, 779,
/
#
# 44 LYS QD 86 VAL HA 3.98
&rst
ixpk= 0, nxpk= 0, iat= -1,1408, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
igr1= 699, 700,
/
#
# 44 LYS QD 86 VAL HB 4.49
&rst
ixpk= 0, nxpk= 0, iat= -1,1410, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr1= 699, 700,
/
#
# 44 LYS QE 45 GLU H 4.15
&rst
ixpk= 0, nxpk= 0, iat= -1, 711, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
igr1= 702, 703,
/
#
# 44 LYS QE 45 GLU HA 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, 713, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1= 702, 703,
/
#
# 44 LYS QE 45 GLU QG 4.40
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
igr1= 702, 703,
igr2= 718, 719,
/
#
# 44 LYS QE 48 LEU QQD 5.98
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.05, r4= 9.55,
igr1= 702, 703,
igr2= 773, 774, 775, 777, 778, 779,
/
#
# 44 LYS QE 86 VAL H 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1,1406, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1= 702, 703,
/
#
# 44 LYS QE 86 VAL HA 4.86
&rst
ixpk= 0, nxpk= 0, iat= -1,1408, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
igr1= 702, 703,
/
#
# 44 LYS QE 86 VAL HB 4.57
&rst
ixpk= 0, nxpk= 0, iat= -1,1410, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
igr1= 702, 703,
/
#
# 44 LYS QE 89 GLU H 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1,1442, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1= 702, 703,
/
#
# 44 LYS QE 89 GLU QG 4.39
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03,
igr1= 702, 703,
igr2=1449,1450,
/
#
# 45 GLU H 45 GLU QG 3.25
&rst
ixpk= 0, nxpk= 0, iat= 711, -1, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15,
igr2= 718, 719,
/
#
# 45 GLU H 48 LEU QQD 6.54
&rst
ixpk= 0, nxpk= 0, iat= 711, -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
igr2= 773, 774, 775, 777, 778, 779,
/
#
# 45 GLU HA 45 GLU QG 2.94
&rst
ixpk= 0, nxpk= 0, iat= 713, -1, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80,
igr2= 718, 719,
/
#
# 45 GLU HA 48 LEU QQD 6.15
&rst
ixpk= 0, nxpk= 0, iat= 713, -1, r1= 1.30, r2= 1.80, r3= 8.29, r4= 8.79,
igr2= 773, 774, 775, 777, 778, 779,
/
#
# 45 GLU QG 46 TYR H 4.27
&rst
ixpk= 0, nxpk= 0, iat= -1, 726, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
igr1= 718, 719,
/
#
# 45 GLU QG 48 LEU QQD 6.71
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3=10.15, r4=10.65,
igr1= 718, 719,
igr2= 773, 774, 775, 777, 778, 779,
/
#
# 46 TYR HA 49 ARG QD 4.32
&rst
ixpk= 0, nxpk= 0, iat= 728, -1, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
igr2= 793, 794,
/
#
# 46 TYR HA 52 VAL QQG 4.38
&rst
ixpk= 0, nxpk= 0, iat= 728, -1, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
igr2= 838, 839, 840, 842, 843, 844,
/
#
# 46 TYR HE 52 VAL QQG 3.47
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
igr1= 736, 741,
igr2= 838, 839, 840, 842, 843, 844,
/
#
# 47 MET H 48 LEU QQD 7.48
&rst
ixpk= 0, nxpk= 0, iat= 747, -1, r1= 1.30, r2= 1.80, r3=10.08, r4=10.58,
igr2= 773, 774, 775, 777, 778, 779,
/
#
# 47 MET H 52 VAL QQG 5.44
&rst
ixpk= 0, nxpk= 0, iat= 747, -1, r1= 1.30, r2= 1.80, r3= 7.33, r4= 7.83,
igr2= 838, 839, 840, 842, 843, 844,
/
#
# 47 MET HA 49 ARG QD 5.34
&rst
ixpk= 0, nxpk= 0, iat= 749, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2= 793, 794,
/
#
# 47 MET HA 52 VAL QQG 3.74
&rst
ixpk= 0, nxpk= 0, iat= 749, -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr2= 838, 839, 840, 842, 843, 844,
/
#
# 47 MET HA 57 LYS QE 4.41
&rst
ixpk= 0, nxpk= 0, iat= 749, -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr2= 937, 938,
/
#
# 47 MET HB3 57 LYS QE 5.01
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.31, r4= 6.81,
igr1= 751, 752,
igr2= 937, 938,
/
#
# 48 LEU H 48 LEU QQD 5.08
&rst
ixpk= 0, nxpk= 0, iat= 764, -1, r1= 1.30, r2= 1.80, r3= 6.85, r4= 7.35,
igr2= 773, 774, 775, 777, 778, 779,
/
#
# 48 LEU HA 48 LEU QQD 4.95
&rst
ixpk= 0, nxpk= 0, iat= 766, -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
igr2= 773, 774, 775, 777, 778, 779,
/
#
# 48 LEU HB2 48 LEU QQD 5.22
&rst
ixpk= 0, nxpk= 0, iat= 768, -1, r1= 1.30, r2= 1.80, r3= 7.04, r4= 7.54,
igr2= 773, 774, 775, 777, 778, 779,
/
#
# 48 LEU QQD 86 VAL HB 4.83
&rst
ixpk= 0, nxpk= 0, iat= -1,1410, r1= 1.30, r2= 1.80, r3= 6.51, r4= 7.01,
igr1= 773, 774, 775, 777, 778, 779,
/
#
# 48 LEU QQD 89 GLU HB2 3.89
&rst
ixpk= 0, nxpk= 0, iat= -1,1446, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr1= 773, 774, 775, 777, 778, 779,
/
#
# 48 LEU QQD 90 VAL H 3.58
&rst
ixpk= 0, nxpk= 0, iat= -1,1457, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
igr1= 773, 774, 775, 777, 778, 779,
/
#
# 48 LEU QQD 90 VAL HA 2.99
&rst
ixpk= 0, nxpk= 0, iat= -1,1459, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,
igr1= 773, 774, 775, 777, 778, 779,
/
#
# 48 LEU QQD 90 VAL QG1 3.56
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.47, r4= 6.97,
igr1= 773, 774, 775, 777, 778, 779,
igr2=1463,1464,1465,1467,1468,1469,
/
#
# 48 LEU QQD 90 VAL QG2 2.82
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
igr1= 773, 774, 775, 777, 778, 779,
igr2=1463,1464,1465,1467,1468,1469,
/
#
# 48 LEU QQD 93 ARG H 3.93
&rst
ixpk= 0, nxpk= 0, iat= -1,1499, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr1= 773, 774, 775, 777, 778, 779,
/
#
# 48 LEU QQD 93 ARG QB 3.63
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
igr1= 773, 774, 775, 777, 778, 779,
igr2=1503,1504,
/
#
# 48 LEU QQD 93 ARG QG 3.32
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
igr1= 773, 774, 775, 777, 778, 779,
igr2=1506,1507,
/
#
# 48 LEU QQD 94 ILE H 4.20
&rst
ixpk= 0, nxpk= 0, iat= -1,1523, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr1= 773, 774, 775, 777, 778, 779,
/
#
# 49 ARG H 49 ARG QD 4.22
&rst
ixpk= 0, nxpk= 0, iat= 783, -1, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr2= 793, 794,
/
#
# 49 ARG H 52 VAL QQG 4.07
&rst
ixpk= 0, nxpk= 0, iat= 783, -1, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
igr2= 838, 839, 840, 842, 843, 844,
/
#
# 49 ARG HA 49 ARG QD 4.72
&rst
ixpk= 0, nxpk= 0, iat= 785, -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr2= 793, 794,
/
#
# 49 ARG HA 51 SER QB 5.34
&rst
ixpk= 0, nxpk= 0, iat= 785, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2= 825, 826,
/
#
# 49 ARG HA 52 VAL QQG 5.30
&rst
ixpk= 0, nxpk= 0, iat= 785, -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
igr2= 838, 839, 840, 842, 843, 844,
/
#
# 49 ARG HB2 50 PRO QD 3.65
&rst
ixpk= 0, nxpk= 0, iat= 787, -1, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,
igr2= 808, 809,
/
#
# 49 ARG HB2 51 SER QB 5.15
&rst
ixpk= 0, nxpk= 0, iat= 787, -1, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr2= 825, 826,
/
#
# 49 ARG HB2 52 VAL QQG 4.64
&rst
ixpk= 0, nxpk= 0, iat= 787, -1, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75,
igr2= 838, 839, 840, 842, 843, 844,
/
#
# 49 ARG HB3 49 ARG QD 3.67
&rst
ixpk= 0, nxpk= 0, iat= 788, -1, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
igr2= 793, 794,
/
#
# 49 ARG HB3 52 VAL QQG 3.87
&rst
ixpk= 0, nxpk= 0, iat= 788, -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
igr2= 838, 839, 840, 842, 843, 844,
/
#
# 49 ARG HG2 50 PRO QD 4.99
&rst
ixpk= 0, nxpk= 0, iat= 790, -1, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
igr2= 808, 809,
/
#
# 49 ARG HG2 51 SER QB 4.41
&rst
ixpk= 0, nxpk= 0, iat= 790, -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr2= 825, 826,
/
#
# 49 ARG HG2 52 VAL QQG 3.70
&rst
ixpk= 0, nxpk= 0, iat= 790, -1, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,
igr2= 838, 839, 840, 842, 843, 844,
/
#
# 49 ARG HG3 52 VAL QQG 4.22
&rst
ixpk= 0, nxpk= 0, iat= 791, -1, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
igr2= 838, 839, 840, 842, 843, 844,
/
#
# 49 ARG QD 51 SER QB 5.13
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.46, r4= 6.96,
igr1= 793, 794,
igr2= 825, 826,
/
#
# 49 ARG QD 52 VAL H 4.37
&rst
ixpk= 0, nxpk= 0, iat= -1, 832, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
igr1= 793, 794,
/
#
# 49 ARG QD 52 VAL HB 4.29
&rst
ixpk= 0, nxpk= 0, iat= -1, 836, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
igr1= 793, 794,
/
#
# 49 ARG QD 52 VAL QQG 3.43
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
igr1= 793, 794,
igr2= 838, 839, 840, 842, 843, 844,
/
#
# 50 PRO HG2 51 SER QB 4.97
&rst
ixpk= 0, nxpk= 0, iat= 811, -1, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr2= 825, 826,
/
#
# 50 PRO QD 51 SER H 3.92
&rst
ixpk= 0, nxpk= 0, iat= -1, 821, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,
igr1= 808, 809,
/
#
# 51 SER H 51 SER QB 3.57
&rst
ixpk= 0, nxpk= 0, iat= 821, -1, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,
igr2= 825, 826,
/
#
# 51 SER H 52 VAL QQG 4.50
&rst
ixpk= 0, nxpk= 0, iat= 821, -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
igr2= 838, 839, 840, 842, 843, 844,
/
#
# 51 SER HA 52 VAL QQG 5.04
&rst
ixpk= 0, nxpk= 0, iat= 823, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2= 838, 839, 840, 842, 843, 844,
/
#
# 51 SER QB 52 VAL QQG 4.87
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.37, r4= 7.87,
igr1= 825, 826,
igr2= 838, 839, 840, 842, 843, 844,
/
#
# 52 VAL H 52 VAL QQG 5.3
&rst
ixpk= 0, nxpk= 0, iat= 832, -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
igr2= 838, 839, 840, 842, 843, 844,
/
#
# 52 VAL H 57 LYS QE 4.93
&rst
ixpk= 0, nxpk= 0, iat= 832, -1, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03,
igr2= 937, 938,
/
#
# 52 VAL HA 53 ASN QB 4.24
&rst
ixpk= 0, nxpk= 0, iat= 834, -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
igr2= 852, 853,
/
#
# 52 VAL HB 57 LYS QE 4.10
&rst
ixpk= 0, nxpk= 0, iat= 836, -1, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
igr2= 937, 938,
/
#
# 52 VAL QQG 53 ASN H 5.1
&rst
ixpk= 0, nxpk= 0, iat= -1, 848, r1= 1.30, r2= 1.80, r3= 6.87, r4= 7.37,
igr1= 838, 839, 840, 842, 843, 844,
/
#
# 52 VAL QQG 53 ASN HA 6.18
&rst
ixpk= 0, nxpk= 0, iat= -1, 850, r1= 1.30, r2= 1.80, r3= 8.33, r4= 8.83,
igr1= 838, 839, 840, 842, 843, 844,
/
#
# 52 VAL QQG 53 ASN QB 6.16
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.32, r4= 9.82,
igr1= 838, 839, 840, 842, 843, 844,
igr2= 852, 853,
/
#
# 52 VAL QQG 54 THR H 7.29
&rst
ixpk= 0, nxpk= 0, iat= -1, 862, r1= 1.30, r2= 1.80, r3= 9.83, r4=10.33,
igr1= 838, 839, 840, 842, 843, 844,
/
#
# 52 VAL QQG 54 THR HA 7.18
&rst
ixpk= 0, nxpk= 0, iat= -1, 864, r1= 1.30, r2= 1.80, r3= 9.68, r4=10.18,
igr1= 838, 839, 840, 842, 843, 844,
/
#
# 52 VAL QQG 55 ARG H 7.59
&rst
ixpk= 0, nxpk= 0, iat= -1, 876, r1= 1.30, r2= 1.80, r3=10.23, r4=10.73,
igr1= 838, 839, 840, 842, 843, 844,
/
#
# 52 VAL QQG 56 ARG H 6.44
&rst
ixpk= 0, nxpk= 0, iat= -1, 900, r1= 1.30, r2= 1.80, r3= 8.68, r4= 9.18,
igr1= 838, 839, 840, 842, 843, 844,
/
#
# 52 VAL QQG 56 ARG QB 5.57
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.43, r4= 8.93,
igr1= 838, 839, 840, 842, 843, 844,
igr2= 904, 905,
/
#
# 52 VAL QQG 56 ARG QG 5.66
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.56, r4= 9.06,
igr1= 838, 839, 840, 842, 843, 844,
igr2= 907, 908,
/
#
# 52 VAL QQG 56 ARG QD 5.71
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.64, r4= 9.14,
igr1= 838, 839, 840, 842, 843, 844,
igr2= 910, 911,
/
#
# 52 VAL QQG 57 LYS H 5.49
&rst
ixpk= 0, nxpk= 0, iat= -1, 924, r1= 1.30, r2= 1.80, r3= 7.40, r4= 7.90,
igr1= 838, 839, 840, 842, 843, 844,
/
#
# 52 VAL QQG 57 LYS HA 6.01
&rst
ixpk= 0, nxpk= 0, iat= -1, 926, r1= 1.30, r2= 1.80, r3= 8.10, r4= 8.60,
igr1= 838, 839, 840, 842, 843, 844,
/
#
# 52 VAL QQG 57 LYS HB3 6.88
&rst
ixpk= 0, nxpk= 0, iat= -1, 929, r1= 1.30, r2= 1.80, r3= 9.27, r4= 9.77,
igr1= 838, 839, 840, 842, 843, 844,
/
#
# 52 VAL QQG 57 LYS HG3 5.64
&rst
ixpk= 0, nxpk= 0, iat= -1, 932, r1= 1.30, r2= 1.80, r3= 7.60, r4= 8.10,
igr1= 838, 839, 840, 842, 843, 844,
/
#
# 52 VAL QQG 57 LYS QE 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.08, r4= 8.58,
igr1= 838, 839, 840, 842, 843, 844,
igr2= 937, 938,
/
#
# 53 ASN H 57 LYS QE 4.33
&rst
ixpk= 0, nxpk= 0, iat= 848, -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
igr2= 937, 938,
/
#
# 53 ASN QB 53 ASN HND1 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 857, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,
igr1= 852, 853,
/
#
# 53 ASN QB 53 ASN HND2 3.34
&rst
ixpk= 0, nxpk= 0, iat= -1, 858, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,
igr1= 852, 853,
/
#
# 53 ASN QB 54 THR H 3.35
&rst
ixpk= 0, nxpk= 0, iat= -1, 862, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,
igr1= 852, 853,
/
#
# 53 ASN QB 54 THR QG2 4.82
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
igr1= 852, 853,
igr2= 868, 869, 870,
/
#
# 53 ASN QB 55 ARG H 3.91
&rst
ixpk= 0, nxpk= 0, iat= -1, 876, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,
igr1= 852, 853,
/
#
# 53 ASN QB 56 ARG H 4.30
&rst
ixpk= 0, nxpk= 0, iat= -1, 900, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
igr1= 852, 853,
/
#
# 53 ASN HND1 102 LEU QQD 7.46
&rst
ixpk= 0, nxpk= 0, iat= 857, -1, r1= 1.30, r2= 1.80, r3=10.06, r4=10.56,
igr2=1667,1668,1669,1671,1672,1673,
/
#
# 54 THR H 102 LEU QQD 7.15
&rst
ixpk= 0, nxpk= 0, iat= 862, -1, r1= 1.30, r2= 1.80, r3= 9.64, r4=10.14,
igr2=1667,1668,1669,1671,1672,1673,
/
#
# 54 THR HA 57 LYS QE 4.04
&rst
ixpk= 0, nxpk= 0, iat= 864, -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
igr2= 937, 938,
/
#
# 54 THR HA 97 GLU QB 5.34
&rst
ixpk= 0, nxpk= 0, iat= 864, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2=1577,1578,
/
#
# 54 THR HA 102 LEU QQD 6.22
&rst
ixpk= 0, nxpk= 0, iat= 864, -1, r1= 1.30, r2= 1.80, r3= 8.38, r4= 8.88,
igr2=1667,1668,1669,1671,1672,1673,
/
#
# 54 THR HB 99 PRO QD 4.60
&rst
ixpk= 0, nxpk= 0, iat= 866, -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
igr2=1609,1610,
/
#
# 54 THR HB 102 LEU QQD 5.48
&rst
ixpk= 0, nxpk= 0, iat= 866, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=1667,1668,1669,1671,1672,1673,
/
#
# 54 THR QG2 57 LYS QE 4.05
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
igr1= 868, 869, 870,
igr2= 937, 938,
/
#
# 54 THR QG2 97 GLU QB 3.42
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
igr1= 868, 869, 870,
igr2=1577,1578,
/
#
# 54 THR QG2 99 PRO QD 3.37
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
igr1= 868, 869, 870,
igr2=1609,1610,
/
#
# 54 THR QG2 102 LEU QQD 5.46
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.84, r4= 9.34,
igr1= 868, 869, 870,
igr2=1667,1668,1669,1671,1672,1673,
/
#
# 55 ARG H 55 ARG QG 3.66
&rst
ixpk= 0, nxpk= 0, iat= 876, -1, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
igr2= 883, 884,
/
#
# 55 ARG H 55 ARG QD 3.77
&rst
ixpk= 0, nxpk= 0, iat= 876, -1, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,
igr2= 886, 887,
/
#
# 55 ARG H 102 LEU QQD 6.23
&rst
ixpk= 0, nxpk= 0, iat= 876, -1, r1= 1.30, r2= 1.80, r3= 8.40, r4= 8.90,
igr2=1667,1668,1669,1671,1672,1673,
/
#
# 55 ARG HA 55 ARG QG 3.31
&rst
ixpk= 0, nxpk= 0, iat= 878, -1, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,
igr2= 883, 884,
/
#
# 55 ARG HA 55 ARG QD 3.72
&rst
ixpk= 0, nxpk= 0, iat= 878, -1, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
igr2= 886, 887,
/
#
# 55 ARG HA 58 LEU QQD 6.13
&rst
ixpk= 0, nxpk= 0, iat= 878, -1, r1= 1.30, r2= 1.80, r3= 8.26, r4= 8.76,
igr2= 955, 956, 957, 959, 960, 961,
/
#
# 55 ARG HA 102 LEU QQD 5.8
&rst
ixpk= 0, nxpk= 0, iat= 878, -1, r1= 1.30, r2= 1.80, r3= 7.82, r4= 8.32,
igr2=1667,1668,1669,1671,1672,1673,
/
#
# 55 ARG QB 55 ARG QD 3.27
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
igr1= 880, 881,
igr2= 886, 887,
/
#
# 55 ARG QG 56 ARG H 4.72
&rst
ixpk= 0, nxpk= 0, iat= -1, 900, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr1= 883, 884,
/
#
# 55 ARG QD 56 ARG H 5.11
&rst
ixpk= 0, nxpk= 0, iat= -1, 900, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
igr1= 886, 887,
/
#
# 55 ARG QD 58 LEU H 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, 946, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1= 886, 887,
/
#
# 55 ARG QD 102 LEU QQD 5.9
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.93, r4= 9.43,
igr1= 886, 887,
igr2=1667,1668,1669,1671,1672,1673,
/
#
# 56 ARG H 57 LYS QE 5.34
&rst
ixpk= 0, nxpk= 0, iat= 900, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2= 937, 938,
/
#
# 56 ARG HA 59 LEU QB 4.89
&rst
ixpk= 0, nxpk= 0, iat= 902, -1, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
igr2= 969, 970,
/
#
# 56 ARG HA 59 LEU QQD 5.88
&rst
ixpk= 0, nxpk= 0, iat= 902, -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
igr2= 974, 975, 976, 978, 979, 980,
/
#
# 56 ARG QB 59 LEU QQD 6.08
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.20, r4= 9.70,
igr1= 904, 905,
igr2= 974, 975, 976, 978, 979, 980,
/
#
# 57 LYS H 57 LYS QE 4.03
&rst
ixpk= 0, nxpk= 0, iat= 924, -1, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
igr2= 937, 938,
/
#
# 57 LYS H 102 LEU QQD 7.64
&rst
ixpk= 0, nxpk= 0, iat= 924, -1, r1= 1.30, r2= 1.80, r3=10.30, r4=10.80,
igr2=1667,1668,1669,1671,1672,1673,
/
#
# 57 LYS HA 57 LYS QD 4.52
&rst
ixpk= 0, nxpk= 0, iat= 926, -1, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
igr2= 934, 935,
/
#
# 57 LYS HA 57 LYS QE 4.59
&rst
ixpk= 0, nxpk= 0, iat= 926, -1, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
igr2= 937, 938,
/
#
# 57 LYS HB3 57 LYS QE 4.82
&rst
ixpk= 0, nxpk= 0, iat= 929, -1, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,
igr2= 937, 938,
/
#
# 57 LYS HG3 57 LYS QE 3.35
&rst
ixpk= 0, nxpk= 0, iat= 932, -1, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,
igr2= 937, 938,
/
#
# 57 LYS QD 94 ILE QG2 3.36
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
igr1= 934, 935,
igr2=1529,1530,1531,
/
#
# 57 LYS QD 98 PHE HE 4.28
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr1= 934, 935,
igr2=1598,1602,
/
#
# 57 LYS QE 58 LEU H 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, 946, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1= 937, 938,
/
#
# 57 LYS QE 94 ILE QG2 4.02
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr1= 937, 938,
igr2=1529,1530,1531,
/
#
# 58 LEU H 58 LEU QQD 6.12
&rst
ixpk= 0, nxpk= 0, iat= 946, -1, r1= 1.30, r2= 1.80, r3= 8.25, r4= 8.75,
igr2= 955, 956, 957, 959, 960, 961,
/
#
# 58 LEU H 61 LEU QB 5.34
&rst
ixpk= 0, nxpk= 0, iat= 946, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2= 995, 996,
/
#
# 58 LEU H 102 LEU QQD 6.06
&rst
ixpk= 0, nxpk= 0, iat= 946, -1, r1= 1.30, r2= 1.80, r3= 8.17, r4= 8.67,
igr2=1667,1668,1669,1671,1672,1673,
/
#
# 58 LEU HA 58 LEU QQD 5.12
&rst
ixpk= 0, nxpk= 0, iat= 948, -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr2= 955, 956, 957, 959, 960, 961,
/
#
# 58 LEU HA 61 LEU QQD 6.01
&rst
ixpk= 0, nxpk= 0, iat= 948, -1, r1= 1.30, r2= 1.80, r3= 8.10, r4= 8.60,
igr2=1000,1001,1002,1004,1005,1006,
/
#
# 58 LEU HA 102 LEU QQD 6.66
&rst
ixpk= 0, nxpk= 0, iat= 948, -1, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
igr2=1667,1668,1669,1671,1672,1673,
/
#
# 58 LEU HB2 102 LEU QQD 5.83
&rst
ixpk= 0, nxpk= 0, iat= 950, -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
igr2=1667,1668,1669,1671,1672,1673,
/
#
# 58 LEU HB3 61 LEU QB 5.34
&rst
ixpk= 0, nxpk= 0, iat= 951, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2= 995, 996,
/
#
# 58 LEU HB3 102 LEU QQD 6.18
&rst
ixpk= 0, nxpk= 0, iat= 951, -1, r1= 1.30, r2= 1.80, r3= 8.33, r4= 8.83,
igr2=1667,1668,1669,1671,1672,1673,
/
#
# 58 LEU QQD 59 LEU H 6.9
&rst
ixpk= 0, nxpk= 0, iat= -1, 965, r1= 1.30, r2= 1.80, r3= 9.30, r4= 9.80,
igr1= 955, 956, 957, 959, 960, 961,
/
#
# 58 LEU QQD 61 LEU H 7.06
&rst
ixpk= 0, nxpk= 0, iat= -1, 991, r1= 1.30, r2= 1.80, r3= 9.52, r4=10.02,
igr1= 955, 956, 957, 959, 960, 961,
/
#
# 58 LEU QQD 61 LEU HA 7.64
&rst
ixpk= 0, nxpk= 0, iat= -1, 993, r1= 1.30, r2= 1.80, r3=10.30, r4=10.80,
igr1= 955, 956, 957, 959, 960, 961,
/
#
# 58 LEU QQD 61 LEU QB 5.91
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.94, r4= 9.44,
igr1= 955, 956, 957, 959, 960, 961,
igr2= 995, 996,
/
#
# 58 LEU QQD 61 LEU HG 7.42
&rst
ixpk= 0, nxpk= 0, iat= -1, 998, r1= 1.30, r2= 1.80, r3=10.00, r4=10.50,
igr1= 955, 956, 957, 959, 960, 961,
/
#
# 58 LEU QQD 61 LEU QQD 7.43
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3=13.50, r4=14.00,
igr1= 955, 956, 957, 959, 960, 961,
igr2=1000,1001,1002,1004,1005,1006,
/
#
# 58 LEU QQD 62 TYR H 4.44
&rst
ixpk= 0, nxpk= 0, iat= -1,1010, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1= 955, 956, 957, 959, 960, 961,
/
#
# 58 LEU QQD 62 TYR HA 5.44
&rst
ixpk= 0, nxpk= 0, iat= -1,1012, r1= 1.30, r2= 1.80, r3= 7.33, r4= 7.83,
igr1= 955, 956, 957, 959, 960, 961,
/
#
# 58 LEU QQD 62 TYR HE 3.62
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
igr1= 955, 956, 957, 959, 960, 961,
igr2=1020,1025,
/
#
# 58 LEU QQD 98 PHE HB3 5.44
&rst
ixpk= 0, nxpk= 0, iat= -1,1593, r1= 1.30, r2= 1.80, r3= 7.33, r4= 7.83,
igr1= 955, 956, 957, 959, 960, 961,
/
#
# 58 LEU QQD 98 PHE HE 3.66
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
igr1= 955, 956, 957, 959, 960, 961,
igr2=1598,1602,
/
#
# 58 LEU QQD 98 PHE HZ 3.78
&rst
ixpk= 0, nxpk= 0, iat= -1,1600, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
igr1= 955, 956, 957, 959, 960, 961,
/
#
# 58 LEU QQD 102 LEU HA 6.07
&rst
ixpk= 0, nxpk= 0, iat= -1,1660, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
igr1= 955, 956, 957, 959, 960, 961,
/
#
# 58 LEU QQD 102 LEU HG 6.58
&rst
ixpk= 0, nxpk= 0, iat= -1,1665, r1= 1.30, r2= 1.80, r3= 8.87, r4= 9.37,
igr1= 955, 956, 957, 959, 960, 961,
/
#
# 58 LEU QQD 102 LEU QQD 6.95
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3=12.63, r4=13.13,
igr1= 955, 956, 957, 959, 960, 961,
igr2=1667,1668,1669,1671,1672,1673,
/
#
# 58 LEU QQD 103 LYS H 5.44
&rst
ixpk= 0, nxpk= 0, iat= -1,1677, r1= 1.30, r2= 1.80, r3= 7.33, r4= 7.83,
igr1= 955, 956, 957, 959, 960, 961,
/
#
# 58 LEU QQD 105 LYS QG 3.77
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr1= 955, 956, 957, 959, 960, 961,
igr2=1728,1729,
/
#
# 58 LEU QQD 105 LYS QE 4.41
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
igr1= 955, 956, 957, 959, 960, 961,
igr2=1734,1735,
/
#
# 58 LEU QQD 106 LEU H 6.2
&rst
ixpk= 0, nxpk= 0, iat= -1,1743, r1= 1.30, r2= 1.80, r3= 8.36, r4= 8.86,
igr1= 955, 956, 957, 959, 960, 961,
/
#
# 58 LEU QQD 106 LEU HB2 5.91
&rst
ixpk= 0, nxpk= 0, iat= -1,1747, r1= 1.30, r2= 1.80, r3= 7.97, r4= 8.47,
igr1= 955, 956, 957, 959, 960, 961,
/
#
# 58 LEU QQD 106 LEU HB3 7.06
&rst
ixpk= 0, nxpk= 0, iat= -1,1748, r1= 1.30, r2= 1.80, r3= 9.52, r4=10.02,
igr1= 955, 956, 957, 959, 960, 961,
/
#
# 58 LEU QQD 109 VAL QQG 4.66
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.47, r4= 8.97,
igr1= 955, 956, 957, 959, 960, 961,
igr2=1803,1804,1805,1807,1808,1809,
/
#
# 59 LEU H 59 LEU QQD 5.36
&rst
ixpk= 0, nxpk= 0, iat= 965, -1, r1= 1.30, r2= 1.80, r3= 7.23, r4= 7.73,
igr2= 974, 975, 976, 978, 979, 980,
/
#
# 59 LEU HA 59 LEU QQD 5.47
&rst
ixpk= 0, nxpk= 0, iat= 967, -1, r1= 1.30, r2= 1.80, r3= 7.37, r4= 7.87,
igr2= 974, 975, 976, 978, 979, 980,
/
#
# 59 LEU QB 60 GLY H 3.71
&rst
ixpk= 0, nxpk= 0, iat= -1, 984, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
igr1= 969, 970,
/
#
# 59 LEU QQD 60 GLY H 4.29
&rst
ixpk= 0, nxpk= 0, iat= -1, 984, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr1= 974, 975, 976, 978, 979, 980,
/
#
# 59 LEU QQD 62 TYR HD 5.08
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.69, r4= 8.19,
igr1= 974, 975, 976, 978, 979, 980,
igr2=1018,1027,
/
#
# 60 GLY H 61 LEU QB 5.29
&rst
ixpk= 0, nxpk= 0, iat= 984, -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
igr2= 995, 996,
/
#
# 60 GLY H 63 LEU QQD 7.32
&rst
ixpk= 0, nxpk= 0, iat= 984, -1, r1= 1.30, r2= 1.80, r3= 9.87, r4=10.37,
igr2=1040,1041,1042,1044,1045,1046,
/
#
# 60 GLY HA2 63 LEU QQD 6.03
&rst
ixpk= 0, nxpk= 0, iat= 986, -1, r1= 1.30, r2= 1.80, r3= 8.13, r4= 8.63,
igr2=1040,1041,1042,1044,1045,1046,
/
#
# 60 GLY HA3 63 LEU QQD 7.32
&rst
ixpk= 0, nxpk= 0, iat= 987, -1, r1= 1.30, r2= 1.80, r3= 9.87, r4=10.37,
igr2=1040,1041,1042,1044,1045,1046,
/
#
# 61 LEU H 61 LEU QQD 6.02
&rst
ixpk= 0, nxpk= 0, iat= 991, -1, r1= 1.30, r2= 1.80, r3= 8.11, r4= 8.61,
igr2=1000,1001,1002,1004,1005,1006,
/
#
# 61 LEU H 63 LEU QB 5.34
&rst
ixpk= 0, nxpk= 0, iat= 991, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2=1035,1036,
/
#
# 61 LEU HA 61 LEU QQD 5.2
&rst
ixpk= 0, nxpk= 0, iat= 993, -1, r1= 1.30, r2= 1.80, r3= 7.01, r4= 7.51,
igr2=1000,1001,1002,1004,1005,1006,
/
#
# 61 LEU HA 91 LEU QQD 6.57
&rst
ixpk= 0, nxpk= 0, iat= 993, -1, r1= 1.30, r2= 1.80, r3= 8.86, r4= 9.36,
igr2=1482,1483,1484,1486,1487,1488,
/
#
# 61 LEU QB 61 LEU QQD 5.04
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.63, r4= 8.13,
igr1= 995, 996,
igr2=1000,1001,1002,1004,1005,1006,
/
#
# 61 LEU QB 62 TYR H 3.30
&rst
ixpk= 0, nxpk= 0, iat= -1,1010, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,
igr1= 995, 996,
/
#
# 61 LEU QB 91 LEU QQD 7.12
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3=10.77, r4=11.27,
igr1= 995, 996,
igr2=1482,1483,1484,1486,1487,1488,
/
#
# 61 LEU QB 94 ILE QD1 3.87
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
igr1= 995, 996,
igr2=1536,1537,1538,
/
#
# 61 LEU QB 109 VAL QQG 4.71
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.13, r4= 7.63,
igr1= 995, 996,
igr2=1803,1804,1805,1807,1808,1809,
/
#
# 61 LEU HG 109 VAL QQG 3.29
&rst
ixpk= 0, nxpk= 0, iat= 998, -1, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
igr2=1803,1804,1805,1807,1808,1809,
/
#
# 61 LEU QQD 62 TYR H 4.04
&rst
ixpk= 0, nxpk= 0, iat= -1,1010, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,
igr1=1000,1001,1002,1004,1005,1006,
/
#
# 61 LEU QQD 62 TYR HE 4.16
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.29, r4= 6.79,
igr1=1000,1001,1002,1004,1005,1006,
igr2=1020,1025,
/
#
# 61 LEU QQD 90 VAL HB 5.41
&rst
ixpk= 0, nxpk= 0, iat= -1,1461, r1= 1.30, r2= 1.80, r3= 7.29, r4= 7.79,
igr1=1000,1001,1002,1004,1005,1006,
/
#
# 61 LEU QQD 90 VAL QG1 4.17
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.58, r4= 8.08,
igr1=1000,1001,1002,1004,1005,1006,
igr2=1463,1464,1465,1467,1468,1469,
/
#
# 61 LEU QQD 91 LEU H 7.07
&rst
ixpk= 0, nxpk= 0, iat= -1,1473, r1= 1.30, r2= 1.80, r3= 9.53, r4=10.03,
igr1=1000,1001,1002,1004,1005,1006,
/
#
# 61 LEU QQD 91 LEU HA 6.39
&rst
ixpk= 0, nxpk= 0, iat= -1,1475, r1= 1.30, r2= 1.80, r3= 8.61, r4= 9.11,
igr1=1000,1001,1002,1004,1005,1006,
/
#
# 61 LEU QQD 91 LEU HG 4.89
&rst
ixpk= 0, nxpk= 0, iat= -1,1480, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
igr1=1000,1001,1002,1004,1005,1006,
/
#
# 61 LEU QQD 91 LEU QQD 6.93
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3=12.59, r4=13.09,
igr1=1000,1001,1002,1004,1005,1006,
igr2=1482,1483,1484,1486,1487,1488,
/
#
# 61 LEU QQD 94 ILE QD1 3.58
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
igr1=1000,1001,1002,1004,1005,1006,
igr2=1536,1537,1538,
/
#
# 61 LEU QQD 98 PHE HE 3.96
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1=1000,1001,1002,1004,1005,1006,
igr2=1598,1602,
/
#
# 61 LEU QQD 102 LEU QQD 9.77
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3=17.75, r4=18.25,
igr1=1000,1001,1002,1004,1005,1006,
igr2=1667,1668,1669,1671,1672,1673,
/
#
# 61 LEU QQD 105 LYS H 5.44
&rst
ixpk= 0, nxpk= 0, iat= -1,1721, r1= 1.30, r2= 1.80, r3= 7.33, r4= 7.83,
igr1=1000,1001,1002,1004,1005,1006,
/
#
# 61 LEU QQD 105 LYS HA 5.44
&rst
ixpk= 0, nxpk= 0, iat= -1,1723, r1= 1.30, r2= 1.80, r3= 7.33, r4= 7.83,
igr1=1000,1001,1002,1004,1005,1006,
/
#
# 61 LEU QQD 106 LEU H 6.02
&rst
ixpk= 0, nxpk= 0, iat= -1,1743, r1= 1.30, r2= 1.80, r3= 8.11, r4= 8.61,
igr1=1000,1001,1002,1004,1005,1006,
/
#
# 61 LEU QQD 106 LEU HA 5.66
&rst
ixpk= 0, nxpk= 0, iat= -1,1745, r1= 1.30, r2= 1.80, r3= 7.63, r4= 8.13,
igr1=1000,1001,1002,1004,1005,1006,
/
#
# 61 LEU QQD 106 LEU HB3 6.28
&rst
ixpk= 0, nxpk= 0, iat= -1,1748, r1= 1.30, r2= 1.80, r3= 8.47, r4= 8.97,
igr1=1000,1001,1002,1004,1005,1006,
/
#
# 61 LEU QQD 106 LEU QQD 7.54
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3=13.70, r4=14.20,
igr1=1000,1001,1002,1004,1005,1006,
igr2=1752,1753,1754,1756,1757,1758,
/
#
# 61 LEU QQD 109 VAL QQG 2.77
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
igr1=1000,1001,1002,1004,1005,1006,
igr2=1803,1804,1805,1807,1808,1809,
/
#
# 62 TYR H 109 VAL QQG 4.98
&rst
ixpk= 0, nxpk= 0, iat=1010, -1, r1= 1.30, r2= 1.80, r3= 6.71, r4= 7.21,
igr2=1803,1804,1805,1807,1808,1809,
/
#
# 62 TYR HA 109 VAL QQG 4.23
&rst
ixpk= 0, nxpk= 0, iat=1012, -1, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr2=1803,1804,1805,1807,1808,1809,
/
#
# 62 TYR HD 109 VAL QQG 3.45
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
igr1=1018,1027,
igr2=1803,1804,1805,1807,1808,1809,
/
#
# 62 TYR HE 109 VAL QQG 3.13
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr1=1020,1025,
igr2=1803,1804,1805,1807,1808,1809,
/
#
# 63 LEU H 63 LEU QB 3.67
&rst
ixpk= 0, nxpk= 0, iat=1031, -1, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
igr2=1035,1036,
/
#
# 63 LEU H 63 LEU QQD 6.24
&rst
ixpk= 0, nxpk= 0, iat=1031, -1, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
igr2=1040,1041,1042,1044,1045,1046,
/
#
# 63 LEU HA 63 LEU QQD 5.12
&rst
ixpk= 0, nxpk= 0, iat=1033, -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr2=1040,1041,1042,1044,1045,1046,
/
#
# 63 LEU QQD 64 MET H 4.42
&rst
ixpk= 0, nxpk= 0, iat= -1,1050, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
igr1=1040,1041,1042,1044,1045,1046,
/
#
# 63 LEU QQD 66 HIS H 5.44
&rst
ixpk= 0, nxpk= 0, iat= -1,1081, r1= 1.30, r2= 1.80, r3= 7.33, r4= 7.83,
igr1=1040,1041,1042,1044,1045,1046,
/
#
# 64 MET H 65 ASN QB 5.23
&rst
ixpk= 0, nxpk= 0, iat=1050, -1, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,
igr2=1071,1072,
/
#
# 64 MET H 67 VAL QQG 4.19
&rst
ixpk= 0, nxpk= 0, iat=1050, -1, r1= 1.30, r2= 1.80, r3= 5.65, r4= 6.15,
igr2=1104,1105,1106,1108,1109,1110,
/
#
# 64 MET HA 67 VAL QQG 4.51
&rst
ixpk= 0, nxpk= 0, iat=1052, -1, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
igr2=1104,1105,1106,1108,1109,1110,
/
#
# 64 MET QE 68 VAL QQG 3.26
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
igr1=1061,1062,1063,
igr2=1120,1121,1122,1124,1125,1126,
/
#
# 65 ASN H 65 ASN QB 3.35
&rst
ixpk= 0, nxpk= 0, iat=1067, -1, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,
igr2=1071,1072,
/
#
# 65 ASN H 66 HIS QB 5.15
&rst
ixpk= 0, nxpk= 0, iat=1067, -1, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr2=1085,1086,
/
#
# 65 ASN H 109 VAL QQG 4.38
&rst
ixpk= 0, nxpk= 0, iat=1067, -1, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
igr2=1803,1804,1805,1807,1808,1809,
/
#
# 65 ASN HA 68 VAL QQG 3.38
&rst
ixpk= 0, nxpk= 0, iat=1069, -1, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
igr2=1120,1121,1122,1124,1125,1126,
/
#
# 65 ASN HA 109 VAL QQG 4.08
&rst
ixpk= 0, nxpk= 0, iat=1069, -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
igr2=1803,1804,1805,1807,1808,1809,
/
#
# 65 ASN QB 66 HIS H 3.91
&rst
ixpk= 0, nxpk= 0, iat= -1,1081, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,
igr1=1071,1072,
/
#
# 65 ASN QB 67 VAL H 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1,1098, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1=1071,1072,
/
#
# 65 ASN QB 68 VAL QQG 5.13
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.76, r4= 8.26,
igr1=1071,1072,
igr2=1120,1121,1122,1124,1125,1126,
/
#
# 65 ASN QB 109 VAL QQG 3.58
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr1=1071,1072,
igr2=1803,1804,1805,1807,1808,1809,
/
#
# 66 HIS H 67 VAL QQG 4.31
&rst
ixpk= 0, nxpk= 0, iat=1081, -1, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
igr2=1104,1105,1106,1108,1109,1110,
/
#
# 66 HIS H 69 GLN QB 4.96
&rst
ixpk= 0, nxpk= 0, iat=1081, -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
igr2=1134,1135,
/
#
# 66 HIS H 109 VAL QQG 5.44
&rst
ixpk= 0, nxpk= 0, iat=1081, -1, r1= 1.30, r2= 1.80, r3= 7.33, r4= 7.83,
igr2=1803,1804,1805,1807,1808,1809,
/
#
# 66 HIS HA 69 GLN QB 4.72
&rst
ixpk= 0, nxpk= 0, iat=1083, -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr2=1134,1135,
/
#
# 66 HIS QB 67 VAL HA 4.75
&rst
ixpk= 0, nxpk= 0, iat= -1,1100, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
igr1=1085,1086,
/
#
# 67 VAL H 67 VAL QQG 5.16
&rst
ixpk= 0, nxpk= 0, iat=1098, -1, r1= 1.30, r2= 1.80, r3= 6.96, r4= 7.46,
igr2=1104,1105,1106,1108,1109,1110,
/
#
# 67 VAL H 70 GLN QB 5.34
&rst
ixpk= 0, nxpk= 0, iat=1098, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2=1151,1152,
/
#
# 67 VAL HA 67 VAL QQG 5.27
&rst
ixpk= 0, nxpk= 0, iat=1100, -1, r1= 1.30, r2= 1.80, r3= 7.10, r4= 7.60,
igr2=1104,1105,1106,1108,1109,1110,
/
#
# 67 VAL HA 70 GLN QB 4.17
&rst
ixpk= 0, nxpk= 0, iat=1100, -1, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
igr2=1151,1152,
/
#
# 67 VAL HA 70 GLN QG 5.34
&rst
ixpk= 0, nxpk= 0, iat=1100, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2=1154,1155,
/
#
# 67 VAL QQG 68 VAL H 5.66
&rst
ixpk= 0, nxpk= 0, iat= -1,1114, r1= 1.30, r2= 1.80, r3= 7.63, r4= 8.13,
igr1=1104,1105,1106,1108,1109,1110,
/
#
# 67 VAL QQG 68 VAL HA 6.44
&rst
ixpk= 0, nxpk= 0, iat= -1,1116, r1= 1.30, r2= 1.80, r3= 8.68, r4= 9.18,
igr1=1104,1105,1106,1108,1109,1110,
/
#
# 67 VAL QQG 68 VAL QQG 8.54
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3=15.52, r4=16.02,
igr1=1104,1105,1106,1108,1109,1110,
igr2=1120,1121,1122,1124,1125,1126,
/
#
# 67 VAL QQG 71 ALA H 6.94
&rst
ixpk= 0, nxpk= 0, iat= -1,1164, r1= 1.30, r2= 1.80, r3= 9.36, r4= 9.86,
igr1=1104,1105,1106,1108,1109,1110,
/
#
# 67 VAL QQG 71 ALA QB 5.92
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.58, r4=10.08,
igr1=1104,1105,1106,1108,1109,1110,
igr2=1168,1169,1170,
/
#
# 67 VAL QQG 83 PHE HD 6.18
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.35, r4= 9.85,
igr1=1104,1105,1106,1108,1109,1110,
igr2=1365,1373,
/
#
# 67 VAL QQG 83 PHE HE 5.87
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.88, r4= 9.38,
igr1=1104,1105,1106,1108,1109,1110,
igr2=1367,1371,
/
#
# 67 VAL QQG 83 PHE HZ 6.53
&rst
ixpk= 0, nxpk= 0, iat= -1,1369, r1= 1.30, r2= 1.80, r3= 8.80, r4= 9.30,
igr1=1104,1105,1106,1108,1109,1110,
/
#
# 68 VAL H 69 GLN QB 4.96
&rst
ixpk= 0, nxpk= 0, iat=1114, -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
igr2=1134,1135,
/
#
# 68 VAL HA 68 VAL QQG 5.2
&rst
ixpk= 0, nxpk= 0, iat=1116, -1, r1= 1.30, r2= 1.80, r3= 7.01, r4= 7.51,
igr2=1120,1121,1122,1124,1125,1126,
/
#
# 68 VAL HA 80 GLN QB 4.73
&rst
ixpk= 0, nxpk= 0, iat=1116, -1, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
igr2=1321,1322,
/
#
# 68 VAL HB 80 GLN QB 4.36
&rst
ixpk= 0, nxpk= 0, iat=1118, -1, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
igr2=1321,1322,
/
#
# 68 VAL QQG 69 GLN H 5.56
&rst
ixpk= 0, nxpk= 0, iat= -1,1130, r1= 1.30, r2= 1.80, r3= 7.49, r4= 7.99,
igr1=1120,1121,1122,1124,1125,1126,
/
#
# 68 VAL QQG 69 GLN HA 6.09
&rst
ixpk= 0, nxpk= 0, iat= -1,1132, r1= 1.30, r2= 1.80, r3= 8.21, r4= 8.71,
igr1=1120,1121,1122,1124,1125,1126,
/
#
# 68 VAL QQG 69 GLN QG 7.04
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3=10.65, r4=11.15,
igr1=1120,1121,1122,1124,1125,1126,
igr2=1137,1138,
/
#
# 68 VAL QQG 80 GLN HA 5.79
&rst
ixpk= 0, nxpk= 0, iat= -1,1319, r1= 1.30, r2= 1.80, r3= 7.80, r4= 8.30,
igr1=1120,1121,1122,1124,1125,1126,
/
#
# 68 VAL QQG 80 GLN QB 6.19
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.37, r4= 9.87,
igr1=1120,1121,1122,1124,1125,1126,
igr2=1321,1322,
/
#
# 68 VAL QQG 83 PHE HB2 6
&rst
ixpk= 0, nxpk= 0, iat= -1,1361, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
igr1=1120,1121,1122,1124,1125,1126,
/
#
# 68 VAL QQG 83 PHE HB3 5.6
&rst
ixpk= 0, nxpk= 0, iat= -1,1362, r1= 1.30, r2= 1.80, r3= 7.55, r4= 8.05,
igr1=1120,1121,1122,1124,1125,1126,
/
#
# 68 VAL QQG 83 PHE HD 5.42
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.20, r4= 8.70,
igr1=1120,1121,1122,1124,1125,1126,
igr2=1365,1373,
/
#
# 68 VAL QQG 118 ILE QG2 5.07
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.21, r4= 8.71,
igr1=1120,1121,1122,1124,1125,1126,
igr2=1962,1963,1964,
/
#
# 68 VAL QQG 118 ILE QD1 6.12
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.91, r4=10.41,
igr1=1120,1121,1122,1124,1125,1126,
igr2=1969,1970,1971,
/
#
# 68 VAL QQG 119 PHE HE 5.53
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.37, r4= 8.87,
igr1=1120,1121,1122,1124,1125,1126,
igr2=1985,1989,
/
#
# 69 GLN H 69 GLN QB 3.68
&rst
ixpk= 0, nxpk= 0, iat=1130, -1, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
igr2=1134,1135,
/
#
# 69 GLN H 69 GLN QG 4.48
&rst
ixpk= 0, nxpk= 0, iat=1130, -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
igr2=1137,1138,
/
#
# 69 GLN QG 71 ALA H 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1,1164, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1=1137,1138,
/
#
# 69 GLN QG 118 ILE QG2 4.85
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.54, r4= 7.04,
igr1=1137,1138,
igr2=1962,1963,1964,
/
#
# 69 GLN QG 118 ILE QD1 4.01
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,
igr1=1137,1138,
igr2=1969,1970,1971,
/
#
# 70 GLN HA 70 GLN QG 3.49
&rst
ixpk= 0, nxpk= 0, iat=1149, -1, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
igr2=1154,1155,
/
#
# 70 GLN HA 70 GLN QE2 3.67
&rst
ixpk= 0, nxpk= 0, iat=1149, -1, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
igr2=1159,1160,
/
#
# 70 GLN QG 70 GLN QE2 2.88
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13,
igr1=1154,1155,
igr2=1159,1160,
/
#
# 70 GLN QG 71 ALA H 4.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1164, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,
igr1=1154,1155,
/
#
# 70 GLN QG 74 GLN HNE1 3.65
&rst
ixpk= 0, nxpk= 0, iat= -1,1215, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,
igr1=1154,1155,
/
#
# 70 GLN QG 74 GLN HNE2 3.31
&rst
ixpk= 0, nxpk= 0, iat= -1,1216, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,
igr1=1154,1155,
/
#
# 70 GLN QE2 71 ALA HA 5.29
&rst
ixpk= 0, nxpk= 0, iat= -1,1166, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
igr1=1159,1160,
/
#
# 72 LYS H 80 GLN QB 4.80
&rst
ixpk= 0, nxpk= 0, iat=1174, -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr2=1321,1322,
/
#
# 72 LYS HA 80 GLN QE2 3.52
&rst
ixpk= 0, nxpk= 0, iat=1176, -1, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
igr2=1329,1330,
/
#
# 72 LYS QB 72 LYS QD 3.47
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
igr1=1178,1179,
igr2=1184,1185,
/
#
# 72 LYS QB 73 GLY H 3.81
&rst
ixpk= 0, nxpk= 0, iat= -1,1196, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,
igr1=1178,1179,
/
#
# 72 LYS QB 80 GLN QE2 4.58
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,
igr1=1178,1179,
igr2=1329,1330,
/
#
# 72 LYS QB 118 ILE QD1 3.80
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
igr1=1178,1179,
igr2=1969,1970,1971,
/
#
# 72 LYS QG 80 GLN QE2 3.87
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
igr1=1181,1182,
igr2=1329,1330,
/
#
# 72 LYS QD 80 GLN QE2 3.99
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
igr1=1184,1185,
igr2=1329,1330,
/
#
# 72 LYS QE 80 GLN QE2 4.53
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21,
igr1=1187,1188,
igr2=1329,1330,
/
#
# 74 GLN H 75 LYS QG 5.34
&rst
ixpk= 0, nxpk= 0, iat=1203, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2=1227,1228,
/
#
# 75 LYS H 75 LYS QB 3.55
&rst
ixpk= 0, nxpk= 0, iat=1220, -1, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,
igr2=1224,1225,
/
#
# 75 LYS H 75 LYS QG 3.21
&rst
ixpk= 0, nxpk= 0, iat=1220, -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr2=1227,1228,
/
#
# 75 LYS HA 75 LYS QG 3.34
&rst
ixpk= 0, nxpk= 0, iat=1222, -1, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,
igr2=1227,1228,
/
#
# 75 LYS QB 75 LYS QD 2.68
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88,
igr1=1224,1225,
igr2=1230,1231,
/
#
# 75 LYS QB 76 ILE QD1 4.37
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.89, r4= 6.39,
igr1=1224,1225,
igr2=1255,1256,1257,
/
#
# 75 LYS QG 75 LYS QE 2.91
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,
igr1=1227,1228,
igr2=1233,1234,
/
#
# 76 ILE QG2 78 GLN QG 4.71
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
igr1=1248,1249,1250,
igr2=1287,1288,
/
#
# 77 ILE H 78 GLN QG 4.50
&rst
ixpk= 0, nxpk= 0, iat=1261, -1, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,
igr2=1287,1288,
/
#
# 77 ILE HA 80 GLN QB 4.65
&rst
ixpk= 0, nxpk= 0, iat=1263, -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
igr2=1321,1322,
/
#
# 77 ILE HA 80 GLN QE2 4.55
&rst
ixpk= 0, nxpk= 0, iat=1263, -1, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,
igr2=1329,1330,
/
#
# 77 ILE QG2 80 GLN QE2 4.07
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
igr1=1267,1268,1269,
igr2=1329,1330,
/
#
# 77 ILE HG13 78 GLN QG 4.51
&rst
ixpk= 0, nxpk= 0, iat=1272, -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
igr2=1287,1288,
/
#
# 77 ILE QD1 78 GLN QG 5.05
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
igr1=1274,1275,1276,
igr2=1287,1288,
/
#
# 78 GLN HA 78 GLN QG 3.69
&rst
ixpk= 0, nxpk= 0, iat=1282, -1, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,
igr2=1287,1288,
/
#
# 78 GLN QG 78 GLN HNE1 3.09
&rst
ixpk= 0, nxpk= 0, iat= -1,1292, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,
igr1=1287,1288,
/
#
# 78 GLN QG 78 GLN HNE2 3.31
&rst
ixpk= 0, nxpk= 0, iat= -1,1293, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,
igr1=1287,1288,
/
#
# 79 PHE HA 82 SER QB 5.34
&rst
ixpk= 0, nxpk= 0, iat=1299, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2=1350,1351,
/
#
# 80 GLN QB 80 GLN QE2 4.12
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
igr1=1321,1322,
igr2=1329,1330,
/
#
# 80 GLN QB 84 GLY H 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1,1377, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1=1321,1322,
/
#
# 80 GLN QB 118 ILE QG2 3.71
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,
igr1=1321,1322,
igr2=1962,1963,1964,
/
#
# 80 GLN QB 118 ILE QD1 5.09
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.86, r4= 7.36,
igr1=1321,1322,
igr2=1969,1970,1971,
/
#
# 80 GLN QB 119 PHE H 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1,1975, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1=1321,1322,
/
#
# 80 GLN QB 119 PHE HA 4.81
&rst
ixpk= 0, nxpk= 0, iat= -1,1977, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr1=1321,1322,
/
#
# 80 GLN QB 119 PHE HB3 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1,1980, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1=1321,1322,
/
#
# 80 GLN HG2 80 GLN QE2 3.54
&rst
ixpk= 0, nxpk= 0, iat=1324, -1, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47,
igr2=1329,1330,
/
#
# 80 GLN QE2 118 ILE HA 4.28
&rst
ixpk= 0, nxpk= 0, iat= -1,1958, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1=1329,1330,
/
#
# 80 GLN QE2 118 ILE QG2 3.72
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
igr1=1329,1330,
igr2=1962,1963,1964,
/
#
# 80 GLN QE2 118 ILE QD1 5.07
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.83, r4= 7.33,
igr1=1329,1330,
igr2=1969,1970,1971,
/
#
# 81 ASP H 82 SER QB 5.34
&rst
ixpk= 0, nxpk= 0, iat=1334, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2=1350,1351,
/
#
# 81 ASP HA 123 VAL QQG 5.44
&rst
ixpk= 0, nxpk= 0, iat=1336, -1, r1= 1.30, r2= 1.80, r3= 7.33, r4= 7.83,
igr2=2051,2052,2053,2055,2056,2057,
/
#
# 81 ASP QB 82 SER QB 5.17
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.51, r4= 7.01,
igr1=1338,1339,
igr2=1350,1351,
/
#
# 82 SER QB 83 PHE H 3.73
&rst
ixpk= 0, nxpk= 0, iat= -1,1357, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,
igr1=1350,1351,
/
#
# 82 SER QB 84 GLY H 4.90
&rst
ixpk= 0, nxpk= 0, iat= -1,1377, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
igr1=1350,1351,
/
#
# 82 SER QB 86 VAL QG1 4.56
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr1=1350,1351,
igr2=1412,1413,1414,1416,1417,1418,
/
#
# 84 GLY H 123 VAL QQG 4.31
&rst
ixpk= 0, nxpk= 0, iat=1377, -1, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
igr2=2051,2052,2053,2055,2056,2057,
/
#
# 84 GLY HA2 123 VAL QQG 3.70
&rst
ixpk= 0, nxpk= 0, iat=1379, -1, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,
igr2=2051,2052,2053,2055,2056,2057,
/
#
# 85 LYS H 123 VAL QQG 3.96
&rst
ixpk= 0, nxpk= 0, iat=1384, -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr2=2051,2052,2053,2055,2056,2057,
/
#
# 85 LYS HA 123 VAL QQG 4.16
&rst
ixpk= 0, nxpk= 0, iat=1386, -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr2=2051,2052,2053,2055,2056,2057,
/
#
# 86 VAL H 123 VAL QQG 7.64
&rst
ixpk= 0, nxpk= 0, iat=1406, -1, r1= 1.30, r2= 1.80, r3=10.30, r4=10.80,
igr2=2051,2052,2053,2055,2056,2057,
/
#
# 86 VAL HA 89 GLU QG 4.42
&rst
ixpk= 0, nxpk= 0, iat=1408, -1, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
igr2=1449,1450,
/
#
# 87 ALA H 123 VAL QQG 4.44
&rst
ixpk= 0, nxpk= 0, iat=1422, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2=2051,2052,2053,2055,2056,2057,
/
#
# 87 ALA HA 91 LEU QQD 5.28
&rst
ixpk= 0, nxpk= 0, iat=1424, -1, r1= 1.30, r2= 1.80, r3= 7.12, r4= 7.62,
igr2=1482,1483,1484,1486,1487,1488,
/
#
# 87 ALA QB 91 LEU QQD 5.3
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.58, r4= 9.08,
igr1=1426,1427,1428,
igr2=1482,1483,1484,1486,1487,1488,
/
#
# 87 ALA QB 123 VAL QQG 3.20
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
igr1=1426,1427,1428,
igr2=2051,2052,2053,2055,2056,2057,
/
#
# 87 ALA QB 127 ILE QG1 3.78
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
igr1=1426,1427,1428,
igr2=2113,2114,
/
#
# 88 ALA H 89 GLU QG 4.68
&rst
ixpk= 0, nxpk= 0, iat=1432, -1, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
igr2=1449,1450,
/
#
# 88 ALA H 126 ASP QB 4.84
&rst
ixpk= 0, nxpk= 0, iat=1432, -1, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
igr2=2095,2096,
/
#
# 88 ALA H 127 ILE QG1 3.80
&rst
ixpk= 0, nxpk= 0, iat=1432, -1, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,
igr2=2113,2114,
/
#
# 88 ALA HA 91 LEU QQD 6.46
&rst
ixpk= 0, nxpk= 0, iat=1434, -1, r1= 1.30, r2= 1.80, r3= 8.71, r4= 9.21,
igr2=1482,1483,1484,1486,1487,1488,
/
#
# 88 ALA HA 126 ASP QB 4.61
&rst
ixpk= 0, nxpk= 0, iat=1434, -1, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67,
igr2=2095,2096,
/
#
# 88 ALA HA 130 SER QB 4.59
&rst
ixpk= 0, nxpk= 0, iat=1434, -1, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
igr2=2165,2166,
/
#
# 88 ALA QB 123 VAL QQG 3.75
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
igr1=1436,1437,1438,
igr2=2051,2052,2053,2055,2056,2057,
/
#
# 88 ALA QB 130 SER QB 3.98
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr1=1436,1437,1438,
igr2=2165,2166,
/
#
# 89 GLU H 126 ASP QB 5.34
&rst
ixpk= 0, nxpk= 0, iat=1442, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2=2095,2096,
/
#
# 90 VAL HB 91 LEU QQD 5.53
&rst
ixpk= 0, nxpk= 0, iat=1461, -1, r1= 1.30, r2= 1.80, r3= 7.45, r4= 7.95,
igr2=1482,1483,1484,1486,1487,1488,
/
#
# 90 VAL QG1 91 LEU QQD 5.61
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3=10.19, r4=10.69,
igr1=1463,1464,1465,1467,1468,1469,
igr2=1482,1483,1484,1486,1487,1488,
/
#
# 91 LEU H 91 LEU QQD 5.36
&rst
ixpk= 0, nxpk= 0, iat=1473, -1, r1= 1.30, r2= 1.80, r3= 7.23, r4= 7.73,
igr2=1482,1483,1484,1486,1487,1488,
/
#
# 91 LEU HA 91 LEU QQD 5.15
&rst
ixpk= 0, nxpk= 0, iat=1475, -1, r1= 1.30, r2= 1.80, r3= 6.94, r4= 7.44,
igr2=1482,1483,1484,1486,1487,1488,
/
#
# 91 LEU HA 106 LEU QQD 5.62
&rst
ixpk= 0, nxpk= 0, iat=1475, -1, r1= 1.30, r2= 1.80, r3= 7.58, r4= 8.08,
igr2=1752,1753,1754,1756,1757,1758,
/
#
# 91 LEU HA 131 LEU QQD 6.74
&rst
ixpk= 0, nxpk= 0, iat=1475, -1, r1= 1.30, r2= 1.80, r3= 9.09, r4= 9.59,
igr2=2181,2182,2183,2185,2186,2187,
/
#
# 91 LEU HB2 91 LEU QQD 4.97
&rst
ixpk= 0, nxpk= 0, iat=1477, -1, r1= 1.30, r2= 1.80, r3= 6.70, r4= 7.20,
igr2=1482,1483,1484,1486,1487,1488,
/
#
# 91 LEU HB2 110 VAL QQG 4.43
&rst
ixpk= 0, nxpk= 0, iat=1477, -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr2=1819,1820,1821,1823,1824,1825,
/
#
# 91 LEU HB3 91 LEU QQD 4.95
&rst
ixpk= 0, nxpk= 0, iat=1478, -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
igr2=1482,1483,1484,1486,1487,1488,
/
#
# 91 LEU HB3 110 VAL QQG 3.50
&rst
ixpk= 0, nxpk= 0, iat=1478, -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
igr2=1819,1820,1821,1823,1824,1825,
/
#
# 91 LEU HB3 131 LEU QQD 5.22
&rst
ixpk= 0, nxpk= 0, iat=1478, -1, r1= 1.30, r2= 1.80, r3= 7.04, r4= 7.54,
igr2=2181,2182,2183,2185,2186,2187,
/
#
# 91 LEU HG 106 LEU QQD 5.58
&rst
ixpk= 0, nxpk= 0, iat=1480, -1, r1= 1.30, r2= 1.80, r3= 7.52, r4= 8.02,
igr2=1752,1753,1754,1756,1757,1758,
/
#
# 91 LEU HG 110 VAL QQG 4.30
&rst
ixpk= 0, nxpk= 0, iat=1480, -1, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
igr2=1819,1820,1821,1823,1824,1825,
/
#
# 91 LEU QQD 92 GLY H 4.17
&rst
ixpk= 0, nxpk= 0, iat= -1,1492, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
igr1=1482,1483,1484,1486,1487,1488,
/
#
# 91 LEU QQD 94 ILE QD1 3.02
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
igr1=1482,1483,1484,1486,1487,1488,
igr2=1536,1537,1538,
/
#
# 91 LEU QQD 110 VAL HA 3.43
&rst
ixpk= 0, nxpk= 0, iat= -1,1815, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
igr1=1482,1483,1484,1486,1487,1488,
/
#
# 91 LEU QQD 127 ILE QD1 3.43
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,
igr1=1482,1483,1484,1486,1487,1488,
igr2=2116,2117,2118,
/
#
# 92 GLY H 93 ARG QD 5.34
&rst
ixpk= 0, nxpk= 0, iat=1492, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2=1509,1510,
/
#
# 92 GLY H 106 LEU QQD 7.51
&rst
ixpk= 0, nxpk= 0, iat=1492, -1, r1= 1.30, r2= 1.80, r3=10.12, r4=10.62,
igr2=1752,1753,1754,1756,1757,1758,
/
#
# 92 GLY H 110 VAL QQG 5.12
&rst
ixpk= 0, nxpk= 0, iat=1492, -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr2=1819,1820,1821,1823,1824,1825,
/
#
# 92 GLY H 131 LEU QQD 5.65
&rst
ixpk= 0, nxpk= 0, iat=1492, -1, r1= 1.30, r2= 1.80, r3= 7.62, r4= 8.12,
igr2=2181,2182,2183,2185,2186,2187,
/
#
# 92 GLY HA2 131 LEU QQD 5.47
&rst
ixpk= 0, nxpk= 0, iat=1494, -1, r1= 1.30, r2= 1.80, r3= 7.37, r4= 7.87,
igr2=2181,2182,2183,2185,2186,2187,
/
#
# 92 GLY HA3 131 LEU QQD 5.33
&rst
ixpk= 0, nxpk= 0, iat=1495, -1, r1= 1.30, r2= 1.80, r3= 7.18, r4= 7.68,
igr2=2181,2182,2183,2185,2186,2187,
/
#
# 93 ARG H 93 ARG QD 3.41
&rst
ixpk= 0, nxpk= 0, iat=1499, -1, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,
igr2=1509,1510,
/
#
# 93 ARG HA 93 ARG QD 3.17
&rst
ixpk= 0, nxpk= 0, iat=1501, -1, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06,
igr2=1509,1510,
/
#
# 93 ARG QD 94 ILE H 5.01
&rst
ixpk= 0, nxpk= 0, iat= -1,1523, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
igr1=1509,1510,
/
#
# 93 ARG QD 95 ASN H 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1,1542, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1=1509,1510,
/
#
# 93 ARG QD 96 GLN HG2 4.86
&rst
ixpk= 0, nxpk= 0, iat= -1,1563, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
igr1=1509,1510,
/
#
# 93 ARG QD 96 GLN HG3 4.73
&rst
ixpk= 0, nxpk= 0, iat= -1,1564, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
igr1=1509,1510,
/
#
# 94 ILE HA 97 GLU QB 3.80
&rst
ixpk= 0, nxpk= 0, iat=1525, -1, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,
igr2=1577,1578,
/
#
# 94 ILE HB 97 GLU QB 5.15
&rst
ixpk= 0, nxpk= 0, iat=1527, -1, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr2=1577,1578,
/
#
# 94 ILE HB 106 LEU QQD 6.39
&rst
ixpk= 0, nxpk= 0, iat=1527, -1, r1= 1.30, r2= 1.80, r3= 8.61, r4= 9.11,
igr2=1752,1753,1754,1756,1757,1758,
/
#
# 94 ILE QD1 106 LEU QQD 4.97
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.05, r4= 8.55,
igr1=1536,1537,1538,
igr2=1752,1753,1754,1756,1757,1758,
/
#
# 95 ASN H 106 LEU QQD 5.48
&rst
ixpk= 0, nxpk= 0, iat=1542, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr2=1752,1753,1754,1756,1757,1758,
/
#
# 95 ASN H 131 LEU QQD 6.69
&rst
ixpk= 0, nxpk= 0, iat=1542, -1, r1= 1.30, r2= 1.80, r3= 9.02, r4= 9.52,
igr2=2181,2182,2183,2185,2186,2187,
/
#
# 95 ASN HA 95 ASN QD2 4.16
&rst
ixpk= 0, nxpk= 0, iat=1544, -1, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
igr2=1551,1552,
/
#
# 95 ASN HA 106 LEU QQD 5.6
&rst
ixpk= 0, nxpk= 0, iat=1544, -1, r1= 1.30, r2= 1.80, r3= 7.55, r4= 8.05,
igr2=1752,1753,1754,1756,1757,1758,
/
#
# 95 ASN HA 131 LEU QQD 6.89
&rst
ixpk= 0, nxpk= 0, iat=1544, -1, r1= 1.30, r2= 1.80, r3= 9.29, r4= 9.79,
igr2=2181,2182,2183,2185,2186,2187,
/
#
# 95 ASN QB 106 LEU QQD 5.44
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.23, r4= 8.73,
igr1=1546,1547,
igr2=1752,1753,1754,1756,1757,1758,
/
#
# 95 ASN QB 131 LEU QQD 5.15
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.79, r4= 8.29,
igr1=1546,1547,
igr2=2181,2182,2183,2185,2186,2187,
/
#
# 95 ASN QD2 96 GLN H 4.98
&rst
ixpk= 0, nxpk= 0, iat= -1,1556, r1= 1.30, r2= 1.80, r3= 5.59, r4= 6.09,
igr1=1551,1552,
/
#
# 95 ASN QD2 96 GLN HA 5.08
&rst
ixpk= 0, nxpk= 0, iat= -1,1558, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr1=1551,1552,
/
#
# 95 ASN QD2 103 LYS QG 4.58
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,
igr1=1551,1552,
igr2=1684,1685,
/
#
# 95 ASN QD2 103 LYS QE 3.73
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
igr1=1551,1552,
igr2=1690,1691,
/
#
# 95 ASN QD2 106 LEU QQD 6.58
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.96, r4=10.46,
igr1=1551,1552,
igr2=1752,1753,1754,1756,1757,1758,
/
#
# 95 ASN QD2 131 LEU HB3 3.60
&rst
ixpk= 0, nxpk= 0, iat= -1,2177, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
igr1=1551,1552,
/
#
# 95 ASN QD2 131 LEU QQD 5.55
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.40, r4= 8.90,
igr1=1551,1552,
igr2=2181,2182,2183,2185,2186,2187,
/
#
# 95 ASN QD2 134 ALA QB 3.31
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
igr1=1551,1552,
igr2=2215,2216,2217,
/
#
# 96 GLN HB2 97 GLU QB 4.51
&rst
ixpk= 0, nxpk= 0, iat=1560, -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
igr2=1577,1578,
/
#
# 96 GLN HG3 97 GLU QB 5.34
&rst
ixpk= 0, nxpk= 0, iat=1564, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2=1577,1578,
/
#
# 97 GLU H 97 GLU QB 3.36
&rst
ixpk= 0, nxpk= 0, iat=1573, -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
igr2=1577,1578,
/
#
# 97 GLU H 97 GLU QG 4.39
&rst
ixpk= 0, nxpk= 0, iat=1573, -1, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,
igr2=1580,1581,
/
#
# 97 GLU HA 97 GLU QG 3.27
&rst
ixpk= 0, nxpk= 0, iat=1575, -1, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,
igr2=1580,1581,
/
#
# 97 GLU QB 98 PHE H 3.30
&rst
ixpk= 0, nxpk= 0, iat= -1,1588, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,
igr1=1577,1578,
/
#
# 97 GLU QB 98 PHE HD 4.69
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41,
igr1=1577,1578,
igr2=1596,1604,
/
#
# 97 GLU QG 98 PHE H 4.38
&rst
ixpk= 0, nxpk= 0, iat= -1,1588, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
igr1=1580,1581,
/
#
# 98 PHE H 99 PRO QD 4.74
&rst
ixpk= 0, nxpk= 0, iat=1588, -1, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
igr2=1609,1610,
/
#
# 98 PHE HA 102 LEU QQD 6.37
&rst
ixpk= 0, nxpk= 0, iat=1590, -1, r1= 1.30, r2= 1.80, r3= 8.59, r4= 9.09,
igr2=1667,1668,1669,1671,1672,1673,
/
#
# 98 PHE HB2 102 LEU QQD 7.04
&rst
ixpk= 0, nxpk= 0, iat=1592, -1, r1= 1.30, r2= 1.80, r3= 9.49, r4= 9.99,
igr2=1667,1668,1669,1671,1672,1673,
/
#
# 98 PHE HB2 106 LEU QQD 7.64
&rst
ixpk= 0, nxpk= 0, iat=1592, -1, r1= 1.30, r2= 1.80, r3=10.30, r4=10.80,
igr2=1752,1753,1754,1756,1757,1758,
/
#
# 98 PHE HB3 99 PRO QD 5.35
&rst
ixpk= 0, nxpk= 0, iat=1593, -1, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51,
igr2=1609,1610,
/
#
# 98 PHE HB3 102 LEU QQD 7.51
&rst
ixpk= 0, nxpk= 0, iat=1593, -1, r1= 1.30, r2= 1.80, r3=10.12, r4=10.62,
igr2=1667,1668,1669,1671,1672,1673,
/
#
# 98 PHE HD 99 PRO QD 4.16
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr1=1596,1604,
igr2=1609,1610,
/
#
# 98 PHE HD 102 LEU QQD 6.88
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3=10.41, r4=10.91,
igr1=1596,1604,
igr2=1667,1668,1669,1671,1672,1673,
/
#
# 98 PHE HD 106 LEU QQD 6
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
igr1=1596,1604,
igr2=1752,1753,1754,1756,1757,1758,
/
#
# 98 PHE HE 102 LEU QQD 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.15, r4= 9.65,
igr1=1598,1602,
igr2=1667,1668,1669,1671,1672,1673,
/
#
# 99 PRO HB2 102 LEU QQD 6.81
&rst
ixpk= 0, nxpk= 0, iat=1615, -1, r1= 1.30, r2= 1.80, r3= 9.18, r4= 9.68,
igr2=1667,1668,1669,1671,1672,1673,
/
#
# 99 PRO HG2 102 LEU QQD 5.3
&rst
ixpk= 0, nxpk= 0, iat=1612, -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
igr2=1667,1668,1669,1671,1672,1673,
/
#
# 99 PRO QD 101 ASP H 5.19
&rst
ixpk= 0, nxpk= 0, iat= -1,1646, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33,
igr1=1609,1610,
/
#
# 99 PRO QD 102 LEU H 3.78
&rst
ixpk= 0, nxpk= 0, iat= -1,1658, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
igr1=1609,1610,
/
#
# 99 PRO QD 102 LEU HB2 4.89
&rst
ixpk= 0, nxpk= 0, iat= -1,1662, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
igr1=1609,1610,
/
#
# 99 PRO QD 102 LEU HB3 5.23
&rst
ixpk= 0, nxpk= 0, iat= -1,1663, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,
igr1=1609,1610,
/
#
# 99 PRO QD 102 LEU HG 4.13
&rst
ixpk= 0, nxpk= 0, iat= -1,1665, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
igr1=1609,1610,
/
#
# 99 PRO QD 102 LEU QQD 5.35
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.10, r4= 8.60,
igr1=1609,1610,
igr2=1667,1668,1669,1671,1672,1673,
/
#
# 99 PRO QD 103 LYS H 4.51
&rst
ixpk= 0, nxpk= 0, iat= -1,1677, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
igr1=1609,1610,
/
#
# 100 ARG HA 100 ARG QG 3.49
&rst
ixpk= 0, nxpk= 0, iat=1624, -1, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
igr2=1629,1630,
/
#
# 100 ARG QG 100 ARG QD 2.35
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 2.96, r4= 3.46,
igr1=1629,1630,
igr2=1632,1633,
/
#
# 100 ARG QG 101 ASP H 3.38
&rst
ixpk= 0, nxpk= 0, iat= -1,1646, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,
igr1=1629,1630,
/
#
# 100 ARG QG 101 ASP HA 3.76
&rst
ixpk= 0, nxpk= 0, iat= -1,1648, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
igr1=1629,1630,
/
#
# 100 ARG QG 101 ASP HB2 4.92
&rst
ixpk= 0, nxpk= 0, iat= -1,1650, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
igr1=1629,1630,
/
#
# 100 ARG QG 101 ASP HB3 5.01
&rst
ixpk= 0, nxpk= 0, iat= -1,1651, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
igr1=1629,1630,
/
#
# 101 ASP H 102 LEU QQD 6.72
&rst
ixpk= 0, nxpk= 0, iat=1646, -1, r1= 1.30, r2= 1.80, r3= 9.06, r4= 9.56,
igr2=1667,1668,1669,1671,1672,1673,
/
#
# 101 ASP HA 102 LEU QQD 6.87
&rst
ixpk= 0, nxpk= 0, iat=1648, -1, r1= 1.30, r2= 1.80, r3= 9.26, r4= 9.76,
igr2=1667,1668,1669,1671,1672,1673,
/
#
# 101 ASP HB2 102 LEU QQD 6.15
&rst
ixpk= 0, nxpk= 0, iat=1650, -1, r1= 1.30, r2= 1.80, r3= 8.29, r4= 8.79,
igr2=1667,1668,1669,1671,1672,1673,
/
#
# 101 ASP HB3 102 LEU QQD 6.17
&rst
ixpk= 0, nxpk= 0, iat=1651, -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
igr2=1667,1668,1669,1671,1672,1673,
/
#
# 101 ASP HB3 105 LYS QG 5.33
&rst
ixpk= 0, nxpk= 0, iat=1651, -1, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
igr2=1728,1729,
/
#
# 102 LEU H 102 LEU QQD 5.16
&rst
ixpk= 0, nxpk= 0, iat=1658, -1, r1= 1.30, r2= 1.80, r3= 6.96, r4= 7.46,
igr2=1667,1668,1669,1671,1672,1673,
/
#
# 102 LEU HA 102 LEU QQD 5.19
&rst
ixpk= 0, nxpk= 0, iat=1660, -1, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,
igr2=1667,1668,1669,1671,1672,1673,
/
#
# 102 LEU QQD 103 LYS H 3.99
&rst
ixpk= 0, nxpk= 0, iat= -1,1677, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
igr1=1667,1668,1669,1671,1672,1673,
/
#
# 104 LYS H 104 LYS QG 3.22
&rst
ixpk= 0, nxpk= 0, iat=1699, -1, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11,
igr2=1706,1707,
/
#
# 104 LYS HA 104 LYS QG 3.18
&rst
ixpk= 0, nxpk= 0, iat=1701, -1, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07,
igr2=1706,1707,
/
#
# 105 LYS HA 105 LYS QD 4.55
&rst
ixpk= 0, nxpk= 0, iat=1723, -1, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,
igr2=1731,1732,
/
#
# 105 LYS HA 109 VAL QQG 4.52
&rst
ixpk= 0, nxpk= 0, iat=1723, -1, r1= 1.30, r2= 1.80, r3= 6.09, r4= 6.59,
igr2=1803,1804,1805,1807,1808,1809,
/
#
# 106 LEU H 106 LEU QQD 6.66
&rst
ixpk= 0, nxpk= 0, iat=1743, -1, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
igr2=1752,1753,1754,1756,1757,1758,
/
#
# 106 LEU H 109 VAL QQG 4.41
&rst
ixpk= 0, nxpk= 0, iat=1743, -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
igr2=1803,1804,1805,1807,1808,1809,
/
#
# 106 LEU HA 109 VAL QQG 3.51
&rst
ixpk= 0, nxpk= 0, iat=1745, -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
igr2=1803,1804,1805,1807,1808,1809,
/
#
# 106 LEU HB3 106 LEU QQD 5.28
&rst
ixpk= 0, nxpk= 0, iat=1748, -1, r1= 1.30, r2= 1.80, r3= 7.12, r4= 7.62,
igr2=1752,1753,1754,1756,1757,1758,
/
#
# 106 LEU HG 109 VAL QQG 3.66
&rst
ixpk= 0, nxpk= 0, iat=1750, -1, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,
igr2=1803,1804,1805,1807,1808,1809,
/
#
# 106 LEU HG 110 VAL QQG 3.60
&rst
ixpk= 0, nxpk= 0, iat=1750, -1, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
igr2=1819,1820,1821,1823,1824,1825,
/
#
# 106 LEU QQD 107 SER H 3.84
&rst
ixpk= 0, nxpk= 0, iat= -1,1762, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
igr1=1752,1753,1754,1756,1757,1758,
/
#
# 106 LEU QQD 107 SER HA 3.49
&rst
ixpk= 0, nxpk= 0, iat= -1,1764, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
igr1=1752,1753,1754,1756,1757,1758,
/
#
# 106 LEU QQD 108 ARG H 5.16
&rst
ixpk= 0, nxpk= 0, iat= -1,1773, r1= 1.30, r2= 1.80, r3= 6.96, r4= 7.46,
igr1=1752,1753,1754,1756,1757,1758,
/
#
# 106 LEU QQD 109 VAL H 4.86
&rst
ixpk= 0, nxpk= 0, iat= -1,1797, r1= 1.30, r2= 1.80, r3= 6.55, r4= 7.05,
igr1=1752,1753,1754,1756,1757,1758,
/
#
# 106 LEU QQD 109 VAL HB 4.88
&rst
ixpk= 0, nxpk= 0, iat= -1,1801, r1= 1.30, r2= 1.80, r3= 6.58, r4= 7.08,
igr1=1752,1753,1754,1756,1757,1758,
/
#
# 106 LEU QQD 109 VAL QQG 3.36
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
igr1=1752,1753,1754,1756,1757,1758,
igr2=1803,1804,1805,1807,1808,1809,
/
#
# 106 LEU QQD 110 VAL H 3.21
&rst
ixpk= 0, nxpk= 0, iat= -1,1813, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,
igr1=1752,1753,1754,1756,1757,1758,
/
#
# 106 LEU QQD 110 VAL QQG 2.66
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
igr1=1752,1753,1754,1756,1757,1758,
igr2=1819,1820,1821,1823,1824,1825,
/
#
# 106 LEU QQD 131 LEU QQD 7.59
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3=13.79, r4=14.29,
igr1=1752,1753,1754,1756,1757,1758,
igr2=2181,2182,2183,2185,2186,2187,
/
#
# 107 SER H 109 VAL QQG 5.07
&rst
ixpk= 0, nxpk= 0, iat=1762, -1, r1= 1.30, r2= 1.80, r3= 6.83, r4= 7.33,
igr2=1803,1804,1805,1807,1808,1809,
/
#
# 107 SER HA 131 LEU QQD 7.04
&rst
ixpk= 0, nxpk= 0, iat=1764, -1, r1= 1.30, r2= 1.80, r3= 9.49, r4= 9.99,
igr2=2181,2182,2183,2185,2186,2187,
/
#
# 108 ARG H 108 ARG QD 4.12
&rst
ixpk= 0, nxpk= 0, iat=1773, -1, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
igr2=1783,1784,
/
#
# 108 ARG H 109 VAL QQG 4.13
&rst
ixpk= 0, nxpk= 0, iat=1773, -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
igr2=1803,1804,1805,1807,1808,1809,
/
#
# 108 ARG H 110 VAL QQG 5.44
&rst
ixpk= 0, nxpk= 0, iat=1773, -1, r1= 1.30, r2= 1.80, r3= 7.33, r4= 7.83,
igr2=1819,1820,1821,1823,1824,1825,
/
#
# 108 ARG HA 111 ASN QB 3.49
&rst
ixpk= 0, nxpk= 0, iat=1775, -1, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
igr2=1833,1834,
/
#
# 108 ARG QB 108 ARG QD 3.26
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
igr1=1777,1778,
igr2=1783,1784,
/
#
# 108 ARG QB 109 VAL H 3.21
&rst
ixpk= 0, nxpk= 0, iat= -1,1797, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr1=1777,1778,
/
#
# 108 ARG QB 109 VAL HA 5.19
&rst
ixpk= 0, nxpk= 0, iat= -1,1799, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33,
igr1=1777,1778,
/
#
# 108 ARG QB 112 ILE QD1 3.65
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
igr1=1777,1778,
igr2=1856,1857,1858,
/
#
# 108 ARG QD 112 ILE QD1 3.83
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
igr1=1783,1784,
igr2=1856,1857,1858,
/
#
# 109 VAL H 109 VAL QQG 5.06
&rst
ixpk= 0, nxpk= 0, iat=1797, -1, r1= 1.30, r2= 1.80, r3= 6.82, r4= 7.32,
igr2=1803,1804,1805,1807,1808,1809,
/
#
# 109 VAL H 110 VAL QQG 7.63
&rst
ixpk= 0, nxpk= 0, iat=1797, -1, r1= 1.30, r2= 1.80, r3=10.29, r4=10.79,
igr2=1819,1820,1821,1823,1824,1825,
/
#
# 109 VAL HA 109 VAL QQG 5.06
&rst
ixpk= 0, nxpk= 0, iat=1799, -1, r1= 1.30, r2= 1.80, r3= 6.82, r4= 7.32,
igr2=1803,1804,1805,1807,1808,1809,
/
#
# 109 VAL HA 111 ASN QB 5.34
&rst
ixpk= 0, nxpk= 0, iat=1799, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2=1833,1834,
/
#
# 109 VAL HB 110 VAL QQG 5.76
&rst
ixpk= 0, nxpk= 0, iat=1801, -1, r1= 1.30, r2= 1.80, r3= 7.76, r4= 8.26,
igr2=1819,1820,1821,1823,1824,1825,
/
#
# 109 VAL QQG 110 VAL HA 7.64
&rst
ixpk= 0, nxpk= 0, iat= -1,1815, r1= 1.30, r2= 1.80, r3=10.30, r4=10.80,
igr1=1803,1804,1805,1807,1808,1809,
/
#
# 109 VAL QQG 112 ILE H 7.64
&rst
ixpk= 0, nxpk= 0, iat= -1,1843, r1= 1.30, r2= 1.80, r3=10.30, r4=10.80,
igr1=1803,1804,1805,1807,1808,1809,
/
#
# 109 VAL QQG 112 ILE HB 6.4
&rst
ixpk= 0, nxpk= 0, iat= -1,1847, r1= 1.30, r2= 1.80, r3= 8.63, r4= 9.13,
igr1=1803,1804,1805,1807,1808,1809,
/
#
# 109 VAL QQG 113 LEU HA 7.15
&rst
ixpk= 0, nxpk= 0, iat= -1,1864, r1= 1.30, r2= 1.80, r3= 9.64, r4=10.14,
igr1=1803,1804,1805,1807,1808,1809,
/
#
# 109 VAL QQG 113 LEU QB 6.13
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.28, r4= 9.78,
igr1=1803,1804,1805,1807,1808,1809,
igr2=1866,1867,
/
#
# 109 VAL QQG 113 LEU HG 7.64
&rst
ixpk= 0, nxpk= 0, iat= -1,1869, r1= 1.30, r2= 1.80, r3=10.30, r4=10.80,
igr1=1803,1804,1805,1807,1808,1809,
/
#
# 110 VAL H 110 VAL QQG 4.79
&rst
ixpk= 0, nxpk= 0, iat=1813, -1, r1= 1.30, r2= 1.80, r3= 6.46, r4= 6.96,
igr2=1819,1820,1821,1823,1824,1825,
/
#
# 110 VAL HA 110 VAL QQG 4.93
&rst
ixpk= 0, nxpk= 0, iat=1815, -1, r1= 1.30, r2= 1.80, r3= 6.65, r4= 7.15,
igr2=1819,1820,1821,1823,1824,1825,
/
#
# 110 VAL HA 113 LEU QB 3.65
&rst
ixpk= 0, nxpk= 0, iat=1815, -1, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,
igr2=1866,1867,
/
#
# 110 VAL HB 111 ASN QB 5.34
&rst
ixpk= 0, nxpk= 0, iat=1817, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2=1833,1834,
/
#
# 110 VAL HB 131 LEU QQD 6.35
&rst
ixpk= 0, nxpk= 0, iat=1817, -1, r1= 1.30, r2= 1.80, r3= 8.56, r4= 9.06,
igr2=2181,2182,2183,2185,2186,2187,
/
#
# 110 VAL QQG 111 ASN H 5.33
&rst
ixpk= 0, nxpk= 0, iat= -1,1829, r1= 1.30, r2= 1.80, r3= 7.18, r4= 7.68,
igr1=1819,1820,1821,1823,1824,1825,
/
#
# 110 VAL QQG 111 ASN HA 5.84
&rst
ixpk= 0, nxpk= 0, iat= -1,1831, r1= 1.30, r2= 1.80, r3= 7.87, r4= 8.37,
igr1=1819,1820,1821,1823,1824,1825,
/
#
# 110 VAL QQG 111 ASN QB 7.23
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3=10.94, r4=11.44,
igr1=1819,1820,1821,1823,1824,1825,
igr2=1833,1834,
/
#
# 110 VAL QQG 111 ASN HND1 6.44
&rst
ixpk= 0, nxpk= 0, iat= -1,1838, r1= 1.30, r2= 1.80, r3= 8.68, r4= 9.18,
igr1=1819,1820,1821,1823,1824,1825,
/
#
# 110 VAL QQG 111 ASN HND2 6.47
&rst
ixpk= 0, nxpk= 0, iat= -1,1839, r1= 1.30, r2= 1.80, r3= 8.72, r4= 9.22,
igr1=1819,1820,1821,1823,1824,1825,
/
#
# 110 VAL QQG 127 ILE QG2 4.73
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.66, r4= 8.16,
igr1=1819,1820,1821,1823,1824,1825,
igr2=2109,2110,2111,
/
#
# 110 VAL QQG 127 ILE QD1 6.27
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3=10.15, r4=10.65,
igr1=1819,1820,1821,1823,1824,1825,
igr2=2116,2117,2118,
/
#
# 110 VAL QQG 128 GLU H 5.62
&rst
ixpk= 0, nxpk= 0, iat= -1,2122, r1= 1.30, r2= 1.80, r3= 7.58, r4= 8.08,
igr1=1819,1820,1821,1823,1824,1825,
/
#
# 110 VAL QQG 128 GLU HA 6.4
&rst
ixpk= 0, nxpk= 0, iat= -1,2124, r1= 1.30, r2= 1.80, r3= 8.63, r4= 9.13,
igr1=1819,1820,1821,1823,1824,1825,
/
#
# 110 VAL QQG 128 GLU QG 6.03
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.12, r4= 9.62,
igr1=1819,1820,1821,1823,1824,1825,
igr2=2129,2130,
/
#
# 110 VAL QQG 131 LEU H 7.3
&rst
ixpk= 0, nxpk= 0, iat= -1,2172, r1= 1.30, r2= 1.80, r3= 9.84, r4=10.34,
igr1=1819,1820,1821,1823,1824,1825,
/
#
# 110 VAL QQG 131 LEU HG 6.03
&rst
ixpk= 0, nxpk= 0, iat= -1,2179, r1= 1.30, r2= 1.80, r3= 8.13, r4= 8.63,
igr1=1819,1820,1821,1823,1824,1825,
/
#
# 110 VAL QQG 131 LEU QQD 6.8
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3=12.36, r4=12.86,
igr1=1819,1820,1821,1823,1824,1825,
igr2=2181,2182,2183,2185,2186,2187,
/
#
# 111 ASN H 111 ASN QB 2.78
&rst
ixpk= 0, nxpk= 0, iat=1829, -1, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,
igr2=1833,1834,
/
#
# 111 ASN HA 115 GLU QB 4.88
&rst
ixpk= 0, nxpk= 0, iat=1831, -1, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
igr2=1907,1908,
/
#
# 111 ASN QB 111 ASN HND1 2.81
&rst
ixpk= 0, nxpk= 0, iat= -1,1838, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
igr1=1833,1834,
/
#
# 111 ASN QB 111 ASN HND2 3.47
&rst
ixpk= 0, nxpk= 0, iat= -1,1839, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,
igr1=1833,1834,
/
#
# 111 ASN QB 112 ILE HA 4.68
&rst
ixpk= 0, nxpk= 0, iat= -1,1845, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
igr1=1833,1834,
/
#
# 111 ASN QB 112 ILE HB 5.13
&rst
ixpk= 0, nxpk= 0, iat= -1,1847, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
igr1=1833,1834,
/
#
# 111 ASN QB 112 ILE QD1 4.34
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
igr1=1833,1834,
igr2=1856,1857,1858,
/
#
# 111 ASN QB 113 LEU H 4.65
&rst
ixpk= 0, nxpk= 0, iat= -1,1862, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
igr1=1833,1834,
/
#
# 111 ASN QB 114 LYS QD 4.75
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
igr1=1833,1834,
igr2=1891,1892,
/
#
# 111 ASN QB 115 GLU QB 4.75
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
igr1=1833,1834,
igr2=1907,1908,
/
#
# 112 ILE H 112 ILE QG1 3.74
&rst
ixpk= 0, nxpk= 0, iat=1843, -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
igr2=1853,1854,
/
#
# 112 ILE H 115 GLU QB 4.69
&rst
ixpk= 0, nxpk= 0, iat=1843, -1, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr2=1907,1908,
/
#
# 112 ILE H 115 GLU QG 5.34
&rst
ixpk= 0, nxpk= 0, iat=1843, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2=1910,1911,
/
#
# 112 ILE HA 112 ILE QG1 3.64
&rst
ixpk= 0, nxpk= 0, iat=1845, -1, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59,
igr2=1853,1854,
/
#
# 112 ILE HA 115 GLU QB 3.43
&rst
ixpk= 0, nxpk= 0, iat=1845, -1, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35,
igr2=1907,1908,
/
#
# 112 ILE HA 115 GLU QG 3.53
&rst
ixpk= 0, nxpk= 0, iat=1845, -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
igr2=1910,1911,
/
#
# 112 ILE QG2 112 ILE QG1 3.16
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,
igr1=1849,1850,1851,
igr2=1853,1854,
/
#
# 112 ILE QG2 113 LEU QB 4.75
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.40, r4= 6.90,
igr1=1849,1850,1851,
igr2=1866,1867,
/
#
# 112 ILE QG2 115 GLU QB 5.03
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.78, r4= 7.28,
igr1=1849,1850,1851,
igr2=1907,1908,
/
#
# 112 ILE QG2 115 GLU QG 4.38
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
igr1=1849,1850,1851,
igr2=1910,1911,
/
#
# 112 ILE QG1 115 GLU QB 4.78
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,
igr1=1853,1854,
igr2=1907,1908,
/
#
# 112 ILE QG1 115 GLU QG 4.37
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
igr1=1853,1854,
igr2=1910,1911,
/
#
# 113 LEU H 113 LEU QB 3.01
&rst
ixpk= 0, nxpk= 0, iat=1862, -1, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88,
igr2=1866,1867,
/
#
# 113 LEU H 113 LEU QQD 6.04
&rst
ixpk= 0, nxpk= 0, iat=1862, -1, r1= 1.30, r2= 1.80, r3= 8.14, r4= 8.64,
igr2=1871,1872,1873,1875,1876,1877,
/
#
# 113 LEU HA 113 LEU QQD 5.3
&rst
ixpk= 0, nxpk= 0, iat=1864, -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
igr2=1871,1872,1873,1875,1876,1877,
/
#
# 113 LEU QB 114 LYS H 3.41
&rst
ixpk= 0, nxpk= 0, iat= -1,1881, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,
igr1=1866,1867,
/
#
# 113 LEU QB 118 ILE HG12 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1,1966, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1=1866,1867,
/
#
# 113 LEU QQD 114 LYS H 3.32
&rst
ixpk= 0, nxpk= 0, iat= -1,1881, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
igr1=1871,1872,1873,1875,1876,1877,
/
#
# 113 LEU QQD 116 ARG H 4.81
&rst
ixpk= 0, nxpk= 0, iat= -1,1918, r1= 1.30, r2= 1.80, r3= 6.48, r4= 6.98,
igr1=1871,1872,1873,1875,1876,1877,
/
#
# 113 LEU QQD 117 ASN H 4.43
&rst
ixpk= 0, nxpk= 0, iat= -1,1942, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr1=1871,1872,1873,1875,1876,1877,
/
#
# 113 LEU QQD 118 ILE H 3.16
&rst
ixpk= 0, nxpk= 0, iat= -1,1956, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,
igr1=1871,1872,1873,1875,1876,1877,
/
#
# 113 LEU QQD 118 ILE HA 4.71
&rst
ixpk= 0, nxpk= 0, iat= -1,1958, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
igr1=1871,1872,1873,1875,1876,1877,
/
#
# 113 LEU QQD 118 ILE HB 4.62
&rst
ixpk= 0, nxpk= 0, iat= -1,1960, r1= 1.30, r2= 1.80, r3= 6.23, r4= 6.73,
igr1=1871,1872,1873,1875,1876,1877,
/
#
# 113 LEU QQD 118 ILE QG2 3.29
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
igr1=1871,1872,1873,1875,1876,1877,
igr2=1962,1963,1964,
/
#
# 113 LEU QQD 118 ILE HG12 2.91
&rst
ixpk= 0, nxpk= 0, iat= -1,1966, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
igr1=1871,1872,1873,1875,1876,1877,
/
#
# 113 LEU QQD 118 ILE QD1 3.82
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.18, r4= 6.68,
igr1=1871,1872,1873,1875,1876,1877,
igr2=1969,1970,1971,
/
#
# 113 LEU QQD 119 PHE H 3.54
&rst
ixpk= 0, nxpk= 0, iat= -1,1975, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
igr1=1871,1872,1873,1875,1876,1877,
/
#
# 113 LEU QQD 119 PHE HA 5.44
&rst
ixpk= 0, nxpk= 0, iat= -1,1977, r1= 1.30, r2= 1.80, r3= 7.33, r4= 7.83,
igr1=1871,1872,1873,1875,1876,1877,
/
#
# 113 LEU QQD 119 PHE HD 3.23
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
igr1=1871,1872,1873,1875,1876,1877,
igr2=1983,1991,
/
#
# 113 LEU QQD 120 SER H 5.44
&rst
ixpk= 0, nxpk= 0, iat= -1,1995, r1= 1.30, r2= 1.80, r3= 7.33, r4= 7.83,
igr1=1871,1872,1873,1875,1876,1877,
/
#
# 113 LEU QQD 123 VAL QQG 3.90
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.09, r4= 7.59,
igr1=1871,1872,1873,1875,1876,1877,
igr2=2051,2052,2053,2055,2056,2057,
/
#
# 113 LEU QQD 124 VAL HA 3.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2063, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
igr1=1871,1872,1873,1875,1876,1877,
/
#
# 113 LEU QQD 124 VAL HB 5.44
&rst
ixpk= 0, nxpk= 0, iat= -1,2065, r1= 1.30, r2= 1.80, r3= 7.33, r4= 7.83,
igr1=1871,1872,1873,1875,1876,1877,
/
#
# 113 LEU QQD 124 VAL QQG 3.88
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.05, r4= 7.55,
igr1=1871,1872,1873,1875,1876,1877,
igr2=2067,2068,2069,2071,2072,2073,
/
#
# 113 LEU QQD 127 ILE QD1 2.77
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
igr1=1871,1872,1873,1875,1876,1877,
igr2=2116,2117,2118,
/
#
# 114 LYS HA 124 VAL QQG 3.11
&rst
ixpk= 0, nxpk= 0, iat=1883, -1, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,
igr2=2067,2068,2069,2071,2072,2073,
/
#
# 114 LYS HB2 124 VAL QQG 3.40
&rst
ixpk= 0, nxpk= 0, iat=1885, -1, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
igr2=2067,2068,2069,2071,2072,2073,
/
#
# 114 LYS HB3 124 VAL QQG 3.85
&rst
ixpk= 0, nxpk= 0, iat=1886, -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
igr2=2067,2068,2069,2071,2072,2073,
/
#
# 114 LYS HG3 115 GLU QB 4.03
&rst
ixpk= 0, nxpk= 0, iat=1889, -1, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
igr2=1907,1908,
/
#
# 114 LYS QE 124 VAL QQG 3.22
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,
igr1=1894,1895,
igr2=2067,2068,2069,2071,2072,2073,
/
#
# 115 GLU H 115 GLU QB 2.71
&rst
ixpk= 0, nxpk= 0, iat=1903, -1, r1= 1.30, r2= 1.80, r3= 3.04, r4= 3.54,
igr2=1907,1908,
/
#
# 115 GLU H 115 GLU QG 4.14
&rst
ixpk= 0, nxpk= 0, iat=1903, -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
igr2=1910,1911,
/
#
# 115 GLU QB 116 ARG H 3.45
&rst
ixpk= 0, nxpk= 0, iat= -1,1918, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,
igr1=1907,1908,
/
#
# 115 GLU QG 116 ARG H 3.83
&rst
ixpk= 0, nxpk= 0, iat= -1,1918, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
igr1=1910,1911,
/
#
# 115 GLU QG 117 ASN H 4.76
&rst
ixpk= 0, nxpk= 0, iat= -1,1942, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14,
igr1=1910,1911,
/
#
# 117 ASN H 124 VAL QQG 5.02
&rst
ixpk= 0, nxpk= 0, iat=1942, -1, r1= 1.30, r2= 1.80, r3= 6.77, r4= 7.27,
igr2=2067,2068,2069,2071,2072,2073,
/
#
# 117 ASN HA 124 VAL QQG 3.96
&rst
ixpk= 0, nxpk= 0, iat=1944, -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr2=2067,2068,2069,2071,2072,2073,
/
#
# 119 PHE H 124 VAL QQG 3.46
&rst
ixpk= 0, nxpk= 0, iat=1975, -1, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
igr2=2067,2068,2069,2071,2072,2073,
/
#
# 119 PHE HA 124 VAL QQG 4.74
&rst
ixpk= 0, nxpk= 0, iat=1977, -1, r1= 1.30, r2= 1.80, r3= 6.39, r4= 6.89,
igr2=2067,2068,2069,2071,2072,2073,
/
#
# 119 PHE HB2 123 VAL QQG 3.30
&rst
ixpk= 0, nxpk= 0, iat=1979, -1, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95,
igr2=2051,2052,2053,2055,2056,2057,
/
#
# 119 PHE HB2 124 VAL QQG 4.86
&rst
ixpk= 0, nxpk= 0, iat=1979, -1, r1= 1.30, r2= 1.80, r3= 6.55, r4= 7.05,
igr2=2067,2068,2069,2071,2072,2073,
/
#
# 119 PHE HB3 123 VAL QQG 3.51
&rst
ixpk= 0, nxpk= 0, iat=1980, -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
igr2=2051,2052,2053,2055,2056,2057,
/
#
# 119 PHE HB3 124 VAL QQG 4.12
&rst
ixpk= 0, nxpk= 0, iat=1980, -1, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,
igr2=2067,2068,2069,2071,2072,2073,
/
#
# 119 PHE HD 123 VAL QQG 3.77
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr1=1983,1991,
igr2=2051,2052,2053,2055,2056,2057,
/
#
# 119 PHE HD 124 VAL QQG 3.93
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.95, r4= 6.45,
igr1=1983,1991,
igr2=2067,2068,2069,2071,2072,2073,
/
#
# 120 SER H 120 SER QB 3.34
&rst
ixpk= 0, nxpk= 0, iat=1995, -1, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,
igr2=1999,2000,
/
#
# 120 SER H 123 VAL QQG 3.11
&rst
ixpk= 0, nxpk= 0, iat=1995, -1, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,
igr2=2051,2052,2053,2055,2056,2057,
/
#
# 120 SER H 124 VAL QQG 4.07
&rst
ixpk= 0, nxpk= 0, iat=1995, -1, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
igr2=2067,2068,2069,2071,2072,2073,
/
#
# 120 SER HA 123 VAL QQG 4.06
&rst
ixpk= 0, nxpk= 0, iat=1997, -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
igr2=2051,2052,2053,2055,2056,2057,
/
#
# 120 SER HA 124 VAL QQG 4.40
&rst
ixpk= 0, nxpk= 0, iat=1997, -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr2=2067,2068,2069,2071,2072,2073,
/
#
# 120 SER QB 121 LYS H 3.42
&rst
ixpk= 0, nxpk= 0, iat= -1,2006, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
igr1=1999,2000,
/
#
# 120 SER QB 121 LYS QB 5.10
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.43, r4= 6.93,
igr1=1999,2000,
igr2=2010,2011,
/
#
# 120 SER QB 122 GLN H 3.24
&rst
ixpk= 0, nxpk= 0, iat= -1,2028, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
igr1=1999,2000,
/
#
# 120 SER QB 122 GLN HG2 4.64
&rst
ixpk= 0, nxpk= 0, iat= -1,2035, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,
igr1=1999,2000,
/
#
# 120 SER QB 122 GLN HG3 4.52
&rst
ixpk= 0, nxpk= 0, iat= -1,2036, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
igr1=1999,2000,
/
#
# 120 SER QB 122 GLN HNE2 4.39
&rst
ixpk= 0, nxpk= 0, iat= -1,2041, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,
igr1=1999,2000,
/
#
# 120 SER QB 123 VAL H 3.71
&rst
ixpk= 0, nxpk= 0, iat= -1,2045, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
igr1=1999,2000,
/
#
# 120 SER QB 123 VAL QQG 4.26
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.45, r4= 6.95,
igr1=1999,2000,
igr2=2051,2052,2053,2055,2056,2057,
/
#
# 121 LYS H 123 VAL QQG 4.97
&rst
ixpk= 0, nxpk= 0, iat=2006, -1, r1= 1.30, r2= 1.80, r3= 6.70, r4= 7.20,
igr2=2051,2052,2053,2055,2056,2057,
/
#
# 121 LYS H 124 VAL QQG 4.55
&rst
ixpk= 0, nxpk= 0, iat=2006, -1, r1= 1.30, r2= 1.80, r3= 6.13, r4= 6.63,
igr2=2067,2068,2069,2071,2072,2073,
/
#
# 121 LYS HA 124 VAL QQG 3.16
&rst
ixpk= 0, nxpk= 0, iat=2008, -1, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,
igr2=2067,2068,2069,2071,2072,2073,
/
#
# 122 GLN H 123 VAL QQG 4.25
&rst
ixpk= 0, nxpk= 0, iat=2028, -1, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23,
igr2=2051,2052,2053,2055,2056,2057,
/
#
# 122 GLN H 124 VAL QQG 4.18
&rst
ixpk= 0, nxpk= 0, iat=2028, -1, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
igr2=2067,2068,2069,2071,2072,2073,
/
#
# 122 GLN HA 126 ASP QB 5.14
&rst
ixpk= 0, nxpk= 0, iat=2030, -1, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,
igr2=2095,2096,
/
#
# 122 GLN HB2 123 VAL QQG 4.09
&rst
ixpk= 0, nxpk= 0, iat=2032, -1, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
igr2=2051,2052,2053,2055,2056,2057,
/
#
# 122 GLN HB2 126 ASP QB 5.14
&rst
ixpk= 0, nxpk= 0, iat=2032, -1, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,
igr2=2095,2096,
/
#
# 122 GLN HB3 123 VAL QQG 4.62
&rst
ixpk= 0, nxpk= 0, iat=2033, -1, r1= 1.30, r2= 1.80, r3= 6.23, r4= 6.73,
igr2=2051,2052,2053,2055,2056,2057,
/
#
# 122 GLN HG2 123 VAL QQG 4.12
&rst
ixpk= 0, nxpk= 0, iat=2035, -1, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,
igr2=2051,2052,2053,2055,2056,2057,
/
#
# 122 GLN HG3 123 VAL QQG 4.16
&rst
ixpk= 0, nxpk= 0, iat=2036, -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr2=2051,2052,2053,2055,2056,2057,
/
#
# 122 GLN HNE1 123 VAL QQG 4.38
&rst
ixpk= 0, nxpk= 0, iat=2040, -1, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
igr2=2051,2052,2053,2055,2056,2057,
/
#
# 123 VAL H 123 VAL QQG 4.89
&rst
ixpk= 0, nxpk= 0, iat=2045, -1, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
igr2=2051,2052,2053,2055,2056,2057,
/
#
# 123 VAL H 124 VAL QQG 5.77
&rst
ixpk= 0, nxpk= 0, iat=2045, -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
igr2=2067,2068,2069,2071,2072,2073,
/
#
# 123 VAL HA 124 VAL QQG 7.47
&rst
ixpk= 0, nxpk= 0, iat=2047, -1, r1= 1.30, r2= 1.80, r3=10.07, r4=10.57,
igr2=2067,2068,2069,2071,2072,2073,
/
#
# 123 VAL HA 126 ASP QB 3.55
&rst
ixpk= 0, nxpk= 0, iat=2047, -1, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,
igr2=2095,2096,
/
#
# 123 VAL QQG 126 ASP QB 6.24
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
igr1=2051,2052,2053,2055,2056,2057,
igr2=2095,2096,
/
#
# 124 VAL H 124 VAL QQG 4.88
&rst
ixpk= 0, nxpk= 0, iat=2061, -1, r1= 1.30, r2= 1.80, r3= 6.58, r4= 7.08,
igr2=2067,2068,2069,2071,2072,2073,
/
#
# 124 VAL H 126 ASP QB 5.07
&rst
ixpk= 0, nxpk= 0, iat=2061, -1, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
igr2=2095,2096,
/
#
# 124 VAL HA 124 VAL QQG 4.89
&rst
ixpk= 0, nxpk= 0, iat=2063, -1, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
igr2=2067,2068,2069,2071,2072,2073,
/
#
# 124 VAL HA 126 ASP QB 5.34
&rst
ixpk= 0, nxpk= 0, iat=2063, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2=2095,2096,
/
#
# 124 VAL HA 127 ILE QG1 4.30
&rst
ixpk= 0, nxpk= 0, iat=2063, -1, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
igr2=2113,2114,
/
#
# 124 VAL QQG 125 ASN H 5.31
&rst
ixpk= 0, nxpk= 0, iat= -1,2077, r1= 1.30, r2= 1.80, r3= 7.16, r4= 7.66,
igr1=2067,2068,2069,2071,2072,2073,
/
#
# 124 VAL QQG 125 ASN HA 5.71
&rst
ixpk= 0, nxpk= 0, iat= -1,2079, r1= 1.30, r2= 1.80, r3= 7.70, r4= 8.20,
igr1=2067,2068,2069,2071,2072,2073,
/
#
# 124 VAL QQG 125 ASN HB2 7.52
&rst
ixpk= 0, nxpk= 0, iat= -1,2081, r1= 1.30, r2= 1.80, r3=10.14, r4=10.64,
igr1=2067,2068,2069,2071,2072,2073,
/
#
# 124 VAL QQG 125 ASN HB3 7.2
&rst
ixpk= 0, nxpk= 0, iat= -1,2082, r1= 1.30, r2= 1.80, r3= 9.71, r4=10.21,
igr1=2067,2068,2069,2071,2072,2073,
/
#
# 124 VAL QQG 125 ASN HND1 6.02
&rst
ixpk= 0, nxpk= 0, iat= -1,2086, r1= 1.30, r2= 1.80, r3= 8.11, r4= 8.61,
igr1=2067,2068,2069,2071,2072,2073,
/
#
# 124 VAL QQG 125 ASN HND2 6.35
&rst
ixpk= 0, nxpk= 0, iat= -1,2087, r1= 1.30, r2= 1.80, r3= 8.56, r4= 9.06,
igr1=2067,2068,2069,2071,2072,2073,
/
#
# 124 VAL QQG 127 ILE QD1 5.82
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.42, r4= 9.92,
igr1=2067,2068,2069,2071,2072,2073,
igr2=2116,2117,2118,
/
#
# 124 VAL QQG 128 GLU H 6.84
&rst
ixpk= 0, nxpk= 0, iat= -1,2122, r1= 1.30, r2= 1.80, r3= 9.22, r4= 9.72,
igr1=2067,2068,2069,2071,2072,2073,
/
#
# 124 VAL QQG 128 GLU QG 5.68
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.59, r4= 9.09,
igr1=2067,2068,2069,2071,2072,2073,
igr2=2129,2130,
/
#
# 125 ASN H 128 GLU QG 5.10
&rst
ixpk= 0, nxpk= 0, iat=2077, -1, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
igr2=2129,2130,
/
#
# 125 ASN HA 128 GLU QG 3.85
&rst
ixpk= 0, nxpk= 0, iat=2079, -1, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,
igr2=2129,2130,
/
#
# 126 ASP H 126 ASP QB 2.81
&rst
ixpk= 0, nxpk= 0, iat=2091, -1, r1= 1.30, r2= 1.80, r3= 3.15, r4= 3.65,
igr2=2095,2096,
/
#
# 126 ASP H 127 ILE QG1 4.81
&rst
ixpk= 0, nxpk= 0, iat=2091, -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr2=2113,2114,
/
#
# 126 ASP QB 127 ILE HA 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1,2105, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1=2095,2096,
/
#
# 126 ASP QB 127 ILE QG2 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.20, r4= 7.70,
igr1=2095,2096,
igr2=2109,2110,2111,
/
#
# 126 ASP QB 127 ILE QG1 4.77
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51,
igr1=2095,2096,
igr2=2113,2114,
/
#
# 126 ASP QB 127 ILE QD1 5.12
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr1=2095,2096,
igr2=2116,2117,2118,
/
#
# 126 ASP QB 128 GLU H 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1,2122, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1=2095,2096,
/
#
# 126 ASP QB 130 SER H 5.14
&rst
ixpk= 0, nxpk= 0, iat= -1,2161, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,
igr1=2095,2096,
/
#
# 127 ILE H 128 GLU QG 4.71
&rst
ixpk= 0, nxpk= 0, iat=2103, -1, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,
igr2=2129,2130,
/
#
# 127 ILE QG2 127 ILE QG1 3.23
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,
igr1=2109,2110,2111,
igr2=2113,2114,
/
#
# 127 ILE QG2 128 GLU QG 4.08
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
igr1=2109,2110,2111,
igr2=2129,2130,
/
#
# 127 ILE QG1 128 GLU H 4.34
&rst
ixpk= 0, nxpk= 0, iat= -1,2122, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,
igr1=2113,2114,
/
#
# 127 ILE QD1 128 GLU QG 4.84
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
igr1=2116,2117,2118,
igr2=2129,2130,
/
#
# 128 GLU H 128 GLU QG 2.87
&rst
ixpk= 0, nxpk= 0, iat=2122, -1, r1= 1.30, r2= 1.80, r3= 3.22, r4= 3.72,
igr2=2129,2130,
/
#
# 128 GLU HA 128 GLU QG 3.39
&rst
ixpk= 0, nxpk= 0, iat=2124, -1, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,
igr2=2129,2130,
/
#
# 128 GLU HA 131 LEU QQD 5.4
&rst
ixpk= 0, nxpk= 0, iat=2124, -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
igr2=2181,2182,2183,2185,2186,2187,
/
#
# 128 GLU QG 129 ARG H 4.23
&rst
ixpk= 0, nxpk= 0, iat= -1,2137, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25,
igr1=2129,2130,
/
#
# 128 GLU QG 131 LEU QQD 6.59
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.97, r4=10.47,
igr1=2129,2130,
igr2=2181,2182,2183,2185,2186,2187,
/
#
# 129 ARG HB2 130 SER QB 4.91
&rst
ixpk= 0, nxpk= 0, iat=2141, -1, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
igr2=2165,2166,
/
#
# 129 ARG QG 130 SER QB 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1=2144,2145,
igr2=2165,2166,
/
#
# 130 SER H 130 SER QB 2.77
&rst
ixpk= 0, nxpk= 0, iat=2161, -1, r1= 1.30, r2= 1.80, r3= 3.11, r4= 3.61,
igr2=2165,2166,
/
#
# 130 SER H 131 LEU QQD 5.65
&rst
ixpk= 0, nxpk= 0, iat=2161, -1, r1= 1.30, r2= 1.80, r3= 7.62, r4= 8.12,
igr2=2181,2182,2183,2185,2186,2187,
/
#
# 130 SER HA 131 LEU QQD 7.06
&rst
ixpk= 0, nxpk= 0, iat=2163, -1, r1= 1.30, r2= 1.80, r3= 9.52, r4=10.02,
igr2=2181,2182,2183,2185,2186,2187,
/
#
# 130 SER QB 131 LEU HG 4.96
&rst
ixpk= 0, nxpk= 0, iat= -1,2179, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
igr1=2165,2166,
/
#
# 130 SER QB 131 LEU QQD 6.55
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.91, r4=10.41,
igr1=2165,2166,
igr2=2181,2182,2183,2185,2186,2187,
/
#
# 130 SER QB 133 ALA QB 4.79
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.46, r4= 6.96,
igr1=2165,2166,
igr2=2205,2206,2207,
/
#
# 130 SER QB 134 ALA QB 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.20, r4= 7.70,
igr1=2165,2166,
igr2=2215,2216,2217,
/
#
# 131 LEU H 131 LEU QQD 5.18
&rst
ixpk= 0, nxpk= 0, iat=2172, -1, r1= 1.30, r2= 1.80, r3= 6.98, r4= 7.48,
igr2=2181,2182,2183,2185,2186,2187,
/
#
# 131 LEU HA 131 LEU QQD 4.86
&rst
ixpk= 0, nxpk= 0, iat=2174, -1, r1= 1.30, r2= 1.80, r3= 6.55, r4= 7.05,
igr2=2181,2182,2183,2185,2186,2187,
/
#
# 131 LEU QQD 132 ALA H 3.69
&rst
ixpk= 0, nxpk= 0, iat= -1,2191, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67,
igr1=2181,2182,2183,2185,2186,2187,
/
#
# 132 ALA HA 135 LEU QQD 5.91
&rst
ixpk= 0, nxpk= 0, iat=2193, -1, r1= 1.30, r2= 1.80, r3= 7.97, r4= 8.47,
igr2=2230,2231,2232,2234,2235,2236,
/
#
# 135 LEU HB2 135 LEU QQD 4.86
&rst
ixpk= 0, nxpk= 0, iat=2225, -1, r1= 1.30, r2= 1.80, r3= 6.55, r4= 7.05,
igr2=2230,2231,2232,2234,2235,2236,
/
#
# 135 LEU HB3 135 LEU QQD 5.1
&rst
ixpk= 0, nxpk= 0, iat=2226, -1, r1= 1.30, r2= 1.80, r3= 6.87, r4= 7.37,
igr2=2230,2231,2232,2234,2235,2236,
/
#
# 135 LEU QQD 136 GLU H 3.65
&rst
ixpk= 0, nxpk= 0, iat= -1,2240, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
igr1=2230,2231,2232,2234,2235,2236,
/
#
# 143 PRO HA 18 SER HA 5.0
&rst
ixpk= 0, nxpk= 0, iat=2370, 270, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,
rk2=50, rk3=50, ir6=1, ialtd=0,
/
#
# 143 PRO HA 18 SER HB2 5.0
&rst
ixpk= 0, nxpk= 0, iat=2370, 272, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, /
#
# 143 PRO HA 18 SER HB3 5.0
&rst
ixpk= 0, nxpk= 0, iat=2370, 273, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, /
#
# 144 SER HA 18 SER HA 5.0
&rst
ixpk= 0, nxpk= 0, iat=2376, 270, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, /
#
# 144 SER HA 18 SER HB2 5.0
&rst
ixpk= 0, nxpk= 0, iat=2376, 272, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, /
#
# 144 SER HA 18 SER HB3 5.0
&rst
ixpk= 0, nxpk= 0, iat=2376, 273, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, /
#
# 145 TYR HA 19 GLN HA 4.5
&rst
ixpk= 0, nxpk= 0, iat=2387, 281, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, /
#
# 145 TYR QB 19 GLN HA 5.0
&rst
ixpk= 0, nxpk= 0, iat= -1, 281, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr1=2389,2390,
/
#
# 145 TYR HA 19 GLN HB2 5.0
&rst
ixpk= 0, nxpk= 0, iat=2387, 283, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, /
#
# 145 TYR HA 19 GLN HB3 5.0
&rst
ixpk= 0, nxpk= 0, iat=2387, 284, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, /
#
# 145 TYR QB 19 GLN HB2 5.0
&rst
ixpk= 0, nxpk= 0, iat= -1, 283, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr1=2389,2390,
/
#
# 145 TYR QB 19 GLN HB3 5.0
&rst
ixpk= 0, nxpk= 0, iat= -1, 284, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr1=2389,2390,
/
#
# 145 TYR HD 19 GLN HA 4.5
&rst
ixpk= 0, nxpk= 0, iat= -1, 281, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
igr1=2393,2402,
/
#
# 145 TYR HH 65 ASN OD1 3.5
&rst
ixpk= 0, nxpk= 0, iat=2398,1074, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, /
#
# 145 TYR OH 65 ASN OD1 4.5
&rst
ixpk= 0, nxpk= 0, iat=2398,1074, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, /
#
# 147 PRO HA 109 VAL QG1 5.5
&rst
ixpk= 0, nxpk= 0, iat=2427, -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr2=1803,1804,1805,1807,1808,1809,
/
#
# 147 PRO QG 109 VAL QG1 4.0
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
igr1=2421,2422,
igr2=1803,1804,1805,1807,1808,1809,
/
#
# 147 PRO QB 109 VAL QG1 4.0
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
igr1=2424,2425,
igr2=1803,1804,1805,1807,1808,1809,
/
#
# 147 PRO QG 109 VAL HA 5.5
&rst
ixpk= 0, nxpk= 0, iat= -1,1799, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1=2421,2422,
/
#
# 147 PRO QB 109 VAL HA 5.5
&rst
ixpk= 0, nxpk= 0, iat= -1,1799, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1=2424,2425,
/
#
# 147 PRO QG 109 VAL QG2 4.5
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
igr1=2421,2422,
igr2=1803,1804,1805,1807,1808,1809,
/
#
# 147 PRO QB 109 VAL QG2 4.5
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
igr1=2424,2425,
igr2=1803,1804,1805,1807,1808,1809,
/
#
# 147 PRO QG 112 ILE QD1 4.5
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
igr1=2421,2422,
igr2=1856,1857,1858,
/
#
# 147 PRO QB 112 ILE QD1 4.5
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
igr1=2424,2425,
igr2=1856,1857,1858,
/
#
# 148 PTH QG2 112 ILE QD1 4.0
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,
igr1=2437,2438,2439,
igr2=1856,1857,1858,
/
#
# 148 PTH QG2 112 ILE HA 5.5
&rst
ixpk= 0, nxpk= 0, iat= -1,1845, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1=2437,2438,2439,
/
#
# 148 PTH QG2 112 ILE HB 5.5
&rst
ixpk= 0, nxpk= 0, iat= -1,1847, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1=2437,2438,2439,
/
#
# 148 PTH HB 112 ILE HB 5.5
&rst
ixpk= 0, nxpk= 0, iat=2435,1847, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00, /
#
# 148 PTH HB 112 ILE HG13 5.5
&rst
ixpk= 0, nxpk= 0, iat=2435,1854, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 148 PTH HB 112 ILE HG12 5.5
&rst
ixpk= 0, nxpk= 0, iat=2435,1853, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, /
#
# 148 PTH QG2 112 ILE HG12 5.5
&rst
ixpk= 0, nxpk= 0, iat= -1,1853, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1=2437,2438,2439,
/
#
# 148 PTH QG2 112 ILE HG13 5.5
&rst
ixpk= 0, nxpk= 0, iat= -1,1854, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1=2437,2438,2439,
/
#
# 148 PTH HA 112 ILE QG2 5.5
&rst
ixpk= 0, nxpk= 0, iat=2433, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2=1849,1850,1851,
/
#
# 148 PTH HB 112 ILE QG2 5.0
&rst
ixpk= 0, nxpk= 0, iat=2435, -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr2=1849,1850,1851,
/
#
# 148 PTH HA 112 ILE QD1 5.0
&rst
ixpk= 0, nxpk= 0, iat=2433, -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr2=1856,1857,1858,
/
#
# 148 PTH HB 112 ILE QD1 5.0
&rst
ixpk= 0, nxpk= 0, iat=2435, -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr2=1856,1857,1858,
/
#
# 152 TYR HD 118 ILE QD1 4.0
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr1=2492,2501,
igr2=1969,1970,1971,
/
#
# 152 TYR HE 118 ILE QD1 5.5
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr1=2494,2499,
igr2=1969,1970,1971,
/
#
# 152 TYR QB 118 ILE QD1 4.0
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr1=2488,2489,
igr2=1969,1970,1971,
/
#
# 152 TYR HD 118 ILE QG2 5.5
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr1=2492,2501,
igr2=1962,1963,1964,
/
#
# 152 TYR HE 116 ARG HA 4.0
&rst
ixpk= 0, nxpk= 0, iat= -1,1920, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
igr1=2494,2499,
/
#
# 152 TYR HD 116 ARG HA 5.0
&rst
ixpk= 0, nxpk= 0, iat= -1,1920, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr1=2492,2501,
/
#
# 152 TYR HE 116 ARG QG 5.0
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
igr1=2494,2499,
igr2=1925,1926,
/
#
# 152 TYR HE 72 LYS QE 5.0
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
igr1=2494,2499,
igr2=1187,1188,
/
#
# 152 TYR HD 72 LYS QE 4.5
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
igr1=2492,2501,
igr2=1187,1188,
/
#
# 152 TYR HD 72 LYS QD 4.5
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
igr1=2492,2501,
igr2=1184,1185,
/
#
# 152 TYR HE 72 LYS QD 5.0
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
igr1=2494,2499,
igr2=1184,1185,
/
#
# 112 ILE QG2 116 ARG HE 3.5
&rst
ixpk= 0, nxpk= 0, iat= -1,1931, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
igr1=1849,1850,1851,
/
#
# 112 ILE CG2 116 ARG NE 4.0
&rst
ixpk= 0, nxpk= 0, iat=1848,1931, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, /
#
# 112 ILE CG2 116 ARG CZ 5.0
&rst
ixpk= 0, nxpk= 0, iat=1848,1932, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, /
#
# 118 ILE QD1 116 ARG HE 5.5
&rst
ixpk= 0, nxpk= 0, iat= -1,1931, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1=1969,1970,1971,
/
#
# 118 ILE CD1 116 ARG NE 6.0
&rst
ixpk= 0, nxpk= 0, iat=1968,1931, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, /
#
# 118 ILE CD1 116 ARG CZ 6.5
&rst
ixpk= 0, nxpk= 0, iat=1968,1932, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00, /
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