NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
605875 |
2n3o   |
25652 | cing | 1-original | 1 | AMBER | distance | NOE | simple |
#
# 74 TYR HA 74 TYR QD 3.20
&rst
ixpk= 0, nxpk= 0, iat=1140, -1, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09,
rk2=50, rk3=50, ir6=1, ialtd=0,
igr2=1146,1155,
&end
#
# 74 TYR QD 79 PRO HD2 4.75
&rst
ixpk= 0, nxpk= 0, iat= -1,1215, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
igr1=1146,1155,
&end
#
# 74 TYR QD 79 PRO HD3 4.30
&rst
ixpk= 0, nxpk= 0, iat= -1,1216, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
igr1=1146,1155,
&end
#
# 74 TYR QD 79 PRO HG3 4.44
&rst
ixpk= 0, nxpk= 0, iat= -1,1219, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
igr1=1146,1155,
&end
#
# 71 VAL HA 74 TYR QD 4.41
&rst
ixpk= 0, nxpk= 0, iat=1089, -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr2=1146,1155,
&end
#
# 73 TYR QD 74 TYR QD 3.51
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
igr1=1125,1134,
igr2=1146,1155,
&end
#
# 73 TYR QD 74 TYR HA 4.02
&rst
ixpk= 0, nxpk= 0, iat= -1,1140, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,
igr1=1125,1134,
&end
#
# 73 TYR HA 73 TYR QD 3.20
&rst
ixpk= 0, nxpk= 0, iat=1119, -1, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09,
igr2=1125,1134,
&end
#
# 73 TYR QD 74 TYR HB3 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1143, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1=1125,1134,
&end
#
# 73 TYR QD 77 VAL HB 4.48
&rst
ixpk= 0, nxpk= 0, iat= -1,1188, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
igr1=1125,1134,
&end
#
# 87 TYR HA 87 TYR QD 3.15
&rst
ixpk= 0, nxpk= 0, iat=1346, -1, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04,
igr2=1352,1361,
&end
#
# 86 ILE HA 87 TYR QD 3.78
&rst
ixpk= 0, nxpk= 0, iat=1327, -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
igr2=1352,1361,
&end
#
# 25 LYS QB 87 TYR QD 3.41
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
igr1= 380, 381,
igr2=1352,1361,
&end
#
# 78 THR QG2 87 TYR QD 4.59
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.19, r4= 6.69,
igr1=1206,1207,1208,
igr2=1352,1361,
&end
#
# 23 ILE QG2 87 TYR QD 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr1= 339, 340, 341,
igr2=1352,1361,
&end
#
# 86 ILE QG2 87 TYR QD 5.07
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.83, r4= 7.33,
igr1=1331,1332,1333,
igr2=1352,1361,
&end
#
# 67 ALA QB 90 PHE QD 4.65
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
igr1=1036,1037,1038,
igr2=1409,1417,
&end
#
# 71 VAL HB 90 PHE QD 5.01
&rst
ixpk= 0, nxpk= 0, iat=1091, -1, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
igr2=1409,1417,
&end
#
# 71 VAL QG2 90 PHE QD 4.21
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
igr1=1097,1098,1099,
igr2=1409,1417,
&end
#
# 71 VAL QG1 90 PHE QD 4.21
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
igr1=1093,1094,1095,
igr2=1409,1417,
&end
#
# 67 ALA HA 90 PHE QE 4.74
&rst
ixpk= 0, nxpk= 0, iat=1034, -1, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
igr2=1411,1415,
&end
#
# 7 PHE HA 7 PHE QD 3.68
&rst
ixpk= 0, nxpk= 0, iat= 94, -1, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
igr2= 100, 108,
&end
#
# 7 PHE QD 8 LYS QD 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
igr1= 100, 108,
igr2= 122, 123,
&end
#
# 71 VAL HB 90 PHE QE 4.21
&rst
ixpk= 0, nxpk= 0, iat=1091, -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
igr2=1411,1415,
&end
#
# 42 PHE QD 69 THR HB 4.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1060, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,
igr1= 642, 650,
&end
#
# 42 PHE HA 42 PHE QE 4.82
&rst
ixpk= 0, nxpk= 0, iat= 636, -1, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,
igr2= 644, 648,
&end
#
# 42 PHE QE 69 THR HB 5.26
&rst
ixpk= 0, nxpk= 0, iat= -1,1060, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
igr1= 644, 648,
&end
#
# 42 PHE QE 70 MET HA 4.35
&rst
ixpk= 0, nxpk= 0, iat= -1,1072, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
igr1= 644, 648,
&end
#
# 42 PHE QE 70 MET QE 5.27
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.10, r4= 7.60,
igr1= 644, 648,
igr2=1081,1082,1083,
&end
#
# 58 PHE HA 58 PHE QD 3.98
&rst
ixpk= 0, nxpk= 0, iat= 895, -1, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
igr2= 901, 909,
&end
#
# 58 PHE QD 91 SER QB 4.21
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr1= 901, 909,
igr2=1425,1426,
&end
#
# 49 LEU HG 58 PHE QD 4.50
&rst
ixpk= 0, nxpk= 0, iat= 753, -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
igr2= 901, 909,
&end
#
# 20 VAL QG2 58 PHE QD 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr1= 291, 292, 293,
igr2= 901, 909,
&end
#
# 71 VAL HB 90 PHE HZ 4.78
&rst
ixpk= 0, nxpk= 0, iat=1091,1413, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, &end
#
# 71 VAL QG2 90 PHE HZ 4.97
&rst
ixpk= 0, nxpk= 0, iat= -1,1413, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr1=1097,1098,1099,
&end
#
# 71 VAL QG1 90 PHE HZ 4.97
&rst
ixpk= 0, nxpk= 0, iat= -1,1413, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr1=1093,1094,1095,
&end
#
# 42 PHE QD 42 PHE HZ 3.95
&rst
ixpk= 0, nxpk= 0, iat= -1, 646, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
igr1= 642, 650,
&end
#
# 42 PHE HZ 73 TYR HB3 4.71
&rst
ixpk= 0, nxpk= 0, iat= 646,1122, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21, &end
#
# 42 PHE HZ 73 TYR HB2 4.71
&rst
ixpk= 0, nxpk= 0, iat= 646,1121, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21, &end
#
# 42 PHE HZ 69 THR QG2 4.98
&rst
ixpk= 0, nxpk= 0, iat= 646, -1, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
igr2=1062,1063,1064,
&end
#
# 86 ILE HA 87 TYR QE 4.54
&rst
ixpk= 0, nxpk= 0, iat=1327, -1, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
igr2=1354,1359,
&end
#
# 25 LYS QE 87 TYR QE 4.55
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23,
igr1= 389, 390,
igr2=1354,1359,
&end
#
# 25 LYS QB 87 TYR QE 4.14
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
igr1= 380, 381,
igr2=1354,1359,
&end
#
# 73 TYR QE 77 VAL HB 3.88
&rst
ixpk= 0, nxpk= 0, iat= -1,1188, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,
igr1=1127,1132,
&end
#
# 74 TYR HA 74 TYR QE 4.13
&rst
ixpk= 0, nxpk= 0, iat=1140, -1, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
igr2=1148,1153,
&end
#
# 74 TYR QE 79 PRO HA 3.51
&rst
ixpk= 0, nxpk= 0, iat= -1,1224, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,
igr1=1148,1153,
&end
#
# 38 LEU HA 74 TYR QE 4.56
&rst
ixpk= 0, nxpk= 0, iat= 577, -1, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
igr2=1148,1153,
&end
#
# 74 TYR QE 79 PRO HD3 4.90
&rst
ixpk= 0, nxpk= 0, iat= -1,1216, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
igr1=1148,1153,
&end
#
# 70 MET HA 74 TYR QE 4.90
&rst
ixpk= 0, nxpk= 0, iat=1072, -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
igr2=1148,1153,
&end
#
# 74 TYR QE 79 PRO HG3 4.11
&rst
ixpk= 0, nxpk= 0, iat= -1,1219, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
igr1=1148,1153,
&end
#
# 38 LEU QD2 74 TYR QE 4.76
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.42, r4= 6.92,
igr1= 588, 589, 590,
igr2=1148,1153,
&end
#
# 35 VAL HA 38 LEU HB3 5.50
&rst
ixpk= 0, nxpk= 0, iat= 531, 580, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 48 LEU HA 59 ILE HB 4.95
&rst
ixpk= 0, nxpk= 0, iat= 729, 917, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45, &end
#
# 94 LYS HA 94 LYS QE 4.13
&rst
ixpk= 0, nxpk= 0, iat=1465, -1, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
igr2=1476,1477,
&end
#
# 44 LYS QE 115 ASN HA 5.18
&rst
ixpk= 0, nxpk= 0, iat= -1,1779, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
igr1= 674, 675,
&end
#
# 52 LYS HG2 52 LYS QE 3.42
&rst
ixpk= 0, nxpk= 0, iat= 808, -1, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
igr2= 814, 815,
&end
#
# 6 LYS HA 6 LYS QE 4.54
&rst
ixpk= 0, nxpk= 0, iat= 72, -1, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
igr2= 83, 84,
&end
#
# 5 LYS QD 5 LYS QE 2.63
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.31, r4= 3.81,
igr1= 58, 59,
igr2= 61, 62,
&end
#
# 44 LYS QD 44 LYS QE 2.89
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
igr1= 671, 672,
igr2= 674, 675,
&end
#
# 5 LYS HG3 5 LYS QE 3.55
&rst
ixpk= 0, nxpk= 0, iat= 56, -1, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,
igr2= 61, 62,
&end
#
# 44 LYS QE 46 THR QG2 3.91
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77,
igr1= 674, 675,
igr2= 705, 706, 707,
&end
#
# 25 LYS QG 25 LYS QE 2.82
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05,
igr1= 383, 384,
igr2= 389, 390,
&end
#
# 47 ASN HB3 96 LEU QB 4.37
&rst
ixpk= 0, nxpk= 0, iat= 718, -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
igr2=1504,1505,
&end
#
# 47 ASN HB3 96 LEU HG 4.86
&rst
ixpk= 0, nxpk= 0, iat= 718,1507, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36, &end
#
# 47 ASN HB3 60 GLU HB2 4.68
&rst
ixpk= 0, nxpk= 0, iat= 718, 936, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18, &end
#
# 19 ARG QD 63 THR HB 4.98
&rst
ixpk= 0, nxpk= 0, iat= -1, 982, r1= 1.30, r2= 1.80, r3= 5.59, r4= 6.09,
igr1= 267, 268,
&end
#
# 74 TYR QD 88 ILE HB 4.84
&rst
ixpk= 0, nxpk= 0, iat= -1,1369, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
igr1=1146,1155,
&end
#
# 74 TYR HB2 88 ILE HB 5.42
&rst
ixpk= 0, nxpk= 0, iat=1142,1369, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92, &end
#
# 31 THR HB 110 ALA QB 5.46
&rst
ixpk= 0, nxpk= 0, iat= 482, -1, r1= 1.30, r2= 1.80, r3= 6.56, r4= 7.06,
igr2=1709,1710,1711,
&end
#
# 31 THR HB 50 MET QE 5.50
&rst
ixpk= 0, nxpk= 0, iat= 482, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2= 776, 777, 778,
&end
#
# 37 SER HA 40 LEU HB3 4.45
&rst
ixpk= 0, nxpk= 0, iat= 566, 606, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95, &end
#
# 40 LEU HB3 41 PRO HA 4.98
&rst
ixpk= 0, nxpk= 0, iat= 606, 630, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48, &end
#
# 69 THR QG2 73 TYR HB3 4.65
&rst
ixpk= 0, nxpk= 0, iat= -1,1122, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr1=1062,1063,1064,
&end
#
# 33 GLY HA3 36 ILE HB 5.01
&rst
ixpk= 0, nxpk= 0, iat= 510, 549, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51, &end
#
# 49 LEU QD2 98 THR HB 5.30
&rst
ixpk= 0, nxpk= 0, iat= -1,1545, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
igr1= 759, 760, 761,
&end
#
# 72 ASN HB2 75 THR QG2 4.98
&rst
ixpk= 0, nxpk= 0, iat=1107, -1, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
igr2=1165,1166,1167,
&end
#
# 78 THR HB 85 PRO HB2 5.31
&rst
ixpk= 0, nxpk= 0, iat=1204,1318, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81, &end
#
# 32 GLU HG2 107 ALA HA 4.40
&rst
ixpk= 0, nxpk= 0, iat= 499,1670, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 74 TYR HB3 78 THR HA 5.24
&rst
ixpk= 0, nxpk= 0, iat=1143,1202, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74, &end
#
# 26 LEU QB 55 ASN HB2 4.97
&rst
ixpk= 0, nxpk= 0, iat= -1, 856, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr1= 402, 403,
&end
#
# 42 PHE HB3 69 THR HB 4.55
&rst
ixpk= 0, nxpk= 0, iat= 639,1060, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05, &end
#
# 44 LYS QE 46 THR HB 4.02
&rst
ixpk= 0, nxpk= 0, iat= -1, 703, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,
igr1= 674, 675,
&end
#
# 80 VAL HB 83 GLY HA2 4.92
&rst
ixpk= 0, nxpk= 0, iat=1232,1289, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42, &end
#
# 69 THR HA 72 ASN HB3 3.51
&rst
ixpk= 0, nxpk= 0, iat=1058,1108, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01, &end
#
# 20 VAL HA 60 GLU HB2 5.17
&rst
ixpk= 0, nxpk= 0, iat= 283, 936, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67, &end
#
# 60 GLU HB2 95 GLU HA 5.20
&rst
ixpk= 0, nxpk= 0, iat= 936,1487, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70, &end
#
# 44 LYS HB3 62 ASN HB3 3.55
&rst
ixpk= 0, nxpk= 0, iat= 666, 969, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05, &end
#
# 44 LYS HB3 62 ASN HB2 4.35
&rst
ixpk= 0, nxpk= 0, iat= 666, 968, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85, &end
#
# 84 GLN QG 86 ILE QG2 5.07
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.83, r4= 7.33,
igr1=1301,1302,
igr2=1331,1332,1333,
&end
#
# 74 TYR QD 77 VAL HB 4.60
&rst
ixpk= 0, nxpk= 0, iat= -1,1188, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
igr1=1146,1155,
&end
#
# 74 TYR HA 77 VAL HB 4.71
&rst
ixpk= 0, nxpk= 0, iat=1140,1188, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21, &end
#
# 50 MET QB 52 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= 769, 770,
igr2= 814, 815,
&end
#
# 20 VAL HB 91 SER QB 3.98
&rst
ixpk= 0, nxpk= 0, iat= 285, -1, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
igr2=1425,1426,
&end
#
# 20 VAL QG2 91 SER QB 4.51
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
igr1= 291, 292, 293,
igr2=1425,1426,
&end
#
# 20 VAL QG1 91 SER QB 4.51
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
igr1= 287, 288, 289,
igr2=1425,1426,
&end
#
# 52 LYS QB 52 LYS QE 3.94
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
igr1= 805, 806,
igr2= 814, 815,
&end
#
# 48 LEU QD2 50 MET HG3 4.90
&rst
ixpk= 0, nxpk= 0, iat= -1, 773, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
igr1= 740, 741, 742,
&end
#
# 50 MET HG3 107 ALA HA 5.09
&rst
ixpk= 0, nxpk= 0, iat= 773,1670, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59, &end
#
# 78 THR QG2 85 PRO HB3 3.47
&rst
ixpk= 0, nxpk= 0, iat= -1,1319, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,
igr1=1206,1207,1208,
&end
#
# 44 LYS QE 45 VAL HB 5.27
&rst
ixpk= 0, nxpk= 0, iat= -1, 687, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
igr1= 674, 675,
&end
#
# 80 VAL QG2 85 PRO HB2 5.11
&rst
ixpk= 0, nxpk= 0, iat= -1,1318, r1= 1.30, r2= 1.80, r3= 6.14, r4= 6.64,
igr1=1238,1239,1240,
&end
#
# 80 VAL QG1 85 PRO HB2 5.11
&rst
ixpk= 0, nxpk= 0, iat= -1,1318, r1= 1.30, r2= 1.80, r3= 6.14, r4= 6.64,
igr1=1234,1235,1236,
&end
#
# 27 PRO HD2 30 VAL HB 4.27
&rst
ixpk= 0, nxpk= 0, iat= 418, 466, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77, &end
#
# 34 GLU QG 37 SER QB 4.77
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51,
igr1= 521, 522,
igr2= 568, 569,
&end
#
# 28 ILE HA 28 ILE HG13 3.75
&rst
ixpk= 0, nxpk= 0, iat= 433, 442, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25, &end
#
# 19 ARG HB2 19 ARG QD 3.79
&rst
ixpk= 0, nxpk= 0, iat= 261, -1, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,
igr2= 267, 268,
&end
#
# 44 LYS QE 46 THR HA 4.24
&rst
ixpk= 0, nxpk= 0, iat= -1, 701, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
igr1= 674, 675,
&end
#
# 46 THR HA 46 THR QG2 3.22
&rst
ixpk= 0, nxpk= 0, iat= 701, -1, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,
igr2= 705, 706, 707,
&end
#
# 36 ILE HG12 48 LEU QD1 5.77
&rst
ixpk= 0, nxpk= 0, iat= 555, -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
igr2= 736, 737, 738,
&end
#
# 117 VAL HA 117 VAL QG1 3.32
&rst
ixpk= 0, nxpk= 0, iat=1804, -1, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,
igr2=1808,1809,1810,
&end
#
# 74 TYR QD 79 PRO HA 4.58
&rst
ixpk= 0, nxpk= 0, iat= -1,1224, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
igr1=1146,1155,
&end
#
# 73 TYR HA 73 TYR QE 4.66
&rst
ixpk= 0, nxpk= 0, iat=1119, -1, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73,
igr2=1127,1132,
&end
#
# 30 VAL HA 31 THR QG2 3.76
&rst
ixpk= 0, nxpk= 0, iat= 464, -1, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
igr2= 484, 485, 486,
&end
#
# 30 VAL HA 30 VAL QG2 3.17
&rst
ixpk= 0, nxpk= 0, iat= 464, -1, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,
igr2= 472, 473, 474,
&end
#
# 20 VAL QG2 93 HIS QB 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr1= 291, 292, 293,
igr2=1450,1451,
&end
#
# 20 VAL QG1 93 HIS QB 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr1= 287, 288, 289,
igr2=1450,1451,
&end
#
# 20 VAL HA 60 GLU HB3 5.07
&rst
ixpk= 0, nxpk= 0, iat= 283, 937, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, &end
#
# 20 VAL HA 21 ILE HG13 5.50
&rst
ixpk= 0, nxpk= 0, iat= 283, 308, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 63 THR HA 64 GLU HB3 5.50
&rst
ixpk= 0, nxpk= 0, iat= 980, 997, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 74 TYR QD 78 THR HA 4.75
&rst
ixpk= 0, nxpk= 0, iat= -1,1202, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
igr1=1146,1155,
&end
#
# 73 TYR QE 77 VAL HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1186, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1=1127,1132,
&end
#
# 44 LYS QD 62 ASN HB2 4.41
&rst
ixpk= 0, nxpk= 0, iat= -1, 968, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr1= 671, 672,
&end
#
# 78 THR HA 79 PRO HG2 4.36
&rst
ixpk= 0, nxpk= 0, iat=1202,1218, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86, &end
#
# 78 THR HA 79 PRO HG3 4.35
&rst
ixpk= 0, nxpk= 0, iat=1202,1219, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85, &end
#
# 77 VAL HA 78 THR QG2 5.50
&rst
ixpk= 0, nxpk= 0, iat=1186, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2=1206,1207,1208,
&end
#
# 7 PHE HA 8 LYS QD 4.42
&rst
ixpk= 0, nxpk= 0, iat= 94, -1, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
igr2= 122, 123,
&end
#
# 94 LYS HA 94 LYS QD 3.71
&rst
ixpk= 0, nxpk= 0, iat=1465, -1, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
igr2=1473,1474,
&end
#
# 21 ILE HA 21 ILE HG12 4.07
&rst
ixpk= 0, nxpk= 0, iat= 299, 307, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57, &end
#
# 21 ILE HG13 90 PHE QD 5.00
&rst
ixpk= 0, nxpk= 0, iat= 308, -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr2=1409,1417,
&end
#
# 106 ARG HA 106 ARG HG2 3.66
&rst
ixpk= 0, nxpk= 0, iat=1646,1651, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16, &end
#
# 21 ILE HG12 74 TYR HB2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 307,1142, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 86 ILE HG12 87 TYR HA 4.38
&rst
ixpk= 0, nxpk= 0, iat=1335,1346, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88, &end
#
# 80 VAL HA 85 PRO HB3 4.22
&rst
ixpk= 0, nxpk= 0, iat=1230,1319, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 84 GLN HA 85 PRO HG3 4.57
&rst
ixpk= 0, nxpk= 0, iat=1296,1316, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07, &end
#
# 80 VAL QG2 85 PRO HG3 4.79
&rst
ixpk= 0, nxpk= 0, iat= -1,1316, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
igr1=1238,1239,1240,
&end
#
# 80 VAL QG1 85 PRO HG3 4.79
&rst
ixpk= 0, nxpk= 0, iat= -1,1316, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
igr1=1234,1235,1236,
&end
#
# 21 ILE HB 59 ILE HG13 4.54
&rst
ixpk= 0, nxpk= 0, iat= 301, 924, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 74 TYR HA 79 PRO HD2 5.46
&rst
ixpk= 0, nxpk= 0, iat=1140,1215, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96, &end
#
# 52 LYS HA 52 LYS QE 4.39
&rst
ixpk= 0, nxpk= 0, iat= 803, -1, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,
igr2= 814, 815,
&end
#
# 52 LYS HA 52 LYS QB 2.79
&rst
ixpk= 0, nxpk= 0, iat= 803, -1, r1= 1.30, r2= 1.80, r3= 3.13, r4= 3.63,
igr2= 805, 806,
&end
#
# 27 PRO HD2 81 LEU HG 5.22
&rst
ixpk= 0, nxpk= 0, iat= 418,1251, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72, &end
#
# 34 GLU HA 34 GLU QG 3.14
&rst
ixpk= 0, nxpk= 0, iat= 516, -1, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02,
igr2= 521, 522,
&end
#
# 34 GLU HA 81 LEU QD1 5.42
&rst
ixpk= 0, nxpk= 0, iat= 516, -1, r1= 1.30, r2= 1.80, r3= 6.51, r4= 7.01,
igr2=1253,1254,1255,
&end
#
# 34 GLU HA 81 LEU QD2 5.42
&rst
ixpk= 0, nxpk= 0, iat= 516, -1, r1= 1.30, r2= 1.80, r3= 6.51, r4= 7.01,
igr2=1257,1258,1259,
&end
#
# 21 ILE HA 90 PHE QD 4.54
&rst
ixpk= 0, nxpk= 0, iat= 299, -1, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
igr2=1409,1417,
&end
#
# 63 THR HA 63 THR QG2 2.79
&rst
ixpk= 0, nxpk= 0, iat= 980, -1, r1= 1.30, r2= 1.80, r3= 3.35, r4= 3.85,
igr2= 984, 985, 986,
&end
#
# 25 LYS QB 86 ILE HA 3.71
&rst
ixpk= 0, nxpk= 0, iat= -1,1327, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
igr1= 380, 381,
&end
#
# 32 GLU HA 48 LEU QD2 3.90
&rst
ixpk= 0, nxpk= 0, iat= 494, -1, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
igr2= 740, 741, 742,
&end
#
# 10 ASP HB2 11 SER HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= 145, 155, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 106 ARG HA 108 GLN QB 5.50
&rst
ixpk= 0, nxpk= 0, iat=1646, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2=1682,1683,
&end
#
# 38 LEU HA 38 LEU HG 4.22
&rst
ixpk= 0, nxpk= 0, iat= 577, 582, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 38 LEU HA 38 LEU QD1 4.25
&rst
ixpk= 0, nxpk= 0, iat= 577, -1, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
igr2= 584, 585, 586,
&end
#
# 108 GLN HA 111 LEU HG 5.25
&rst
ixpk= 0, nxpk= 0, iat=1680,1722, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75, &end
#
# 74 TYR HB2 79 PRO HG3 5.18
&rst
ixpk= 0, nxpk= 0, iat=1142,1219, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68, &end
#
# 42 PHE HA 42 PHE QD 3.55
&rst
ixpk= 0, nxpk= 0, iat= 636, -1, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,
igr2= 642, 650,
&end
#
# 42 PHE HA 69 THR QG2 4.12
&rst
ixpk= 0, nxpk= 0, iat= 636, -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr2=1062,1063,1064,
&end
#
# 40 LEU HA 40 LEU QQD 2.93
&rst
ixpk= 0, nxpk= 0, iat= 603, -1, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
igr2= 610, 611, 612, 614, 615, 616,
&end
#
# 81 LEU HA 81 LEU QD2 4.03
&rst
ixpk= 0, nxpk= 0, iat=1246, -1, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
igr2=1257,1258,1259,
&end
#
# 25 LYS QG 87 TYR QD 4.14
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
igr1= 383, 384,
igr2=1352,1361,
&end
#
# 47 ASN HA 111 LEU QD2 3.52
&rst
ixpk= 0, nxpk= 0, iat= 715, -1, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,
igr2=1728,1729,1730,
&end
#
# 47 ASN HB3 111 LEU QD2 4.84
&rst
ixpk= 0, nxpk= 0, iat= 718, -1, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
igr2=1728,1729,1730,
&end
#
# 37 SER HA 40 LEU QQD 2.82
&rst
ixpk= 0, nxpk= 0, iat= 566, -1, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,
igr2= 610, 611, 612, 614, 615, 616,
&end
#
# 52 LYS HG3 52 LYS QE 3.42
&rst
ixpk= 0, nxpk= 0, iat= 809, -1, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
igr2= 814, 815,
&end
#
# 32 GLU HA 48 LEU QD1 3.90
&rst
ixpk= 0, nxpk= 0, iat= 494, -1, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
igr2= 736, 737, 738,
&end
#
# 48 LEU QD1 50 MET HG3 4.90
&rst
ixpk= 0, nxpk= 0, iat= -1, 773, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
igr1= 736, 737, 738,
&end
#
# 87 TYR HA 87 TYR QE 4.89
&rst
ixpk= 0, nxpk= 0, iat=1346, -1, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
igr2=1354,1359,
&end
#
# 79 PRO HG3 87 TYR HA 5.50
&rst
ixpk= 0, nxpk= 0, iat=1219,1346, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 111 LEU HA 111 LEU QD2 4.15
&rst
ixpk= 0, nxpk= 0, iat=1717, -1, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
igr2=1728,1729,1730,
&end
#
# 94 LYS HA 94 LYS QG 3.52
&rst
ixpk= 0, nxpk= 0, iat=1465, -1, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
igr2=1470,1471,
&end
#
# 44 LYS HA 44 LYS HG3 4.10
&rst
ixpk= 0, nxpk= 0, iat= 663, 669, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60, &end
#
# 44 LYS HG2 62 ASN HB3 3.93
&rst
ixpk= 0, nxpk= 0, iat= 668, 969, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43, &end
#
# 5 LYS HG2 5 LYS QE 3.55
&rst
ixpk= 0, nxpk= 0, iat= 55, -1, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,
igr2= 61, 62,
&end
#
# 54 LYS QG 55 ASN HA 4.60
&rst
ixpk= 0, nxpk= 0, iat= -1, 854, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
igr1= 837, 838,
&end
#
# 81 LEU HA 81 LEU QD1 4.03
&rst
ixpk= 0, nxpk= 0, iat=1246, -1, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
igr2=1253,1254,1255,
&end
#
# 35 VAL HA 81 LEU QD1 3.92
&rst
ixpk= 0, nxpk= 0, iat= 531, -1, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
igr2=1253,1254,1255,
&end
#
# 46 THR QG2 62 ASN HA 3.07
&rst
ixpk= 0, nxpk= 0, iat= -1, 966, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19,
igr1= 705, 706, 707,
&end
#
# 8 LYS HA 8 LYS QG 3.45
&rst
ixpk= 0, nxpk= 0, iat= 114, -1, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,
igr2= 119, 120,
&end
#
# 5 LYS HA 5 LYS QE 4.63
&rst
ixpk= 0, nxpk= 0, iat= 50, -1, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
igr2= 61, 62,
&end
#
# 48 LEU HA 96 LEU QD2 4.94
&rst
ixpk= 0, nxpk= 0, iat= 729, -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr2=1513,1514,1515,
&end
#
# 96 LEU HA 96 LEU QD2 3.95
&rst
ixpk= 0, nxpk= 0, iat=1502, -1, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr2=1513,1514,1515,
&end
#
# 58 PHE QB 96 LEU QD2 3.65
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
igr1= 897, 898,
igr2=1513,1514,1515,
&end
#
# 47 ASN HB2 96 LEU QD2 4.16
&rst
ixpk= 0, nxpk= 0, iat= 717, -1, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,
igr2=1513,1514,1515,
&end
#
# 5 LYS HA 7 PHE QD 4.99
&rst
ixpk= 0, nxpk= 0, iat= 50, -1, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
igr2= 100, 108,
&end
#
# 35 VAL HA 57 ALA QB 4.67
&rst
ixpk= 0, nxpk= 0, iat= 531, -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr2= 887, 888, 889,
&end
#
# 96 LEU HA 96 LEU QD1 3.95
&rst
ixpk= 0, nxpk= 0, iat=1502, -1, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr2=1509,1510,1511,
&end
#
# 58 PHE QB 96 LEU QD1 3.65
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
igr1= 897, 898,
igr2=1509,1510,1511,
&end
#
# 60 GLU HB3 96 LEU QD1 5.03
&rst
ixpk= 0, nxpk= 0, iat= 937, -1, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54,
igr2=1509,1510,1511,
&end
#
# 47 ASN HA 111 LEU QD1 3.52
&rst
ixpk= 0, nxpk= 0, iat= 715, -1, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,
igr2=1724,1725,1726,
&end
#
# 47 ASN HB3 111 LEU QD1 4.84
&rst
ixpk= 0, nxpk= 0, iat= 718, -1, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
igr2=1724,1725,1726,
&end
#
# 58 PHE HA 96 LEU QD1 4.66
&rst
ixpk= 0, nxpk= 0, iat= 895, -1, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
igr2=1509,1510,1511,
&end
#
# 18 SER HA 19 ARG QD 4.95
&rst
ixpk= 0, nxpk= 0, iat= 248, -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
igr2= 267, 268,
&end
#
# 58 PHE QE 91 SER HA 4.68
&rst
ixpk= 0, nxpk= 0, iat= -1,1423, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
igr1= 903, 907,
&end
#
# 42 PHE QD 66 ALA HA 5.27
&rst
ixpk= 0, nxpk= 0, iat= -1,1024, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
igr1= 642, 650,
&end
#
# 44 LYS HA 44 LYS QE 4.22
&rst
ixpk= 0, nxpk= 0, iat= 663, -1, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr2= 674, 675,
&end
#
# 20 VAL HA 20 VAL QG2 3.63
&rst
ixpk= 0, nxpk= 0, iat= 283, -1, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,
igr2= 291, 292, 293,
&end
#
# 104 GLN QG 105 ALA HA 4.15
&rst
ixpk= 0, nxpk= 0, iat= -1,1636, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
igr1=1624,1625,
&end
#
# 60 GLU HA 96 LEU QB 5.50
&rst
ixpk= 0, nxpk= 0, iat= 934, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2=1504,1505,
&end
#
# 60 GLU HA 96 LEU HG 5.50
&rst
ixpk= 0, nxpk= 0, iat= 934,1507, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 47 ASN HB3 60 GLU HA 5.34
&rst
ixpk= 0, nxpk= 0, iat= 718, 934, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84, &end
#
# 95 GLU HA 96 LEU HG 5.50
&rst
ixpk= 0, nxpk= 0, iat=1487,1507, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 20 VAL QG2 95 GLU HA 4.83
&rst
ixpk= 0, nxpk= 0, iat= -1,1487, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
igr1= 291, 292, 293,
&end
#
# 20 VAL QG1 95 GLU HA 4.83
&rst
ixpk= 0, nxpk= 0, iat= -1,1487, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
igr1= 287, 288, 289,
&end
#
# 48 LEU HA 96 LEU QD1 4.94
&rst
ixpk= 0, nxpk= 0, iat= 729, -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr2=1509,1510,1511,
&end
#
# 26 LEU QD2 55 ASN HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 854, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 411, 412, 413,
&end
#
# 66 ALA HA 69 THR QG2 4.85
&rst
ixpk= 0, nxpk= 0, iat=1024, -1, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32,
igr2=1062,1063,1064,
&end
#
# 81 LEU HA 81 LEU HG 3.77
&rst
ixpk= 0, nxpk= 0, iat=1246,1251, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27, &end
#
# 63 THR QG2 66 ALA HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1024, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 984, 985, 986,
&end
#
# 89 GLN HA 90 PHE QD 5.20
&rst
ixpk= 0, nxpk= 0, iat=1386, -1, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
igr2=1409,1417,
&end
#
# 71 VAL QG1 89 GLN HA 5.12
&rst
ixpk= 0, nxpk= 0, iat= -1,1386, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
igr1=1093,1094,1095,
&end
#
# 98 THR HA 98 THR QG2 3.44
&rst
ixpk= 0, nxpk= 0, iat=1543, -1, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
igr2=1547,1548,1549,
&end
#
# 88 ILE QD1 89 GLN HA 4.40
&rst
ixpk= 0, nxpk= 0, iat= -1,1386, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
igr1=1378,1379,1380,
&end
#
# 28 ILE QG2 29 ASP HA 4.20
&rst
ixpk= 0, nxpk= 0, iat= -1, 452, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr1= 437, 438, 439,
&end
#
# 78 THR QG2 86 ILE HA 3.82
&rst
ixpk= 0, nxpk= 0, iat= -1,1327, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
igr1=1206,1207,1208,
&end
#
# 80 VAL HA 80 VAL QG1 3.22
&rst
ixpk= 0, nxpk= 0, iat=1230, -1, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,
igr2=1234,1235,1236,
&end
#
# 114 VAL HA 114 VAL QG2 3.55
&rst
ixpk= 0, nxpk= 0, iat=1763, -1, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,
igr2=1771,1772,1773,
&end
#
# 71 VAL QG2 89 GLN HA 5.12
&rst
ixpk= 0, nxpk= 0, iat= -1,1386, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
igr1=1097,1098,1099,
&end
#
# 74 TYR QD 77 VAL QG1 4.37
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.89, r4= 6.39,
igr1=1146,1155,
igr2=1190,1191,1192,
&end
#
# 27 PRO HG3 84 GLN HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= 422,1296, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 80 VAL HA 80 VAL QG2 3.22
&rst
ixpk= 0, nxpk= 0, iat=1230, -1, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,
igr2=1238,1239,1240,
&end
#
# 42 PHE QD 66 ALA QB 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr1= 642, 650,
igr2=1026,1027,1028,
&end
#
# 61 MET HA 66 ALA QB 4.66
&rst
ixpk= 0, nxpk= 0, iat= 949, -1, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
igr2=1026,1027,1028,
&end
#
# 63 THR HA 66 ALA QB 5.16
&rst
ixpk= 0, nxpk= 0, iat= 980, -1, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
igr2=1026,1027,1028,
&end
#
# 63 THR HB 66 ALA QB 5.44
&rst
ixpk= 0, nxpk= 0, iat= 982, -1, r1= 1.30, r2= 1.80, r3= 6.53, r4= 7.03,
igr2=1026,1027,1028,
&end
#
# 67 ALA QB 90 PHE QE 3.34
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
igr1=1036,1037,1038,
igr2=1411,1415,
&end
#
# 19 ARG QD 67 ALA QB 4.53
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
igr1= 267, 268,
igr2=1036,1037,1038,
&end
#
# 41 PRO HD2 42 PHE QE 5.50
&rst
ixpk= 0, nxpk= 0, iat= 621, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 644, 648,
&end
#
# 41 PRO HD3 42 PHE QD 5.21
&rst
ixpk= 0, nxpk= 0, iat= 622, -1, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
igr2= 642, 650,
&end
#
# 21 ILE QG2 90 PHE QE 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr1= 303, 304, 305,
igr2=1411,1415,
&end
#
# 21 ILE HA 21 ILE QG2 3.39
&rst
ixpk= 0, nxpk= 0, iat= 299, -1, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,
igr2= 303, 304, 305,
&end
#
# 80 VAL HA 85 PRO HD2 5.50
&rst
ixpk= 0, nxpk= 0, iat=1230,1312, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 48 LEU HA 59 ILE QG2 4.05
&rst
ixpk= 0, nxpk= 0, iat= 729, -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
igr2= 919, 920, 921,
&end
#
# 85 PRO HD3 86 ILE QG2 5.49
&rst
ixpk= 0, nxpk= 0, iat=1313, -1, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
igr2=1331,1332,1333,
&end
#
# 80 VAL HA 86 ILE QG2 4.49
&rst
ixpk= 0, nxpk= 0, iat=1230, -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr2=1331,1332,1333,
&end
#
# 86 ILE HA 86 ILE QG2 3.19
&rst
ixpk= 0, nxpk= 0, iat=1327, -1, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,
igr2=1331,1332,1333,
&end
#
# 39 GLY HA3 70 MET QE 3.68
&rst
ixpk= 0, nxpk= 0, iat= 597, -1, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
igr2=1081,1082,1083,
&end
#
# 38 LEU HA 70 MET QE 4.98
&rst
ixpk= 0, nxpk= 0, iat= 577, -1, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
igr2=1081,1082,1083,
&end
#
# 67 ALA HA 70 MET QE 5.50
&rst
ixpk= 0, nxpk= 0, iat=1034, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2=1081,1082,1083,
&end
#
# 70 MET QE 79 PRO HD3 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1216, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1=1081,1082,1083,
&end
#
# 39 GLY HA2 70 MET QE 3.68
&rst
ixpk= 0, nxpk= 0, iat= 596, -1, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
igr2=1081,1082,1083,
&end
#
# 104 GLN QG 105 ALA QB 4.32
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32,
igr1=1624,1625,
igr2=1638,1639,1640,
&end
#
# 87 TYR HA 88 ILE QG2 3.58
&rst
ixpk= 0, nxpk= 0, iat=1346, -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
igr2=1371,1372,1373,
&end
#
# 27 PRO HD3 86 ILE HG12 4.78
&rst
ixpk= 0, nxpk= 0, iat= 419,1335, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, &end
#
# 27 PRO HD2 86 ILE HG12 5.50
&rst
ixpk= 0, nxpk= 0, iat= 418,1335, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 79 PRO HD3 88 ILE QG2 5.07
&rst
ixpk= 0, nxpk= 0, iat=1216, -1, r1= 1.30, r2= 1.80, r3= 6.09, r4= 6.59,
igr2=1371,1372,1373,
&end
#
# 70 MET QE 88 ILE QG2 3.94
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
igr1=1081,1082,1083,
igr2=1371,1372,1373,
&end
#
# 35 VAL HA 50 MET QE 5.24
&rst
ixpk= 0, nxpk= 0, iat= 531, -1, r1= 1.30, r2= 1.80, r3= 6.29, r4= 6.79,
igr2= 776, 777, 778,
&end
#
# 42 PHE QD 61 MET QE 4.82
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
igr1= 642, 650,
igr2= 958, 959, 960,
&end
#
# 61 MET HA 61 MET QE 3.79
&rst
ixpk= 0, nxpk= 0, iat= 949, -1, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,
igr2= 958, 959, 960,
&end
#
# 33 GLY HA2 36 ILE QG2 5.36
&rst
ixpk= 0, nxpk= 0, iat= 509, -1, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,
igr2= 551, 552, 553,
&end
#
# 33 GLY HA2 36 ILE HB 4.26
&rst
ixpk= 0, nxpk= 0, iat= 509, 549, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76, &end
#
# 79 PRO HD2 88 ILE QD1 5.03
&rst
ixpk= 0, nxpk= 0, iat=1215, -1, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54,
igr2=1378,1379,1380,
&end
#
# 79 PRO HG2 88 ILE QD1 4.54
&rst
ixpk= 0, nxpk= 0, iat=1218, -1, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,
igr2=1378,1379,1380,
&end
#
# 78 THR HA 88 ILE QD1 5.50
&rst
ixpk= 0, nxpk= 0, iat=1202, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2=1378,1379,1380,
&end
#
# 27 PRO HD3 81 LEU HB3 5.50
&rst
ixpk= 0, nxpk= 0, iat= 419,1249, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 23 ILE QD1 79 PRO HD3 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1216, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 346, 347, 348,
&end
#
# 23 ILE QD1 35 VAL HA 5.20
&rst
ixpk= 0, nxpk= 0, iat= -1, 531, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
igr1= 346, 347, 348,
&end
#
# 23 ILE QD1 79 PRO HD2 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1215, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 346, 347, 348,
&end
#
# 28 ILE HA 28 ILE QD1 3.69
&rst
ixpk= 0, nxpk= 0, iat= 433, -1, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
igr2= 444, 445, 446,
&end
#
# 28 ILE HB 28 ILE QD1 3.20
&rst
ixpk= 0, nxpk= 0, iat= 435, -1, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
igr2= 444, 445, 446,
&end
#
# 21 ILE QD1 90 PHE QE 3.83
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
igr1= 310, 311, 312,
igr2=1411,1415,
&end
#
# 21 ILE HA 21 ILE QD1 3.65
&rst
ixpk= 0, nxpk= 0, iat= 299, -1, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
igr2= 310, 311, 312,
&end
#
# 43 GLY HA3 66 ALA QB 3.68
&rst
ixpk= 0, nxpk= 0, iat= 657, -1, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
igr2=1026,1027,1028,
&end
#
# 83 GLY HA3 84 GLN QG 5.38
&rst
ixpk= 0, nxpk= 0, iat=1290, -1, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54,
igr2=1301,1302,
&end
#
# 19 ARG QD 63 THR HA 3.34
&rst
ixpk= 0, nxpk= 0, iat= -1, 980, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,
igr1= 267, 268,
&end
#
# 19 ARG HB3 19 ARG QD 3.79
&rst
ixpk= 0, nxpk= 0, iat= 262, -1, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,
igr2= 267, 268,
&end
#
# 19 ARG QG 19 ARG QD 2.94
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,
igr1= 264, 265,
igr2= 267, 268,
&end
#
# 82 ARG QB 82 ARG HD2 3.36
&rst
ixpk= 0, nxpk= 0, iat= -1,1273, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
igr1=1267,1268,
&end
#
# 82 ARG QB 82 ARG HD3 3.36
&rst
ixpk= 0, nxpk= 0, iat= -1,1274, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
igr1=1267,1268,
&end
#
# 47 ASN HB2 96 LEU QB 4.29
&rst
ixpk= 0, nxpk= 0, iat= 717, -1, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
igr2=1504,1505,
&end
#
# 19 ARG QD 63 THR H 4.34
&rst
ixpk= 0, nxpk= 0, iat= -1, 978, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,
igr1= 267, 268,
&end
#
# 19 ARG QD 61 MET H 5.45
&rst
ixpk= 0, nxpk= 0, iat= -1, 947, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,
igr1= 267, 268,
&end
#
# 19 ARG H 19 ARG QD 3.80
&rst
ixpk= 0, nxpk= 0, iat= 257, -1, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,
igr2= 267, 268,
&end
#
# 19 ARG QD 67 ALA H 5.45
&rst
ixpk= 0, nxpk= 0, iat= -1,1032, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,
igr1= 267, 268,
&end
#
# 19 ARG HA 19 ARG QD 3.65
&rst
ixpk= 0, nxpk= 0, iat= 259, -1, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,
igr2= 267, 268,
&end
#
# 106 ARG HA 106 ARG QD 3.46
&rst
ixpk= 0, nxpk= 0, iat=1646, -1, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,
igr2=1654,1655,
&end
#
# 106 ARG QB 106 ARG QD 2.63
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.31, r4= 3.81,
igr1=1648,1649,
igr2=1654,1655,
&end
#
# 106 ARG HG2 106 ARG QD 2.58
&rst
ixpk= 0, nxpk= 0, iat=1651, -1, r1= 1.30, r2= 1.80, r3= 2.90, r4= 3.40,
igr2=1654,1655,
&end
#
# 106 ARG HG3 106 ARG QD 2.58
&rst
ixpk= 0, nxpk= 0, iat=1652, -1, r1= 1.30, r2= 1.80, r3= 2.90, r4= 3.40,
igr2=1654,1655,
&end
#
# 106 ARG QD 109 ALA QB 3.96
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr1=1654,1655,
igr2=1699,1700,1701,
&end
#
# 12 ARG QB 12 ARG QD 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,
igr1= 168, 169,
igr2= 174, 175,
&end
#
# 58 PHE HB3 96 LEU QD1 5.22
&rst
ixpk= 0, nxpk= 0, iat= 898, -1, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
igr2=1509,1510,1511,
&end
#
# 96 LEU H 96 LEU QB 3.69
&rst
ixpk= 0, nxpk= 0, iat=1500, -1, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,
igr2=1504,1505,
&end
#
# 47 ASN HD22 96 LEU QB 4.78
&rst
ixpk= 0, nxpk= 0, iat= 722, -1, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr2=1504,1505,
&end
#
# 47 ASN HD21 96 LEU QB 4.78
&rst
ixpk= 0, nxpk= 0, iat= 723, -1, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr2=1504,1505,
&end
#
# 95 GLU HA 96 LEU QB 4.69
&rst
ixpk= 0, nxpk= 0, iat=1487, -1, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr2=1504,1505,
&end
#
# 12 ARG QG 12 ARG QD 2.46
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.10, r4= 3.60,
igr1= 171, 172,
igr2= 174, 175,
&end
#
# 38 LEU HB3 39 GLY H 4.50
&rst
ixpk= 0, nxpk= 0, iat= 580, 594, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 38 LEU H 38 LEU HB3 3.90
&rst
ixpk= 0, nxpk= 0, iat= 575, 580, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40, &end
#
# 38 LEU HB2 39 GLY H 4.50
&rst
ixpk= 0, nxpk= 0, iat= 579, 594, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 35 VAL HA 38 LEU HB2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 531, 579, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 38 LEU H 38 LEU HB2 3.90
&rst
ixpk= 0, nxpk= 0, iat= 575, 579, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40, &end
#
# 28 ILE HA 52 LYS QE 3.99
&rst
ixpk= 0, nxpk= 0, iat= 433, -1, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
igr2= 814, 815,
&end
#
# 21 ILE H 59 ILE HB 4.86
&rst
ixpk= 0, nxpk= 0, iat= 297, 917, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36, &end
#
# 59 ILE H 59 ILE HB 3.84
&rst
ixpk= 0, nxpk= 0, iat= 913, 917, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34, &end
#
# 59 ILE HB 61 MET H 5.50
&rst
ixpk= 0, nxpk= 0, iat= 917, 947, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 94 LYS QD 94 LYS QE 2.40
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.02, r4= 3.52,
igr1=1473,1474,
igr2=1476,1477,
&end
#
# 44 LYS H 44 LYS QE 5.50
&rst
ixpk= 0, nxpk= 0, iat= 661, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 674, 675,
&end
#
# 8 LYS QD 8 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= 122, 123,
igr2= 125, 126,
&end
#
# 97 LYS QD 97 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=1529,1530,
igr2=1532,1533,
&end
#
# 44 LYS QE 45 VAL H 4.43
&rst
ixpk= 0, nxpk= 0, iat= -1, 683, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
igr1= 674, 675,
&end
#
# 51 LEU QD2 54 LYS QE 4.52
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.09, r4= 6.59,
igr1= 795, 796, 797,
igr2= 843, 844,
&end
#
# 8 LYS QG 8 LYS QE 2.94
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,
igr1= 119, 120,
igr2= 125, 126,
&end
#
# 54 LYS QG 54 LYS QE 2.94
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,
igr1= 837, 838,
igr2= 843, 844,
&end
#
# 111 LEU H 111 LEU HB3 3.86
&rst
ixpk= 0, nxpk= 0, iat=1715,1720, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 111 LEU H 111 LEU HB2 3.86
&rst
ixpk= 0, nxpk= 0, iat=1715,1719, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 10 ASP HB3 11 SER HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= 146, 155, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 47 ASN HB2 96 LEU HG 4.97
&rst
ixpk= 0, nxpk= 0, iat= 717,1507, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 87 TYR HB3 88 ILE H 4.36
&rst
ixpk= 0, nxpk= 0, iat=1349,1365, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86, &end
#
# 87 TYR HB2 88 ILE H 4.36
&rst
ixpk= 0, nxpk= 0, iat=1348,1365, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86, &end
#
# 88 ILE HB 89 GLN H 4.30
&rst
ixpk= 0, nxpk= 0, iat=1369,1384, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80, &end
#
# 88 ILE HB 88 ILE QD1 3.25
&rst
ixpk= 0, nxpk= 0, iat=1369, -1, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40,
igr2=1378,1379,1380,
&end
#
# 74 TYR HB3 88 ILE HB 4.84
&rst
ixpk= 0, nxpk= 0, iat=1143,1369, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34, &end
#
# 42 PHE HB2 61 MET QE 4.39
&rst
ixpk= 0, nxpk= 0, iat= 638, -1, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77,
igr2= 958, 959, 960,
&end
#
# 42 PHE HB3 70 MET HA 4.83
&rst
ixpk= 0, nxpk= 0, iat= 639,1072, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33, &end
#
# 42 PHE HB3 70 MET HB3 5.28
&rst
ixpk= 0, nxpk= 0, iat= 639,1075, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 42 PHE HB3 70 MET H 4.78
&rst
ixpk= 0, nxpk= 0, iat= 639,1070, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, &end
#
# 42 PHE HB3 43 GLY H 4.66
&rst
ixpk= 0, nxpk= 0, iat= 639, 654, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16, &end
#
# 42 PHE HB3 61 MET QE 4.18
&rst
ixpk= 0, nxpk= 0, iat= 639, -1, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
igr2= 958, 959, 960,
&end
#
# 42 PHE HB3 70 MET HB2 5.28
&rst
ixpk= 0, nxpk= 0, iat= 639,1074, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 42 PHE HB3 66 ALA QB 4.46
&rst
ixpk= 0, nxpk= 0, iat= 639, -1, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
igr2=1026,1027,1028,
&end
#
# 40 LEU H 40 LEU HB2 3.91
&rst
ixpk= 0, nxpk= 0, iat= 601, 605, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41, &end
#
# 21 ILE H 21 ILE HB 3.85
&rst
ixpk= 0, nxpk= 0, iat= 297, 301, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35, &end
#
# 21 ILE HB 59 ILE H 4.53
&rst
ixpk= 0, nxpk= 0, iat= 301, 913, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03, &end
#
# 20 VAL HA 21 ILE HB 4.59
&rst
ixpk= 0, nxpk= 0, iat= 283, 301, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 39 GLY H 40 LEU HB2 4.85
&rst
ixpk= 0, nxpk= 0, iat= 594, 605, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35, &end
#
# 37 SER HA 40 LEU HB2 3.86
&rst
ixpk= 0, nxpk= 0, iat= 566, 605, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 40 LEU HB2 41 PRO HD2 4.29
&rst
ixpk= 0, nxpk= 0, iat= 605, 621, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79, &end
#
# 40 LEU HB2 41 PRO HD3 4.40
&rst
ixpk= 0, nxpk= 0, iat= 605, 622, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 40 LEU HB2 40 LEU QQD 2.85
&rst
ixpk= 0, nxpk= 0, iat= 605, -1, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
igr2= 610, 611, 612, 614, 615, 616,
&end
#
# 40 LEU HB3 41 PRO HD2 4.44
&rst
ixpk= 0, nxpk= 0, iat= 606, 621, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94, &end
#
# 39 GLY H 40 LEU HB3 5.50
&rst
ixpk= 0, nxpk= 0, iat= 594, 606, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 40 LEU H 40 LEU HB3 3.78
&rst
ixpk= 0, nxpk= 0, iat= 601, 606, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28, &end
#
# 40 LEU HB3 41 PRO HD3 4.27
&rst
ixpk= 0, nxpk= 0, iat= 606, 622, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77, &end
#
# 63 THR H 63 THR HB 4.10
&rst
ixpk= 0, nxpk= 0, iat= 978, 982, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60, &end
#
# 63 THR HB 64 GLU HB3 5.24
&rst
ixpk= 0, nxpk= 0, iat= 982, 997, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74, &end
#
# 86 ILE HB 87 TYR H 3.79
&rst
ixpk= 0, nxpk= 0, iat=1329,1344, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29, &end
#
# 23 ILE QG2 86 ILE HB 3.51
&rst
ixpk= 0, nxpk= 0, iat= -1,1329, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
igr1= 339, 340, 341,
&end
#
# 86 ILE HB 87 TYR HA 5.01
&rst
ixpk= 0, nxpk= 0, iat=1329,1346, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51, &end
#
# 31 THR HB 33 GLY H 4.30
&rst
ixpk= 0, nxpk= 0, iat= 482, 507, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80, &end
#
# 67 ALA QB 68 ASN HB3 4.79
&rst
ixpk= 0, nxpk= 0, iat= -1,1047, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
igr1=1036,1037,1038,
&end
#
# 68 ASN H 68 ASN HB2 3.48
&rst
ixpk= 0, nxpk= 0, iat=1042,1046, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98, &end
#
# 29 ASP H 29 ASP HB3 3.81
&rst
ixpk= 0, nxpk= 0, iat= 450, 455, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31, &end
#
# 29 ASP HB3 30 VAL H 4.50
&rst
ixpk= 0, nxpk= 0, iat= 455, 462, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 28 ILE QG2 29 ASP HB3 4.31
&rst
ixpk= 0, nxpk= 0, iat= -1, 455, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
igr1= 437, 438, 439,
&end
#
# 29 ASP HB2 30 VAL H 4.50
&rst
ixpk= 0, nxpk= 0, iat= 454, 462, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 29 ASP H 29 ASP HB2 3.81
&rst
ixpk= 0, nxpk= 0, iat= 450, 454, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31, &end
#
# 28 ILE QG2 29 ASP HB2 4.31
&rst
ixpk= 0, nxpk= 0, iat= -1, 454, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
igr1= 437, 438, 439,
&end
#
# 65 GLU HA 68 ASN HB3 3.98
&rst
ixpk= 0, nxpk= 0, iat=1009,1047, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48, &end
#
# 68 ASN H 68 ASN HB3 3.48
&rst
ixpk= 0, nxpk= 0, iat=1042,1047, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98, &end
#
# 68 ASN HB3 69 THR H 4.22
&rst
ixpk= 0, nxpk= 0, iat=1047,1056, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 68 ASN HB2 69 THR H 4.22
&rst
ixpk= 0, nxpk= 0, iat=1046,1056, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 65 GLU HA 68 ASN HB2 3.98
&rst
ixpk= 0, nxpk= 0, iat=1009,1046, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48, &end
#
# 115 ASN HA 115 ASN HB3 3.01
&rst
ixpk= 0, nxpk= 0, iat=1779,1782, r1= 1.30, r2= 1.80, r3= 3.01, r4= 3.51, &end
#
# 115 ASN HB3 116 SER QB 5.27
&rst
ixpk= 0, nxpk= 0, iat=1782, -1, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
igr2=1795,1796,
&end
#
# 115 ASN HA 115 ASN HB2 3.01
&rst
ixpk= 0, nxpk= 0, iat=1779,1781, r1= 1.30, r2= 1.80, r3= 3.01, r4= 3.51, &end
#
# 115 ASN HB2 116 SER QB 5.27
&rst
ixpk= 0, nxpk= 0, iat=1781, -1, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
igr2=1795,1796,
&end
#
# 69 THR QG2 73 TYR HB2 4.65
&rst
ixpk= 0, nxpk= 0, iat= -1,1121, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr1=1062,1063,1064,
&end
#
# 73 TYR HB3 74 TYR H 4.58
&rst
ixpk= 0, nxpk= 0, iat=1122,1138, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08, &end
#
# 73 TYR HB2 74 TYR H 4.58
&rst
ixpk= 0, nxpk= 0, iat=1121,1138, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08, &end
#
# 36 ILE H 36 ILE HB 3.47
&rst
ixpk= 0, nxpk= 0, iat= 545, 549, r1= 1.30, r2= 1.80, r3= 3.47, r4= 3.97, &end
#
# 36 ILE HB 37 SER H 3.89
&rst
ixpk= 0, nxpk= 0, iat= 549, 564, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39, &end
#
# 28 ILE HB 30 VAL H 5.36
&rst
ixpk= 0, nxpk= 0, iat= 435, 462, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86, &end
#
# 35 VAL H 36 ILE HB 5.50
&rst
ixpk= 0, nxpk= 0, iat= 529, 549, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 72 ASN HB3 75 THR QG2 4.98
&rst
ixpk= 0, nxpk= 0, iat=1108, -1, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
igr2=1165,1166,1167,
&end
#
# 69 THR HA 72 ASN HB2 3.51
&rst
ixpk= 0, nxpk= 0, iat=1058,1107, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01, &end
#
# 34 GLU H 34 GLU QG 4.27
&rst
ixpk= 0, nxpk= 0, iat= 514, -1, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
igr2= 521, 522,
&end
#
# 28 ILE HA 28 ILE HB 2.85
&rst
ixpk= 0, nxpk= 0, iat= 433, 435, r1= 1.30, r2= 1.80, r3= 2.85, r4= 3.35, &end
#
# 34 GLU QG 35 VAL H 4.48
&rst
ixpk= 0, nxpk= 0, iat= -1, 529, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
igr1= 521, 522,
&end
#
# 44 LYS HB2 62 ASN HB3 4.60
&rst
ixpk= 0, nxpk= 0, iat= 665, 969, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 44 LYS QD 62 ASN HB3 5.07
&rst
ixpk= 0, nxpk= 0, iat= -1, 969, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
igr1= 671, 672,
&end
#
# 46 THR QG2 62 ASN HB3 4.02
&rst
ixpk= 0, nxpk= 0, iat= -1, 969, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
igr1= 705, 706, 707,
&end
#
# 61 MET HA 62 ASN HB2 5.34
&rst
ixpk= 0, nxpk= 0, iat= 949, 968, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84, &end
#
# 44 LYS HB2 62 ASN HB2 5.28
&rst
ixpk= 0, nxpk= 0, iat= 665, 968, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 62 ASN HB3 63 THR HA 4.92
&rst
ixpk= 0, nxpk= 0, iat= 969, 980, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42, &end
#
# 74 TYR HB3 79 PRO HG2 5.50
&rst
ixpk= 0, nxpk= 0, iat=1143,1218, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 74 TYR HB3 88 ILE H 5.03
&rst
ixpk= 0, nxpk= 0, iat=1143,1365, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53, &end
#
# 71 VAL H 74 TYR HB2 5.50
&rst
ixpk= 0, nxpk= 0, iat=1087,1142, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 73 TYR H 74 TYR HB2 5.50
&rst
ixpk= 0, nxpk= 0, iat=1117,1142, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 78 THR H 78 THR HB 2.97
&rst
ixpk= 0, nxpk= 0, iat=1200,1204, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 78 THR HB 85 PRO HB3 5.42
&rst
ixpk= 0, nxpk= 0, iat=1204,1319, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92, &end
#
# 26 LEU QB 55 ASN HB3 4.97
&rst
ixpk= 0, nxpk= 0, iat= -1, 857, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr1= 402, 403,
&end
#
# 25 LYS H 55 ASN HB2 5.13
&rst
ixpk= 0, nxpk= 0, iat= 376, 856, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63, &end
#
# 65 GLU HA 65 GLU HG3 3.81
&rst
ixpk= 0, nxpk= 0, iat=1009,1015, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31, &end
#
# 65 GLU H 65 GLU HG2 4.25
&rst
ixpk= 0, nxpk= 0, iat=1007,1014, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75, &end
#
# 65 GLU HG2 66 ALA H 4.10
&rst
ixpk= 0, nxpk= 0, iat=1014,1022, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60, &end
#
# 65 GLU HA 65 GLU HG2 3.81
&rst
ixpk= 0, nxpk= 0, iat=1009,1014, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31, &end
#
# 74 TYR H 75 THR HB 5.23
&rst
ixpk= 0, nxpk= 0, iat=1138,1163, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73, &end
#
# 75 THR H 75 THR HB 3.43
&rst
ixpk= 0, nxpk= 0, iat=1159,1163, r1= 1.30, r2= 1.80, r3= 3.43, r4= 3.93, &end
#
# 72 ASN H 75 THR HB 4.61
&rst
ixpk= 0, nxpk= 0, iat=1103,1163, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 80 VAL H 80 VAL HB 3.64
&rst
ixpk= 0, nxpk= 0, iat=1228,1232, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14, &end
#
# 80 VAL HB 85 PRO HD3 5.38
&rst
ixpk= 0, nxpk= 0, iat=1232,1313, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88, &end
#
# 80 VAL HB 81 LEU H 4.17
&rst
ixpk= 0, nxpk= 0, iat=1232,1244, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67, &end
#
# 79 PRO HA 80 VAL HB 5.11
&rst
ixpk= 0, nxpk= 0, iat=1224,1232, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61, &end
#
# 66 ALA QB 69 THR HB 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1060, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr1=1026,1027,1028,
&end
#
# 69 THR H 69 THR HB 3.65
&rst
ixpk= 0, nxpk= 0, iat=1056,1060, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15, &end
#
# 69 THR HB 72 ASN H 5.50
&rst
ixpk= 0, nxpk= 0, iat=1060,1103, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 69 THR HB 70 MET H 3.74
&rst
ixpk= 0, nxpk= 0, iat=1060,1070, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24, &end
#
# 69 THR HB 70 MET HA 4.76
&rst
ixpk= 0, nxpk= 0, iat=1060,1072, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26, &end
#
# 61 MET QE 69 THR HB 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1060, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 958, 959, 960,
&end
#
# 44 LYS QD 46 THR HB 4.75
&rst
ixpk= 0, nxpk= 0, iat= -1, 703, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
igr1= 671, 672,
&end
#
# 95 GLU QG 96 LEU H 4.23
&rst
ixpk= 0, nxpk= 0, iat= -1,1500, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25,
igr1=1492,1493,
&end
#
# 95 GLU H 95 GLU QG 3.92
&rst
ixpk= 0, nxpk= 0, iat=1485, -1, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,
igr2=1492,1493,
&end
#
# 95 GLU HA 95 GLU QG 3.41
&rst
ixpk= 0, nxpk= 0, iat=1487, -1, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,
igr2=1492,1493,
&end
#
# 108 GLN H 108 GLN QG 4.21
&rst
ixpk= 0, nxpk= 0, iat=1678, -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
igr2=1685,1686,
&end
#
# 108 GLN HA 108 GLN QG 2.94
&rst
ixpk= 0, nxpk= 0, iat=1680, -1, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80,
igr2=1685,1686,
&end
#
# 43 GLY HA2 44 LYS HB2 4.87
&rst
ixpk= 0, nxpk= 0, iat= 656, 665, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37, &end
#
# 43 GLY HA3 44 LYS HB3 5.11
&rst
ixpk= 0, nxpk= 0, iat= 657, 666, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61, &end
#
# 42 PHE QE 69 THR HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1058, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 644, 648,
&end
#
# 112 GLN H 112 GLN HG2 3.79
&rst
ixpk= 0, nxpk= 0, iat=1734,1741, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29, &end
#
# 112 GLN HA 112 GLN HG2 3.29
&rst
ixpk= 0, nxpk= 0, iat=1736,1741, r1= 1.30, r2= 1.80, r3= 3.29, r4= 3.79, &end
#
# 112 GLN H 112 GLN HG3 3.79
&rst
ixpk= 0, nxpk= 0, iat=1734,1742, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29, &end
#
# 112 GLN HA 112 GLN HG3 3.29
&rst
ixpk= 0, nxpk= 0, iat=1736,1742, r1= 1.30, r2= 1.80, r3= 3.29, r4= 3.79, &end
#
# 44 LYS HB2 45 VAL H 4.37
&rst
ixpk= 0, nxpk= 0, iat= 665, 683, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87, &end
#
# 44 LYS H 44 LYS HB2 3.59
&rst
ixpk= 0, nxpk= 0, iat= 661, 665, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09, &end
#
# 44 LYS HB2 44 LYS QE 4.12
&rst
ixpk= 0, nxpk= 0, iat= 665, -1, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
igr2= 674, 675,
&end
#
# 44 LYS HB2 62 ASN H 5.50
&rst
ixpk= 0, nxpk= 0, iat= 665, 964, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 44 LYS HB3 62 ASN H 4.42
&rst
ixpk= 0, nxpk= 0, iat= 666, 964, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92, &end
#
# 44 LYS HB3 45 VAL H 4.48
&rst
ixpk= 0, nxpk= 0, iat= 666, 683, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98, &end
#
# 44 LYS H 44 LYS HB3 3.55
&rst
ixpk= 0, nxpk= 0, iat= 661, 666, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05, &end
#
# 44 LYS HB3 62 ASN HD22 5.50
&rst
ixpk= 0, nxpk= 0, iat= 666, 973, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 44 LYS HB3 44 LYS QE 4.26
&rst
ixpk= 0, nxpk= 0, iat= 666, -1, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
igr2= 674, 675,
&end
#
# 69 THR HA 72 ASN H 3.79
&rst
ixpk= 0, nxpk= 0, iat=1058,1103, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29, &end
#
# 35 VAL HA 38 LEU HG 3.74
&rst
ixpk= 0, nxpk= 0, iat= 531, 582, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24, &end
#
# 69 THR HA 72 ASN HD21 5.50
&rst
ixpk= 0, nxpk= 0, iat=1058,1113, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 81 LEU H 84 GLN QG 5.34
&rst
ixpk= 0, nxpk= 0, iat=1244, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2=1301,1302,
&end
#
# 84 GLN H 84 GLN QG 3.18
&rst
ixpk= 0, nxpk= 0, iat=1294, -1, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07,
igr2=1301,1302,
&end
#
# 84 GLN HA 84 GLN QG 3.22
&rst
ixpk= 0, nxpk= 0, iat=1296, -1, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11,
igr2=1301,1302,
&end
#
# 77 VAL HB 78 THR H 4.14
&rst
ixpk= 0, nxpk= 0, iat=1188,1200, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64, &end
#
# 77 VAL H 77 VAL HB 3.89
&rst
ixpk= 0, nxpk= 0, iat=1184,1188, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39, &end
#
# 74 TYR QE 77 VAL HB 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1188, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1=1148,1153,
&end
#
# 50 MET H 50 MET QB 4.01
&rst
ixpk= 0, nxpk= 0, iat= 765, -1, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
igr2= 769, 770,
&end
#
# 50 MET QB 51 LEU H 3.95
&rst
ixpk= 0, nxpk= 0, iat= -1, 782, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
igr1= 769, 770,
&end
#
# 77 VAL HB 78 THR HA 5.23
&rst
ixpk= 0, nxpk= 0, iat=1188,1202, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73, &end
#
# 94 LYS HB2 95 GLU H 5.03
&rst
ixpk= 0, nxpk= 0, iat=1467,1485, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53, &end
#
# 94 LYS HB3 95 GLU H 5.03
&rst
ixpk= 0, nxpk= 0, iat=1468,1485, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53, &end
#
# 5 LYS QB 7 PHE QD 4.44
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.59, r4= 6.09,
igr1= 52, 53,
igr2= 100, 108,
&end
#
# 5 LYS QB 5 LYS QE 3.78
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
igr1= 52, 53,
igr2= 61, 62,
&end
#
# 35 VAL H 36 ILE HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= 529, 547, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 8 LYS QB 9 GLY H 3.33
&rst
ixpk= 0, nxpk= 0, iat= -1, 134, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24,
igr1= 116, 117,
&end
#
# 95 GLU HB2 96 LEU H 3.95
&rst
ixpk= 0, nxpk= 0, iat=1489,1500, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45, &end
#
# 95 GLU HB3 96 LEU H 3.95
&rst
ixpk= 0, nxpk= 0, iat=1490,1500, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45, &end
#
# 114 VAL HB 115 ASN HA 5.33
&rst
ixpk= 0, nxpk= 0, iat=1765,1779, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83, &end
#
# 36 ILE QD1 114 VAL HB 3.92
&rst
ixpk= 0, nxpk= 0, iat= -1,1765, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
igr1= 558, 559, 560,
&end
#
# 114 VAL H 114 VAL HB 3.87
&rst
ixpk= 0, nxpk= 0, iat=1761,1765, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37, &end
#
# 114 VAL HA 114 VAL HB 2.78
&rst
ixpk= 0, nxpk= 0, iat=1763,1765, r1= 1.30, r2= 1.80, r3= 2.78, r4= 3.28, &end
#
# 45 VAL H 45 VAL HB 3.71
&rst
ixpk= 0, nxpk= 0, iat= 683, 687, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21, &end
#
# 52 LYS QB 54 LYS H 5.07
&rst
ixpk= 0, nxpk= 0, iat= -1, 830, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
igr1= 805, 806,
&end
#
# 50 MET H 50 MET HG3 4.56
&rst
ixpk= 0, nxpk= 0, iat= 765, 773, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06, &end
#
# 50 MET HG3 51 LEU H 5.19
&rst
ixpk= 0, nxpk= 0, iat= 773, 782, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69, &end
#
# 50 MET H 50 MET HG2 4.56
&rst
ixpk= 0, nxpk= 0, iat= 765, 772, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06, &end
#
# 48 LEU QD1 50 MET HG2 4.90
&rst
ixpk= 0, nxpk= 0, iat= -1, 772, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
igr1= 736, 737, 738,
&end
#
# 48 LEU QD2 50 MET HG2 4.90
&rst
ixpk= 0, nxpk= 0, iat= -1, 772, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
igr1= 740, 741, 742,
&end
#
# 50 MET HG2 51 LEU H 5.19
&rst
ixpk= 0, nxpk= 0, iat= 772, 782, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69, &end
#
# 50 MET HG2 107 ALA HA 5.09
&rst
ixpk= 0, nxpk= 0, iat= 772,1670, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59, &end
#
# 85 PRO HB3 86 ILE H 4.10
&rst
ixpk= 0, nxpk= 0, iat=1319,1325, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60, &end
#
# 80 VAL QG1 85 PRO HB3 3.95
&rst
ixpk= 0, nxpk= 0, iat= -1,1319, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr1=1234,1235,1236,
&end
#
# 45 VAL HB 46 THR H 4.91
&rst
ixpk= 0, nxpk= 0, iat= 687, 699, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41, &end
#
# 52 LYS H 52 LYS QB 3.38
&rst
ixpk= 0, nxpk= 0, iat= 801, -1, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,
igr2= 805, 806,
&end
#
# 85 PRO HB2 86 ILE H 3.71
&rst
ixpk= 0, nxpk= 0, iat=1318,1325, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21, &end
#
# 75 THR HA 75 THR QG2 3.32
&rst
ixpk= 0, nxpk= 0, iat=1161, -1, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,
igr2=1165,1166,1167,
&end
#
# 81 LEU H 85 PRO HB3 5.50
&rst
ixpk= 0, nxpk= 0, iat=1244,1319, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 79 PRO HA 85 PRO HB3 5.50
&rst
ixpk= 0, nxpk= 0, iat=1224,1319, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 30 VAL H 30 VAL HB 3.81
&rst
ixpk= 0, nxpk= 0, iat= 462, 466, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31, &end
#
# 40 LEU H 41 PRO HA 5.30
&rst
ixpk= 0, nxpk= 0, iat= 601, 630, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80, &end
#
# 40 LEU QQD 41 PRO HA 4.67
&rst
ixpk= 0, nxpk= 0, iat= -1, 630, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
igr1= 610, 611, 612, 614, 615, 616,
&end
#
# 76 SER QB 77 VAL H 3.91
&rst
ixpk= 0, nxpk= 0, iat= -1,1184, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,
igr1=1177,1178,
&end
#
# 73 TYR QD 76 SER QB 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
igr1=1125,1134,
igr2=1177,1178,
&end
#
# 35 VAL HB 36 ILE H 4.13
&rst
ixpk= 0, nxpk= 0, iat= 533, 545, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63, &end
#
# 35 VAL H 35 VAL HB 3.56
&rst
ixpk= 0, nxpk= 0, iat= 529, 533, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06, &end
#
# 35 VAL HB 57 ALA QB 4.62
&rst
ixpk= 0, nxpk= 0, iat= 533, -1, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,
igr2= 887, 888, 889,
&end
#
# 32 GLU HA 35 VAL HB 4.15
&rst
ixpk= 0, nxpk= 0, iat= 494, 533, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65, &end
#
# 71 VAL H 71 VAL HB 3.65
&rst
ixpk= 0, nxpk= 0, iat=1087,1091, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15, &end
#
# 71 VAL HB 75 THR H 5.50
&rst
ixpk= 0, nxpk= 0, iat=1091,1159, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 117 VAL HB 119 SER QB 5.50
&rst
ixpk= 0, nxpk= 0, iat=1806, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2=1839,1840,
&end
#
# 13 SER QB 14 ALA QB 4.74
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.39, r4= 6.89,
igr1= 192, 193,
igr2= 203, 204, 205,
&end
#
# 31 THR H 34 GLU HB3 5.13
&rst
ixpk= 0, nxpk= 0, iat= 478, 519, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63, &end
#
# 84 GLN H 84 GLN HB3 3.74
&rst
ixpk= 0, nxpk= 0, iat=1294,1299, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24, &end
#
# 81 LEU H 84 GLN HB2 4.87
&rst
ixpk= 0, nxpk= 0, iat=1244,1298, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37, &end
#
# 84 GLN H 84 GLN HB2 3.74
&rst
ixpk= 0, nxpk= 0, iat=1294,1298, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24, &end
#
# 4 SER QB 5 LYS QB 5.32
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.70, r4= 7.20,
igr1= 41, 42,
igr2= 52, 53,
&end
#
# 4 SER QB 5 LYS QD 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
igr1= 41, 42,
igr2= 58, 59,
&end
#
# 31 THR H 34 GLU HB2 5.13
&rst
ixpk= 0, nxpk= 0, iat= 478, 518, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63, &end
#
# 106 ARG QB 107 ALA H 4.81
&rst
ixpk= 0, nxpk= 0, iat= -1,1668, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr1=1648,1649,
&end
#
# 40 LEU H 41 PRO HB3 5.50
&rst
ixpk= 0, nxpk= 0, iat= 601, 628, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 41 PRO HB2 42 PHE QD 4.83
&rst
ixpk= 0, nxpk= 0, iat= 627, -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr2= 642, 650,
&end
#
# 40 LEU H 41 PRO HB2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 601, 627, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 41 PRO HB2 42 PHE QE 5.50
&rst
ixpk= 0, nxpk= 0, iat= 627, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 644, 648,
&end
#
# 106 ARG HA 106 ARG QB 2.83
&rst
ixpk= 0, nxpk= 0, iat=1646, -1, r1= 1.30, r2= 1.80, r3= 3.18, r4= 3.68,
igr2=1648,1649,
&end
#
# 79 PRO HB3 80 VAL H 4.57
&rst
ixpk= 0, nxpk= 0, iat=1222,1228, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07, &end
#
# 113 ALA QB 114 VAL HA 3.95
&rst
ixpk= 0, nxpk= 0, iat= -1,1763, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr1=1755,1756,1757,
&end
#
# 114 VAL HA 114 VAL QG1 3.55
&rst
ixpk= 0, nxpk= 0, iat=1763, -1, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,
igr2=1767,1768,1769,
&end
#
# 36 ILE QD1 114 VAL HA 5.36
&rst
ixpk= 0, nxpk= 0, iat= -1,1763, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,
igr1= 558, 559, 560,
&end
#
# 28 ILE HA 28 ILE QG2 3.24
&rst
ixpk= 0, nxpk= 0, iat= 433, -1, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,
igr2= 437, 438, 439,
&end
#
# 37 SER QB 38 LEU H 4.09
&rst
ixpk= 0, nxpk= 0, iat= -1, 575, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
igr1= 568, 569,
&end
#
# 36 ILE H 37 SER QB 4.77
&rst
ixpk= 0, nxpk= 0, iat= 545, -1, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,
igr2= 568, 569,
&end
#
# 37 SER H 37 SER QB 3.33
&rst
ixpk= 0, nxpk= 0, iat= 564, -1, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24,
igr2= 568, 569,
&end
#
# 37 SER QB 40 LEU QQD 3.81
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
igr1= 568, 569,
igr2= 610, 611, 612, 614, 615, 616,
&end
#
# 44 LYS QD 46 THR HA 5.47
&rst
ixpk= 0, nxpk= 0, iat= -1, 701, r1= 1.30, r2= 1.80, r3= 6.14, r4= 6.64,
igr1= 671, 672,
&end
#
# 80 VAL QG2 85 PRO HA 3.88
&rst
ixpk= 0, nxpk= 0, iat= -1,1321, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
igr1=1238,1239,1240,
&end
#
# 80 VAL QG1 85 PRO HA 3.88
&rst
ixpk= 0, nxpk= 0, iat= -1,1321, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
igr1=1234,1235,1236,
&end
#
# 79 PRO HA 88 ILE QG2 5.50
&rst
ixpk= 0, nxpk= 0, iat=1224, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2=1371,1372,1373,
&end
#
# 79 PRO HA 80 VAL H 3.22
&rst
ixpk= 0, nxpk= 0, iat=1224,1228, r1= 1.30, r2= 1.80, r3= 3.22, r4= 3.72, &end
#
# 64 GLU H 64 GLU HB3 4.17
&rst
ixpk= 0, nxpk= 0, iat= 992, 997, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67, &end
#
# 19 ARG QD 64 GLU HB3 5.25
&rst
ixpk= 0, nxpk= 0, iat= -1, 997, r1= 1.30, r2= 1.80, r3= 5.89, r4= 6.39,
igr1= 267, 268,
&end
#
# 64 GLU H 64 GLU HB2 4.17
&rst
ixpk= 0, nxpk= 0, iat= 992, 996, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67, &end
#
# 63 THR HA 64 GLU HB2 4.79
&rst
ixpk= 0, nxpk= 0, iat= 980, 996, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29, &end
#
# 19 ARG QD 64 GLU HB2 4.98
&rst
ixpk= 0, nxpk= 0, iat= -1, 996, r1= 1.30, r2= 1.80, r3= 5.59, r4= 6.09,
igr1= 267, 268,
&end
#
# 64 GLU HB2 65 GLU H 4.26
&rst
ixpk= 0, nxpk= 0, iat= 996,1007, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76, &end
#
# 27 PRO HA 28 ILE H 3.24
&rst
ixpk= 0, nxpk= 0, iat= 427, 431, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74, &end
#
# 73 TYR HA 74 TYR HA 5.19
&rst
ixpk= 0, nxpk= 0, iat=1119,1140, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69, &end
#
# 64 GLU HB3 68 ASN H 5.50
&rst
ixpk= 0, nxpk= 0, iat= 997,1042, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 65 GLU HB2 68 ASN H 5.50
&rst
ixpk= 0, nxpk= 0, iat=1011,1042, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 27 PRO HA 28 ILE QG2 3.98
&rst
ixpk= 0, nxpk= 0, iat= 427, -1, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
igr2= 437, 438, 439,
&end
#
# 37 SER HA 40 LEU H 4.32
&rst
ixpk= 0, nxpk= 0, iat= 566, 601, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82, &end
#
# 25 LYS QB 87 TYR H 4.26
&rst
ixpk= 0, nxpk= 0, iat= -1,1344, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
igr1= 380, 381,
&end
#
# 65 GLU HB3 68 ASN H 5.50
&rst
ixpk= 0, nxpk= 0, iat=1012,1042, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 65 GLU HB3 66 ALA H 4.10
&rst
ixpk= 0, nxpk= 0, iat=1012,1022, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60, &end
#
# 65 GLU HB2 66 ALA H 4.10
&rst
ixpk= 0, nxpk= 0, iat=1011,1022, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60, &end
#
# 52 LYS H 52 LYS QD 4.44
&rst
ixpk= 0, nxpk= 0, iat= 801, -1, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
igr2= 811, 812,
&end
#
# 52 LYS HA 52 LYS QD 3.37
&rst
ixpk= 0, nxpk= 0, iat= 803, -1, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,
igr2= 811, 812,
&end
#
# 28 ILE HA 52 LYS QD 4.28
&rst
ixpk= 0, nxpk= 0, iat= 433, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2= 811, 812,
&end
#
# 52 LYS QD 52 LYS QE 2.45
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.09, r4= 3.59,
igr1= 811, 812,
igr2= 814, 815,
&end
#
# 44 LYS HA 44 LYS QD 3.40
&rst
ixpk= 0, nxpk= 0, iat= 663, -1, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,
igr2= 671, 672,
&end
#
# 5 LYS H 5 LYS QD 4.62
&rst
ixpk= 0, nxpk= 0, iat= 48, -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
igr2= 58, 59,
&end
#
# 8 LYS QD 9 GLY H 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 134, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 122, 123,
&end
#
# 44 LYS H 44 LYS QD 4.64
&rst
ixpk= 0, nxpk= 0, iat= 661, -1, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,
igr2= 671, 672,
&end
#
# 5 LYS HA 5 LYS QD 3.38
&rst
ixpk= 0, nxpk= 0, iat= 50, -1, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,
igr2= 58, 59,
&end
#
# 108 GLN QB 109 ALA H 3.67
&rst
ixpk= 0, nxpk= 0, iat= -1,1695, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
igr1=1682,1683,
&end
#
# 112 GLN H 112 GLN QB 3.89
&rst
ixpk= 0, nxpk= 0, iat=1734, -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
igr2=1738,1739,
&end
#
# 112 GLN QB 113 ALA H 4.71
&rst
ixpk= 0, nxpk= 0, iat= -1,1751, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,
igr1=1738,1739,
&end
#
# 112 GLN HA 112 GLN QB 2.59
&rst
ixpk= 0, nxpk= 0, iat=1736, -1, r1= 1.30, r2= 1.80, r3= 2.91, r4= 3.41,
igr2=1738,1739,
&end
#
# 108 GLN H 108 GLN QB 3.98
&rst
ixpk= 0, nxpk= 0, iat=1678, -1, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
igr2=1682,1683,
&end
#
# 19 ARG H 19 ARG QG 4.41
&rst
ixpk= 0, nxpk= 0, iat= 257, -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr2= 264, 265,
&end
#
# 32 GLU HA 110 ALA QB 4.74
&rst
ixpk= 0, nxpk= 0, iat= 494, -1, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
igr2=1709,1710,1711,
&end
#
# 19 ARG QG 63 THR HA 5.19
&rst
ixpk= 0, nxpk= 0, iat= -1, 980, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33,
igr1= 264, 265,
&end
#
# 20 VAL HA 59 ILE HB 5.50
&rst
ixpk= 0, nxpk= 0, iat= 283, 917, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 31 THR QG2 32 GLU HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 494, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 484, 485, 486,
&end
#
# 28 ILE HG13 29 ASP H 4.03
&rst
ixpk= 0, nxpk= 0, iat= 442, 450, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53, &end
#
# 28 ILE HG12 29 ASP H 4.03
&rst
ixpk= 0, nxpk= 0, iat= 441, 450, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53, &end
#
# 28 ILE HA 28 ILE HG12 3.75
&rst
ixpk= 0, nxpk= 0, iat= 433, 441, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25, &end
#
# 21 ILE H 21 ILE HG12 5.17
&rst
ixpk= 0, nxpk= 0, iat= 297, 307, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67, &end
#
# 21 ILE HG12 90 PHE QD 4.66
&rst
ixpk= 0, nxpk= 0, iat= 307, -1, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73,
igr2=1409,1417,
&end
#
# 21 ILE H 21 ILE HG13 4.35
&rst
ixpk= 0, nxpk= 0, iat= 297, 308, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85, &end
#
# 21 ILE HG13 91 SER H 5.18
&rst
ixpk= 0, nxpk= 0, iat= 308,1421, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68, &end
#
# 21 ILE HG13 67 ALA HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= 308,1034, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 79 PRO HD3 86 ILE HG12 5.50
&rst
ixpk= 0, nxpk= 0, iat=1216,1335, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 21 ILE HG13 22 HIS H 5.24
&rst
ixpk= 0, nxpk= 0, iat= 308, 316, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74, &end
#
# 106 ARG HA 106 ARG HG3 3.66
&rst
ixpk= 0, nxpk= 0, iat=1646,1652, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16, &end
#
# 21 ILE HG12 88 ILE QD1 4.36
&rst
ixpk= 0, nxpk= 0, iat= 307, -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr2=1378,1379,1380,
&end
#
# 88 ILE H 88 ILE HG13 4.98
&rst
ixpk= 0, nxpk= 0, iat=1365,1376, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48, &end
#
# 74 TYR QD 88 ILE HG13 5.02
&rst
ixpk= 0, nxpk= 0, iat= -1,1376, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr1=1146,1155,
&end
#
# 88 ILE HG13 89 GLN H 4.52
&rst
ixpk= 0, nxpk= 0, iat=1376,1384, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02, &end
#
# 88 ILE HG12 89 GLN H 4.52
&rst
ixpk= 0, nxpk= 0, iat=1375,1384, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02, &end
#
# 88 ILE H 88 ILE HG12 4.98
&rst
ixpk= 0, nxpk= 0, iat=1365,1375, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48, &end
#
# 74 TYR QD 88 ILE HG12 5.02
&rst
ixpk= 0, nxpk= 0, iat= -1,1375, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr1=1146,1155,
&end
#
# 78 THR QG2 85 PRO HG3 4.43
&rst
ixpk= 0, nxpk= 0, iat= -1,1316, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
igr1=1206,1207,1208,
&end
#
# 27 PRO HG2 30 VAL H 4.59
&rst
ixpk= 0, nxpk= 0, iat= 421, 462, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 85 PRO HG2 86 ILE H 5.02
&rst
ixpk= 0, nxpk= 0, iat=1315,1325, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52, &end
#
# 84 GLN HA 85 PRO HG2 4.23
&rst
ixpk= 0, nxpk= 0, iat=1296,1315, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73, &end
#
# 17 PRO HG2 18 SER HA 5.12
&rst
ixpk= 0, nxpk= 0, iat= 236, 248, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, &end
#
# 26 LEU HA 27 PRO HG3 4.61
&rst
ixpk= 0, nxpk= 0, iat= 400, 422, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 48 LEU HA 48 LEU HG 3.99
&rst
ixpk= 0, nxpk= 0, iat= 729, 734, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49, &end
#
# 49 LEU HG 58 PHE H 5.50
&rst
ixpk= 0, nxpk= 0, iat= 753, 893, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 49 LEU HG 50 MET H 4.72
&rst
ixpk= 0, nxpk= 0, iat= 753, 765, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22, &end
#
# 27 PRO HG2 29 ASP H 5.50
&rst
ixpk= 0, nxpk= 0, iat= 421, 450, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 49 LEU H 59 ILE HG12 5.50
&rst
ixpk= 0, nxpk= 0, iat= 746, 923, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 8 LYS HA 17 PRO HG2 3.87
&rst
ixpk= 0, nxpk= 0, iat= 114, 236, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37, &end
#
# 9 GLY H 17 PRO HG2 5.27
&rst
ixpk= 0, nxpk= 0, iat= 134, 236, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77, &end
#
# 8 LYS HA 17 PRO HG3 3.57
&rst
ixpk= 0, nxpk= 0, iat= 114, 237, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07, &end
#
# 59 ILE H 59 ILE HG12 4.13
&rst
ixpk= 0, nxpk= 0, iat= 913, 923, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63, &end
#
# 59 ILE HG12 60 GLU H 5.34
&rst
ixpk= 0, nxpk= 0, iat= 923, 932, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84, &end
#
# 58 PHE HA 59 ILE HG12 5.32
&rst
ixpk= 0, nxpk= 0, iat= 895, 923, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82, &end
#
# 23 ILE QD1 59 ILE HG12 3.65
&rst
ixpk= 0, nxpk= 0, iat= -1, 923, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
igr1= 346, 347, 348,
&end
#
# 65 GLU HA 67 ALA H 4.80
&rst
ixpk= 0, nxpk= 0, iat=1009,1032, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30, &end
#
# 81 LEU H 81 LEU HG 4.74
&rst
ixpk= 0, nxpk= 0, iat=1244,1251, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24, &end
#
# 19 ARG QG 64 GLU HA 3.66
&rst
ixpk= 0, nxpk= 0, iat= -1, 994, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
igr1= 264, 265,
&end
#
# 63 THR HA 64 GLU HA 4.68
&rst
ixpk= 0, nxpk= 0, iat= 980, 994, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18, &end
#
# 111 LEU H 111 LEU HG 4.44
&rst
ixpk= 0, nxpk= 0, iat=1715,1722, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94, &end
#
# 111 LEU HA 111 LEU HG 3.28
&rst
ixpk= 0, nxpk= 0, iat=1717,1722, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78, &end
#
# 96 LEU H 96 LEU HG 4.60
&rst
ixpk= 0, nxpk= 0, iat=1500,1507, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 75 THR QG2 76 SER HA 3.92
&rst
ixpk= 0, nxpk= 0, iat= -1,1175, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
igr1=1165,1166,1167,
&end
#
# 36 ILE HG12 48 LEU QD2 5.77
&rst
ixpk= 0, nxpk= 0, iat= 555, -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
igr2= 740, 741, 742,
&end
#
# 16 VAL HA 17 PRO HG3 4.58
&rst
ixpk= 0, nxpk= 0, iat= 218, 237, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08, &end
#
# 73 TYR H 74 TYR HA 5.17
&rst
ixpk= 0, nxpk= 0, iat=1117,1140, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67, &end
#
# 74 TYR HA 75 THR HA 5.24
&rst
ixpk= 0, nxpk= 0, iat=1140,1161, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74, &end
#
# 38 LEU QD1 39 GLY H 4.64
&rst
ixpk= 0, nxpk= 0, iat= -1, 594, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
igr1= 584, 585, 586,
&end
#
# 73 TYR QE 74 TYR HA 5.21
&rst
ixpk= 0, nxpk= 0, iat= -1,1140, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
igr1=1127,1132,
&end
#
# 20 VAL H 21 ILE HA 5.07
&rst
ixpk= 0, nxpk= 0, iat= 281, 299, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, &end
#
# 70 MET HA 88 ILE QD1 5.50
&rst
ixpk= 0, nxpk= 0, iat=1072, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2=1378,1379,1380,
&end
#
# 79 PRO HG2 86 ILE QD1 4.94
&rst
ixpk= 0, nxpk= 0, iat=1218, -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr2=1338,1339,1340,
&end
#
# 37 SER HA 40 LEU HG 3.60
&rst
ixpk= 0, nxpk= 0, iat= 566, 608, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10, &end
#
# 38 LEU H 38 LEU QD1 3.66
&rst
ixpk= 0, nxpk= 0, iat= 575, -1, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,
igr2= 584, 585, 586,
&end
#
# 38 LEU QD1 74 TYR QE 4.76
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.42, r4= 6.92,
igr1= 584, 585, 586,
igr2=1148,1153,
&end
#
# 26 LEU QD1 57 ALA H 4.95
&rst
ixpk= 0, nxpk= 0, iat= -1, 883, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
igr1= 407, 408, 409,
&end
#
# 26 LEU H 26 LEU QD1 4.45
&rst
ixpk= 0, nxpk= 0, iat= 398, -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr2= 407, 408, 409,
&end
#
# 26 LEU QD1 55 ASN HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 854, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 407, 408, 409,
&end
#
# 26 LEU QD1 27 PRO HD2 4.25
&rst
ixpk= 0, nxpk= 0, iat= -1, 418, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
igr1= 407, 408, 409,
&end
#
# 42 PHE QD 70 MET HA 4.26
&rst
ixpk= 0, nxpk= 0, iat= -1,1072, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
igr1= 642, 650,
&end
#
# 67 ALA HA 70 MET HA 5.50
&rst
ixpk= 0, nxpk= 0, iat=1034,1072, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 21 ILE QD1 70 MET HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1072, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 310, 311, 312,
&end
#
# 39 GLY H 40 LEU HG 5.23
&rst
ixpk= 0, nxpk= 0, iat= 594, 608, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73, &end
#
# 40 LEU H 40 LEU HG 3.73
&rst
ixpk= 0, nxpk= 0, iat= 601, 608, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23, &end
#
# 40 LEU HG 41 PRO HD3 5.00
&rst
ixpk= 0, nxpk= 0, iat= 608, 622, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 40 LEU HA 40 LEU HG 3.87
&rst
ixpk= 0, nxpk= 0, iat= 603, 608, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37, &end
#
# 79 PRO HG3 88 ILE QD1 4.63
&rst
ixpk= 0, nxpk= 0, iat=1219, -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
igr2=1378,1379,1380,
&end
#
# 35 VAL HA 81 LEU QD2 3.92
&rst
ixpk= 0, nxpk= 0, iat= 531, -1, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
igr2=1257,1258,1259,
&end
#
# 117 VAL HB 119 SER HA 5.50
&rst
ixpk= 0, nxpk= 0, iat=1806,1837, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 51 LEU QD1 58 PHE QD 4.20
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr1= 791, 792, 793,
igr2= 901, 909,
&end
#
# 51 LEU QD1 54 LYS QE 4.52
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.09, r4= 6.59,
igr1= 791, 792, 793,
igr2= 843, 844,
&end
#
# 25 LYS H 25 LYS QG 4.18
&rst
ixpk= 0, nxpk= 0, iat= 376, -1, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,
igr2= 383, 384,
&end
#
# 25 LYS QG 87 TYR QE 3.94
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
igr1= 383, 384,
igr2=1354,1359,
&end
#
# 25 LYS HA 25 LYS QG 3.41
&rst
ixpk= 0, nxpk= 0, iat= 378, -1, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,
igr2= 383, 384,
&end
#
# 37 SER H 40 LEU QQD 4.11
&rst
ixpk= 0, nxpk= 0, iat= 564, -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
igr2= 610, 611, 612, 614, 615, 616,
&end
#
# 40 LEU H 40 LEU QQD 3.76
&rst
ixpk= 0, nxpk= 0, iat= 601, -1, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
igr2= 610, 611, 612, 614, 615, 616,
&end
#
# 40 LEU QQD 41 PRO HD3 3.90
&rst
ixpk= 0, nxpk= 0, iat= -1, 622, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr1= 610, 611, 612, 614, 615, 616,
&end
#
# 13 SER HA 14 ALA QB 4.25
&rst
ixpk= 0, nxpk= 0, iat= 190, -1, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
igr2= 203, 204, 205,
&end
#
# 106 ARG HA 109 ALA QB 3.04
&rst
ixpk= 0, nxpk= 0, iat=1646, -1, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15,
igr2=1699,1700,1701,
&end
#
# 52 LYS H 52 LYS HG3 4.16
&rst
ixpk= 0, nxpk= 0, iat= 801, 809, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66, &end
#
# 52 LYS HA 52 LYS HG3 3.71
&rst
ixpk= 0, nxpk= 0, iat= 803, 809, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21, &end
#
# 52 LYS H 52 LYS HG2 4.16
&rst
ixpk= 0, nxpk= 0, iat= 801, 808, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66, &end
#
# 52 LYS HA 52 LYS HG2 3.71
&rst
ixpk= 0, nxpk= 0, iat= 803, 808, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21, &end
#
# 49 LEU QD1 50 MET H 5.28
&rst
ixpk= 0, nxpk= 0, iat= -1, 765, r1= 1.30, r2= 1.80, r3= 6.34, r4= 6.84,
igr1= 755, 756, 757,
&end
#
# 49 LEU HA 49 LEU QD1 4.51
&rst
ixpk= 0, nxpk= 0, iat= 748, -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr2= 755, 756, 757,
&end
#
# 49 LEU QD1 98 THR HB 5.30
&rst
ixpk= 0, nxpk= 0, iat= -1,1545, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
igr1= 755, 756, 757,
&end
#
# 107 ALA QB 108 GLN HA 4.04
&rst
ixpk= 0, nxpk= 0, iat= -1,1680, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
igr1=1672,1673,1674,
&end
#
# 108 GLN HA 111 LEU H 5.00
&rst
ixpk= 0, nxpk= 0, iat=1680,1715, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 19 ARG HA 67 ALA H 5.19
&rst
ixpk= 0, nxpk= 0, iat= 259,1032, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69, &end
#
# 44 LYS H 44 LYS HG3 4.68
&rst
ixpk= 0, nxpk= 0, iat= 661, 669, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18, &end
#
# 44 LYS HG3 62 ASN HB3 3.93
&rst
ixpk= 0, nxpk= 0, iat= 669, 969, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43, &end
#
# 44 LYS HA 44 LYS HG2 4.10
&rst
ixpk= 0, nxpk= 0, iat= 663, 668, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60, &end
#
# 44 LYS H 44 LYS HG2 4.68
&rst
ixpk= 0, nxpk= 0, iat= 661, 668, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18, &end
#
# 19 ARG HA 19 ARG QG 3.69
&rst
ixpk= 0, nxpk= 0, iat= 259, -1, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,
igr2= 264, 265,
&end
#
# 54 LYS H 54 LYS QG 4.70
&rst
ixpk= 0, nxpk= 0, iat= 830, -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
igr2= 837, 838,
&end
#
# 54 LYS QG 56 GLN H 5.16
&rst
ixpk= 0, nxpk= 0, iat= -1, 866, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,
igr1= 837, 838,
&end
#
# 26 LEU QD2 57 ALA H 4.95
&rst
ixpk= 0, nxpk= 0, iat= -1, 883, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
igr1= 411, 412, 413,
&end
#
# 26 LEU H 26 LEU QD2 4.45
&rst
ixpk= 0, nxpk= 0, iat= 398, -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr2= 411, 412, 413,
&end
#
# 26 LEU HA 26 LEU QD2 4.01
&rst
ixpk= 0, nxpk= 0, iat= 400, -1, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
igr2= 411, 412, 413,
&end
#
# 26 LEU QD2 27 PRO HD2 4.25
&rst
ixpk= 0, nxpk= 0, iat= -1, 418, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
igr1= 411, 412, 413,
&end
#
# 26 LEU QD2 50 MET QE 4.13
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
igr1= 411, 412, 413,
igr2= 776, 777, 778,
&end
#
# 8 LYS QG 9 GLY QA 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
igr1= 119, 120,
igr2= 136, 137,
&end
#
# 96 LEU H 96 LEU QD2 4.45
&rst
ixpk= 0, nxpk= 0, iat=1500, -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr2=1513,1514,1515,
&end
#
# 60 GLU HB2 96 LEU QD2 4.29
&rst
ixpk= 0, nxpk= 0, iat= 936, -1, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
igr2=1513,1514,1515,
&end
#
# 49 LEU H 96 LEU QD2 4.68
&rst
ixpk= 0, nxpk= 0, iat= 746, -1, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
igr2=1513,1514,1515,
&end
#
# 58 PHE HA 96 LEU QD2 4.66
&rst
ixpk= 0, nxpk= 0, iat= 895, -1, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
igr2=1513,1514,1515,
&end
#
# 95 GLU HA 96 LEU QD2 5.50
&rst
ixpk= 0, nxpk= 0, iat=1487, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2=1513,1514,1515,
&end
#
# 47 ASN HB3 96 LEU QD2 4.21
&rst
ixpk= 0, nxpk= 0, iat= 718, -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
igr2=1513,1514,1515,
&end
#
# 58 PHE HB2 96 LEU QD2 5.22
&rst
ixpk= 0, nxpk= 0, iat= 897, -1, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
igr2=1513,1514,1515,
&end
#
# 60 GLU HB3 96 LEU QD2 5.03
&rst
ixpk= 0, nxpk= 0, iat= 937, -1, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54,
igr2=1513,1514,1515,
&end
#
# 57 ALA H 57 ALA QB 3.67
&rst
ixpk= 0, nxpk= 0, iat= 883, -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
igr2= 887, 888, 889,
&end
#
# 51 LEU H 57 ALA QB 3.93
&rst
ixpk= 0, nxpk= 0, iat= 782, -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
igr2= 887, 888, 889,
&end
#
# 57 ALA QB 58 PHE QD 4.96
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.69, r4= 7.19,
igr1= 887, 888, 889,
igr2= 901, 909,
&end
#
# 57 ALA QB 58 PHE HA 4.53
&rst
ixpk= 0, nxpk= 0, iat= -1, 895, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
igr1= 887, 888, 889,
&end
#
# 87 TYR HA 88 ILE HB 4.95
&rst
ixpk= 0, nxpk= 0, iat=1346,1369, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45, &end
#
# 104 GLN HA 107 ALA QB 3.16
&rst
ixpk= 0, nxpk= 0, iat=1619, -1, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,
igr2=1672,1673,1674,
&end
#
# 38 LEU HA 42 PHE QE 5.50
&rst
ixpk= 0, nxpk= 0, iat= 577, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 644, 648,
&end
#
# 35 VAL QG2 36 ILE H 3.89
&rst
ixpk= 0, nxpk= 0, iat= -1, 545, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
igr1= 539, 540, 541,
&end
#
# 35 VAL H 35 VAL QG2 3.90
&rst
ixpk= 0, nxpk= 0, iat= 529, -1, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
igr2= 539, 540, 541,
&end
#
# 32 GLU HA 35 VAL QG2 4.65
&rst
ixpk= 0, nxpk= 0, iat= 494, -1, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr2= 539, 540, 541,
&end
#
# 35 VAL HA 35 VAL QG2 3.21
&rst
ixpk= 0, nxpk= 0, iat= 531, -1, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,
igr2= 539, 540, 541,
&end
#
# 49 LEU H 96 LEU QD1 4.68
&rst
ixpk= 0, nxpk= 0, iat= 746, -1, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
igr2=1509,1510,1511,
&end
#
# 96 LEU H 96 LEU QD1 4.45
&rst
ixpk= 0, nxpk= 0, iat=1500, -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr2=1509,1510,1511,
&end
#
# 47 ASN HB3 96 LEU QD1 4.21
&rst
ixpk= 0, nxpk= 0, iat= 718, -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
igr2=1509,1510,1511,
&end
#
# 58 PHE HB2 96 LEU QD1 5.22
&rst
ixpk= 0, nxpk= 0, iat= 897, -1, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
igr2=1509,1510,1511,
&end
#
# 47 ASN HB2 96 LEU QD1 4.16
&rst
ixpk= 0, nxpk= 0, iat= 717, -1, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,
igr2=1509,1510,1511,
&end
#
# 60 GLU HB2 96 LEU QD1 4.29
&rst
ixpk= 0, nxpk= 0, iat= 936, -1, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
igr2=1509,1510,1511,
&end
#
# 38 LEU HA 38 LEU QD2 4.25
&rst
ixpk= 0, nxpk= 0, iat= 577, -1, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
igr2= 588, 589, 590,
&end
#
# 36 ILE QD1 111 LEU HA 3.27
&rst
ixpk= 0, nxpk= 0, iat= -1,1717, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
igr1= 558, 559, 560,
&end
#
# 111 LEU HA 114 VAL HB 5.04
&rst
ixpk= 0, nxpk= 0, iat=1717,1765, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54, &end
#
# 35 VAL QG2 37 SER H 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 564, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 539, 540, 541,
&end
#
# 82 ARG HA 84 GLN H 4.68
&rst
ixpk= 0, nxpk= 0, iat=1265,1294, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18, &end
#
# 111 LEU HA 111 LEU QD1 4.15
&rst
ixpk= 0, nxpk= 0, iat=1717, -1, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
igr2=1724,1725,1726,
&end
#
# 5 LYS HA 5 LYS QB 2.55
&rst
ixpk= 0, nxpk= 0, iat= 50, -1, r1= 1.30, r2= 1.80, r3= 2.86, r4= 3.36,
igr2= 52, 53,
&end
#
# 24 ARG HA 25 LYS HA 4.59
&rst
ixpk= 0, nxpk= 0, iat= 354, 378, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 71 VAL QG1 90 PHE H 5.11
&rst
ixpk= 0, nxpk= 0, iat= -1,1401, r1= 1.30, r2= 1.80, r3= 6.14, r4= 6.64,
igr1=1093,1094,1095,
&end
#
# 71 VAL H 71 VAL QG1 3.51
&rst
ixpk= 0, nxpk= 0, iat=1087, -1, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
igr2=1093,1094,1095,
&end
#
# 71 VAL QG1 90 PHE QE 3.83
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
igr1=1093,1094,1095,
igr2=1411,1415,
&end
#
# 71 VAL HA 71 VAL QG1 3.39
&rst
ixpk= 0, nxpk= 0, iat=1089, -1, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,
igr2=1093,1094,1095,
&end
#
# 51 LEU QD2 58 PHE QD 4.20
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr1= 795, 796, 797,
igr2= 901, 909,
&end
#
# 30 VAL QG2 31 THR H 4.12
&rst
ixpk= 0, nxpk= 0, iat= -1, 478, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr1= 472, 473, 474,
&end
#
# 30 VAL H 30 VAL QG2 3.72
&rst
ixpk= 0, nxpk= 0, iat= 462, -1, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
igr2= 472, 473, 474,
&end
#
# 118 GLN HA 118 GLN QG 3.34
&rst
ixpk= 0, nxpk= 0, iat=1820, -1, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,
igr2=1825,1826,
&end
#
# 46 THR QG2 62 ASN HD22 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 973, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 705, 706, 707,
&end
#
# 46 THR QG2 62 ASN H 4.15
&rst
ixpk= 0, nxpk= 0, iat= -1, 964, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
igr1= 705, 706, 707,
&end
#
# 46 THR QG2 61 MET HA 4.25
&rst
ixpk= 0, nxpk= 0, iat= -1, 949, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
igr1= 705, 706, 707,
&end
#
# 46 THR QG2 62 ASN HB2 3.02
&rst
ixpk= 0, nxpk= 0, iat= -1, 968, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13,
igr1= 705, 706, 707,
&end
#
# 35 VAL QG1 36 ILE H 3.89
&rst
ixpk= 0, nxpk= 0, iat= -1, 545, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
igr1= 535, 536, 537,
&end
#
# 35 VAL QG1 37 SER H 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 564, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 535, 536, 537,
&end
#
# 35 VAL H 35 VAL QG1 3.90
&rst
ixpk= 0, nxpk= 0, iat= 529, -1, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
igr2= 535, 536, 537,
&end
#
# 32 GLU HA 35 VAL QG1 4.65
&rst
ixpk= 0, nxpk= 0, iat= 494, -1, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr2= 535, 536, 537,
&end
#
# 35 VAL HA 35 VAL QG1 3.21
&rst
ixpk= 0, nxpk= 0, iat= 531, -1, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,
igr2= 535, 536, 537,
&end
#
# 58 PHE HA 59 ILE QG2 4.89
&rst
ixpk= 0, nxpk= 0, iat= 895, -1, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,
igr2= 919, 920, 921,
&end
#
# 58 PHE HA 59 ILE HG13 5.30
&rst
ixpk= 0, nxpk= 0, iat= 895, 924, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80, &end
#
# 46 THR H 46 THR QG2 3.14
&rst
ixpk= 0, nxpk= 0, iat= 699, -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
igr2= 705, 706, 707,
&end
#
# 69 THR H 69 THR QG2 3.81
&rst
ixpk= 0, nxpk= 0, iat=1056, -1, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
igr2=1062,1063,1064,
&end
#
# 69 THR QG2 73 TYR H 4.02
&rst
ixpk= 0, nxpk= 0, iat= -1,1117, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
igr1=1062,1063,1064,
&end
#
# 69 THR QG2 70 MET H 3.65
&rst
ixpk= 0, nxpk= 0, iat= -1,1070, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
igr1=1062,1063,1064,
&end
#
# 42 PHE QD 69 THR QG2 2.85
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
igr1= 642, 650,
igr2=1062,1063,1064,
&end
#
# 42 PHE QE 69 THR QG2 3.17
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,
igr1= 644, 648,
igr2=1062,1063,1064,
&end
#
# 69 THR QG2 73 TYR QD 4.97
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.70, r4= 7.20,
igr1=1062,1063,1064,
igr2=1125,1134,
&end
#
# 69 THR HA 69 THR QG2 2.64
&rst
ixpk= 0, nxpk= 0, iat=1058, -1, r1= 1.30, r2= 1.80, r3= 3.17, r4= 3.67,
igr2=1062,1063,1064,
&end
#
# 42 PHE HB3 69 THR QG2 4.18
&rst
ixpk= 0, nxpk= 0, iat= 639, -1, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
igr2=1062,1063,1064,
&end
#
# 66 ALA HA 70 MET H 4.73
&rst
ixpk= 0, nxpk= 0, iat=1024,1070, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, &end
#
# 63 THR H 66 ALA HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= 978,1024, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 45 VAL H 45 VAL QG1 3.94
&rst
ixpk= 0, nxpk= 0, iat= 683, -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
igr2= 689, 690, 691,
&end
#
# 38 LEU QD2 39 GLY H 4.64
&rst
ixpk= 0, nxpk= 0, iat= -1, 594, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
igr1= 588, 589, 590,
&end
#
# 20 VAL QG1 58 PHE QD 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr1= 287, 288, 289,
igr2= 901, 909,
&end
#
# 20 VAL HA 20 VAL QG1 3.63
&rst
ixpk= 0, nxpk= 0, iat= 283, -1, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,
igr2= 287, 288, 289,
&end
#
# 44 LYS HA 45 VAL HB 5.12
&rst
ixpk= 0, nxpk= 0, iat= 663, 687, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, &end
#
# 40 LEU QQD 44 LYS HA 4.66
&rst
ixpk= 0, nxpk= 0, iat= -1, 663, r1= 1.30, r2= 1.80, r3= 6.28, r4= 6.78,
igr1= 610, 611, 612, 614, 615, 616,
&end
#
# 63 THR QG2 64 GLU H 4.28
&rst
ixpk= 0, nxpk= 0, iat= -1, 992, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
igr1= 984, 985, 986,
&end
#
# 63 THR QG2 65 GLU H 4.86
&rst
ixpk= 0, nxpk= 0, iat= -1,1007, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
igr1= 984, 985, 986,
&end
#
# 63 THR QG2 66 ALA H 4.24
&rst
ixpk= 0, nxpk= 0, iat= -1,1022, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
igr1= 984, 985, 986,
&end
#
# 63 THR H 63 THR QG2 3.11
&rst
ixpk= 0, nxpk= 0, iat= 978, -1, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23,
igr2= 984, 985, 986,
&end
#
# 19 ARG QD 63 THR QG2 4.66
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.28, r4= 6.78,
igr1= 267, 268,
igr2= 984, 985, 986,
&end
#
# 62 ASN HB3 63 THR QG2 3.71
&rst
ixpk= 0, nxpk= 0, iat= 969, -1, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
igr2= 984, 985, 986,
&end
#
# 62 ASN HB2 63 THR QG2 4.29
&rst
ixpk= 0, nxpk= 0, iat= 968, -1, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
igr2= 984, 985, 986,
&end
#
# 95 GLU HA 96 LEU QD1 5.50
&rst
ixpk= 0, nxpk= 0, iat=1487, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2=1509,1510,1511,
&end
#
# 32 GLU HG3 107 ALA HA 4.40
&rst
ixpk= 0, nxpk= 0, iat= 500,1670, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 31 THR QG2 32 GLU H 3.78
&rst
ixpk= 0, nxpk= 0, iat= -1, 492, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
igr1= 484, 485, 486,
&end
#
# 31 THR QG2 33 GLY H 4.42
&rst
ixpk= 0, nxpk= 0, iat= -1, 507, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
igr1= 484, 485, 486,
&end
#
# 31 THR H 31 THR QG2 3.05
&rst
ixpk= 0, nxpk= 0, iat= 478, -1, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,
igr2= 484, 485, 486,
&end
#
# 31 THR QG2 34 GLU H 4.81
&rst
ixpk= 0, nxpk= 0, iat= -1, 514, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr1= 484, 485, 486,
&end
#
# 21 ILE HB 60 GLU HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= 301, 934, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 60 GLU HA 61 MET QE 5.50
&rst
ixpk= 0, nxpk= 0, iat= 934, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2= 958, 959, 960,
&end
#
# 49 LEU HA 49 LEU QD2 4.51
&rst
ixpk= 0, nxpk= 0, iat= 748, -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr2= 759, 760, 761,
&end
#
# 26 LEU QB 55 ASN HA 4.43
&rst
ixpk= 0, nxpk= 0, iat= -1, 854, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
igr1= 402, 403,
&end
#
# 114 VAL H 114 VAL QG1 3.69
&rst
ixpk= 0, nxpk= 0, iat=1761, -1, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
igr2=1767,1768,1769,
&end
#
# 111 LEU HA 114 VAL QG1 3.01
&rst
ixpk= 0, nxpk= 0, iat=1717, -1, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11,
igr2=1767,1768,1769,
&end
#
# 72 ASN H 75 THR QG2 4.73
&rst
ixpk= 0, nxpk= 0, iat=1103, -1, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
igr2=1165,1166,1167,
&end
#
# 73 TYR H 75 THR QG2 4.94
&rst
ixpk= 0, nxpk= 0, iat=1117, -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr2=1165,1166,1167,
&end
#
# 74 TYR H 75 THR QG2 4.53
&rst
ixpk= 0, nxpk= 0, iat=1138, -1, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
igr2=1165,1166,1167,
&end
#
# 75 THR H 75 THR QG2 3.10
&rst
ixpk= 0, nxpk= 0, iat=1159, -1, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,
igr2=1165,1166,1167,
&end
#
# 75 THR QG2 76 SER H 4.85
&rst
ixpk= 0, nxpk= 0, iat= -1,1173, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32,
igr1=1165,1166,1167,
&end
#
# 72 ASN HA 75 THR QG2 2.85
&rst
ixpk= 0, nxpk= 0, iat=1105, -1, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92,
igr2=1165,1166,1167,
&end
#
# 71 VAL HA 75 THR QG2 5.00
&rst
ixpk= 0, nxpk= 0, iat=1089, -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr2=1165,1166,1167,
&end
#
# 78 THR H 78 THR QG2 3.72
&rst
ixpk= 0, nxpk= 0, iat=1200, -1, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
igr2=1206,1207,1208,
&end
#
# 78 THR QG2 86 ILE H 3.77
&rst
ixpk= 0, nxpk= 0, iat= -1,1325, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
igr1=1206,1207,1208,
&end
#
# 78 THR QG2 87 TYR QE 4.56
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
igr1=1206,1207,1208,
igr2=1354,1359,
&end
#
# 78 THR QG2 85 PRO HA 3.52
&rst
ixpk= 0, nxpk= 0, iat= -1,1321, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,
igr1=1206,1207,1208,
&end
#
# 78 THR QG2 87 TYR HA 3.80
&rst
ixpk= 0, nxpk= 0, iat= -1,1346, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
igr1=1206,1207,1208,
&end
#
# 78 THR HA 78 THR QG2 2.88
&rst
ixpk= 0, nxpk= 0, iat=1202, -1, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96,
igr2=1206,1207,1208,
&end
#
# 78 THR QG2 79 PRO HD2 3.24
&rst
ixpk= 0, nxpk= 0, iat= -1,1215, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,
igr1=1206,1207,1208,
&end
#
# 36 ILE QD1 110 ALA HA 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1707, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr1= 558, 559, 560,
&end
#
# 24 ARG HA 57 ALA H 4.93
&rst
ixpk= 0, nxpk= 0, iat= 354, 883, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43, &end
#
# 45 VAL H 45 VAL QG2 3.94
&rst
ixpk= 0, nxpk= 0, iat= 683, -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
igr2= 693, 694, 695,
&end
#
# 45 VAL QG2 61 MET HA 4.01
&rst
ixpk= 0, nxpk= 0, iat= -1, 949, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
igr1= 693, 694, 695,
&end
#
# 80 VAL H 80 VAL QG1 3.84
&rst
ixpk= 0, nxpk= 0, iat=1228, -1, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
igr2=1234,1235,1236,
&end
#
# 80 VAL QG1 84 GLN HA 4.44
&rst
ixpk= 0, nxpk= 0, iat= -1,1296, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
igr1=1234,1235,1236,
&end
#
# 80 VAL QG1 85 PRO HD3 4.49
&rst
ixpk= 0, nxpk= 0, iat= -1,1313, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr1=1234,1235,1236,
&end
#
# 80 VAL QG1 83 GLY HA2 4.39
&rst
ixpk= 0, nxpk= 0, iat= -1,1289, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77,
igr1=1234,1235,1236,
&end
#
# 23 ILE QG2 24 ARG HA 4.99
&rst
ixpk= 0, nxpk= 0, iat= -1, 354, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1= 339, 340, 341,
&end
#
# 24 ARG HA 25 LYS QG 4.74
&rst
ixpk= 0, nxpk= 0, iat= 354, -1, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
igr2= 383, 384,
&end
#
# 77 VAL H 77 VAL QG2 3.71
&rst
ixpk= 0, nxpk= 0, iat=1184, -1, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
igr2=1194,1195,1196,
&end
#
# 74 TYR QD 77 VAL QG2 4.37
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.89, r4= 6.39,
igr1=1146,1155,
igr2=1194,1195,1196,
&end
#
# 73 TYR QE 77 VAL QG2 3.05
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
igr1=1127,1132,
igr2=1194,1195,1196,
&end
#
# 73 TYR QD 77 VAL QG2 3.46
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
igr1=1125,1134,
igr2=1194,1195,1196,
&end
#
# 74 TYR HA 77 VAL QG2 3.93
&rst
ixpk= 0, nxpk= 0, iat=1140, -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
igr2=1194,1195,1196,
&end
#
# 77 VAL HA 77 VAL QG2 3.19
&rst
ixpk= 0, nxpk= 0, iat=1186, -1, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,
igr2=1194,1195,1196,
&end
#
# 28 ILE H 30 VAL QG1 5.50
&rst
ixpk= 0, nxpk= 0, iat= 431, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2= 468, 469, 470,
&end
#
# 30 VAL QG1 31 THR H 4.12
&rst
ixpk= 0, nxpk= 0, iat= -1, 478, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr1= 468, 469, 470,
&end
#
# 30 VAL H 30 VAL QG1 3.72
&rst
ixpk= 0, nxpk= 0, iat= 462, -1, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
igr2= 468, 469, 470,
&end
#
# 30 VAL HA 30 VAL QG1 3.17
&rst
ixpk= 0, nxpk= 0, iat= 464, -1, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,
igr2= 468, 469, 470,
&end
#
# 71 VAL QG2 90 PHE H 5.11
&rst
ixpk= 0, nxpk= 0, iat= -1,1401, r1= 1.30, r2= 1.80, r3= 6.14, r4= 6.64,
igr1=1097,1098,1099,
&end
#
# 71 VAL H 71 VAL QG2 3.51
&rst
ixpk= 0, nxpk= 0, iat=1087, -1, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
igr2=1097,1098,1099,
&end
#
# 71 VAL QG2 90 PHE QE 3.83
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
igr1=1097,1098,1099,
igr2=1411,1415,
&end
#
# 71 VAL HA 71 VAL QG2 3.39
&rst
ixpk= 0, nxpk= 0, iat=1089, -1, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,
igr2=1097,1098,1099,
&end
#
# 112 GLN H 114 VAL QG2 5.50
&rst
ixpk= 0, nxpk= 0, iat=1734, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2=1771,1772,1773,
&end
#
# 114 VAL H 114 VAL QG2 3.69
&rst
ixpk= 0, nxpk= 0, iat=1761, -1, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
igr2=1771,1772,1773,
&end
#
# 111 LEU HA 114 VAL QG2 3.01
&rst
ixpk= 0, nxpk= 0, iat=1717, -1, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11,
igr2=1771,1772,1773,
&end
#
# 117 VAL HA 117 VAL QG2 3.32
&rst
ixpk= 0, nxpk= 0, iat=1804, -1, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,
igr2=1812,1813,1814,
&end
#
# 26 LEU HA 26 LEU QD1 4.01
&rst
ixpk= 0, nxpk= 0, iat= 400, -1, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
igr2= 407, 408, 409,
&end
#
# 26 LEU HA 57 ALA QB 4.86
&rst
ixpk= 0, nxpk= 0, iat= 400, -1, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
igr2= 887, 888, 889,
&end
#
# 26 LEU HA 86 ILE HG12 5.17
&rst
ixpk= 0, nxpk= 0, iat= 400,1335, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67, &end
#
# 77 VAL H 77 VAL QG1 3.71
&rst
ixpk= 0, nxpk= 0, iat=1184, -1, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
igr2=1190,1191,1192,
&end
#
# 73 TYR QE 77 VAL QG1 3.05
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
igr1=1127,1132,
igr2=1190,1191,1192,
&end
#
# 73 TYR QD 77 VAL QG1 3.46
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
igr1=1125,1134,
igr2=1190,1191,1192,
&end
#
# 74 TYR HA 77 VAL QG1 3.93
&rst
ixpk= 0, nxpk= 0, iat=1140, -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
igr2=1190,1191,1192,
&end
#
# 77 VAL HA 77 VAL QG1 3.19
&rst
ixpk= 0, nxpk= 0, iat=1186, -1, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,
igr2=1190,1191,1192,
&end
#
# 80 VAL H 80 VAL QG2 3.84
&rst
ixpk= 0, nxpk= 0, iat=1228, -1, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
igr2=1238,1239,1240,
&end
#
# 80 VAL QG2 85 PRO HD3 4.49
&rst
ixpk= 0, nxpk= 0, iat= -1,1313, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr1=1238,1239,1240,
&end
#
# 80 VAL QG2 83 GLY HA2 4.39
&rst
ixpk= 0, nxpk= 0, iat= -1,1289, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77,
igr1=1238,1239,1240,
&end
#
# 80 VAL QG2 85 PRO HB3 3.95
&rst
ixpk= 0, nxpk= 0, iat= -1,1319, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr1=1238,1239,1240,
&end
#
# 62 ASN H 66 ALA QB 3.87
&rst
ixpk= 0, nxpk= 0, iat= 964, -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
igr2=1026,1027,1028,
&end
#
# 66 ALA QB 69 THR H 5.07
&rst
ixpk= 0, nxpk= 0, iat= -1,1056, r1= 1.30, r2= 1.80, r3= 6.09, r4= 6.59,
igr1=1026,1027,1028,
&end
#
# 66 ALA H 66 ALA QB 2.95
&rst
ixpk= 0, nxpk= 0, iat=1022, -1, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04,
igr2=1026,1027,1028,
&end
#
# 43 GLY H 66 ALA QB 4.38
&rst
ixpk= 0, nxpk= 0, iat= 654, -1, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr2=1026,1027,1028,
&end
#
# 66 ALA QB 67 ALA H 2.90
&rst
ixpk= 0, nxpk= 0, iat= -1,1032, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98,
igr1=1026,1027,1028,
&end
#
# 63 THR H 66 ALA QB 3.06
&rst
ixpk= 0, nxpk= 0, iat= 978, -1, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,
igr2=1026,1027,1028,
&end
#
# 67 ALA QB 68 ASN H 3.28
&rst
ixpk= 0, nxpk= 0, iat= -1,1042, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,
igr1=1036,1037,1038,
&end
#
# 67 ALA QB 70 MET H 5.03
&rst
ixpk= 0, nxpk= 0, iat= -1,1070, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54,
igr1=1036,1037,1038,
&end
#
# 67 ALA H 67 ALA QB 2.66
&rst
ixpk= 0, nxpk= 0, iat=1032, -1, r1= 1.30, r2= 1.80, r3= 3.19, r4= 3.69,
igr2=1036,1037,1038,
&end
#
# 61 MET HA 67 ALA QB 5.30
&rst
ixpk= 0, nxpk= 0, iat= 949, -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
igr2=1036,1037,1038,
&end
#
# 19 ARG HA 67 ALA QB 3.06
&rst
ixpk= 0, nxpk= 0, iat= 259, -1, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,
igr2=1036,1037,1038,
&end
#
# 64 GLU HA 67 ALA QB 3.22
&rst
ixpk= 0, nxpk= 0, iat= 994, -1, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,
igr2=1036,1037,1038,
&end
#
# 67 ALA QB 68 ASN HB2 4.79
&rst
ixpk= 0, nxpk= 0, iat= -1,1046, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
igr1=1036,1037,1038,
&end
#
# 14 ALA QB 15 GLY H 4.79
&rst
ixpk= 0, nxpk= 0, iat= -1, 209, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
igr1= 203, 204, 205,
&end
#
# 14 ALA QB 90 PHE QE 4.80
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.47, r4= 6.97,
igr1= 203, 204, 205,
igr2=1411,1415,
&end
#
# 47 ASN HA 48 LEU H 3.32
&rst
ixpk= 0, nxpk= 0, iat= 715, 727, r1= 1.30, r2= 1.80, r3= 3.32, r4= 3.82, &end
#
# 47 ASN HA 60 GLU HB3 5.28
&rst
ixpk= 0, nxpk= 0, iat= 715, 937, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 23 ILE QG2 26 LEU H 4.27
&rst
ixpk= 0, nxpk= 0, iat= -1, 398, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
igr1= 339, 340, 341,
&end
#
# 23 ILE QG2 87 TYR H 4.40
&rst
ixpk= 0, nxpk= 0, iat= -1,1344, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
igr1= 339, 340, 341,
&end
#
# 23 ILE HA 23 ILE QG2 3.74
&rst
ixpk= 0, nxpk= 0, iat= 335, -1, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
igr2= 339, 340, 341,
&end
#
# 23 ILE QG2 88 ILE HA 4.31
&rst
ixpk= 0, nxpk= 0, iat= -1,1367, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
igr1= 339, 340, 341,
&end
#
# 23 ILE QG2 26 LEU HA 4.19
&rst
ixpk= 0, nxpk= 0, iat= -1, 400, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
igr1= 339, 340, 341,
&end
#
# 23 ILE QG2 27 PRO HD3 5.09
&rst
ixpk= 0, nxpk= 0, iat= -1, 419, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
igr1= 339, 340, 341,
&end
#
# 23 ILE QG2 87 TYR HB3 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1349, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 339, 340, 341,
&end
#
# 23 ILE QG2 87 TYR HB2 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1348, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 339, 340, 341,
&end
#
# 23 ILE QG2 70 MET QE 5.15
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.43, r4= 7.93,
igr1= 339, 340, 341,
igr2=1081,1082,1083,
&end
#
# 23 ILE QG2 27 PRO HD2 5.21
&rst
ixpk= 0, nxpk= 0, iat= -1, 418, r1= 1.30, r2= 1.80, r3= 6.26, r4= 6.76,
igr1= 339, 340, 341,
&end
#
# 84 GLN HA 85 PRO HD3 3.01
&rst
ixpk= 0, nxpk= 0, iat=1296,1313, r1= 1.30, r2= 1.80, r3= 3.01, r4= 3.51, &end
#
# 84 GLN HA 85 PRO HD2 3.02
&rst
ixpk= 0, nxpk= 0, iat=1296,1312, r1= 1.30, r2= 1.80, r3= 3.02, r4= 3.52, &end
#
# 84 GLN HA 85 PRO HB2 5.50
&rst
ixpk= 0, nxpk= 0, iat=1296,1318, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 80 VAL QG2 84 GLN HA 4.44
&rst
ixpk= 0, nxpk= 0, iat= -1,1296, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
igr1=1238,1239,1240,
&end
#
# 21 ILE QG2 90 PHE QD 4.68
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.31, r4= 6.81,
igr1= 303, 304, 305,
igr2=1409,1417,
&end
#
# 61 MET HA 62 ASN HA 5.10
&rst
ixpk= 0, nxpk= 0, iat= 949, 966, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, &end
#
# 61 MET HA 61 MET QG 3.78
&rst
ixpk= 0, nxpk= 0, iat= 949, -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
igr2= 954, 955,
&end
#
# 60 GLU HB3 61 MET HA 5.25
&rst
ixpk= 0, nxpk= 0, iat= 937, 949, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75, &end
#
# 45 VAL QG1 61 MET HA 4.01
&rst
ixpk= 0, nxpk= 0, iat= -1, 949, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
igr1= 689, 690, 691,
&end
#
# 61 MET HA 63 THR H 5.04
&rst
ixpk= 0, nxpk= 0, iat= 949, 978, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54, &end
#
# 44 LYS QE 61 MET HA 5.41
&rst
ixpk= 0, nxpk= 0, iat= -1, 949, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
igr1= 674, 675,
&end
#
# 21 ILE H 21 ILE QG2 3.66
&rst
ixpk= 0, nxpk= 0, iat= 297, -1, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,
igr2= 303, 304, 305,
&end
#
# 21 ILE QG2 22 HIS H 3.53
&rst
ixpk= 0, nxpk= 0, iat= -1, 316, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
igr1= 303, 304, 305,
&end
#
# 21 ILE QG2 59 ILE H 4.38
&rst
ixpk= 0, nxpk= 0, iat= -1, 913, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr1= 303, 304, 305,
&end
#
# 21 ILE QG2 89 GLN H 3.62
&rst
ixpk= 0, nxpk= 0, iat= -1,1384, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,
igr1= 303, 304, 305,
&end
#
# 21 ILE QG2 74 TYR QE 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr1= 303, 304, 305,
igr2=1148,1153,
&end
#
# 21 ILE QG2 71 VAL HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1089, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 303, 304, 305,
&end
#
# 45 VAL H 61 MET HA 5.25
&rst
ixpk= 0, nxpk= 0, iat= 683, 949, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75, &end
#
# 113 ALA QB 114 VAL H 3.52
&rst
ixpk= 0, nxpk= 0, iat= -1,1761, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,
igr1=1755,1756,1757,
&end
#
# 32 GLU H 110 ALA QB 4.54
&rst
ixpk= 0, nxpk= 0, iat= 492, -1, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,
igr2=1709,1710,1711,
&end
#
# 33 GLY H 110 ALA QB 4.10
&rst
ixpk= 0, nxpk= 0, iat= 507, -1, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
igr2=1709,1710,1711,
&end
#
# 110 ALA QB 111 LEU H 3.16
&rst
ixpk= 0, nxpk= 0, iat= -1,1715, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,
igr1=1709,1710,1711,
&end
#
# 110 ALA H 110 ALA QB 3.20
&rst
ixpk= 0, nxpk= 0, iat=1705, -1, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
igr2=1709,1710,1711,
&end
#
# 107 ALA HA 110 ALA QB 2.92
&rst
ixpk= 0, nxpk= 0, iat=1670, -1, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01,
igr2=1709,1710,1711,
&end
#
# 33 GLY HA2 110 ALA QB 3.90
&rst
ixpk= 0, nxpk= 0, iat= 509, -1, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
igr2=1709,1710,1711,
&end
#
# 106 ARG QD 107 ALA QB 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr1=1654,1655,
igr2=1672,1673,1674,
&end
#
# 50 MET H 107 ALA QB 5.17
&rst
ixpk= 0, nxpk= 0, iat= 765, -1, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,
igr2=1672,1673,1674,
&end
#
# 107 ALA QB 108 GLN H 3.96
&rst
ixpk= 0, nxpk= 0, iat= -1,1678, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
igr1=1672,1673,1674,
&end
#
# 107 ALA H 107 ALA QB 4.20
&rst
ixpk= 0, nxpk= 0, iat=1668, -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr2=1672,1673,1674,
&end
#
# 48 LEU HA 107 ALA QB 5.08
&rst
ixpk= 0, nxpk= 0, iat= 729, -1, r1= 1.30, r2= 1.80, r3= 6.10, r4= 6.60,
igr2=1672,1673,1674,
&end
#
# 109 ALA QB 110 ALA H 3.46
&rst
ixpk= 0, nxpk= 0, iat= -1,1705, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
igr1=1699,1700,1701,
&end
#
# 113 ALA H 113 ALA QB 3.73
&rst
ixpk= 0, nxpk= 0, iat=1751, -1, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
igr2=1755,1756,1757,
&end
#
# 106 ARG QD 110 ALA QB 4.78
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,
igr1=1654,1655,
igr2=1709,1710,1711,
&end
#
# 109 ALA H 109 ALA QB 3.10
&rst
ixpk= 0, nxpk= 0, iat=1695, -1, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,
igr2=1699,1700,1701,
&end
#
# 41 PRO HD2 42 PHE H 5.03
&rst
ixpk= 0, nxpk= 0, iat= 621, 634, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53, &end
#
# 40 LEU QQD 41 PRO HD2 4.12
&rst
ixpk= 0, nxpk= 0, iat= -1, 621, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,
igr1= 610, 611, 612, 614, 615, 616,
&end
#
# 41 PRO HD2 42 PHE QD 4.78
&rst
ixpk= 0, nxpk= 0, iat= 621, -1, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr2= 642, 650,
&end
#
# 40 LEU H 41 PRO HD2 4.14
&rst
ixpk= 0, nxpk= 0, iat= 601, 621, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64, &end
#
# 39 GLY H 41 PRO HD3 5.49
&rst
ixpk= 0, nxpk= 0, iat= 594, 622, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99, &end
#
# 40 LEU H 41 PRO HD3 4.03
&rst
ixpk= 0, nxpk= 0, iat= 601, 622, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53, &end
#
# 37 SER HA 41 PRO HD3 4.45
&rst
ixpk= 0, nxpk= 0, iat= 566, 622, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95, &end
#
# 81 LEU H 86 ILE QG2 4.04
&rst
ixpk= 0, nxpk= 0, iat=1244, -1, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
igr2=1331,1332,1333,
&end
#
# 26 LEU H 86 ILE QG2 4.37
&rst
ixpk= 0, nxpk= 0, iat= 398, -1, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
igr2=1331,1332,1333,
&end
#
# 86 ILE H 86 ILE QG2 3.08
&rst
ixpk= 0, nxpk= 0, iat=1325, -1, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,
igr2=1331,1332,1333,
&end
#
# 85 PRO HA 86 ILE QG2 4.08
&rst
ixpk= 0, nxpk= 0, iat=1321, -1, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,
igr2=1331,1332,1333,
&end
#
# 26 LEU HA 86 ILE QG2 3.23
&rst
ixpk= 0, nxpk= 0, iat= 400, -1, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,
igr2=1331,1332,1333,
&end
#
# 27 PRO HD3 86 ILE QG2 3.45
&rst
ixpk= 0, nxpk= 0, iat= 419, -1, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,
igr2=1331,1332,1333,
&end
#
# 27 PRO HD2 86 ILE QG2 3.50
&rst
ixpk= 0, nxpk= 0, iat= 418, -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
igr2=1331,1332,1333,
&end
#
# 25 LYS QB 86 ILE QG2 3.53
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
igr1= 380, 381,
igr2=1331,1332,1333,
&end
#
# 70 MET QE 71 VAL H 5.17
&rst
ixpk= 0, nxpk= 0, iat= -1,1087, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,
igr1=1081,1082,1083,
&end
#
# 70 MET QE 74 TYR QD 2.98
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,
igr1=1081,1082,1083,
igr2=1146,1155,
&end
#
# 70 MET QE 74 TYR QE 2.87
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,
igr1=1081,1082,1083,
igr2=1148,1153,
&end
#
# 59 ILE QD1 70 MET QE 2.55
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18,
igr1= 926, 927, 928,
igr2=1081,1082,1083,
&end
#
# 70 MET QE 88 ILE QD1 2.66
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
igr1=1081,1082,1083,
igr2=1378,1379,1380,
&end
#
# 84 GLN H 85 PRO HD3 4.35
&rst
ixpk= 0, nxpk= 0, iat=1294,1313, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85, &end
#
# 84 GLN QG 85 PRO HD3 4.58
&rst
ixpk= 0, nxpk= 0, iat= -1,1313, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
igr1=1301,1302,
&end
#
# 78 THR QG2 85 PRO HD3 5.37
&rst
ixpk= 0, nxpk= 0, iat= -1,1313, r1= 1.30, r2= 1.80, r3= 6.45, r4= 6.95,
igr1=1206,1207,1208,
&end
#
# 78 THR QG2 85 PRO HD2 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1312, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1=1206,1207,1208,
&end
#
# 80 VAL QG1 85 PRO HD2 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1312, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1=1234,1235,1236,
&end
#
# 80 VAL QG2 85 PRO HD2 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1312, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1=1238,1239,1240,
&end
#
# 88 ILE QG2 89 GLN H 4.18
&rst
ixpk= 0, nxpk= 0, iat= -1,1384, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
igr1=1371,1372,1373,
&end
#
# 88 ILE H 88 ILE QG2 3.25
&rst
ixpk= 0, nxpk= 0, iat=1365, -1, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40,
igr2=1371,1372,1373,
&end
#
# 74 TYR H 88 ILE QG2 4.60
&rst
ixpk= 0, nxpk= 0, iat=1138, -1, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
igr2=1371,1372,1373,
&end
#
# 74 TYR QD 88 ILE QG2 3.47
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
igr1=1146,1155,
igr2=1371,1372,1373,
&end
#
# 74 TYR QE 88 ILE QG2 4.61
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,
igr1=1148,1153,
igr2=1371,1372,1373,
&end
#
# 74 TYR HA 88 ILE QG2 4.32
&rst
ixpk= 0, nxpk= 0, iat=1140, -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
igr2=1371,1372,1373,
&end
#
# 74 TYR HB3 88 ILE QG2 3.78
&rst
ixpk= 0, nxpk= 0, iat=1143, -1, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
igr2=1371,1372,1373,
&end
#
# 71 VAL HA 88 ILE QG2 3.86
&rst
ixpk= 0, nxpk= 0, iat=1089, -1, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
igr2=1371,1372,1373,
&end
#
# 74 TYR HB2 88 ILE QG2 3.95
&rst
ixpk= 0, nxpk= 0, iat=1142, -1, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr2=1371,1372,1373,
&end
#
# 84 GLN H 85 PRO HD2 4.80
&rst
ixpk= 0, nxpk= 0, iat=1294,1312, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30, &end
#
# 84 GLN QG 85 PRO HD2 3.84
&rst
ixpk= 0, nxpk= 0, iat= -1,1312, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,
igr1=1301,1302,
&end
#
# 74 TYR HB2 79 PRO HD3 4.99
&rst
ixpk= 0, nxpk= 0, iat=1142,1216, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49, &end
#
# 78 THR QG2 79 PRO HD3 4.01
&rst
ixpk= 0, nxpk= 0, iat= -1,1216, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
igr1=1206,1207,1208,
&end
#
# 9 GLY H 17 PRO HD3 4.83
&rst
ixpk= 0, nxpk= 0, iat= 134, 234, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33, &end
#
# 9 GLY H 17 PRO HD2 4.83
&rst
ixpk= 0, nxpk= 0, iat= 134, 233, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33, &end
#
# 36 ILE QG2 37 SER H 4.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 564, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
igr1= 551, 552, 553,
&end
#
# 36 ILE HA 36 ILE QG2 2.96
&rst
ixpk= 0, nxpk= 0, iat= 547, -1, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05,
igr2= 551, 552, 553,
&end
#
# 26 LEU H 27 PRO HD3 4.96
&rst
ixpk= 0, nxpk= 0, iat= 398, 419, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46, &end
#
# 25 LYS QB 27 PRO HD3 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 419, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 380, 381,
&end
#
# 32 GLU H 50 MET QE 4.37
&rst
ixpk= 0, nxpk= 0, iat= 492, -1, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
igr2= 776, 777, 778,
&end
#
# 35 VAL H 50 MET QE 4.27
&rst
ixpk= 0, nxpk= 0, iat= 529, -1, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
igr2= 776, 777, 778,
&end
#
# 32 GLU HA 50 MET QE 3.21
&rst
ixpk= 0, nxpk= 0, iat= 494, -1, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,
igr2= 776, 777, 778,
&end
#
# 50 MET QE 52 LYS QE 3.13
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
igr1= 776, 777, 778,
igr2= 814, 815,
&end
#
# 26 LEU QD1 50 MET QE 4.13
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
igr1= 407, 408, 409,
igr2= 776, 777, 778,
&end
#
# 31 THR H 50 MET QE 4.50
&rst
ixpk= 0, nxpk= 0, iat= 478, -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr2= 776, 777, 778,
&end
#
# 34 GLU H 50 MET QE 5.04
&rst
ixpk= 0, nxpk= 0, iat= 514, -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
igr2= 776, 777, 778,
&end
#
# 30 VAL H 50 MET QE 4.68
&rst
ixpk= 0, nxpk= 0, iat= 462, -1, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
igr2= 776, 777, 778,
&end
#
# 61 MET H 61 MET QE 4.60
&rst
ixpk= 0, nxpk= 0, iat= 947, -1, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
igr2= 958, 959, 960,
&end
#
# 61 MET QE 67 ALA HA 2.98
&rst
ixpk= 0, nxpk= 0, iat= -1,1034, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08,
igr1= 958, 959, 960,
&end
#
# 21 ILE QD1 61 MET QE 3.79
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,
igr1= 310, 311, 312,
igr2= 958, 959, 960,
&end
#
# 59 ILE QD1 61 MET QE 4.25
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.13, r4= 6.63,
igr1= 926, 927, 928,
igr2= 958, 959, 960,
&end
#
# 81 LEU H 86 ILE QD1 4.01
&rst
ixpk= 0, nxpk= 0, iat=1244, -1, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
igr2=1338,1339,1340,
&end
#
# 86 ILE H 86 ILE QD1 3.23
&rst
ixpk= 0, nxpk= 0, iat=1325, -1, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,
igr2=1338,1339,1340,
&end
#
# 85 PRO HA 86 ILE QD1 4.09
&rst
ixpk= 0, nxpk= 0, iat=1321, -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
igr2=1338,1339,1340,
&end
#
# 86 ILE HA 86 ILE QD1 3.64
&rst
ixpk= 0, nxpk= 0, iat=1327, -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
igr2=1338,1339,1340,
&end
#
# 79 PRO HD2 86 ILE QD1 3.85
&rst
ixpk= 0, nxpk= 0, iat=1215, -1, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
igr2=1338,1339,1340,
&end
#
# 26 LEU HA 86 ILE QD1 4.13
&rst
ixpk= 0, nxpk= 0, iat= 400, -1, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
igr2=1338,1339,1340,
&end
#
# 27 PRO HD3 86 ILE QD1 4.18
&rst
ixpk= 0, nxpk= 0, iat= 419, -1, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
igr2=1338,1339,1340,
&end
#
# 86 ILE HB 86 ILE QD1 3.35
&rst
ixpk= 0, nxpk= 0, iat=1329, -1, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,
igr2=1338,1339,1340,
&end
#
# 81 LEU HG 86 ILE QD1 3.59
&rst
ixpk= 0, nxpk= 0, iat=1251, -1, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,
igr2=1338,1339,1340,
&end
#
# 88 ILE QD1 89 GLN H 4.17
&rst
ixpk= 0, nxpk= 0, iat= -1,1384, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
igr1=1378,1379,1380,
&end
#
# 74 TYR H 88 ILE QD1 4.76
&rst
ixpk= 0, nxpk= 0, iat=1138, -1, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
igr2=1378,1379,1380,
&end
#
# 74 TYR QD 88 ILE QD1 3.23
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,
igr1=1146,1155,
igr2=1378,1379,1380,
&end
#
# 74 TYR QE 88 ILE QD1 3.90
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr1=1148,1153,
igr2=1378,1379,1380,
&end
#
# 74 TYR HA 88 ILE QD1 4.71
&rst
ixpk= 0, nxpk= 0, iat=1140, -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr2=1378,1379,1380,
&end
#
# 79 PRO HD3 88 ILE QD1 4.49
&rst
ixpk= 0, nxpk= 0, iat=1216, -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr2=1378,1379,1380,
&end
#
# 74 TYR HB3 88 ILE QD1 3.51
&rst
ixpk= 0, nxpk= 0, iat=1143, -1, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
igr2=1378,1379,1380,
&end
#
# 71 VAL HA 88 ILE QD1 3.48
&rst
ixpk= 0, nxpk= 0, iat=1089, -1, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
igr2=1378,1379,1380,
&end
#
# 74 TYR HB2 88 ILE QD1 3.75
&rst
ixpk= 0, nxpk= 0, iat=1142, -1, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
igr2=1378,1379,1380,
&end
#
# 23 ILE QD1 70 MET QE 3.45
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
igr1= 346, 347, 348,
igr2=1081,1082,1083,
&end
#
# 27 PRO HD2 86 ILE QD1 4.32
&rst
ixpk= 0, nxpk= 0, iat= 418, -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
igr2=1338,1339,1340,
&end
#
# 59 ILE H 59 ILE QD1 3.96
&rst
ixpk= 0, nxpk= 0, iat= 913, -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
igr2= 926, 927, 928,
&end
#
# 39 GLY H 59 ILE QD1 4.05
&rst
ixpk= 0, nxpk= 0, iat= 594, -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
igr2= 926, 927, 928,
&end
#
# 39 GLY HA3 59 ILE QD1 4.50
&rst
ixpk= 0, nxpk= 0, iat= 597, -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr2= 926, 927, 928,
&end
#
# 23 ILE QD1 58 PHE H 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 893, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 346, 347, 348,
&end
#
# 23 ILE QD1 59 ILE H 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 913, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 346, 347, 348,
&end
#
# 23 ILE QD1 58 PHE HA 5.16
&rst
ixpk= 0, nxpk= 0, iat= -1, 895, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
igr1= 346, 347, 348,
&end
#
# 33 GLY H 36 ILE QD1 4.36
&rst
ixpk= 0, nxpk= 0, iat= 507, -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr2= 558, 559, 560,
&end
#
# 36 ILE H 36 ILE QD1 3.51
&rst
ixpk= 0, nxpk= 0, iat= 545, -1, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
igr2= 558, 559, 560,
&end
#
# 36 ILE QD1 37 SER H 4.51
&rst
ixpk= 0, nxpk= 0, iat= -1, 564, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr1= 558, 559, 560,
&end
#
# 36 ILE QD1 114 VAL H 4.74
&rst
ixpk= 0, nxpk= 0, iat= -1,1761, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
igr1= 558, 559, 560,
&end
#
# 35 VAL H 36 ILE QD1 5.24
&rst
ixpk= 0, nxpk= 0, iat= 529, -1, r1= 1.30, r2= 1.80, r3= 6.29, r4= 6.79,
igr2= 558, 559, 560,
&end
#
# 33 GLY HA2 36 ILE QD1 3.69
&rst
ixpk= 0, nxpk= 0, iat= 509, -1, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
igr2= 558, 559, 560,
&end
#
# 36 ILE HA 36 ILE QD1 4.02
&rst
ixpk= 0, nxpk= 0, iat= 547, -1, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
igr2= 558, 559, 560,
&end
#
# 36 ILE HB 36 ILE QD1 2.89
&rst
ixpk= 0, nxpk= 0, iat= 549, -1, r1= 1.30, r2= 1.80, r3= 3.47, r4= 3.97,
igr2= 558, 559, 560,
&end
#
# 36 ILE QD1 111 LEU HG 3.19
&rst
ixpk= 0, nxpk= 0, iat= -1,1722, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,
igr1= 558, 559, 560,
&end
#
# 33 GLY HA2 37 SER H 5.13
&rst
ixpk= 0, nxpk= 0, iat= 509, 564, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63, &end
#
# 33 GLY HA3 110 ALA QB 4.60
&rst
ixpk= 0, nxpk= 0, iat= 510, -1, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
igr2=1709,1710,1711,
&end
#
# 33 GLY HA3 36 ILE QD1 3.98
&rst
ixpk= 0, nxpk= 0, iat= 510, -1, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
igr2= 558, 559, 560,
&end
#
# 21 ILE H 21 ILE QD1 3.64
&rst
ixpk= 0, nxpk= 0, iat= 297, -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
igr2= 310, 311, 312,
&end
#
# 21 ILE QD1 22 HIS H 4.87
&rst
ixpk= 0, nxpk= 0, iat= -1, 316, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
igr1= 310, 311, 312,
&end
#
# 21 ILE QD1 59 ILE H 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 913, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 310, 311, 312,
&end
#
# 21 ILE QD1 91 SER H 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1421, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 310, 311, 312,
&end
#
# 21 ILE QD1 71 VAL H 3.90
&rst
ixpk= 0, nxpk= 0, iat= -1,1087, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
igr1= 310, 311, 312,
&end
#
# 21 ILE QD1 70 MET H 4.67
&rst
ixpk= 0, nxpk= 0, iat= -1,1070, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr1= 310, 311, 312,
&end
#
# 21 ILE QD1 90 PHE QD 3.32
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
igr1= 310, 311, 312,
igr2=1409,1417,
&end
#
# 21 ILE QD1 67 ALA HA 2.95
&rst
ixpk= 0, nxpk= 0, iat= -1,1034, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04,
igr1= 310, 311, 312,
&end
#
# 21 ILE HB 21 ILE QD1 2.97
&rst
ixpk= 0, nxpk= 0, iat= 301, -1, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07,
igr2= 310, 311, 312,
&end
#
# 21 ILE QD1 67 ALA QB 2.56
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19,
igr1= 310, 311, 312,
igr2=1036,1037,1038,
&end
#
# 81 LEU H 81 LEU HB2 3.96
&rst
ixpk= 0, nxpk= 0, iat=1244,1248, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46, &end
#
# 27 PRO HD3 81 LEU HB2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 419,1248, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 39 GLY HA2 59 ILE QD1 4.50
&rst
ixpk= 0, nxpk= 0, iat= 596, -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr2= 926, 927, 928,
&end
#
# 43 GLY HA3 61 MET QE 4.38
&rst
ixpk= 0, nxpk= 0, iat= 657, -1, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr2= 958, 959, 960,
&end
#
# 83 GLY HA2 84 GLN QG 5.16
&rst
ixpk= 0, nxpk= 0, iat=1289, -1, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,
igr2=1301,1302,
&end
#
# 9 GLY QA 17 PRO HG3 5.42
&rst
ixpk= 0, nxpk= 0, iat= -1, 237, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
igr1= 136, 137,
&end
#
# 21 ILE H 58 PHE HA 4.62
&rst
ixpk= 0, nxpk= 0, iat= 297, 895, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12, &end
#
# 21 ILE H 60 GLU HA 3.91
&rst
ixpk= 0, nxpk= 0, iat= 297, 934, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41, &end
#
# 20 VAL HA 21 ILE H 3.40
&rst
ixpk= 0, nxpk= 0, iat= 283, 297, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90, &end
#
# 21 ILE H 59 ILE HG12 4.40
&rst
ixpk= 0, nxpk= 0, iat= 297, 923, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 21 ILE H 59 ILE HG13 3.24
&rst
ixpk= 0, nxpk= 0, iat= 297, 924, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74, &end
#
# 21 ILE HG12 22 HIS H 4.97
&rst
ixpk= 0, nxpk= 0, iat= 307, 316, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 22 HIS H 58 PHE HA 5.13
&rst
ixpk= 0, nxpk= 0, iat= 316, 895, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63, &end
#
# 21 ILE HA 22 HIS H 3.48
&rst
ixpk= 0, nxpk= 0, iat= 299, 316, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98, &end
#
# 22 HIS H 59 ILE HG13 5.50
&rst
ixpk= 0, nxpk= 0, iat= 316, 924, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 22 HIS H 22 HIS HD2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 316, 329, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 47 ASN HB3 60 GLU H 4.44
&rst
ixpk= 0, nxpk= 0, iat= 718, 932, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94, &end
#
# 48 LEU HA 60 GLU H 4.12
&rst
ixpk= 0, nxpk= 0, iat= 729, 932, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62, &end
#
# 59 ILE HA 60 GLU H 3.18
&rst
ixpk= 0, nxpk= 0, iat= 915, 932, r1= 1.30, r2= 1.80, r3= 3.18, r4= 3.68, &end
#
# 47 ASN HB2 60 GLU H 4.78
&rst
ixpk= 0, nxpk= 0, iat= 717, 932, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, &end
#
# 59 ILE HB 60 GLU H 3.56
&rst
ixpk= 0, nxpk= 0, iat= 917, 932, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06, &end
#
# 59 ILE QG2 60 GLU H 3.69
&rst
ixpk= 0, nxpk= 0, iat= -1, 932, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
igr1= 919, 920, 921,
&end
#
# 50 MET H 51 LEU H 4.54
&rst
ixpk= 0, nxpk= 0, iat= 765, 782, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 49 LEU HA 50 MET H 3.24
&rst
ixpk= 0, nxpk= 0, iat= 748, 765, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74, &end
#
# 50 MET H 107 ALA HA 5.23
&rst
ixpk= 0, nxpk= 0, iat= 765,1670, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73, &end
#
# 49 LEU QD2 50 MET H 5.28
&rst
ixpk= 0, nxpk= 0, iat= -1, 765, r1= 1.30, r2= 1.80, r3= 6.34, r4= 6.84,
igr1= 759, 760, 761,
&end
#
# 45 VAL H 62 ASN HB3 5.37
&rst
ixpk= 0, nxpk= 0, iat= 683, 969, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87, &end
#
# 51 LEU H 56 GLN H 4.63
&rst
ixpk= 0, nxpk= 0, iat= 782, 866, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, &end
#
# 51 LEU H 57 ALA HA 3.75
&rst
ixpk= 0, nxpk= 0, iat= 782, 885, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25, &end
#
# 44 LYS HA 45 VAL H 2.97
&rst
ixpk= 0, nxpk= 0, iat= 663, 683, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 44 LYS QD 45 VAL H 3.91
&rst
ixpk= 0, nxpk= 0, iat= -1, 683, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,
igr1= 671, 672,
&end
#
# 13 SER QB 14 ALA H 4.96
&rst
ixpk= 0, nxpk= 0, iat= -1, 199, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
igr1= 192, 193,
&end
#
# 49 LEU H 59 ILE HA 4.62
&rst
ixpk= 0, nxpk= 0, iat= 746, 915, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12, &end
#
# 48 LEU HA 49 LEU H 3.54
&rst
ixpk= 0, nxpk= 0, iat= 729, 746, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04, &end
#
# 49 LEU H 96 LEU HG 3.99
&rst
ixpk= 0, nxpk= 0, iat= 746,1507, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49, &end
#
# 49 LEU H 59 ILE HB 5.50
&rst
ixpk= 0, nxpk= 0, iat= 746, 917, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 51 LEU HA 52 LYS H 3.10
&rst
ixpk= 0, nxpk= 0, iat= 784, 801, r1= 1.30, r2= 1.80, r3= 3.10, r4= 3.60, &end
#
# 66 ALA H 67 ALA H 3.27
&rst
ixpk= 0, nxpk= 0, iat=1022,1032, r1= 1.30, r2= 1.80, r3= 3.27, r4= 3.77, &end
#
# 63 THR HB 66 ALA H 4.02
&rst
ixpk= 0, nxpk= 0, iat= 982,1022, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52, &end
#
# 64 GLU HA 66 ALA H 4.67
&rst
ixpk= 0, nxpk= 0, iat= 994,1022, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, &end
#
# 66 ALA H 68 ASN QB 4.73
&rst
ixpk= 0, nxpk= 0, iat=1022, -1, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
igr2=1046,1047,
&end
#
# 65 GLU HG3 66 ALA H 4.10
&rst
ixpk= 0, nxpk= 0, iat=1015,1022, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60, &end
#
# 81 LEU H 82 ARG H 4.80
&rst
ixpk= 0, nxpk= 0, iat=1244,1263, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30, &end
#
# 80 VAL HA 81 LEU H 2.83
&rst
ixpk= 0, nxpk= 0, iat=1230,1244, r1= 1.30, r2= 1.80, r3= 2.83, r4= 3.33, &end
#
# 81 LEU H 82 ARG QB 4.97
&rst
ixpk= 0, nxpk= 0, iat=1244, -1, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr2=1267,1268,
&end
#
# 81 LEU H 83 GLY HA2 5.50
&rst
ixpk= 0, nxpk= 0, iat=1244,1289, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 81 LEU H 84 GLN HB3 4.87
&rst
ixpk= 0, nxpk= 0, iat=1244,1299, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37, &end
#
# 81 LEU H 81 LEU HB3 3.96
&rst
ixpk= 0, nxpk= 0, iat=1244,1249, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46, &end
#
# 104 GLN HA 107 ALA H 4.15
&rst
ixpk= 0, nxpk= 0, iat=1619,1668, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65, &end
#
# 69 THR HA 73 TYR H 4.40
&rst
ixpk= 0, nxpk= 0, iat=1058,1117, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 70 MET HA 73 TYR H 4.50
&rst
ixpk= 0, nxpk= 0, iat=1072,1117, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 88 ILE H 88 ILE HB 3.53
&rst
ixpk= 0, nxpk= 0, iat=1365,1369, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03, &end
#
# 71 VAL HA 73 TYR H 4.41
&rst
ixpk= 0, nxpk= 0, iat=1089,1117, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, &end
#
# 74 TYR HA 77 VAL H 3.30
&rst
ixpk= 0, nxpk= 0, iat=1140,1184, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80, &end
#
# 75 THR HA 77 VAL H 4.38
&rst
ixpk= 0, nxpk= 0, iat=1161,1184, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88, &end
#
# 60 GLU HA 61 MET H 3.40
&rst
ixpk= 0, nxpk= 0, iat= 934, 947, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90, &end
#
# 20 VAL HA 61 MET H 3.96
&rst
ixpk= 0, nxpk= 0, iat= 283, 947, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46, &end
#
# 19 ARG HA 61 MET H 4.53
&rst
ixpk= 0, nxpk= 0, iat= 259, 947, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03, &end
#
# 61 MET H 67 ALA HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= 947,1034, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 60 GLU HB3 61 MET H 4.34
&rst
ixpk= 0, nxpk= 0, iat= 937, 947, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84, &end
#
# 67 ALA HA 70 MET H 3.88
&rst
ixpk= 0, nxpk= 0, iat=1034,1070, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38, &end
#
# 68 ASN QB 70 MET H 5.18
&rst
ixpk= 0, nxpk= 0, iat= -1,1070, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
igr1=1046,1047,
&end
#
# 66 ALA QB 70 MET H 5.06
&rst
ixpk= 0, nxpk= 0, iat= -1,1070, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
igr1=1026,1027,1028,
&end
#
# 91 SER QB 92 ASN H 5.24
&rst
ixpk= 0, nxpk= 0, iat= -1,1432, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
igr1=1425,1426,
&end
#
# 87 TYR HA 88 ILE H 2.91
&rst
ixpk= 0, nxpk= 0, iat=1346,1365, r1= 1.30, r2= 1.80, r3= 2.91, r4= 3.41, &end
#
# 23 ILE QG2 88 ILE H 4.71
&rst
ixpk= 0, nxpk= 0, iat= -1,1365, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr1= 339, 340, 341,
&end
#
# 63 THR HA 64 GLU H 2.94
&rst
ixpk= 0, nxpk= 0, iat= 980, 992, r1= 1.30, r2= 1.80, r3= 2.94, r4= 3.44, &end
#
# 64 GLU H 66 ALA H 5.20
&rst
ixpk= 0, nxpk= 0, iat= 992,1022, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70, &end
#
# 95 GLU H 96 LEU H 4.63
&rst
ixpk= 0, nxpk= 0, iat=1485,1500, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, &end
#
# 95 GLU HA 96 LEU H 2.76
&rst
ixpk= 0, nxpk= 0, iat=1487,1500, r1= 1.30, r2= 1.80, r3= 2.76, r4= 3.26, &end
#
# 47 ASN HB3 96 LEU H 4.87
&rst
ixpk= 0, nxpk= 0, iat= 718,1500, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37, &end
#
# 107 ALA QB 109 ALA H 4.64
&rst
ixpk= 0, nxpk= 0, iat= -1,1695, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
igr1=1672,1673,1674,
&end
#
# 64 GLU H 65 GLU HA 5.46
&rst
ixpk= 0, nxpk= 0, iat= 992,1009, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96, &end
#
# 82 ARG H 84 GLN H 4.68
&rst
ixpk= 0, nxpk= 0, iat=1263,1294, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18, &end
#
# 80 VAL HA 84 GLN H 4.68
&rst
ixpk= 0, nxpk= 0, iat=1230,1294, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18, &end
#
# 81 LEU HA 84 GLN H 4.60
&rst
ixpk= 0, nxpk= 0, iat=1246,1294, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 83 GLY HA3 84 GLN H 3.37
&rst
ixpk= 0, nxpk= 0, iat=1290,1294, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87, &end
#
# 83 GLY HA2 84 GLN H 3.38
&rst
ixpk= 0, nxpk= 0, iat=1289,1294, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88, &end
#
# 81 LEU HA 82 ARG H 3.40
&rst
ixpk= 0, nxpk= 0, iat=1246,1263, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90, &end
#
# 82 ARG H 83 GLY HA2 5.02
&rst
ixpk= 0, nxpk= 0, iat=1263,1289, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52, &end
#
# 47 ASN HB3 48 LEU H 3.68
&rst
ixpk= 0, nxpk= 0, iat= 718, 727, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18, &end
#
# 48 LEU H 96 LEU QB 4.75
&rst
ixpk= 0, nxpk= 0, iat= 727, -1, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
igr2=1504,1505,
&end
#
# 48 LEU H 96 LEU HG 5.43
&rst
ixpk= 0, nxpk= 0, iat= 727,1507, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93, &end
#
# 36 ILE QD1 110 ALA H 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1705, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 558, 559, 560,
&end
#
# 36 ILE QD1 113 ALA H 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1751, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 558, 559, 560,
&end
#
# 47 ASN HB2 48 LEU H 4.61
&rst
ixpk= 0, nxpk= 0, iat= 717, 727, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 48 LEU H 60 GLU HB2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 727, 936, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 32 GLU H 36 ILE QD1 5.50
&rst
ixpk= 0, nxpk= 0, iat= 492, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2= 558, 559, 560,
&end
#
# 104 GLN H 105 ALA QB 5.04
&rst
ixpk= 0, nxpk= 0, iat=1617, -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
igr2=1638,1639,1640,
&end
#
# 33 GLY H 34 GLU H 3.79
&rst
ixpk= 0, nxpk= 0, iat= 507, 514, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29, &end
#
# 34 GLU H 35 VAL HB 5.24
&rst
ixpk= 0, nxpk= 0, iat= 514, 533, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74, &end
#
# 34 GLU H 35 VAL HA 5.43
&rst
ixpk= 0, nxpk= 0, iat= 514, 531, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93, &end
#
# 23 ILE QG2 89 GLN H 4.64
&rst
ixpk= 0, nxpk= 0, iat= -1,1384, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
igr1= 339, 340, 341,
&end
#
# 21 ILE HG13 89 GLN H 5.26
&rst
ixpk= 0, nxpk= 0, iat= 308,1384, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76, &end
#
# 74 TYR HA 78 THR H 5.38
&rst
ixpk= 0, nxpk= 0, iat=1140,1200, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88, &end
#
# 77 VAL HA 78 THR H 2.55
&rst
ixpk= 0, nxpk= 0, iat=1186,1200, r1= 1.30, r2= 1.80, r3= 2.55, r4= 3.05, &end
#
# 32 GLU H 34 GLU H 4.85
&rst
ixpk= 0, nxpk= 0, iat= 492, 514, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35, &end
#
# 28 ILE H 30 VAL H 4.37
&rst
ixpk= 0, nxpk= 0, iat= 431, 462, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87, &end
#
# 28 ILE H 84 GLN HE22 5.01
&rst
ixpk= 0, nxpk= 0, iat= 431,1306, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51, &end
#
# 28 ILE H 52 LYS QE 5.50
&rst
ixpk= 0, nxpk= 0, iat= 431, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 814, 815,
&end
#
# 28 ILE H 28 ILE HB 3.17
&rst
ixpk= 0, nxpk= 0, iat= 431, 435, r1= 1.30, r2= 1.80, r3= 3.17, r4= 3.67, &end
#
# 28 ILE H 30 VAL QG2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 431, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2= 472, 473, 474,
&end
#
# 28 ILE H 28 ILE QG2 2.92
&rst
ixpk= 0, nxpk= 0, iat= 431, -1, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01,
igr2= 437, 438, 439,
&end
#
# 6 LYS H 6 LYS QB 3.71
&rst
ixpk= 0, nxpk= 0, iat= 70, -1, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
igr2= 74, 75,
&end
#
# 15 GLY QA 16 VAL H 2.99
&rst
ixpk= 0, nxpk= 0, iat= -1, 216, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
igr1= 211, 212,
&end
#
# 6 LYS HA 7 PHE H 3.47
&rst
ixpk= 0, nxpk= 0, iat= 72, 92, r1= 1.30, r2= 1.80, r3= 3.47, r4= 3.97, &end
#
# 7 PHE H 8 LYS QD 4.25
&rst
ixpk= 0, nxpk= 0, iat= 92, -1, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
igr2= 122, 123,
&end
#
# 7 PHE H 7 PHE QD 4.88
&rst
ixpk= 0, nxpk= 0, iat= 92, -1, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
igr2= 100, 108,
&end
#
# 65 GLU H 68 ASN QB 5.04
&rst
ixpk= 0, nxpk= 0, iat=1007, -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr2=1046,1047,
&end
#
# 63 THR H 65 GLU H 5.50
&rst
ixpk= 0, nxpk= 0, iat= 978,1007, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 63 THR HB 65 GLU H 3.38
&rst
ixpk= 0, nxpk= 0, iat= 982,1007, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88, &end
#
# 65 GLU H 65 GLU HG3 4.25
&rst
ixpk= 0, nxpk= 0, iat=1007,1015, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75, &end
#
# 64 GLU HB3 65 GLU H 3.14
&rst
ixpk= 0, nxpk= 0, iat= 997,1007, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64, &end
#
# 65 GLU H 67 ALA H 4.89
&rst
ixpk= 0, nxpk= 0, iat=1007,1032, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39, &end
#
# 111 LEU HA 115 ASN H 5.22
&rst
ixpk= 0, nxpk= 0, iat=1717,1777, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72, &end
#
# 89 GLN HA 90 PHE H 3.04
&rst
ixpk= 0, nxpk= 0, iat=1386,1401, r1= 1.30, r2= 1.80, r3= 3.04, r4= 3.54, &end
#
# 89 GLN QG 90 PHE H 4.28
&rst
ixpk= 0, nxpk= 0, iat= -1,1401, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1=1391,1392,
&end
#
# 37 SER HA 38 LEU H 3.57
&rst
ixpk= 0, nxpk= 0, iat= 566, 575, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07, &end
#
# 35 VAL HA 38 LEU H 4.22
&rst
ixpk= 0, nxpk= 0, iat= 531, 575, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 38 LEU H 38 LEU HG 2.78
&rst
ixpk= 0, nxpk= 0, iat= 575, 582, r1= 1.30, r2= 1.80, r3= 2.78, r4= 3.28, &end
#
# 38 LEU H 38 LEU QD2 3.66
&rst
ixpk= 0, nxpk= 0, iat= 575, -1, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,
igr2= 588, 589, 590,
&end
#
# 38 LEU HA 40 LEU H 4.65
&rst
ixpk= 0, nxpk= 0, iat= 577, 601, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15, &end
#
# 111 LEU H 114 VAL QG2 5.50
&rst
ixpk= 0, nxpk= 0, iat=1715, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2=1771,1772,1773,
&end
#
# 111 LEU H 114 VAL QG1 5.50
&rst
ixpk= 0, nxpk= 0, iat=1715, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2=1767,1768,1769,
&end
#
# 36 ILE QD1 111 LEU H 4.06
&rst
ixpk= 0, nxpk= 0, iat= -1,1715, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
igr1= 558, 559, 560,
&end
#
# 20 VAL H 67 ALA QB 4.32
&rst
ixpk= 0, nxpk= 0, iat= 281, -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
igr2=1036,1037,1038,
&end
#
# 56 GLN HB2 57 ALA H 4.56
&rst
ixpk= 0, nxpk= 0, iat= 870, 883, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06, &end
#
# 56 GLN HB3 57 ALA H 4.56
&rst
ixpk= 0, nxpk= 0, iat= 871, 883, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06, &end
#
# 33 GLY HA3 35 VAL H 5.15
&rst
ixpk= 0, nxpk= 0, iat= 510, 529, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65, &end
#
# 112 GLN H 114 VAL QG1 5.50
&rst
ixpk= 0, nxpk= 0, iat=1734, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2=1767,1768,1769,
&end
#
# 35 VAL H 36 ILE H 3.28
&rst
ixpk= 0, nxpk= 0, iat= 529, 545, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78, &end
#
# 32 GLU HA 35 VAL H 3.99
&rst
ixpk= 0, nxpk= 0, iat= 494, 529, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49, &end
#
# 64 GLU HA 67 ALA H 4.29
&rst
ixpk= 0, nxpk= 0, iat= 994,1032, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79, &end
#
# 67 ALA H 69 THR H 4.59
&rst
ixpk= 0, nxpk= 0, iat=1032,1056, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 43 GLY HA3 44 LYS H 3.18
&rst
ixpk= 0, nxpk= 0, iat= 657, 661, r1= 1.30, r2= 1.80, r3= 3.18, r4= 3.68, &end
#
# 44 LYS H 62 ASN HB2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 661, 968, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 44 LYS H 63 THR QG2 4.20
&rst
ixpk= 0, nxpk= 0, iat= 661, -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr2= 984, 985, 986,
&end
#
# 44 LYS H 62 ASN HB3 4.76
&rst
ixpk= 0, nxpk= 0, iat= 661, 969, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26, &end
#
# 67 ALA H 68 ASN QB 4.47
&rst
ixpk= 0, nxpk= 0, iat=1032, -1, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
igr2=1046,1047,
&end
#
# 72 ASN H 72 ASN HA 2.94
&rst
ixpk= 0, nxpk= 0, iat=1103,1105, r1= 1.30, r2= 1.80, r3= 2.94, r4= 3.44, &end
#
# 72 ASN H 72 ASN HB3 2.99
&rst
ixpk= 0, nxpk= 0, iat=1103,1108, r1= 1.30, r2= 1.80, r3= 2.99, r4= 3.49, &end
#
# 72 ASN H 72 ASN HB2 2.99
&rst
ixpk= 0, nxpk= 0, iat=1103,1107, r1= 1.30, r2= 1.80, r3= 2.99, r4= 3.49, &end
#
# 44 LYS H 62 ASN H 4.97
&rst
ixpk= 0, nxpk= 0, iat= 661, 964, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 72 ASN H 72 ASN HD21 4.79
&rst
ixpk= 0, nxpk= 0, iat=1103,1113, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29, &end
#
# 33 GLY HA2 36 ILE H 3.87
&rst
ixpk= 0, nxpk= 0, iat= 509, 545, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37, &end
#
# 70 MET HA 72 ASN H 5.04
&rst
ixpk= 0, nxpk= 0, iat=1072,1103, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54, &end
#
# 69 THR QG2 72 ASN H 4.80
&rst
ixpk= 0, nxpk= 0, iat= -1,1103, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
igr1=1062,1063,1064,
&end
#
# 67 ALA HA 71 VAL H 4.69
&rst
ixpk= 0, nxpk= 0, iat=1034,1087, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, &end
#
# 58 PHE HA 59 ILE H 3.13
&rst
ixpk= 0, nxpk= 0, iat= 895, 913, r1= 1.30, r2= 1.80, r3= 3.13, r4= 3.63, &end
#
# 20 VAL HA 59 ILE H 4.87
&rst
ixpk= 0, nxpk= 0, iat= 283, 913, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37, &end
#
# 59 ILE H 59 ILE HG13 3.41
&rst
ixpk= 0, nxpk= 0, iat= 913, 924, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91, &end
#
# 28 ILE QG2 29 ASP H 2.93
&rst
ixpk= 0, nxpk= 0, iat= -1, 450, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02,
igr1= 437, 438, 439,
&end
#
# 29 ASP H 30 VAL H 3.02
&rst
ixpk= 0, nxpk= 0, iat= 450, 462, r1= 1.30, r2= 1.80, r3= 3.02, r4= 3.52, &end
#
# 30 VAL H 31 THR H 4.73
&rst
ixpk= 0, nxpk= 0, iat= 462, 478, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, &end
#
# 29 ASP HA 30 VAL H 3.48
&rst
ixpk= 0, nxpk= 0, iat= 452, 462, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98, &end
#
# 28 ILE HA 30 VAL H 3.66
&rst
ixpk= 0, nxpk= 0, iat= 433, 462, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16, &end
#
# 30 VAL H 52 LYS QE 4.89
&rst
ixpk= 0, nxpk= 0, iat= 462, -1, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
igr2= 814, 815,
&end
#
# 30 VAL H 82 ARG QB 5.11
&rst
ixpk= 0, nxpk= 0, iat= 462, -1, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
igr2=1267,1268,
&end
#
# 28 ILE QG2 30 VAL H 4.27
&rst
ixpk= 0, nxpk= 0, iat= -1, 462, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
igr1= 437, 438, 439,
&end
#
# 79 PRO HG2 87 TYR H 5.49
&rst
ixpk= 0, nxpk= 0, iat=1218,1344, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99, &end
#
# 86 ILE QG2 87 TYR H 4.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1344, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1=1331,1332,1333,
&end
#
# 66 ALA HA 69 THR H 4.28
&rst
ixpk= 0, nxpk= 0, iat=1024,1056, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78, &end
#
# 65 GLU HA 69 THR H 4.02
&rst
ixpk= 0, nxpk= 0, iat=1009,1056, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52, &end
#
# 68 ASN H 70 MET H 4.83
&rst
ixpk= 0, nxpk= 0, iat=1042,1070, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33, &end
#
# 67 ALA H 68 ASN H 3.28
&rst
ixpk= 0, nxpk= 0, iat=1032,1042, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78, &end
#
# 66 ALA HA 68 ASN H 4.78
&rst
ixpk= 0, nxpk= 0, iat=1024,1042, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, &end
#
# 65 GLU HA 68 ASN H 3.61
&rst
ixpk= 0, nxpk= 0, iat=1009,1042, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11, &end
#
# 64 GLU HA 68 ASN H 4.30
&rst
ixpk= 0, nxpk= 0, iat= 994,1042, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80, &end
#
# 68 ASN H 68 ASN QB 3.00
&rst
ixpk= 0, nxpk= 0, iat=1042, -1, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87,
igr2=1046,1047,
&end
#
# 68 ASN HD22 69 THR H 4.90
&rst
ixpk= 0, nxpk= 0, iat=1051,1056, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40, &end
#
# 62 ASN H 62 ASN HD21 4.60
&rst
ixpk= 0, nxpk= 0, iat= 964, 974, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 61 MET HA 62 ASN H 3.01
&rst
ixpk= 0, nxpk= 0, iat= 949, 964, r1= 1.30, r2= 1.80, r3= 3.01, r4= 3.51, &end
#
# 62 ASN H 62 ASN HB3 3.38
&rst
ixpk= 0, nxpk= 0, iat= 964, 969, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88, &end
#
# 62 ASN H 62 ASN HB2 3.33
&rst
ixpk= 0, nxpk= 0, iat= 964, 968, r1= 1.30, r2= 1.80, r3= 3.33, r4= 3.83, &end
#
# 20 VAL HB 91 SER H 3.33
&rst
ixpk= 0, nxpk= 0, iat= 285,1421, r1= 1.30, r2= 1.80, r3= 3.33, r4= 3.83, &end
#
# 62 ASN H 63 THR QG2 4.39
&rst
ixpk= 0, nxpk= 0, iat= 964, -1, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77,
igr2= 984, 985, 986,
&end
#
# 80 VAL HA 86 ILE H 3.60
&rst
ixpk= 0, nxpk= 0, iat=1230,1325, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10, &end
#
# 79 PRO HG2 86 ILE H 3.94
&rst
ixpk= 0, nxpk= 0, iat=1218,1325, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44, &end
#
# 79 PRO HB2 86 ILE H 4.73
&rst
ixpk= 0, nxpk= 0, iat=1221,1325, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, &end
#
# 81 LEU H 86 ILE H 4.59
&rst
ixpk= 0, nxpk= 0, iat=1244,1325, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 30 VAL H 82 ARG HE 4.20
&rst
ixpk= 0, nxpk= 0, iat= 462,1276, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 82 ARG HA 82 ARG HE 5.14
&rst
ixpk= 0, nxpk= 0, iat=1265,1276, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64, &end
#
# 30 VAL HB 82 ARG HE 4.88
&rst
ixpk= 0, nxpk= 0, iat= 466,1276, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38, &end
#
# 30 VAL HA 82 ARG HE 4.15
&rst
ixpk= 0, nxpk= 0, iat= 464,1276, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65, &end
#
# 74 TYR HA 76 SER H 5.00
&rst
ixpk= 0, nxpk= 0, iat=1140,1173, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 57 ALA HA 58 PHE H 3.48
&rst
ixpk= 0, nxpk= 0, iat= 885, 893, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98, &end
#
# 42 PHE HZ 74 TYR H 5.37
&rst
ixpk= 0, nxpk= 0, iat= 646,1138, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87, &end
#
# 71 VAL HA 74 TYR H 3.86
&rst
ixpk= 0, nxpk= 0, iat=1089,1138, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 70 MET HA 74 TYR H 4.53
&rst
ixpk= 0, nxpk= 0, iat=1072,1138, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03, &end
#
# 26 LEU H 57 ALA H 5.15
&rst
ixpk= 0, nxpk= 0, iat= 398, 883, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65, &end
#
# 26 LEU H 56 GLN HA 4.44
&rst
ixpk= 0, nxpk= 0, iat= 398, 868, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94, &end
#
# 26 LEU H 55 ASN HA 4.24
&rst
ixpk= 0, nxpk= 0, iat= 398, 854, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74, &end
#
# 25 LYS QG 26 LEU H 4.87
&rst
ixpk= 0, nxpk= 0, iat= -1, 398, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,
igr1= 383, 384,
&end
#
# 24 ARG HA 26 LEU H 4.06
&rst
ixpk= 0, nxpk= 0, iat= 354, 398, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56, &end
#
# 25 LYS HA 26 LEU H 3.45
&rst
ixpk= 0, nxpk= 0, iat= 378, 398, r1= 1.30, r2= 1.80, r3= 3.45, r4= 3.95, &end
#
# 54 LYS HA 55 ASN H 3.57
&rst
ixpk= 0, nxpk= 0, iat= 832, 852, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07, &end
#
# 31 THR H 32 GLU H 4.76
&rst
ixpk= 0, nxpk= 0, iat= 478, 492, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26, &end
#
# 30 VAL HA 31 THR H 2.97
&rst
ixpk= 0, nxpk= 0, iat= 464, 478, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 52 LYS HA 54 LYS H 4.11
&rst
ixpk= 0, nxpk= 0, iat= 803, 830, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 51 LEU QQD 54 LYS H 4.95
&rst
ixpk= 0, nxpk= 0, iat= -1, 830, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
igr1= 791, 792, 793, 795, 796, 797,
&end
#
# 111 LEU HA 114 VAL H 3.71
&rst
ixpk= 0, nxpk= 0, iat=1717,1761, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21, &end
#
# 110 ALA QB 114 VAL H 5.12
&rst
ixpk= 0, nxpk= 0, iat= -1,1761, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
igr1=1709,1710,1711,
&end
#
# 114 VAL H 115 ASN HA 5.50
&rst
ixpk= 0, nxpk= 0, iat=1761,1779, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 62 ASN HA 62 ASN HD22 4.76
&rst
ixpk= 0, nxpk= 0, iat= 966, 973, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26, &end
#
# 62 ASN HD22 63 THR HA 4.87
&rst
ixpk= 0, nxpk= 0, iat= 973, 980, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37, &end
#
# 62 ASN HB3 62 ASN HD22 3.66
&rst
ixpk= 0, nxpk= 0, iat= 969, 973, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16, &end
#
# 62 ASN HD21 63 THR HA 5.30
&rst
ixpk= 0, nxpk= 0, iat= 974, 980, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80, &end
#
# 62 ASN HD21 63 THR HB 5.50
&rst
ixpk= 0, nxpk= 0, iat= 974, 982, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 62 ASN HA 62 ASN HD21 4.50
&rst
ixpk= 0, nxpk= 0, iat= 966, 974, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 44 LYS QD 62 ASN HD21 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 974, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 671, 672,
&end
#
# 62 ASN HD21 63 THR QG2 3.87
&rst
ixpk= 0, nxpk= 0, iat= 974, -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
igr2= 984, 985, 986,
&end
#
# 25 LYS H 55 ASN HB3 5.13
&rst
ixpk= 0, nxpk= 0, iat= 376, 857, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63, &end
#
# 18 SER H 19 ARG H 5.12
&rst
ixpk= 0, nxpk= 0, iat= 246, 257, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, &end
#
# 37 SER H 38 LEU HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= 564, 577, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 37 SER H 37 SER HA 2.91
&rst
ixpk= 0, nxpk= 0, iat= 564, 566, r1= 1.30, r2= 1.80, r3= 2.91, r4= 3.41, &end
#
# 33 GLY HA3 37 SER H 5.32
&rst
ixpk= 0, nxpk= 0, iat= 510, 564, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82, &end
#
# 35 VAL HA 37 SER H 4.96
&rst
ixpk= 0, nxpk= 0, iat= 531, 564, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46, &end
#
# 73 TYR HA 75 THR H 4.22
&rst
ixpk= 0, nxpk= 0, iat=1119,1159, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 71 VAL HA 75 THR H 4.43
&rst
ixpk= 0, nxpk= 0, iat=1089,1159, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93, &end
#
# 56 GLN H 57 ALA H 4.61
&rst
ixpk= 0, nxpk= 0, iat= 866, 883, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 55 ASN HA 56 GLN H 3.31
&rst
ixpk= 0, nxpk= 0, iat= 854, 866, r1= 1.30, r2= 1.80, r3= 3.31, r4= 3.81, &end
#
# 29 ASP H 84 GLN HE22 5.50
&rst
ixpk= 0, nxpk= 0, iat= 450,1306, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 84 GLN HA 84 GLN HE21 5.09
&rst
ixpk= 0, nxpk= 0, iat=1296,1307, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59, &end
#
# 84 GLN QG 84 GLN HE21 3.11
&rst
ixpk= 0, nxpk= 0, iat= -1,1307, r1= 1.30, r2= 1.80, r3= 3.49, r4= 3.99,
igr1=1301,1302,
&end
#
# 84 GLN QG 84 GLN HE22 3.45
&rst
ixpk= 0, nxpk= 0, iat= -1,1306, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,
igr1=1301,1302,
&end
#
# 65 GLU HA 68 ASN HD21 4.46
&rst
ixpk= 0, nxpk= 0, iat=1009,1052, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, &end
#
# 68 ASN HD21 69 THR H 4.90
&rst
ixpk= 0, nxpk= 0, iat=1052,1056, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40, &end
#
# 65 GLU HA 68 ASN HD22 4.46
&rst
ixpk= 0, nxpk= 0, iat=1009,1051, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, &end
#
# 68 ASN QB 68 ASN HD21 3.97
&rst
ixpk= 0, nxpk= 0, iat= -1,1052, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
igr1=1046,1047,
&end
#
# 68 ASN QB 68 ASN HD22 3.97
&rst
ixpk= 0, nxpk= 0, iat= -1,1051, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
igr1=1046,1047,
&end
#
# 72 ASN HD21 73 TYR H 4.33
&rst
ixpk= 0, nxpk= 0, iat=1113,1117, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83, &end
#
# 72 ASN HA 72 ASN HD21 4.45
&rst
ixpk= 0, nxpk= 0, iat=1105,1113, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95, &end
#
# 36 ILE QD1 115 ASN HD21 4.87
&rst
ixpk= 0, nxpk= 0, iat= -1,1787, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
igr1= 558, 559, 560,
&end
#
# 115 ASN HA 115 ASN HD22 4.71
&rst
ixpk= 0, nxpk= 0, iat=1779,1786, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21, &end
#
# 36 ILE QD1 115 ASN HD22 5.25
&rst
ixpk= 0, nxpk= 0, iat= -1,1786, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
igr1= 558, 559, 560,
&end
#
# 115 ASN HA 115 ASN HD21 4.46
&rst
ixpk= 0, nxpk= 0, iat=1779,1787, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, &end
#
# 111 LEU HA 115 ASN HD21 4.28
&rst
ixpk= 0, nxpk= 0, iat=1717,1787, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78, &end
#
# 111 LEU HA 115 ASN HD22 5.10
&rst
ixpk= 0, nxpk= 0, iat=1717,1786, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, &end
#
# 47 ASN HB3 47 ASN HD21 4.00
&rst
ixpk= 0, nxpk= 0, iat= 718, 723, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 47 ASN HB3 47 ASN HD22 4.00
&rst
ixpk= 0, nxpk= 0, iat= 718, 722, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 42 PHE HA 43 GLY H 3.45
&rst
ixpk= 0, nxpk= 0, iat= 636, 654, r1= 1.30, r2= 1.80, r3= 3.45, r4= 3.95, &end
#
# 43 GLY H 66 ALA HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= 654,1024, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 63 THR H 66 ALA H 4.24
&rst
ixpk= 0, nxpk= 0, iat= 978,1022, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74, &end
#
# 62 ASN HB3 63 THR H 3.85
&rst
ixpk= 0, nxpk= 0, iat= 969, 978, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35, &end
#
# 62 ASN HB2 63 THR H 3.92
&rst
ixpk= 0, nxpk= 0, iat= 968, 978, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42, &end
#
# 63 THR H 64 GLU H 4.48
&rst
ixpk= 0, nxpk= 0, iat= 978, 992, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98, &end
#
# 62 ASN H 63 THR H 3.41
&rst
ixpk= 0, nxpk= 0, iat= 964, 978, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91, &end
#
# 43 GLY HA3 63 THR H 5.50
&rst
ixpk= 0, nxpk= 0, iat= 657, 978, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 32 GLU H 33 GLY H 3.81
&rst
ixpk= 0, nxpk= 0, iat= 492, 507, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31, &end
#
# 33 GLY H 35 VAL H 4.89
&rst
ixpk= 0, nxpk= 0, iat= 507, 529, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39, &end
#
# 80 VAL HA 83 GLY H 5.23
&rst
ixpk= 0, nxpk= 0, iat=1230,1287, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73, &end
#
# 83 GLY H 84 GLN QG 4.98
&rst
ixpk= 0, nxpk= 0, iat=1287, -1, r1= 1.30, r2= 1.80, r3= 5.59, r4= 6.09,
igr2=1301,1302,
&end
#
# 82 ARG H 83 GLY H 4.09
&rst
ixpk= 0, nxpk= 0, iat=1263,1287, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59, &end
#
# 81 LEU HA 83 GLY H 3.97
&rst
ixpk= 0, nxpk= 0, iat=1246,1287, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47, &end
#
# 82 ARG HA 83 GLY H 3.26
&rst
ixpk= 0, nxpk= 0, iat=1265,1287, r1= 1.30, r2= 1.80, r3= 3.26, r4= 3.76, &end
#
# 38 LEU HG 39 GLY H 3.75
&rst
ixpk= 0, nxpk= 0, iat= 582, 594, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25, &end
#
# 4 SER QB 5 LYS QG 4.39
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03,
igr1= 41, 42,
igr2= 55, 56,
&end
#
# 5 LYS H 5 LYS QG 3.83
&rst
ixpk= 0, nxpk= 0, iat= 48, -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
igr2= 55, 56,
&end
#
# 5 LYS HA 7 PHE QB 5.34
&rst
ixpk= 0, nxpk= 0, iat= 50, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2= 96, 97,
&end
#
# 5 LYS QB 7 PHE QB 4.68
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
igr1= 52, 53,
igr2= 96, 97,
&end
#
# 5 LYS QG 5 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= 55, 56,
igr2= 61, 62,
&end
#
# 5 LYS QD 7 PHE QD 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1= 58, 59,
igr2= 100, 108,
&end
#
# 6 LYS HA 6 LYS QG 3.19
&rst
ixpk= 0, nxpk= 0, iat= 72, -1, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08,
igr2= 77, 78,
&end
#
# 6 LYS QG 6 LYS QE 3.34
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,
igr1= 77, 78,
igr2= 83, 84,
&end
#
# 8 LYS HA 17 PRO QB 4.89
&rst
ixpk= 0, nxpk= 0, iat= 114, -1, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
igr2= 239, 240,
&end
#
# 8 LYS QB 17 PRO QD 4.30
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr1= 116, 117,
igr2= 233, 234,
&end
#
# 9 GLY H 17 PRO QD 4.14
&rst
ixpk= 0, nxpk= 0, iat= 134, -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
igr2= 233, 234,
&end
#
# 10 ASP QB 11 SER HA 4.74
&rst
ixpk= 0, nxpk= 0, iat= -1, 155, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
igr1= 145, 146,
&end
#
# 10 ASP QB 11 SER QB 4.96
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75,
igr1= 145, 146,
igr2= 157, 158,
&end
#
# 14 ALA HA 16 VAL QQG 4.62
&rst
ixpk= 0, nxpk= 0, iat= 201, -1, r1= 1.30, r2= 1.80, r3= 6.23, r4= 6.73,
igr2= 222, 223, 224, 226, 227, 228,
&end
#
# 14 ALA HA 71 VAL QQG 5.44
&rst
ixpk= 0, nxpk= 0, iat= 201, -1, r1= 1.30, r2= 1.80, r3= 7.33, r4= 7.83,
igr2=1093,1094,1095,1097,1098,1099,
&end
#
# 14 ALA QB 71 VAL QQG 5.44
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.81, r4= 9.31,
igr1= 203, 204, 205,
igr2=1093,1094,1095,1097,1098,1099,
&end
#
# 15 GLY QA 16 VAL QQG 4.09
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.19, r4= 6.69,
igr1= 211, 212,
igr2= 222, 223, 224, 226, 227, 228,
&end
#
# 16 VAL H 16 VAL QQG 2.58
&rst
ixpk= 0, nxpk= 0, iat= 216, -1, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98,
igr2= 222, 223, 224, 226, 227, 228,
&end
#
# 16 VAL H 17 PRO QD 4.80
&rst
ixpk= 0, nxpk= 0, iat= 216, -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr2= 233, 234,
&end
#
# 16 VAL HA 16 VAL QQG 2.66
&rst
ixpk= 0, nxpk= 0, iat= 218, -1, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09,
igr2= 222, 223, 224, 226, 227, 228,
&end
#
# 16 VAL HA 17 PRO QB 5.23
&rst
ixpk= 0, nxpk= 0, iat= 218, -1, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,
igr2= 239, 240,
&end
#
# 16 VAL HA 17 PRO QD 2.96
&rst
ixpk= 0, nxpk= 0, iat= 218, -1, r1= 1.30, r2= 1.80, r3= 3.32, r4= 3.82,
igr2= 233, 234,
&end
#
# 16 VAL HB 17 PRO QD 3.45
&rst
ixpk= 0, nxpk= 0, iat= 220, -1, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,
igr2= 233, 234,
&end
#
# 16 VAL QQG 17 PRO QB 5.15
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.79, r4= 8.29,
igr1= 222, 223, 224, 226, 227, 228,
igr2= 239, 240,
&end
#
# 16 VAL QQG 17 PRO HG2 3.93
&rst
ixpk= 0, nxpk= 0, iat= -1, 236, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr1= 222, 223, 224, 226, 227, 228,
&end
#
# 16 VAL QQG 17 PRO QD 3.51
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
igr1= 222, 223, 224, 226, 227, 228,
igr2= 233, 234,
&end
#
# 16 VAL QQG 18 SER H 4.63
&rst
ixpk= 0, nxpk= 0, iat= -1, 246, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
igr1= 222, 223, 224, 226, 227, 228,
&end
#
# 16 VAL QQG 18 SER HA 5.15
&rst
ixpk= 0, nxpk= 0, iat= -1, 248, r1= 1.30, r2= 1.80, r3= 6.94, r4= 7.44,
igr1= 222, 223, 224, 226, 227, 228,
&end
#
# 16 VAL QQG 18 SER QB 4.91
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.43, r4= 7.93,
igr1= 222, 223, 224, 226, 227, 228,
igr2= 250, 251,
&end
#
# 16 VAL QQG 64 GLU HA 5.44
&rst
ixpk= 0, nxpk= 0, iat= -1, 994, r1= 1.30, r2= 1.80, r3= 7.33, r4= 7.83,
igr1= 222, 223, 224, 226, 227, 228,
&end
#
# 16 VAL QQG 64 GLU QG 4.64
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.02, r4= 7.52,
igr1= 222, 223, 224, 226, 227, 228,
igr2= 999,1000,
&end
#
# 16 VAL QQG 90 PHE HZ 5.44
&rst
ixpk= 0, nxpk= 0, iat= -1,1413, r1= 1.30, r2= 1.80, r3= 7.33, r4= 7.83,
igr1= 222, 223, 224, 226, 227, 228,
&end
#
# 17 PRO QB 18 SER H 4.10
&rst
ixpk= 0, nxpk= 0, iat= -1, 246, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
igr1= 239, 240,
&end
#
# 17 PRO QB 18 SER QB 5.18
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.53, r4= 7.03,
igr1= 239, 240,
igr2= 250, 251,
&end
#
# 18 SER QB 19 ARG H 4.40
&rst
ixpk= 0, nxpk= 0, iat= -1, 257, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
igr1= 250, 251,
&end
#
# 18 SER QB 20 VAL H 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, 281, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1= 250, 251,
&end
#
# 19 ARG H 20 VAL QQG 3.71
&rst
ixpk= 0, nxpk= 0, iat= 257, -1, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,
igr2= 287, 288, 289, 291, 292, 293,
&end
#
# 19 ARG HA 20 VAL QQG 3.99
&rst
ixpk= 0, nxpk= 0, iat= 259, -1, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
igr2= 287, 288, 289, 291, 292, 293,
&end
#
# 19 ARG HA 64 GLU QG 4.64
&rst
ixpk= 0, nxpk= 0, iat= 259, -1, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,
igr2= 999,1000,
&end
#
# 19 ARG QB 19 ARG QD 3.12
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
igr1= 261, 262,
igr2= 267, 268,
&end
#
# 19 ARG QB 63 THR H 5.10
&rst
ixpk= 0, nxpk= 0, iat= -1, 978, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
igr1= 261, 262,
&end
#
# 19 ARG QG 20 VAL QQG 4.98
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.54, r4= 8.04,
igr1= 264, 265,
igr2= 287, 288, 289, 291, 292, 293,
&end
#
# 19 ARG QD 20 VAL QQG 4.95
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.49, r4= 7.99,
igr1= 267, 268,
igr2= 287, 288, 289, 291, 292, 293,
&end
#
# 20 VAL H 60 GLU QG 4.74
&rst
ixpk= 0, nxpk= 0, iat= 281, -1, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
igr2= 939, 940,
&end
#
# 20 VAL HA 60 GLU QG 4.79
&rst
ixpk= 0, nxpk= 0, iat= 283, -1, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
igr2= 939, 940,
&end
#
# 20 VAL QQG 21 ILE H 4.28
&rst
ixpk= 0, nxpk= 0, iat= -1, 297, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,
igr1= 287, 288, 289, 291, 292, 293,
&end
#
# 20 VAL QQG 58 PHE HA 4.66
&rst
ixpk= 0, nxpk= 0, iat= -1, 895, r1= 1.30, r2= 1.80, r3= 6.28, r4= 6.78,
igr1= 287, 288, 289, 291, 292, 293,
&end
#
# 20 VAL QQG 58 PHE QB 4.53
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.85, r4= 7.35,
igr1= 287, 288, 289, 291, 292, 293,
igr2= 897, 898,
&end
#
# 20 VAL QQG 58 PHE QB 4.53
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.85, r4= 7.35,
igr1= 287, 288, 289, 291, 292, 293,
igr2= 897, 898,
&end
#
# 20 VAL QQG 58 PHE QD 4.08
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 287, 288, 289, 291, 292, 293,
igr2= 901, 909,
&end
#
# 20 VAL QQG 60 GLU HA 3.81
&rst
ixpk= 0, nxpk= 0, iat= -1, 934, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
igr1= 287, 288, 289, 291, 292, 293,
&end
#
# 20 VAL QQG 60 GLU HB2 4.80
&rst
ixpk= 0, nxpk= 0, iat= -1, 936, r1= 1.30, r2= 1.80, r3= 6.47, r4= 6.97,
igr1= 287, 288, 289, 291, 292, 293,
&end
#
# 20 VAL QQG 60 GLU HB3 4.45
&rst
ixpk= 0, nxpk= 0, iat= -1, 937, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr1= 287, 288, 289, 291, 292, 293,
&end
#
# 20 VAL QQG 60 GLU QG 3.94
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
igr1= 287, 288, 289, 291, 292, 293,
igr2= 939, 940,
&end
#
# 20 VAL QQG 91 SER H 4.55
&rst
ixpk= 0, nxpk= 0, iat= -1,1421, r1= 1.30, r2= 1.80, r3= 6.13, r4= 6.63,
igr1= 287, 288, 289, 291, 292, 293,
&end
#
# 20 VAL QQG 91 SER QB 3.53
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr1= 287, 288, 289, 291, 292, 293,
igr2=1425,1426,
&end
#
# 20 VAL QQG 93 HIS HD2 5.44
&rst
ixpk= 0, nxpk= 0, iat= -1,1459, r1= 1.30, r2= 1.80, r3= 7.33, r4= 7.83,
igr1= 287, 288, 289, 291, 292, 293,
&end
#
# 20 VAL QQG 94 LYS HA 5.03
&rst
ixpk= 0, nxpk= 0, iat= -1,1465, r1= 1.30, r2= 1.80, r3= 6.78, r4= 7.28,
igr1= 287, 288, 289, 291, 292, 293,
&end
#
# 20 VAL QQG 95 GLU H 5.28
&rst
ixpk= 0, nxpk= 0, iat= -1,1485, r1= 1.30, r2= 1.80, r3= 7.12, r4= 7.62,
igr1= 287, 288, 289, 291, 292, 293,
&end
#
# 20 VAL QQG 95 GLU HA 3.62
&rst
ixpk= 0, nxpk= 0, iat= -1,1487, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
igr1= 287, 288, 289, 291, 292, 293,
&end
#
# 20 VAL QQG 95 GLU QG 5.44
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.23, r4= 8.73,
igr1= 287, 288, 289, 291, 292, 293,
igr2=1492,1493,
&end
#
# 21 ILE H 96 LEU QQD 5.06
&rst
ixpk= 0, nxpk= 0, iat= 297, -1, r1= 1.30, r2= 1.80, r3= 6.82, r4= 7.32,
igr2=1509,1510,1511,1513,1514,1515,
&end
#
# 21 ILE HA 71 VAL QQG 4.94
&rst
ixpk= 0, nxpk= 0, iat= 299, -1, r1= 1.30, r2= 1.80, r3= 6.66, r4= 7.16,
igr2=1093,1094,1095,1097,1098,1099,
&end
#
# 21 ILE HA 90 PHE QB 5.11
&rst
ixpk= 0, nxpk= 0, iat= 299, -1, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
igr2=1405,1406,
&end
#
# 21 ILE HB 71 VAL QQG 5.01
&rst
ixpk= 0, nxpk= 0, iat= 301, -1, r1= 1.30, r2= 1.80, r3= 6.75, r4= 7.25,
igr2=1093,1094,1095,1097,1098,1099,
&end
#
# 21 ILE HG12 71 VAL QQG 3.15
&rst
ixpk= 0, nxpk= 0, iat= 307, -1, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,
igr2=1093,1094,1095,1097,1098,1099,
&end
#
# 21 ILE HG13 71 VAL QQG 3.57
&rst
ixpk= 0, nxpk= 0, iat= 308, -1, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31,
igr2=1093,1094,1095,1097,1098,1099,
&end
#
# 21 ILE QD1 61 MET QB 4.85
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.54, r4= 7.04,
igr1= 310, 311, 312,
igr2= 951, 952,
&end
#
# 21 ILE QD1 90 PHE QB 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.20, r4= 7.70,
igr1= 310, 311, 312,
igr2=1405,1406,
&end
#
# 23 ILE QG2 87 TYR QB 4.66
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.28, r4= 6.78,
igr1= 339, 340, 341,
igr2=1348,1349,
&end
#
# 23 ILE QG1 35 VAL HA 5.19
&rst
ixpk= 0, nxpk= 0, iat= -1, 531, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33,
igr1= 343, 344,
&end
#
# 23 ILE QG1 89 GLN H 4.98
&rst
ixpk= 0, nxpk= 0, iat= -1,1384, r1= 1.30, r2= 1.80, r3= 5.59, r4= 6.09,
igr1= 343, 344,
&end
#
# 24 ARG H 24 ARG QB 3.29
&rst
ixpk= 0, nxpk= 0, iat= 352, -1, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19,
igr2= 356, 357,
&end
#
# 24 ARG H 26 LEU QQD 5.44
&rst
ixpk= 0, nxpk= 0, iat= 352, -1, r1= 1.30, r2= 1.80, r3= 7.33, r4= 7.83,
igr2= 407, 408, 409, 411, 412, 413,
&end
#
# 24 ARG HA 24 ARG QD 4.72
&rst
ixpk= 0, nxpk= 0, iat= 354, -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr2= 362, 363,
&end
#
# 24 ARG QB 24 ARG QD 3.16
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,
igr1= 356, 357,
igr2= 362, 363,
&end
#
# 24 ARG QB 25 LYS H 4.44
&rst
ixpk= 0, nxpk= 0, iat= -1, 376, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
igr1= 356, 357,
&end
#
# 24 ARG QG 87 TYR QB 4.15
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73,
igr1= 359, 360,
igr2=1348,1349,
&end
#
# 24 ARG QD 87 TYR QD 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1= 362, 363,
igr2=1352,1361,
&end
#
# 25 LYS H 26 LEU QQD 5.44
&rst
ixpk= 0, nxpk= 0, iat= 376, -1, r1= 1.30, r2= 1.80, r3= 7.33, r4= 7.83,
igr2= 407, 408, 409, 411, 412, 413,
&end
#
# 25 LYS H 56 GLN QG 4.39
&rst
ixpk= 0, nxpk= 0, iat= 376, -1, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,
igr2= 873, 874,
&end
#
# 25 LYS HA 25 LYS QD 3.58
&rst
ixpk= 0, nxpk= 0, iat= 378, -1, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,
igr2= 386, 387,
&end
#
# 25 LYS QG 87 TYR QB 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1= 383, 384,
igr2=1348,1349,
&end
#
# 26 LEU H 26 LEU QQD 3.80
&rst
ixpk= 0, nxpk= 0, iat= 398, -1, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
igr2= 407, 408, 409, 411, 412, 413,
&end
#
# 26 LEU H 55 ASN QB 3.46
&rst
ixpk= 0, nxpk= 0, iat= 398, -1, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,
igr2= 856, 857,
&end
#
# 26 LEU H 56 GLN QG 4.61
&rst
ixpk= 0, nxpk= 0, iat= 398, -1, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67,
igr2= 873, 874,
&end
#
# 26 LEU HA 26 LEU QQD 2.93
&rst
ixpk= 0, nxpk= 0, iat= 400, -1, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
igr2= 407, 408, 409, 411, 412, 413,
&end
#
# 26 LEU HA 27 PRO QB 5.23
&rst
ixpk= 0, nxpk= 0, iat= 400, -1, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,
igr2= 424, 425,
&end
#
# 26 LEU QB 55 ASN QB 4.37
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
igr1= 402, 403,
igr2= 856, 857,
&end
#
# 26 LEU QQD 27 PRO QB 5.21
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.88, r4= 8.38,
igr1= 407, 408, 409, 411, 412, 413,
igr2= 424, 425,
&end
#
# 26 LEU QQD 27 PRO HD2 3.23
&rst
ixpk= 0, nxpk= 0, iat= -1, 418, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,
igr1= 407, 408, 409, 411, 412, 413,
&end
#
# 26 LEU QQD 27 PRO HD3 3.58
&rst
ixpk= 0, nxpk= 0, iat= -1, 419, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
igr1= 407, 408, 409, 411, 412, 413,
&end
#
# 26 LEU QQD 35 VAL H 5.44
&rst
ixpk= 0, nxpk= 0, iat= -1, 529, r1= 1.30, r2= 1.80, r3= 7.33, r4= 7.83,
igr1= 407, 408, 409, 411, 412, 413,
&end
#
# 26 LEU QQD 50 MET QG 4.84
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.32, r4= 7.82,
igr1= 407, 408, 409, 411, 412, 413,
igr2= 772, 773,
&end
#
# 26 LEU QQD 50 MET QE 2.74
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
igr1= 407, 408, 409, 411, 412, 413,
igr2= 776, 777, 778,
&end
#
# 26 LEU QQD 52 LYS QE 4.64
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.02, r4= 7.52,
igr1= 407, 408, 409, 411, 412, 413,
igr2= 814, 815,
&end
#
# 26 LEU QQD 55 ASN HA 4.08
&rst
ixpk= 0, nxpk= 0, iat= -1, 854, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
igr1= 407, 408, 409, 411, 412, 413,
&end
#
# 26 LEU QQD 55 ASN QB 5.28
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.99, r4= 8.49,
igr1= 407, 408, 409, 411, 412, 413,
igr2= 856, 857,
&end
#
# 26 LEU QQD 56 GLN H 4.32
&rst
ixpk= 0, nxpk= 0, iat= -1, 866, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32,
igr1= 407, 408, 409, 411, 412, 413,
&end
#
# 26 LEU QQD 56 GLN HA 4.75
&rst
ixpk= 0, nxpk= 0, iat= -1, 868, r1= 1.30, r2= 1.80, r3= 6.40, r4= 6.90,
igr1= 407, 408, 409, 411, 412, 413,
&end
#
# 26 LEU QQD 57 ALA H 4.08
&rst
ixpk= 0, nxpk= 0, iat= -1, 883, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
igr1= 407, 408, 409, 411, 412, 413,
&end
#
# 26 LEU QQD 57 ALA HA 4.49
&rst
ixpk= 0, nxpk= 0, iat= -1, 885, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
igr1= 407, 408, 409, 411, 412, 413,
&end
#
# 27 PRO HA 30 VAL QQG 5.11
&rst
ixpk= 0, nxpk= 0, iat= 427, -1, r1= 1.30, r2= 1.80, r3= 6.89, r4= 7.39,
igr2= 468, 469, 470, 472, 473, 474,
&end
#
# 27 PRO QB 28 ILE HA 5.26
&rst
ixpk= 0, nxpk= 0, iat= -1, 433, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
igr1= 424, 425,
&end
#
# 27 PRO QB 29 ASP QB 4.93
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,
igr1= 424, 425,
igr2= 454, 455,
&end
#
# 27 PRO QB 30 VAL QQG 3.19
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
igr1= 424, 425,
igr2= 468, 469, 470, 472, 473, 474,
&end
#
# 27 PRO QB 81 LEU QB 4.30
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr1= 424, 425,
igr2=1248,1249,
&end
#
# 27 PRO QB 84 GLN H 5.04
&rst
ixpk= 0, nxpk= 0, iat= -1,1294, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr1= 424, 425,
&end
#
# 27 PRO QB 86 ILE QG2 4.99
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1= 424, 425,
igr2=1331,1332,1333,
&end
#
# 27 PRO QB 86 ILE QD1 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.20, r4= 7.70,
igr1= 424, 425,
igr2=1338,1339,1340,
&end
#
# 27 PRO HG2 30 VAL QQG 3.26
&rst
ixpk= 0, nxpk= 0, iat= 421, -1, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,
igr2= 468, 469, 470, 472, 473, 474,
&end
#
# 27 PRO HG2 81 LEU QQD 3.09
&rst
ixpk= 0, nxpk= 0, iat= 421, -1, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,
igr2=1253,1254,1255,1257,1258,1259,
&end
#
# 27 PRO HG3 30 VAL QQG 4.34
&rst
ixpk= 0, nxpk= 0, iat= 422, -1, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
igr2= 468, 469, 470, 472, 473, 474,
&end
#
# 27 PRO HD2 30 VAL QQG 4.13
&rst
ixpk= 0, nxpk= 0, iat= 418, -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
igr2= 468, 469, 470, 472, 473, 474,
&end
#
# 27 PRO HD2 81 LEU QB 4.87
&rst
ixpk= 0, nxpk= 0, iat= 418, -1, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,
igr2=1248,1249,
&end
#
# 27 PRO HD2 81 LEU QQD 3.59
&rst
ixpk= 0, nxpk= 0, iat= 418, -1, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
igr2=1253,1254,1255,1257,1258,1259,
&end
#
# 27 PRO HD2 84 GLN QB 5.34
&rst
ixpk= 0, nxpk= 0, iat= 418, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2=1298,1299,
&end
#
# 27 PRO HD3 30 VAL QQG 5.22
&rst
ixpk= 0, nxpk= 0, iat= 419, -1, r1= 1.30, r2= 1.80, r3= 7.04, r4= 7.54,
igr2= 468, 469, 470, 472, 473, 474,
&end
#
# 27 PRO HD3 81 LEU QB 4.66
&rst
ixpk= 0, nxpk= 0, iat= 419, -1, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73,
igr2=1248,1249,
&end
#
# 27 PRO HD3 81 LEU QQD 3.93
&rst
ixpk= 0, nxpk= 0, iat= 419, -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr2=1253,1254,1255,1257,1258,1259,
&end
#
# 27 PRO HD3 84 GLN QB 5.34
&rst
ixpk= 0, nxpk= 0, iat= 419, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2=1298,1299,
&end
#
# 28 ILE H 29 ASP QB 5.18
&rst
ixpk= 0, nxpk= 0, iat= 431, -1, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
igr2= 454, 455,
&end
#
# 28 ILE H 30 VAL QQG 4.62
&rst
ixpk= 0, nxpk= 0, iat= 431, -1, r1= 1.30, r2= 1.80, r3= 6.23, r4= 6.73,
igr2= 468, 469, 470, 472, 473, 474,
&end
#
# 28 ILE HA 28 ILE QG1 3.16
&rst
ixpk= 0, nxpk= 0, iat= 433, -1, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05,
igr2= 441, 442,
&end
#
# 28 ILE HA 30 VAL QQG 5.36
&rst
ixpk= 0, nxpk= 0, iat= 433, -1, r1= 1.30, r2= 1.80, r3= 7.23, r4= 7.73,
igr2= 468, 469, 470, 472, 473, 474,
&end
#
# 28 ILE QG2 29 ASP QB 3.53
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
igr1= 437, 438, 439,
igr2= 454, 455,
&end
#
# 28 ILE QG1 29 ASP H 3.22
&rst
ixpk= 0, nxpk= 0, iat= -1, 450, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11,
igr1= 441, 442,
&end
#
# 28 ILE QG1 29 ASP HA 5.09
&rst
ixpk= 0, nxpk= 0, iat= -1, 452, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21,
igr1= 441, 442,
&end
#
# 28 ILE QG1 29 ASP QB 4.24
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr1= 441, 442,
igr2= 454, 455,
&end
#
# 28 ILE QG1 30 VAL H 4.72
&rst
ixpk= 0, nxpk= 0, iat= -1, 462, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr1= 441, 442,
&end
#
# 29 ASP H 29 ASP QB 3.32
&rst
ixpk= 0, nxpk= 0, iat= 450, -1, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23,
igr2= 454, 455,
&end
#
# 29 ASP H 30 VAL QQG 5.11
&rst
ixpk= 0, nxpk= 0, iat= 450, -1, r1= 1.30, r2= 1.80, r3= 6.89, r4= 7.39,
igr2= 468, 469, 470, 472, 473, 474,
&end
#
# 29 ASP QB 30 VAL H 3.87
&rst
ixpk= 0, nxpk= 0, iat= -1, 462, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,
igr1= 454, 455,
&end
#
# 29 ASP QB 30 VAL HB 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, 466, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1= 454, 455,
&end
#
# 29 ASP QB 30 VAL QQG 4.90
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr1= 454, 455,
igr2= 468, 469, 470, 472, 473, 474,
&end
#
# 30 VAL H 30 VAL QQG 2.81
&rst
ixpk= 0, nxpk= 0, iat= 462, -1, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,
igr2= 468, 469, 470, 472, 473, 474,
&end
#
# 30 VAL H 81 LEU QQD 5.44
&rst
ixpk= 0, nxpk= 0, iat= 462, -1, r1= 1.30, r2= 1.80, r3= 7.33, r4= 7.83,
igr2=1253,1254,1255,1257,1258,1259,
&end
#
# 30 VAL H 82 ARG QD 5.04
&rst
ixpk= 0, nxpk= 0, iat= 462, -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr2=1273,1274,
&end
#
# 30 VAL HA 81 LEU QB 5.34
&rst
ixpk= 0, nxpk= 0, iat= 464, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2=1248,1249,
&end
#
# 30 VAL HA 82 ARG QD 4.56
&rst
ixpk= 0, nxpk= 0, iat= 464, -1, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
igr2=1273,1274,
&end
#
# 30 VAL HB 82 ARG QD 3.96
&rst
ixpk= 0, nxpk= 0, iat= 466, -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
igr2=1273,1274,
&end
#
# 30 VAL QQG 31 THR H 3.23
&rst
ixpk= 0, nxpk= 0, iat= -1, 478, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,
igr1= 468, 469, 470, 472, 473, 474,
&end
#
# 30 VAL QQG 34 GLU H 4.36
&rst
ixpk= 0, nxpk= 0, iat= -1, 514, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
igr1= 468, 469, 470, 472, 473, 474,
&end
#
# 30 VAL QQG 34 GLU HA 5.44
&rst
ixpk= 0, nxpk= 0, iat= -1, 516, r1= 1.30, r2= 1.80, r3= 7.33, r4= 7.83,
igr1= 468, 469, 470, 472, 473, 474,
&end
#
# 30 VAL QQG 34 GLU QB 3.09
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
igr1= 468, 469, 470, 472, 473, 474,
igr2= 518, 519,
&end
#
# 30 VAL QQG 34 GLU QG 3.95
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
igr1= 468, 469, 470, 472, 473, 474,
igr2= 521, 522,
&end
#
# 30 VAL QQG 35 VAL H 3.89
&rst
ixpk= 0, nxpk= 0, iat= -1, 529, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr1= 468, 469, 470, 472, 473, 474,
&end
#
# 30 VAL QQG 82 ARG HA 5.15
&rst
ixpk= 0, nxpk= 0, iat= -1,1265, r1= 1.30, r2= 1.80, r3= 6.94, r4= 7.44,
igr1= 468, 469, 470, 472, 473, 474,
&end
#
# 30 VAL QQG 82 ARG QD 3.16
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
igr1= 468, 469, 470, 472, 473, 474,
igr2=1273,1274,
&end
#
# 30 VAL QQG 84 GLN H 4.39
&rst
ixpk= 0, nxpk= 0, iat= -1,1294, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
igr1= 468, 469, 470, 472, 473, 474,
&end
#
# 30 VAL QQG 84 GLN QB 3.89
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.89, r4= 6.39,
igr1= 468, 469, 470, 472, 473, 474,
igr2=1298,1299,
&end
#
# 31 THR H 34 GLU QB 4.51
&rst
ixpk= 0, nxpk= 0, iat= 478, -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
igr2= 518, 519,
&end
#
# 31 THR H 35 VAL QQG 5.44
&rst
ixpk= 0, nxpk= 0, iat= 478, -1, r1= 1.30, r2= 1.80, r3= 7.33, r4= 7.83,
igr2= 535, 536, 537, 539, 540, 541,
&end
#
# 31 THR H 81 LEU QQD 5.44
&rst
ixpk= 0, nxpk= 0, iat= 478, -1, r1= 1.30, r2= 1.80, r3= 7.33, r4= 7.83,
igr2=1253,1254,1255,1257,1258,1259,
&end
#
# 32 GLU H 32 GLU QG 4.66
&rst
ixpk= 0, nxpk= 0, iat= 492, -1, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73,
igr2= 499, 500,
&end
#
# 32 GLU H 48 LEU QQD 5.05
&rst
ixpk= 0, nxpk= 0, iat= 492, -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
igr2= 736, 737, 738, 740, 741, 742,
&end
#
# 32 GLU HA 32 GLU QG 3.57
&rst
ixpk= 0, nxpk= 0, iat= 494, -1, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,
igr2= 499, 500,
&end
#
# 32 GLU HA 35 VAL QQG 3.35
&rst
ixpk= 0, nxpk= 0, iat= 494, -1, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
igr2= 535, 536, 537, 539, 540, 541,
&end
#
# 32 GLU HA 48 LEU QQD 3.41
&rst
ixpk= 0, nxpk= 0, iat= 494, -1, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
igr2= 736, 737, 738, 740, 741, 742,
&end
#
# 32 GLU HA 50 MET QG 3.45
&rst
ixpk= 0, nxpk= 0, iat= 494, -1, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,
igr2= 772, 773,
&end
#
# 32 GLU QB 36 ILE QD1 4.29
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr1= 496, 497,
igr2= 558, 559, 560,
&end
#
# 32 GLU QB 48 LEU QQD 2.89
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
igr1= 496, 497,
igr2= 736, 737, 738, 740, 741, 742,
&end
#
# 32 GLU QB 107 ALA HA 4.72
&rst
ixpk= 0, nxpk= 0, iat= -1,1670, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr1= 496, 497,
&end
#
# 32 GLU QG 35 VAL QQG 4.84
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.32, r4= 7.82,
igr1= 499, 500,
igr2= 535, 536, 537, 539, 540, 541,
&end
#
# 32 GLU QG 48 LEU QQD 3.44
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,
igr1= 499, 500,
igr2= 736, 737, 738, 740, 741, 742,
&end
#
# 32 GLU QG 107 ALA H 5.22
&rst
ixpk= 0, nxpk= 0, iat= -1,1668, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
igr1= 499, 500,
&end
#
# 32 GLU QG 107 ALA HA 3.74
&rst
ixpk= 0, nxpk= 0, iat= -1,1670, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
igr1= 499, 500,
&end
#
# 32 GLU QG 110 ALA QB 3.21
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,
igr1= 499, 500,
igr2=1709,1710,1711,
&end
#
# 33 GLY H 48 LEU QQD 5.16
&rst
ixpk= 0, nxpk= 0, iat= 507, -1, r1= 1.30, r2= 1.80, r3= 6.96, r4= 7.46,
igr2= 736, 737, 738, 740, 741, 742,
&end
#
# 33 GLY HA2 36 ILE QG1 4.41
&rst
ixpk= 0, nxpk= 0, iat= 509, -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr2= 555, 556,
&end
#
# 33 GLY HA3 36 ILE QG1 5.34
&rst
ixpk= 0, nxpk= 0, iat= 510, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2= 555, 556,
&end
#
# 34 GLU H 35 VAL QQG 4.08
&rst
ixpk= 0, nxpk= 0, iat= 514, -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
igr2= 535, 536, 537, 539, 540, 541,
&end
#
# 34 GLU HA 81 LEU QQD 4.36
&rst
ixpk= 0, nxpk= 0, iat= 516, -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
igr2=1253,1254,1255,1257,1258,1259,
&end
#
# 34 GLU QB 35 VAL QQG 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.57, r4= 8.07,
igr1= 518, 519,
igr2= 535, 536, 537, 539, 540, 541,
&end
#
# 34 GLU QB 37 SER QB 4.93
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,
igr1= 518, 519,
igr2= 568, 569,
&end
#
# 34 GLU QB 81 LEU QQD 3.78
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
igr1= 518, 519,
igr2=1253,1254,1255,1257,1258,1259,
&end
#
# 34 GLU QG 81 LEU QB 5.01
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.31, r4= 6.81,
igr1= 521, 522,
igr2=1248,1249,
&end
#
# 34 GLU QG 81 LEU QQD 4.14
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.26, r4= 6.76,
igr1= 521, 522,
igr2=1253,1254,1255,1257,1258,1259,
&end
#
# 35 VAL H 35 VAL QQG 2.79
&rst
ixpk= 0, nxpk= 0, iat= 529, -1, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,
igr2= 535, 536, 537, 539, 540, 541,
&end
#
# 35 VAL H 36 ILE QG1 4.99
&rst
ixpk= 0, nxpk= 0, iat= 529, -1, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
igr2= 555, 556,
&end
#
# 35 VAL H 48 LEU QQD 5.44
&rst
ixpk= 0, nxpk= 0, iat= 529, -1, r1= 1.30, r2= 1.80, r3= 7.33, r4= 7.83,
igr2= 736, 737, 738, 740, 741, 742,
&end
#
# 35 VAL H 81 LEU QQD 4.37
&rst
ixpk= 0, nxpk= 0, iat= 529, -1, r1= 1.30, r2= 1.80, r3= 5.89, r4= 6.39,
igr2=1253,1254,1255,1257,1258,1259,
&end
#
# 35 VAL HA 35 VAL QQG 2.70
&rst
ixpk= 0, nxpk= 0, iat= 531, -1, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
igr2= 535, 536, 537, 539, 540, 541,
&end
#
# 35 VAL HA 38 LEU QQD 3.18
&rst
ixpk= 0, nxpk= 0, iat= 531, -1, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,
igr2= 584, 585, 586, 588, 589, 590,
&end
#
# 35 VAL HA 81 LEU QQD 3.18
&rst
ixpk= 0, nxpk= 0, iat= 531, -1, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,
igr2=1253,1254,1255,1257,1258,1259,
&end
#
# 35 VAL QQG 36 ILE QG1 4.36
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.60, r4= 7.10,
igr1= 535, 536, 537, 539, 540, 541,
igr2= 555, 556,
&end
#
# 35 VAL QQG 37 SER H 4.84
&rst
ixpk= 0, nxpk= 0, iat= -1, 564, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
igr1= 535, 536, 537, 539, 540, 541,
&end
#
# 35 VAL QQG 50 MET QG 3.72
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr1= 535, 536, 537, 539, 540, 541,
igr2= 772, 773,
&end
#
# 35 VAL QQG 50 MET QE 2.73
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
igr1= 535, 536, 537, 539, 540, 541,
igr2= 776, 777, 778,
&end
#
# 35 VAL QQG 57 ALA H 5.44
&rst
ixpk= 0, nxpk= 0, iat= -1, 883, r1= 1.30, r2= 1.80, r3= 7.33, r4= 7.83,
igr1= 535, 536, 537, 539, 540, 541,
&end
#
# 35 VAL QQG 57 ALA HA 5.21
&rst
ixpk= 0, nxpk= 0, iat= -1, 885, r1= 1.30, r2= 1.80, r3= 7.02, r4= 7.52,
igr1= 535, 536, 537, 539, 540, 541,
&end
#
# 36 ILE H 36 ILE QG1 4.01
&rst
ixpk= 0, nxpk= 0, iat= 545, -1, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
igr2= 555, 556,
&end
#
# 36 ILE H 38 LEU QQD 5.29
&rst
ixpk= 0, nxpk= 0, iat= 545, -1, r1= 1.30, r2= 1.80, r3= 7.13, r4= 7.63,
igr2= 584, 585, 586, 588, 589, 590,
&end
#
# 36 ILE H 48 LEU QQD 4.98
&rst
ixpk= 0, nxpk= 0, iat= 545, -1, r1= 1.30, r2= 1.80, r3= 6.71, r4= 7.21,
igr2= 736, 737, 738, 740, 741, 742,
&end
#
# 36 ILE HA 36 ILE QG1 3.74
&rst
ixpk= 0, nxpk= 0, iat= 547, -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
igr2= 555, 556,
&end
#
# 36 ILE HA 48 LEU QB 5.16
&rst
ixpk= 0, nxpk= 0, iat= 547, -1, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,
igr2= 731, 732,
&end
#
# 36 ILE HA 48 LEU QQD 4.27
&rst
ixpk= 0, nxpk= 0, iat= 547, -1, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
igr2= 736, 737, 738, 740, 741, 742,
&end
#
# 36 ILE QG1 48 LEU QQD 3.35
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
igr1= 555, 556,
igr2= 736, 737, 738, 740, 741, 742,
&end
#
# 36 ILE HG13 48 LEU QD1 5.77
&rst
ixpk= 0, nxpk= 0, iat= 556, -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
igr2= 736, 737, 738,
&end
#
# 36 ILE HG13 48 LEU QD2 5.77
&rst
ixpk= 0, nxpk= 0, iat= 556, -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
igr2= 740, 741, 742,
&end
#
# 37 SER QB 38 LEU QQD 4.29
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
igr1= 568, 569,
igr2= 584, 585, 586, 588, 589, 590,
&end
#
# 38 LEU H 38 LEU QQD 2.82
&rst
ixpk= 0, nxpk= 0, iat= 575, -1, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,
igr2= 584, 585, 586, 588, 589, 590,
&end
#
# 38 LEU H 39 GLY QA 5.24
&rst
ixpk= 0, nxpk= 0, iat= 575, -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
igr2= 596, 597,
&end
#
# 38 LEU HA 38 LEU QQD 3.27
&rst
ixpk= 0, nxpk= 0, iat= 577, -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
igr2= 584, 585, 586, 588, 589, 590,
&end
#
# 38 LEU HA 39 GLY QA 5.30
&rst
ixpk= 0, nxpk= 0, iat= 577, -1, r1= 1.30, r2= 1.80, r3= 5.95, r4= 6.45,
igr2= 596, 597,
&end
#
# 38 LEU QB 38 LEU QQD 2.70
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59,
igr1= 579, 580,
igr2= 584, 585, 586, 588, 589, 590,
&end
#
# 38 LEU QB 39 GLY QA 4.76
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr1= 579, 580,
igr2= 596, 597,
&end
#
# 38 LEU QB 74 TYR QE 3.61
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,
igr1= 579, 580,
igr2=1148,1153,
&end
#
# 38 LEU QQD 39 GLY H 4.03
&rst
ixpk= 0, nxpk= 0, iat= -1, 594, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
igr1= 584, 585, 586, 588, 589, 590,
&end
#
# 38 LEU QQD 39 GLY QA 3.35
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
igr1= 584, 585, 586, 588, 589, 590,
igr2= 596, 597,
&end
#
# 38 LEU QQD 70 MET QE 2.78
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
igr1= 584, 585, 586, 588, 589, 590,
igr2=1081,1082,1083,
&end
#
# 38 LEU QQD 74 TYR QD 3.88
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,
igr1= 584, 585, 586, 588, 589, 590,
igr2=1146,1155,
&end
#
# 38 LEU QQD 74 TYR QE 3.52
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
igr1= 584, 585, 586, 588, 589, 590,
igr2=1148,1153,
&end
#
# 39 GLY QA 40 LEU HA 5.01
&rst
ixpk= 0, nxpk= 0, iat= -1, 603, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
igr1= 596, 597,
&end
#
# 39 GLY QA 40 LEU QQD 5.27
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.97, r4= 8.47,
igr1= 596, 597,
igr2= 610, 611, 612, 614, 615, 616,
&end
#
# 39 GLY QA 42 PHE H 4.43
&rst
ixpk= 0, nxpk= 0, iat= -1, 634, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
igr1= 596, 597,
&end
#
# 39 GLY QA 42 PHE QD 4.13
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
igr1= 596, 597,
igr2= 642, 650,
&end
#
# 39 GLY QA 43 GLY H 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, 654, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1= 596, 597,
&end
#
# 39 GLY QA 45 VAL QQG 3.54
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
igr1= 596, 597,
igr2= 689, 690, 691, 693, 694, 695,
&end
#
# 39 GLY QA 59 ILE QD1 3.85
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
igr1= 596, 597,
igr2= 926, 927, 928,
&end
#
# 39 GLY QA 61 MET QE 3.49
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
igr1= 596, 597,
igr2= 958, 959, 960,
&end
#
# 39 GLY QA 70 MET QB 5.07
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.39, r4= 6.89,
igr1= 596, 597,
igr2=1074,1075,
&end
#
# 39 GLY QA 70 MET QE 3.19
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
igr1= 596, 597,
igr2=1081,1082,1083,
&end
#
# 40 LEU H 45 VAL QQG 4.43
&rst
ixpk= 0, nxpk= 0, iat= 601, -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr2= 689, 690, 691, 693, 694, 695,
&end
#
# 41 PRO QG 42 PHE H 4.47
&rst
ixpk= 0, nxpk= 0, iat= -1, 634, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
igr1= 624, 625,
&end
#
# 41 PRO QG 42 PHE QD 4.48
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14,
igr1= 624, 625,
igr2= 642, 650,
&end
#
# 42 PHE HB3 70 MET QB 4.57
&rst
ixpk= 0, nxpk= 0, iat= 639, -1, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
igr2=1074,1075,
&end
#
# 42 PHE QD 70 MET QB 4.65
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
igr1= 642, 650,
igr2=1074,1075,
&end
#
# 42 PHE QD 70 MET QG 4.83
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.09, r4= 6.59,
igr1= 642, 650,
igr2=1077,1078,
&end
#
# 42 PHE QE 73 TYR QB 4.92
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
igr1= 644, 648,
igr2=1121,1122,
&end
#
# 42 PHE HZ 73 TYR QB 3.97
&rst
ixpk= 0, nxpk= 0, iat= 646, -1, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
igr2=1121,1122,
&end
#
# 44 LYS H 44 LYS QG 4.10
&rst
ixpk= 0, nxpk= 0, iat= 661, -1, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
igr2= 668, 669,
&end
#
# 44 LYS H 45 VAL QQG 5.37
&rst
ixpk= 0, nxpk= 0, iat= 661, -1, r1= 1.30, r2= 1.80, r3= 7.24, r4= 7.74,
igr2= 689, 690, 691, 693, 694, 695,
&end
#
# 44 LYS HA 44 LYS QG 3.22
&rst
ixpk= 0, nxpk= 0, iat= 663, -1, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11,
igr2= 668, 669,
&end
#
# 44 LYS HA 45 VAL QQG 3.75
&rst
ixpk= 0, nxpk= 0, iat= 663, -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
igr2= 689, 690, 691, 693, 694, 695,
&end
#
# 44 LYS QG 44 LYS QE 2.48
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,
igr1= 668, 669,
igr2= 674, 675,
&end
#
# 44 LYS QG 45 VAL H 3.80
&rst
ixpk= 0, nxpk= 0, iat= -1, 683, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,
igr1= 668, 669,
&end
#
# 44 LYS QG 46 THR HA 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, 701, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1= 668, 669,
&end
#
# 44 LYS QG 46 THR HB 4.10
&rst
ixpk= 0, nxpk= 0, iat= -1, 703, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
igr1= 668, 669,
&end
#
# 44 LYS QG 62 ASN H 5.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 964, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
igr1= 668, 669,
&end
#
# 44 LYS QG 62 ASN HB2 4.21
&rst
ixpk= 0, nxpk= 0, iat= -1, 968, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
igr1= 668, 669,
&end
#
# 44 LYS QG 62 ASN HB3 3.39
&rst
ixpk= 0, nxpk= 0, iat= -1, 969, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,
igr1= 668, 669,
&end
#
# 44 LYS QG 63 THR H 4.97
&rst
ixpk= 0, nxpk= 0, iat= -1, 978, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr1= 668, 669,
&end
#
# 44 LYS QE 114 VAL QQG 5.21
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.88, r4= 8.38,
igr1= 674, 675,
igr2=1767,1768,1769,1771,1772,1773,
&end
#
# 45 VAL H 45 VAL QQG 2.98
&rst
ixpk= 0, nxpk= 0, iat= 683, -1, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,
igr2= 689, 690, 691, 693, 694, 695,
&end
#
# 45 VAL QQG 46 THR H 3.29
&rst
ixpk= 0, nxpk= 0, iat= -1, 699, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
igr1= 689, 690, 691, 693, 694, 695,
&end
#
# 45 VAL QQG 47 ASN HA 4.69
&rst
ixpk= 0, nxpk= 0, iat= -1, 715, r1= 1.30, r2= 1.80, r3= 6.32, r4= 6.82,
igr1= 689, 690, 691, 693, 694, 695,
&end
#
# 45 VAL QQG 47 ASN HB2 4.65
&rst
ixpk= 0, nxpk= 0, iat= -1, 717, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
igr1= 689, 690, 691, 693, 694, 695,
&end
#
# 45 VAL QQG 60 GLU H 4.30
&rst
ixpk= 0, nxpk= 0, iat= -1, 932, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
igr1= 689, 690, 691, 693, 694, 695,
&end
#
# 45 VAL QQG 61 MET HA 3.47
&rst
ixpk= 0, nxpk= 0, iat= -1, 949, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
igr1= 689, 690, 691, 693, 694, 695,
&end
#
# 47 ASN HA 47 ASN QD2 4.48
&rst
ixpk= 0, nxpk= 0, iat= 715, -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
igr2= 722, 723,
&end
#
# 47 ASN HA 48 LEU QB 4.65
&rst
ixpk= 0, nxpk= 0, iat= 715, -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
igr2= 731, 732,
&end
#
# 47 ASN HA 96 LEU QQD 4.40
&rst
ixpk= 0, nxpk= 0, iat= 715, -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr2=1509,1510,1511,1513,1514,1515,
&end
#
# 47 ASN HA 111 LEU QB 5.34
&rst
ixpk= 0, nxpk= 0, iat= 715, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2=1719,1720,
&end
#
# 47 ASN HA 111 LEU QQD 2.82
&rst
ixpk= 0, nxpk= 0, iat= 715, -1, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30,
igr2=1724,1725,1726,1728,1729,1730,
&end
#
# 47 ASN HB2 47 ASN QD2 3.44
&rst
ixpk= 0, nxpk= 0, iat= 717, -1, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,
igr2= 722, 723,
&end
#
# 47 ASN HB2 96 LEU QQD 3.49
&rst
ixpk= 0, nxpk= 0, iat= 717, -1, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
igr2=1509,1510,1511,1513,1514,1515,
&end
#
# 47 ASN HB2 111 LEU QQD 5.13
&rst
ixpk= 0, nxpk= 0, iat= 717, -1, r1= 1.30, r2= 1.80, r3= 6.92, r4= 7.42,
igr2=1724,1725,1726,1728,1729,1730,
&end
#
# 47 ASN HB3 47 ASN QD2 3.35
&rst
ixpk= 0, nxpk= 0, iat= 718, -1, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,
igr2= 722, 723,
&end
#
# 47 ASN HB3 96 LEU QQD 3.37
&rst
ixpk= 0, nxpk= 0, iat= 718, -1, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
igr2=1509,1510,1511,1513,1514,1515,
&end
#
# 47 ASN HB3 111 LEU QQD 4.23
&rst
ixpk= 0, nxpk= 0, iat= 718, -1, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr2=1724,1725,1726,1728,1729,1730,
&end
#
# 47 ASN QD2 48 LEU H 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, 727, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1= 722, 723,
&end
#
# 47 ASN QD2 60 GLU HB3 5.18
&rst
ixpk= 0, nxpk= 0, iat= -1, 937, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
igr1= 722, 723,
&end
#
# 47 ASN QD2 96 LEU H 5.10
&rst
ixpk= 0, nxpk= 0, iat= -1,1500, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
igr1= 722, 723,
&end
#
# 47 ASN QD2 96 LEU QB 4.03
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
igr1= 722, 723,
igr2=1504,1505,
&end
#
# 47 ASN QD2 96 LEU QQD 3.89
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.89, r4= 6.39,
igr1= 722, 723,
igr2=1509,1510,1511,1513,1514,1515,
&end
#
# 48 LEU H 48 LEU QQD 4.35
&rst
ixpk= 0, nxpk= 0, iat= 727, -1, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
igr2= 736, 737, 738, 740, 741, 742,
&end
#
# 48 LEU H 111 LEU QQD 3.83
&rst
ixpk= 0, nxpk= 0, iat= 727, -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
igr2=1724,1725,1726,1728,1729,1730,
&end
#
# 48 LEU HA 48 LEU QQD 3.00
&rst
ixpk= 0, nxpk= 0, iat= 729, -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
igr2= 736, 737, 738, 740, 741, 742,
&end
#
# 48 LEU HA 96 LEU QQD 3.91
&rst
ixpk= 0, nxpk= 0, iat= 729, -1, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77,
igr2=1509,1510,1511,1513,1514,1515,
&end
#
# 48 LEU QB 49 LEU H 4.16
&rst
ixpk= 0, nxpk= 0, iat= -1, 746, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
igr1= 731, 732,
&end
#
# 48 LEU QB 96 LEU QQD 4.66
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.05, r4= 7.55,
igr1= 731, 732,
igr2=1509,1510,1511,1513,1514,1515,
&end
#
# 48 LEU QB 107 ALA HA 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1,1670, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1= 731, 732,
&end
#
# 48 LEU HG 50 MET QG 4.25
&rst
ixpk= 0, nxpk= 0, iat= 734, -1, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
igr2= 772, 773,
&end
#
# 48 LEU QQD 49 LEU H 3.31
&rst
ixpk= 0, nxpk= 0, iat= -1, 746, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
igr1= 736, 737, 738, 740, 741, 742,
&end
#
# 48 LEU QQD 50 MET H 4.20
&rst
ixpk= 0, nxpk= 0, iat= -1, 765, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr1= 736, 737, 738, 740, 741, 742,
&end
#
# 48 LEU QQD 50 MET QB 4.33
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.55, r4= 7.05,
igr1= 736, 737, 738, 740, 741, 742,
igr2= 769, 770,
&end
#
# 48 LEU QQD 50 MET QG 2.99
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
igr1= 736, 737, 738, 740, 741, 742,
igr2= 772, 773,
&end
#
# 48 LEU QQD 106 ARG QD 5.44
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.23, r4= 8.73,
igr1= 736, 737, 738, 740, 741, 742,
igr2=1654,1655,
&end
#
# 48 LEU QQD 107 ALA H 4.88
&rst
ixpk= 0, nxpk= 0, iat= -1,1668, r1= 1.30, r2= 1.80, r3= 6.58, r4= 7.08,
igr1= 736, 737, 738, 740, 741, 742,
&end
#
# 48 LEU QQD 107 ALA HA 3.48
&rst
ixpk= 0, nxpk= 0, iat= -1,1670, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,
igr1= 736, 737, 738, 740, 741, 742,
&end
#
# 48 LEU QQD 109 ALA H 5.42
&rst
ixpk= 0, nxpk= 0, iat= -1,1695, r1= 1.30, r2= 1.80, r3= 7.31, r4= 7.81,
igr1= 736, 737, 738, 740, 741, 742,
&end
#
# 48 LEU QQD 110 ALA H 4.67
&rst
ixpk= 0, nxpk= 0, iat= -1,1705, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
igr1= 736, 737, 738, 740, 741, 742,
&end
#
# 48 LEU QQD 110 ALA HA 5.44
&rst
ixpk= 0, nxpk= 0, iat= -1,1707, r1= 1.30, r2= 1.80, r3= 7.33, r4= 7.83,
igr1= 736, 737, 738, 740, 741, 742,
&end
#
# 48 LEU QQD 111 LEU H 3.67
&rst
ixpk= 0, nxpk= 0, iat= -1,1715, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr1= 736, 737, 738, 740, 741, 742,
&end
#
# 48 LEU QQD 111 LEU QB 4.16
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.29, r4= 6.79,
igr1= 736, 737, 738, 740, 741, 742,
igr2=1719,1720,
&end
#
# 49 LEU H 96 LEU QQD 3.81
&rst
ixpk= 0, nxpk= 0, iat= 746, -1, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
igr2=1509,1510,1511,1513,1514,1515,
&end
#
# 49 LEU HA 49 LEU QQD 3.81
&rst
ixpk= 0, nxpk= 0, iat= 748, -1, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
igr2= 755, 756, 757, 759, 760, 761,
&end
#
# 49 LEU QB 58 PHE QB 4.23
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
igr1= 750, 751,
igr2= 897, 898,
&end
#
# 49 LEU QB 58 PHE QD 4.44
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.59, r4= 6.09,
igr1= 750, 751,
igr2= 901, 909,
&end
#
# 49 LEU QB 96 LEU QQD 3.87
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
igr1= 750, 751,
igr2=1509,1510,1511,1513,1514,1515,
&end
#
# 49 LEU QB 98 THR HB 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1,1545, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1= 750, 751,
&end
#
# 49 LEU QQD 50 MET H 4.26
&rst
ixpk= 0, nxpk= 0, iat= -1, 765, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
igr1= 755, 756, 757, 759, 760, 761,
&end
#
# 49 LEU QQD 58 PHE QB 4.44
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.72, r4= 7.22,
igr1= 755, 756, 757, 759, 760, 761,
igr2= 897, 898,
&end
#
# 49 LEU QQD 58 PHE QD 3.73
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14,
igr1= 755, 756, 757, 759, 760, 761,
igr2= 901, 909,
&end
#
# 49 LEU QQD 98 THR HA 4.93
&rst
ixpk= 0, nxpk= 0, iat= -1,1543, r1= 1.30, r2= 1.80, r3= 6.65, r4= 7.15,
igr1= 755, 756, 757, 759, 760, 761,
&end
#
# 49 LEU QQD 98 THR HB 4.18
&rst
ixpk= 0, nxpk= 0, iat= -1,1545, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr1= 755, 756, 757, 759, 760, 761,
&end
#
# 49 LEU QQD 99 ASP H 5.39
&rst
ixpk= 0, nxpk= 0, iat= -1,1555, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 755, 756, 757, 759, 760, 761,
&end
#
# 50 MET H 50 MET QG 3.74
&rst
ixpk= 0, nxpk= 0, iat= 765, -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
igr2= 772, 773,
&end
#
# 50 MET HA 50 MET QG 3.70
&rst
ixpk= 0, nxpk= 0, iat= 767, -1, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65,
igr2= 772, 773,
&end
#
# 50 MET QG 52 LYS QG 5.18
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.53, r4= 7.03,
igr1= 772, 773,
igr2= 808, 809,
&end
#
# 50 MET QG 57 ALA QB 4.35
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
igr1= 772, 773,
igr2= 887, 888, 889,
&end
#
# 50 MET QG 107 ALA QB 4.44
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1= 772, 773,
igr2=1672,1673,1674,
&end
#
# 51 LEU H 51 LEU QQD 4.20
&rst
ixpk= 0, nxpk= 0, iat= 782, -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr2= 791, 792, 793, 795, 796, 797,
&end
#
# 51 LEU HA 51 LEU QQD 3.78
&rst
ixpk= 0, nxpk= 0, iat= 784, -1, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
igr2= 791, 792, 793, 795, 796, 797,
&end
#
# 51 LEU QB 54 LYS H 4.07
&rst
ixpk= 0, nxpk= 0, iat= -1, 830, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,
igr1= 786, 787,
&end
#
# 51 LEU QB 55 ASN H 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, 852, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1= 786, 787,
&end
#
# 51 LEU QB 55 ASN HA 5.33
&rst
ixpk= 0, nxpk= 0, iat= -1, 854, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
igr1= 786, 787,
&end
#
# 51 LEU QB 56 GLN H 3.83
&rst
ixpk= 0, nxpk= 0, iat= -1, 866, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
igr1= 786, 787,
&end
#
# 51 LEU QQD 54 LYS QB 4.74
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.17, r4= 7.67,
igr1= 791, 792, 793, 795, 796, 797,
igr2= 834, 835,
&end
#
# 51 LEU QQD 54 LYS QE 3.79
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23,
igr1= 791, 792, 793, 795, 796, 797,
igr2= 843, 844,
&end
#
# 51 LEU QQD 56 GLN H 4.51
&rst
ixpk= 0, nxpk= 0, iat= -1, 866, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
igr1= 791, 792, 793, 795, 796, 797,
&end
#
# 51 LEU QQD 56 GLN HA 4.74
&rst
ixpk= 0, nxpk= 0, iat= -1, 868, r1= 1.30, r2= 1.80, r3= 6.39, r4= 6.89,
igr1= 791, 792, 793, 795, 796, 797,
&end
#
# 51 LEU QQD 56 GLN QB 4.15
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.28, r4= 6.78,
igr1= 791, 792, 793, 795, 796, 797,
igr2= 870, 871,
&end
#
# 51 LEU QQD 57 ALA H 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 883, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
igr1= 791, 792, 793, 795, 796, 797,
&end
#
# 51 LEU QQD 58 PHE QD 3.63
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
igr1= 791, 792, 793, 795, 796, 797,
igr2= 901, 909,
&end
#
# 52 LYS H 52 LYS QG 3.56
&rst
ixpk= 0, nxpk= 0, iat= 801, -1, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,
igr2= 808, 809,
&end
#
# 52 LYS HA 52 LYS QG 3.17
&rst
ixpk= 0, nxpk= 0, iat= 803, -1, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06,
igr2= 808, 809,
&end
#
# 52 LYS QB 53 GLY QA 4.98
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
igr1= 805, 806,
igr2= 825, 826,
&end
#
# 52 LYS QB 103 ASN QB 4.83
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.09, r4= 6.59,
igr1= 805, 806,
igr2=1607,1608,
&end
#
# 52 LYS QG 52 LYS QE 2.69
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89,
igr1= 808, 809,
igr2= 814, 815,
&end
#
# 55 ASN QB 56 GLN H 4.41
&rst
ixpk= 0, nxpk= 0, iat= -1, 866, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr1= 856, 857,
&end
#
# 56 GLN QB 57 ALA H 3.99
&rst
ixpk= 0, nxpk= 0, iat= -1, 883, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
igr1= 870, 871,
&end
#
# 58 PHE QB 96 LEU QQD 3.05
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
igr1= 897, 898,
igr2=1509,1510,1511,1513,1514,1515,
&end
#
# 58 PHE HB3 96 LEU QD2 5.22
&rst
ixpk= 0, nxpk= 0, iat= 898, -1, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
igr2=1513,1514,1515,
&end
#
# 58 PHE QD 96 LEU QQD 3.90
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
igr1= 901, 909,
igr2=1509,1510,1511,1513,1514,1515,
&end
#
# 60 GLU H 60 GLU QG 4.83
&rst
ixpk= 0, nxpk= 0, iat= 932, -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr2= 939, 940,
&end
#
# 60 GLU HA 96 LEU QQD 4.53
&rst
ixpk= 0, nxpk= 0, iat= 934, -1, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
igr2=1509,1510,1511,1513,1514,1515,
&end
#
# 60 GLU QG 61 MET H 3.61
&rst
ixpk= 0, nxpk= 0, iat= -1, 947, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,
igr1= 939, 940,
&end
#
# 60 GLU QG 95 GLU HA 3.99
&rst
ixpk= 0, nxpk= 0, iat= -1,1487, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
igr1= 939, 940,
&end
#
# 60 GLU QG 96 LEU H 4.39
&rst
ixpk= 0, nxpk= 0, iat= -1,1500, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,
igr1= 939, 940,
&end
#
# 61 MET QB 66 ALA H 5.07
&rst
ixpk= 0, nxpk= 0, iat= -1,1022, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
igr1= 951, 952,
&end
#
# 61 MET QB 67 ALA HA 4.61
&rst
ixpk= 0, nxpk= 0, iat= -1,1034, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67,
igr1= 951, 952,
&end
#
# 63 THR HB 65 GLU QB 4.12
&rst
ixpk= 0, nxpk= 0, iat= 982, -1, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
igr2=1011,1012,
&end
#
# 63 THR HB 65 GLU QG 4.36
&rst
ixpk= 0, nxpk= 0, iat= 982, -1, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
igr2=1014,1015,
&end
#
# 63 THR QG2 65 GLU QG 4.27
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
igr1= 984, 985, 986,
igr2=1014,1015,
&end
#
# 64 GLU HA 64 GLU QG 3.28
&rst
ixpk= 0, nxpk= 0, iat= 994, -1, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18,
igr2= 999,1000,
&end
#
# 64 GLU QG 67 ALA H 5.28
&rst
ixpk= 0, nxpk= 0, iat= -1,1032, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr1= 999,1000,
&end
#
# 65 GLU H 65 GLU QB 3.56
&rst
ixpk= 0, nxpk= 0, iat=1007, -1, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,
igr2=1011,1012,
&end
#
# 65 GLU H 65 GLU QG 3.52
&rst
ixpk= 0, nxpk= 0, iat=1007, -1, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
igr2=1014,1015,
&end
#
# 65 GLU HA 65 GLU QB 2.58
&rst
ixpk= 0, nxpk= 0, iat=1009, -1, r1= 1.30, r2= 1.80, r3= 2.90, r4= 3.40,
igr2=1011,1012,
&end
#
# 65 GLU HA 65 GLU QG 3.29
&rst
ixpk= 0, nxpk= 0, iat=1009, -1, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19,
igr2=1014,1015,
&end
#
# 65 GLU HA 68 ASN QB 3.37
&rst
ixpk= 0, nxpk= 0, iat=1009, -1, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,
igr2=1046,1047,
&end
#
# 65 GLU HA 68 ASN QD2 3.90
&rst
ixpk= 0, nxpk= 0, iat=1009, -1, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
igr2=1051,1052,
&end
#
# 65 GLU QB 66 ALA H 3.48
&rst
ixpk= 0, nxpk= 0, iat= -1,1022, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41,
igr1=1011,1012,
&end
#
# 65 GLU QB 67 ALA H 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1,1032, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1=1011,1012,
&end
#
# 65 GLU QB 68 ASN QB 4.35
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
igr1=1011,1012,
igr2=1046,1047,
&end
#
# 65 GLU QB 68 ASN QD2 4.65
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
igr1=1011,1012,
igr2=1051,1052,
&end
#
# 65 GLU QG 66 ALA H 3.52
&rst
ixpk= 0, nxpk= 0, iat= -1,1022, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
igr1=1014,1015,
&end
#
# 65 GLU QG 66 ALA HA 4.86
&rst
ixpk= 0, nxpk= 0, iat= -1,1024, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
igr1=1014,1015,
&end
#
# 65 GLU QG 68 ASN H 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1,1042, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1=1014,1015,
&end
#
# 67 ALA H 68 ASN QB 4.47
&rst
ixpk= 0, nxpk= 0, iat=1032, -1, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
igr2=1046,1047,
&end
#
# 67 ALA HA 71 VAL QQG 4.77
&rst
ixpk= 0, nxpk= 0, iat=1034, -1, r1= 1.30, r2= 1.80, r3= 6.43, r4= 6.93,
igr2=1093,1094,1095,1097,1098,1099,
&end
#
# 67 ALA QB 68 ASN QB 4.13
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
igr1=1036,1037,1038,
igr2=1046,1047,
&end
#
# 67 ALA QB 71 VAL QQG 4.18
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.77, r4= 7.27,
igr1=1036,1037,1038,
igr2=1093,1094,1095,1097,1098,1099,
&end
#
# 68 ASN H 68 ASN QD2 4.22
&rst
ixpk= 0, nxpk= 0, iat=1042, -1, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr2=1051,1052,
&end
#
# 68 ASN H 71 VAL QQG 5.44
&rst
ixpk= 0, nxpk= 0, iat=1042, -1, r1= 1.30, r2= 1.80, r3= 7.33, r4= 7.83,
igr2=1093,1094,1095,1097,1098,1099,
&end
#
# 68 ASN QB 68 ASN QD2 3.20
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,
igr1=1046,1047,
igr2=1051,1052,
&end
#
# 68 ASN QB 69 THR H 3.61
&rst
ixpk= 0, nxpk= 0, iat= -1,1056, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,
igr1=1046,1047,
&end
#
# 68 ASN QB 68 ASN QD2 3.20
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,
igr1=1046,1047,
igr2=1051,1052,
&end
#
# 68 ASN QD2 69 THR HA 4.76
&rst
ixpk= 0, nxpk= 0, iat= -1,1058, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr1=1051,1052,
&end
#
# 68 ASN QD2 69 THR QG2 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.20, r4= 7.70,
igr1=1051,1052,
igr2=1062,1063,1064,
&end
#
# 69 THR H 72 ASN QB 4.44
&rst
ixpk= 0, nxpk= 0, iat=1056, -1, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
igr2=1107,1108,
&end
#
# 69 THR HA 70 MET QB 5.34
&rst
ixpk= 0, nxpk= 0, iat=1058, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2=1074,1075,
&end
#
# 69 THR HA 72 ASN QB 3.02
&rst
ixpk= 0, nxpk= 0, iat=1058, -1, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89,
igr2=1107,1108,
&end
#
# 69 THR HB 70 MET QB 5.08
&rst
ixpk= 0, nxpk= 0, iat=1060, -1, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr2=1074,1075,
&end
#
# 69 THR HB 72 ASN QB 4.95
&rst
ixpk= 0, nxpk= 0, iat=1060, -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
igr2=1107,1108,
&end
#
# 69 THR QG2 72 ASN QB 3.43
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
igr1=1062,1063,1064,
igr2=1107,1108,
&end
#
# 70 MET H 70 MET QG 4.46
&rst
ixpk= 0, nxpk= 0, iat=1070, -1, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
igr2=1077,1078,
&end
#
# 70 MET H 72 ASN QB 4.74
&rst
ixpk= 0, nxpk= 0, iat=1070, -1, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
igr2=1107,1108,
&end
#
# 70 MET HA 71 VAL QQG 5.44
&rst
ixpk= 0, nxpk= 0, iat=1072, -1, r1= 1.30, r2= 1.80, r3= 7.33, r4= 7.83,
igr2=1093,1094,1095,1097,1098,1099,
&end
#
# 70 MET QB 71 VAL QQG 4.48
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.78, r4= 7.28,
igr1=1074,1075,
igr2=1093,1094,1095,1097,1098,1099,
&end
#
# 70 MET QB 74 TYR QD 4.11
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
igr1=1074,1075,
igr2=1146,1155,
&end
#
# 70 MET QG 71 VAL H 4.49
&rst
ixpk= 0, nxpk= 0, iat= -1,1087, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr1=1077,1078,
&end
#
# 70 MET QG 74 TYR QD 3.97
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,
igr1=1077,1078,
igr2=1146,1155,
&end
#
# 70 MET QG 74 TYR QE 3.81
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1=1077,1078,
igr2=1148,1153,
&end
#
# 70 MET QG 88 ILE QD1 4.28
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,
igr1=1077,1078,
igr2=1378,1379,1380,
&end
#
# 70 MET QE 71 VAL QQG 4.35
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.04, r4= 7.54,
igr1=1081,1082,1083,
igr2=1093,1094,1095,1097,1098,1099,
&end
#
# 70 MET QE 88 ILE QG1 4.49
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
igr1=1081,1082,1083,
igr2=1375,1376,
&end
#
# 71 VAL H 71 VAL QQG 2.83
&rst
ixpk= 0, nxpk= 0, iat=1087, -1, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,
igr2=1093,1094,1095,1097,1098,1099,
&end
#
# 71 VAL HA 71 VAL QQG 2.67
&rst
ixpk= 0, nxpk= 0, iat=1089, -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr2=1093,1094,1095,1097,1098,1099,
&end
#
# 71 VAL HA 88 ILE QG1 5.27
&rst
ixpk= 0, nxpk= 0, iat=1089, -1, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
igr2=1375,1376,
&end
#
# 71 VAL HB 72 ASN QB 5.34
&rst
ixpk= 0, nxpk= 0, iat=1091, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2=1107,1108,
&end
#
# 71 VAL QQG 72 ASN H 3.63
&rst
ixpk= 0, nxpk= 0, iat= -1,1103, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
igr1=1093,1094,1095,1097,1098,1099,
&end
#
# 71 VAL QQG 72 ASN HA 3.41
&rst
ixpk= 0, nxpk= 0, iat= -1,1105, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
igr1=1093,1094,1095,1097,1098,1099,
&end
#
# 71 VAL QQG 72 ASN QB 3.95
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
igr1=1093,1094,1095,1097,1098,1099,
igr2=1107,1108,
&end
#
# 71 VAL QQG 73 TYR H 4.61
&rst
ixpk= 0, nxpk= 0, iat= -1,1117, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,
igr1=1093,1094,1095,1097,1098,1099,
&end
#
# 71 VAL QQG 74 TYR HB2 5.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1142, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
igr1=1093,1094,1095,1097,1098,1099,
&end
#
# 71 VAL QQG 74 TYR QD 4.63
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.01, r4= 7.51,
igr1=1093,1094,1095,1097,1098,1099,
igr2=1146,1155,
&end
#
# 71 VAL QQG 75 THR H 4.51
&rst
ixpk= 0, nxpk= 0, iat= -1,1159, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
igr1=1093,1094,1095,1097,1098,1099,
&end
#
# 71 VAL QQG 75 THR HA 3.92
&rst
ixpk= 0, nxpk= 0, iat= -1,1161, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
igr1=1093,1094,1095,1097,1098,1099,
&end
#
# 71 VAL QQG 75 THR HB 5.04
&rst
ixpk= 0, nxpk= 0, iat= -1,1163, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1=1093,1094,1095,1097,1098,1099,
&end
#
# 71 VAL QQG 75 THR QG2 3.98
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,
igr1=1093,1094,1095,1097,1098,1099,
igr2=1165,1166,1167,
&end
#
# 71 VAL QQG 88 ILE HB 5.44
&rst
ixpk= 0, nxpk= 0, iat= -1,1369, r1= 1.30, r2= 1.80, r3= 7.33, r4= 7.83,
igr1=1093,1094,1095,1097,1098,1099,
&end
#
# 71 VAL QQG 88 ILE QG1 3.96
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1=1093,1094,1095,1097,1098,1099,
igr2=1375,1376,
&end
#
# 71 VAL QQG 89 GLN HA 4.36
&rst
ixpk= 0, nxpk= 0, iat= -1,1386, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
igr1=1093,1094,1095,1097,1098,1099,
&end
#
# 71 VAL QQG 90 PHE H 3.94
&rst
ixpk= 0, nxpk= 0, iat= -1,1401, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
igr1=1093,1094,1095,1097,1098,1099,
&end
#
# 71 VAL QQG 90 PHE QB 4.82
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.29, r4= 7.79,
igr1=1093,1094,1095,1097,1098,1099,
igr2=1405,1406,
&end
#
# 71 VAL QQG 90 PHE QD 3.58
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr1=1093,1094,1095,1097,1098,1099,
igr2=1409,1417,
&end
#
# 71 VAL QQG 90 PHE QE 3.08
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
igr1=1093,1094,1095,1097,1098,1099,
igr2=1411,1415,
&end
#
# 71 VAL QQG 90 PHE HZ 4.12
&rst
ixpk= 0, nxpk= 0, iat= -1,1413, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,
igr1=1093,1094,1095,1097,1098,1099,
&end
#
# 72 ASN QB 73 TYR H 3.37
&rst
ixpk= 0, nxpk= 0, iat= -1,1117, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,
igr1=1107,1108,
&end
#
# 72 ASN QB 73 TYR HA 4.89
&rst
ixpk= 0, nxpk= 0, iat= -1,1119, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
igr1=1107,1108,
&end
#
# 72 ASN QB 75 THR QG2 4.29
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr1=1107,1108,
igr2=1165,1166,1167,
&end
#
# 73 TYR H 73 TYR QB 3.52
&rst
ixpk= 0, nxpk= 0, iat=1117, -1, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
igr2=1121,1122,
&end
#
# 73 TYR HA 77 VAL QQG 4.78
&rst
ixpk= 0, nxpk= 0, iat=1119, -1, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,
igr2=1190,1191,1192,1194,1195,1196,
&end
#
# 73 TYR QB 74 TYR H 4.01
&rst
ixpk= 0, nxpk= 0, iat= -1,1138, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
igr1=1121,1122,
&end
#
# 74 TYR H 77 VAL QQG 5.27
&rst
ixpk= 0, nxpk= 0, iat=1138, -1, r1= 1.30, r2= 1.80, r3= 7.10, r4= 7.60,
igr2=1190,1191,1192,1194,1195,1196,
&end
#
# 74 TYR HA 77 VAL QQG 3.34
&rst
ixpk= 0, nxpk= 0, iat=1140, -1, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
igr2=1190,1191,1192,1194,1195,1196,
&end
#
# 74 TYR HB2 77 VAL QQG 5.44
&rst
ixpk= 0, nxpk= 0, iat=1142, -1, r1= 1.30, r2= 1.80, r3= 7.33, r4= 7.83,
igr2=1190,1191,1192,1194,1195,1196,
&end
#
# 74 TYR HB2 88 ILE QG1 4.60
&rst
ixpk= 0, nxpk= 0, iat=1142, -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
igr2=1375,1376,
&end
#
# 74 TYR HB3 77 VAL QQG 5.29
&rst
ixpk= 0, nxpk= 0, iat=1143, -1, r1= 1.30, r2= 1.80, r3= 7.13, r4= 7.63,
igr2=1190,1191,1192,1194,1195,1196,
&end
#
# 74 TYR HB3 88 ILE QG1 4.52
&rst
ixpk= 0, nxpk= 0, iat=1143, -1, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
igr2=1375,1376,
&end
#
# 74 TYR QD 77 VAL QQG 3.27
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr1=1146,1155,
igr2=1190,1191,1192,1194,1195,1196,
&end
#
# 74 TYR QE 77 VAL QQG 3.38
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,
igr1=1148,1153,
igr2=1190,1191,1192,1194,1195,1196,
&end
#
# 75 THR QG2 76 SER QB 4.12
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,
igr1=1165,1166,1167,
igr2=1177,1178,
&end
#
# 76 SER HA 77 VAL QQG 4.79
&rst
ixpk= 0, nxpk= 0, iat=1175, -1, r1= 1.30, r2= 1.80, r3= 6.46, r4= 6.96,
igr2=1190,1191,1192,1194,1195,1196,
&end
#
# 76 SER QB 77 VAL HB 5.29
&rst
ixpk= 0, nxpk= 0, iat= -1,1188, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
igr1=1177,1178,
&end
#
# 76 SER QB 77 VAL QQG 3.30
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,
igr1=1177,1178,
igr2=1190,1191,1192,1194,1195,1196,
&end
#
# 76 SER QB 77 VAL QQG 3.30
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,
igr1=1177,1178,
igr2=1190,1191,1192,1194,1195,1196,
&end
#
# 77 VAL H 77 VAL QQG 3.01
&rst
ixpk= 0, nxpk= 0, iat=1184, -1, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,
igr2=1190,1191,1192,1194,1195,1196,
&end
#
# 77 VAL HA 77 VAL QQG 2.45
&rst
ixpk= 0, nxpk= 0, iat=1186, -1, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80,
igr2=1190,1191,1192,1194,1195,1196,
&end
#
# 77 VAL QQG 78 THR H 2.96
&rst
ixpk= 0, nxpk= 0, iat= -1,1200, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,
igr1=1190,1191,1192,1194,1195,1196,
&end
#
# 77 VAL QQG 78 THR HA 3.48
&rst
ixpk= 0, nxpk= 0, iat= -1,1202, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,
igr1=1190,1191,1192,1194,1195,1196,
&end
#
# 77 VAL QQG 79 PRO HA 4.21
&rst
ixpk= 0, nxpk= 0, iat= -1,1224, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
igr1=1190,1191,1192,1194,1195,1196,
&end
#
# 77 VAL QQG 79 PRO HD3 4.70
&rst
ixpk= 0, nxpk= 0, iat= -1,1216, r1= 1.30, r2= 1.80, r3= 6.34, r4= 6.84,
igr1=1190,1191,1192,1194,1195,1196,
&end
#
# 79 PRO HA 80 VAL QQG 3.78
&rst
ixpk= 0, nxpk= 0, iat=1224, -1, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
igr2=1234,1235,1236,1238,1239,1240,
&end
#
# 80 VAL H 80 VAL QQG 3.01
&rst
ixpk= 0, nxpk= 0, iat=1228, -1, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,
igr2=1234,1235,1236,1238,1239,1240,
&end
#
# 80 VAL HA 80 VAL QQG 2.80
&rst
ixpk= 0, nxpk= 0, iat=1230, -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
igr2=1234,1235,1236,1238,1239,1240,
&end
#
# 80 VAL QQG 81 LEU H 2.83
&rst
ixpk= 0, nxpk= 0, iat= -1,1244, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,
igr1=1234,1235,1236,1238,1239,1240,
&end
#
# 80 VAL QQG 82 ARG H 5.17
&rst
ixpk= 0, nxpk= 0, iat= -1,1263, r1= 1.30, r2= 1.80, r3= 6.97, r4= 7.47,
igr1=1234,1235,1236,1238,1239,1240,
&end
#
# 80 VAL QQG 82 ARG HA 4.85
&rst
ixpk= 0, nxpk= 0, iat= -1,1265, r1= 1.30, r2= 1.80, r3= 6.54, r4= 7.04,
igr1=1234,1235,1236,1238,1239,1240,
&end
#
# 80 VAL QQG 83 GLY H 3.14
&rst
ixpk= 0, nxpk= 0, iat= -1,1287, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,
igr1=1234,1235,1236,1238,1239,1240,
&end
#
# 80 VAL QQG 83 GLY HA2 2.97
&rst
ixpk= 0, nxpk= 0, iat= -1,1289, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,
igr1=1234,1235,1236,1238,1239,1240,
&end
#
# 80 VAL QQG 83 GLY HA3 3.67
&rst
ixpk= 0, nxpk= 0, iat= -1,1290, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr1=1234,1235,1236,1238,1239,1240,
&end
#
# 80 VAL QQG 84 GLN H 2.81
&rst
ixpk= 0, nxpk= 0, iat= -1,1294, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,
igr1=1234,1235,1236,1238,1239,1240,
&end
#
# 80 VAL QQG 84 GLN HA 3.53
&rst
ixpk= 0, nxpk= 0, iat= -1,1296, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
igr1=1234,1235,1236,1238,1239,1240,
&end
#
# 80 VAL QQG 84 GLN QB 4.06
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.14, r4= 6.64,
igr1=1234,1235,1236,1238,1239,1240,
igr2=1298,1299,
&end
#
# 80 VAL QQG 84 GLN QG 4.58
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
igr1=1234,1235,1236,1238,1239,1240,
igr2=1301,1302,
&end
#
# 80 VAL QQG 85 PRO HA 3.39
&rst
ixpk= 0, nxpk= 0, iat= -1,1321, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,
igr1=1234,1235,1236,1238,1239,1240,
&end
#
# 80 VAL QQG 85 PRO HB2 4.25
&rst
ixpk= 0, nxpk= 0, iat= -1,1318, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23,
igr1=1234,1235,1236,1238,1239,1240,
&end
#
# 80 VAL QQG 85 PRO HB3 3.33
&rst
ixpk= 0, nxpk= 0, iat= -1,1319, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
igr1=1234,1235,1236,1238,1239,1240,
&end
#
# 80 VAL QQG 85 PRO HG2 5.27
&rst
ixpk= 0, nxpk= 0, iat= -1,1315, r1= 1.30, r2= 1.80, r3= 7.10, r4= 7.60,
igr1=1234,1235,1236,1238,1239,1240,
&end
#
# 80 VAL QQG 85 PRO HG3 4.15
&rst
ixpk= 0, nxpk= 0, iat= -1,1316, r1= 1.30, r2= 1.80, r3= 5.59, r4= 6.09,
igr1=1234,1235,1236,1238,1239,1240,
&end
#
# 80 VAL QQG 85 PRO HD2 4.20
&rst
ixpk= 0, nxpk= 0, iat= -1,1312, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr1=1234,1235,1236,1238,1239,1240,
&end
#
# 80 VAL QQG 85 PRO HD3 3.39
&rst
ixpk= 0, nxpk= 0, iat= -1,1313, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,
igr1=1234,1235,1236,1238,1239,1240,
&end
#
# 81 LEU H 81 LEU QB 3.25
&rst
ixpk= 0, nxpk= 0, iat=1244, -1, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15,
igr2=1248,1249,
&end
#
# 81 LEU H 81 LEU QQD 4.19
&rst
ixpk= 0, nxpk= 0, iat=1244, -1, r1= 1.30, r2= 1.80, r3= 5.65, r4= 6.15,
igr2=1253,1254,1255,1257,1258,1259,
&end
#
# 81 LEU H 84 GLN QB 4.18
&rst
ixpk= 0, nxpk= 0, iat=1244, -1, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,
igr2=1298,1299,
&end
#
# 81 LEU HA 81 LEU QQD 2.72
&rst
ixpk= 0, nxpk= 0, iat=1246, -1, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,
igr2=1253,1254,1255,1257,1258,1259,
&end
#
# 81 LEU QB 82 ARG HA 5.08
&rst
ixpk= 0, nxpk= 0, iat= -1,1265, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr1=1248,1249,
&end
#
# 81 LEU QB 82 ARG QD 5.18
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.53, r4= 7.03,
igr1=1248,1249,
igr2=1273,1274,
&end
#
# 81 LEU QB 82 ARG HE 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1,1276, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1=1248,1249,
&end
#
# 81 LEU QB 84 GLN H 4.46
&rst
ixpk= 0, nxpk= 0, iat= -1,1294, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
igr1=1248,1249,
&end
#
# 81 LEU QQD 82 ARG HA 5.44
&rst
ixpk= 0, nxpk= 0, iat= -1,1265, r1= 1.30, r2= 1.80, r3= 7.33, r4= 7.83,
igr1=1253,1254,1255,1257,1258,1259,
&end
#
# 82 ARG HA 82 ARG QD 4.59
&rst
ixpk= 0, nxpk= 0, iat=1265, -1, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
igr2=1273,1274,
&end
#
# 82 ARG QB 82 ARG QD 2.87
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.62, r4= 4.12,
igr1=1267,1268,
igr2=1273,1274,
&end
#
# 84 GLN H 84 GLN QB 3.04
&rst
ixpk= 0, nxpk= 0, iat=1294, -1, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91,
igr2=1298,1299,
&end
#
# 84 GLN QB 84 GLN HE22 3.96
&rst
ixpk= 0, nxpk= 0, iat= -1,1306, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
igr1=1298,1299,
&end
#
# 84 GLN QB 85 PRO HD2 3.69
&rst
ixpk= 0, nxpk= 0, iat= -1,1312, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,
igr1=1298,1299,
&end
#
# 84 GLN QB 85 PRO HD3 4.70
&rst
ixpk= 0, nxpk= 0, iat= -1,1313, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
igr1=1298,1299,
&end
#
# 84 GLN QB 86 ILE QG2 4.64
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75,
igr1=1298,1299,
igr2=1331,1332,1333,
&end
#
# 88 ILE H 88 ILE QG1 4.18
&rst
ixpk= 0, nxpk= 0, iat=1365, -1, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,
igr2=1375,1376,
&end
#
# 94 LYS HA 94 LYS QG 3.52
&rst
ixpk= 0, nxpk= 0, iat=1465, -1, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
igr2=1470,1471,
&end
#
# 94 LYS QB 94 LYS QE 3.81
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1=1467,1468,
igr2=1476,1477,
&end
#
# 94 LYS QB 95 GLU H 4.31
&rst
ixpk= 0, nxpk= 0, iat= -1,1485, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
igr1=1467,1468,
&end
#
# 94 LYS QG 94 LYS QE 2.51
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.16, r4= 3.66,
igr1=1470,1471,
igr2=1476,1477,
&end
#
# 95 GLU H 95 GLU QB 3.50
&rst
ixpk= 0, nxpk= 0, iat=1485, -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
igr2=1489,1490,
&end
#
# 95 GLU HA 96 LEU QQD 4.28
&rst
ixpk= 0, nxpk= 0, iat=1487, -1, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,
igr2=1509,1510,1511,1513,1514,1515,
&end
#
# 95 GLU QB 96 LEU H 3.44
&rst
ixpk= 0, nxpk= 0, iat= -1,1500, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,
igr1=1489,1490,
&end
#
# 96 LEU H 96 LEU QQD 3.90
&rst
ixpk= 0, nxpk= 0, iat=1500, -1, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr2=1509,1510,1511,1513,1514,1515,
&end
#
# 96 LEU HA 96 LEU QQD 3.44
&rst
ixpk= 0, nxpk= 0, iat=1502, -1, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
igr2=1509,1510,1511,1513,1514,1515,
&end
#
# 96 LEU QB 96 LEU QQD 2.84
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
igr1=1504,1505,
igr2=1509,1510,1511,1513,1514,1515,
&end
#
# 96 LEU QQD 107 ALA QB 5.26
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.52, r4= 9.02,
igr1=1509,1510,1511,1513,1514,1515,
igr2=1672,1673,1674,
&end
#
# 97 LYS H 97 LYS QG 4.83
&rst
ixpk= 0, nxpk= 0, iat=1519, -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr2=1526,1527,
&end
#
# 97 LYS QB 97 LYS QE 4.11
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
igr1=1523,1524,
igr2=1532,1533,
&end
#
# 97 LYS QG 97 LYS QE 3.55
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
igr1=1526,1527,
igr2=1532,1533,
&end
#
# 98 THR HB 104 GLN QG 4.71
&rst
ixpk= 0, nxpk= 0, iat=1545, -1, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,
igr2=1624,1625,
&end
#
# 98 THR QG2 104 GLN QG 4.23
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr1=1547,1548,1549,
igr2=1624,1625,
&end
#
# 101 SER H 102 PRO QD 4.86
&rst
ixpk= 0, nxpk= 0, iat=1578, -1, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
igr2=1590,1591,
&end
#
# 101 SER QB 104 GLN H 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1,1617, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1=1582,1583,
&end
#
# 102 PRO QB 103 ASN H 4.06
&rst
ixpk= 0, nxpk= 0, iat= -1,1603, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
igr1=1596,1597,
&end
#
# 104 GLN QB 107 ALA H 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1,1668, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1=1621,1622,
&end
#
# 106 ARG HA 106 ARG QG 3.03
&rst
ixpk= 0, nxpk= 0, iat=1646, -1, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,
igr2=1651,1652,
&end
#
# 108 GLN HA 111 LEU QB 3.46
&rst
ixpk= 0, nxpk= 0, iat=1680, -1, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,
igr2=1719,1720,
&end
#
# 108 GLN HA 111 LEU QQD 3.02
&rst
ixpk= 0, nxpk= 0, iat=1680, -1, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,
igr2=1724,1725,1726,1728,1729,1730,
&end
#
# 108 GLN QB 111 LEU QQD 4.64
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.02, r4= 7.52,
igr1=1682,1683,
igr2=1724,1725,1726,1728,1729,1730,
&end
#
# 108 GLN QG 111 LEU QB 4.97
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.26, r4= 6.76,
igr1=1685,1686,
igr2=1719,1720,
&end
#
# 108 GLN QG 111 LEU QQD 4.17
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.31, r4= 6.81,
igr1=1685,1686,
igr2=1724,1725,1726,1728,1729,1730,
&end
#
# 111 LEU H 111 LEU QB 3.35
&rst
ixpk= 0, nxpk= 0, iat=1715, -1, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,
igr2=1719,1720,
&end
#
# 111 LEU H 111 LEU QQD 4.66
&rst
ixpk= 0, nxpk= 0, iat=1715, -1, r1= 1.30, r2= 1.80, r3= 6.28, r4= 6.78,
igr2=1724,1725,1726,1728,1729,1730,
&end
#
# 111 LEU H 114 VAL QQG 4.41
&rst
ixpk= 0, nxpk= 0, iat=1715, -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
igr2=1767,1768,1769,1771,1772,1773,
&end
#
# 111 LEU HA 111 LEU QQD 2.70
&rst
ixpk= 0, nxpk= 0, iat=1717, -1, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
igr2=1724,1725,1726,1728,1729,1730,
&end
#
# 111 LEU QB 111 LEU QQD 2.60
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
igr1=1719,1720,
igr2=1724,1725,1726,1728,1729,1730,
&end
#
# 111 LEU QB 112 GLN H 4.07
&rst
ixpk= 0, nxpk= 0, iat= -1,1734, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,
igr1=1719,1720,
&end
#
# 111 LEU QB 112 GLN QG 4.16
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr1=1719,1720,
igr2=1741,1742,
&end
#
# 111 LEU QB 113 ALA H 4.88
&rst
ixpk= 0, nxpk= 0, iat= -1,1751, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
igr1=1719,1720,
&end
#
# 111 LEU QB 114 VAL H 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1,1761, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1=1719,1720,
&end
#
# 111 LEU QQD 112 GLN H 5.16
&rst
ixpk= 0, nxpk= 0, iat= -1,1734, r1= 1.30, r2= 1.80, r3= 6.96, r4= 7.46,
igr1=1724,1725,1726,1728,1729,1730,
&end
#
# 111 LEU QQD 112 GLN QG 4.23
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.40, r4= 6.90,
igr1=1724,1725,1726,1728,1729,1730,
igr2=1741,1742,
&end
#
# 112 GLN H 112 GLN QG 3.32
&rst
ixpk= 0, nxpk= 0, iat=1734, -1, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23,
igr2=1741,1742,
&end
#
# 112 GLN HA 112 GLN QG 2.80
&rst
ixpk= 0, nxpk= 0, iat=1736, -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
igr2=1741,1742,
&end
#
# 112 GLN HA 115 ASN QB 3.80
&rst
ixpk= 0, nxpk= 0, iat=1736, -1, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,
igr2=1781,1782,
&end
#
# 113 ALA H 114 VAL QQG 4.70
&rst
ixpk= 0, nxpk= 0, iat=1751, -1, r1= 1.30, r2= 1.80, r3= 6.34, r4= 6.84,
igr2=1767,1768,1769,1771,1772,1773,
&end
#
# 114 VAL H 114 VAL QQG 3.00
&rst
ixpk= 0, nxpk= 0, iat=1761, -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
igr2=1767,1768,1769,1771,1772,1773,
&end
#
# 114 VAL HA 114 VAL QQG 2.68
&rst
ixpk= 0, nxpk= 0, iat=1763, -1, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11,
igr2=1767,1768,1769,1771,1772,1773,
&end
#
# 114 VAL QQG 115 ASN HA 4.64
&rst
ixpk= 0, nxpk= 0, iat= -1,1779, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75,
igr1=1767,1768,1769,1771,1772,1773,
&end
#
# 114 VAL QQG 115 ASN QB 3.95
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
igr1=1767,1768,1769,1771,1772,1773,
igr2=1781,1782,
&end
#
# 115 ASN HA 115 ASN QB 2.57
&rst
ixpk= 0, nxpk= 0, iat=1779, -1, r1= 1.30, r2= 1.80, r3= 2.88, r4= 3.38,
igr2=1781,1782,
&end
#
# 115 ASN QB 115 ASN HD22 3.49
&rst
ixpk= 0, nxpk= 0, iat= -1,1786, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
igr1=1781,1782,
&end
#
# 115 ASN QB 116 SER QB 4.55
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23,
igr1=1781,1782,
igr2=1795,1796,
&end
#
# 117 VAL HA 117 VAL QQG 2.90
&rst
ixpk= 0, nxpk= 0, iat=1804, -1, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41,
igr2=1808,1809,1810,1812,1813,1814,
&end
#
# 117 VAL QQG 118 GLN HA 4.30
&rst
ixpk= 0, nxpk= 0, iat= -1,1820, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
igr1=1808,1809,1810,1812,1813,1814,
&end
#
# 117 VAL QQG 118 GLN QB 5.22
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.90, r4= 8.40,
igr1=1808,1809,1810,1812,1813,1814,
igr2=1822,1823,
&end
#
# 117 VAL QQG 118 GLN QG 3.82
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr1=1808,1809,1810,1812,1813,1814,
igr2=1825,1826,
&end
#
# 117 VAL QQG 119 SER HA 4.41
&rst
ixpk= 0, nxpk= 0, iat= -1,1837, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
igr1=1808,1809,1810,1812,1813,1814,
&end
#
# 117 VAL QQG 119 SER QB 3.82
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr1=1808,1809,1810,1812,1813,1814,
igr2=1839,1840,
&end
#
# 11 SER QB 134 RCYT H5 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2235, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
rk2=50, rk3=50, ir6=1, ialtd=0,
igr1= 157, 158,
&end
#
# 11 SER QB 134 RCYT H6 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2233, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 157, 158,
&end
#
# 12 ARG QD 133 URA H4' 6.0
&rst
ixpk= 0, nxpk= 0, iat= -1,2197, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1= 174, 175,
&end
#
# 12 ARG QD 134 RCYT H2' 6.0
&rst
ixpk= 0, nxpk= 0, iat= -1,2246, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1= 174, 175,
&end
#
# 12 ARG QD 134 RCYT H5 6.0
&rst
ixpk= 0, nxpk= 0, iat= -1,2235, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1= 174, 175,
&end
#
# 12 ARG QD 134 RCYT H6 6.0
&rst
ixpk= 0, nxpk= 0, iat= -1,2233, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1= 174, 175,
&end
#
# 12 ARG QD 134 RCYT H2' 6.0
&rst
ixpk= 0, nxpk= 0, iat= -1,2246, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1= 174, 175,
&end
#
# 25 LYS QE 132 RGUA H8 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2169, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr1= 389, 390,
&end
#
# 25 LYS HA 133 URA H5 5.50
&rst
ixpk= 0, nxpk= 0, iat= 378,2205, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 24 ARG QD 133 URA H1' 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2200, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr1= 362, 363,
&end
#
# 24 ARG QD 133 URA H5 4.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2205, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
igr1= 362, 363,
&end
#
# 24 ARG QD 133 URA H6 4.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2203, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
igr1= 362, 363,
&end
#
# 24 ARG QD 134 RCYT H5 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2235, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr1= 362, 363,
&end
#
# 25 LYS QD 133 URA H5 5.0
&rst
ixpk= 0, nxpk= 0, iat= -1,2205, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr1= 386, 387,
&end
#
# 25 LYS QE 133 URA H5 4.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2205, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
igr1= 389, 390,
&end
#
# 25 LYS QG 133 URA H5 5.5
&rst
ixpk= 0, nxpk= 0, iat= -1,2205, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 383, 384,
&end
#
# 58 PHE HZ 134 RCYT H1' 5.10
&rst
ixpk= 0, nxpk= 0, iat= 905,2230, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, &end
#
# 58 PHE HZ 134 RCYT H4' 5.10
&rst
ixpk= 0, nxpk= 0, iat= 905,2227, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, &end
#
# 58 PHE QD 134 RCYT H1' 5.10
&rst
ixpk= 0, nxpk= 0, iat= -1,2230, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
igr1= 901, 909,
&end
#
# 51 LEU QQD 134 RCYT H4' 5.60
&rst
ixpk= 0, nxpk= 0, iat= -1,2227, r1= 1.30, r2= 1.80, r3= 7.55, r4= 8.05,
igr1= 791, 792, 793, 795, 796, 797,
&end
#
# 58 PHE QE 134 RCYT H1' 5.10
&rst
ixpk= 0, nxpk= 0, iat= -1,2230, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
igr1= 903, 907,
&end
#
# 58 PHE QE 134 RCYT H4' 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2227, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 903, 907,
&end
#
# 51 LEU HA 135 URA H1' 5.50
&rst
ixpk= 0, nxpk= 0, iat= 784,2261, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 98 THR QG2 135 URA H1' 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2261, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr1=1547,1548,1549,
&end
#
# 98 THR HA 135 URA H3 5.00
&rst
ixpk= 0, nxpk= 0, iat=1543,2270, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 51 LEU HB2 135 URA H4' 5.50
&rst
ixpk= 0, nxpk= 0, iat= 786,2258, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 93 HIS HE1 135 URA H1' 6.00
&rst
ixpk= 0, nxpk= 0, iat=1455,2261, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 93 HIS HE1 135 URA H2' 4.50
&rst
ixpk= 0, nxpk= 0, iat=1455,2276, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 93 HIS HE1 135 URA H5' 5.40
&rst
ixpk= 0, nxpk= 0, iat=1455,2255, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90, &end
#
# 93 HIS HE1 135 URA H6 6.00
&rst
ixpk= 0, nxpk= 0, iat=1455,2264, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 51 LEU HG 135 URA H1' 5.10
&rst
ixpk= 0, nxpk= 0, iat= 789,2261, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, &end
#
# 51 LEU HG 135 URA H4' 5.00
&rst
ixpk= 0, nxpk= 0, iat= 789,2258, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 58 PHE HZ 135 URA H5' 4.40
&rst
ixpk= 0, nxpk= 0, iat= 905,2255, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 58 PHE HZ 135 URA H5" 5.10
&rst
ixpk= 0, nxpk= 0, iat= 905,2256, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, &end
#
# 58 PHE QD 135 URA H1' 5.10
&rst
ixpk= 0, nxpk= 0, iat= -1,2261, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
igr1= 901, 909,
&end
#
# 58 PHE QD 135 URA H5' 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2255, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr1= 901, 909,
&end
#
# 49 LEU QD2 135 URA H3 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2270, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 759, 760, 761,
&end
#
# 49 LEU QD2 135 URA H4' 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2258, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr1= 759, 760, 761,
&end
#
# 51 LEU QD2 135 URA H1' 4.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2261, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr1= 795, 796, 797,
&end
#
# 51 LEU QD2 135 URA H2' 4.90
&rst
ixpk= 0, nxpk= 0, iat= -1,2276, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
igr1= 795, 796, 797,
&end
#
# 51 LEU QD1 135 URA H3' 4.90
&rst
ixpk= 0, nxpk= 0, iat= -1,2274, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
igr1= 791, 792, 793,
&end
#
# 51 LEU QD1 135 URA H4' 4.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2258, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr1= 791, 792, 793,
&end
#
# 51 LEU QD1 135 URA H5' 4.20
&rst
ixpk= 0, nxpk= 0, iat= -1,2255, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr1= 791, 792, 793,
&end
#
# 51 LEU QD1 135 URA H5" 4.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2256, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr1= 791, 792, 793,
&end
#
# 96 LEU QD2 135 URA H3 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2270, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1=1513,1514,1515,
&end
#
# 96 LEU QD2 135 URA H6 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2264, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr1=1513,1514,1515,
&end
#
# 49 LEU QD2 135 URA H1' 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2261, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr1= 759, 760, 761,
&end
#
# 49 LEU QD2 135 URA H6 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2264, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 759, 760, 761,
&end
#
# 51 LEU QD1 135 URA H6 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2264, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr1= 791, 792, 793,
&end
#
# 54 LYS QE 135 URA H4' 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2258, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr1= 843, 844,
&end
#
# 54 LYS QE 135 URA H5' 5.40
&rst
ixpk= 0, nxpk= 0, iat= -1,2255, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
igr1= 843, 844,
&end
#
# 58 PHE QE 135 URA H4' 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2258, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 903, 907,
&end
#
# 58 PHE QE 135 URA H5' 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2255, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr1= 903, 907,
&end
#
# 58 PHE QE 135 URA H5" 5.40
&rst
ixpk= 0, nxpk= 0, iat= -1,2256, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
igr1= 903, 907,
&end
#
# 98 THR QG2 135 URA H3 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2270, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr1=1547,1548,1549,
&end
#
# 51 LEU QD1 136 URA H6 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2294, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr1= 791, 792, 793,
&end
#
# 51 LEU HA 136 URA H1' 5.00
&rst
ixpk= 0, nxpk= 0, iat= 784,2291, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 52 LYS HA 136 URA H1' 5.00
&rst
ixpk= 0, nxpk= 0, iat= 803,2291, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 99 ASP QB 136 URA H5 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2296, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr1=1559,1560,
&end
#
# 100 SER QB 136 URA H5 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2296, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr1=1571,1572,
&end
#
# 100 SER QB 136 URA H6 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2294, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1=1571,1572,
&end
#
# 101 SER QB 136 URA H5 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2296, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr1=1582,1583,
&end
#
# 51 LEU HB3 136 URA H1' 5.00
&rst
ixpk= 0, nxpk= 0, iat= 787,2291, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 51 LEU HB3 136 URA H4' 5.00
&rst
ixpk= 0, nxpk= 0, iat= 787,2288, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 51 LEU HB3 136 URA Q5' 5.50
&rst
ixpk= 0, nxpk= 0, iat= 787, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2=2285,2286,
&end
#
# 51 LEU HG 136 URA H1' 5.00
&rst
ixpk= 0, nxpk= 0, iat= 789,2291, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 51 LEU HG 136 URA H4' 5.00
&rst
ixpk= 0, nxpk= 0, iat= 789,2288, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 51 LEU HG 136 URA Q5' 5.50
&rst
ixpk= 0, nxpk= 0, iat= 789, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2=2285,2286,
&end
#
# 103 ASN QB 136 URA H1' 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2291, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr1=1607,1608,
&end
#
# 54 LYS QD 136 URA H1' 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2291, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1= 840, 841,
&end
#
# 54 LYS QD 136 URA H4' 4.90
&rst
ixpk= 0, nxpk= 0, iat= -1,2288, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
igr1= 840, 841,
&end
#
# 54 LYS QD 136 URA H5' 5.20
&rst
ixpk= 0, nxpk= 0, iat= -1,2285, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
igr1= 840, 841,
&end
#
# 54 LYS QB 136 URA H1' 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2291, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 834, 835,
&end
#
# 49 LEU QD1 136 URA H1' 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2291, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 755, 756, 757,
&end
#
# 51 LEU QD2 136 URA H2' 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2306, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 795, 796, 797,
&end
#
# 51 LEU QD2 136 URA H4' 4.90
&rst
ixpk= 0, nxpk= 0, iat= -1,2288, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
igr1= 795, 796, 797,
&end
#
# 51 LEU QD2 136 URA H5' 4.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2285, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr1= 795, 796, 797,
&end
#
# 49 LEU QD1 136 URA H5 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2296, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 755, 756, 757,
&end
#
# 51 LEU QD2 136 URA H1' 4.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2291, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr1= 795, 796, 797,
&end
#
# 51 LEU QD2 136 URA H2' 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2306, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr1= 795, 796, 797,
&end
#
# 51 LEU QD2 136 URA H3' 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2304, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr1= 795, 796, 797,
&end
#
# 51 LEU QD2 136 URA H4' 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2288, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr1= 795, 796, 797,
&end
#
# 54 LYS QE 136 URA H1' 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2291, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr1= 843, 844,
&end
#
# 54 LYS QE 136 URA H3' 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2304, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr1= 843, 844,
&end
#
# 54 LYS QE 136 URA H4' 4.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2288, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
igr1= 843, 844,
&end
#
# 54 LYS QE 136 URA H5' 4.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2285, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
igr1= 843, 844,
&end
#
# 54 LYS QE 136 URA Q5' 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
igr1= 843, 844,
igr2=2285,2286,
&end
#
# 54 LYS QG 136 URA H4' 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2288, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr1= 837, 838,
&end
#
# 54 LYS HA 137 URA H5 5.00
&rst
ixpk= 0, nxpk= 0, iat= 832,2326, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 54 LYS HA 137 URA H6 5.00
&rst
ixpk= 0, nxpk= 0, iat= 832,2324, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 53 GLY QA 136 URA H1' 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2291, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr1= 825, 826,
&end
#
# 54 LYS QE 137 URA H6 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2324, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr1= 843, 844,
&end
#
# 132 RGUA H1' 131 RGUA H2' 4.0
&rst
ixpk= 0, nxpk= 0, iat=2166,2151, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,
rk2=50, rk3=50, ir6=1, ialtd=0,
&end
#
# 132 RGUA H1' 132 RGUA H8 4.2
&rst
ixpk= 0, nxpk= 0, iat=2166,2169, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 132 RGUA H1' 133 URA H6 5.0
&rst
ixpk= 0, nxpk= 0, iat=2166,2203, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 132 RGUA H2' 132 RGUA H8 4.5
&rst
ixpk= 0, nxpk= 0, iat=2185,2169, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 132 RGUA H2' 133 URA H1' 4.9
&rst
ixpk= 0, nxpk= 0, iat=2185,2200, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40, &end
#
# 132 RGUA H2' 133 URA H5 4.3
&rst
ixpk= 0, nxpk= 0, iat=2185,2205, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80, &end
#
# 132 RGUA H2' 133 URA H6 3.6
&rst
ixpk= 0, nxpk= 0, iat=2185,2203, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10, &end
#
# 132 RGUA H2' 133 URA Q5' 4.2
&rst
ixpk= 0, nxpk= 0, iat=2185, -1, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
igr2=2194,2195,
&end
#
# 132 RGUA H3' 132 RGUA H8 4.1
&rst
ixpk= 0, nxpk= 0, iat=2183,2169, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60, &end
#
# 132 RGUA H3' 133 URA H5 4.4
&rst
ixpk= 0, nxpk= 0, iat=2183,2205, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 132 RGUA H3' 133 URA H6 4.0
&rst
ixpk= 0, nxpk= 0, iat=2183,2203, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 132 RGUA H4' 132 RGUA H8 4.7
&rst
ixpk= 0, nxpk= 0, iat=2163,2169, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 132 RGUA H5" 132 RGUA H8 4.7
&rst
ixpk= 0, nxpk= 0, iat=2161,2169, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 132 RGUA H5' 132 RGUA H8 4.6
&rst
ixpk= 0, nxpk= 0, iat=2160,2169, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 134 RCYT H2' 134 RCYT H5 4.6
&rst
ixpk= 0, nxpk= 0, iat=2246,2235, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 134 RCYT H2' 134 RCYT H6 3.5
&rst
ixpk= 0, nxpk= 0, iat=2246,2233, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 134 RCYT H4' 134 RCYT H5 6.0
&rst
ixpk= 0, nxpk= 0, iat=2227,2235, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 134 RCYT H4' 134 RCYT H6 4.8
&rst
ixpk= 0, nxpk= 0, iat=2227,2233, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30, &end
#
# 134 RCYT H5" 133 URA H1' 4.8
&rst
ixpk= 0, nxpk= 0, iat=2225,2200, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30, &end
#
# 134 RCYT H5" 134 RCYT H5 5.1
&rst
ixpk= 0, nxpk= 0, iat=2225,2235, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, &end
#
# 134 RCYT H5" 134 RCYT H6 4.6
&rst
ixpk= 0, nxpk= 0, iat=2225,2233, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 134 RCYT H5' 133 URA H1' 4.7
&rst
ixpk= 0, nxpk= 0, iat=2224,2200, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 134 RCYT H5' 134 RCYT H6 4.5
&rst
ixpk= 0, nxpk= 0, iat=2224,2233, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 136 URA H2' 136 URA H5 4.5
&rst
ixpk= 0, nxpk= 0, iat=2306,2296, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 136 URA H2' 136 URA H6 2.8
&rst
ixpk= 0, nxpk= 0, iat=2306,2294, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30, &end
#
# 136 URA H3' 136 URA H6 3.7
&rst
ixpk= 0, nxpk= 0, iat=2304,2294, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20, &end
#
# 136 URA H3' 137 URA H6 4.5
&rst
ixpk= 0, nxpk= 0, iat=2304,2324, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 136 URA H4' 136 URA H6 4.2
&rst
ixpk= 0, nxpk= 0, iat=2288,2294, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 136 URA H4' 137 URA H6 4.0
&rst
ixpk= 0, nxpk= 0, iat=2288,2324, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 136 URA H5' 136 URA H6 3.7
&rst
ixpk= 0, nxpk= 0, iat=2285,2294, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20, &end
#
# 138 RCYT H1' 137 URA H1' 5.0
&rst
ixpk= 0, nxpk= 0, iat=2351,2321, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 138 RCYT H1' 137 URA H2' 4.1
&rst
ixpk= 0, nxpk= 0, iat=2351,2336, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60, &end
#
# 138 RCYT H1' 138 RCYT H5 5.0
&rst
ixpk= 0, nxpk= 0, iat=2351,2356, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 138 RCYT H1' 138 RCYT H6 3.7
&rst
ixpk= 0, nxpk= 0, iat=2351,2354, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20, &end
#
# 138 RCYT H1' 139 RCYT H1' 5.0
&rst
ixpk= 0, nxpk= 0, iat=2351,2382, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 138 RCYT H2' 138 RCYT H6 4.5
&rst
ixpk= 0, nxpk= 0, iat=2367,2354, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 138 RCYT H3' 138 RCYT H5 5.1
&rst
ixpk= 0, nxpk= 0, iat=2365,2356, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, &end
#
# 138 RCYT H3' 138 RCYT H6 3.9
&rst
ixpk= 0, nxpk= 0, iat=2365,2354, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40, &end
#
# 138 RCYT H3' 139 RCYT H5 4.8
&rst
ixpk= 0, nxpk= 0, iat=2365,2387, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30, &end
#
# 138 RCYT H4' 138 RCYT H5 6.0
&rst
ixpk= 0, nxpk= 0, iat=2348,2356, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 138 RCYT H4' 138 RCYT H6 4.1
&rst
ixpk= 0, nxpk= 0, iat=2348,2354, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60, &end
#
# 138 RCYT H5" 138 RCYT H6 4.0
&rst
ixpk= 0, nxpk= 0, iat=2346,2354, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 138 RCYT H5' 138 RCYT H5 4.8
&rst
ixpk= 0, nxpk= 0, iat=2345,2356, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30, &end
#
# 138 RCYT H5' 138 RCYT H6 3.8
&rst
ixpk= 0, nxpk= 0, iat=2345,2354, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30, &end
#
# 133 URA H1' 133 URA H5 5.5
&rst
ixpk= 0, nxpk= 0, iat=2200,2205, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 133 URA H1' 133 URA H6 4.1
&rst
ixpk= 0, nxpk= 0, iat=2200,2203, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60, &end
#
# 133 URA H1' 134 RCYT H5 4.5
&rst
ixpk= 0, nxpk= 0, iat=2200,2235, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 133 URA H1' 134 RCYT H6 4.6
&rst
ixpk= 0, nxpk= 0, iat=2200,2233, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 133 URA H2' 133 URA H5 4.3
&rst
ixpk= 0, nxpk= 0, iat=2215,2205, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80, &end
#
# 133 URA H2' 133 URA H6 3.4
&rst
ixpk= 0, nxpk= 0, iat=2215,2203, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90, &end
#
# 133 URA H2' 134 RCYT H5 4.7
&rst
ixpk= 0, nxpk= 0, iat=2215,2235, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 133 URA H2' 134 RCYT H6 4.3
&rst
ixpk= 0, nxpk= 0, iat=2215,2233, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80, &end
#
# 133 URA H3' 133 URA H6 4.5
&rst
ixpk= 0, nxpk= 0, iat=2213,2203, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 133 URA H4' 133 URA H6 4.5
&rst
ixpk= 0, nxpk= 0, iat=2197,2203, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 133 URA H4' 134 RCYT H5 5.0
&rst
ixpk= 0, nxpk= 0, iat=2197,2235, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 133 URA H4' 134 RCYT H6 5.0
&rst
ixpk= 0, nxpk= 0, iat=2197,2233, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 133 URA H5" 133 URA H6 4.6
&rst
ixpk= 0, nxpk= 0, iat=2195,2203, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 133 URA H5' 132 RGUA H1' 4.7
&rst
ixpk= 0, nxpk= 0, iat=2194,2166, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 133 URA H5' 133 URA H6 4.4
&rst
ixpk= 0, nxpk= 0, iat=2194,2203, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 135 URA H1' 135 URA H6 3.9
&rst
ixpk= 0, nxpk= 0, iat=2261,2264, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40, &end
#
# 135 URA H1' 136 URA H6 3.9
&rst
ixpk= 0, nxpk= 0, iat=2261,2294, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40, &end
#
# 135 URA H1' 136 URA H5 3.5
&rst
ixpk= 0, nxpk= 0, iat=2261,2296, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 135 URA H2' 135 URA H6 3.3
&rst
ixpk= 0, nxpk= 0, iat=2276,2264, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80, &end
#
# 135 URA H3' 135 URA H6 4.6
&rst
ixpk= 0, nxpk= 0, iat=2274,2264, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 135 URA H3' 136 URA H6 5.4
&rst
ixpk= 0, nxpk= 0, iat=2274,2294, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90, &end
#
# 135 URA H4' 135 URA H6 5.0
&rst
ixpk= 0, nxpk= 0, iat=2258,2264, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 135 URA H4' 136 URA H6 4.3
&rst
ixpk= 0, nxpk= 0, iat=2258,2294, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80, &end
#
# 135 URA H5" 135 URA H6 4.9
&rst
ixpk= 0, nxpk= 0, iat=2256,2264, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40, &end
#
# 135 URA H5' 135 URA H6 4.4
&rst
ixpk= 0, nxpk= 0, iat=2255,2264, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 137 URA H1' 137 URA H5 5.5
&rst
ixpk= 0, nxpk= 0, iat=2321,2326, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 137 URA H1' 137 URA H6 3.3
&rst
ixpk= 0, nxpk= 0, iat=2321,2324, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80, &end
#
# 137 URA H1' 138 RCYT H1' 5.0
&rst
ixpk= 0, nxpk= 0, iat=2321,2351, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 137 URA H1' 138 RCYT H6 5.0
&rst
ixpk= 0, nxpk= 0, iat=2321,2354, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 137 URA H2' 137 URA H5 5.0
&rst
ixpk= 0, nxpk= 0, iat=2336,2326, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 137 URA H2' 137 URA H6 3.5
&rst
ixpk= 0, nxpk= 0, iat=2336,2324, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 137 URA H2' 138 RCYT H1' 4.6
&rst
ixpk= 0, nxpk= 0, iat=2336,2351, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 137 URA H2' 138 RCYT H5 4.5
&rst
ixpk= 0, nxpk= 0, iat=2336,2356, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 137 URA H2' 138 RCYT H6 3.5
&rst
ixpk= 0, nxpk= 0, iat=2336,2354, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 137 URA H3' 137 URA H5 5.4
&rst
ixpk= 0, nxpk= 0, iat=2334,2326, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90, &end
#
# 137 URA H3' 137 URA H6 3.6
&rst
ixpk= 0, nxpk= 0, iat=2334,2324, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10, &end
#
# 137 URA H3' 138 RCYT H5 4.4
&rst
ixpk= 0, nxpk= 0, iat=2334,2356, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 137 URA H3' 138 RCYT H6 3.8
&rst
ixpk= 0, nxpk= 0, iat=2334,2354, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30, &end
#
# 137 URA H4' 137 URA H5 6.0
&rst
ixpk= 0, nxpk= 0, iat=2318,2326, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 137 URA H4' 137 URA H6 4.2
&rst
ixpk= 0, nxpk= 0, iat=2318,2324, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 137 URA H4' 138 RCYT H5 6.0
&rst
ixpk= 0, nxpk= 0, iat=2318,2356, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 137 URA H4' 138 RCYT H6 5.0
&rst
ixpk= 0, nxpk= 0, iat=2318,2354, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 137 URA H5" 137 URA H5 4.4
&rst
ixpk= 0, nxpk= 0, iat=2316,2326, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 137 URA H5" 137 URA H6 3.6
&rst
ixpk= 0, nxpk= 0, iat=2316,2324, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10, &end
#
# 137 URA H5" 138 RCYT H5 4.5
&rst
ixpk= 0, nxpk= 0, iat=2316,2356, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 137 URA H5" 138 RCYT H6 4.2
&rst
ixpk= 0, nxpk= 0, iat=2316,2354, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 132 RGUA H8 133 URA H5 4.50
&rst
ixpk= 0, nxpk= 0, iat=2169,2205, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 132 RGUA H8 133 URA H6 5.00
&rst
ixpk= 0, nxpk= 0, iat=2169,2203, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 97 LYS O 135 URA H3 2.4
&rst
ixpk= 0, nxpk= 0, iat=1539,2270, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90, &end
#
# 97 LYS O 135 URA N3 3.4
&rst
ixpk= 0, nxpk= 0, iat=1539,2269, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90, &end
#
# 97 LYS H 135 URA O4 2.4
&rst
ixpk= 0, nxpk= 0, iat=1519,2268, r1= 1.30, r2= 1.80, r3= 2.40, r4= 2.90, &end
#
# 97 LYS N 135 URA O4 3.4
&rst
ixpk= 0, nxpk= 0, iat=1518,2268, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90, &end
#
# 21 ILE H 59 ILE O 1.8 2.3
&rst
ixpk= 0, nxpk= 0, iat= 297, 930, r1= 1.30, r2= 1.80, r3= 2.30, r4= 2.80,
rk2=50, rk3=50, ir6=1, ialtd=0,
&end
#
# 22 HIS H 89 GLN O 1.8 2.3
&rst
ixpk= 0, nxpk= 0, iat= 316,1399, r1= 1.30, r2= 1.80, r3= 2.30, r4= 2.80, &end
#
# 23 ILE H 57 ALA O 1.8 2.3
&rst
ixpk= 0, nxpk= 0, iat= 333, 891, r1= 1.30, r2= 1.80, r3= 2.30, r4= 2.80, &end
#
# 24 ARG H 87 TYR O 1.8 2.3
&rst
ixpk= 0, nxpk= 0, iat= 352,1363, r1= 1.30, r2= 1.80, r3= 2.30, r4= 2.80, &end
#
# 37 SER H 33 GLY O 1.8 2.3
&rst
ixpk= 0, nxpk= 0, iat= 564, 512, r1= 1.30, r2= 1.80, r3= 2.30, r4= 2.80, &end
#
# 38 LEU H 34 GLU O 1.8 2.3
&rst
ixpk= 0, nxpk= 0, iat= 575, 527, r1= 1.30, r2= 1.80, r3= 2.30, r4= 2.80, &end
#
# 47 ASN H 60 GLU O 1.8 2.3
&rst
ixpk= 0, nxpk= 0, iat= 713, 945, r1= 1.30, r2= 1.80, r3= 2.30, r4= 2.80, &end
#
# 49 LEU H 58 PHE O 1.8 2.3
&rst
ixpk= 0, nxpk= 0, iat= 746, 911, r1= 1.30, r2= 1.80, r3= 2.30, r4= 2.80, &end
#
# 57 ALA H 23 ILE O 1.8 2.3
&rst
ixpk= 0, nxpk= 0, iat= 883, 350, r1= 1.30, r2= 1.80, r3= 2.30, r4= 2.80, &end
#
# 58 PHE H 49 LEU O 1.8 2.3
&rst
ixpk= 0, nxpk= 0, iat= 893, 763, r1= 1.30, r2= 1.80, r3= 2.30, r4= 2.80, &end
#
# 59 ILE H 21 ILE O 1.8 2.3
&rst
ixpk= 0, nxpk= 0, iat= 913, 314, r1= 1.30, r2= 1.80, r3= 2.30, r4= 2.80, &end
#
# 67 ALA H 63 THR O 1.8 2.3
&rst
ixpk= 0, nxpk= 0, iat=1032, 990, r1= 1.30, r2= 1.80, r3= 2.30, r4= 2.80, &end
#
# 68 ASN H 64 GLU O 1.8 2.3
&rst
ixpk= 0, nxpk= 0, iat=1042,1005, r1= 1.30, r2= 1.80, r3= 2.30, r4= 2.80, &end
#
# 69 THR H 65 GLU O 1.8 2.3
&rst
ixpk= 0, nxpk= 0, iat=1056,1020, r1= 1.30, r2= 1.80, r3= 2.30, r4= 2.80, &end
#
# 70 MET H 66 ALA O 1.8 2.3
&rst
ixpk= 0, nxpk= 0, iat=1070,1030, r1= 1.30, r2= 1.80, r3= 2.30, r4= 2.80, &end
#
# 71 VAL H 67 ALA O 1.8 2.3
&rst
ixpk= 0, nxpk= 0, iat=1087,1040, r1= 1.30, r2= 1.80, r3= 2.30, r4= 2.80, &end
#
# 72 ASN H 68 ASN O 1.8 2.3
&rst
ixpk= 0, nxpk= 0, iat=1103,1054, r1= 1.30, r2= 1.80, r3= 2.30, r4= 2.80, &end
#
# 73 TYR H 69 THR O 1.8 2.3
&rst
ixpk= 0, nxpk= 0, iat=1117,1068, r1= 1.30, r2= 1.80, r3= 2.30, r4= 2.80, &end
#
# 74 TYR H 70 MET O 1.8 2.3
&rst
ixpk= 0, nxpk= 0, iat=1138,1085, r1= 1.30, r2= 1.80, r3= 2.30, r4= 2.80, &end
#
# 124 RGUA H21 146 RCYT O2 1.80 2.00
&rst
ixpk= 0, nxpk= 0, iat=1917,2618, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end
#
# 124 RGUA H1 146 RCYT N3 1.80 2.00
&rst
ixpk= 0, nxpk= 0, iat=1914,2616, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end
#
# 124 RGUA O6 146 RCYT H41 1.80 2.00
&rst
ixpk= 0, nxpk= 0, iat=1912,2614, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end
#
# 125 RGUA H21 145 RCYT O2 1.80 2.00
&rst
ixpk= 0, nxpk= 0, iat=1951,2587, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end
#
# 125 RGUA H1 145 RCYT N3 1.80 2.00
&rst
ixpk= 0, nxpk= 0, iat=1948,2585, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end
#
# 125 RGUA O6 145 RCYT H41 1.80 2.00
&rst
ixpk= 0, nxpk= 0, iat=1946,2583, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end
#
# 126 RGUA H21 144 RCYT O2 1.80 2.00
&rst
ixpk= 0, nxpk= 0, iat=1985,2556, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end
#
# 126 RGUA H1 144 RCYT N3 1.80 2.00
&rst
ixpk= 0, nxpk= 0, iat=1982,2554, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end
#
# 126 RGUA O6 144 RCYT H41 1.80 2.00
&rst
ixpk= 0, nxpk= 0, iat=1980,2552, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end
#
# 127 RADE N1 143 URA H3 1.80 2.00
&rst
ixpk= 0, nxpk= 0, iat=2017,2523, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end
#
# 127 RADE H61 143 URA O4 1.80 2.00
&rst
ixpk= 0, nxpk= 0, iat=2015,2521, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end
#
# 142 RGUA H21 128 RCYT O2 1.80 2.00
&rst
ixpk= 0, nxpk= 0, iat=2492,2052, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end
#
# 142 RGUA H1 128 RCYT N3 1.80 2.00
&rst
ixpk= 0, nxpk= 0, iat=2489,2050, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end
#
# 142 RGUA O6 128 RCYT H41 1.80 2.00
&rst
ixpk= 0, nxpk= 0, iat=2487,2048, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end
#
# 141 RGUA H21 129 RCYT O2 1.80 2.00
&rst
ixpk= 0, nxpk= 0, iat=2458,2083, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end
#
# 141 RGUA H1 129 RCYT N3 1.80 2.00
&rst
ixpk= 0, nxpk= 0, iat=2455,2081, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end
#
# 141 RGUA O6 129 RCYT H41 1.80 2.00
&rst
ixpk= 0, nxpk= 0, iat=2453,2079, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end
#
# 140 RADE N1 130 URA H3 1.80 2.00
&rst
ixpk= 0, nxpk= 0, iat=2423,2111, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end
#
# 140 RADE H61 130 URA O4 1.80 2.00
&rst
ixpk= 0, nxpk= 0, iat=2421,2109, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end
#
# 131 RGUA H21 139 RCYT O2 1.80 2.00
&rst
ixpk= 0, nxpk= 0, iat=2144,2394, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end
#
# 131 RGUA H1 139 RCYT N3 1.80 2.00
&rst
ixpk= 0, nxpk= 0, iat=2141,2392, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end
#
# 131 RGUA O6 139 RCYT H41 1.80 2.00
&rst
ixpk= 0, nxpk= 0, iat=2139,2390, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end
#
# 132 RGUA H21 138 RCYT O2 1.80 2.00
&rst
ixpk= 0, nxpk= 0, iat=2178,2363, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end
#
# 132 RGUA H1 138 RCYT N3 1.80 2.00
&rst
ixpk= 0, nxpk= 0, iat=2175,2361, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end
#
# 132 RGUA O6 138 RCYT H41 1.80 2.00
&rst
ixpk= 0, nxpk= 0, iat=2173,2359, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end
#
# 133 URA H3 137 URA O4 1.8 2.5
&rst
ixpk= 0, nxpk= 0, iat=2209,2328, r1= 1.30, r2= 1.80, r3= 2.50, r4= 3.00, &end
#
# 133 URA O2 137 URA H3 1.8 2.5
&rst
ixpk= 0, nxpk= 0, iat=2211,2330, r1= 1.30, r2= 1.80, r3= 2.50, r4= 3.00, &end
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