NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
588695 |
2ruu   |
11475 | cing | 1-original | 3 | AMBER | distance | NOE | simple |
#
# 8 LYS HA 10 TYR HN 4.52
&rst
ixpk= 0, nxpk= 0, iat= 71, 105, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
rk2 = 32.0, rk3 = 32.0, ir6=1, ialtd=0,
&end
#
# 8 LYS HA 18 ALA QB 4.71
&rst
ixpk= 0, nxpk= 0, iat= 71, -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr2= 235, 236, 237,
&end
#
# 8 LYS HA 20 ALA HA 3.83
&rst
ixpk= 0, nxpk= 0, iat= 71, 254, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33, &end
#
# 8 LYS HA 20 ALA QB 3.98
&rst
ixpk= 0, nxpk= 0, iat= 71, -1, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
igr2= 256, 257, 258,
&end
#
# 8 LYS HA 8 LYS HD2 4.66
&rst
ixpk= 0, nxpk= 0, iat= 71, 79, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16, &end
#
# 8 LYS HA 8 LYS HD3 4.66
&rst
ixpk= 0, nxpk= 0, iat= 71, 80, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16, &end
#
# 8 LYS HA 8 LYS HG2 4.05
&rst
ixpk= 0, nxpk= 0, iat= 71, 76, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55, &end
#
# 8 LYS HA 8 LYS HG3 4.05
&rst
ixpk= 0, nxpk= 0, iat= 71, 77, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55, &end
#
# 8 LYS HA 8 LYS QG 3.46
&rst
ixpk= 0, nxpk= 0, iat= 71, -1, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,
igr2= 76, 77,
&end
#
# 8 LYS HA 9 PRO HB3 5.10
&rst
ixpk= 0, nxpk= 0, iat= 71, 99, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, &end
#
# 8 LYS HA 9 PRO HD2 3.18
&rst
ixpk= 0, nxpk= 0, iat= 71, 92, r1= 1.30, r2= 1.80, r3= 3.18, r4= 3.68, &end
#
# 8 LYS HA 9 PRO HD3 3.17
&rst
ixpk= 0, nxpk= 0, iat= 71, 93, r1= 1.30, r2= 1.80, r3= 3.17, r4= 3.67, &end
#
# 8 LYS HA 9 PRO HG2 4.68
&rst
ixpk= 0, nxpk= 0, iat= 71, 95, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18, &end
#
# 8 LYS HB2 18 ALA QB 3.52
&rst
ixpk= 0, nxpk= 0, iat= 73, -1, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,
igr2= 235, 236, 237,
&end
#
# 8 LYS HB2 19 SER HA 5.12
&rst
ixpk= 0, nxpk= 0, iat= 73, 243, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, &end
#
# 8 LYS HB2 19 SER HN 4.25
&rst
ixpk= 0, nxpk= 0, iat= 73, 241, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75, &end
#
# 8 LYS HB2 8 LYS QE 4.85
&rst
ixpk= 0, nxpk= 0, iat= 73, -1, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
igr2= 82, 83,
&end
#
# 8 LYS HB3 18 ALA QB 3.52
&rst
ixpk= 0, nxpk= 0, iat= 74, -1, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,
igr2= 235, 236, 237,
&end
#
# 8 LYS HB3 19 SER HA 5.12
&rst
ixpk= 0, nxpk= 0, iat= 74, 243, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, &end
#
# 8 LYS HB3 19 SER HN 4.25
&rst
ixpk= 0, nxpk= 0, iat= 74, 241, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75, &end
#
# 8 LYS HB3 8 LYS QE 4.85
&rst
ixpk= 0, nxpk= 0, iat= 74, -1, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
igr2= 82, 83,
&end
#
# 8 LYS HD2 19 SER HA 4.72
&rst
ixpk= 0, nxpk= 0, iat= 79, 243, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22, &end
#
# 8 LYS HD3 19 SER HA 4.72
&rst
ixpk= 0, nxpk= 0, iat= 80, 243, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22, &end
#
# 8 LYS HG2 20 ALA QB 4.80
&rst
ixpk= 0, nxpk= 0, iat= 76, -1, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
igr2= 256, 257, 258,
&end
#
# 8 LYS HG2 8 LYS QE 3.50
&rst
ixpk= 0, nxpk= 0, iat= 76, -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
igr2= 82, 83,
&end
#
# 8 LYS HG2 9 PRO HD2 4.73
&rst
ixpk= 0, nxpk= 0, iat= 76, 92, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, &end
#
# 8 LYS HG3 20 ALA QB 4.80
&rst
ixpk= 0, nxpk= 0, iat= 77, -1, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
igr2= 256, 257, 258,
&end
#
# 8 LYS HG3 8 LYS QE 3.50
&rst
ixpk= 0, nxpk= 0, iat= 77, -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
igr2= 82, 83,
&end
#
# 8 LYS HG3 9 PRO HD2 4.73
&rst
ixpk= 0, nxpk= 0, iat= 77, 92, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, &end
#
# 8 LYS QB 10 TYR HN 4.49
&rst
ixpk= 0, nxpk= 0, iat= -1, 105, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr1= 73, 74,
&end
#
# 8 LYS QB 10 TYR QB 5.06
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.38, r4= 6.88,
igr1= 73, 74,
igr2= 109, 110,
&end
#
# 8 LYS QB 18 ALA QB 3.03
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,
igr1= 73, 74,
igr2= 235, 236, 237,
&end
#
# 8 LYS QB 19 SER HN 3.73
&rst
ixpk= 0, nxpk= 0, iat= -1, 241, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,
igr1= 73, 74,
&end
#
# 8 LYS QB 20 ALA QB 4.46
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51,
igr1= 73, 74,
igr2= 256, 257, 258,
&end
#
# 8 LYS QB 8 LYS QD 3.09
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,
igr1= 73, 74,
igr2= 79, 80,
&end
#
# 8 LYS QB 8 LYS QE 4.20
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,
igr1= 73, 74,
igr2= 82, 83,
&end
#
# 8 LYS QB 9 PRO HD2 3.98
&rst
ixpk= 0, nxpk= 0, iat= -1, 92, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
igr1= 73, 74,
&end
#
# 8 LYS QB 9 PRO HD3 4.39
&rst
ixpk= 0, nxpk= 0, iat= -1, 93, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,
igr1= 73, 74,
&end
#
# 8 LYS QD 19 SER HA 4.11
&rst
ixpk= 0, nxpk= 0, iat= -1, 243, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
igr1= 79, 80,
&end
#
# 8 LYS QD 19 SER QB 4.99
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.29, r4= 6.79,
igr1= 79, 80,
igr2= 245, 246,
&end
#
# 8 LYS QE 19 SER HA 4.47
&rst
ixpk= 0, nxpk= 0, iat= -1, 243, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
igr1= 82, 83,
&end
#
# 8 LYS QE 20 ALA QB 4.29
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr1= 82, 83,
igr2= 256, 257, 258,
&end
#
# 8 LYS QG 18 ALA QB 3.94
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
igr1= 76, 77,
igr2= 235, 236, 237,
&end
#
# 8 LYS QG 19 SER HA 4.34
&rst
ixpk= 0, nxpk= 0, iat= -1, 243, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,
igr1= 76, 77,
&end
#
# 8 LYS QG 20 ALA QB 4.11
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
igr1= 76, 77,
igr2= 256, 257, 258,
&end
#
# 8 LYS QG 9 PRO HD2 4.04
&rst
ixpk= 0, nxpk= 0, iat= -1, 92, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
igr1= 76, 77,
&end
#
# 9 PRO HA 10 TYR HA 4.76
&rst
ixpk= 0, nxpk= 0, iat= 101, 107, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26, &end
#
# 9 PRO HA 11 LYS QD 5.24
&rst
ixpk= 0, nxpk= 0, iat= 101, -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
igr2= 136, 137,
&end
#
# 9 PRO HA 11 LYS QE 4.09
&rst
ixpk= 0, nxpk= 0, iat= 101, -1, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
igr2= 139, 140,
&end
#
# 9 PRO HB2 10 TYR HA 4.61
&rst
ixpk= 0, nxpk= 0, iat= 98, 107, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 9 PRO HB2 10 TYR HN 4.00
&rst
ixpk= 0, nxpk= 0, iat= 98, 105, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 9 PRO HB2 10 TYR QB 5.02
&rst
ixpk= 0, nxpk= 0, iat= 98, -1, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr2= 109, 110,
&end
#
# 9 PRO HB2 10 TYR QD 4.47
&rst
ixpk= 0, nxpk= 0, iat= 98, -1, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
igr2= 113, 122,
&end
#
# 9 PRO HB2 10 TYR QE 4.57
&rst
ixpk= 0, nxpk= 0, iat= 98, -1, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
igr2= 115, 120,
&end
#
# 9 PRO HB3 10 TYR HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= 99, 107, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 9 PRO HB3 10 TYR HN 4.40
&rst
ixpk= 0, nxpk= 0, iat= 99, 105, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 9 PRO HD2 10 TYR HN 3.96
&rst
ixpk= 0, nxpk= 0, iat= 92, 105, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46, &end
#
# 9 PRO HD2 10 TYR QB 4.74
&rst
ixpk= 0, nxpk= 0, iat= 92, -1, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
igr2= 109, 110,
&end
#
# 9 PRO HD2 10 TYR QD 4.54
&rst
ixpk= 0, nxpk= 0, iat= 92, -1, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
igr2= 113, 122,
&end
#
# 9 PRO HD2 18 ALA QB 5.12
&rst
ixpk= 0, nxpk= 0, iat= 92, -1, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
igr2= 235, 236, 237,
&end
#
# 9 PRO HD2 20 ALA HA 3.36
&rst
ixpk= 0, nxpk= 0, iat= 92, 254, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86, &end
#
# 9 PRO HD2 20 ALA QB 3.76
&rst
ixpk= 0, nxpk= 0, iat= 92, -1, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
igr2= 256, 257, 258,
&end
#
# 9 PRO HD3 10 TYR HN 4.29
&rst
ixpk= 0, nxpk= 0, iat= 93, 105, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79, &end
#
# 9 PRO HD3 10 TYR QD 4.58
&rst
ixpk= 0, nxpk= 0, iat= 93, -1, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
igr2= 113, 122,
&end
#
# 9 PRO HD3 20 ALA HA 4.02
&rst
ixpk= 0, nxpk= 0, iat= 93, 254, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52, &end
#
# 9 PRO HD3 20 ALA QB 4.39
&rst
ixpk= 0, nxpk= 0, iat= 93, -1, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77,
igr2= 256, 257, 258,
&end
#
# 9 PRO HG2 10 TYR HN 4.31
&rst
ixpk= 0, nxpk= 0, iat= 95, 105, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81, &end
#
# 9 PRO HG2 10 TYR QB 4.24
&rst
ixpk= 0, nxpk= 0, iat= 95, -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
igr2= 109, 110,
&end
#
# 9 PRO HG2 10 TYR QD 4.59
&rst
ixpk= 0, nxpk= 0, iat= 95, -1, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
igr2= 113, 122,
&end
#
# 9 PRO HG2 10 TYR QE 4.77
&rst
ixpk= 0, nxpk= 0, iat= 95, -1, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,
igr2= 115, 120,
&end
#
# 9 PRO HG2 20 ALA HA 4.44
&rst
ixpk= 0, nxpk= 0, iat= 95, 254, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94, &end
#
# 9 PRO HG3 10 TYR HN 3.90
&rst
ixpk= 0, nxpk= 0, iat= 96, 105, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40, &end
#
# 9 PRO HG3 10 TYR QB 5.50
&rst
ixpk= 0, nxpk= 0, iat= 96, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 109, 110,
&end
#
# 9 PRO HG3 10 TYR QD 4.16
&rst
ixpk= 0, nxpk= 0, iat= 96, -1, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
igr2= 113, 122,
&end
#
# 9 PRO HG3 10 TYR QE 4.19
&rst
ixpk= 0, nxpk= 0, iat= 96, -1, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
igr2= 115, 120,
&end
#
# 9 PRO HG3 20 ALA HA 4.17
&rst
ixpk= 0, nxpk= 0, iat= 96, 254, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67, &end
#
# 10 TYR HA 10 TYR QD 3.67
&rst
ixpk= 0, nxpk= 0, iat= 107, -1, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
igr2= 113, 122,
&end
#
# 10 TYR HA 11 LYS HB2 4.79
&rst
ixpk= 0, nxpk= 0, iat= 107, 130, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29, &end
#
# 10 TYR HA 11 LYS HN 2.81
&rst
ixpk= 0, nxpk= 0, iat= 107, 126, r1= 1.30, r2= 1.80, r3= 2.81, r4= 3.31, &end
#
# 10 TYR HA 25 LEU QD2 3.92
&rst
ixpk= 0, nxpk= 0, iat= 107, -1, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
igr2= 340, 341, 342,
&end
#
# 10 TYR HN 10 TYR QB 3.14
&rst
ixpk= 0, nxpk= 0, iat= 105, -1, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02,
igr2= 109, 110,
&end
#
# 10 TYR HN 10 TYR QD 3.53
&rst
ixpk= 0, nxpk= 0, iat= 105, -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
igr2= 113, 122,
&end
#
# 10 TYR HN 10 TYR QE 4.26
&rst
ixpk= 0, nxpk= 0, iat= 105, -1, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
igr2= 115, 120,
&end
#
# 10 TYR HN 11 LYS HN 4.58
&rst
ixpk= 0, nxpk= 0, iat= 105, 126, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08, &end
#
# 10 TYR HN 18 ALA QB 4.80
&rst
ixpk= 0, nxpk= 0, iat= 105, -1, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
igr2= 235, 236, 237,
&end
#
# 10 TYR HN 19 SER HN 4.27
&rst
ixpk= 0, nxpk= 0, iat= 105, 241, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77, &end
#
# 10 TYR HN 20 ALA QB 5.43
&rst
ixpk= 0, nxpk= 0, iat= 105, -1, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
igr2= 256, 257, 258,
&end
#
# 10 TYR HN 25 LEU QD2 5.11
&rst
ixpk= 0, nxpk= 0, iat= 105, -1, r1= 1.30, r2= 1.80, r3= 6.14, r4= 6.64,
igr2= 340, 341, 342,
&end
#
# 10 TYR QB 11 LYS HN 3.65
&rst
ixpk= 0, nxpk= 0, iat= -1, 126, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,
igr1= 109, 110,
&end
#
# 10 TYR QB 19 SER HN 3.68
&rst
ixpk= 0, nxpk= 0, iat= -1, 241, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
igr1= 109, 110,
&end
#
# 10 TYR QB 19 SER QB 3.90
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
igr1= 109, 110,
igr2= 245, 246,
&end
#
# 10 TYR QB 21 ILE HN 4.65
&rst
ixpk= 0, nxpk= 0, iat= -1, 262, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
igr1= 109, 110,
&end
#
# 10 TYR QB 22 LYS QB 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1= 109, 110,
igr2= 285, 286,
&end
#
# 10 TYR QB 25 LEU HB2 3.76
&rst
ixpk= 0, nxpk= 0, iat= -1, 331, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
igr1= 109, 110,
&end
#
# 10 TYR QB 25 LEU HB3 3.93
&rst
ixpk= 0, nxpk= 0, iat= -1, 332, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
igr1= 109, 110,
&end
#
# 10 TYR QB 25 LEU HG 4.61
&rst
ixpk= 0, nxpk= 0, iat= -1, 334, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67,
igr1= 109, 110,
&end
#
# 10 TYR QB 25 LEU QD1 4.19
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.65, r4= 6.15,
igr1= 109, 110,
igr2= 336, 337, 338,
&end
#
# 10 TYR QB 25 LEU QD2 3.13
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
igr1= 109, 110,
igr2= 340, 341, 342,
&end
#
# 10 TYR QD 11 LYS HN 4.65
&rst
ixpk= 0, nxpk= 0, iat= -1, 126, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
igr1= 113, 122,
&end
#
# 10 TYR QD 19 SER QB 5.11
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,
igr1= 113, 122,
igr2= 245, 246,
&end
#
# 10 TYR QD 20 ALA HA 3.83
&rst
ixpk= 0, nxpk= 0, iat= -1, 254, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
igr1= 113, 122,
&end
#
# 10 TYR QD 20 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= 113, 122,
igr2= 256, 257, 258,
&end
#
# 10 TYR QD 21 ILE HA 4.44
&rst
ixpk= 0, nxpk= 0, iat= -1, 264, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
igr1= 113, 122,
&end
#
# 10 TYR QD 21 ILE HN 4.37
&rst
ixpk= 0, nxpk= 0, iat= -1, 262, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
igr1= 113, 122,
&end
#
# 10 TYR QD 22 LYS HA 4.06
&rst
ixpk= 0, nxpk= 0, iat= -1, 283, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
igr1= 113, 122,
&end
#
# 10 TYR QD 22 LYS HB2 5.01
&rst
ixpk= 0, nxpk= 0, iat= -1, 285, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
igr1= 113, 122,
&end
#
# 10 TYR QD 22 LYS HB3 5.01
&rst
ixpk= 0, nxpk= 0, iat= -1, 286, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
igr1= 113, 122,
&end
#
# 10 TYR QD 22 LYS HG2 5.12
&rst
ixpk= 0, nxpk= 0, iat= -1, 288, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
igr1= 113, 122,
&end
#
# 10 TYR QD 22 LYS HG3 5.12
&rst
ixpk= 0, nxpk= 0, iat= -1, 289, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
igr1= 113, 122,
&end
#
# 10 TYR QD 22 LYS QB 4.25
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,
igr1= 113, 122,
igr2= 285, 286,
&end
#
# 10 TYR QD 22 LYS QE 4.60
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
igr1= 113, 122,
igr2= 294, 295,
&end
#
# 10 TYR QD 22 LYS QG 4.41
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
igr1= 113, 122,
igr2= 288, 289,
&end
#
# 10 TYR QD 25 LEU HB2 4.75
&rst
ixpk= 0, nxpk= 0, iat= -1, 331, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
igr1= 113, 122,
&end
#
# 10 TYR QD 25 LEU QD2 3.92
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
igr1= 113, 122,
igr2= 340, 341, 342,
&end
#
# 10 TYR QE 20 ALA HA 3.91
&rst
ixpk= 0, nxpk= 0, iat= -1, 254, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,
igr1= 115, 120,
&end
#
# 10 TYR QE 20 ALA QB 4.70
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.34, r4= 6.84,
igr1= 115, 120,
igr2= 256, 257, 258,
&end
#
# 10 TYR QE 21 ILE HA 4.27
&rst
ixpk= 0, nxpk= 0, iat= -1, 264, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
igr1= 115, 120,
&end
#
# 10 TYR QE 22 LYS HA 4.71
&rst
ixpk= 0, nxpk= 0, iat= -1, 283, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,
igr1= 115, 120,
&end
#
# 10 TYR QE 22 LYS HB2 4.69
&rst
ixpk= 0, nxpk= 0, iat= -1, 285, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr1= 115, 120,
&end
#
# 10 TYR QE 22 LYS HB3 4.69
&rst
ixpk= 0, nxpk= 0, iat= -1, 286, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr1= 115, 120,
&end
#
# 10 TYR QE 22 LYS HD2 4.86
&rst
ixpk= 0, nxpk= 0, iat= -1, 291, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
igr1= 115, 120,
&end
#
# 10 TYR QE 22 LYS HD3 4.86
&rst
ixpk= 0, nxpk= 0, iat= -1, 292, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
igr1= 115, 120,
&end
#
# 10 TYR QE 22 LYS HG2 4.81
&rst
ixpk= 0, nxpk= 0, iat= -1, 288, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr1= 115, 120,
&end
#
# 10 TYR QE 22 LYS HG3 4.81
&rst
ixpk= 0, nxpk= 0, iat= -1, 289, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr1= 115, 120,
&end
#
# 10 TYR QE 22 LYS QB 4.01
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
igr1= 115, 120,
igr2= 285, 286,
&end
#
# 10 TYR QE 22 LYS QD 4.22
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
igr1= 115, 120,
igr2= 291, 292,
&end
#
# 10 TYR QE 22 LYS QE 4.24
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr1= 115, 120,
igr2= 294, 295,
&end
#
# 10 TYR QE 25 LEU QD2 5.14
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
igr1= 115, 120,
igr2= 340, 341, 342,
&end
#
# 11 LYS HA 11 LYS HD2 4.64
&rst
ixpk= 0, nxpk= 0, iat= 128, 136, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14, &end
#
# 11 LYS HA 11 LYS HD3 4.64
&rst
ixpk= 0, nxpk= 0, iat= 128, 137, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14, &end
#
# 11 LYS HA 12 CYM HN 3.09
&rst
ixpk= 0, nxpk= 0, iat= 128, 148, r1= 1.30, r2= 1.80, r3= 3.09, r4= 3.59, &end
#
# 11 LYS HA 17 TYR QD 4.67
&rst
ixpk= 0, nxpk= 0, iat= 128, -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr2= 218, 227,
&end
#
# 11 LYS HA 17 TYR QE 5.50
&rst
ixpk= 0, nxpk= 0, iat= 128, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 220, 225,
&end
#
# 11 LYS HA 18 ALA QB 3.39
&rst
ixpk= 0, nxpk= 0, iat= 128, -1, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,
igr2= 235, 236, 237,
&end
#
# 11 LYS HA 19 SER HN 4.13
&rst
ixpk= 0, nxpk= 0, iat= 128, 241, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63, &end
#
# 11 LYS HB2 11 LYS QE 4.63
&rst
ixpk= 0, nxpk= 0, iat= 130, -1, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
igr2= 139, 140,
&end
#
# 11 LYS HB2 12 CYM HN 4.18
&rst
ixpk= 0, nxpk= 0, iat= 130, 148, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68, &end
#
# 11 LYS HB2 18 ALA QB 4.86
&rst
ixpk= 0, nxpk= 0, iat= 130, -1, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
igr2= 235, 236, 237,
&end
#
# 11 LYS HB2 25 LEU QD2 4.91
&rst
ixpk= 0, nxpk= 0, iat= 130, -1, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
igr2= 340, 341, 342,
&end
#
# 11 LYS HB3 11 LYS QE 4.46
&rst
ixpk= 0, nxpk= 0, iat= 131, -1, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
igr2= 139, 140,
&end
#
# 11 LYS HB3 12 CYM HN 3.96
&rst
ixpk= 0, nxpk= 0, iat= 131, 148, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46, &end
#
# 11 LYS HB3 18 ALA HA 4.83
&rst
ixpk= 0, nxpk= 0, iat= 131, 233, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33, &end
#
# 11 LYS HB3 18 ALA QB 4.31
&rst
ixpk= 0, nxpk= 0, iat= 131, -1, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
igr2= 235, 236, 237,
&end
#
# 11 LYS HB3 25 LEU QD2 5.33
&rst
ixpk= 0, nxpk= 0, iat= 131, -1, r1= 1.30, r2= 1.80, r3= 6.40, r4= 6.90,
igr2= 340, 341, 342,
&end
#
# 11 LYS HD2 18 ALA QB 4.25
&rst
ixpk= 0, nxpk= 0, iat= 136, -1, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
igr2= 235, 236, 237,
&end
#
# 11 LYS HD3 18 ALA QB 4.25
&rst
ixpk= 0, nxpk= 0, iat= 137, -1, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
igr2= 235, 236, 237,
&end
#
# 11 LYS HG2 11 LYS QE 3.71
&rst
ixpk= 0, nxpk= 0, iat= 133, -1, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
igr2= 139, 140,
&end
#
# 11 LYS HG2 12 CYM HN 5.47
&rst
ixpk= 0, nxpk= 0, iat= 133, 148, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97, &end
#
# 11 LYS HG3 11 LYS QE 3.71
&rst
ixpk= 0, nxpk= 0, iat= 134, -1, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
igr2= 139, 140,
&end
#
# 11 LYS HG3 12 CYM HN 5.47
&rst
ixpk= 0, nxpk= 0, iat= 134, 148, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97, &end
#
# 11 LYS HN 11 LYS HB2 3.38
&rst
ixpk= 0, nxpk= 0, iat= 126, 130, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88, &end
#
# 11 LYS HN 11 LYS HB3 3.81
&rst
ixpk= 0, nxpk= 0, iat= 126, 131, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31, &end
#
# 11 LYS HN 11 LYS QG 4.12
&rst
ixpk= 0, nxpk= 0, iat= 126, -1, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
igr2= 133, 134,
&end
#
# 11 LYS HN 12 CYM HN 4.56
&rst
ixpk= 0, nxpk= 0, iat= 126, 148, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06, &end
#
# 11 LYS HN 18 ALA QB 5.10
&rst
ixpk= 0, nxpk= 0, iat= 126, -1, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,
igr2= 235, 236, 237,
&end
#
# 11 LYS HN 25 LEU QD2 3.90
&rst
ixpk= 0, nxpk= 0, iat= 126, -1, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
igr2= 340, 341, 342,
&end
#
# 11 LYS QD 12 CYM HN 5.17
&rst
ixpk= 0, nxpk= 0, iat= -1, 148, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
igr1= 136, 137,
&end
#
# 11 LYS QD 18 ALA QB 3.73
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
igr1= 136, 137,
igr2= 235, 236, 237,
&end
#
# 11 LYS QE 18 ALA QB 3.92
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
igr1= 139, 140,
igr2= 235, 236, 237,
&end
#
# 11 LYS QG 12 CYM HN 4.68
&rst
ixpk= 0, nxpk= 0, iat= -1, 148, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
igr1= 133, 134,
&end
#
# 11 LYS QG 18 ALA QB 3.56
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1= 133, 134,
igr2= 235, 236, 237,
&end
#
# 12 CYM HA 13 PRO HD2 3.24
&rst
ixpk= 0, nxpk= 0, iat= 150, 159, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74, &end
#
# 12 CYM HA 13 PRO HD3 3.07
&rst
ixpk= 0, nxpk= 0, iat= 150, 160, r1= 1.30, r2= 1.80, r3= 3.07, r4= 3.57, &end
#
# 12 CYM HA 15 CYM HN 4.75
&rst
ixpk= 0, nxpk= 0, iat= 150, 189, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, &end
#
# 12 CYM HA 17 TYR HB3 4.82
&rst
ixpk= 0, nxpk= 0, iat= 150, 215, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32, &end
#
# 12 CYM HA 17 TYR QD 4.94
&rst
ixpk= 0, nxpk= 0, iat= 150, -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
igr2= 218, 227,
&end
#
# 12 CYM HA 17 TYR QE 5.50
&rst
ixpk= 0, nxpk= 0, iat= 150, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 220, 225,
&end
#
# 12 CYM HA 25 LEU QD1 3.11
&rst
ixpk= 0, nxpk= 0, iat= 150, -1, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23,
igr2= 336, 337, 338,
&end
#
# 12 CYM HA 25 LEU QD2 3.93
&rst
ixpk= 0, nxpk= 0, iat= 150, -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
igr2= 340, 341, 342,
&end
#
# 12 CYM HA 28 HIS HD2 4.61
&rst
ixpk= 0, nxpk= 0, iat= 150, 389, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 12 CYM HA 29 LEU QD1 4.88
&rst
ixpk= 0, nxpk= 0, iat= 150, -1, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
igr2= 402, 403, 404,
&end
#
# 12 CYM HA 29 LEU QD2 3.92
&rst
ixpk= 0, nxpk= 0, iat= 150, -1, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
igr2= 406, 407, 408,
&end
#
# 12 CYM HB2 13 PRO HD2 4.51
&rst
ixpk= 0, nxpk= 0, iat= 153, 159, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01, &end
#
# 12 CYM HB2 13 PRO HD3 4.82
&rst
ixpk= 0, nxpk= 0, iat= 153, 160, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32, &end
#
# 12 CYM HB2 14 GLN HN 4.44
&rst
ixpk= 0, nxpk= 0, iat= 153, 172, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94, &end
#
# 12 CYM HB2 15 CYM HN 3.87
&rst
ixpk= 0, nxpk= 0, iat= 153, 189, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37, &end
#
# 12 CYM HB2 17 TYR HB2 4.30
&rst
ixpk= 0, nxpk= 0, iat= 153, 214, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80, &end
#
# 12 CYM HB2 17 TYR HB3 3.72
&rst
ixpk= 0, nxpk= 0, iat= 153, 215, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22, &end
#
# 12 CYM HB2 17 TYR HN 4.06
&rst
ixpk= 0, nxpk= 0, iat= 153, 210, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56, &end
#
# 12 CYM HB2 17 TYR QD 3.59
&rst
ixpk= 0, nxpk= 0, iat= 153, -1, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,
igr2= 218, 227,
&end
#
# 12 CYM HB2 17 TYR QE 4.44
&rst
ixpk= 0, nxpk= 0, iat= 153, -1, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
igr2= 220, 225,
&end
#
# 12 CYM HB2 25 LEU QD1 3.60
&rst
ixpk= 0, nxpk= 0, iat= 153, -1, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,
igr2= 336, 337, 338,
&end
#
# 12 CYM HB2 25 LEU QD2 4.73
&rst
ixpk= 0, nxpk= 0, iat= 153, -1, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
igr2= 340, 341, 342,
&end
#
# 12 CYM HB2 28 HIS HD2 3.72
&rst
ixpk= 0, nxpk= 0, iat= 153, 389, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22, &end
#
# 12 CYM HB2 29 LEU QD2 4.73
&rst
ixpk= 0, nxpk= 0, iat= 153, -1, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
igr2= 406, 407, 408,
&end
#
# 12 CYM HB3 13 PRO HD2 4.40
&rst
ixpk= 0, nxpk= 0, iat= 152, 159, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 12 CYM HB3 13 PRO HD3 5.05
&rst
ixpk= 0, nxpk= 0, iat= 152, 160, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55, &end
#
# 12 CYM HB3 14 GLN HN 4.47
&rst
ixpk= 0, nxpk= 0, iat= 152, 172, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97, &end
#
# 12 CYM HB3 15 CYM HN 3.41
&rst
ixpk= 0, nxpk= 0, iat= 152, 189, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91, &end
#
# 12 CYM HB3 17 TYR HA 4.89
&rst
ixpk= 0, nxpk= 0, iat= 152, 212, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39, &end
#
# 12 CYM HB3 17 TYR HB2 4.14
&rst
ixpk= 0, nxpk= 0, iat= 152, 214, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64, &end
#
# 12 CYM HB3 17 TYR HB3 3.70
&rst
ixpk= 0, nxpk= 0, iat= 152, 215, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20, &end
#
# 12 CYM HB3 17 TYR HN 3.91
&rst
ixpk= 0, nxpk= 0, iat= 152, 210, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41, &end
#
# 12 CYM HB3 17 TYR QD 3.87
&rst
ixpk= 0, nxpk= 0, iat= 152, -1, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,
igr2= 218, 227,
&end
#
# 12 CYM HB3 25 LEU QD1 3.97
&rst
ixpk= 0, nxpk= 0, iat= 152, -1, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
igr2= 336, 337, 338,
&end
#
# 12 CYM HB3 28 HIS HD2 4.41
&rst
ixpk= 0, nxpk= 0, iat= 152, 389, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, &end
#
# 12 CYM HN 12 CYM HB2 3.34
&rst
ixpk= 0, nxpk= 0, iat= 148, 153, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84, &end
#
# 12 CYM HN 12 CYM HB3 3.26
&rst
ixpk= 0, nxpk= 0, iat= 148, 152, r1= 1.30, r2= 1.80, r3= 3.26, r4= 3.76, &end
#
# 12 CYM HN 13 PRO HD2 5.31
&rst
ixpk= 0, nxpk= 0, iat= 148, 159, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81, &end
#
# 12 CYM HN 13 PRO HD3 4.91
&rst
ixpk= 0, nxpk= 0, iat= 148, 160, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41, &end
#
# 12 CYM HN 15 CYM HN 4.72
&rst
ixpk= 0, nxpk= 0, iat= 148, 189, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22, &end
#
# 12 CYM HN 16 SER HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= 148, 201, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 12 CYM HN 17 TYR HB2 5.22
&rst
ixpk= 0, nxpk= 0, iat= 148, 214, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72, &end
#
# 12 CYM HN 17 TYR HB3 4.30
&rst
ixpk= 0, nxpk= 0, iat= 148, 215, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80, &end
#
# 12 CYM HN 17 TYR QD 3.99
&rst
ixpk= 0, nxpk= 0, iat= 148, -1, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
igr2= 218, 227,
&end
#
# 12 CYM HN 18 ALA QB 4.27
&rst
ixpk= 0, nxpk= 0, iat= 148, -1, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
igr2= 235, 236, 237,
&end
#
# 12 CYM HN 19 SER HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 148, 241, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 12 CYM HN 25 LEU QD1 3.80
&rst
ixpk= 0, nxpk= 0, iat= 148, -1, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
igr2= 336, 337, 338,
&end
#
# 13 PRO HA 15 CYM HN 5.24
&rst
ixpk= 0, nxpk= 0, iat= 168, 189, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74, &end
#
# 13 PRO HB2 14 GLN HN 4.27
&rst
ixpk= 0, nxpk= 0, iat= 165, 172, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77, &end
#
# 13 PRO HB2 14 GLN QG 4.25
&rst
ixpk= 0, nxpk= 0, iat= 165, -1, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
igr2= 179, 180,
&end
#
# 13 PRO HB2 29 LEU QD2 4.74
&rst
ixpk= 0, nxpk= 0, iat= 165, -1, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
igr2= 406, 407, 408,
&end
#
# 13 PRO HB3 14 GLN QG 4.81
&rst
ixpk= 0, nxpk= 0, iat= 166, -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr2= 179, 180,
&end
#
# 13 PRO HB3 29 LEU QD2 5.18
&rst
ixpk= 0, nxpk= 0, iat= 166, -1, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
igr2= 406, 407, 408,
&end
#
# 13 PRO HD2 14 GLN HN 3.53
&rst
ixpk= 0, nxpk= 0, iat= 159, 172, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03, &end
#
# 13 PRO HD2 25 LEU QD1 4.05
&rst
ixpk= 0, nxpk= 0, iat= 159, -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
igr2= 336, 337, 338,
&end
#
# 13 PRO HD2 28 HIS HD2 4.78
&rst
ixpk= 0, nxpk= 0, iat= 159, 389, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, &end
#
# 13 PRO HD2 29 LEU QD1 4.66
&rst
ixpk= 0, nxpk= 0, iat= 159, -1, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
igr2= 402, 403, 404,
&end
#
# 13 PRO HD2 29 LEU QD2 3.27
&rst
ixpk= 0, nxpk= 0, iat= 159, -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
igr2= 406, 407, 408,
&end
#
# 13 PRO HD3 14 GLN HN 4.26
&rst
ixpk= 0, nxpk= 0, iat= 160, 172, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76, &end
#
# 13 PRO HD3 25 LEU QD1 3.77
&rst
ixpk= 0, nxpk= 0, iat= 160, -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
igr2= 336, 337, 338,
&end
#
# 13 PRO HD3 25 LEU QD2 4.23
&rst
ixpk= 0, nxpk= 0, iat= 160, -1, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
igr2= 340, 341, 342,
&end
#
# 13 PRO HD3 29 LEU QD1 4.47
&rst
ixpk= 0, nxpk= 0, iat= 160, -1, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr2= 402, 403, 404,
&end
#
# 13 PRO HD3 29 LEU QD2 3.60
&rst
ixpk= 0, nxpk= 0, iat= 160, -1, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,
igr2= 406, 407, 408,
&end
#
# 13 PRO HG2 14 GLN HN 4.82
&rst
ixpk= 0, nxpk= 0, iat= 162, 172, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32, &end
#
# 13 PRO HG3 14 GLN HN 4.82
&rst
ixpk= 0, nxpk= 0, iat= 163, 172, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32, &end
#
# 13 PRO QG 14 GLN HN 4.12
&rst
ixpk= 0, nxpk= 0, iat= -1, 172, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
igr1= 162, 163,
&end
#
# 13 PRO QG 14 GLN QG 4.04
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
igr1= 162, 163,
igr2= 179, 180,
&end
#
# 13 PRO QG 29 LEU QD1 4.53
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
igr1= 162, 163,
igr2= 402, 403, 404,
&end
#
# 13 PRO QG 29 LEU QD2 3.92
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
igr1= 162, 163,
igr2= 406, 407, 408,
&end
#
# 14 GLN HA 14 GLN HG2 3.90
&rst
ixpk= 0, nxpk= 0, iat= 174, 179, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40, &end
#
# 14 GLN HA 14 GLN HG3 3.90
&rst
ixpk= 0, nxpk= 0, iat= 174, 180, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40, &end
#
# 14 GLN HA 15 CYM HN 3.51
&rst
ixpk= 0, nxpk= 0, iat= 174, 189, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01, &end
#
# 14 GLN HB2 15 CYM HN 4.00
&rst
ixpk= 0, nxpk= 0, iat= 176, 189, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 14 GLN HB2 32 HIS HE1 4.57
&rst
ixpk= 0, nxpk= 0, iat= 176, 468, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07, &end
#
# 14 GLN HB3 15 CYM HN 4.00
&rst
ixpk= 0, nxpk= 0, iat= 177, 189, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 14 GLN HB3 32 HIS HE1 4.57
&rst
ixpk= 0, nxpk= 0, iat= 177, 468, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07, &end
#
# 14 GLN HN 14 GLN HB2 3.87
&rst
ixpk= 0, nxpk= 0, iat= 172, 176, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37, &end
#
# 14 GLN HN 14 GLN HB3 3.87
&rst
ixpk= 0, nxpk= 0, iat= 172, 177, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37, &end
#
# 14 GLN HN 14 GLN HG2 4.09
&rst
ixpk= 0, nxpk= 0, iat= 172, 179, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59, &end
#
# 14 GLN HN 14 GLN HG3 4.09
&rst
ixpk= 0, nxpk= 0, iat= 172, 180, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59, &end
#
# 14 GLN HN 14 GLN QB 3.20
&rst
ixpk= 0, nxpk= 0, iat= 172, -1, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09,
igr2= 176, 177,
&end
#
# 14 GLN HN 14 GLN QG 3.56
&rst
ixpk= 0, nxpk= 0, iat= 172, -1, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,
igr2= 179, 180,
&end
#
# 14 GLN HN 15 CYM HN 2.84
&rst
ixpk= 0, nxpk= 0, iat= 172, 189, r1= 1.30, r2= 1.80, r3= 2.84, r4= 3.34, &end
#
# 14 GLN HN 29 LEU QD2 4.83
&rst
ixpk= 0, nxpk= 0, iat= 172, -1, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
igr2= 406, 407, 408,
&end
#
# 14 GLN HN 32 HIS HD2 5.22
&rst
ixpk= 0, nxpk= 0, iat= 172, 471, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72, &end
#
# 14 GLN QB 15 CYM HN 3.46
&rst
ixpk= 0, nxpk= 0, iat= -1, 189, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,
igr1= 176, 177,
&end
#
# 14 GLN QB 32 HIS HD2 4.13
&rst
ixpk= 0, nxpk= 0, iat= -1, 471, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
igr1= 176, 177,
&end
#
# 14 GLN QB 32 HIS HE1 4.02
&rst
ixpk= 0, nxpk= 0, iat= -1, 468, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,
igr1= 176, 177,
&end
#
# 14 GLN QE2 32 HIS HB2 4.53
&rst
ixpk= 0, nxpk= 0, iat= -1, 462, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
igr1= 184, 185,
&end
#
# 14 GLN QE2 32 HIS HB3 4.43
&rst
ixpk= 0, nxpk= 0, iat= -1, 463, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
igr1= 184, 185,
&end
#
# 14 GLN QG 15 CYM HN 4.40
&rst
ixpk= 0, nxpk= 0, iat= -1, 189, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
igr1= 179, 180,
&end
#
# 15 CYM HA 17 TYR HN 4.58
&rst
ixpk= 0, nxpk= 0, iat= 191, 210, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08, &end
#
# 15 CYM HB2 16 SER HN 4.67
&rst
ixpk= 0, nxpk= 0, iat= 194, 199, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, &end
#
# 15 CYM HB2 17 TYR HN 4.73
&rst
ixpk= 0, nxpk= 0, iat= 194, 210, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, &end
#
# 15 CYM HB3 16 SER HN 4.67
&rst
ixpk= 0, nxpk= 0, iat= 193, 199, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, &end
#
# 15 CYM HB3 17 TYR HN 4.73
&rst
ixpk= 0, nxpk= 0, iat= 193, 210, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, &end
#
# 15 CYM HN 15 CYM HB2 3.99
&rst
ixpk= 0, nxpk= 0, iat= 189, 194, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49, &end
#
# 15 CYM HN 15 CYM HB3 3.99
&rst
ixpk= 0, nxpk= 0, iat= 189, 193, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49, &end
#
# 15 CYM HN 15 CYM QB 3.27
&rst
ixpk= 0, nxpk= 0, iat= 189, -1, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,
igr2= 194, 193,
&end
#
# 15 CYM HN 17 TYR HB3 4.50
&rst
ixpk= 0, nxpk= 0, iat= 189, 215, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 15 CYM HN 17 TYR HN 4.55
&rst
ixpk= 0, nxpk= 0, iat= 189, 210, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05, &end
#
# 15 CYM HN 29 LEU QD2 5.39
&rst
ixpk= 0, nxpk= 0, iat= 189, -1, r1= 1.30, r2= 1.80, r3= 6.47, r4= 6.97,
igr2= 406, 407, 408,
&end
#
# 15 CYM QB 16 SER HN 4.07
&rst
ixpk= 0, nxpk= 0, iat= -1, 199, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,
igr1= 194, 193,
&end
#
# 15 CYM QB 17 TYR HN 4.10
&rst
ixpk= 0, nxpk= 0, iat= -1, 210, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
igr1= 194, 193,
&end
#
# 16 SER HB2 17 TYR HN 4.82
&rst
ixpk= 0, nxpk= 0, iat= 203, 210, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32, &end
#
# 16 SER HB3 17 TYR HN 4.82
&rst
ixpk= 0, nxpk= 0, iat= 204, 210, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32, &end
#
# 16 SER HN 17 TYR HN 4.44
&rst
ixpk= 0, nxpk= 0, iat= 199, 210, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94, &end
#
# 16 SER QB 17 TYR HN 4.15
&rst
ixpk= 0, nxpk= 0, iat= -1, 210, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
igr1= 203, 204,
&end
#
# 17 TYR HA 17 TYR QD 3.56
&rst
ixpk= 0, nxpk= 0, iat= 212, -1, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,
igr2= 218, 227,
&end
#
# 17 TYR HA 17 TYR QE 5.00
&rst
ixpk= 0, nxpk= 0, iat= 212, -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr2= 220, 225,
&end
#
# 17 TYR HA 18 ALA HA 4.67
&rst
ixpk= 0, nxpk= 0, iat= 212, 233, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, &end
#
# 17 TYR HA 18 ALA HN 2.77
&rst
ixpk= 0, nxpk= 0, iat= 212, 231, r1= 1.30, r2= 1.80, r3= 2.77, r4= 3.27, &end
#
# 17 TYR HA 18 ALA QB 4.09
&rst
ixpk= 0, nxpk= 0, iat= 212, -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
igr2= 235, 236, 237,
&end
#
# 17 TYR HA 28 HIS HE1 5.50
&rst
ixpk= 0, nxpk= 0, iat= 212, 386, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 17 TYR HB2 18 ALA HN 4.22
&rst
ixpk= 0, nxpk= 0, iat= 214, 231, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 17 TYR HB2 25 LEU QD1 5.38
&rst
ixpk= 0, nxpk= 0, iat= 214, -1, r1= 1.30, r2= 1.80, r3= 6.46, r4= 6.96,
igr2= 336, 337, 338,
&end
#
# 17 TYR HB2 28 HIS HE1 3.83
&rst
ixpk= 0, nxpk= 0, iat= 214, 386, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33, &end
#
# 17 TYR HB3 18 ALA HN 4.36
&rst
ixpk= 0, nxpk= 0, iat= 215, 231, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86, &end
#
# 17 TYR HB3 25 LEU QD1 4.72
&rst
ixpk= 0, nxpk= 0, iat= 215, -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
igr2= 336, 337, 338,
&end
#
# 17 TYR HB3 28 HIS HE1 4.12
&rst
ixpk= 0, nxpk= 0, iat= 215, 386, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62, &end
#
# 17 TYR HN 17 TYR HB2 3.08
&rst
ixpk= 0, nxpk= 0, iat= 210, 214, r1= 1.30, r2= 1.80, r3= 3.08, r4= 3.58, &end
#
# 17 TYR HN 17 TYR HB3 3.14
&rst
ixpk= 0, nxpk= 0, iat= 210, 215, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64, &end
#
# 17 TYR HN 17 TYR QD 4.31
&rst
ixpk= 0, nxpk= 0, iat= 210, -1, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
igr2= 218, 227,
&end
#
# 17 TYR HN 18 ALA HN 4.67
&rst
ixpk= 0, nxpk= 0, iat= 210, 231, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, &end
#
# 17 TYR HN 28 HIS HE1 5.30
&rst
ixpk= 0, nxpk= 0, iat= 210, 386, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80, &end
#
# 17 TYR QD 18 ALA HA 4.10
&rst
ixpk= 0, nxpk= 0, iat= -1, 233, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
igr1= 218, 227,
&end
#
# 17 TYR QD 18 ALA HN 3.85
&rst
ixpk= 0, nxpk= 0, iat= -1, 231, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,
igr1= 218, 227,
&end
#
# 17 TYR QD 19 SER HN 4.61
&rst
ixpk= 0, nxpk= 0, iat= -1, 241, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67,
igr1= 218, 227,
&end
#
# 17 TYR QD 19 SER QB 4.72
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.95, r4= 6.45,
igr1= 218, 227,
igr2= 245, 246,
&end
#
# 17 TYR QD 25 LEU HA 3.99
&rst
ixpk= 0, nxpk= 0, iat= -1, 329, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
igr1= 218, 227,
&end
#
# 17 TYR QD 25 LEU QD1 3.35
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
igr1= 218, 227,
igr2= 336, 337, 338,
&end
#
# 17 TYR QD 25 LEU QD2 4.49
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
igr1= 218, 227,
igr2= 340, 341, 342,
&end
#
# 17 TYR QD 28 HIS HB2 4.68
&rst
ixpk= 0, nxpk= 0, iat= -1, 380, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
igr1= 218, 227,
&end
#
# 17 TYR QD 28 HIS HB3 4.60
&rst
ixpk= 0, nxpk= 0, iat= -1, 381, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
igr1= 218, 227,
&end
#
# 17 TYR QD 28 HIS HD2 4.30
&rst
ixpk= 0, nxpk= 0, iat= -1, 389, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
igr1= 218, 227,
&end
#
# 17 TYR QD 28 HIS HE1 4.31
&rst
ixpk= 0, nxpk= 0, iat= -1, 386, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
igr1= 218, 227,
&end
#
# 17 TYR QE 18 ALA HN 4.52
&rst
ixpk= 0, nxpk= 0, iat= -1, 231, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
igr1= 220, 225,
&end
#
# 17 TYR QE 19 SER HA 5.03
&rst
ixpk= 0, nxpk= 0, iat= -1, 243, r1= 1.30, r2= 1.80, r3= 5.65, r4= 6.15,
igr1= 220, 225,
&end
#
# 17 TYR QE 19 SER HB2 3.99
&rst
ixpk= 0, nxpk= 0, iat= -1, 245, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
igr1= 220, 225,
&end
#
# 17 TYR QE 19 SER HB3 3.99
&rst
ixpk= 0, nxpk= 0, iat= -1, 246, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
igr1= 220, 225,
&end
#
# 17 TYR QE 19 SER HN 4.40
&rst
ixpk= 0, nxpk= 0, iat= -1, 241, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
igr1= 220, 225,
&end
#
# 17 TYR QE 19 SER QB 3.42
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,
igr1= 220, 225,
igr2= 245, 246,
&end
#
# 17 TYR QE 25 LEU HA 3.27
&rst
ixpk= 0, nxpk= 0, iat= -1, 329, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,
igr1= 220, 225,
&end
#
# 17 TYR QE 25 LEU HB2 4.06
&rst
ixpk= 0, nxpk= 0, iat= -1, 331, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
igr1= 220, 225,
&end
#
# 17 TYR QE 25 LEU HB3 4.85
&rst
ixpk= 0, nxpk= 0, iat= -1, 332, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
igr1= 220, 225,
&end
#
# 17 TYR QE 25 LEU HN 4.57
&rst
ixpk= 0, nxpk= 0, iat= -1, 327, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
igr1= 220, 225,
&end
#
# 17 TYR QE 25 LEU QD1 3.41
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
igr1= 220, 225,
igr2= 336, 337, 338,
&end
#
# 17 TYR QE 25 LEU QD2 4.38
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
igr1= 220, 225,
igr2= 340, 341, 342,
&end
#
# 17 TYR QE 28 HIS HB2 4.12
&rst
ixpk= 0, nxpk= 0, iat= -1, 380, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
igr1= 220, 225,
&end
#
# 17 TYR QE 28 HIS HB3 4.01
&rst
ixpk= 0, nxpk= 0, iat= -1, 381, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
igr1= 220, 225,
&end
#
# 17 TYR QE 28 HIS HN 4.88
&rst
ixpk= 0, nxpk= 0, iat= -1, 376, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
igr1= 220, 225,
&end
#
# 18 ALA HA 19 SER HN 3.18
&rst
ixpk= 0, nxpk= 0, iat= 233, 241, r1= 1.30, r2= 1.80, r3= 3.18, r4= 3.68, &end
#
# 18 ALA HA 25 LEU QD1 4.70
&rst
ixpk= 0, nxpk= 0, iat= 233, -1, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14,
igr2= 336, 337, 338,
&end
#
# 18 ALA HN 18 ALA QB 3.38
&rst
ixpk= 0, nxpk= 0, iat= 231, -1, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,
igr2= 235, 236, 237,
&end
#
# 18 ALA HN 19 SER HN 4.51
&rst
ixpk= 0, nxpk= 0, iat= 231, 241, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01, &end
#
# 18 ALA QB 19 SER HA 4.62
&rst
ixpk= 0, nxpk= 0, iat= -1, 243, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,
igr1= 235, 236, 237,
&end
#
# 18 ALA QB 19 SER HN 3.29
&rst
ixpk= 0, nxpk= 0, iat= -1, 241, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
igr1= 235, 236, 237,
&end
#
# 19 SER HB2 21 ILE HN 4.39
&rst
ixpk= 0, nxpk= 0, iat= 245, 262, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89, &end
#
# 19 SER HB2 24 ASN HB2 4.69
&rst
ixpk= 0, nxpk= 0, iat= 245, 317, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, &end
#
# 19 SER HB2 24 ASN HB3 4.69
&rst
ixpk= 0, nxpk= 0, iat= 245, 318, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, &end
#
# 19 SER HB2 25 LEU HB2 4.76
&rst
ixpk= 0, nxpk= 0, iat= 245, 331, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26, &end
#
# 19 SER HB2 25 LEU QD1 5.50
&rst
ixpk= 0, nxpk= 0, iat= 245, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2= 336, 337, 338,
&end
#
# 19 SER HB3 21 ILE HN 4.39
&rst
ixpk= 0, nxpk= 0, iat= 246, 262, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89, &end
#
# 19 SER HB3 24 ASN HB2 4.69
&rst
ixpk= 0, nxpk= 0, iat= 246, 317, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, &end
#
# 19 SER HB3 24 ASN HB3 4.69
&rst
ixpk= 0, nxpk= 0, iat= 246, 318, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, &end
#
# 19 SER HB3 25 LEU HB2 4.76
&rst
ixpk= 0, nxpk= 0, iat= 246, 331, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26, &end
#
# 19 SER HB3 25 LEU QD1 5.50
&rst
ixpk= 0, nxpk= 0, iat= 246, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2= 336, 337, 338,
&end
#
# 19 SER HN 19 SER HB2 3.82
&rst
ixpk= 0, nxpk= 0, iat= 241, 245, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32, &end
#
# 19 SER HN 19 SER HB3 3.82
&rst
ixpk= 0, nxpk= 0, iat= 241, 246, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32, &end
#
# 19 SER HN 25 LEU QD1 4.79
&rst
ixpk= 0, nxpk= 0, iat= 241, -1, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
igr2= 336, 337, 338,
&end
#
# 19 SER HN 25 LEU QD2 4.62
&rst
ixpk= 0, nxpk= 0, iat= 241, -1, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,
igr2= 340, 341, 342,
&end
#
# 19 SER QB 21 ILE HN 3.67
&rst
ixpk= 0, nxpk= 0, iat= -1, 262, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
igr1= 245, 246,
&end
#
# 19 SER QB 24 ASN HN 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, 313, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1= 245, 246,
&end
#
# 19 SER QB 24 ASN QB 3.60
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
igr1= 245, 246,
igr2= 317, 318,
&end
#
# 19 SER QB 25 LEU HA 4.88
&rst
ixpk= 0, nxpk= 0, iat= -1, 329, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
igr1= 245, 246,
&end
#
# 19 SER QB 25 LEU HB2 3.95
&rst
ixpk= 0, nxpk= 0, iat= -1, 331, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
igr1= 245, 246,
&end
#
# 19 SER QB 25 LEU HN 4.37
&rst
ixpk= 0, nxpk= 0, iat= -1, 327, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
igr1= 245, 246,
&end
#
# 19 SER QB 25 LEU QD1 4.70
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.34, r4= 6.84,
igr1= 245, 246,
igr2= 336, 337, 338,
&end
#
# 19 SER QB 25 LEU QD2 5.23
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.05, r4= 7.55,
igr1= 245, 246,
igr2= 340, 341, 342,
&end
#
# 20 ALA QB 21 ILE HB 4.67
&rst
ixpk= 0, nxpk= 0, iat= -1, 266, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr1= 256, 257, 258,
&end
#
# 20 ALA QB 21 ILE HG12 4.18
&rst
ixpk= 0, nxpk= 0, iat= -1, 272, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
igr1= 256, 257, 258,
&end
#
# 20 ALA QB 21 ILE HG13 4.18
&rst
ixpk= 0, nxpk= 0, iat= -1, 273, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
igr1= 256, 257, 258,
&end
#
# 20 ALA QB 21 ILE HN 3.79
&rst
ixpk= 0, nxpk= 0, iat= -1, 262, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,
igr1= 256, 257, 258,
&end
#
# 20 ALA QB 21 ILE QD1 4.04
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33,
igr1= 256, 257, 258,
igr2= 275, 276, 277,
&end
#
# 20 ALA QB 21 ILE QG1 3.60
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
igr1= 256, 257, 258,
igr2= 272, 273,
&end
#
# 20 ALA QB 21 ILE QG2 5.09
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.34, r4= 7.84,
igr1= 256, 257, 258,
igr2= 268, 269, 270,
&end
#
# 21 ILE HA 21 ILE HG12 4.14
&rst
ixpk= 0, nxpk= 0, iat= 264, 272, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64, &end
#
# 21 ILE HA 21 ILE HG13 4.14
&rst
ixpk= 0, nxpk= 0, iat= 264, 273, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64, &end
#
# 21 ILE HA 21 ILE QD1 4.05
&rst
ixpk= 0, nxpk= 0, iat= 264, -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
igr2= 275, 276, 277,
&end
#
# 21 ILE HA 21 ILE QG2 3.36
&rst
ixpk= 0, nxpk= 0, iat= 264, -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
igr2= 268, 269, 270,
&end
#
# 21 ILE HA 22 LYS HA 4.90
&rst
ixpk= 0, nxpk= 0, iat= 264, 283, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40, &end
#
# 21 ILE HA 24 ASN HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 264, 313, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 21 ILE HB 21 ILE QD1 3.39
&rst
ixpk= 0, nxpk= 0, iat= 266, -1, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,
igr2= 275, 276, 277,
&end
#
# 21 ILE HB 24 ASN HB2 4.23
&rst
ixpk= 0, nxpk= 0, iat= 266, 317, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73, &end
#
# 21 ILE HB 24 ASN HB3 4.23
&rst
ixpk= 0, nxpk= 0, iat= 266, 318, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73, &end
#
# 21 ILE HB 24 ASN HN 3.88
&rst
ixpk= 0, nxpk= 0, iat= 266, 313, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38, &end
#
# 21 ILE HB 24 ASN QB 3.65
&rst
ixpk= 0, nxpk= 0, iat= 266, -1, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,
igr2= 317, 318,
&end
#
# 21 ILE HN 21 ILE HB 3.40
&rst
ixpk= 0, nxpk= 0, iat= 262, 266, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90, &end
#
# 21 ILE HN 21 ILE HG12 4.35
&rst
ixpk= 0, nxpk= 0, iat= 262, 272, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85, &end
#
# 21 ILE HN 21 ILE HG13 4.35
&rst
ixpk= 0, nxpk= 0, iat= 262, 273, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85, &end
#
# 21 ILE HN 21 ILE QD1 4.21
&rst
ixpk= 0, nxpk= 0, iat= 262, -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
igr2= 275, 276, 277,
&end
#
# 21 ILE HN 21 ILE QG1 3.52
&rst
ixpk= 0, nxpk= 0, iat= 262, -1, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
igr2= 272, 273,
&end
#
# 21 ILE HN 21 ILE QG2 4.14
&rst
ixpk= 0, nxpk= 0, iat= 262, -1, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
igr2= 268, 269, 270,
&end
#
# 21 ILE HN 24 ASN QB 4.55
&rst
ixpk= 0, nxpk= 0, iat= 262, -1, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,
igr2= 317, 318,
&end
#
# 21 ILE QD1 23 ALA QB 4.62
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.66, r4= 7.16,
igr1= 275, 276, 277,
igr2= 307, 308, 309,
&end
#
# 21 ILE QD1 24 ASN HN 4.51
&rst
ixpk= 0, nxpk= 0, iat= -1, 313, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr1= 275, 276, 277,
&end
#
# 21 ILE QD1 24 ASN QB 4.51
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
igr1= 275, 276, 277,
igr2= 317, 318,
&end
#
# 21 ILE QD1 24 ASN QD2 4.32
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32,
igr1= 275, 276, 277,
igr2= 322, 323,
&end
#
# 21 ILE QG2 21 ILE HG12 3.34
&rst
ixpk= 0, nxpk= 0, iat= -1, 272, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,
igr1= 268, 269, 270,
&end
#
# 21 ILE QG2 21 ILE HG13 3.34
&rst
ixpk= 0, nxpk= 0, iat= -1, 273, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,
igr1= 268, 269, 270,
&end
#
# 21 ILE QG2 21 ILE QD1 2.97
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,
igr1= 268, 269, 270,
igr2= 275, 276, 277,
&end
#
# 21 ILE QG2 22 LYS HA 4.61
&rst
ixpk= 0, nxpk= 0, iat= -1, 283, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
igr1= 268, 269, 270,
&end
#
# 21 ILE QG2 23 ALA HA 4.30
&rst
ixpk= 0, nxpk= 0, iat= -1, 305, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
igr1= 268, 269, 270,
&end
#
# 21 ILE QG2 23 ALA HN 4.15
&rst
ixpk= 0, nxpk= 0, iat= -1, 303, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
igr1= 268, 269, 270,
&end
#
# 21 ILE QG2 23 ALA QB 3.03
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
igr1= 268, 269, 270,
igr2= 307, 308, 309,
&end
#
# 21 ILE QG2 24 ASN HB2 4.83
&rst
ixpk= 0, nxpk= 0, iat= -1, 317, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
igr1= 268, 269, 270,
&end
#
# 21 ILE QG2 24 ASN HB3 4.83
&rst
ixpk= 0, nxpk= 0, iat= -1, 318, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
igr1= 268, 269, 270,
&end
#
# 21 ILE QG2 24 ASN HN 3.14
&rst
ixpk= 0, nxpk= 0, iat= -1, 313, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
igr1= 268, 269, 270,
&end
#
# 21 ILE QG2 24 ASN QB 3.98
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr1= 268, 269, 270,
igr2= 317, 318,
&end
#
# 21 ILE QG2 25 LEU HN 4.52
&rst
ixpk= 0, nxpk= 0, iat= -1, 327, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
igr1= 268, 269, 270,
&end
#
# 22 LYS HA 22 LYS HD2 4.85
&rst
ixpk= 0, nxpk= 0, iat= 283, 291, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35, &end
#
# 22 LYS HA 22 LYS HD3 4.85
&rst
ixpk= 0, nxpk= 0, iat= 283, 292, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35, &end
#
# 22 LYS HA 22 LYS HG2 4.09
&rst
ixpk= 0, nxpk= 0, iat= 283, 288, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59, &end
#
# 22 LYS HA 22 LYS HG3 4.09
&rst
ixpk= 0, nxpk= 0, iat= 283, 289, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59, &end
#
# 22 LYS HA 22 LYS QD 4.21
&rst
ixpk= 0, nxpk= 0, iat= 283, -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
igr2= 291, 292,
&end
#
# 22 LYS HA 22 LYS QG 3.28
&rst
ixpk= 0, nxpk= 0, iat= 283, -1, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18,
igr2= 288, 289,
&end
#
# 22 LYS HA 24 ASN HN 4.52
&rst
ixpk= 0, nxpk= 0, iat= 283, 313, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02, &end
#
# 22 LYS HA 25 LEU HB2 4.23
&rst
ixpk= 0, nxpk= 0, iat= 283, 331, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73, &end
#
# 22 LYS HA 25 LEU HB3 4.00
&rst
ixpk= 0, nxpk= 0, iat= 283, 332, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 22 LYS HA 25 LEU HN 4.02
&rst
ixpk= 0, nxpk= 0, iat= 283, 327, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52, &end
#
# 22 LYS HA 25 LEU QD2 4.26
&rst
ixpk= 0, nxpk= 0, iat= 283, -1, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
igr2= 340, 341, 342,
&end
#
# 22 LYS HG2 22 LYS QE 3.85
&rst
ixpk= 0, nxpk= 0, iat= 288, -1, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,
igr2= 294, 295,
&end
#
# 22 LYS HG3 22 LYS QE 3.85
&rst
ixpk= 0, nxpk= 0, iat= 289, -1, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,
igr2= 294, 295,
&end
#
# 22 LYS QB 22 LYS QE 3.84
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
igr1= 285, 286,
igr2= 294, 295,
&end
#
# 22 LYS QE 25 LEU QD2 5.40
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
igr1= 294, 295,
igr2= 340, 341, 342,
&end
#
# 22 LYS QG 22 LYS QE 3.37
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,
igr1= 288, 289,
igr2= 294, 295,
&end
#
# 22 LYS QG 23 ALA HA 4.65
&rst
ixpk= 0, nxpk= 0, iat= -1, 305, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
igr1= 288, 289,
&end
#
# 22 LYS QG 23 ALA QB 5.04
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 288, 289,
igr2= 307, 308, 309,
&end
#
# 23 ALA HA 25 LEU HN 4.66
&rst
ixpk= 0, nxpk= 0, iat= 305, 327, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16, &end
#
# 23 ALA HA 26 ASN HA 5.41
&rst
ixpk= 0, nxpk= 0, iat= 305, 348, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91, &end
#
# 23 ALA HA 26 ASN HB2 4.09
&rst
ixpk= 0, nxpk= 0, iat= 305, 350, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59, &end
#
# 23 ALA HA 26 ASN HB3 4.09
&rst
ixpk= 0, nxpk= 0, iat= 305, 351, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59, &end
#
# 23 ALA HA 26 ASN HN 4.02
&rst
ixpk= 0, nxpk= 0, iat= 305, 346, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52, &end
#
# 23 ALA HA 26 ASN QB 3.37
&rst
ixpk= 0, nxpk= 0, iat= 305, -1, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,
igr2= 350, 351,
&end
#
# 23 ALA HA 26 ASN QD2 4.34
&rst
ixpk= 0, nxpk= 0, iat= 305, -1, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,
igr2= 355, 356,
&end
#
# 23 ALA HA 27 VAL HN 4.52
&rst
ixpk= 0, nxpk= 0, iat= 305, 360, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02, &end
#
# 23 ALA HA 27 VAL QG2 4.47
&rst
ixpk= 0, nxpk= 0, iat= 305, -1, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr2= 370, 371, 372,
&end
#
# 23 ALA HN 23 ALA QB 3.94
&rst
ixpk= 0, nxpk= 0, iat= 303, -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
igr2= 307, 308, 309,
&end
#
# 23 ALA HN 24 ASN HN 4.56
&rst
ixpk= 0, nxpk= 0, iat= 303, 313, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06, &end
#
# 23 ALA QB 24 ASN HA 4.58
&rst
ixpk= 0, nxpk= 0, iat= -1, 315, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
igr1= 307, 308, 309,
&end
#
# 23 ALA QB 24 ASN HN 3.53
&rst
ixpk= 0, nxpk= 0, iat= -1, 313, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
igr1= 307, 308, 309,
&end
#
# 23 ALA QB 24 ASN QB 4.70
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.34, r4= 6.84,
igr1= 307, 308, 309,
igr2= 317, 318,
&end
#
# 23 ALA QB 25 LEU HN 4.68
&rst
ixpk= 0, nxpk= 0, iat= -1, 327, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
igr1= 307, 308, 309,
&end
#
# 23 ALA QB 26 ASN HN 4.90
&rst
ixpk= 0, nxpk= 0, iat= -1, 346, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
igr1= 307, 308, 309,
&end
#
# 23 ALA QB 26 ASN QB 4.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr1= 307, 308, 309,
igr2= 350, 351,
&end
#
# 23 ALA QB 26 ASN QD2 4.46
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51,
igr1= 307, 308, 309,
igr2= 355, 356,
&end
#
# 23 ALA QB 27 VAL QG2 3.97
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23,
igr1= 307, 308, 309,
igr2= 370, 371, 372,
&end
#
# 24 ASN HA 27 VAL HB 3.73
&rst
ixpk= 0, nxpk= 0, iat= 315, 364, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23, &end
#
# 24 ASN HA 27 VAL HN 4.06
&rst
ixpk= 0, nxpk= 0, iat= 315, 360, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56, &end
#
# 24 ASN HA 27 VAL QG1 4.77
&rst
ixpk= 0, nxpk= 0, iat= 315, -1, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23,
igr2= 366, 367, 368,
&end
#
# 24 ASN HA 27 VAL QG2 3.58
&rst
ixpk= 0, nxpk= 0, iat= 315, -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
igr2= 370, 371, 372,
&end
#
# 24 ASN HA 28 HIS HN 5.11
&rst
ixpk= 0, nxpk= 0, iat= 315, 376, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61, &end
#
# 24 ASN HB2 25 LEU HN 3.97
&rst
ixpk= 0, nxpk= 0, iat= 317, 327, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47, &end
#
# 24 ASN HB3 25 LEU HN 3.97
&rst
ixpk= 0, nxpk= 0, iat= 318, 327, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47, &end
#
# 24 ASN HN 24 ASN HB2 3.61
&rst
ixpk= 0, nxpk= 0, iat= 313, 317, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11, &end
#
# 24 ASN HN 24 ASN HB3 3.61
&rst
ixpk= 0, nxpk= 0, iat= 313, 318, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11, &end
#
# 24 ASN HN 24 ASN QB 3.10
&rst
ixpk= 0, nxpk= 0, iat= 313, -1, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98,
igr2= 317, 318,
&end
#
# 24 ASN HN 25 LEU HB2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 313, 331, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 24 ASN HN 25 LEU HB3 5.15
&rst
ixpk= 0, nxpk= 0, iat= 313, 332, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65, &end
#
# 24 ASN HN 25 LEU HN 3.13
&rst
ixpk= 0, nxpk= 0, iat= 313, 327, r1= 1.30, r2= 1.80, r3= 3.13, r4= 3.63, &end
#
# 24 ASN HN 26 ASN HN 4.41
&rst
ixpk= 0, nxpk= 0, iat= 313, 346, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, &end
#
# 24 ASN QB 25 LEU HN 3.49
&rst
ixpk= 0, nxpk= 0, iat= -1, 327, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
igr1= 317, 318,
&end
#
# 25 LEU HA 25 LEU HG 4.24
&rst
ixpk= 0, nxpk= 0, iat= 329, 334, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74, &end
#
# 25 LEU HA 25 LEU QD1 2.99
&rst
ixpk= 0, nxpk= 0, iat= 329, -1, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09,
igr2= 336, 337, 338,
&end
#
# 25 LEU HA 25 LEU QD2 3.94
&rst
ixpk= 0, nxpk= 0, iat= 329, -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
igr2= 340, 341, 342,
&end
#
# 25 LEU HA 27 VAL HB 5.46
&rst
ixpk= 0, nxpk= 0, iat= 329, 364, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96, &end
#
# 25 LEU HA 28 HIS HA 5.14
&rst
ixpk= 0, nxpk= 0, iat= 329, 378, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64, &end
#
# 25 LEU HA 28 HIS HB2 3.80
&rst
ixpk= 0, nxpk= 0, iat= 329, 380, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30, &end
#
# 25 LEU HA 28 HIS HB3 3.65
&rst
ixpk= 0, nxpk= 0, iat= 329, 381, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15, &end
#
# 25 LEU HA 28 HIS HD2 5.21
&rst
ixpk= 0, nxpk= 0, iat= 329, 389, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71, &end
#
# 25 LEU HA 28 HIS HN 3.70
&rst
ixpk= 0, nxpk= 0, iat= 329, 376, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20, &end
#
# 25 LEU HA 29 LEU HG 5.50
&rst
ixpk= 0, nxpk= 0, iat= 329, 400, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 25 LEU HB2 25 LEU QD1 3.45
&rst
ixpk= 0, nxpk= 0, iat= 331, -1, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,
igr2= 336, 337, 338,
&end
#
# 25 LEU HB2 25 LEU QD2 3.38
&rst
ixpk= 0, nxpk= 0, iat= 331, -1, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,
igr2= 340, 341, 342,
&end
#
# 25 LEU HB2 26 ASN HN 4.10
&rst
ixpk= 0, nxpk= 0, iat= 331, 346, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60, &end
#
# 25 LEU HB3 25 LEU QD1 3.67
&rst
ixpk= 0, nxpk= 0, iat= 332, -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
igr2= 336, 337, 338,
&end
#
# 25 LEU HB3 25 LEU QD2 3.31
&rst
ixpk= 0, nxpk= 0, iat= 332, -1, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,
igr2= 340, 341, 342,
&end
#
# 25 LEU HB3 26 ASN HN 3.76
&rst
ixpk= 0, nxpk= 0, iat= 332, 346, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26, &end
#
# 25 LEU HB3 29 LEU QD1 5.13
&rst
ixpk= 0, nxpk= 0, iat= 332, -1, r1= 1.30, r2= 1.80, r3= 6.16, r4= 6.66,
igr2= 402, 403, 404,
&end
#
# 25 LEU HG 26 ASN HA 4.60
&rst
ixpk= 0, nxpk= 0, iat= 334, 348, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 25 LEU HG 26 ASN HN 4.59
&rst
ixpk= 0, nxpk= 0, iat= 334, 346, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 25 LEU HG 28 HIS HB3 4.91
&rst
ixpk= 0, nxpk= 0, iat= 334, 381, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41, &end
#
# 25 LEU HG 29 LEU HG 3.92
&rst
ixpk= 0, nxpk= 0, iat= 334, 400, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42, &end
#
# 25 LEU HG 29 LEU HN 5.02
&rst
ixpk= 0, nxpk= 0, iat= 334, 393, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52, &end
#
# 25 LEU HG 29 LEU QD1 3.57
&rst
ixpk= 0, nxpk= 0, iat= 334, -1, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,
igr2= 402, 403, 404,
&end
#
# 25 LEU HG 29 LEU QD2 4.35
&rst
ixpk= 0, nxpk= 0, iat= 334, -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
igr2= 406, 407, 408,
&end
#
# 25 LEU HN 25 LEU HB2 3.35
&rst
ixpk= 0, nxpk= 0, iat= 327, 331, r1= 1.30, r2= 1.80, r3= 3.35, r4= 3.85, &end
#
# 25 LEU HN 25 LEU HB3 3.26
&rst
ixpk= 0, nxpk= 0, iat= 327, 332, r1= 1.30, r2= 1.80, r3= 3.26, r4= 3.76, &end
#
# 25 LEU HN 25 LEU HG 4.53
&rst
ixpk= 0, nxpk= 0, iat= 327, 334, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03, &end
#
# 25 LEU HN 25 LEU QD1 4.14
&rst
ixpk= 0, nxpk= 0, iat= 327, -1, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
igr2= 336, 337, 338,
&end
#
# 25 LEU HN 25 LEU QD2 4.49
&rst
ixpk= 0, nxpk= 0, iat= 327, -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr2= 340, 341, 342,
&end
#
# 25 LEU HN 26 ASN HN 3.44
&rst
ixpk= 0, nxpk= 0, iat= 327, 346, r1= 1.30, r2= 1.80, r3= 3.44, r4= 3.94, &end
#
# 25 LEU HN 26 ASN QB 4.60
&rst
ixpk= 0, nxpk= 0, iat= 327, -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
igr2= 350, 351,
&end
#
# 25 LEU HN 28 HIS HB2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 327, 380, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 25 LEU QD1 26 ASN HN 4.56
&rst
ixpk= 0, nxpk= 0, iat= -1, 346, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
igr1= 336, 337, 338,
&end
#
# 25 LEU QD1 28 HIS HB2 4.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 380, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
igr1= 336, 337, 338,
&end
#
# 25 LEU QD1 28 HIS HB3 3.77
&rst
ixpk= 0, nxpk= 0, iat= -1, 381, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
igr1= 336, 337, 338,
&end
#
# 25 LEU QD1 28 HIS HD2 3.45
&rst
ixpk= 0, nxpk= 0, iat= -1, 389, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,
igr1= 336, 337, 338,
&end
#
# 25 LEU QD1 28 HIS HN 4.40
&rst
ixpk= 0, nxpk= 0, iat= -1, 376, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
igr1= 336, 337, 338,
&end
#
# 25 LEU QD1 29 LEU HA 4.54
&rst
ixpk= 0, nxpk= 0, iat= -1, 395, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,
igr1= 336, 337, 338,
&end
#
# 25 LEU QD1 29 LEU HB2 4.72
&rst
ixpk= 0, nxpk= 0, iat= -1, 397, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
igr1= 336, 337, 338,
&end
#
# 25 LEU QD1 29 LEU HB3 5.37
&rst
ixpk= 0, nxpk= 0, iat= -1, 398, r1= 1.30, r2= 1.80, r3= 6.45, r4= 6.95,
igr1= 336, 337, 338,
&end
#
# 25 LEU QD1 29 LEU HG 3.42
&rst
ixpk= 0, nxpk= 0, iat= -1, 400, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
igr1= 336, 337, 338,
&end
#
# 25 LEU QD1 29 LEU HN 3.90
&rst
ixpk= 0, nxpk= 0, iat= -1, 393, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
igr1= 336, 337, 338,
&end
#
# 25 LEU QD1 29 LEU QD2 3.38
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,
igr1= 336, 337, 338,
igr2= 406, 407, 408,
&end
#
# 25 LEU QD1 32 HIS HD2 4.79
&rst
ixpk= 0, nxpk= 0, iat= -1, 471, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
igr1= 336, 337, 338,
&end
#
# 25 LEU QD2 29 LEU HG 4.52
&rst
ixpk= 0, nxpk= 0, iat= -1, 400, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
igr1= 340, 341, 342,
&end
#
# 25 LEU QD2 29 LEU QD2 4.47
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.45, r4= 6.95,
igr1= 340, 341, 342,
igr2= 406, 407, 408,
&end
#
# 26 ASN HA 29 LEU HB2 3.98
&rst
ixpk= 0, nxpk= 0, iat= 348, 397, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48, &end
#
# 26 ASN HA 29 LEU HB3 4.99
&rst
ixpk= 0, nxpk= 0, iat= 348, 398, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49, &end
#
# 26 ASN HA 29 LEU HG 4.20
&rst
ixpk= 0, nxpk= 0, iat= 348, 400, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 26 ASN HA 29 LEU HN 3.71
&rst
ixpk= 0, nxpk= 0, iat= 348, 393, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21, &end
#
# 26 ASN HA 29 LEU QD1 3.23
&rst
ixpk= 0, nxpk= 0, iat= 348, -1, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,
igr2= 402, 403, 404,
&end
#
# 26 ASN HB2 27 VAL HN 4.10
&rst
ixpk= 0, nxpk= 0, iat= 350, 360, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60, &end
#
# 26 ASN HB2 29 LEU QD1 4.91
&rst
ixpk= 0, nxpk= 0, iat= 350, -1, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
igr2= 402, 403, 404,
&end
#
# 26 ASN HB3 27 VAL HN 4.10
&rst
ixpk= 0, nxpk= 0, iat= 351, 360, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60, &end
#
# 26 ASN HB3 29 LEU QD1 4.91
&rst
ixpk= 0, nxpk= 0, iat= 351, -1, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
igr2= 402, 403, 404,
&end
#
# 26 ASN HN 26 ASN HB2 3.71
&rst
ixpk= 0, nxpk= 0, iat= 346, 350, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21, &end
#
# 26 ASN HN 26 ASN HB3 3.71
&rst
ixpk= 0, nxpk= 0, iat= 346, 351, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21, &end
#
# 26 ASN HN 26 ASN QB 3.19
&rst
ixpk= 0, nxpk= 0, iat= 346, -1, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08,
igr2= 350, 351,
&end
#
# 26 ASN HN 27 VAL HN 3.64
&rst
ixpk= 0, nxpk= 0, iat= 346, 360, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14, &end
#
# 26 ASN HN 29 LEU QD1 4.85
&rst
ixpk= 0, nxpk= 0, iat= 346, -1, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32,
igr2= 402, 403, 404,
&end
#
# 26 ASN QB 27 VAL HN 3.43
&rst
ixpk= 0, nxpk= 0, iat= -1, 360, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35,
igr1= 350, 351,
&end
#
# 26 ASN QB 27 VAL QG2 4.02
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr1= 350, 351,
igr2= 370, 371, 372,
&end
#
# 26 ASN QB 29 LEU HB2 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, 397, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1= 350, 351,
&end
#
# 26 ASN QB 29 LEU QD1 4.23
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr1= 350, 351,
igr2= 402, 403, 404,
&end
#
# 27 VAL HA 27 VAL QG1 3.20
&rst
ixpk= 0, nxpk= 0, iat= 362, -1, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
igr2= 366, 367, 368,
&end
#
# 27 VAL HA 27 VAL QG2 2.88
&rst
ixpk= 0, nxpk= 0, iat= 362, -1, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96,
igr2= 370, 371, 372,
&end
#
# 27 VAL HA 29 LEU HN 4.72
&rst
ixpk= 0, nxpk= 0, iat= 362, 393, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22, &end
#
# 27 VAL HA 30 ARG HB3 4.83
&rst
ixpk= 0, nxpk= 0, iat= 362, 417, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33, &end
#
# 27 VAL HA 30 ARG HG2 4.45
&rst
ixpk= 0, nxpk= 0, iat= 362, 419, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95, &end
#
# 27 VAL HA 30 ARG HG3 4.45
&rst
ixpk= 0, nxpk= 0, iat= 362, 420, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95, &end
#
# 27 VAL HA 30 ARG HN 4.16
&rst
ixpk= 0, nxpk= 0, iat= 362, 412, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66, &end
#
# 27 VAL HA 30 ARG QD 3.73
&rst
ixpk= 0, nxpk= 0, iat= 362, -1, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,
igr2= 422, 423,
&end
#
# 27 VAL HA 30 ARG QG 3.73
&rst
ixpk= 0, nxpk= 0, iat= 362, -1, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,
igr2= 419, 420,
&end
#
# 27 VAL HB 28 HIS HA 4.58
&rst
ixpk= 0, nxpk= 0, iat= 364, 378, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08, &end
#
# 27 VAL HB 28 HIS HB2 4.63
&rst
ixpk= 0, nxpk= 0, iat= 364, 380, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, &end
#
# 27 VAL HB 28 HIS HN 3.27
&rst
ixpk= 0, nxpk= 0, iat= 364, 376, r1= 1.30, r2= 1.80, r3= 3.27, r4= 3.77, &end
#
# 27 VAL HB 29 LEU HN 5.26
&rst
ixpk= 0, nxpk= 0, iat= 364, 393, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76, &end
#
# 27 VAL HB 30 ARG QD 4.85
&rst
ixpk= 0, nxpk= 0, iat= 364, -1, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
igr2= 422, 423,
&end
#
# 27 VAL HN 27 VAL HB 3.08
&rst
ixpk= 0, nxpk= 0, iat= 360, 364, r1= 1.30, r2= 1.80, r3= 3.08, r4= 3.58, &end
#
# 27 VAL HN 27 VAL QG1 3.79
&rst
ixpk= 0, nxpk= 0, iat= 360, -1, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,
igr2= 366, 367, 368,
&end
#
# 27 VAL HN 27 VAL QG2 2.95
&rst
ixpk= 0, nxpk= 0, iat= 360, -1, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04,
igr2= 370, 371, 372,
&end
#
# 27 VAL HN 28 HIS HB2 5.31
&rst
ixpk= 0, nxpk= 0, iat= 360, 380, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81, &end
#
# 27 VAL HN 28 HIS HB3 4.95
&rst
ixpk= 0, nxpk= 0, iat= 360, 381, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45, &end
#
# 27 VAL HN 28 HIS HN 3.30
&rst
ixpk= 0, nxpk= 0, iat= 360, 376, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80, &end
#
# 27 VAL HN 29 LEU HN 4.36
&rst
ixpk= 0, nxpk= 0, iat= 360, 393, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86, &end
#
# 27 VAL QG1 28 HIS HA 3.98
&rst
ixpk= 0, nxpk= 0, iat= -1, 378, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
igr1= 366, 367, 368,
&end
#
# 27 VAL QG1 28 HIS HN 3.83
&rst
ixpk= 0, nxpk= 0, iat= -1, 376, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
igr1= 366, 367, 368,
&end
#
# 27 VAL QG1 30 ARG QD 3.97
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,
igr1= 366, 367, 368,
igr2= 422, 423,
&end
#
# 27 VAL QG1 30 ARG QG 4.87
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.56, r4= 7.06,
igr1= 366, 367, 368,
igr2= 419, 420,
&end
#
# 27 VAL QG1 31 LYS QD 4.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
igr1= 366, 367, 368,
igr2= 446, 447,
&end
#
# 27 VAL QG1 31 LYS QE 4.56
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
igr1= 366, 367, 368,
igr2= 449, 450,
&end
#
# 27 VAL QG2 28 HIS HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 378, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 370, 371, 372,
&end
#
# 27 VAL QG2 28 HIS HN 4.07
&rst
ixpk= 0, nxpk= 0, iat= -1, 376, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
igr1= 370, 371, 372,
&end
#
# 27 VAL QG2 30 ARG QD 4.02
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr1= 370, 371, 372,
igr2= 422, 423,
&end
#
# 28 HIS HA 28 HIS HD2 4.74
&rst
ixpk= 0, nxpk= 0, iat= 378, 389, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24, &end
#
# 28 HIS HA 31 LYS HN 4.66
&rst
ixpk= 0, nxpk= 0, iat= 378, 436, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16, &end
#
# 28 HIS HA 31 LYS QB 4.60
&rst
ixpk= 0, nxpk= 0, iat= 378, -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
igr2= 440, 441,
&end
#
# 28 HIS HA 31 LYS QD 3.94
&rst
ixpk= 0, nxpk= 0, iat= 378, -1, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
igr2= 446, 447,
&end
#
# 28 HIS HA 31 LYS QE 4.86
&rst
ixpk= 0, nxpk= 0, iat= 378, -1, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
igr2= 449, 450,
&end
#
# 28 HIS HA 31 LYS QG 4.15
&rst
ixpk= 0, nxpk= 0, iat= 378, -1, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
igr2= 443, 444,
&end
#
# 28 HIS HB2 29 LEU HN 3.97
&rst
ixpk= 0, nxpk= 0, iat= 380, 393, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47, &end
#
# 28 HIS HB3 28 HIS HD2 3.86
&rst
ixpk= 0, nxpk= 0, iat= 381, 389, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 28 HIS HB3 29 LEU HA 4.94
&rst
ixpk= 0, nxpk= 0, iat= 381, 395, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44, &end
#
# 28 HIS HB3 29 LEU HG 4.45
&rst
ixpk= 0, nxpk= 0, iat= 381, 400, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95, &end
#
# 28 HIS HB3 29 LEU HN 3.52
&rst
ixpk= 0, nxpk= 0, iat= 381, 393, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02, &end
#
# 28 HIS HD2 29 LEU HA 3.77
&rst
ixpk= 0, nxpk= 0, iat= 389, 395, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27, &end
#
# 28 HIS HD2 29 LEU HG 4.03
&rst
ixpk= 0, nxpk= 0, iat= 389, 400, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53, &end
#
# 28 HIS HD2 29 LEU HN 4.18
&rst
ixpk= 0, nxpk= 0, iat= 389, 393, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68, &end
#
# 28 HIS HD2 29 LEU QD1 4.82
&rst
ixpk= 0, nxpk= 0, iat= 389, -1, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,
igr2= 402, 403, 404,
&end
#
# 28 HIS HD2 29 LEU QD2 3.60
&rst
ixpk= 0, nxpk= 0, iat= 389, -1, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,
igr2= 406, 407, 408,
&end
#
# 28 HIS HD2 32 HIS HD2 4.03
&rst
ixpk= 0, nxpk= 0, iat= 389, 471, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53, &end
#
# 28 HIS HE1 31 LYS QD 4.95
&rst
ixpk= 0, nxpk= 0, iat= 386, -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
igr2= 446, 447,
&end
#
# 28 HIS HN 28 HIS HB2 3.22
&rst
ixpk= 0, nxpk= 0, iat= 376, 380, r1= 1.30, r2= 1.80, r3= 3.22, r4= 3.72, &end
#
# 28 HIS HN 28 HIS HB3 3.16
&rst
ixpk= 0, nxpk= 0, iat= 376, 381, r1= 1.30, r2= 1.80, r3= 3.16, r4= 3.66, &end
#
# 28 HIS HN 28 HIS HD2 5.40
&rst
ixpk= 0, nxpk= 0, iat= 376, 389, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90, &end
#
# 28 HIS HN 29 LEU HB2 5.14
&rst
ixpk= 0, nxpk= 0, iat= 376, 397, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64, &end
#
# 28 HIS HN 29 LEU HN 3.41
&rst
ixpk= 0, nxpk= 0, iat= 376, 393, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91, &end
#
# 28 HIS HN 30 ARG HN 4.55
&rst
ixpk= 0, nxpk= 0, iat= 376, 412, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05, &end
#
# 29 LEU HA 29 LEU HG 3.75
&rst
ixpk= 0, nxpk= 0, iat= 395, 400, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25, &end
#
# 29 LEU HA 29 LEU QD1 3.99
&rst
ixpk= 0, nxpk= 0, iat= 395, -1, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
igr2= 402, 403, 404,
&end
#
# 29 LEU HA 29 LEU QD2 3.07
&rst
ixpk= 0, nxpk= 0, iat= 395, -1, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19,
igr2= 406, 407, 408,
&end
#
# 29 LEU HA 30 ARG HA 5.04
&rst
ixpk= 0, nxpk= 0, iat= 395, 414, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54, &end
#
# 29 LEU HA 31 LYS HN 4.00
&rst
ixpk= 0, nxpk= 0, iat= 395, 436, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 29 LEU HA 31 LYS QB 4.82
&rst
ixpk= 0, nxpk= 0, iat= 395, -1, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,
igr2= 440, 441,
&end
#
# 29 LEU HA 32 HIS HB2 4.57
&rst
ixpk= 0, nxpk= 0, iat= 395, 462, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07, &end
#
# 29 LEU HA 32 HIS HB3 4.78
&rst
ixpk= 0, nxpk= 0, iat= 395, 463, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, &end
#
# 29 LEU HA 32 HIS HD2 3.26
&rst
ixpk= 0, nxpk= 0, iat= 395, 471, r1= 1.30, r2= 1.80, r3= 3.26, r4= 3.76, &end
#
# 29 LEU HA 32 HIS HN 4.05
&rst
ixpk= 0, nxpk= 0, iat= 395, 458, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55, &end
#
# 29 LEU HB2 29 LEU QD1 3.29
&rst
ixpk= 0, nxpk= 0, iat= 397, -1, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
igr2= 402, 403, 404,
&end
#
# 29 LEU HB2 29 LEU QD2 3.49
&rst
ixpk= 0, nxpk= 0, iat= 397, -1, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,
igr2= 406, 407, 408,
&end
#
# 29 LEU HB2 30 ARG HN 3.17
&rst
ixpk= 0, nxpk= 0, iat= 397, 412, r1= 1.30, r2= 1.80, r3= 3.17, r4= 3.67, &end
#
# 29 LEU HB2 32 HIS HD2 4.95
&rst
ixpk= 0, nxpk= 0, iat= 397, 471, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45, &end
#
# 29 LEU HB2 33 THR QG2 4.61
&rst
ixpk= 0, nxpk= 0, iat= 397, -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
igr2= 481, 482, 483,
&end
#
# 29 LEU HB3 29 LEU QD1 3.31
&rst
ixpk= 0, nxpk= 0, iat= 398, -1, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,
igr2= 402, 403, 404,
&end
#
# 29 LEU HB3 29 LEU QD2 3.27
&rst
ixpk= 0, nxpk= 0, iat= 398, -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
igr2= 406, 407, 408,
&end
#
# 29 LEU HB3 30 ARG HN 4.36
&rst
ixpk= 0, nxpk= 0, iat= 398, 412, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86, &end
#
# 29 LEU HB3 31 LYS HN 5.39
&rst
ixpk= 0, nxpk= 0, iat= 398, 436, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89, &end
#
# 29 LEU HB3 32 HIS HD2 4.23
&rst
ixpk= 0, nxpk= 0, iat= 398, 471, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73, &end
#
# 29 LEU HB3 33 THR QG2 4.61
&rst
ixpk= 0, nxpk= 0, iat= 398, -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
igr2= 481, 482, 483,
&end
#
# 29 LEU HG 30 ARG HN 4.58
&rst
ixpk= 0, nxpk= 0, iat= 400, 412, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08, &end
#
# 29 LEU HG 32 HIS HD2 4.47
&rst
ixpk= 0, nxpk= 0, iat= 400, 471, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97, &end
#
# 29 LEU HG 32 HIS HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 400, 458, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 29 LEU HN 29 LEU HB2 3.24
&rst
ixpk= 0, nxpk= 0, iat= 393, 397, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74, &end
#
# 29 LEU HN 29 LEU HB3 3.71
&rst
ixpk= 0, nxpk= 0, iat= 393, 398, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21, &end
#
# 29 LEU HN 29 LEU HG 3.27
&rst
ixpk= 0, nxpk= 0, iat= 393, 400, r1= 1.30, r2= 1.80, r3= 3.27, r4= 3.77, &end
#
# 29 LEU HN 29 LEU QD1 4.07
&rst
ixpk= 0, nxpk= 0, iat= 393, -1, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
igr2= 402, 403, 404,
&end
#
# 29 LEU HN 29 LEU QD2 3.93
&rst
ixpk= 0, nxpk= 0, iat= 393, -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
igr2= 406, 407, 408,
&end
#
# 29 LEU HN 30 ARG HB2 5.43
&rst
ixpk= 0, nxpk= 0, iat= 393, 416, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93, &end
#
# 29 LEU HN 30 ARG HN 3.43
&rst
ixpk= 0, nxpk= 0, iat= 393, 412, r1= 1.30, r2= 1.80, r3= 3.43, r4= 3.93, &end
#
# 29 LEU HN 31 LYS HN 4.54
&rst
ixpk= 0, nxpk= 0, iat= 393, 436, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 29 LEU HN 31 LYS QB 5.50
&rst
ixpk= 0, nxpk= 0, iat= 393, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 440, 441,
&end
#
# 29 LEU QD1 30 ARG HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 414, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 402, 403, 404,
&end
#
# 29 LEU QD1 30 ARG HN 4.47
&rst
ixpk= 0, nxpk= 0, iat= -1, 412, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr1= 402, 403, 404,
&end
#
# 29 LEU QD1 32 HIS HB2 5.47
&rst
ixpk= 0, nxpk= 0, iat= -1, 462, r1= 1.30, r2= 1.80, r3= 6.57, r4= 7.07,
igr1= 402, 403, 404,
&end
#
# 29 LEU QD1 32 HIS HD2 4.80
&rst
ixpk= 0, nxpk= 0, iat= -1, 471, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
igr1= 402, 403, 404,
&end
#
# 29 LEU QD2 30 ARG HN 5.01
&rst
ixpk= 0, nxpk= 0, iat= -1, 412, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,
igr1= 406, 407, 408,
&end
#
# 29 LEU QD2 32 HIS HB2 4.43
&rst
ixpk= 0, nxpk= 0, iat= -1, 462, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
igr1= 406, 407, 408,
&end
#
# 29 LEU QD2 32 HIS HB3 4.35
&rst
ixpk= 0, nxpk= 0, iat= -1, 463, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
igr1= 406, 407, 408,
&end
#
# 29 LEU QD2 32 HIS HD2 3.40
&rst
ixpk= 0, nxpk= 0, iat= -1, 471, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,
igr1= 406, 407, 408,
&end
#
# 29 LEU QD2 32 HIS HN 4.60
&rst
ixpk= 0, nxpk= 0, iat= -1, 458, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
igr1= 406, 407, 408,
&end
#
# 29 LEU QD2 33 THR HN 4.93
&rst
ixpk= 0, nxpk= 0, iat= -1, 475, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
igr1= 406, 407, 408,
&end
#
# 30 ARG HA 30 ARG HG2 3.86
&rst
ixpk= 0, nxpk= 0, iat= 414, 419, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 30 ARG HA 30 ARG HG3 3.86
&rst
ixpk= 0, nxpk= 0, iat= 414, 420, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 30 ARG HA 30 ARG QD 4.15
&rst
ixpk= 0, nxpk= 0, iat= 414, -1, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
igr2= 422, 423,
&end
#
# 30 ARG HA 30 ARG QG 3.18
&rst
ixpk= 0, nxpk= 0, iat= 414, -1, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07,
igr2= 419, 420,
&end
#
# 30 ARG HA 32 HIS HN 4.55
&rst
ixpk= 0, nxpk= 0, iat= 414, 458, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05, &end
#
# 30 ARG HA 33 THR QG2 4.09
&rst
ixpk= 0, nxpk= 0, iat= 414, -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
igr2= 481, 482, 483,
&end
#
# 30 ARG HB2 30 ARG QD 3.76
&rst
ixpk= 0, nxpk= 0, iat= 416, -1, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
igr2= 422, 423,
&end
#
# 30 ARG HB2 31 LYS HN 4.13
&rst
ixpk= 0, nxpk= 0, iat= 416, 436, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63, &end
#
# 30 ARG HB3 30 ARG QD 3.74
&rst
ixpk= 0, nxpk= 0, iat= 417, -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
igr2= 422, 423,
&end
#
# 30 ARG HB3 31 LYS HA 4.83
&rst
ixpk= 0, nxpk= 0, iat= 417, 438, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33, &end
#
# 30 ARG HB3 31 LYS HN 4.15
&rst
ixpk= 0, nxpk= 0, iat= 417, 436, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65, &end
#
# 30 ARG HN 30 ARG HB2 3.18
&rst
ixpk= 0, nxpk= 0, iat= 412, 416, r1= 1.30, r2= 1.80, r3= 3.18, r4= 3.68, &end
#
# 30 ARG HN 30 ARG HB3 3.77
&rst
ixpk= 0, nxpk= 0, iat= 412, 417, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27, &end
#
# 30 ARG HN 30 ARG HG2 3.84
&rst
ixpk= 0, nxpk= 0, iat= 412, 419, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34, &end
#
# 30 ARG HN 30 ARG HG3 3.84
&rst
ixpk= 0, nxpk= 0, iat= 412, 420, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34, &end
#
# 30 ARG HN 30 ARG QD 4.13
&rst
ixpk= 0, nxpk= 0, iat= 412, -1, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
igr2= 422, 423,
&end
#
# 30 ARG HN 30 ARG QG 3.30
&rst
ixpk= 0, nxpk= 0, iat= 412, -1, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,
igr2= 419, 420,
&end
#
# 30 ARG HN 31 LYS HA 5.48
&rst
ixpk= 0, nxpk= 0, iat= 412, 438, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98, &end
#
# 30 ARG HN 31 LYS HN 3.33
&rst
ixpk= 0, nxpk= 0, iat= 412, 436, r1= 1.30, r2= 1.80, r3= 3.33, r4= 3.83, &end
#
# 30 ARG HN 31 LYS QB 5.18
&rst
ixpk= 0, nxpk= 0, iat= 412, -1, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
igr2= 440, 441,
&end
#
# 30 ARG HN 31 LYS QG 4.48
&rst
ixpk= 0, nxpk= 0, iat= 412, -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
igr2= 443, 444,
&end
#
# 30 ARG QG 31 LYS HN 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, 436, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1= 419, 420,
&end
#
# 31 LYS HA 31 LYS QB 2.92
&rst
ixpk= 0, nxpk= 0, iat= 438, -1, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78,
igr2= 440, 441,
&end
#
# 31 LYS HA 31 LYS QD 4.25
&rst
ixpk= 0, nxpk= 0, iat= 438, -1, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
igr2= 446, 447,
&end
#
# 31 LYS HA 31 LYS QG 3.37
&rst
ixpk= 0, nxpk= 0, iat= 438, -1, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,
igr2= 443, 444,
&end
#
# 31 LYS HN 31 LYS QB 3.03
&rst
ixpk= 0, nxpk= 0, iat= 436, -1, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,
igr2= 440, 441,
&end
#
# 31 LYS HN 31 LYS QD 4.83
&rst
ixpk= 0, nxpk= 0, iat= 436, -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr2= 446, 447,
&end
#
# 31 LYS HN 31 LYS QE 4.87
&rst
ixpk= 0, nxpk= 0, iat= 436, -1, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,
igr2= 449, 450,
&end
#
# 31 LYS HN 31 LYS QG 3.48
&rst
ixpk= 0, nxpk= 0, iat= 436, -1, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41,
igr2= 443, 444,
&end
#
# 31 LYS HN 32 HIS HB2 4.57
&rst
ixpk= 0, nxpk= 0, iat= 436, 462, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07, &end
#
# 31 LYS HN 32 HIS HD2 5.20
&rst
ixpk= 0, nxpk= 0, iat= 436, 471, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70, &end
#
# 31 LYS HN 32 HIS HN 3.08
&rst
ixpk= 0, nxpk= 0, iat= 436, 458, r1= 1.30, r2= 1.80, r3= 3.08, r4= 3.58, &end
#
# 31 LYS QB 31 LYS QE 4.20
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,
igr1= 440, 441,
igr2= 449, 450,
&end
#
# 31 LYS QB 31 LYS QG 2.79
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02,
igr1= 440, 441,
igr2= 443, 444,
&end
#
# 31 LYS QB 32 HIS HN 3.64
&rst
ixpk= 0, nxpk= 0, iat= -1, 458, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59,
igr1= 440, 441,
&end
#
# 31 LYS QG 31 LYS QE 3.44
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,
igr1= 443, 444,
igr2= 449, 450,
&end
#
# 31 LYS QG 32 HIS HN 4.53
&rst
ixpk= 0, nxpk= 0, iat= -1, 458, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
igr1= 443, 444,
&end
#
# 32 HIS HB2 32 HIS HD2 3.72
&rst
ixpk= 0, nxpk= 0, iat= 462, 471, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22, &end
#
# 32 HIS HB2 33 THR QG2 4.86
&rst
ixpk= 0, nxpk= 0, iat= 462, -1, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
igr2= 481, 482, 483,
&end
#
# 32 HIS HB3 32 HIS HD2 3.96
&rst
ixpk= 0, nxpk= 0, iat= 463, 471, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46, &end
#
# 32 HIS HB3 33 THR QG2 4.71
&rst
ixpk= 0, nxpk= 0, iat= 463, -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr2= 481, 482, 483,
&end
#
# 32 HIS HN 32 HIS HB2 3.30
&rst
ixpk= 0, nxpk= 0, iat= 458, 462, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80, &end
#
# 32 HIS HN 32 HIS HB3 3.71
&rst
ixpk= 0, nxpk= 0, iat= 458, 463, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21, &end
#
# 32 HIS HN 32 HIS HD2 3.96
&rst
ixpk= 0, nxpk= 0, iat= 458, 471, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46, &end
#
# 32 HIS HN 33 THR HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= 458, 477, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 32 HIS HN 33 THR HN 4.10
&rst
ixpk= 0, nxpk= 0, iat= 458, 475, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60, &end
#
# 32 HIS HN 33 THR QG2 4.74
&rst
ixpk= 0, nxpk= 0, iat= 458, -1, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
igr2= 481, 482, 483,
&end
#
# 33 THR HA 33 THR QG2 3.29
&rst
ixpk= 0, nxpk= 0, iat= 477, -1, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
igr2= 481, 482, 483,
&end
#
# 33 THR HN 33 THR HB 4.16
&rst
ixpk= 0, nxpk= 0, iat= 475, 479, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66, &end
#
# 33 THR HN 33 THR QG2 4.91
&rst
ixpk= 0, nxpk= 0, iat= 475, -1, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
igr2= 481, 482, 483,
&end
#
# 35 GLU HA 35 GLU QG 3.65
&rst
ixpk= 0, nxpk= 0, iat= 498, -1, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,
igr2= 503, 504,
&end
#
# 35 GLU HA 36 LYS HN 3.20
&rst
ixpk= 0, nxpk= 0, iat= 498, 511, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 35 GLU HB2 36 LYS HN 4.54
&rst
ixpk= 0, nxpk= 0, iat= 500, 511, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 35 GLU HB3 36 LYS HN 4.54
&rst
ixpk= 0, nxpk= 0, iat= 501, 511, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 35 GLU HN 35 GLU QG 4.36
&rst
ixpk= 0, nxpk= 0, iat= 496, -1, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
igr2= 503, 504,
&end
#
# 35 GLU QB 36 LYS HN 3.93
&rst
ixpk= 0, nxpk= 0, iat= -1, 511, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
igr1= 500, 501,
&end
#
# 36 LYS HN 36 LYS QG 4.39
&rst
ixpk= 0, nxpk= 0, iat= 511, -1, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,
igr2= 518, 519,
&end
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