NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
466858 |
2rr6   |
cing | 1-original | 4 | AMBER | distance | NOE | simple |
#
# 6 SER HA 33 ASN HB2 4.75
&rst
ixpk= 0, nxpk= 0, iat= 53, 509, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25,
rk2 = 32.0, rk3 = 32.0, ir6=1, ialtd=0,
&end
#
# 6 SER HA 33 ASN HB3 4.75
&rst
ixpk= 0, nxpk= 0, iat= 53, 510, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, &end
#
# 6 SER HA 7 GLY QA 4.98
&rst
ixpk= 0, nxpk= 0, iat= 53, -1, r1= 1.30, r2= 1.80, r3= 5.59, r4= 6.09,
igr2= 64, 65,
&end
#
# 6 SER HA 8 MET HN 5.07
&rst
ixpk= 0, nxpk= 0, iat= 53, 69, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, &end
#
# 6 SER QB 33 ASN QB 3.86
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
igr1= 55, 56,
igr2= 509, 510,
&end
#
# 7 GLY HA2 35 LYS QD 4.63
&rst
ixpk= 0, nxpk= 0, iat= 64, -1, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
igr2= 540, 541,
&end
#
# 7 GLY HA2 35 LYS QG 4.63
&rst
ixpk= 0, nxpk= 0, iat= 64, -1, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
igr2= 537, 538,
&end
#
# 7 GLY HA3 35 LYS QD 4.63
&rst
ixpk= 0, nxpk= 0, iat= 65, -1, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
igr2= 540, 541,
&end
#
# 7 GLY HA3 35 LYS QG 4.63
&rst
ixpk= 0, nxpk= 0, iat= 65, -1, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
igr2= 537, 538,
&end
#
# 7 GLY HN 35 LYS QE 5.34
&rst
ixpk= 0, nxpk= 0, iat= 62, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2= 543, 544,
&end
#
# 7 GLY HN 8 MET HN 4.30
&rst
ixpk= 0, nxpk= 0, iat= 62, 69, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80, &end
#
# 7 GLY HN 8 MET QB 4.55
&rst
ixpk= 0, nxpk= 0, iat= 62, -1, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,
igr2= 73, 74,
&end
#
# 7 GLY QA 35 LYS HN 5.20
&rst
ixpk= 0, nxpk= 0, iat= -1, 530, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
igr1= 64, 65,
&end
#
# 7 GLY QA 35 LYS QB 4.41
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
igr1= 64, 65,
igr2= 534, 535,
&end
#
# 7 GLY QA 35 LYS QD 3.99
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
igr1= 64, 65,
igr2= 540, 541,
&end
#
# 7 GLY QA 35 LYS QE 3.92
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
igr1= 64, 65,
igr2= 543, 544,
&end
#
# 7 GLY QA 35 LYS QG 4.01
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
igr1= 64, 65,
igr2= 537, 538,
&end
#
# 7 GLY QA 8 MET HA 5.32
&rst
ixpk= 0, nxpk= 0, iat= -1, 71, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr1= 64, 65,
&end
#
# 7 GLY QA 8 MET QB 5.18
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.53, r4= 7.03,
igr1= 64, 65,
igr2= 73, 74,
&end
#
# 8 MET HA 35 LYS HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 71, 530, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 8 MET HA 35 LYS QG 5.50
&rst
ixpk= 0, nxpk= 0, iat= 71, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 537, 538,
&end
#
# 8 MET HA 8 MET HG2 3.88
&rst
ixpk= 0, nxpk= 0, iat= 71, 76, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38, &end
#
# 8 MET HA 8 MET HG3 3.88
&rst
ixpk= 0, nxpk= 0, iat= 71, 77, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38, &end
#
# 8 MET HA 9 ASP HB2 5.05
&rst
ixpk= 0, nxpk= 0, iat= 71, 90, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55, &end
#
# 8 MET HA 9 ASP HN 3.14
&rst
ixpk= 0, nxpk= 0, iat= 71, 86, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64, &end
#
# 8 MET HB2 13 ARG HD3 4.81
&rst
ixpk= 0, nxpk= 0, iat= 73, 172, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31, &end
#
# 8 MET HB2 9 ASP HN 4.33
&rst
ixpk= 0, nxpk= 0, iat= 73, 86, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83, &end
#
# 8 MET HB3 13 ARG HD3 4.81
&rst
ixpk= 0, nxpk= 0, iat= 74, 172, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31, &end
#
# 8 MET HB3 9 ASP HN 4.33
&rst
ixpk= 0, nxpk= 0, iat= 74, 86, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83, &end
#
# 8 MET HG2 12 ARG HN 5.49
&rst
ixpk= 0, nxpk= 0, iat= 76, 137, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99, &end
#
# 8 MET HG2 12 ARG QB 3.89
&rst
ixpk= 0, nxpk= 0, iat= 76, -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
igr2= 141, 142,
&end
#
# 8 MET HG2 13 ARG HA 4.96
&rst
ixpk= 0, nxpk= 0, iat= 76, 163, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46, &end
#
# 8 MET HG2 13 ARG HB2 4.70
&rst
ixpk= 0, nxpk= 0, iat= 76, 165, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 8 MET HG2 13 ARG HD3 5.50
&rst
ixpk= 0, nxpk= 0, iat= 76, 172, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 8 MET HG2 13 ARG HN 4.41
&rst
ixpk= 0, nxpk= 0, iat= 76, 161, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, &end
#
# 8 MET HG2 16 LEU QD1 5.50
&rst
ixpk= 0, nxpk= 0, iat= 76, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2= 230, 231, 232,
&end
#
# 8 MET HG2 16 LEU QD2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 76, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2= 234, 235, 236,
&end
#
# 8 MET HG2 8 MET QE 3.28
&rst
ixpk= 0, nxpk= 0, iat= 76, -1, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,
igr2= 80, 81, 82,
&end
#
# 8 MET HG2 9 ASP HN 4.06
&rst
ixpk= 0, nxpk= 0, iat= 76, 86, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56, &end
#
# 8 MET HG3 12 ARG HN 5.49
&rst
ixpk= 0, nxpk= 0, iat= 77, 137, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99, &end
#
# 8 MET HG3 12 ARG QB 3.89
&rst
ixpk= 0, nxpk= 0, iat= 77, -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
igr2= 141, 142,
&end
#
# 8 MET HG3 13 ARG HA 4.96
&rst
ixpk= 0, nxpk= 0, iat= 77, 163, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46, &end
#
# 8 MET HG3 13 ARG HB2 4.70
&rst
ixpk= 0, nxpk= 0, iat= 77, 165, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 8 MET HG3 13 ARG HD3 5.50
&rst
ixpk= 0, nxpk= 0, iat= 77, 172, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 8 MET HG3 13 ARG HN 4.41
&rst
ixpk= 0, nxpk= 0, iat= 77, 161, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, &end
#
# 8 MET HG3 16 LEU QD1 5.50
&rst
ixpk= 0, nxpk= 0, iat= 77, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2= 230, 231, 232,
&end
#
# 8 MET HG3 16 LEU QD2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 77, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2= 234, 235, 236,
&end
#
# 8 MET HG3 8 MET QE 3.28
&rst
ixpk= 0, nxpk= 0, iat= 77, -1, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,
igr2= 80, 81, 82,
&end
#
# 8 MET HG3 9 ASP HN 4.06
&rst
ixpk= 0, nxpk= 0, iat= 77, 86, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56, &end
#
# 8 MET HN 34 CYS HA 4.23
&rst
ixpk= 0, nxpk= 0, iat= 69, 521, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73, &end
#
# 8 MET HN 35 LYS HN 4.95
&rst
ixpk= 0, nxpk= 0, iat= 69, 530, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45, &end
#
# 8 MET HN 8 MET HB2 3.66
&rst
ixpk= 0, nxpk= 0, iat= 69, 73, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16, &end
#
# 8 MET HN 8 MET HB3 3.66
&rst
ixpk= 0, nxpk= 0, iat= 69, 74, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16, &end
#
# 8 MET HN 8 MET HG2 4.79
&rst
ixpk= 0, nxpk= 0, iat= 69, 76, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29, &end
#
# 8 MET HN 8 MET HG3 4.79
&rst
ixpk= 0, nxpk= 0, iat= 69, 77, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29, &end
#
# 8 MET QB 13 ARG HB2 4.33
&rst
ixpk= 0, nxpk= 0, iat= -1, 165, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
igr1= 73, 74,
&end
#
# 8 MET QB 13 ARG HD3 4.08
&rst
ixpk= 0, nxpk= 0, iat= -1, 172, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
igr1= 73, 74,
&end
#
# 8 MET QB 13 ARG HN 4.62
&rst
ixpk= 0, nxpk= 0, iat= -1, 161, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
igr1= 73, 74,
&end
#
# 8 MET QE 12 ARG HD2 4.22
&rst
ixpk= 0, nxpk= 0, iat= -1, 147, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
igr1= 80, 81, 82,
&end
#
# 8 MET QE 12 ARG HD3 4.22
&rst
ixpk= 0, nxpk= 0, iat= -1, 148, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
igr1= 80, 81, 82,
&end
#
# 8 MET QE 12 ARG HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 137, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 80, 81, 82,
&end
#
# 8 MET QE 12 ARG QD 3.48
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,
igr1= 80, 81, 82,
igr2= 147, 148,
&end
#
# 8 MET QE 12 ARG QG 3.68
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
igr1= 80, 81, 82,
igr2= 144, 145,
&end
#
# 8 MET QE 13 ARG HA 3.81
&rst
ixpk= 0, nxpk= 0, iat= -1, 163, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
igr1= 80, 81, 82,
&end
#
# 8 MET QE 13 ARG HD2 5.28
&rst
ixpk= 0, nxpk= 0, iat= -1, 171, r1= 1.30, r2= 1.80, r3= 6.34, r4= 6.84,
igr1= 80, 81, 82,
&end
#
# 8 MET QE 13 ARG HN 5.27
&rst
ixpk= 0, nxpk= 0, iat= -1, 161, r1= 1.30, r2= 1.80, r3= 6.33, r4= 6.83,
igr1= 80, 81, 82,
&end
#
# 8 MET QE 16 LEU HG 4.31
&rst
ixpk= 0, nxpk= 0, iat= -1, 228, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
igr1= 80, 81, 82,
&end
#
# 8 MET QE 16 LEU HN 5.26
&rst
ixpk= 0, nxpk= 0, iat= -1, 221, r1= 1.30, r2= 1.80, r3= 6.32, r4= 6.82,
igr1= 80, 81, 82,
&end
#
# 8 MET QE 16 LEU QD1 3.01
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,
igr1= 80, 81, 82,
igr2= 230, 231, 232,
&end
#
# 8 MET QE 16 LEU QD2 3.01
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,
igr1= 80, 81, 82,
igr2= 234, 235, 236,
&end
#
# 8 MET QE 9 ASP HN 5.01
&rst
ixpk= 0, nxpk= 0, iat= -1, 86, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,
igr1= 80, 81, 82,
&end
#
# 8 MET QG 12 ARG HN 4.64
&rst
ixpk= 0, nxpk= 0, iat= -1, 137, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,
igr1= 76, 77,
&end
#
# 8 MET QG 12 ARG QD 4.26
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr1= 76, 77,
igr2= 147, 148,
&end
#
# 8 MET QG 12 ARG QG 4.25
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,
igr1= 76, 77,
igr2= 144, 145,
&end
#
# 8 MET QG 13 ARG HA 4.24
&rst
ixpk= 0, nxpk= 0, iat= -1, 163, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
igr1= 76, 77,
&end
#
# 8 MET QG 13 ARG HB2 4.02
&rst
ixpk= 0, nxpk= 0, iat= -1, 165, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,
igr1= 76, 77,
&end
#
# 8 MET QG 16 LEU QQD 4.07
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.16, r4= 6.66,
igr1= 76, 77,
igr2= 230, 231, 232, 234, 235, 236,
&end
#
# 8 MET QG 8 MET QE 2.80
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
igr1= 76, 77,
igr2= 80, 81, 82,
&end
#
# 9 ASP HB2 10 MET HN 4.10
&rst
ixpk= 0, nxpk= 0, iat= 90, 98, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60, &end
#
# 9 ASP HB2 11 LYS HN 4.60
&rst
ixpk= 0, nxpk= 0, iat= 90, 115, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 9 ASP HB2 12 ARG HN 4.67
&rst
ixpk= 0, nxpk= 0, iat= 90, 137, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, &end
#
# 9 ASP HB2 12 ARG QB 4.05
&rst
ixpk= 0, nxpk= 0, iat= 90, -1, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,
igr2= 141, 142,
&end
#
# 9 ASP HB3 10 MET HN 3.91
&rst
ixpk= 0, nxpk= 0, iat= 91, 98, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41, &end
#
# 9 ASP HB3 10 MET QB 4.79
&rst
ixpk= 0, nxpk= 0, iat= 91, -1, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
igr2= 102, 103,
&end
#
# 9 ASP HB3 11 LYS HN 4.29
&rst
ixpk= 0, nxpk= 0, iat= 91, 115, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79, &end
#
# 9 ASP HB3 11 LYS QB 4.40
&rst
ixpk= 0, nxpk= 0, iat= 91, -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
igr2= 119, 120,
&end
#
# 9 ASP HB3 12 ARG HN 4.45
&rst
ixpk= 0, nxpk= 0, iat= 91, 137, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95, &end
#
# 9 ASP HB3 12 ARG QB 4.05
&rst
ixpk= 0, nxpk= 0, iat= 91, -1, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,
igr2= 141, 142,
&end
#
# 9 ASP HB3 36 SER HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= 91, 554, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 9 ASP HN 10 MET HN 4.72
&rst
ixpk= 0, nxpk= 0, iat= 86, 98, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22, &end
#
# 9 ASP HN 12 ARG HG2 5.04
&rst
ixpk= 0, nxpk= 0, iat= 86, 144, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54, &end
#
# 9 ASP HN 12 ARG HG3 5.04
&rst
ixpk= 0, nxpk= 0, iat= 86, 145, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54, &end
#
# 9 ASP HN 12 ARG QB 3.97
&rst
ixpk= 0, nxpk= 0, iat= 86, -1, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
igr2= 141, 142,
&end
#
# 9 ASP HN 12 ARG QG 4.27
&rst
ixpk= 0, nxpk= 0, iat= 86, -1, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
igr2= 144, 145,
&end
#
# 9 ASP HN 9 ASP HB2 3.75
&rst
ixpk= 0, nxpk= 0, iat= 86, 90, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25, &end
#
# 9 ASP HN 9 ASP HB3 3.90
&rst
ixpk= 0, nxpk= 0, iat= 86, 91, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40, &end
#
# 10 MET HA 10 MET HG2 3.78
&rst
ixpk= 0, nxpk= 0, iat= 100, 105, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28, &end
#
# 10 MET HA 10 MET HG3 3.78
&rst
ixpk= 0, nxpk= 0, iat= 100, 106, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28, &end
#
# 10 MET HA 10 MET QE 3.95
&rst
ixpk= 0, nxpk= 0, iat= 100, -1, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr2= 109, 110, 111,
&end
#
# 10 MET HA 13 ARG HB2 4.22
&rst
ixpk= 0, nxpk= 0, iat= 100, 165, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 10 MET HA 13 ARG HB3 4.70
&rst
ixpk= 0, nxpk= 0, iat= 100, 166, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 10 MET HA 13 ARG HN 4.05
&rst
ixpk= 0, nxpk= 0, iat= 100, 161, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55, &end
#
# 10 MET HA 14 ILE HG13 4.15
&rst
ixpk= 0, nxpk= 0, iat= 100, 196, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65, &end
#
# 10 MET HA 14 ILE HN 4.81
&rst
ixpk= 0, nxpk= 0, iat= 100, 185, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31, &end
#
# 10 MET HA 34 CYS HB2 4.86
&rst
ixpk= 0, nxpk= 0, iat= 100, 523, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36, &end
#
# 10 MET HA 34 CYS HB3 4.86
&rst
ixpk= 0, nxpk= 0, iat= 100, 524, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36, &end
#
# 10 MET HA 34 CYS QB 4.09
&rst
ixpk= 0, nxpk= 0, iat= 100, -1, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
igr2= 523, 524,
&end
#
# 10 MET HA 35 LYS HN 4.48
&rst
ixpk= 0, nxpk= 0, iat= 100, 530, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98, &end
#
# 10 MET HG2 10 MET QE 3.47
&rst
ixpk= 0, nxpk= 0, iat= 105, -1, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,
igr2= 109, 110, 111,
&end
#
# 10 MET HG2 14 ILE HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 105, 185, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 10 MET HG2 14 ILE QD1 3.54
&rst
ixpk= 0, nxpk= 0, iat= 105, -1, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,
igr2= 198, 199, 200,
&end
#
# 10 MET HG3 10 MET QE 3.47
&rst
ixpk= 0, nxpk= 0, iat= 106, -1, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,
igr2= 109, 110, 111,
&end
#
# 10 MET HG3 14 ILE HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 106, 185, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 10 MET HG3 14 ILE QD1 3.54
&rst
ixpk= 0, nxpk= 0, iat= 106, -1, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,
igr2= 198, 199, 200,
&end
#
# 10 MET HN 10 MET QB 3.23
&rst
ixpk= 0, nxpk= 0, iat= 98, -1, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13,
igr2= 102, 103,
&end
#
# 10 MET HN 10 MET QE 3.87
&rst
ixpk= 0, nxpk= 0, iat= 98, -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
igr2= 109, 110, 111,
&end
#
# 10 MET HN 10 MET QG 4.55
&rst
ixpk= 0, nxpk= 0, iat= 98, -1, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,
igr2= 105, 106,
&end
#
# 10 MET HN 11 LYS HN 3.95
&rst
ixpk= 0, nxpk= 0, iat= 98, 115, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45, &end
#
# 10 MET HN 12 ARG HN 4.88
&rst
ixpk= 0, nxpk= 0, iat= 98, 137, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38, &end
#
# 10 MET HN 14 ILE QD1 5.49
&rst
ixpk= 0, nxpk= 0, iat= 98, -1, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
igr2= 198, 199, 200,
&end
#
# 10 MET HN 34 CYS QB 4.85
&rst
ixpk= 0, nxpk= 0, iat= 98, -1, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
igr2= 523, 524,
&end
#
# 10 MET HN 35 LYS HB2 4.87
&rst
ixpk= 0, nxpk= 0, iat= 98, 534, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37, &end
#
# 10 MET HN 35 LYS HB3 4.87
&rst
ixpk= 0, nxpk= 0, iat= 98, 535, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37, &end
#
# 10 MET HN 35 LYS QB 4.24
&rst
ixpk= 0, nxpk= 0, iat= 98, -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
igr2= 534, 535,
&end
#
# 10 MET HN 36 SER HA 4.46
&rst
ixpk= 0, nxpk= 0, iat= 98, 554, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, &end
#
# 10 MET QB 10 MET QE 2.88
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,
igr1= 102, 103,
igr2= 109, 110, 111,
&end
#
# 10 MET QB 11 LYS HN 3.56
&rst
ixpk= 0, nxpk= 0, iat= -1, 115, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,
igr1= 102, 103,
&end
#
# 10 MET QB 11 LYS QB 4.32
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
igr1= 102, 103,
igr2= 119, 120,
&end
#
# 10 MET QB 12 ARG HN 4.71
&rst
ixpk= 0, nxpk= 0, iat= -1, 137, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,
igr1= 102, 103,
&end
#
# 10 MET QB 14 ILE QD1 4.08
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
igr1= 102, 103,
igr2= 198, 199, 200,
&end
#
# 10 MET QB 36 SER HA 4.01
&rst
ixpk= 0, nxpk= 0, iat= -1, 554, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
igr1= 102, 103,
&end
#
# 10 MET QB 37 ASN HN 4.99
&rst
ixpk= 0, nxpk= 0, iat= -1, 563, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
igr1= 102, 103,
&end
#
# 10 MET QB 37 ASN QB 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
igr1= 102, 103,
igr2= 567, 568,
&end
#
# 10 MET QB 41 ILE HA 4.47
&rst
ixpk= 0, nxpk= 0, iat= -1, 620, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
igr1= 102, 103,
&end
#
# 10 MET QB 41 ILE QG2 4.49
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
igr1= 102, 103,
igr2= 624, 625, 626,
&end
#
# 10 MET QE 34 CYS QB 4.88
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.58, r4= 7.08,
igr1= 109, 110, 111,
igr2= 523, 524,
&end
#
# 10 MET QE 35 LYS HA 4.77
&rst
ixpk= 0, nxpk= 0, iat= -1, 532, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23,
igr1= 109, 110, 111,
&end
#
# 10 MET QE 36 SER HA 3.27
&rst
ixpk= 0, nxpk= 0, iat= -1, 554, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
igr1= 109, 110, 111,
&end
#
# 10 MET QE 36 SER HB2 3.96
&rst
ixpk= 0, nxpk= 0, iat= -1, 556, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
igr1= 109, 110, 111,
&end
#
# 10 MET QE 36 SER HB3 3.96
&rst
ixpk= 0, nxpk= 0, iat= -1, 557, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
igr1= 109, 110, 111,
&end
#
# 10 MET QE 36 SER HN 4.14
&rst
ixpk= 0, nxpk= 0, iat= -1, 552, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
igr1= 109, 110, 111,
&end
#
# 10 MET QE 36 SER QB 3.21
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,
igr1= 109, 110, 111,
igr2= 556, 557,
&end
#
# 10 MET QE 37 ASN HN 4.22
&rst
ixpk= 0, nxpk= 0, iat= -1, 563, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
igr1= 109, 110, 111,
&end
#
# 10 MET QE 41 ILE HA 3.62
&rst
ixpk= 0, nxpk= 0, iat= -1, 620, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,
igr1= 109, 110, 111,
&end
#
# 10 MET QE 41 ILE HN 4.93
&rst
ixpk= 0, nxpk= 0, iat= -1, 618, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
igr1= 109, 110, 111,
&end
#
# 10 MET QE 42 GLU HN 4.27
&rst
ixpk= 0, nxpk= 0, iat= -1, 637, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
igr1= 109, 110, 111,
&end
#
# 10 MET QE 59 VAL HA 5.21
&rst
ixpk= 0, nxpk= 0, iat= -1, 905, r1= 1.30, r2= 1.80, r3= 6.26, r4= 6.76,
igr1= 109, 110, 111,
&end
#
# 10 MET QE 59 VAL QG2 3.54
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,
igr1= 109, 110, 111,
igr2= 913, 914, 915,
&end
#
# 10 MET QG 10 MET QE 3.03
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,
igr1= 105, 106,
igr2= 109, 110, 111,
&end
#
# 10 MET QG 11 LYS HA 4.57
&rst
ixpk= 0, nxpk= 0, iat= -1, 117, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
igr1= 105, 106,
&end
#
# 10 MET QG 11 LYS HN 4.94
&rst
ixpk= 0, nxpk= 0, iat= -1, 115, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
igr1= 105, 106,
&end
#
# 10 MET QG 14 ILE HB 4.92
&rst
ixpk= 0, nxpk= 0, iat= -1, 189, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
igr1= 105, 106,
&end
#
# 10 MET QG 14 ILE HN 4.68
&rst
ixpk= 0, nxpk= 0, iat= -1, 185, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
igr1= 105, 106,
&end
#
# 10 MET QG 41 ILE HA 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, 620, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1= 105, 106,
&end
#
# 10 MET QG 41 ILE QG2 3.98
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr1= 105, 106,
igr2= 624, 625, 626,
&end
#
# 10 MET QG 44 LEU QD1 5.03
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.78, r4= 7.28,
igr1= 105, 106,
igr2= 668, 669, 670,
&end
#
# 11 LYS HA 11 LYS QD 5.34
&rst
ixpk= 0, nxpk= 0, iat= 117, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2= 125, 126,
&end
#
# 11 LYS HA 11 LYS QE 4.14
&rst
ixpk= 0, nxpk= 0, iat= 117, -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
igr2= 128, 129,
&end
#
# 11 LYS HA 11 LYS QG 3.41
&rst
ixpk= 0, nxpk= 0, iat= 117, -1, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,
igr2= 122, 123,
&end
#
# 11 LYS HA 14 ILE HB 3.47
&rst
ixpk= 0, nxpk= 0, iat= 117, 189, r1= 1.30, r2= 1.80, r3= 3.47, r4= 3.97, &end
#
# 11 LYS HA 14 ILE HN 4.30
&rst
ixpk= 0, nxpk= 0, iat= 117, 185, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80, &end
#
# 11 LYS HA 14 ILE QD1 3.40
&rst
ixpk= 0, nxpk= 0, iat= 117, -1, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,
igr2= 198, 199, 200,
&end
#
# 11 LYS HA 14 ILE QG2 4.38
&rst
ixpk= 0, nxpk= 0, iat= 117, -1, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr2= 191, 192, 193,
&end
#
# 11 LYS HN 11 LYS QB 3.13
&rst
ixpk= 0, nxpk= 0, iat= 115, -1, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01,
igr2= 119, 120,
&end
#
# 11 LYS HN 11 LYS QE 5.27
&rst
ixpk= 0, nxpk= 0, iat= 115, -1, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
igr2= 128, 129,
&end
#
# 11 LYS HN 11 LYS QG 3.79
&rst
ixpk= 0, nxpk= 0, iat= 115, -1, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,
igr2= 122, 123,
&end
#
# 11 LYS HN 12 ARG HN 3.60
&rst
ixpk= 0, nxpk= 0, iat= 115, 137, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10, &end
#
# 11 LYS HN 12 ARG QB 4.80
&rst
ixpk= 0, nxpk= 0, iat= 115, -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr2= 141, 142,
&end
#
# 11 LYS HN 13 ARG HN 4.78
&rst
ixpk= 0, nxpk= 0, iat= 115, 161, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, &end
#
# 11 LYS HN 14 ILE QD1 4.57
&rst
ixpk= 0, nxpk= 0, iat= 115, -1, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
igr2= 198, 199, 200,
&end
#
# 11 LYS HN 42 GLU QB 5.34
&rst
ixpk= 0, nxpk= 0, iat= 115, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2= 641, 642,
&end
#
# 11 LYS QB 11 LYS QE 3.93
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr1= 119, 120,
igr2= 128, 129,
&end
#
# 11 LYS QB 12 ARG HA 4.09
&rst
ixpk= 0, nxpk= 0, iat= -1, 139, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
igr1= 119, 120,
&end
#
# 11 LYS QB 12 ARG HN 3.33
&rst
ixpk= 0, nxpk= 0, iat= -1, 137, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24,
igr1= 119, 120,
&end
#
# 11 LYS QB 14 ILE QD1 4.75
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.40, r4= 6.90,
igr1= 119, 120,
igr2= 198, 199, 200,
&end
#
# 11 LYS QB 14 ILE QG2 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr1= 119, 120,
igr2= 191, 192, 193,
&end
#
# 11 LYS QB 43 GLY HA2 4.53
&rst
ixpk= 0, nxpk= 0, iat= -1, 654, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
igr1= 119, 120,
&end
#
# 11 LYS QB 43 GLY HA3 4.37
&rst
ixpk= 0, nxpk= 0, iat= -1, 655, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
igr1= 119, 120,
&end
#
# 11 LYS QE 14 ILE QD1 4.64
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75,
igr1= 128, 129,
igr2= 198, 199, 200,
&end
#
# 11 LYS QE 43 GLY HA2 4.69
&rst
ixpk= 0, nxpk= 0, iat= -1, 654, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr1= 128, 129,
&end
#
# 11 LYS QG 11 LYS QE 2.92
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18,
igr1= 122, 123,
igr2= 128, 129,
&end
#
# 11 LYS QG 12 ARG HN 4.78
&rst
ixpk= 0, nxpk= 0, iat= -1, 137, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr1= 122, 123,
&end
#
# 11 LYS QG 14 ILE QD1 3.93
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr1= 122, 123,
igr2= 198, 199, 200,
&end
#
# 11 LYS QG 43 GLY HA2 4.29
&rst
ixpk= 0, nxpk= 0, iat= -1, 654, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
igr1= 122, 123,
&end
#
# 11 LYS QG 43 GLY HA3 4.20
&rst
ixpk= 0, nxpk= 0, iat= -1, 655, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
igr1= 122, 123,
&end
#
# 12 ARG HA 12 ARG HD2 3.72
&rst
ixpk= 0, nxpk= 0, iat= 139, 147, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22, &end
#
# 12 ARG HA 12 ARG HD3 3.72
&rst
ixpk= 0, nxpk= 0, iat= 139, 148, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22, &end
#
# 12 ARG HA 12 ARG HG2 3.78
&rst
ixpk= 0, nxpk= 0, iat= 139, 144, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28, &end
#
# 12 ARG HA 12 ARG HG3 3.78
&rst
ixpk= 0, nxpk= 0, iat= 139, 145, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28, &end
#
# 12 ARG HA 12 ARG QD 3.21
&rst
ixpk= 0, nxpk= 0, iat= 139, -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr2= 147, 148,
&end
#
# 12 ARG HA 12 ARG QG 3.30
&rst
ixpk= 0, nxpk= 0, iat= 139, -1, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,
igr2= 144, 145,
&end
#
# 12 ARG HA 16 LEU HN 5.10
&rst
ixpk= 0, nxpk= 0, iat= 139, 221, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, &end
#
# 12 ARG HN 12 ARG HD2 5.33
&rst
ixpk= 0, nxpk= 0, iat= 137, 147, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83, &end
#
# 12 ARG HN 12 ARG HD3 5.33
&rst
ixpk= 0, nxpk= 0, iat= 137, 148, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83, &end
#
# 12 ARG HN 12 ARG HG2 4.11
&rst
ixpk= 0, nxpk= 0, iat= 137, 144, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 12 ARG HN 12 ARG HG3 4.11
&rst
ixpk= 0, nxpk= 0, iat= 137, 145, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 12 ARG HN 12 ARG QB 3.05
&rst
ixpk= 0, nxpk= 0, iat= 137, -1, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92,
igr2= 141, 142,
&end
#
# 12 ARG HN 12 ARG QD 4.49
&rst
ixpk= 0, nxpk= 0, iat= 137, -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr2= 147, 148,
&end
#
# 12 ARG HN 12 ARG QG 3.45
&rst
ixpk= 0, nxpk= 0, iat= 137, -1, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,
igr2= 144, 145,
&end
#
# 12 ARG HN 13 ARG HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= 137, 163, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 12 ARG HN 13 ARG HN 3.40
&rst
ixpk= 0, nxpk= 0, iat= 137, 161, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90, &end
#
# 12 ARG HN 14 ILE HG13 5.50
&rst
ixpk= 0, nxpk= 0, iat= 137, 196, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 12 ARG HN 14 ILE QD1 5.50
&rst
ixpk= 0, nxpk= 0, iat= 137, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2= 198, 199, 200,
&end
#
# 12 ARG QB 12 ARG QD 3.27
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
igr1= 141, 142,
igr2= 147, 148,
&end
#
# 12 ARG QB 13 ARG HN 3.43
&rst
ixpk= 0, nxpk= 0, iat= -1, 161, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35,
igr1= 141, 142,
&end
#
# 12 ARG QD 13 ARG HN 5.18
&rst
ixpk= 0, nxpk= 0, iat= -1, 161, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
igr1= 147, 148,
&end
#
# 12 ARG QD 16 LEU QQD 3.96
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1= 147, 148,
igr2= 230, 231, 232, 234, 235, 236,
&end
#
# 12 ARG QG 13 ARG HN 5.30
&rst
ixpk= 0, nxpk= 0, iat= -1, 161, r1= 1.30, r2= 1.80, r3= 5.95, r4= 6.45,
igr1= 144, 145,
&end
#
# 13 ARG HA 13 ARG HD2 3.75
&rst
ixpk= 0, nxpk= 0, iat= 163, 171, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25, &end
#
# 13 ARG HA 13 ARG HD3 3.87
&rst
ixpk= 0, nxpk= 0, iat= 163, 172, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37, &end
#
# 13 ARG HA 13 ARG HE 4.98
&rst
ixpk= 0, nxpk= 0, iat= 163, 174, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48, &end
#
# 13 ARG HA 13 ARG QG 3.64
&rst
ixpk= 0, nxpk= 0, iat= 163, -1, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59,
igr2= 168, 169,
&end
#
# 13 ARG HA 16 LEU HB2 3.93
&rst
ixpk= 0, nxpk= 0, iat= 163, 225, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43, &end
#
# 13 ARG HA 16 LEU HN 3.74
&rst
ixpk= 0, nxpk= 0, iat= 163, 221, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24, &end
#
# 13 ARG HA 16 LEU QD1 3.88
&rst
ixpk= 0, nxpk= 0, iat= 163, -1, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
igr2= 230, 231, 232,
&end
#
# 13 ARG HA 16 LEU QD2 3.88
&rst
ixpk= 0, nxpk= 0, iat= 163, -1, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
igr2= 234, 235, 236,
&end
#
# 13 ARG HA 16 LEU QQD 3.15
&rst
ixpk= 0, nxpk= 0, iat= 163, -1, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,
igr2= 230, 231, 232, 234, 235, 236,
&end
#
# 13 ARG HB2 14 ILE HN 4.34
&rst
ixpk= 0, nxpk= 0, iat= 165, 185, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84, &end
#
# 13 ARG HB2 15 HIS HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 165, 204, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 13 ARG HB3 14 ILE HG13 4.59
&rst
ixpk= 0, nxpk= 0, iat= 166, 196, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 13 ARG HB3 14 ILE HN 4.18
&rst
ixpk= 0, nxpk= 0, iat= 166, 185, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68, &end
#
# 13 ARG HB3 34 CYS HB2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 166, 523, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 13 ARG HB3 34 CYS HB3 5.50
&rst
ixpk= 0, nxpk= 0, iat= 166, 524, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 13 ARG HD2 16 LEU HB2 4.97
&rst
ixpk= 0, nxpk= 0, iat= 171, 225, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 13 ARG HD2 16 LEU HB3 4.78
&rst
ixpk= 0, nxpk= 0, iat= 171, 226, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, &end
#
# 13 ARG HD2 16 LEU HG 5.28
&rst
ixpk= 0, nxpk= 0, iat= 171, 228, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 13 ARG HD2 16 LEU QD1 4.39
&rst
ixpk= 0, nxpk= 0, iat= 171, -1, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77,
igr2= 230, 231, 232,
&end
#
# 13 ARG HD2 16 LEU QD2 4.39
&rst
ixpk= 0, nxpk= 0, iat= 171, -1, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77,
igr2= 234, 235, 236,
&end
#
# 13 ARG HD2 16 LEU QQD 3.60
&rst
ixpk= 0, nxpk= 0, iat= 171, -1, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
igr2= 230, 231, 232, 234, 235, 236,
&end
#
# 13 ARG HD3 16 LEU HB2 4.72
&rst
ixpk= 0, nxpk= 0, iat= 172, 225, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22, &end
#
# 13 ARG HD3 16 LEU HB3 5.39
&rst
ixpk= 0, nxpk= 0, iat= 172, 226, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89, &end
#
# 13 ARG HD3 16 LEU QQD 3.74
&rst
ixpk= 0, nxpk= 0, iat= 172, -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr2= 230, 231, 232, 234, 235, 236,
&end
#
# 13 ARG HE 16 LEU HB3 5.50
&rst
ixpk= 0, nxpk= 0, iat= 174, 226, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 13 ARG HE 16 LEU QQD 4.74
&rst
ixpk= 0, nxpk= 0, iat= 174, -1, r1= 1.30, r2= 1.80, r3= 6.39, r4= 6.89,
igr2= 230, 231, 232, 234, 235, 236,
&end
#
# 13 ARG HE 17 GLU QG 5.10
&rst
ixpk= 0, nxpk= 0, iat= 174, -1, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
igr2= 247, 248,
&end
#
# 13 ARG HN 13 ARG HB2 3.60
&rst
ixpk= 0, nxpk= 0, iat= 161, 165, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10, &end
#
# 13 ARG HN 13 ARG HB3 3.58
&rst
ixpk= 0, nxpk= 0, iat= 161, 166, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08, &end
#
# 13 ARG HN 13 ARG HD3 5.05
&rst
ixpk= 0, nxpk= 0, iat= 161, 172, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55, &end
#
# 13 ARG HN 14 ILE HG13 4.88
&rst
ixpk= 0, nxpk= 0, iat= 161, 196, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38, &end
#
# 13 ARG HN 14 ILE HN 3.75
&rst
ixpk= 0, nxpk= 0, iat= 161, 185, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25, &end
#
# 13 ARG HN 16 LEU QQD 5.11
&rst
ixpk= 0, nxpk= 0, iat= 161, -1, r1= 1.30, r2= 1.80, r3= 6.89, r4= 7.39,
igr2= 230, 231, 232, 234, 235, 236,
&end
#
# 14 ILE HA 14 ILE HG12 3.65
&rst
ixpk= 0, nxpk= 0, iat= 187, 195, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15, &end
#
# 14 ILE HA 14 ILE HG13 3.00
&rst
ixpk= 0, nxpk= 0, iat= 187, 196, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 14 ILE HA 14 ILE QD1 3.90
&rst
ixpk= 0, nxpk= 0, iat= 187, -1, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
igr2= 198, 199, 200,
&end
#
# 14 ILE HA 14 ILE QG2 3.25
&rst
ixpk= 0, nxpk= 0, iat= 187, -1, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40,
igr2= 191, 192, 193,
&end
#
# 14 ILE HA 17 GLU HG2 4.66
&rst
ixpk= 0, nxpk= 0, iat= 187, 247, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16, &end
#
# 14 ILE HA 17 GLU HG3 4.66
&rst
ixpk= 0, nxpk= 0, iat= 187, 248, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16, &end
#
# 14 ILE HA 17 GLU HN 4.26
&rst
ixpk= 0, nxpk= 0, iat= 187, 240, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76, &end
#
# 14 ILE HA 17 GLU QB 4.14
&rst
ixpk= 0, nxpk= 0, iat= 187, -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
igr2= 244, 245,
&end
#
# 14 ILE HA 18 LEU HN 5.10
&rst
ixpk= 0, nxpk= 0, iat= 187, 255, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, &end
#
# 14 ILE HA 29 LEU QD1 4.12
&rst
ixpk= 0, nxpk= 0, iat= 187, -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr2= 448, 449, 450,
&end
#
# 14 ILE HA 29 LEU QD2 4.20
&rst
ixpk= 0, nxpk= 0, iat= 187, -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr2= 452, 453, 454,
&end
#
# 14 ILE HB 14 ILE QD1 3.09
&rst
ixpk= 0, nxpk= 0, iat= 189, -1, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21,
igr2= 198, 199, 200,
&end
#
# 14 ILE HB 15 HIS HA 4.97
&rst
ixpk= 0, nxpk= 0, iat= 189, 206, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 14 ILE HB 15 HIS HB2 4.77
&rst
ixpk= 0, nxpk= 0, iat= 189, 208, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27, &end
#
# 14 ILE HB 15 HIS HB3 5.17
&rst
ixpk= 0, nxpk= 0, iat= 189, 209, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67, &end
#
# 14 ILE HB 15 HIS HN 3.11
&rst
ixpk= 0, nxpk= 0, iat= 189, 204, r1= 1.30, r2= 1.80, r3= 3.11, r4= 3.61, &end
#
# 14 ILE HG12 29 LEU QD2 3.42
&rst
ixpk= 0, nxpk= 0, iat= 195, -1, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
igr2= 452, 453, 454,
&end
#
# 14 ILE HG12 44 LEU QD1 4.83
&rst
ixpk= 0, nxpk= 0, iat= 195, -1, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
igr2= 668, 669, 670,
&end
#
# 14 ILE HG12 48 PHE QE 4.89
&rst
ixpk= 0, nxpk= 0, iat= 195, -1, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
igr2= 727, 731,
&end
#
# 14 ILE HN 14 ILE HB 3.18
&rst
ixpk= 0, nxpk= 0, iat= 185, 189, r1= 1.30, r2= 1.80, r3= 3.18, r4= 3.68, &end
#
# 14 ILE HN 14 ILE HG12 4.15
&rst
ixpk= 0, nxpk= 0, iat= 185, 195, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65, &end
#
# 14 ILE HN 14 ILE HG13 3.25
&rst
ixpk= 0, nxpk= 0, iat= 185, 196, r1= 1.30, r2= 1.80, r3= 3.25, r4= 3.75, &end
#
# 14 ILE HN 14 ILE QD1 3.69
&rst
ixpk= 0, nxpk= 0, iat= 185, -1, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
igr2= 198, 199, 200,
&end
#
# 14 ILE HN 14 ILE QG2 3.87
&rst
ixpk= 0, nxpk= 0, iat= 185, -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
igr2= 191, 192, 193,
&end
#
# 14 ILE HN 15 HIS HB3 5.12
&rst
ixpk= 0, nxpk= 0, iat= 185, 209, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, &end
#
# 14 ILE HN 15 HIS HN 3.56
&rst
ixpk= 0, nxpk= 0, iat= 185, 204, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06, &end
#
# 14 ILE HN 17 GLU QG 5.34
&rst
ixpk= 0, nxpk= 0, iat= 185, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2= 247, 248,
&end
#
# 14 ILE QD1 43 GLY HA2 3.88
&rst
ixpk= 0, nxpk= 0, iat= -1, 654, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
igr1= 198, 199, 200,
&end
#
# 14 ILE QD1 43 GLY HA3 3.42
&rst
ixpk= 0, nxpk= 0, iat= -1, 655, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
igr1= 198, 199, 200,
&end
#
# 14 ILE QD1 44 LEU HA 3.74
&rst
ixpk= 0, nxpk= 0, iat= -1, 661, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
igr1= 198, 199, 200,
&end
#
# 14 ILE QD1 44 LEU HN 3.58
&rst
ixpk= 0, nxpk= 0, iat= -1, 659, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
igr1= 198, 199, 200,
&end
#
# 14 ILE QD1 45 THR HN 4.15
&rst
ixpk= 0, nxpk= 0, iat= -1, 678, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
igr1= 198, 199, 200,
&end
#
# 14 ILE QD1 45 THR QG2 4.43
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.39, r4= 6.89,
igr1= 198, 199, 200,
igr2= 684, 685, 686,
&end
#
# 14 ILE QD1 48 PHE HZ 4.63
&rst
ixpk= 0, nxpk= 0, iat= -1, 729, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
igr1= 198, 199, 200,
&end
#
# 14 ILE QD1 48 PHE QE 3.84
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
igr1= 198, 199, 200,
igr2= 727, 731,
&end
#
# 14 ILE QG2 14 ILE HG12 3.28
&rst
ixpk= 0, nxpk= 0, iat= -1, 195, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,
igr1= 191, 192, 193,
&end
#
# 14 ILE QG2 14 ILE HG13 3.89
&rst
ixpk= 0, nxpk= 0, iat= -1, 196, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
igr1= 191, 192, 193,
&end
#
# 14 ILE QG2 14 ILE QD1 2.58
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,
igr1= 191, 192, 193,
igr2= 198, 199, 200,
&end
#
# 14 ILE QG2 15 HIS HA 3.90
&rst
ixpk= 0, nxpk= 0, iat= -1, 206, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
igr1= 191, 192, 193,
&end
#
# 14 ILE QG2 15 HIS HB2 5.16
&rst
ixpk= 0, nxpk= 0, iat= -1, 208, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
igr1= 191, 192, 193,
&end
#
# 14 ILE QG2 15 HIS HN 3.78
&rst
ixpk= 0, nxpk= 0, iat= -1, 204, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
igr1= 191, 192, 193,
&end
#
# 14 ILE QG2 18 LEU HN 4.27
&rst
ixpk= 0, nxpk= 0, iat= -1, 255, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
igr1= 191, 192, 193,
&end
#
# 14 ILE QG2 29 LEU QD2 3.88
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
igr1= 191, 192, 193,
igr2= 452, 453, 454,
&end
#
# 14 ILE QG2 43 GLY HA2 4.83
&rst
ixpk= 0, nxpk= 0, iat= -1, 654, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
igr1= 191, 192, 193,
&end
#
# 14 ILE QG2 43 GLY HA3 4.42
&rst
ixpk= 0, nxpk= 0, iat= -1, 655, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
igr1= 191, 192, 193,
&end
#
# 14 ILE QG2 44 LEU QD1 3.81
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
igr1= 191, 192, 193,
igr2= 668, 669, 670,
&end
#
# 14 ILE QG2 45 THR HN 4.99
&rst
ixpk= 0, nxpk= 0, iat= -1, 678, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1= 191, 192, 193,
&end
#
# 14 ILE QG2 48 PHE HZ 3.40
&rst
ixpk= 0, nxpk= 0, iat= -1, 729, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,
igr1= 191, 192, 193,
&end
#
# 14 ILE QG2 48 PHE QE 3.30
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95,
igr1= 191, 192, 193,
igr2= 727, 731,
&end
#
# 15 HIS HA 15 HIS HD2 4.53
&rst
ixpk= 0, nxpk= 0, iat= 206, 217, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03, &end
#
# 15 HIS HA 18 LEU HB2 3.43
&rst
ixpk= 0, nxpk= 0, iat= 206, 259, r1= 1.30, r2= 1.80, r3= 3.43, r4= 3.93, &end
#
# 15 HIS HA 18 LEU HB3 4.10
&rst
ixpk= 0, nxpk= 0, iat= 206, 260, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60, &end
#
# 15 HIS HA 18 LEU HN 4.16
&rst
ixpk= 0, nxpk= 0, iat= 206, 255, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66, &end
#
# 15 HIS HA 18 LEU QD1 4.21
&rst
ixpk= 0, nxpk= 0, iat= 206, -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
igr2= 264, 265, 266,
&end
#
# 15 HIS HA 18 LEU QD2 4.21
&rst
ixpk= 0, nxpk= 0, iat= 206, -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
igr2= 268, 269, 270,
&end
#
# 15 HIS HA 18 LEU QQD 3.13
&rst
ixpk= 0, nxpk= 0, iat= 206, -1, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
igr2= 264, 265, 266, 268, 269, 270,
&end
#
# 15 HIS HB2 16 LEU HN 4.16
&rst
ixpk= 0, nxpk= 0, iat= 208, 221, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66, &end
#
# 15 HIS HB2 16 LEU QQD 5.44
&rst
ixpk= 0, nxpk= 0, iat= 208, -1, r1= 1.30, r2= 1.80, r3= 7.33, r4= 7.83,
igr2= 230, 231, 232, 234, 235, 236,
&end
#
# 15 HIS HB2 18 LEU QQD 5.44
&rst
ixpk= 0, nxpk= 0, iat= 208, -1, r1= 1.30, r2= 1.80, r3= 7.33, r4= 7.83,
igr2= 264, 265, 266, 268, 269, 270,
&end
#
# 15 HIS HB3 16 LEU HB2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 209, 225, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 15 HIS HB3 16 LEU HG 5.47
&rst
ixpk= 0, nxpk= 0, iat= 209, 228, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97, &end
#
# 15 HIS HB3 16 LEU HN 3.70
&rst
ixpk= 0, nxpk= 0, iat= 209, 221, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20, &end
#
# 15 HIS HB3 16 LEU QQD 4.10
&rst
ixpk= 0, nxpk= 0, iat= 209, -1, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03,
igr2= 230, 231, 232, 234, 235, 236,
&end
#
# 15 HIS HD2 16 LEU HB2 4.66
&rst
ixpk= 0, nxpk= 0, iat= 217, 225, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16, &end
#
# 15 HIS HD2 16 LEU HG 4.65
&rst
ixpk= 0, nxpk= 0, iat= 217, 228, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15, &end
#
# 15 HIS HD2 16 LEU QD1 4.95
&rst
ixpk= 0, nxpk= 0, iat= 217, -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
igr2= 230, 231, 232,
&end
#
# 15 HIS HD2 16 LEU QD2 4.95
&rst
ixpk= 0, nxpk= 0, iat= 217, -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
igr2= 234, 235, 236,
&end
#
# 15 HIS HD2 16 LEU QQD 3.93
&rst
ixpk= 0, nxpk= 0, iat= 217, -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr2= 230, 231, 232, 234, 235, 236,
&end
#
# 15 HIS HN 15 HIS HB2 3.21
&rst
ixpk= 0, nxpk= 0, iat= 204, 208, r1= 1.30, r2= 1.80, r3= 3.21, r4= 3.71, &end
#
# 15 HIS HN 15 HIS HB3 3.18
&rst
ixpk= 0, nxpk= 0, iat= 204, 209, r1= 1.30, r2= 1.80, r3= 3.18, r4= 3.68, &end
#
# 15 HIS HN 15 HIS HD2 4.89
&rst
ixpk= 0, nxpk= 0, iat= 204, 217, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39, &end
#
# 15 HIS HN 16 LEU HN 3.58
&rst
ixpk= 0, nxpk= 0, iat= 204, 221, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08, &end
#
# 15 HIS HN 16 LEU QQD 4.26
&rst
ixpk= 0, nxpk= 0, iat= 204, -1, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
igr2= 230, 231, 232, 234, 235, 236,
&end
#
# 16 LEU HA 16 LEU HG 3.53
&rst
ixpk= 0, nxpk= 0, iat= 223, 228, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03, &end
#
# 16 LEU HA 16 LEU QQD 3.13
&rst
ixpk= 0, nxpk= 0, iat= 223, -1, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
igr2= 230, 231, 232, 234, 235, 236,
&end
#
# 16 LEU HA 18 LEU HN 5.04
&rst
ixpk= 0, nxpk= 0, iat= 223, 255, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54, &end
#
# 16 LEU HA 19 ARG HN 4.31
&rst
ixpk= 0, nxpk= 0, iat= 223, 274, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81, &end
#
# 16 LEU HB2 16 LEU QD1 3.85
&rst
ixpk= 0, nxpk= 0, iat= 225, -1, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
igr2= 230, 231, 232,
&end
#
# 16 LEU HB2 16 LEU QD2 3.85
&rst
ixpk= 0, nxpk= 0, iat= 225, -1, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
igr2= 234, 235, 236,
&end
#
# 16 LEU HB2 16 LEU QQD 3.13
&rst
ixpk= 0, nxpk= 0, iat= 225, -1, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
igr2= 230, 231, 232, 234, 235, 236,
&end
#
# 16 LEU HB2 17 GLU HN 3.26
&rst
ixpk= 0, nxpk= 0, iat= 225, 240, r1= 1.30, r2= 1.80, r3= 3.26, r4= 3.76, &end
#
# 16 LEU HB3 17 GLU HN 3.96
&rst
ixpk= 0, nxpk= 0, iat= 226, 240, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46, &end
#
# 16 LEU HG 17 GLU HN 5.28
&rst
ixpk= 0, nxpk= 0, iat= 228, 240, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 16 LEU HN 16 LEU HB2 3.04
&rst
ixpk= 0, nxpk= 0, iat= 221, 225, r1= 1.30, r2= 1.80, r3= 3.04, r4= 3.54, &end
#
# 16 LEU HN 16 LEU HB3 3.69
&rst
ixpk= 0, nxpk= 0, iat= 221, 226, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19, &end
#
# 16 LEU HN 16 LEU HG 3.84
&rst
ixpk= 0, nxpk= 0, iat= 221, 228, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34, &end
#
# 16 LEU HN 16 LEU QD1 4.30
&rst
ixpk= 0, nxpk= 0, iat= 221, -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
igr2= 230, 231, 232,
&end
#
# 16 LEU HN 16 LEU QD2 4.30
&rst
ixpk= 0, nxpk= 0, iat= 221, -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
igr2= 234, 235, 236,
&end
#
# 16 LEU HN 16 LEU QQD 3.55
&rst
ixpk= 0, nxpk= 0, iat= 221, -1, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
igr2= 230, 231, 232, 234, 235, 236,
&end
#
# 16 LEU HN 17 GLU HN 3.50
&rst
ixpk= 0, nxpk= 0, iat= 221, 240, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 16 LEU QD1 17 GLU HN 4.99
&rst
ixpk= 0, nxpk= 0, iat= -1, 240, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1= 230, 231, 232,
&end
#
# 16 LEU QD2 17 GLU HN 4.99
&rst
ixpk= 0, nxpk= 0, iat= -1, 240, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1= 234, 235, 236,
&end
#
# 16 LEU QQD 17 GLU HN 4.29
&rst
ixpk= 0, nxpk= 0, iat= -1, 240, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr1= 230, 231, 232, 234, 235, 236,
&end
#
# 17 GLU HA 17 GLU QG 3.64
&rst
ixpk= 0, nxpk= 0, iat= 242, -1, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59,
igr2= 247, 248,
&end
#
# 17 GLU HB2 18 LEU HN 4.15
&rst
ixpk= 0, nxpk= 0, iat= 244, 255, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65, &end
#
# 17 GLU HB2 29 LEU QD1 3.25
&rst
ixpk= 0, nxpk= 0, iat= 244, -1, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40,
igr2= 448, 449, 450,
&end
#
# 17 GLU HB3 18 LEU HN 4.15
&rst
ixpk= 0, nxpk= 0, iat= 245, 255, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65, &end
#
# 17 GLU HB3 29 LEU QD1 3.25
&rst
ixpk= 0, nxpk= 0, iat= 245, -1, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40,
igr2= 448, 449, 450,
&end
#
# 17 GLU HG2 29 LEU QD1 3.75
&rst
ixpk= 0, nxpk= 0, iat= 247, -1, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
igr2= 448, 449, 450,
&end
#
# 17 GLU HG3 29 LEU QD1 3.75
&rst
ixpk= 0, nxpk= 0, iat= 248, -1, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
igr2= 448, 449, 450,
&end
#
# 17 GLU HN 17 GLU HB2 4.10
&rst
ixpk= 0, nxpk= 0, iat= 240, 244, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60, &end
#
# 17 GLU HN 17 GLU HB3 4.10
&rst
ixpk= 0, nxpk= 0, iat= 240, 245, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60, &end
#
# 17 GLU HN 17 GLU HG2 3.86
&rst
ixpk= 0, nxpk= 0, iat= 240, 247, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 17 GLU HN 17 GLU HG3 3.86
&rst
ixpk= 0, nxpk= 0, iat= 240, 248, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 17 GLU HN 17 GLU QB 3.50
&rst
ixpk= 0, nxpk= 0, iat= 240, -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
igr2= 244, 245,
&end
#
# 17 GLU HN 17 GLU QG 3.35
&rst
ixpk= 0, nxpk= 0, iat= 240, -1, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,
igr2= 247, 248,
&end
#
# 17 GLU HN 18 LEU HN 3.59
&rst
ixpk= 0, nxpk= 0, iat= 240, 255, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09, &end
#
# 17 GLU HN 19 ARG HN 4.69
&rst
ixpk= 0, nxpk= 0, iat= 240, 274, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, &end
#
# 17 GLU HN 29 LEU QD1 4.54
&rst
ixpk= 0, nxpk= 0, iat= 240, -1, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,
igr2= 448, 449, 450,
&end
#
# 17 GLU QB 29 LEU QD1 2.77
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23,
igr1= 244, 245,
igr2= 448, 449, 450,
&end
#
# 17 GLU QB 29 LEU QD2 4.07
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
igr1= 244, 245,
igr2= 452, 453, 454,
&end
#
# 17 GLU QG 18 LEU HN 4.54
&rst
ixpk= 0, nxpk= 0, iat= -1, 255, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
igr1= 247, 248,
&end
#
# 17 GLU QG 29 LEU QD2 4.41
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
igr1= 247, 248,
igr2= 452, 453, 454,
&end
#
# 18 LEU HA 18 LEU HG 3.93
&rst
ixpk= 0, nxpk= 0, iat= 257, 262, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43, &end
#
# 18 LEU HA 18 LEU QD1 4.09
&rst
ixpk= 0, nxpk= 0, iat= 257, -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
igr2= 264, 265, 266,
&end
#
# 18 LEU HA 18 LEU QD2 4.09
&rst
ixpk= 0, nxpk= 0, iat= 257, -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
igr2= 268, 269, 270,
&end
#
# 18 LEU HA 18 LEU QQD 2.97
&rst
ixpk= 0, nxpk= 0, iat= 257, -1, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,
igr2= 264, 265, 266, 268, 269, 270,
&end
#
# 18 LEU HA 21 ARG HN 4.38
&rst
ixpk= 0, nxpk= 0, iat= 257, 312, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88, &end
#
# 18 LEU HA 26 VAL QG2 4.47
&rst
ixpk= 0, nxpk= 0, iat= 257, -1, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr2= 394, 395, 396,
&end
#
# 18 LEU HB2 18 LEU QQD 2.91
&rst
ixpk= 0, nxpk= 0, iat= 259, -1, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
igr2= 264, 265, 266, 268, 269, 270,
&end
#
# 18 LEU HB2 19 ARG HN 3.57
&rst
ixpk= 0, nxpk= 0, iat= 259, 274, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07, &end
#
# 18 LEU HB3 19 ARG HN 4.56
&rst
ixpk= 0, nxpk= 0, iat= 260, 274, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06, &end
#
# 18 LEU HB3 20 ASN HN 4.83
&rst
ixpk= 0, nxpk= 0, iat= 260, 298, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33, &end
#
# 18 LEU HB3 21 ARG HN 5.15
&rst
ixpk= 0, nxpk= 0, iat= 260, 312, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65, &end
#
# 18 LEU HG 23 PRO HD2 5.48
&rst
ixpk= 0, nxpk= 0, iat= 262, 351, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98, &end
#
# 18 LEU HG 23 PRO HD3 3.43
&rst
ixpk= 0, nxpk= 0, iat= 262, 352, r1= 1.30, r2= 1.80, r3= 3.43, r4= 3.93, &end
#
# 18 LEU HN 18 LEU HB2 2.96
&rst
ixpk= 0, nxpk= 0, iat= 255, 259, r1= 1.30, r2= 1.80, r3= 2.96, r4= 3.46, &end
#
# 18 LEU HN 18 LEU HB3 3.57
&rst
ixpk= 0, nxpk= 0, iat= 255, 260, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07, &end
#
# 18 LEU HN 18 LEU HG 4.22
&rst
ixpk= 0, nxpk= 0, iat= 255, 262, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 18 LEU HN 18 LEU QD1 3.91
&rst
ixpk= 0, nxpk= 0, iat= 255, -1, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
igr2= 264, 265, 266,
&end
#
# 18 LEU HN 18 LEU QD2 3.91
&rst
ixpk= 0, nxpk= 0, iat= 255, -1, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
igr2= 268, 269, 270,
&end
#
# 18 LEU HN 19 ARG HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= 255, 276, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 18 LEU HN 19 ARG HN 3.43
&rst
ixpk= 0, nxpk= 0, iat= 255, 274, r1= 1.30, r2= 1.80, r3= 3.43, r4= 3.93, &end
#
# 18 LEU QD1 23 PRO HA 4.61
&rst
ixpk= 0, nxpk= 0, iat= -1, 360, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
igr1= 264, 265, 266,
&end
#
# 18 LEU QD1 23 PRO HD2 5.01
&rst
ixpk= 0, nxpk= 0, iat= -1, 351, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,
igr1= 264, 265, 266,
&end
#
# 18 LEU QD2 23 PRO HA 4.61
&rst
ixpk= 0, nxpk= 0, iat= -1, 360, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
igr1= 268, 269, 270,
&end
#
# 18 LEU QD2 23 PRO HD2 5.01
&rst
ixpk= 0, nxpk= 0, iat= -1, 351, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,
igr1= 268, 269, 270,
&end
#
# 18 LEU QQD 19 ARG HN 4.71
&rst
ixpk= 0, nxpk= 0, iat= -1, 274, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
igr1= 264, 265, 266, 268, 269, 270,
&end
#
# 18 LEU QQD 21 ARG HN 4.70
&rst
ixpk= 0, nxpk= 0, iat= -1, 312, r1= 1.30, r2= 1.80, r3= 6.34, r4= 6.84,
igr1= 264, 265, 266, 268, 269, 270,
&end
#
# 18 LEU QQD 22 THR HA 5.20
&rst
ixpk= 0, nxpk= 0, iat= -1, 338, r1= 1.30, r2= 1.80, r3= 7.01, r4= 7.51,
igr1= 264, 265, 266, 268, 269, 270,
&end
#
# 18 LEU QQD 23 PRO HA 3.24
&rst
ixpk= 0, nxpk= 0, iat= -1, 360, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
igr1= 264, 265, 266, 268, 269, 270,
&end
#
# 18 LEU QQD 23 PRO HB2 4.18
&rst
ixpk= 0, nxpk= 0, iat= -1, 357, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr1= 264, 265, 266, 268, 269, 270,
&end
#
# 18 LEU QQD 23 PRO HD2 4.09
&rst
ixpk= 0, nxpk= 0, iat= -1, 351, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
igr1= 264, 265, 266, 268, 269, 270,
&end
#
# 18 LEU QQD 23 PRO HD3 3.97
&rst
ixpk= 0, nxpk= 0, iat= -1, 352, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,
igr1= 264, 265, 266, 268, 269, 270,
&end
#
# 18 LEU QQD 23 PRO HG3 3.43
&rst
ixpk= 0, nxpk= 0, iat= -1, 355, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
igr1= 264, 265, 266, 268, 269, 270,
&end
#
# 18 LEU QQD 26 VAL HB 4.94
&rst
ixpk= 0, nxpk= 0, iat= -1, 388, r1= 1.30, r2= 1.80, r3= 6.66, r4= 7.16,
igr1= 264, 265, 266, 268, 269, 270,
&end
#
# 18 LEU QQD 48 PHE HZ 3.41
&rst
ixpk= 0, nxpk= 0, iat= -1, 729, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
igr1= 264, 265, 266, 268, 269, 270,
&end
#
# 18 LEU QQD 48 PHE QD 5.08
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.69, r4= 8.19,
igr1= 264, 265, 266, 268, 269, 270,
igr2= 725, 733,
&end
#
# 18 LEU QQD 48 PHE QE 3.29
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
igr1= 264, 265, 266, 268, 269, 270,
igr2= 727, 731,
&end
#
# 19 ARG HA 19 ARG HD2 4.77
&rst
ixpk= 0, nxpk= 0, iat= 276, 284, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27, &end
#
# 19 ARG HA 19 ARG HD3 4.77
&rst
ixpk= 0, nxpk= 0, iat= 276, 285, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27, &end
#
# 19 ARG HA 19 ARG QD 4.01
&rst
ixpk= 0, nxpk= 0, iat= 276, -1, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
igr2= 284, 285,
&end
#
# 19 ARG HA 19 ARG QG 3.45
&rst
ixpk= 0, nxpk= 0, iat= 276, -1, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,
igr2= 281, 282,
&end
#
# 19 ARG HA 21 ARG HN 5.07
&rst
ixpk= 0, nxpk= 0, iat= 276, 312, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, &end
#
# 19 ARG HB2 20 ASN HN 4.20
&rst
ixpk= 0, nxpk= 0, iat= 278, 298, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 19 ARG HB3 20 ASN HN 4.20
&rst
ixpk= 0, nxpk= 0, iat= 279, 298, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 19 ARG HN 19 ARG HA 2.82
&rst
ixpk= 0, nxpk= 0, iat= 274, 276, r1= 1.30, r2= 1.80, r3= 2.82, r4= 3.32, &end
#
# 19 ARG HN 19 ARG QB 3.09
&rst
ixpk= 0, nxpk= 0, iat= 274, -1, r1= 1.30, r2= 1.80, r3= 3.47, r4= 3.97,
igr2= 278, 279,
&end
#
# 19 ARG HN 19 ARG QD 4.44
&rst
ixpk= 0, nxpk= 0, iat= 274, -1, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
igr2= 284, 285,
&end
#
# 19 ARG HN 19 ARG QG 3.47
&rst
ixpk= 0, nxpk= 0, iat= 274, -1, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,
igr2= 281, 282,
&end
#
# 19 ARG HN 20 ASN HN 3.65
&rst
ixpk= 0, nxpk= 0, iat= 274, 298, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15, &end
#
# 19 ARG QB 19 ARG QD 2.90
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15,
igr1= 278, 279,
igr2= 284, 285,
&end
#
# 19 ARG QB 19 ARG QG 2.32
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
igr1= 278, 279,
igr2= 281, 282,
&end
#
# 19 ARG QB 20 ASN HA 4.55
&rst
ixpk= 0, nxpk= 0, iat= -1, 300, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,
igr1= 278, 279,
&end
#
# 19 ARG QB 20 ASN HN 3.62
&rst
ixpk= 0, nxpk= 0, iat= -1, 298, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,
igr1= 278, 279,
&end
#
# 19 ARG QG 20 ASN HN 4.88
&rst
ixpk= 0, nxpk= 0, iat= -1, 298, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
igr1= 281, 282,
&end
#
# 20 ASN HA 21 ARG HB3 5.50
&rst
ixpk= 0, nxpk= 0, iat= 300, 317, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 20 ASN HN 20 ASN HB2 4.06
&rst
ixpk= 0, nxpk= 0, iat= 298, 302, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56, &end
#
# 20 ASN HN 20 ASN HB3 4.06
&rst
ixpk= 0, nxpk= 0, iat= 298, 303, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56, &end
#
# 20 ASN HN 21 ARG HN 3.60
&rst
ixpk= 0, nxpk= 0, iat= 298, 312, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10, &end
#
# 20 ASN QB 20 ASN QD2 3.14
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
igr1= 302, 303,
igr2= 307, 308,
&end
#
# 21 ARG HA 21 ARG HD2 5.14
&rst
ixpk= 0, nxpk= 0, iat= 314, 322, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64, &end
#
# 21 ARG HA 21 ARG HD3 5.14
&rst
ixpk= 0, nxpk= 0, iat= 314, 323, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64, &end
#
# 21 ARG HA 21 ARG QD 4.29
&rst
ixpk= 0, nxpk= 0, iat= 314, -1, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
igr2= 322, 323,
&end
#
# 21 ARG HA 21 ARG QG 3.71
&rst
ixpk= 0, nxpk= 0, iat= 314, -1, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
igr2= 319, 320,
&end
#
# 21 ARG HA 22 THR HN 3.00
&rst
ixpk= 0, nxpk= 0, iat= 314, 336, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 21 ARG HA 26 VAL QG2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 314, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2= 394, 395, 396,
&end
#
# 21 ARG HB2 22 THR HN 3.22
&rst
ixpk= 0, nxpk= 0, iat= 316, 336, r1= 1.30, r2= 1.80, r3= 3.22, r4= 3.72, &end
#
# 21 ARG HB2 26 VAL QG2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 316, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2= 394, 395, 396,
&end
#
# 21 ARG HB3 21 ARG HE 4.64
&rst
ixpk= 0, nxpk= 0, iat= 317, 325, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14, &end
#
# 21 ARG HB3 21 ARG QD 3.46
&rst
ixpk= 0, nxpk= 0, iat= 317, -1, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,
igr2= 322, 323,
&end
#
# 21 ARG HB3 26 VAL QG2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 317, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2= 394, 395, 396,
&end
#
# 21 ARG HD2 25 ALA QB 4.60
&rst
ixpk= 0, nxpk= 0, iat= 322, -1, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
igr2= 378, 379, 380,
&end
#
# 21 ARG HD2 26 VAL QG2 4.26
&rst
ixpk= 0, nxpk= 0, iat= 322, -1, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
igr2= 394, 395, 396,
&end
#
# 21 ARG HD3 25 ALA QB 4.60
&rst
ixpk= 0, nxpk= 0, iat= 323, -1, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
igr2= 378, 379, 380,
&end
#
# 21 ARG HD3 26 VAL QG2 4.26
&rst
ixpk= 0, nxpk= 0, iat= 323, -1, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
igr2= 394, 395, 396,
&end
#
# 21 ARG HG2 25 ALA QB 3.69
&rst
ixpk= 0, nxpk= 0, iat= 319, -1, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
igr2= 378, 379, 380,
&end
#
# 21 ARG HG3 25 ALA QB 3.69
&rst
ixpk= 0, nxpk= 0, iat= 320, -1, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
igr2= 378, 379, 380,
&end
#
# 21 ARG HN 21 ARG HB3 3.88
&rst
ixpk= 0, nxpk= 0, iat= 312, 317, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38, &end
#
# 21 ARG HN 21 ARG HD2 4.38
&rst
ixpk= 0, nxpk= 0, iat= 312, 322, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88, &end
#
# 21 ARG HN 21 ARG HD3 4.38
&rst
ixpk= 0, nxpk= 0, iat= 312, 323, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88, &end
#
# 21 ARG HN 21 ARG HE 4.93
&rst
ixpk= 0, nxpk= 0, iat= 312, 325, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43, &end
#
# 21 ARG HN 21 ARG QD 3.68
&rst
ixpk= 0, nxpk= 0, iat= 312, -1, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
igr2= 322, 323,
&end
#
# 21 ARG HN 21 ARG QG 4.11
&rst
ixpk= 0, nxpk= 0, iat= 312, -1, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
igr2= 319, 320,
&end
#
# 21 ARG HN 22 THR HN 4.47
&rst
ixpk= 0, nxpk= 0, iat= 312, 336, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97, &end
#
# 21 ARG HN 25 ALA QB 5.50
&rst
ixpk= 0, nxpk= 0, iat= 312, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2= 378, 379, 380,
&end
#
# 21 ARG HN 26 VAL QG2 4.70
&rst
ixpk= 0, nxpk= 0, iat= 312, -1, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14,
igr2= 394, 395, 396,
&end
#
# 21 ARG QD 22 THR HN 5.21
&rst
ixpk= 0, nxpk= 0, iat= -1, 336, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
igr1= 322, 323,
&end
#
# 21 ARG QD 25 ALA QB 3.89
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr1= 322, 323,
igr2= 378, 379, 380,
&end
#
# 21 ARG QD 26 VAL HA 4.63
&rst
ixpk= 0, nxpk= 0, iat= -1, 386, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
igr1= 322, 323,
&end
#
# 21 ARG QG 22 THR HB 5.23
&rst
ixpk= 0, nxpk= 0, iat= -1, 340, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,
igr1= 319, 320,
&end
#
# 21 ARG QG 22 THR HN 4.69
&rst
ixpk= 0, nxpk= 0, iat= -1, 336, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr1= 319, 320,
&end
#
# 21 ARG QG 25 ALA HN 4.42
&rst
ixpk= 0, nxpk= 0, iat= -1, 374, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
igr1= 319, 320,
&end
#
# 21 ARG QG 25 ALA QB 3.19
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
igr1= 319, 320,
igr2= 378, 379, 380,
&end
#
# 21 ARG QG 26 VAL QG2 3.45
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
igr1= 319, 320,
igr2= 394, 395, 396,
&end
#
# 22 THR HA 22 THR QG2 3.17
&rst
ixpk= 0, nxpk= 0, iat= 338, -1, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,
igr2= 342, 343, 344,
&end
#
# 22 THR HA 23 PRO HD2 3.51
&rst
ixpk= 0, nxpk= 0, iat= 338, 351, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01, &end
#
# 22 THR HA 23 PRO HD3 3.46
&rst
ixpk= 0, nxpk= 0, iat= 338, 352, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96, &end
#
# 22 THR HA 23 PRO HG2 4.74
&rst
ixpk= 0, nxpk= 0, iat= 338, 354, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24, &end
#
# 22 THR HA 24 ALA HN 4.71
&rst
ixpk= 0, nxpk= 0, iat= 338, 364, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21, &end
#
# 22 THR HB 23 PRO HA 5.23
&rst
ixpk= 0, nxpk= 0, iat= 340, 360, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73, &end
#
# 22 THR HB 23 PRO HD2 3.37
&rst
ixpk= 0, nxpk= 0, iat= 340, 351, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87, &end
#
# 22 THR HB 23 PRO HG2 4.78
&rst
ixpk= 0, nxpk= 0, iat= 340, 354, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, &end
#
# 22 THR HB 24 ALA HN 3.46
&rst
ixpk= 0, nxpk= 0, iat= 340, 364, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96, &end
#
# 22 THR HB 24 ALA QB 3.70
&rst
ixpk= 0, nxpk= 0, iat= 340, -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
igr2= 368, 369, 370,
&end
#
# 22 THR HB 25 ALA HN 3.63
&rst
ixpk= 0, nxpk= 0, iat= 340, 374, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13, &end
#
# 22 THR HB 25 ALA QB 4.39
&rst
ixpk= 0, nxpk= 0, iat= 340, -1, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77,
igr2= 378, 379, 380,
&end
#
# 22 THR HB 26 VAL QG2 5.23
&rst
ixpk= 0, nxpk= 0, iat= 340, -1, r1= 1.30, r2= 1.80, r3= 6.28, r4= 6.78,
igr2= 394, 395, 396,
&end
#
# 22 THR HN 22 THR HB 3.91
&rst
ixpk= 0, nxpk= 0, iat= 336, 340, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41, &end
#
# 22 THR HN 22 THR QG2 3.61
&rst
ixpk= 0, nxpk= 0, iat= 336, -1, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,
igr2= 342, 343, 344,
&end
#
# 22 THR HN 23 PRO HD2 4.84
&rst
ixpk= 0, nxpk= 0, iat= 336, 351, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34, &end
#
# 22 THR HN 25 ALA HN 5.31
&rst
ixpk= 0, nxpk= 0, iat= 336, 374, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81, &end
#
# 22 THR HN 25 ALA QB 3.61
&rst
ixpk= 0, nxpk= 0, iat= 336, -1, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,
igr2= 378, 379, 380,
&end
#
# 22 THR HN 26 VAL QG2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 336, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2= 394, 395, 396,
&end
#
# 22 THR QG2 23 PRO HA 5.10
&rst
ixpk= 0, nxpk= 0, iat= -1, 360, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,
igr1= 342, 343, 344,
&end
#
# 22 THR QG2 23 PRO HD2 3.78
&rst
ixpk= 0, nxpk= 0, iat= -1, 351, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
igr1= 342, 343, 344,
&end
#
# 22 THR QG2 23 PRO HD3 3.82
&rst
ixpk= 0, nxpk= 0, iat= -1, 352, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
igr1= 342, 343, 344,
&end
#
# 22 THR QG2 23 PRO HG2 4.02
&rst
ixpk= 0, nxpk= 0, iat= -1, 354, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
igr1= 342, 343, 344,
&end
#
# 22 THR QG2 24 ALA HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 366, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 342, 343, 344,
&end
#
# 22 THR QG2 24 ALA HN 3.22
&rst
ixpk= 0, nxpk= 0, iat= -1, 364, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,
igr1= 342, 343, 344,
&end
#
# 22 THR QG2 25 ALA HN 4.78
&rst
ixpk= 0, nxpk= 0, iat= -1, 374, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
igr1= 342, 343, 344,
&end
#
# 22 THR QG2 25 ALA QB 4.24
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,
igr1= 342, 343, 344,
igr2= 378, 379, 380,
&end
#
# 23 PRO HA 25 ALA HN 4.60
&rst
ixpk= 0, nxpk= 0, iat= 360, 374, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 23 PRO HA 26 VAL HB 4.59
&rst
ixpk= 0, nxpk= 0, iat= 360, 388, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 23 PRO HA 26 VAL HN 4.19
&rst
ixpk= 0, nxpk= 0, iat= 360, 384, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69, &end
#
# 23 PRO HA 26 VAL QG2 3.44
&rst
ixpk= 0, nxpk= 0, iat= 360, -1, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
igr2= 394, 395, 396,
&end
#
# 23 PRO HA 48 PHE HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= 360, 719, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 23 PRO HA 48 PHE HZ 5.43
&rst
ixpk= 0, nxpk= 0, iat= 360, 729, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93, &end
#
# 23 PRO HA 48 PHE QE 4.03
&rst
ixpk= 0, nxpk= 0, iat= 360, -1, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
igr2= 727, 731,
&end
#
# 23 PRO HB2 24 ALA HN 4.03
&rst
ixpk= 0, nxpk= 0, iat= 357, 364, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53, &end
#
# 23 PRO HB2 24 ALA QB 4.81
&rst
ixpk= 0, nxpk= 0, iat= 357, -1, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr2= 368, 369, 370,
&end
#
# 23 PRO HB2 26 VAL QG2 4.74
&rst
ixpk= 0, nxpk= 0, iat= 357, -1, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
igr2= 394, 395, 396,
&end
#
# 23 PRO HB2 47 GLU HB2 4.56
&rst
ixpk= 0, nxpk= 0, iat= 357, 706, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06, &end
#
# 23 PRO HB2 47 GLU HB3 4.56
&rst
ixpk= 0, nxpk= 0, iat= 357, 707, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06, &end
#
# 23 PRO HB2 47 GLU QB 3.96
&rst
ixpk= 0, nxpk= 0, iat= 357, -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
igr2= 706, 707,
&end
#
# 23 PRO HB2 48 PHE HA 4.62
&rst
ixpk= 0, nxpk= 0, iat= 357, 719, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12, &end
#
# 23 PRO HB2 48 PHE QD 4.59
&rst
ixpk= 0, nxpk= 0, iat= 357, -1, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
igr2= 725, 733,
&end
#
# 23 PRO HB2 48 PHE QE 4.89
&rst
ixpk= 0, nxpk= 0, iat= 357, -1, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
igr2= 727, 731,
&end
#
# 23 PRO HB3 24 ALA HN 4.63
&rst
ixpk= 0, nxpk= 0, iat= 358, 364, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, &end
#
# 23 PRO HB3 47 GLU HB2 4.69
&rst
ixpk= 0, nxpk= 0, iat= 358, 706, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, &end
#
# 23 PRO HB3 47 GLU HB3 4.69
&rst
ixpk= 0, nxpk= 0, iat= 358, 707, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, &end
#
# 23 PRO HB3 47 GLU QB 4.05
&rst
ixpk= 0, nxpk= 0, iat= 358, -1, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,
igr2= 706, 707,
&end
#
# 23 PRO HD2 24 ALA HN 4.11
&rst
ixpk= 0, nxpk= 0, iat= 351, 364, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 23 PRO HD3 24 ALA HN 4.54
&rst
ixpk= 0, nxpk= 0, iat= 352, 364, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 23 PRO HG2 24 ALA HA 4.56
&rst
ixpk= 0, nxpk= 0, iat= 354, 366, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06, &end
#
# 23 PRO HG2 24 ALA HN 4.40
&rst
ixpk= 0, nxpk= 0, iat= 354, 364, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 24 ALA HA 26 VAL HN 4.62
&rst
ixpk= 0, nxpk= 0, iat= 366, 384, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12, &end
#
# 24 ALA HA 26 VAL QG2 4.93
&rst
ixpk= 0, nxpk= 0, iat= 366, -1, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
igr2= 394, 395, 396,
&end
#
# 24 ALA HA 48 PHE HA 4.27
&rst
ixpk= 0, nxpk= 0, iat= 366, 719, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77, &end
#
# 24 ALA HA 49 VAL HN 4.51
&rst
ixpk= 0, nxpk= 0, iat= 366, 737, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01, &end
#
# 24 ALA HA 49 VAL QG2 3.65
&rst
ixpk= 0, nxpk= 0, iat= 366, -1, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
igr2= 747, 748, 749,
&end
#
# 24 ALA HA 50 ASN HN 4.16
&rst
ixpk= 0, nxpk= 0, iat= 366, 753, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66, &end
#
# 24 ALA HA 50 ASN QD2 4.08
&rst
ixpk= 0, nxpk= 0, iat= 366, -1, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
igr2= 762, 763,
&end
#
# 24 ALA HN 24 ALA QB 2.88
&rst
ixpk= 0, nxpk= 0, iat= 364, -1, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96,
igr2= 368, 369, 370,
&end
#
# 24 ALA HN 25 ALA HA 5.15
&rst
ixpk= 0, nxpk= 0, iat= 364, 376, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65, &end
#
# 24 ALA HN 25 ALA HN 3.40
&rst
ixpk= 0, nxpk= 0, iat= 364, 374, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90, &end
#
# 24 ALA HN 25 ALA QB 4.21
&rst
ixpk= 0, nxpk= 0, iat= 364, -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
igr2= 378, 379, 380,
&end
#
# 24 ALA HN 26 VAL HN 4.54
&rst
ixpk= 0, nxpk= 0, iat= 364, 384, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 24 ALA HN 26 VAL QG2 4.44
&rst
ixpk= 0, nxpk= 0, iat= 364, -1, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
igr2= 394, 395, 396,
&end
#
# 24 ALA HN 47 GLU QB 4.93
&rst
ixpk= 0, nxpk= 0, iat= 364, -1, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03,
igr2= 706, 707,
&end
#
# 24 ALA HN 49 VAL QG2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 364, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2= 747, 748, 749,
&end
#
# 24 ALA QB 25 ALA HN 3.57
&rst
ixpk= 0, nxpk= 0, iat= -1, 374, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,
igr1= 368, 369, 370,
&end
#
# 24 ALA QB 26 VAL HN 4.78
&rst
ixpk= 0, nxpk= 0, iat= -1, 384, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
igr1= 368, 369, 370,
&end
#
# 24 ALA QB 48 PHE HA 4.61
&rst
ixpk= 0, nxpk= 0, iat= -1, 719, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
igr1= 368, 369, 370,
&end
#
# 24 ALA QB 48 PHE HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 717, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 368, 369, 370,
&end
#
# 24 ALA QB 49 VAL HN 4.27
&rst
ixpk= 0, nxpk= 0, iat= -1, 737, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
igr1= 368, 369, 370,
&end
#
# 24 ALA QB 49 VAL QG1 4.58
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 368, 369, 370,
igr2= 743, 744, 745,
&end
#
# 24 ALA QB 49 VAL QG2 2.99
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,
igr1= 368, 369, 370,
igr2= 747, 748, 749,
&end
#
# 24 ALA QB 50 ASN HD21 3.62
&rst
ixpk= 0, nxpk= 0, iat= -1, 762, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,
igr1= 368, 369, 370,
&end
#
# 24 ALA QB 50 ASN HD22 3.62
&rst
ixpk= 0, nxpk= 0, iat= -1, 763, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,
igr1= 368, 369, 370,
&end
#
# 24 ALA QB 50 ASN HN 4.56
&rst
ixpk= 0, nxpk= 0, iat= -1, 753, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
igr1= 368, 369, 370,
&end
#
# 24 ALA QB 50 ASN QB 4.39
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
igr1= 368, 369, 370,
igr2= 757, 758,
&end
#
# 25 ALA HA 26 VAL QG2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 376, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2= 394, 395, 396,
&end
#
# 25 ALA HA 50 ASN HD21 5.32
&rst
ixpk= 0, nxpk= 0, iat= 376, 762, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82, &end
#
# 25 ALA HA 50 ASN HD22 5.32
&rst
ixpk= 0, nxpk= 0, iat= 376, 763, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82, &end
#
# 25 ALA HN 25 ALA QB 2.89
&rst
ixpk= 0, nxpk= 0, iat= 374, -1, r1= 1.30, r2= 1.80, r3= 3.47, r4= 3.97,
igr2= 378, 379, 380,
&end
#
# 25 ALA HN 26 VAL HB 4.67
&rst
ixpk= 0, nxpk= 0, iat= 374, 388, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, &end
#
# 25 ALA HN 26 VAL HN 3.18
&rst
ixpk= 0, nxpk= 0, iat= 374, 384, r1= 1.30, r2= 1.80, r3= 3.18, r4= 3.68, &end
#
# 25 ALA HN 26 VAL QG2 3.69
&rst
ixpk= 0, nxpk= 0, iat= 374, -1, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
igr2= 394, 395, 396,
&end
#
# 25 ALA QB 26 VAL HA 4.42
&rst
ixpk= 0, nxpk= 0, iat= -1, 386, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
igr1= 378, 379, 380,
&end
#
# 25 ALA QB 26 VAL HB 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 388, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 378, 379, 380,
&end
#
# 25 ALA QB 26 VAL HN 3.62
&rst
ixpk= 0, nxpk= 0, iat= -1, 384, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,
igr1= 378, 379, 380,
&end
#
# 25 ALA QB 26 VAL QG2 3.46
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,
igr1= 378, 379, 380,
igr2= 394, 395, 396,
&end
#
# 26 VAL HA 26 VAL QG1 3.15
&rst
ixpk= 0, nxpk= 0, iat= 386, -1, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,
igr2= 390, 391, 392,
&end
#
# 26 VAL HA 26 VAL QG2 3.20
&rst
ixpk= 0, nxpk= 0, iat= 386, -1, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
igr2= 394, 395, 396,
&end
#
# 26 VAL HA 27 ARG HN 3.25
&rst
ixpk= 0, nxpk= 0, iat= 386, 400, r1= 1.30, r2= 1.80, r3= 3.25, r4= 3.75, &end
#
# 26 VAL HA 27 ARG QG 4.71
&rst
ixpk= 0, nxpk= 0, iat= 386, -1, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,
igr2= 407, 408,
&end
#
# 26 VAL HA 28 GLU HN 4.21
&rst
ixpk= 0, nxpk= 0, iat= 386, 424, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71, &end
#
# 26 VAL HB 27 ARG HN 4.62
&rst
ixpk= 0, nxpk= 0, iat= 388, 400, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12, &end
#
# 26 VAL HB 28 GLU HN 5.26
&rst
ixpk= 0, nxpk= 0, iat= 388, 424, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76, &end
#
# 26 VAL HB 48 PHE QD 3.83
&rst
ixpk= 0, nxpk= 0, iat= 388, -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
igr2= 725, 733,
&end
#
# 26 VAL HB 48 PHE QE 4.26
&rst
ixpk= 0, nxpk= 0, iat= 388, -1, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
igr2= 727, 731,
&end
#
# 26 VAL HB 51 LEU QD1 4.09
&rst
ixpk= 0, nxpk= 0, iat= 388, -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
igr2= 776, 777, 778,
&end
#
# 26 VAL HN 26 VAL HB 3.24
&rst
ixpk= 0, nxpk= 0, iat= 384, 388, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74, &end
#
# 26 VAL HN 26 VAL QG2 3.02
&rst
ixpk= 0, nxpk= 0, iat= 384, -1, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13,
igr2= 394, 395, 396,
&end
#
# 26 VAL HN 27 ARG HN 4.85
&rst
ixpk= 0, nxpk= 0, iat= 384, 400, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35, &end
#
# 26 VAL HN 27 ARG QD 4.73
&rst
ixpk= 0, nxpk= 0, iat= 384, -1, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
igr2= 410, 411,
&end
#
# 26 VAL QG1 27 ARG HN 3.66
&rst
ixpk= 0, nxpk= 0, iat= -1, 400, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,
igr1= 390, 391, 392,
&end
#
# 26 VAL QG1 28 GLU HA 4.78
&rst
ixpk= 0, nxpk= 0, iat= -1, 426, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
igr1= 390, 391, 392,
&end
#
# 26 VAL QG1 28 GLU HN 3.29
&rst
ixpk= 0, nxpk= 0, iat= -1, 424, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
igr1= 390, 391, 392,
&end
#
# 26 VAL QG1 29 LEU HB3 4.11
&rst
ixpk= 0, nxpk= 0, iat= -1, 444, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
igr1= 390, 391, 392,
&end
#
# 26 VAL QG1 29 LEU HN 4.57
&rst
ixpk= 0, nxpk= 0, iat= -1, 439, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
igr1= 390, 391, 392,
&end
#
# 26 VAL QG1 29 LEU QD2 3.79
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,
igr1= 390, 391, 392,
igr2= 452, 453, 454,
&end
#
# 26 VAL QG1 48 PHE QD 4.72
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
igr1= 390, 391, 392,
igr2= 725, 733,
&end
#
# 26 VAL QG1 48 PHE QE 4.20
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr1= 390, 391, 392,
igr2= 727, 731,
&end
#
# 26 VAL QG1 51 LEU QD1 2.84
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,
igr1= 390, 391, 392,
igr2= 776, 777, 778,
&end
#
# 26 VAL QG2 27 ARG HN 4.17
&rst
ixpk= 0, nxpk= 0, iat= -1, 400, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
igr1= 394, 395, 396,
&end
#
# 26 VAL QG2 48 PHE HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 719, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 394, 395, 396,
&end
#
# 26 VAL QG2 48 PHE QD 3.87
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
igr1= 394, 395, 396,
igr2= 725, 733,
&end
#
# 26 VAL QG2 48 PHE QE 3.64
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
igr1= 394, 395, 396,
igr2= 727, 731,
&end
#
# 27 ARG HB2 27 ARG QD 3.92
&rst
ixpk= 0, nxpk= 0, iat= 404, -1, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,
igr2= 410, 411,
&end
#
# 27 ARG HB2 28 GLU HN 4.19
&rst
ixpk= 0, nxpk= 0, iat= 404, 424, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69, &end
#
# 27 ARG HB3 27 ARG QD 3.92
&rst
ixpk= 0, nxpk= 0, iat= 405, -1, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,
igr2= 410, 411,
&end
#
# 27 ARG HB3 28 GLU HN 4.19
&rst
ixpk= 0, nxpk= 0, iat= 405, 424, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69, &end
#
# 27 ARG HG2 52 GLU HG2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 407, 793, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 27 ARG HG3 52 GLU HG2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 408, 793, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 27 ARG HN 27 ARG HB2 4.11
&rst
ixpk= 0, nxpk= 0, iat= 400, 404, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 27 ARG HN 27 ARG HB3 4.11
&rst
ixpk= 0, nxpk= 0, iat= 400, 405, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 27 ARG HN 27 ARG HG2 4.30
&rst
ixpk= 0, nxpk= 0, iat= 400, 407, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80, &end
#
# 27 ARG HN 27 ARG HG3 4.30
&rst
ixpk= 0, nxpk= 0, iat= 400, 408, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80, &end
#
# 27 ARG HN 27 ARG QB 3.56
&rst
ixpk= 0, nxpk= 0, iat= 400, -1, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,
igr2= 404, 405,
&end
#
# 27 ARG HN 27 ARG QD 4.40
&rst
ixpk= 0, nxpk= 0, iat= 400, -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
igr2= 410, 411,
&end
#
# 27 ARG HN 28 GLU HN 3.28
&rst
ixpk= 0, nxpk= 0, iat= 400, 424, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78, &end
#
# 27 ARG QB 27 ARG QD 3.42
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,
igr1= 404, 405,
igr2= 410, 411,
&end
#
# 27 ARG QB 28 GLU HN 3.56
&rst
ixpk= 0, nxpk= 0, iat= -1, 424, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,
igr1= 404, 405,
&end
#
# 27 ARG QB 52 GLU HG2 4.35
&rst
ixpk= 0, nxpk= 0, iat= -1, 793, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
igr1= 404, 405,
&end
#
# 27 ARG QD 52 GLU HG2 5.28
&rst
ixpk= 0, nxpk= 0, iat= -1, 793, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr1= 410, 411,
&end
#
# 27 ARG QG 28 GLU HN 4.81
&rst
ixpk= 0, nxpk= 0, iat= -1, 424, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr1= 407, 408,
&end
#
# 28 GLU HA 28 GLU HG2 3.97
&rst
ixpk= 0, nxpk= 0, iat= 426, 431, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47, &end
#
# 28 GLU HA 28 GLU HG3 3.97
&rst
ixpk= 0, nxpk= 0, iat= 426, 432, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47, &end
#
# 28 GLU HA 29 LEU HB2 4.97
&rst
ixpk= 0, nxpk= 0, iat= 426, 443, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 28 GLU HA 29 LEU HB3 4.67
&rst
ixpk= 0, nxpk= 0, iat= 426, 444, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, &end
#
# 28 GLU HA 29 LEU HN 3.14
&rst
ixpk= 0, nxpk= 0, iat= 426, 439, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64, &end
#
# 28 GLU HA 51 LEU QD1 3.61
&rst
ixpk= 0, nxpk= 0, iat= 426, -1, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,
igr2= 776, 777, 778,
&end
#
# 28 GLU HA 52 GLU HN 4.97
&rst
ixpk= 0, nxpk= 0, iat= 426, 786, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 28 GLU HA 53 PHE HB2 4.16
&rst
ixpk= 0, nxpk= 0, iat= 426, 805, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66, &end
#
# 28 GLU HA 53 PHE HB3 3.95
&rst
ixpk= 0, nxpk= 0, iat= 426, 806, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45, &end
#
# 28 GLU HA 53 PHE HN 3.73
&rst
ixpk= 0, nxpk= 0, iat= 426, 801, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23, &end
#
# 28 GLU HA 53 PHE QD 4.61
&rst
ixpk= 0, nxpk= 0, iat= 426, -1, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67,
igr2= 809, 817,
&end
#
# 28 GLU HB2 29 LEU HN 4.56
&rst
ixpk= 0, nxpk= 0, iat= 428, 439, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06, &end
#
# 28 GLU HB2 53 PHE HB2 4.31
&rst
ixpk= 0, nxpk= 0, iat= 428, 805, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81, &end
#
# 28 GLU HB2 53 PHE HB3 3.98
&rst
ixpk= 0, nxpk= 0, iat= 428, 806, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48, &end
#
# 28 GLU HB2 53 PHE QD 4.27
&rst
ixpk= 0, nxpk= 0, iat= 428, -1, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
igr2= 809, 817,
&end
#
# 28 GLU HB3 29 LEU HN 4.53
&rst
ixpk= 0, nxpk= 0, iat= 429, 439, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03, &end
#
# 28 GLU HB3 53 PHE HB3 4.74
&rst
ixpk= 0, nxpk= 0, iat= 429, 806, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24, &end
#
# 28 GLU HB3 53 PHE QD 4.51
&rst
ixpk= 0, nxpk= 0, iat= 429, -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
igr2= 809, 817,
&end
#
# 28 GLU HG2 29 LEU HN 4.54
&rst
ixpk= 0, nxpk= 0, iat= 431, 439, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 28 GLU HG2 53 PHE HB2 4.75
&rst
ixpk= 0, nxpk= 0, iat= 431, 805, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, &end
#
# 28 GLU HG2 53 PHE HB3 4.06
&rst
ixpk= 0, nxpk= 0, iat= 431, 806, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56, &end
#
# 28 GLU HG2 53 PHE QD 4.17
&rst
ixpk= 0, nxpk= 0, iat= 431, -1, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
igr2= 809, 817,
&end
#
# 28 GLU HG3 29 LEU HN 4.54
&rst
ixpk= 0, nxpk= 0, iat= 432, 439, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 28 GLU HG3 53 PHE HB2 4.75
&rst
ixpk= 0, nxpk= 0, iat= 432, 805, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, &end
#
# 28 GLU HG3 53 PHE HB3 4.06
&rst
ixpk= 0, nxpk= 0, iat= 432, 806, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56, &end
#
# 28 GLU HG3 53 PHE QD 4.17
&rst
ixpk= 0, nxpk= 0, iat= 432, -1, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
igr2= 809, 817,
&end
#
# 28 GLU HN 28 GLU HB2 3.83
&rst
ixpk= 0, nxpk= 0, iat= 424, 428, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33, &end
#
# 28 GLU HN 28 GLU HB3 3.64
&rst
ixpk= 0, nxpk= 0, iat= 424, 429, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14, &end
#
# 28 GLU HN 28 GLU HG2 5.15
&rst
ixpk= 0, nxpk= 0, iat= 424, 431, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65, &end
#
# 28 GLU HN 28 GLU HG3 5.15
&rst
ixpk= 0, nxpk= 0, iat= 424, 432, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65, &end
#
# 28 GLU HN 28 GLU QG 4.53
&rst
ixpk= 0, nxpk= 0, iat= 424, -1, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
igr2= 431, 432,
&end
#
# 28 GLU HN 29 LEU HN 4.55
&rst
ixpk= 0, nxpk= 0, iat= 424, 439, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05, &end
#
# 28 GLU HN 51 LEU QD1 3.68
&rst
ixpk= 0, nxpk= 0, iat= 424, -1, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
igr2= 776, 777, 778,
&end
#
# 28 GLU HN 53 PHE QD 5.50
&rst
ixpk= 0, nxpk= 0, iat= 424, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 809, 817,
&end
#
# 28 GLU QG 30 VAL QQG 3.97
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51,
igr1= 431, 432,
igr2= 464, 465, 466, 468, 469, 470,
&end
#
# 28 GLU QG 53 PHE HB2 4.16
&rst
ixpk= 0, nxpk= 0, iat= -1, 805, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
igr1= 431, 432,
&end
#
# 28 GLU QG 53 PHE HB3 3.55
&rst
ixpk= 0, nxpk= 0, iat= -1, 806, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,
igr1= 431, 432,
&end
#
# 29 LEU HA 29 LEU QD1 3.21
&rst
ixpk= 0, nxpk= 0, iat= 441, -1, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,
igr2= 448, 449, 450,
&end
#
# 29 LEU HA 29 LEU QD2 4.04
&rst
ixpk= 0, nxpk= 0, iat= 441, -1, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
igr2= 452, 453, 454,
&end
#
# 29 LEU HA 30 VAL HN 3.14
&rst
ixpk= 0, nxpk= 0, iat= 441, 458, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64, &end
#
# 29 LEU HA 30 VAL QQG 3.96
&rst
ixpk= 0, nxpk= 0, iat= 441, -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr2= 464, 465, 466, 468, 469, 470,
&end
#
# 29 LEU HB2 29 LEU QD1 3.00
&rst
ixpk= 0, nxpk= 0, iat= 443, -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr2= 448, 449, 450,
&end
#
# 29 LEU HB2 29 LEU QD2 3.50
&rst
ixpk= 0, nxpk= 0, iat= 443, -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
igr2= 452, 453, 454,
&end
#
# 29 LEU HB2 30 VAL HN 4.69
&rst
ixpk= 0, nxpk= 0, iat= 443, 458, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, &end
#
# 29 LEU HB2 51 LEU QD1 3.16
&rst
ixpk= 0, nxpk= 0, iat= 443, -1, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,
igr2= 776, 777, 778,
&end
#
# 29 LEU HB3 29 LEU QD1 3.10
&rst
ixpk= 0, nxpk= 0, iat= 444, -1, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,
igr2= 448, 449, 450,
&end
#
# 29 LEU HB3 29 LEU QD2 3.11
&rst
ixpk= 0, nxpk= 0, iat= 444, -1, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23,
igr2= 452, 453, 454,
&end
#
# 29 LEU HB3 30 VAL HN 4.50
&rst
ixpk= 0, nxpk= 0, iat= 444, 458, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 29 LEU HB3 48 PHE HZ 5.50
&rst
ixpk= 0, nxpk= 0, iat= 444, 729, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 29 LEU HB3 48 PHE QD 4.91
&rst
ixpk= 0, nxpk= 0, iat= 444, -1, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
igr2= 725, 733,
&end
#
# 29 LEU HB3 48 PHE QE 4.69
&rst
ixpk= 0, nxpk= 0, iat= 444, -1, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr2= 727, 731,
&end
#
# 29 LEU HB3 54 LEU HA 4.93
&rst
ixpk= 0, nxpk= 0, iat= 444, 823, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43, &end
#
# 29 LEU HG 30 VAL HN 4.09
&rst
ixpk= 0, nxpk= 0, iat= 446, 458, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59, &end
#
# 29 LEU HN 29 LEU HB2 3.68
&rst
ixpk= 0, nxpk= 0, iat= 439, 443, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18, &end
#
# 29 LEU HN 29 LEU HB3 3.79
&rst
ixpk= 0, nxpk= 0, iat= 439, 444, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29, &end
#
# 29 LEU HN 29 LEU HG 4.81
&rst
ixpk= 0, nxpk= 0, iat= 439, 446, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31, &end
#
# 29 LEU HN 29 LEU QD2 4.59
&rst
ixpk= 0, nxpk= 0, iat= 439, -1, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
igr2= 452, 453, 454,
&end
#
# 29 LEU HN 30 VAL HN 4.60
&rst
ixpk= 0, nxpk= 0, iat= 439, 458, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 29 LEU HN 30 VAL QQG 4.62
&rst
ixpk= 0, nxpk= 0, iat= 439, -1, r1= 1.30, r2= 1.80, r3= 6.23, r4= 6.73,
igr2= 464, 465, 466, 468, 469, 470,
&end
#
# 29 LEU HN 51 LEU QD1 3.51
&rst
ixpk= 0, nxpk= 0, iat= 439, -1, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
igr2= 776, 777, 778,
&end
#
# 29 LEU HN 51 LEU QD2 3.64
&rst
ixpk= 0, nxpk= 0, iat= 439, -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
igr2= 780, 781, 782,
&end
#
# 29 LEU HN 53 PHE HB2 4.83
&rst
ixpk= 0, nxpk= 0, iat= 439, 805, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33, &end
#
# 29 LEU HN 53 PHE HB3 4.50
&rst
ixpk= 0, nxpk= 0, iat= 439, 806, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 29 LEU HN 53 PHE HN 4.39
&rst
ixpk= 0, nxpk= 0, iat= 439, 801, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89, &end
#
# 29 LEU HN 53 PHE QD 4.58
&rst
ixpk= 0, nxpk= 0, iat= 439, -1, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
igr2= 809, 817,
&end
#
# 29 LEU HN 54 LEU HA 4.28
&rst
ixpk= 0, nxpk= 0, iat= 439, 823, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78, &end
#
# 29 LEU HN 55 SER HN 4.87
&rst
ixpk= 0, nxpk= 0, iat= 439, 840, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37, &end
#
# 29 LEU QD1 30 VAL HN 3.59
&rst
ixpk= 0, nxpk= 0, iat= -1, 458, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,
igr1= 448, 449, 450,
&end
#
# 29 LEU QD1 48 PHE HZ 5.20
&rst
ixpk= 0, nxpk= 0, iat= -1, 729, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
igr1= 448, 449, 450,
&end
#
# 29 LEU QD1 48 PHE QE 4.07
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
igr1= 448, 449, 450,
igr2= 727, 731,
&end
#
# 29 LEU QD2 30 VAL HN 4.67
&rst
ixpk= 0, nxpk= 0, iat= -1, 458, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr1= 452, 453, 454,
&end
#
# 29 LEU QD2 48 PHE QD 4.52
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.09, r4= 6.59,
igr1= 452, 453, 454,
igr2= 725, 733,
&end
#
# 29 LEU QD2 48 PHE QE 4.10
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03,
igr1= 452, 453, 454,
igr2= 727, 731,
&end
#
# 30 VAL HA 30 VAL QG1 3.34
&rst
ixpk= 0, nxpk= 0, iat= 460, -1, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,
igr2= 464, 465, 466,
&end
#
# 30 VAL HA 30 VAL QG2 3.34
&rst
ixpk= 0, nxpk= 0, iat= 460, -1, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,
igr2= 468, 469, 470,
&end
#
# 30 VAL HA 31 LEU HN 3.55
&rst
ixpk= 0, nxpk= 0, iat= 460, 474, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05, &end
#
# 30 VAL HA 32 ASP HN 4.22
&rst
ixpk= 0, nxpk= 0, iat= 460, 493, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 30 VAL HA 54 LEU QD1 5.17
&rst
ixpk= 0, nxpk= 0, iat= 460, -1, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,
igr2= 830, 831, 832,
&end
#
# 30 VAL HA 55 SER HN 4.03
&rst
ixpk= 0, nxpk= 0, iat= 460, 840, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53, &end
#
# 30 VAL HA 55 SER QB 3.91
&rst
ixpk= 0, nxpk= 0, iat= 460, -1, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,
igr2= 844, 845,
&end
#
# 30 VAL HB 31 LEU HN 4.99
&rst
ixpk= 0, nxpk= 0, iat= 462, 474, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49, &end
#
# 30 VAL HB 55 SER HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 462, 840, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 30 VAL HB 55 SER QB 4.76
&rst
ixpk= 0, nxpk= 0, iat= 462, -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr2= 844, 845,
&end
#
# 30 VAL HN 30 VAL HB 3.90
&rst
ixpk= 0, nxpk= 0, iat= 458, 462, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40, &end
#
# 30 VAL HN 30 VAL QG1 3.68
&rst
ixpk= 0, nxpk= 0, iat= 458, -1, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
igr2= 464, 465, 466,
&end
#
# 30 VAL HN 30 VAL QG2 3.68
&rst
ixpk= 0, nxpk= 0, iat= 458, -1, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
igr2= 468, 469, 470,
&end
#
# 30 VAL HN 30 VAL QQG 3.08
&rst
ixpk= 0, nxpk= 0, iat= 458, -1, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65,
igr2= 464, 465, 466, 468, 469, 470,
&end
#
# 30 VAL HN 31 LEU HN 4.75
&rst
ixpk= 0, nxpk= 0, iat= 458, 474, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, &end
#
# 30 VAL QG1 31 LEU HN 4.43
&rst
ixpk= 0, nxpk= 0, iat= -1, 474, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
igr1= 464, 465, 466,
&end
#
# 30 VAL QG1 55 SER HB2 4.31
&rst
ixpk= 0, nxpk= 0, iat= -1, 844, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
igr1= 464, 465, 466,
&end
#
# 30 VAL QG1 55 SER HB3 4.31
&rst
ixpk= 0, nxpk= 0, iat= -1, 845, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
igr1= 464, 465, 466,
&end
#
# 30 VAL QG1 55 SER HN 5.23
&rst
ixpk= 0, nxpk= 0, iat= -1, 840, r1= 1.30, r2= 1.80, r3= 6.28, r4= 6.78,
igr1= 464, 465, 466,
&end
#
# 30 VAL QG2 31 LEU HN 4.43
&rst
ixpk= 0, nxpk= 0, iat= -1, 474, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
igr1= 468, 469, 470,
&end
#
# 30 VAL QG2 55 SER HB2 4.31
&rst
ixpk= 0, nxpk= 0, iat= -1, 844, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
igr1= 468, 469, 470,
&end
#
# 30 VAL QG2 55 SER HB3 4.31
&rst
ixpk= 0, nxpk= 0, iat= -1, 845, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
igr1= 468, 469, 470,
&end
#
# 30 VAL QG2 55 SER HN 5.23
&rst
ixpk= 0, nxpk= 0, iat= -1, 840, r1= 1.30, r2= 1.80, r3= 6.28, r4= 6.78,
igr1= 468, 469, 470,
&end
#
# 30 VAL QQG 31 LEU HG 5.16
&rst
ixpk= 0, nxpk= 0, iat= -1, 481, r1= 1.30, r2= 1.80, r3= 6.96, r4= 7.46,
igr1= 464, 465, 466, 468, 469, 470,
&end
#
# 30 VAL QQG 31 LEU HN 3.46
&rst
ixpk= 0, nxpk= 0, iat= -1, 474, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
igr1= 464, 465, 466, 468, 469, 470,
&end
#
# 30 VAL QQG 31 LEU QB 4.96
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.50, r4= 8.00,
igr1= 464, 465, 466, 468, 469, 470,
igr2= 478, 479,
&end
#
# 30 VAL QQG 32 ASP HN 3.22
&rst
ixpk= 0, nxpk= 0, iat= -1, 493, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,
igr1= 464, 465, 466, 468, 469, 470,
&end
#
# 30 VAL QQG 32 ASP QB 3.69
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr1= 464, 465, 466, 468, 469, 470,
igr2= 497, 498,
&end
#
# 30 VAL QQG 53 PHE HZ 4.12
&rst
ixpk= 0, nxpk= 0, iat= -1, 813, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,
igr1= 464, 465, 466, 468, 469, 470,
&end
#
# 30 VAL QQG 53 PHE QE 3.35
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
igr1= 464, 465, 466, 468, 469, 470,
igr2= 811, 815,
&end
#
# 30 VAL QQG 55 SER HN 3.98
&rst
ixpk= 0, nxpk= 0, iat= -1, 840, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr1= 464, 465, 466, 468, 469, 470,
&end
#
# 30 VAL QQG 55 SER QB 3.02
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,
igr1= 464, 465, 466, 468, 469, 470,
igr2= 844, 845,
&end
#
# 31 LEU HA 31 LEU QQD 3.27
&rst
ixpk= 0, nxpk= 0, iat= 476, -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
igr2= 483, 484, 485, 487, 488, 489,
&end
#
# 31 LEU HG 32 ASP HN 5.19
&rst
ixpk= 0, nxpk= 0, iat= 481, 493, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69, &end
#
# 31 LEU HN 31 LEU HG 4.13
&rst
ixpk= 0, nxpk= 0, iat= 474, 481, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63, &end
#
# 31 LEU HN 31 LEU QQD 3.74
&rst
ixpk= 0, nxpk= 0, iat= 474, -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr2= 483, 484, 485, 487, 488, 489,
&end
#
# 31 LEU HN 32 ASP HN 3.52
&rst
ixpk= 0, nxpk= 0, iat= 474, 493, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02, &end
#
# 31 LEU HN 55 SER HB2 4.74
&rst
ixpk= 0, nxpk= 0, iat= 474, 844, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24, &end
#
# 31 LEU HN 55 SER HB3 4.74
&rst
ixpk= 0, nxpk= 0, iat= 474, 845, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24, &end
#
# 31 LEU HN 55 SER HN 4.43
&rst
ixpk= 0, nxpk= 0, iat= 474, 840, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93, &end
#
# 31 LEU HN 55 SER QB 4.15
&rst
ixpk= 0, nxpk= 0, iat= 474, -1, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
igr2= 844, 845,
&end
#
# 31 LEU HN 56 LEU QD2 4.70
&rst
ixpk= 0, nxpk= 0, iat= 474, -1, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14,
igr2= 864, 865, 866,
&end
#
# 31 LEU QB 31 LEU QQD 3.38
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,
igr1= 478, 479,
igr2= 483, 484, 485, 487, 488, 489,
&end
#
# 31 LEU QB 32 ASP HN 4.61
&rst
ixpk= 0, nxpk= 0, iat= -1, 493, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67,
igr1= 478, 479,
&end
#
# 31 LEU QB 55 SER HN 5.09
&rst
ixpk= 0, nxpk= 0, iat= -1, 840, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21,
igr1= 478, 479,
&end
#
# 31 LEU QQD 32 ASP HN 4.74
&rst
ixpk= 0, nxpk= 0, iat= -1, 493, r1= 1.30, r2= 1.80, r3= 6.39, r4= 6.89,
igr1= 483, 484, 485, 487, 488, 489,
&end
#
# 32 ASP HA 33 ASN HN 3.29
&rst
ixpk= 0, nxpk= 0, iat= 495, 505, r1= 1.30, r2= 1.80, r3= 3.29, r4= 3.79, &end
#
# 32 ASP HA 57 ILE HB 4.50
&rst
ixpk= 0, nxpk= 0, iat= 495, 874, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 32 ASP HA 57 ILE HN 3.79
&rst
ixpk= 0, nxpk= 0, iat= 495, 870, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29, &end
#
# 32 ASP HA 59 VAL QG1 3.62
&rst
ixpk= 0, nxpk= 0, iat= 495, -1, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,
igr2= 909, 910, 911,
&end
#
# 32 ASP HB2 33 ASN HN 4.66
&rst
ixpk= 0, nxpk= 0, iat= 497, 505, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16, &end
#
# 32 ASP HB3 33 ASN HN 4.66
&rst
ixpk= 0, nxpk= 0, iat= 498, 505, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16, &end
#
# 32 ASP HN 32 ASP QB 3.57
&rst
ixpk= 0, nxpk= 0, iat= 493, -1, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,
igr2= 497, 498,
&end
#
# 32 ASP QB 33 ASN HN 3.83
&rst
ixpk= 0, nxpk= 0, iat= -1, 505, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
igr1= 497, 498,
&end
#
# 32 ASP QB 33 ASN QD2 3.75
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
igr1= 497, 498,
igr2= 514, 515,
&end
#
# 32 ASP QB 57 ILE HB 4.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 874, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,
igr1= 497, 498,
&end
#
# 32 ASP QB 57 ILE HN 4.14
&rst
ixpk= 0, nxpk= 0, iat= -1, 870, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
igr1= 497, 498,
&end
#
# 32 ASP QB 57 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= 497, 498,
igr2= 883, 884, 885,
&end
#
# 32 ASP QB 57 ILE QG2 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.20, r4= 7.70,
igr1= 497, 498,
igr2= 876, 877, 878,
&end
#
# 32 ASP QB 59 VAL QG1 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.20, r4= 7.70,
igr1= 497, 498,
igr2= 909, 910, 911,
&end
#
# 33 ASN HA 33 ASN QD2 4.88
&rst
ixpk= 0, nxpk= 0, iat= 507, -1, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
igr2= 514, 515,
&end
#
# 33 ASN HA 58 ASN HD21 4.41
&rst
ixpk= 0, nxpk= 0, iat= 507, 898, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, &end
#
# 33 ASN HA 58 ASN HD22 4.41
&rst
ixpk= 0, nxpk= 0, iat= 507, 899, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, &end
#
# 33 ASN HN 34 CYS HN 3.74
&rst
ixpk= 0, nxpk= 0, iat= 505, 519, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24, &end
#
# 33 ASN HN 57 ILE HN 4.55
&rst
ixpk= 0, nxpk= 0, iat= 505, 870, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05, &end
#
# 33 ASN HN 57 ILE QG2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 505, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2= 876, 877, 878,
&end
#
# 33 ASN HN 58 ASN QB 5.17
&rst
ixpk= 0, nxpk= 0, iat= 505, -1, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
igr2= 893, 894,
&end
#
# 33 ASN HN 58 ASN QD2 4.85
&rst
ixpk= 0, nxpk= 0, iat= 505, -1, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
igr2= 898, 899,
&end
#
# 33 ASN HN 59 VAL QG1 3.65
&rst
ixpk= 0, nxpk= 0, iat= 505, -1, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
igr2= 909, 910, 911,
&end
#
# 33 ASN QB 33 ASN QD2 2.97
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24,
igr1= 509, 510,
igr2= 514, 515,
&end
#
# 33 ASN QB 58 ASN QD2 4.37
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
igr1= 509, 510,
igr2= 898, 899,
&end
#
# 34 CYS HA 35 LYS HN 3.35
&rst
ixpk= 0, nxpk= 0, iat= 521, 530, r1= 1.30, r2= 1.80, r3= 3.35, r4= 3.85, &end
#
# 34 CYS HB2 35 LYS HN 3.99
&rst
ixpk= 0, nxpk= 0, iat= 523, 530, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49, &end
#
# 34 CYS HB2 59 VAL HB 5.50
&rst
ixpk= 0, nxpk= 0, iat= 523, 907, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 34 CYS HB2 59 VAL QG1 4.60
&rst
ixpk= 0, nxpk= 0, iat= 523, -1, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
igr2= 909, 910, 911,
&end
#
# 34 CYS HB3 35 LYS HN 3.99
&rst
ixpk= 0, nxpk= 0, iat= 524, 530, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49, &end
#
# 34 CYS HB3 59 VAL HB 5.50
&rst
ixpk= 0, nxpk= 0, iat= 524, 907, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 34 CYS HB3 59 VAL QG1 4.60
&rst
ixpk= 0, nxpk= 0, iat= 524, -1, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
igr2= 909, 910, 911,
&end
#
# 34 CYS HN 34 CYS HB2 3.94
&rst
ixpk= 0, nxpk= 0, iat= 519, 523, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44, &end
#
# 34 CYS HN 34 CYS HB3 3.94
&rst
ixpk= 0, nxpk= 0, iat= 519, 524, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44, &end
#
# 34 CYS HN 34 CYS QB 3.31
&rst
ixpk= 0, nxpk= 0, iat= 519, -1, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,
igr2= 523, 524,
&end
#
# 34 CYS HN 35 LYS HN 4.58
&rst
ixpk= 0, nxpk= 0, iat= 519, 530, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08, &end
#
# 34 CYS HN 59 VAL HA 4.58
&rst
ixpk= 0, nxpk= 0, iat= 519, 905, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08, &end
#
# 34 CYS HN 59 VAL HB 4.96
&rst
ixpk= 0, nxpk= 0, iat= 519, 907, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46, &end
#
# 34 CYS HN 59 VAL QG1 3.05
&rst
ixpk= 0, nxpk= 0, iat= 519, -1, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,
igr2= 909, 910, 911,
&end
#
# 34 CYS HN 59 VAL QG2 5.29
&rst
ixpk= 0, nxpk= 0, iat= 519, -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
igr2= 913, 914, 915,
&end
#
# 34 CYS QB 35 LYS HN 3.31
&rst
ixpk= 0, nxpk= 0, iat= -1, 530, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,
igr1= 523, 524,
&end
#
# 35 LYS HA 35 LYS QD 4.37
&rst
ixpk= 0, nxpk= 0, iat= 532, -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
igr2= 540, 541,
&end
#
# 35 LYS HA 35 LYS QG 3.47
&rst
ixpk= 0, nxpk= 0, iat= 532, -1, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,
igr2= 537, 538,
&end
#
# 35 LYS HA 36 SER HN 2.94
&rst
ixpk= 0, nxpk= 0, iat= 532, 552, r1= 1.30, r2= 1.80, r3= 2.94, r4= 3.44, &end
#
# 35 LYS HA 59 VAL HA 4.26
&rst
ixpk= 0, nxpk= 0, iat= 532, 905, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76, &end
#
# 35 LYS HB2 35 LYS QG 2.90
&rst
ixpk= 0, nxpk= 0, iat= 534, -1, r1= 1.30, r2= 1.80, r3= 3.26, r4= 3.76,
igr2= 537, 538,
&end
#
# 35 LYS HB3 35 LYS QG 2.90
&rst
ixpk= 0, nxpk= 0, iat= 535, -1, r1= 1.30, r2= 1.80, r3= 3.26, r4= 3.76,
igr2= 537, 538,
&end
#
# 35 LYS HN 35 LYS HB2 3.71
&rst
ixpk= 0, nxpk= 0, iat= 530, 534, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21, &end
#
# 35 LYS HN 35 LYS HB3 3.71
&rst
ixpk= 0, nxpk= 0, iat= 530, 535, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21, &end
#
# 35 LYS HN 35 LYS QB 3.22
&rst
ixpk= 0, nxpk= 0, iat= 530, -1, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11,
igr2= 534, 535,
&end
#
# 35 LYS HN 35 LYS QD 4.31
&rst
ixpk= 0, nxpk= 0, iat= 530, -1, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
igr2= 540, 541,
&end
#
# 35 LYS HN 35 LYS QG 3.97
&rst
ixpk= 0, nxpk= 0, iat= 530, -1, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
igr2= 537, 538,
&end
#
# 35 LYS HN 36 SER HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= 530, 554, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 35 LYS QB 35 LYS QE 4.10
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67,
igr1= 534, 535,
igr2= 543, 544,
&end
#
# 35 LYS QB 36 SER HN 3.80
&rst
ixpk= 0, nxpk= 0, iat= -1, 552, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,
igr1= 534, 535,
&end
#
# 35 LYS QD 36 SER HN 4.53
&rst
ixpk= 0, nxpk= 0, iat= -1, 552, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
igr1= 540, 541,
&end
#
# 35 LYS QG 36 SER HN 4.01
&rst
ixpk= 0, nxpk= 0, iat= -1, 552, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
igr1= 537, 538,
&end
#
# 36 SER HA 37 ASN HN 2.50
&rst
ixpk= 0, nxpk= 0, iat= 554, 563, r1= 1.30, r2= 1.80, r3= 2.50, r4= 3.00, &end
#
# 36 SER HA 37 ASN QB 4.50
&rst
ixpk= 0, nxpk= 0, iat= 554, -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
igr2= 567, 568,
&end
#
# 36 SER HA 61 LEU QD1 4.64
&rst
ixpk= 0, nxpk= 0, iat= 554, -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
igr2= 935, 936, 937,
&end
#
# 36 SER HB2 37 ASN HN 4.31
&rst
ixpk= 0, nxpk= 0, iat= 556, 563, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81, &end
#
# 36 SER HB3 37 ASN HN 4.31
&rst
ixpk= 0, nxpk= 0, iat= 557, 563, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81, &end
#
# 36 SER HN 36 SER HB2 3.86
&rst
ixpk= 0, nxpk= 0, iat= 552, 556, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 36 SER HN 36 SER HB3 3.86
&rst
ixpk= 0, nxpk= 0, iat= 552, 557, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 36 SER HN 36 SER QB 3.36
&rst
ixpk= 0, nxpk= 0, iat= 552, -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
igr2= 556, 557,
&end
#
# 36 SER HN 59 VAL HA 4.85
&rst
ixpk= 0, nxpk= 0, iat= 552, 905, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35, &end
#
# 36 SER HN 59 VAL HB 4.16
&rst
ixpk= 0, nxpk= 0, iat= 552, 907, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66, &end
#
# 36 SER QB 37 ASN HN 3.73
&rst
ixpk= 0, nxpk= 0, iat= -1, 563, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,
igr1= 556, 557,
&end
#
# 36 SER QB 37 ASN QB 4.97
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.26, r4= 6.76,
igr1= 556, 557,
igr2= 567, 568,
&end
#
# 36 SER QB 40 LYS HN 3.98
&rst
ixpk= 0, nxpk= 0, iat= -1, 596, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
igr1= 556, 557,
&end
#
# 36 SER QB 59 VAL HB 4.51
&rst
ixpk= 0, nxpk= 0, iat= -1, 907, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
igr1= 556, 557,
&end
#
# 36 SER QB 59 VAL QG2 3.89
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr1= 556, 557,
igr2= 913, 914, 915,
&end
#
# 36 SER QB 61 LEU HB2 4.84
&rst
ixpk= 0, nxpk= 0, iat= -1, 930, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
igr1= 556, 557,
&end
#
# 36 SER QB 61 LEU HG 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, 933, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1= 556, 557,
&end
#
# 36 SER QB 61 LEU QD1 3.61
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,
igr1= 556, 557,
igr2= 935, 936, 937,
&end
#
# 37 ASN HA 38 ASP HN 2.30
&rst
ixpk= 0, nxpk= 0, iat= 565, 577, r1= 1.30, r2= 1.80, r3= 2.30, r4= 2.80, &end
#
# 37 ASN HA 38 ASP HN 2.50
&rst
ixpk= 0, nxpk= 0, iat= 565, 577, r1= 1.30, r2= 1.80, r3= 2.50, r4= 3.00, &end
#
# 37 ASN HN 37 ASN QB 3.50
&rst
ixpk= 0, nxpk= 0, iat= 563, -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
igr2= 567, 568,
&end
#
# 37 ASN HN 37 ASN QD2 4.88
&rst
ixpk= 0, nxpk= 0, iat= 563, -1, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
igr2= 572, 573,
&end
#
# 37 ASN HN 40 LYS HN 4.18
&rst
ixpk= 0, nxpk= 0, iat= 563, 596, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68, &end
#
# 37 ASN HN 42 GLU HB2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 563, 641, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 37 ASN HN 42 GLU HB3 5.50
&rst
ixpk= 0, nxpk= 0, iat= 563, 642, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 37 ASN HN 42 GLU QB 4.68
&rst
ixpk= 0, nxpk= 0, iat= 563, -1, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
igr2= 641, 642,
&end
#
# 37 ASN HN 61 LEU QD1 4.96
&rst
ixpk= 0, nxpk= 0, iat= 563, -1, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
igr2= 935, 936, 937,
&end
#
# 37 ASN QB 37 ASN HD21 3.89
&rst
ixpk= 0, nxpk= 0, iat= -1, 572, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
igr1= 567, 568,
&end
#
# 37 ASN QB 37 ASN HD22 3.89
&rst
ixpk= 0, nxpk= 0, iat= -1, 573, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
igr1= 567, 568,
&end
#
# 37 ASN QB 37 ASN QD2 3.18
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,
igr1= 567, 568,
igr2= 572, 573,
&end
#
# 37 ASN QB 40 LYS HN 4.26
&rst
ixpk= 0, nxpk= 0, iat= -1, 596, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
igr1= 567, 568,
&end
#
# 37 ASN QB 40 LYS QB 4.29
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,
igr1= 567, 568,
igr2= 600, 601,
&end
#
# 37 ASN QB 41 ILE HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 620, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 567, 568,
&end
#
# 37 ASN QB 42 GLU HB2 4.07
&rst
ixpk= 0, nxpk= 0, iat= -1, 641, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,
igr1= 567, 568,
&end
#
# 37 ASN QB 42 GLU HB3 4.07
&rst
ixpk= 0, nxpk= 0, iat= -1, 642, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,
igr1= 567, 568,
&end
#
# 37 ASN QB 42 GLU HN 4.38
&rst
ixpk= 0, nxpk= 0, iat= -1, 637, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
igr1= 567, 568,
&end
#
# 37 ASN QB 42 GLU QB 3.38
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,
igr1= 567, 568,
igr2= 641, 642,
&end
#
# 37 ASN QB 42 GLU QG 5.14
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.48, r4= 6.98,
igr1= 567, 568,
igr2= 644, 645,
&end
#
# 37 ASN QD2 42 GLU QB 4.07
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
igr1= 572, 573,
igr2= 641, 642,
&end
#
# 37 ASN QD2 42 GLU QG 4.73
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
igr1= 572, 573,
igr2= 644, 645,
&end
#
# 38 ASP HA 38 ASP HN 2.30
&rst
ixpk= 0, nxpk= 0, iat= 579, 577, r1= 1.30, r2= 1.80, r3= 2.30, r4= 2.80, &end
#
# 38 ASP HN 39 GLY HN 4.23
&rst
ixpk= 0, nxpk= 0, iat= 577, 589, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73, &end
#
# 38 ASP QB 40 LYS HN 5.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 596, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
igr1= 581, 582,
&end
#
# 39 GLY HA2 61 LEU HA 3.95
&rst
ixpk= 0, nxpk= 0, iat= 591, 928, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45, &end
#
# 39 GLY HA2 61 LEU HG 4.10
&rst
ixpk= 0, nxpk= 0, iat= 591, 933, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60, &end
#
# 39 GLY HA2 61 LEU QD1 4.64
&rst
ixpk= 0, nxpk= 0, iat= 591, -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
igr2= 935, 936, 937,
&end
#
# 39 GLY HA2 61 LEU QD2 4.50
&rst
ixpk= 0, nxpk= 0, iat= 591, -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr2= 939, 940, 941,
&end
#
# 39 GLY HA2 62 ILE HB 5.46
&rst
ixpk= 0, nxpk= 0, iat= 591, 949, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96, &end
#
# 39 GLY HA2 62 ILE HG13 5.00
&rst
ixpk= 0, nxpk= 0, iat= 591, 956, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 39 GLY HA2 62 ILE HN 4.19
&rst
ixpk= 0, nxpk= 0, iat= 591, 945, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69, &end
#
# 39 GLY HA2 62 ILE QD1 4.23
&rst
ixpk= 0, nxpk= 0, iat= 591, -1, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
igr2= 958, 959, 960,
&end
#
# 39 GLY HA3 61 LEU HA 4.22
&rst
ixpk= 0, nxpk= 0, iat= 592, 928, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 39 GLY HA3 61 LEU HG 4.14
&rst
ixpk= 0, nxpk= 0, iat= 592, 933, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64, &end
#
# 39 GLY HA3 61 LEU QD1 4.55
&rst
ixpk= 0, nxpk= 0, iat= 592, -1, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
igr2= 935, 936, 937,
&end
#
# 39 GLY HA3 62 ILE HB 4.42
&rst
ixpk= 0, nxpk= 0, iat= 592, 949, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92, &end
#
# 39 GLY HA3 62 ILE HG13 4.09
&rst
ixpk= 0, nxpk= 0, iat= 592, 956, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59, &end
#
# 39 GLY HA3 62 ILE HN 4.31
&rst
ixpk= 0, nxpk= 0, iat= 592, 945, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81, &end
#
# 39 GLY HA3 62 ILE QD1 3.52
&rst
ixpk= 0, nxpk= 0, iat= 592, -1, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,
igr2= 958, 959, 960,
&end
#
# 39 GLY HA3 63 SER HN 4.44
&rst
ixpk= 0, nxpk= 0, iat= 592, 964, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94, &end
#
# 39 GLY HN 61 LEU HA 4.76
&rst
ixpk= 0, nxpk= 0, iat= 589, 928, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26, &end
#
# 39 GLY HN 62 ILE QD1 4.85
&rst
ixpk= 0, nxpk= 0, iat= 589, -1, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32,
igr2= 958, 959, 960,
&end
#
# 40 LYS HA 40 LYS HG2 4.21
&rst
ixpk= 0, nxpk= 0, iat= 598, 603, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71, &end
#
# 40 LYS HA 40 LYS HG3 4.21
&rst
ixpk= 0, nxpk= 0, iat= 598, 604, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71, &end
#
# 40 LYS HA 40 LYS QG 3.69
&rst
ixpk= 0, nxpk= 0, iat= 598, -1, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,
igr2= 603, 604,
&end
#
# 40 LYS HA 61 LEU QD2 4.46
&rst
ixpk= 0, nxpk= 0, iat= 598, -1, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
igr2= 939, 940, 941,
&end
#
# 40 LYS HB2 41 ILE HN 4.74
&rst
ixpk= 0, nxpk= 0, iat= 600, 618, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24, &end
#
# 40 LYS HB2 66 ASN HD22 4.59
&rst
ixpk= 0, nxpk= 0, iat= 600,1012, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 40 LYS HB3 41 ILE HN 4.74
&rst
ixpk= 0, nxpk= 0, iat= 601, 618, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24, &end
#
# 40 LYS HB3 66 ASN HD22 4.59
&rst
ixpk= 0, nxpk= 0, iat= 601,1012, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 40 LYS HG2 63 SER HB2 5.13
&rst
ixpk= 0, nxpk= 0, iat= 603, 968, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63, &end
#
# 40 LYS HG2 63 SER HB3 5.13
&rst
ixpk= 0, nxpk= 0, iat= 603, 969, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63, &end
#
# 40 LYS HG3 63 SER HB2 5.13
&rst
ixpk= 0, nxpk= 0, iat= 604, 968, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63, &end
#
# 40 LYS HG3 63 SER HB3 5.13
&rst
ixpk= 0, nxpk= 0, iat= 604, 969, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63, &end
#
# 40 LYS HN 40 LYS HB2 4.05
&rst
ixpk= 0, nxpk= 0, iat= 596, 600, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55, &end
#
# 40 LYS HN 40 LYS HB3 4.05
&rst
ixpk= 0, nxpk= 0, iat= 596, 601, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55, &end
#
# 40 LYS HN 40 LYS QB 3.32
&rst
ixpk= 0, nxpk= 0, iat= 596, -1, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23,
igr2= 600, 601,
&end
#
# 40 LYS HN 40 LYS QE 4.73
&rst
ixpk= 0, nxpk= 0, iat= 596, -1, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
igr2= 609, 610,
&end
#
# 40 LYS HN 40 LYS QG 3.49
&rst
ixpk= 0, nxpk= 0, iat= 596, -1, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
igr2= 603, 604,
&end
#
# 40 LYS HN 61 LEU HG 5.50
&rst
ixpk= 0, nxpk= 0, iat= 596, 933, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 40 LYS HN 61 LEU QD1 3.68
&rst
ixpk= 0, nxpk= 0, iat= 596, -1, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
igr2= 935, 936, 937,
&end
#
# 40 LYS QB 40 LYS QE 3.82
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31,
igr1= 600, 601,
igr2= 609, 610,
&end
#
# 40 LYS QB 66 ASN HD21 5.17
&rst
ixpk= 0, nxpk= 0, iat= -1,1011, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
igr1= 600, 601,
&end
#
# 40 LYS QB 66 ASN HD22 3.96
&rst
ixpk= 0, nxpk= 0, iat= -1,1012, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
igr1= 600, 601,
&end
#
# 40 LYS QB 66 ASN QB 5.16
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
igr1= 600, 601,
igr2=1006,1007,
&end
#
# 40 LYS QG 40 LYS QE 3.07
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,
igr1= 603, 604,
igr2= 609, 610,
&end
#
# 40 LYS QG 63 SER HN 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, 964, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1= 603, 604,
&end
#
# 40 LYS QG 63 SER QB 3.82
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31,
igr1= 603, 604,
igr2= 968, 969,
&end
#
# 41 ILE HA 41 ILE HG12 4.03
&rst
ixpk= 0, nxpk= 0, iat= 620, 628, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53, &end
#
# 41 ILE HA 41 ILE HG13 4.03
&rst
ixpk= 0, nxpk= 0, iat= 620, 629, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53, &end
#
# 41 ILE HA 41 ILE QD1 3.93
&rst
ixpk= 0, nxpk= 0, iat= 620, -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
igr2= 631, 632, 633,
&end
#
# 41 ILE HA 41 ILE QG2 3.29
&rst
ixpk= 0, nxpk= 0, iat= 620, -1, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
igr2= 624, 625, 626,
&end
#
# 41 ILE HA 42 GLU HN 2.98
&rst
ixpk= 0, nxpk= 0, iat= 620, 637, r1= 1.30, r2= 1.80, r3= 2.98, r4= 3.48, &end
#
# 41 ILE HA 42 GLU QB 5.05
&rst
ixpk= 0, nxpk= 0, iat= 620, -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
igr2= 641, 642,
&end
#
# 41 ILE HA 61 LEU QD1 3.43
&rst
ixpk= 0, nxpk= 0, iat= 620, -1, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
igr2= 935, 936, 937,
&end
#
# 41 ILE HA 66 ASN QB 5.34
&rst
ixpk= 0, nxpk= 0, iat= 620, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2=1006,1007,
&end
#
# 41 ILE HB 41 ILE QD1 3.43
&rst
ixpk= 0, nxpk= 0, iat= 622, -1, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
igr2= 631, 632, 633,
&end
#
# 41 ILE HB 41 ILE QG1 2.65
&rst
ixpk= 0, nxpk= 0, iat= 622, -1, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47,
igr2= 628, 629,
&end
#
# 41 ILE HB 42 GLU HN 4.50
&rst
ixpk= 0, nxpk= 0, iat= 622, 637, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 41 ILE HB 66 ASN HB2 3.73
&rst
ixpk= 0, nxpk= 0, iat= 622,1006, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23, &end
#
# 41 ILE HB 66 ASN HB3 3.73
&rst
ixpk= 0, nxpk= 0, iat= 622,1007, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23, &end
#
# 41 ILE HB 66 ASN HD21 4.19
&rst
ixpk= 0, nxpk= 0, iat= 622,1011, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69, &end
#
# 41 ILE HB 66 ASN HD22 5.32
&rst
ixpk= 0, nxpk= 0, iat= 622,1012, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82, &end
#
# 41 ILE HB 66 ASN QB 3.27
&rst
ixpk= 0, nxpk= 0, iat= 622, -1, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,
igr2=1006,1007,
&end
#
# 41 ILE HN 41 ILE HB 3.74
&rst
ixpk= 0, nxpk= 0, iat= 618, 622, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24, &end
#
# 41 ILE HN 41 ILE HG12 4.32
&rst
ixpk= 0, nxpk= 0, iat= 618, 628, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82, &end
#
# 41 ILE HN 41 ILE HG13 4.32
&rst
ixpk= 0, nxpk= 0, iat= 618, 629, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82, &end
#
# 41 ILE HN 41 ILE QD1 3.91
&rst
ixpk= 0, nxpk= 0, iat= 618, -1, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
igr2= 631, 632, 633,
&end
#
# 41 ILE HN 41 ILE QG1 3.49
&rst
ixpk= 0, nxpk= 0, iat= 618, -1, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
igr2= 628, 629,
&end
#
# 41 ILE HN 41 ILE QG2 3.97
&rst
ixpk= 0, nxpk= 0, iat= 618, -1, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
igr2= 624, 625, 626,
&end
#
# 41 ILE HN 42 GLU HN 4.67
&rst
ixpk= 0, nxpk= 0, iat= 618, 637, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, &end
#
# 41 ILE HN 61 LEU QD1 3.91
&rst
ixpk= 0, nxpk= 0, iat= 618, -1, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
igr2= 935, 936, 937,
&end
#
# 41 ILE HN 61 LEU QD2 3.96
&rst
ixpk= 0, nxpk= 0, iat= 618, -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
igr2= 939, 940, 941,
&end
#
# 41 ILE HN 66 ASN HB2 4.79
&rst
ixpk= 0, nxpk= 0, iat= 618,1006, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29, &end
#
# 41 ILE HN 66 ASN HB3 4.79
&rst
ixpk= 0, nxpk= 0, iat= 618,1007, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29, &end
#
# 41 ILE HN 66 ASN HD21 4.87
&rst
ixpk= 0, nxpk= 0, iat= 618,1011, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37, &end
#
# 41 ILE HN 66 ASN HD22 5.09
&rst
ixpk= 0, nxpk= 0, iat= 618,1012, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59, &end
#
# 41 ILE HN 66 ASN QB 4.01
&rst
ixpk= 0, nxpk= 0, iat= 618, -1, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
igr2=1006,1007,
&end
#
# 41 ILE QD1 42 GLU HN 5.42
&rst
ixpk= 0, nxpk= 0, iat= -1, 637, r1= 1.30, r2= 1.80, r3= 6.51, r4= 7.01,
igr1= 631, 632, 633,
&end
#
# 41 ILE QD1 44 LEU QB 3.83
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
igr1= 631, 632, 633,
igr2= 663, 664,
&end
#
# 41 ILE QD1 44 LEU QD2 2.56
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19,
igr1= 631, 632, 633,
igr2= 672, 673, 674,
&end
#
# 41 ILE QD1 66 ASN HB2 4.32
&rst
ixpk= 0, nxpk= 0, iat= -1,1006, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
igr1= 631, 632, 633,
&end
#
# 41 ILE QD1 66 ASN HB3 4.32
&rst
ixpk= 0, nxpk= 0, iat= -1,1007, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
igr1= 631, 632, 633,
&end
#
# 41 ILE QD1 66 ASN HD21 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1011, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 631, 632, 633,
&end
#
# 41 ILE QD1 66 ASN QB 3.74
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr1= 631, 632, 633,
igr2=1006,1007,
&end
#
# 41 ILE QD1 67 LEU HA 3.74
&rst
ixpk= 0, nxpk= 0, iat= -1,1018, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
igr1= 631, 632, 633,
&end
#
# 41 ILE QD1 67 LEU HB2 5.08
&rst
ixpk= 0, nxpk= 0, iat= -1,1020, r1= 1.30, r2= 1.80, r3= 6.10, r4= 6.60,
igr1= 631, 632, 633,
&end
#
# 41 ILE QD1 67 LEU HB3 4.68
&rst
ixpk= 0, nxpk= 0, iat= -1,1021, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
igr1= 631, 632, 633,
&end
#
# 41 ILE QD1 67 LEU HG 3.37
&rst
ixpk= 0, nxpk= 0, iat= -1,1023, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,
igr1= 631, 632, 633,
&end
#
# 41 ILE QD1 67 LEU HN 4.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1016, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
igr1= 631, 632, 633,
&end
#
# 41 ILE QD1 68 PRO HD2 4.45
&rst
ixpk= 0, nxpk= 0, iat= -1,1036, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr1= 631, 632, 633,
&end
#
# 41 ILE QD1 68 PRO HD3 4.12
&rst
ixpk= 0, nxpk= 0, iat= -1,1037, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr1= 631, 632, 633,
&end
#
# 41 ILE QG1 42 GLU HN 4.65
&rst
ixpk= 0, nxpk= 0, iat= -1, 637, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
igr1= 628, 629,
&end
#
# 41 ILE QG1 61 LEU QD1 3.48
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,
igr1= 628, 629,
igr2= 935, 936, 937,
&end
#
# 41 ILE QG1 66 ASN HD21 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1,1011, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1= 628, 629,
&end
#
# 41 ILE QG2 41 ILE QG1 3.20
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,
igr1= 624, 625, 626,
igr2= 628, 629,
&end
#
# 41 ILE QG2 42 GLU HA 4.06
&rst
ixpk= 0, nxpk= 0, iat= -1, 639, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
igr1= 624, 625, 626,
&end
#
# 41 ILE QG2 42 GLU HN 3.31
&rst
ixpk= 0, nxpk= 0, iat= -1, 637, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,
igr1= 624, 625, 626,
&end
#
# 41 ILE QG2 42 GLU QB 5.17
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.97, r4= 7.47,
igr1= 624, 625, 626,
igr2= 641, 642,
&end
#
# 41 ILE QG2 43 GLY HA3 4.61
&rst
ixpk= 0, nxpk= 0, iat= -1, 655, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
igr1= 624, 625, 626,
&end
#
# 41 ILE QG2 44 LEU HA 4.68
&rst
ixpk= 0, nxpk= 0, iat= -1, 661, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
igr1= 624, 625, 626,
&end
#
# 41 ILE QG2 44 LEU HB2 3.40
&rst
ixpk= 0, nxpk= 0, iat= -1, 663, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,
igr1= 624, 625, 626,
&end
#
# 41 ILE QG2 44 LEU HB3 3.40
&rst
ixpk= 0, nxpk= 0, iat= -1, 664, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,
igr1= 624, 625, 626,
&end
#
# 41 ILE QG2 44 LEU HN 3.53
&rst
ixpk= 0, nxpk= 0, iat= -1, 659, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
igr1= 624, 625, 626,
&end
#
# 41 ILE QG2 44 LEU QD2 3.30
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
igr1= 624, 625, 626,
igr2= 672, 673, 674,
&end
#
# 41 ILE QG2 66 ASN HB2 4.74
&rst
ixpk= 0, nxpk= 0, iat= -1,1006, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
igr1= 624, 625, 626,
&end
#
# 41 ILE QG2 66 ASN HB3 4.74
&rst
ixpk= 0, nxpk= 0, iat= -1,1007, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
igr1= 624, 625, 626,
&end
#
# 41 ILE QG2 66 ASN HD21 4.75
&rst
ixpk= 0, nxpk= 0, iat= -1,1011, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr1= 624, 625, 626,
&end
#
# 41 ILE QG2 66 ASN HD22 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1012, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 624, 625, 626,
&end
#
# 41 ILE QG2 66 ASN QB 3.89
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr1= 624, 625, 626,
igr2=1006,1007,
&end
#
# 41 ILE QG2 67 LEU HA 4.80
&rst
ixpk= 0, nxpk= 0, iat= -1,1018, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
igr1= 624, 625, 626,
&end
#
# 41 ILE QG2 68 PRO HD2 4.28
&rst
ixpk= 0, nxpk= 0, iat= -1,1036, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
igr1= 624, 625, 626,
&end
#
# 41 ILE QG2 68 PRO HD3 4.56
&rst
ixpk= 0, nxpk= 0, iat= -1,1037, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
igr1= 624, 625, 626,
&end
#
# 41 ILE QG2 68 PRO QB 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.20, r4= 7.70,
igr1= 624, 625, 626,
igr2=1042,1043,
&end
#
# 42 GLU HA 42 GLU QG 3.44
&rst
ixpk= 0, nxpk= 0, iat= 639, -1, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,
igr2= 644, 645,
&end
#
# 42 GLU HA 43 GLY HN 3.57
&rst
ixpk= 0, nxpk= 0, iat= 639, 652, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07, &end
#
# 42 GLU HA 66 ASN HD21 4.81
&rst
ixpk= 0, nxpk= 0, iat= 639,1011, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31, &end
#
# 42 GLU HA 66 ASN HD22 4.93
&rst
ixpk= 0, nxpk= 0, iat= 639,1012, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43, &end
#
# 42 GLU HB2 43 GLY HN 4.57
&rst
ixpk= 0, nxpk= 0, iat= 641, 652, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07, &end
#
# 42 GLU HB3 43 GLY HN 4.57
&rst
ixpk= 0, nxpk= 0, iat= 642, 652, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07, &end
#
# 42 GLU HN 42 GLU HB2 4.03
&rst
ixpk= 0, nxpk= 0, iat= 637, 641, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53, &end
#
# 42 GLU HN 42 GLU HB3 4.03
&rst
ixpk= 0, nxpk= 0, iat= 637, 642, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53, &end
#
# 42 GLU HN 42 GLU QB 3.37
&rst
ixpk= 0, nxpk= 0, iat= 637, -1, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,
igr2= 641, 642,
&end
#
# 42 GLU QG 43 GLY HN 4.62
&rst
ixpk= 0, nxpk= 0, iat= -1, 652, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
igr1= 644, 645,
&end
#
# 43 GLY HA2 45 THR QG2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 654, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2= 684, 685, 686,
&end
#
# 43 GLY HA3 44 LEU QB 5.11
&rst
ixpk= 0, nxpk= 0, iat= 655, -1, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
igr2= 663, 664,
&end
#
# 43 GLY HA3 44 LEU QD1 5.21
&rst
ixpk= 0, nxpk= 0, iat= 655, -1, r1= 1.30, r2= 1.80, r3= 6.26, r4= 6.76,
igr2= 668, 669, 670,
&end
#
# 43 GLY HN 44 LEU HN 3.53
&rst
ixpk= 0, nxpk= 0, iat= 652, 659, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03, &end
#
# 44 LEU HA 44 LEU HG 4.17
&rst
ixpk= 0, nxpk= 0, iat= 661, 666, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67, &end
#
# 44 LEU HA 44 LEU QD1 3.42
&rst
ixpk= 0, nxpk= 0, iat= 661, -1, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
igr2= 668, 669, 670,
&end
#
# 44 LEU HA 44 LEU QD2 3.93
&rst
ixpk= 0, nxpk= 0, iat= 661, -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
igr2= 672, 673, 674,
&end
#
# 44 LEU HA 45 THR HN 2.96
&rst
ixpk= 0, nxpk= 0, iat= 661, 678, r1= 1.30, r2= 1.80, r3= 2.96, r4= 3.46, &end
#
# 44 LEU HA 45 THR QG2 3.78
&rst
ixpk= 0, nxpk= 0, iat= 661, -1, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
igr2= 684, 685, 686,
&end
#
# 44 LEU HA 48 PHE QD 4.30
&rst
ixpk= 0, nxpk= 0, iat= 661, -1, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
igr2= 725, 733,
&end
#
# 44 LEU HA 48 PHE QE 3.95
&rst
ixpk= 0, nxpk= 0, iat= 661, -1, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
igr2= 727, 731,
&end
#
# 44 LEU HB2 44 LEU QD2 3.81
&rst
ixpk= 0, nxpk= 0, iat= 663, -1, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
igr2= 672, 673, 674,
&end
#
# 44 LEU HB2 68 PRO HD2 4.96
&rst
ixpk= 0, nxpk= 0, iat= 663,1036, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46, &end
#
# 44 LEU HB2 68 PRO HD3 4.72
&rst
ixpk= 0, nxpk= 0, iat= 663,1037, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22, &end
#
# 44 LEU HB3 44 LEU QD2 3.81
&rst
ixpk= 0, nxpk= 0, iat= 664, -1, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
igr2= 672, 673, 674,
&end
#
# 44 LEU HB3 68 PRO HD2 4.96
&rst
ixpk= 0, nxpk= 0, iat= 664,1036, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46, &end
#
# 44 LEU HB3 68 PRO HD3 4.72
&rst
ixpk= 0, nxpk= 0, iat= 664,1037, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22, &end
#
# 44 LEU HG 45 THR HN 4.39
&rst
ixpk= 0, nxpk= 0, iat= 666, 678, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89, &end
#
# 44 LEU HG 48 PHE QD 4.23
&rst
ixpk= 0, nxpk= 0, iat= 666, -1, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25,
igr2= 725, 733,
&end
#
# 44 LEU HG 48 PHE QE 4.44
&rst
ixpk= 0, nxpk= 0, iat= 666, -1, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
igr2= 727, 731,
&end
#
# 44 LEU HG 68 PRO HD2 4.68
&rst
ixpk= 0, nxpk= 0, iat= 666,1036, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18, &end
#
# 44 LEU HG 68 PRO HD3 4.80
&rst
ixpk= 0, nxpk= 0, iat= 666,1037, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30, &end
#
# 44 LEU HG 68 PRO HG2 3.71
&rst
ixpk= 0, nxpk= 0, iat= 666,1039, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21, &end
#
# 44 LEU HG 68 PRO HG3 4.15
&rst
ixpk= 0, nxpk= 0, iat= 666,1040, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65, &end
#
# 44 LEU HN 44 LEU HB2 3.30
&rst
ixpk= 0, nxpk= 0, iat= 659, 663, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80, &end
#
# 44 LEU HN 44 LEU HB3 3.30
&rst
ixpk= 0, nxpk= 0, iat= 659, 664, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80, &end
#
# 44 LEU HN 44 LEU HG 4.58
&rst
ixpk= 0, nxpk= 0, iat= 659, 666, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08, &end
#
# 44 LEU HN 44 LEU QD1 3.95
&rst
ixpk= 0, nxpk= 0, iat= 659, -1, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr2= 668, 669, 670,
&end
#
# 44 LEU QB 44 LEU QD1 3.29
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
igr1= 663, 664,
igr2= 668, 669, 670,
&end
#
# 44 LEU QB 44 LEU QD2 3.08
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65,
igr1= 663, 664,
igr2= 672, 673, 674,
&end
#
# 44 LEU QB 45 THR HN 4.03
&rst
ixpk= 0, nxpk= 0, iat= -1, 678, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
igr1= 663, 664,
&end
#
# 44 LEU QB 67 LEU HA 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1,1018, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1= 663, 664,
&end
#
# 44 LEU QB 68 PRO HD2 4.21
&rst
ixpk= 0, nxpk= 0, iat= -1,1036, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
igr1= 663, 664,
&end
#
# 44 LEU QB 68 PRO HD3 4.09
&rst
ixpk= 0, nxpk= 0, iat= -1,1037, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
igr1= 663, 664,
&end
#
# 44 LEU QB 68 PRO HG3 4.29
&rst
ixpk= 0, nxpk= 0, iat= -1,1040, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
igr1= 663, 664,
&end
#
# 44 LEU QD1 45 THR HN 3.78
&rst
ixpk= 0, nxpk= 0, iat= -1, 678, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
igr1= 668, 669, 670,
&end
#
# 44 LEU QD1 45 THR QG2 4.84
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.98, r4= 7.48,
igr1= 668, 669, 670,
igr2= 684, 685, 686,
&end
#
# 44 LEU QD1 48 PHE HB2 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 721, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 668, 669, 670,
&end
#
# 44 LEU QD1 48 PHE QD 4.13
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
igr1= 668, 669, 670,
igr2= 725, 733,
&end
#
# 44 LEU QD1 48 PHE QE 4.25
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23,
igr1= 668, 669, 670,
igr2= 727, 731,
&end
#
# 44 LEU QD1 54 LEU QD1 2.63
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,
igr1= 668, 669, 670,
igr2= 830, 831, 832,
&end
#
# 44 LEU QD1 54 LEU QD2 3.03
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
igr1= 668, 669, 670,
igr2= 834, 835, 836,
&end
#
# 44 LEU QD1 68 PRO HD2 4.61
&rst
ixpk= 0, nxpk= 0, iat= -1,1036, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
igr1= 668, 669, 670,
&end
#
# 44 LEU QD1 68 PRO HD3 5.04
&rst
ixpk= 0, nxpk= 0, iat= -1,1037, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
igr1= 668, 669, 670,
&end
#
# 44 LEU QD1 68 PRO HG2 4.83
&rst
ixpk= 0, nxpk= 0, iat= -1,1039, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
igr1= 668, 669, 670,
&end
#
# 44 LEU QD1 68 PRO HG3 5.06
&rst
ixpk= 0, nxpk= 0, iat= -1,1040, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
igr1= 668, 669, 670,
&end
#
# 44 LEU QD2 45 THR HN 4.75
&rst
ixpk= 0, nxpk= 0, iat= -1, 678, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr1= 672, 673, 674,
&end
#
# 44 LEU QD2 48 PHE HB2 5.04
&rst
ixpk= 0, nxpk= 0, iat= -1, 721, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
igr1= 672, 673, 674,
&end
#
# 44 LEU QD2 48 PHE HB3 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 722, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 672, 673, 674,
&end
#
# 44 LEU QD2 48 PHE QD 4.14
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr1= 672, 673, 674,
igr2= 725, 733,
&end
#
# 44 LEU QD2 48 PHE QE 4.71
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
igr1= 672, 673, 674,
igr2= 727, 731,
&end
#
# 44 LEU QD2 67 LEU HA 4.42
&rst
ixpk= 0, nxpk= 0, iat= -1,1018, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
igr1= 672, 673, 674,
&end
#
# 44 LEU QD2 67 LEU HG 4.76
&rst
ixpk= 0, nxpk= 0, iat= -1,1023, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
igr1= 672, 673, 674,
&end
#
# 44 LEU QD2 68 PRO HD2 4.46
&rst
ixpk= 0, nxpk= 0, iat= -1,1036, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
igr1= 672, 673, 674,
&end
#
# 44 LEU QD2 68 PRO HD3 4.42
&rst
ixpk= 0, nxpk= 0, iat= -1,1037, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
igr1= 672, 673, 674,
&end
#
# 44 LEU QD2 68 PRO HG2 4.14
&rst
ixpk= 0, nxpk= 0, iat= -1,1039, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
igr1= 672, 673, 674,
&end
#
# 44 LEU QD2 68 PRO HG3 4.26
&rst
ixpk= 0, nxpk= 0, iat= -1,1040, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
igr1= 672, 673, 674,
&end
#
# 45 THR HA 46 ALA HN 3.37
&rst
ixpk= 0, nxpk= 0, iat= 680, 692, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87, &end
#
# 45 THR HB 46 ALA HN 4.47
&rst
ixpk= 0, nxpk= 0, iat= 682, 692, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97, &end
#
# 45 THR HG1 47 GLU HN 4.33
&rst
ixpk= 0, nxpk= 0, iat= 688, 702, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83, &end
#
# 45 THR HN 45 THR QG2 3.29
&rst
ixpk= 0, nxpk= 0, iat= 678, -1, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
igr2= 684, 685, 686,
&end
#
# 45 THR HN 47 GLU HN 4.71
&rst
ixpk= 0, nxpk= 0, iat= 678, 702, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21, &end
#
# 45 THR HN 48 PHE QD 3.40
&rst
ixpk= 0, nxpk= 0, iat= 678, -1, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,
igr2= 725, 733,
&end
#
# 45 THR HN 48 PHE QE 3.74
&rst
ixpk= 0, nxpk= 0, iat= 678, -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
igr2= 727, 731,
&end
#
# 45 THR HN 68 PRO HG3 4.22
&rst
ixpk= 0, nxpk= 0, iat= 678,1040, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 45 THR QG2 45 THR HG1 3.77
&rst
ixpk= 0, nxpk= 0, iat= -1, 688, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
igr1= 684, 685, 686,
&end
#
# 45 THR QG2 46 ALA HN 3.77
&rst
ixpk= 0, nxpk= 0, iat= -1, 692, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
igr1= 684, 685, 686,
&end
#
# 45 THR QG2 46 ALA QB 4.67
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
igr1= 684, 685, 686,
igr2= 696, 697, 698,
&end
#
# 45 THR QG2 47 GLU HA 4.57
&rst
ixpk= 0, nxpk= 0, iat= -1, 704, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
igr1= 684, 685, 686,
&end
#
# 45 THR QG2 47 GLU HN 4.14
&rst
ixpk= 0, nxpk= 0, iat= -1, 702, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
igr1= 684, 685, 686,
&end
#
# 45 THR QG2 47 GLU QB 3.68
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
igr1= 684, 685, 686,
igr2= 706, 707,
&end
#
# 45 THR QG2 47 GLU QG 4.32
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32,
igr1= 684, 685, 686,
igr2= 709, 710,
&end
#
# 45 THR QG2 48 PHE HN 4.84
&rst
ixpk= 0, nxpk= 0, iat= -1, 717, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
igr1= 684, 685, 686,
&end
#
# 45 THR QG2 48 PHE QD 4.32
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32,
igr1= 684, 685, 686,
igr2= 725, 733,
&end
#
# 45 THR QG2 48 PHE QE 4.11
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
igr1= 684, 685, 686,
igr2= 727, 731,
&end
#
# 45 THR QG2 68 PRO QB 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.20, r4= 7.70,
igr1= 684, 685, 686,
igr2=1042,1043,
&end
#
# 46 ALA HA 49 VAL QG1 4.04
&rst
ixpk= 0, nxpk= 0, iat= 694, -1, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
igr2= 743, 744, 745,
&end
#
# 46 ALA HA 68 PRO HB2 4.06
&rst
ixpk= 0, nxpk= 0, iat= 694,1042, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56, &end
#
# 46 ALA HA 68 PRO HB3 4.06
&rst
ixpk= 0, nxpk= 0, iat= 694,1043, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56, &end
#
# 46 ALA HA 68 PRO QB 3.30
&rst
ixpk= 0, nxpk= 0, iat= 694, -1, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,
igr2=1042,1043,
&end
#
# 46 ALA HA 69 LYS HN 4.64
&rst
ixpk= 0, nxpk= 0, iat= 694,1049, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14, &end
#
# 46 ALA HA 70 LEU QD2 3.87
&rst
ixpk= 0, nxpk= 0, iat= 694, -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
igr2=1084,1085,1086,
&end
#
# 46 ALA HN 46 ALA QB 3.06
&rst
ixpk= 0, nxpk= 0, iat= 692, -1, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,
igr2= 696, 697, 698,
&end
#
# 46 ALA HN 47 GLU HN 4.07
&rst
ixpk= 0, nxpk= 0, iat= 692, 702, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57, &end
#
# 46 ALA HN 68 PRO QB 4.59
&rst
ixpk= 0, nxpk= 0, iat= 692, -1, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
igr2=1042,1043,
&end
#
# 46 ALA QB 47 GLU HA 4.17
&rst
ixpk= 0, nxpk= 0, iat= -1, 704, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
igr1= 696, 697, 698,
&end
#
# 46 ALA QB 47 GLU HN 3.58
&rst
ixpk= 0, nxpk= 0, iat= -1, 702, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
igr1= 696, 697, 698,
&end
#
# 46 ALA QB 47 GLU QG 4.36
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
igr1= 696, 697, 698,
igr2= 709, 710,
&end
#
# 46 ALA QB 48 PHE HN 4.38
&rst
ixpk= 0, nxpk= 0, iat= -1, 717, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr1= 696, 697, 698,
&end
#
# 46 ALA QB 49 VAL HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 739, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 696, 697, 698,
&end
#
# 46 ALA QB 49 VAL QG1 4.05
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
igr1= 696, 697, 698,
igr2= 743, 744, 745,
&end
#
# 46 ALA QB 68 PRO QB 3.62
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
igr1= 696, 697, 698,
igr2=1042,1043,
&end
#
# 46 ALA QB 69 LYS HB3 3.99
&rst
ixpk= 0, nxpk= 0, iat= -1,1054, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
igr1= 696, 697, 698,
&end
#
# 46 ALA QB 69 LYS HN 3.68
&rst
ixpk= 0, nxpk= 0, iat= -1,1049, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
igr1= 696, 697, 698,
&end
#
# 46 ALA QB 70 LEU QD2 4.17
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51,
igr1= 696, 697, 698,
igr2=1084,1085,1086,
&end
#
# 47 GLU HA 47 GLU HG2 3.81
&rst
ixpk= 0, nxpk= 0, iat= 704, 709, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31, &end
#
# 47 GLU HA 47 GLU HG3 3.81
&rst
ixpk= 0, nxpk= 0, iat= 704, 710, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31, &end
#
# 47 GLU HA 47 GLU QG 3.12
&rst
ixpk= 0, nxpk= 0, iat= 704, -1, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,
igr2= 709, 710,
&end
#
# 47 GLU HA 49 VAL HN 3.87
&rst
ixpk= 0, nxpk= 0, iat= 704, 737, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37, &end
#
# 47 GLU HA 49 VAL QG1 3.50
&rst
ixpk= 0, nxpk= 0, iat= 704, -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
igr2= 743, 744, 745,
&end
#
# 47 GLU HA 49 VAL QG2 3.94
&rst
ixpk= 0, nxpk= 0, iat= 704, -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
igr2= 747, 748, 749,
&end
#
# 47 GLU HN 47 GLU HB2 3.83
&rst
ixpk= 0, nxpk= 0, iat= 702, 706, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33, &end
#
# 47 GLU HN 47 GLU HB3 3.83
&rst
ixpk= 0, nxpk= 0, iat= 702, 707, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33, &end
#
# 47 GLU HN 47 GLU HG2 3.77
&rst
ixpk= 0, nxpk= 0, iat= 702, 709, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27, &end
#
# 47 GLU HN 47 GLU HG3 3.77
&rst
ixpk= 0, nxpk= 0, iat= 702, 710, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27, &end
#
# 47 GLU HN 47 GLU QG 3.16
&rst
ixpk= 0, nxpk= 0, iat= 702, -1, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05,
igr2= 709, 710,
&end
#
# 47 GLU HN 48 PHE HB2 4.90
&rst
ixpk= 0, nxpk= 0, iat= 702, 721, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40, &end
#
# 47 GLU HN 48 PHE HN 3.48
&rst
ixpk= 0, nxpk= 0, iat= 702, 717, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98, &end
#
# 47 GLU HN 48 PHE QD 4.97
&rst
ixpk= 0, nxpk= 0, iat= 702, -1, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr2= 725, 733,
&end
#
# 47 GLU HN 70 LEU QD2 5.30
&rst
ixpk= 0, nxpk= 0, iat= 702, -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
igr2=1084,1085,1086,
&end
#
# 47 GLU QB 48 PHE HA 4.74
&rst
ixpk= 0, nxpk= 0, iat= -1, 719, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
igr1= 706, 707,
&end
#
# 47 GLU QB 48 PHE HN 4.01
&rst
ixpk= 0, nxpk= 0, iat= -1, 717, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
igr1= 706, 707,
&end
#
# 47 GLU QG 48 PHE HN 4.61
&rst
ixpk= 0, nxpk= 0, iat= -1, 717, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67,
igr1= 709, 710,
&end
#
# 48 PHE HA 48 PHE QD 3.60
&rst
ixpk= 0, nxpk= 0, iat= 719, -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
igr2= 725, 733,
&end
#
# 48 PHE HA 49 VAL HN 3.36
&rst
ixpk= 0, nxpk= 0, iat= 719, 737, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86, &end
#
# 48 PHE HA 49 VAL QG2 4.25
&rst
ixpk= 0, nxpk= 0, iat= 719, -1, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
igr2= 747, 748, 749,
&end
#
# 48 PHE HA 50 ASN HN 4.37
&rst
ixpk= 0, nxpk= 0, iat= 719, 753, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87, &end
#
# 48 PHE HA 51 LEU HB2 4.65
&rst
ixpk= 0, nxpk= 0, iat= 719, 771, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15, &end
#
# 48 PHE HA 51 LEU QD1 4.98
&rst
ixpk= 0, nxpk= 0, iat= 719, -1, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
igr2= 776, 777, 778,
&end
#
# 48 PHE HA 51 LEU QD2 5.31
&rst
ixpk= 0, nxpk= 0, iat= 719, -1, r1= 1.30, r2= 1.80, r3= 6.38, r4= 6.88,
igr2= 780, 781, 782,
&end
#
# 48 PHE HA 70 LEU QD2 4.21
&rst
ixpk= 0, nxpk= 0, iat= 719, -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
igr2=1084,1085,1086,
&end
#
# 48 PHE HB2 49 VAL HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= 721, 739, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 48 PHE HB2 51 LEU HB2 4.40
&rst
ixpk= 0, nxpk= 0, iat= 721, 771, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 48 PHE HB2 51 LEU HB3 4.73
&rst
ixpk= 0, nxpk= 0, iat= 721, 772, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, &end
#
# 48 PHE HB2 51 LEU QD2 4.02
&rst
ixpk= 0, nxpk= 0, iat= 721, -1, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
igr2= 780, 781, 782,
&end
#
# 48 PHE HB2 70 LEU QD2 3.71
&rst
ixpk= 0, nxpk= 0, iat= 721, -1, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
igr2=1084,1085,1086,
&end
#
# 48 PHE HB3 49 VAL HN 4.84
&rst
ixpk= 0, nxpk= 0, iat= 722, 737, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34, &end
#
# 48 PHE HB3 51 LEU HA 5.29
&rst
ixpk= 0, nxpk= 0, iat= 722, 769, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79, &end
#
# 48 PHE HB3 51 LEU HB2 4.32
&rst
ixpk= 0, nxpk= 0, iat= 722, 771, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82, &end
#
# 48 PHE HB3 51 LEU HB3 4.09
&rst
ixpk= 0, nxpk= 0, iat= 722, 772, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59, &end
#
# 48 PHE HB3 51 LEU HN 4.53
&rst
ixpk= 0, nxpk= 0, iat= 722, 767, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03, &end
#
# 48 PHE HB3 51 LEU QD1 4.33
&rst
ixpk= 0, nxpk= 0, iat= 722, -1, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
igr2= 776, 777, 778,
&end
#
# 48 PHE HB3 51 LEU QD2 3.85
&rst
ixpk= 0, nxpk= 0, iat= 722, -1, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
igr2= 780, 781, 782,
&end
#
# 48 PHE HB3 70 LEU QD2 4.07
&rst
ixpk= 0, nxpk= 0, iat= 722, -1, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
igr2=1084,1085,1086,
&end
#
# 48 PHE HN 48 PHE HB2 3.34
&rst
ixpk= 0, nxpk= 0, iat= 717, 721, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84, &end
#
# 48 PHE HN 48 PHE HB3 3.66
&rst
ixpk= 0, nxpk= 0, iat= 717, 722, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16, &end
#
# 48 PHE HN 48 PHE QD 3.33
&rst
ixpk= 0, nxpk= 0, iat= 717, -1, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24,
igr2= 725, 733,
&end
#
# 48 PHE HN 49 VAL HN 4.29
&rst
ixpk= 0, nxpk= 0, iat= 717, 737, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79, &end
#
# 48 PHE HN 49 VAL QG1 4.50
&rst
ixpk= 0, nxpk= 0, iat= 717, -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr2= 743, 744, 745,
&end
#
# 48 PHE HN 70 LEU QD2 3.72
&rst
ixpk= 0, nxpk= 0, iat= 717, -1, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
igr2=1084,1085,1086,
&end
#
# 48 PHE QD 51 LEU HB2 3.99
&rst
ixpk= 0, nxpk= 0, iat= -1, 771, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
igr1= 725, 733,
&end
#
# 48 PHE QD 51 LEU HB3 4.44
&rst
ixpk= 0, nxpk= 0, iat= -1, 772, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
igr1= 725, 733,
&end
#
# 48 PHE QD 51 LEU QD1 3.85
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
igr1= 725, 733,
igr2= 776, 777, 778,
&end
#
# 48 PHE QD 51 LEU QD2 3.91
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77,
igr1= 725, 733,
igr2= 780, 781, 782,
&end
#
# 48 PHE QE 51 LEU QD2 3.86
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
igr1= 727, 731,
igr2= 780, 781, 782,
&end
#
# 49 VAL HA 49 VAL QG1 2.96
&rst
ixpk= 0, nxpk= 0, iat= 739, -1, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05,
igr2= 743, 744, 745,
&end
#
# 49 VAL HA 49 VAL QG2 3.42
&rst
ixpk= 0, nxpk= 0, iat= 739, -1, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
igr2= 747, 748, 749,
&end
#
# 49 VAL HA 51 LEU HN 4.94
&rst
ixpk= 0, nxpk= 0, iat= 739, 767, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44, &end
#
# 49 VAL HB 50 ASN HN 4.69
&rst
ixpk= 0, nxpk= 0, iat= 741, 753, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, &end
#
# 49 VAL HN 49 VAL HB 3.76
&rst
ixpk= 0, nxpk= 0, iat= 737, 741, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26, &end
#
# 49 VAL HN 49 VAL QG1 3.02
&rst
ixpk= 0, nxpk= 0, iat= 737, -1, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13,
igr2= 743, 744, 745,
&end
#
# 49 VAL HN 49 VAL QG2 2.97
&rst
ixpk= 0, nxpk= 0, iat= 737, -1, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07,
igr2= 747, 748, 749,
&end
#
# 49 VAL HN 50 ASN HN 3.82
&rst
ixpk= 0, nxpk= 0, iat= 737, 753, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32, &end
#
# 49 VAL HN 51 LEU HN 4.83
&rst
ixpk= 0, nxpk= 0, iat= 737, 767, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33, &end
#
# 49 VAL QG1 50 ASN HN 4.23
&rst
ixpk= 0, nxpk= 0, iat= -1, 753, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
igr1= 743, 744, 745,
&end
#
# 49 VAL QG1 50 ASN QD2 4.78
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,
igr1= 743, 744, 745,
igr2= 762, 763,
&end
#
# 49 VAL QG1 69 LYS QG 4.98
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.71, r4= 7.21,
igr1= 743, 744, 745,
igr2=1056,1057,
&end
#
# 49 VAL QG1 71 PRO HD3 4.48
&rst
ixpk= 0, nxpk= 0, iat= -1,1092, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
igr1= 743, 744, 745,
&end
#
# 49 VAL QG1 71 PRO HG2 4.51
&rst
ixpk= 0, nxpk= 0, iat= -1,1094, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr1= 743, 744, 745,
&end
#
# 49 VAL QG1 71 PRO HG3 4.67
&rst
ixpk= 0, nxpk= 0, iat= -1,1095, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr1= 743, 744, 745,
&end
#
# 49 VAL QG2 50 ASN HA 4.51
&rst
ixpk= 0, nxpk= 0, iat= -1, 755, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr1= 747, 748, 749,
&end
#
# 49 VAL QG2 50 ASN HB2 4.73
&rst
ixpk= 0, nxpk= 0, iat= -1, 757, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
igr1= 747, 748, 749,
&end
#
# 49 VAL QG2 50 ASN HB3 4.73
&rst
ixpk= 0, nxpk= 0, iat= -1, 758, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
igr1= 747, 748, 749,
&end
#
# 49 VAL QG2 50 ASN HD21 3.71
&rst
ixpk= 0, nxpk= 0, iat= -1, 762, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
igr1= 747, 748, 749,
&end
#
# 49 VAL QG2 50 ASN HD22 3.71
&rst
ixpk= 0, nxpk= 0, iat= -1, 763, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
igr1= 747, 748, 749,
&end
#
# 49 VAL QG2 50 ASN HN 3.63
&rst
ixpk= 0, nxpk= 0, iat= -1, 753, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,
igr1= 747, 748, 749,
&end
#
# 49 VAL QG2 50 ASN QB 4.02
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr1= 747, 748, 749,
igr2= 757, 758,
&end
#
# 50 ASN HA 50 ASN QD2 4.93
&rst
ixpk= 0, nxpk= 0, iat= 755, -1, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03,
igr2= 762, 763,
&end
#
# 50 ASN HA 72 LYS HB2 4.31
&rst
ixpk= 0, nxpk= 0, iat= 755,1108, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81, &end
#
# 50 ASN HA 72 LYS HG2 4.91
&rst
ixpk= 0, nxpk= 0, iat= 755,1111, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41, &end
#
# 50 ASN HA 72 LYS HG3 4.04
&rst
ixpk= 0, nxpk= 0, iat= 755,1112, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, &end
#
# 50 ASN HA 72 LYS QD 3.32
&rst
ixpk= 0, nxpk= 0, iat= 755, -1, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23,
igr2=1114,1115,
&end
#
# 50 ASN HA 72 LYS QE 4.73
&rst
ixpk= 0, nxpk= 0, iat= 755, -1, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
igr2=1117,1118,
&end
#
# 50 ASN HB2 51 LEU HN 4.65
&rst
ixpk= 0, nxpk= 0, iat= 757, 767, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15, &end
#
# 50 ASN HB3 51 LEU HN 4.65
&rst
ixpk= 0, nxpk= 0, iat= 758, 767, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15, &end
#
# 50 ASN HN 50 ASN HB2 3.91
&rst
ixpk= 0, nxpk= 0, iat= 753, 757, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41, &end
#
# 50 ASN HN 50 ASN HB3 3.91
&rst
ixpk= 0, nxpk= 0, iat= 753, 758, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41, &end
#
# 50 ASN HN 50 ASN QB 3.43
&rst
ixpk= 0, nxpk= 0, iat= 753, -1, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35,
igr2= 757, 758,
&end
#
# 50 ASN HN 51 LEU HB2 4.79
&rst
ixpk= 0, nxpk= 0, iat= 753, 771, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29, &end
#
# 50 ASN HN 51 LEU HN 3.32
&rst
ixpk= 0, nxpk= 0, iat= 753, 767, r1= 1.30, r2= 1.80, r3= 3.32, r4= 3.82, &end
#
# 50 ASN HN 51 LEU QD1 5.50
&rst
ixpk= 0, nxpk= 0, iat= 753, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2= 776, 777, 778,
&end
#
# 50 ASN HN 72 LYS QD 4.56
&rst
ixpk= 0, nxpk= 0, iat= 753, -1, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
igr2=1114,1115,
&end
#
# 50 ASN QB 50 ASN QD2 3.01
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,
igr1= 757, 758,
igr2= 762, 763,
&end
#
# 51 LEU HA 51 LEU HN 2.70
&rst
ixpk= 0, nxpk= 0, iat= 769, 767, r1= 1.30, r2= 1.80, r3= 2.70, r4= 3.20, &end
#
# 51 LEU HA 51 LEU QD1 3.26
&rst
ixpk= 0, nxpk= 0, iat= 769, -1, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
igr2= 776, 777, 778,
&end
#
# 51 LEU HA 52 GLU HG2 4.50
&rst
ixpk= 0, nxpk= 0, iat= 769, 793, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 51 LEU HA 52 GLU HN 3.50
&rst
ixpk= 0, nxpk= 0, iat= 769, 786, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 51 LEU HA 53 PHE HN 3.92
&rst
ixpk= 0, nxpk= 0, iat= 769, 801, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42, &end
#
# 51 LEU HB3 51 LEU QD2 2.79
&rst
ixpk= 0, nxpk= 0, iat= 772, -1, r1= 1.30, r2= 1.80, r3= 3.35, r4= 3.85,
igr2= 780, 781, 782,
&end
#
# 51 LEU HB3 52 GLU HN 4.56
&rst
ixpk= 0, nxpk= 0, iat= 772, 786, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06, &end
#
# 51 LEU HB3 53 PHE HN 4.76
&rst
ixpk= 0, nxpk= 0, iat= 772, 801, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26, &end
#
# 51 LEU HN 51 LEU HB2 3.57
&rst
ixpk= 0, nxpk= 0, iat= 767, 771, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07, &end
#
# 51 LEU HN 51 LEU HB3 3.98
&rst
ixpk= 0, nxpk= 0, iat= 767, 772, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48, &end
#
# 51 LEU HN 51 LEU QD1 3.89
&rst
ixpk= 0, nxpk= 0, iat= 767, -1, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
igr2= 776, 777, 778,
&end
#
# 51 LEU HN 51 LEU QD2 4.33
&rst
ixpk= 0, nxpk= 0, iat= 767, -1, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
igr2= 780, 781, 782,
&end
#
# 51 LEU HN 72 LYS QD 5.34
&rst
ixpk= 0, nxpk= 0, iat= 767, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2=1114,1115,
&end
#
# 51 LEU QD1 52 GLU HN 3.66
&rst
ixpk= 0, nxpk= 0, iat= -1, 786, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,
igr1= 776, 777, 778,
&end
#
# 51 LEU QD1 53 PHE HB3 4.62
&rst
ixpk= 0, nxpk= 0, iat= -1, 806, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,
igr1= 776, 777, 778,
&end
#
# 51 LEU QD2 54 LEU HA 4.26
&rst
ixpk= 0, nxpk= 0, iat= -1, 823, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
igr1= 780, 781, 782,
&end
#
# 51 LEU QD2 55 SER HN 5.12
&rst
ixpk= 0, nxpk= 0, iat= -1, 840, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
igr1= 780, 781, 782,
&end
#
# 52 GLU HA 52 GLU HG2 4.12
&rst
ixpk= 0, nxpk= 0, iat= 788, 793, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62, &end
#
# 52 GLU HA 52 GLU HG3 4.01
&rst
ixpk= 0, nxpk= 0, iat= 788, 794, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51, &end
#
# 52 GLU HA 73 LEU HA 3.60
&rst
ixpk= 0, nxpk= 0, iat= 788,1128, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10, &end
#
# 52 GLU HA 73 LEU HN 4.42
&rst
ixpk= 0, nxpk= 0, iat= 788,1126, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92, &end
#
# 52 GLU HA 73 LEU QD1 3.57
&rst
ixpk= 0, nxpk= 0, iat= 788, -1, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,
igr2=1135,1136,1137,
&end
#
# 52 GLU HA 74 LYS HN 4.10
&rst
ixpk= 0, nxpk= 0, iat= 788,1145, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60, &end
#
# 52 GLU HA 74 LYS QG 5.34
&rst
ixpk= 0, nxpk= 0, iat= 788, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2=1152,1153,
&end
#
# 52 GLU HA 75 LYS HN 5.12
&rst
ixpk= 0, nxpk= 0, iat= 788,1167, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, &end
#
# 52 GLU HB2 53 PHE HB2 4.46
&rst
ixpk= 0, nxpk= 0, iat= 790, 805, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, &end
#
# 52 GLU HB2 53 PHE HB3 5.25
&rst
ixpk= 0, nxpk= 0, iat= 790, 806, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75, &end
#
# 52 GLU HB2 53 PHE HN 3.75
&rst
ixpk= 0, nxpk= 0, iat= 790, 801, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25, &end
#
# 52 GLU HB3 74 LYS HN 4.61
&rst
ixpk= 0, nxpk= 0, iat= 791,1145, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 52 GLU HG2 53 PHE HN 4.71
&rst
ixpk= 0, nxpk= 0, iat= 793, 801, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21, &end
#
# 52 GLU HG3 53 PHE HB2 5.34
&rst
ixpk= 0, nxpk= 0, iat= 794, 805, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84, &end
#
# 52 GLU HG3 53 PHE HN 5.25
&rst
ixpk= 0, nxpk= 0, iat= 794, 801, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75, &end
#
# 52 GLU HN 52 GLU HB2 3.99
&rst
ixpk= 0, nxpk= 0, iat= 786, 790, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49, &end
#
# 52 GLU HN 52 GLU HG2 4.40
&rst
ixpk= 0, nxpk= 0, iat= 786, 793, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 52 GLU HN 52 GLU HG3 4.82
&rst
ixpk= 0, nxpk= 0, iat= 786, 794, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32, &end
#
# 52 GLU HN 53 PHE HN 3.39
&rst
ixpk= 0, nxpk= 0, iat= 786, 801, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89, &end
#
# 52 GLU HN 73 LEU QD1 4.62
&rst
ixpk= 0, nxpk= 0, iat= 786, -1, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,
igr2=1135,1136,1137,
&end
#
# 53 PHE HA 53 PHE QD 3.75
&rst
ixpk= 0, nxpk= 0, iat= 803, -1, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,
igr2= 809, 817,
&end
#
# 53 PHE HA 54 LEU HN 3.21
&rst
ixpk= 0, nxpk= 0, iat= 803, 821, r1= 1.30, r2= 1.80, r3= 3.21, r4= 3.71, &end
#
# 53 PHE HA 73 LEU HG 4.73
&rst
ixpk= 0, nxpk= 0, iat= 803,1133, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, &end
#
# 53 PHE HA 73 LEU QD1 3.91
&rst
ixpk= 0, nxpk= 0, iat= 803, -1, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
igr2=1135,1136,1137,
&end
#
# 53 PHE HA 75 LYS HB3 4.07
&rst
ixpk= 0, nxpk= 0, iat= 803,1172, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57, &end
#
# 53 PHE HA 75 LYS HN 4.53
&rst
ixpk= 0, nxpk= 0, iat= 803,1167, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03, &end
#
# 53 PHE HB2 54 LEU HN 4.38
&rst
ixpk= 0, nxpk= 0, iat= 805, 821, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88, &end
#
# 53 PHE HB2 73 LEU QD1 4.82
&rst
ixpk= 0, nxpk= 0, iat= 805, -1, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,
igr2=1135,1136,1137,
&end
#
# 53 PHE HB2 75 LYS HB3 4.93
&rst
ixpk= 0, nxpk= 0, iat= 805,1172, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43, &end
#
# 53 PHE HB3 54 LEU HN 4.61
&rst
ixpk= 0, nxpk= 0, iat= 806, 821, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 53 PHE HB3 73 LEU QD1 5.39
&rst
ixpk= 0, nxpk= 0, iat= 806, -1, r1= 1.30, r2= 1.80, r3= 6.47, r4= 6.97,
igr2=1135,1136,1137,
&end
#
# 53 PHE HN 53 PHE HB2 3.85
&rst
ixpk= 0, nxpk= 0, iat= 801, 805, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35, &end
#
# 53 PHE HN 53 PHE HB3 3.81
&rst
ixpk= 0, nxpk= 0, iat= 801, 806, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31, &end
#
# 53 PHE HN 53 PHE QD 4.70
&rst
ixpk= 0, nxpk= 0, iat= 801, -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
igr2= 809, 817,
&end
#
# 53 PHE HN 73 LEU QD1 3.64
&rst
ixpk= 0, nxpk= 0, iat= 801, -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
igr2=1135,1136,1137,
&end
#
# 53 PHE HZ 55 SER HB2 4.74
&rst
ixpk= 0, nxpk= 0, iat= 813, 844, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24, &end
#
# 53 PHE HZ 55 SER HB3 4.74
&rst
ixpk= 0, nxpk= 0, iat= 813, 845, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24, &end
#
# 53 PHE HZ 55 SER QB 3.98
&rst
ixpk= 0, nxpk= 0, iat= 813, -1, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
igr2= 844, 845,
&end
#
# 53 PHE HZ 77 GLU HB2 4.71
&rst
ixpk= 0, nxpk= 0, iat= 813,1212, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21, &end
#
# 53 PHE HZ 77 GLU QG 4.29
&rst
ixpk= 0, nxpk= 0, iat= 813, -1, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
igr2=1215,1216,
&end
#
# 53 PHE QD 54 LEU HN 3.71
&rst
ixpk= 0, nxpk= 0, iat= -1, 821, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
igr1= 809, 817,
&end
#
# 53 PHE QD 55 SER HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 840, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 809, 817,
&end
#
# 53 PHE QD 73 LEU QD1 4.82
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
igr1= 809, 817,
igr2=1135,1136,1137,
&end
#
# 53 PHE QD 75 LYS HB3 3.61
&rst
ixpk= 0, nxpk= 0, iat= -1,1172, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,
igr1= 809, 817,
&end
#
# 53 PHE QD 75 LYS HE2 5.31
&rst
ixpk= 0, nxpk= 0, iat= -1,1180, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
igr1= 809, 817,
&end
#
# 53 PHE QD 75 LYS HE3 5.31
&rst
ixpk= 0, nxpk= 0, iat= -1,1181, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
igr1= 809, 817,
&end
#
# 53 PHE QD 75 LYS HN 5.32
&rst
ixpk= 0, nxpk= 0, iat= -1,1167, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr1= 809, 817,
&end
#
# 53 PHE QD 75 LYS QD 4.59
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr1= 809, 817,
igr2=1177,1178,
&end
#
# 53 PHE QD 75 LYS QE 4.64
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
igr1= 809, 817,
igr2=1180,1181,
&end
#
# 53 PHE QD 75 LYS QG 3.85
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
igr1= 809, 817,
igr2=1174,1175,
&end
#
# 53 PHE QE 55 SER HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 840, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 811, 815,
&end
#
# 53 PHE QE 55 SER QB 4.49
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr1= 811, 815,
igr2= 844, 845,
&end
#
# 53 PHE QE 75 LYS HD2 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1177, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 811, 815,
&end
#
# 53 PHE QE 75 LYS HD3 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1178, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 811, 815,
&end
#
# 53 PHE QE 75 LYS HE2 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1180, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 811, 815,
&end
#
# 53 PHE QE 75 LYS HE3 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1181, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 811, 815,
&end
#
# 53 PHE QE 75 LYS QD 4.75
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
igr1= 811, 815,
igr2=1177,1178,
&end
#
# 53 PHE QE 75 LYS QG 4.31
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
igr1= 811, 815,
igr2=1174,1175,
&end
#
# 53 PHE QE 77 GLU HB2 3.82
&rst
ixpk= 0, nxpk= 0, iat= -1,1212, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,
igr1= 811, 815,
&end
#
# 53 PHE QE 77 GLU HB3 5.01
&rst
ixpk= 0, nxpk= 0, iat= -1,1213, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
igr1= 811, 815,
&end
#
# 53 PHE QE 77 GLU HG2 4.86
&rst
ixpk= 0, nxpk= 0, iat= -1,1215, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
igr1= 811, 815,
&end
#
# 53 PHE QE 77 GLU HG3 4.86
&rst
ixpk= 0, nxpk= 0, iat= -1,1216, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
igr1= 811, 815,
&end
#
# 53 PHE QE 77 GLU HN 4.76
&rst
ixpk= 0, nxpk= 0, iat= -1,1208, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr1= 811, 815,
&end
#
# 53 PHE QE 77 GLU QG 4.02
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
igr1= 811, 815,
igr2=1215,1216,
&end
#
# 54 LEU HA 54 LEU QD1 3.29
&rst
ixpk= 0, nxpk= 0, iat= 823, -1, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
igr2= 830, 831, 832,
&end
#
# 54 LEU HA 54 LEU QD2 4.21
&rst
ixpk= 0, nxpk= 0, iat= 823, -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
igr2= 834, 835, 836,
&end
#
# 54 LEU HA 55 SER HN 3.28
&rst
ixpk= 0, nxpk= 0, iat= 823, 840, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78, &end
#
# 54 LEU HA 73 LEU QD2 4.81
&rst
ixpk= 0, nxpk= 0, iat= 823, -1, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr2=1139,1140,1141,
&end
#
# 54 LEU HB2 54 LEU QD1 3.90
&rst
ixpk= 0, nxpk= 0, iat= 825, -1, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
igr2= 830, 831, 832,
&end
#
# 54 LEU HB2 54 LEU QD2 3.85
&rst
ixpk= 0, nxpk= 0, iat= 825, -1, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
igr2= 834, 835, 836,
&end
#
# 54 LEU HB2 55 SER HN 5.37
&rst
ixpk= 0, nxpk= 0, iat= 825, 840, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87, &end
#
# 54 LEU HB2 73 LEU QD1 4.07
&rst
ixpk= 0, nxpk= 0, iat= 825, -1, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
igr2=1135,1136,1137,
&end
#
# 54 LEU HB2 76 LEU QD1 3.72
&rst
ixpk= 0, nxpk= 0, iat= 825, -1, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
igr2=1198,1199,1200,
&end
#
# 54 LEU HB3 54 LEU QD1 3.90
&rst
ixpk= 0, nxpk= 0, iat= 826, -1, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
igr2= 830, 831, 832,
&end
#
# 54 LEU HB3 54 LEU QD2 3.85
&rst
ixpk= 0, nxpk= 0, iat= 826, -1, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
igr2= 834, 835, 836,
&end
#
# 54 LEU HB3 55 SER HN 5.37
&rst
ixpk= 0, nxpk= 0, iat= 826, 840, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87, &end
#
# 54 LEU HB3 73 LEU QD1 4.07
&rst
ixpk= 0, nxpk= 0, iat= 826, -1, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
igr2=1135,1136,1137,
&end
#
# 54 LEU HB3 76 LEU QD1 3.72
&rst
ixpk= 0, nxpk= 0, iat= 826, -1, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
igr2=1198,1199,1200,
&end
#
# 54 LEU HG 55 SER HN 4.02
&rst
ixpk= 0, nxpk= 0, iat= 828, 840, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52, &end
#
# 54 LEU HG 56 LEU QD1 3.73
&rst
ixpk= 0, nxpk= 0, iat= 828, -1, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
igr2= 860, 861, 862,
&end
#
# 54 LEU HG 76 LEU QD1 3.98
&rst
ixpk= 0, nxpk= 0, iat= 828, -1, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
igr2=1198,1199,1200,
&end
#
# 54 LEU HN 54 LEU HB2 3.91
&rst
ixpk= 0, nxpk= 0, iat= 821, 825, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41, &end
#
# 54 LEU HN 54 LEU HB3 3.91
&rst
ixpk= 0, nxpk= 0, iat= 821, 826, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41, &end
#
# 54 LEU HN 54 LEU QD2 4.71
&rst
ixpk= 0, nxpk= 0, iat= 821, -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr2= 834, 835, 836,
&end
#
# 54 LEU HN 55 SER HN 4.58
&rst
ixpk= 0, nxpk= 0, iat= 821, 840, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08, &end
#
# 54 LEU HN 73 LEU HG 4.50
&rst
ixpk= 0, nxpk= 0, iat= 821,1133, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 54 LEU HN 73 LEU QD1 3.38
&rst
ixpk= 0, nxpk= 0, iat= 821, -1, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,
igr2=1135,1136,1137,
&end
#
# 54 LEU HN 73 LEU QD2 4.27
&rst
ixpk= 0, nxpk= 0, iat= 821, -1, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
igr2=1139,1140,1141,
&end
#
# 54 LEU HN 76 LEU HA 4.25
&rst
ixpk= 0, nxpk= 0, iat= 821,1191, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75, &end
#
# 54 LEU HN 76 LEU QD1 4.24
&rst
ixpk= 0, nxpk= 0, iat= 821, -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
igr2=1198,1199,1200,
&end
#
# 54 LEU HN 77 GLU HN 4.78
&rst
ixpk= 0, nxpk= 0, iat= 821,1208, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, &end
#
# 54 LEU QB 54 LEU QD1 3.16
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,
igr1= 825, 826,
igr2= 830, 831, 832,
&end
#
# 54 LEU QB 54 LEU QD2 3.16
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,
igr1= 825, 826,
igr2= 834, 835, 836,
&end
#
# 54 LEU QB 73 LEU QD1 3.47
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
igr1= 825, 826,
igr2=1135,1136,1137,
&end
#
# 54 LEU QB 76 LEU QD1 3.19
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
igr1= 825, 826,
igr2=1198,1199,1200,
&end
#
# 54 LEU QD1 55 SER HN 3.52
&rst
ixpk= 0, nxpk= 0, iat= -1, 840, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,
igr1= 830, 831, 832,
&end
#
# 54 LEU QD2 73 LEU QD2 3.37
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
igr1= 834, 835, 836,
igr2=1139,1140,1141,
&end
#
# 54 LEU QD2 76 LEU HA 4.98
&rst
ixpk= 0, nxpk= 0, iat= -1,1191, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
igr1= 834, 835, 836,
&end
#
# 54 LEU QD2 76 LEU QD1 2.99
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,
igr1= 834, 835, 836,
igr2=1198,1199,1200,
&end
#
# 55 SER HA 77 GLU HB2 3.80
&rst
ixpk= 0, nxpk= 0, iat= 842,1212, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30, &end
#
# 55 SER HA 77 GLU HB3 3.93
&rst
ixpk= 0, nxpk= 0, iat= 842,1213, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43, &end
#
# 55 SER HA 77 GLU HN 4.23
&rst
ixpk= 0, nxpk= 0, iat= 842,1208, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73, &end
#
# 55 SER HN 55 SER HB2 4.08
&rst
ixpk= 0, nxpk= 0, iat= 840, 844, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58, &end
#
# 55 SER HN 55 SER HB3 4.08
&rst
ixpk= 0, nxpk= 0, iat= 840, 845, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58, &end
#
# 55 SER HN 56 LEU HN 4.87
&rst
ixpk= 0, nxpk= 0, iat= 840, 851, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37, &end
#
# 55 SER HN 56 LEU QD2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 840, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2= 864, 865, 866,
&end
#
# 55 SER HN 77 GLU HB2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 840,1212, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 56 LEU HA 56 LEU QD1 4.27
&rst
ixpk= 0, nxpk= 0, iat= 853, -1, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
igr2= 860, 861, 862,
&end
#
# 56 LEU HA 56 LEU QD2 3.24
&rst
ixpk= 0, nxpk= 0, iat= 853, -1, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,
igr2= 864, 865, 866,
&end
#
# 56 LEU HA 59 VAL QG1 3.75
&rst
ixpk= 0, nxpk= 0, iat= 853, -1, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
igr2= 909, 910, 911,
&end
#
# 56 LEU HA 59 VAL QG2 4.58
&rst
ixpk= 0, nxpk= 0, iat= 853, -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
igr2= 913, 914, 915,
&end
#
# 56 LEU HB2 56 LEU QD1 3.20
&rst
ixpk= 0, nxpk= 0, iat= 855, -1, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
igr2= 860, 861, 862,
&end
#
# 56 LEU HB2 78 LEU HA 4.68
&rst
ixpk= 0, nxpk= 0, iat= 855,1225, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18, &end
#
# 56 LEU HB2 78 LEU QD2 3.25
&rst
ixpk= 0, nxpk= 0, iat= 855, -1, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40,
igr2=1236,1237,1238,
&end
#
# 56 LEU HB3 56 LEU QD1 3.28
&rst
ixpk= 0, nxpk= 0, iat= 856, -1, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,
igr2= 860, 861, 862,
&end
#
# 56 LEU HB3 59 VAL QG2 3.33
&rst
ixpk= 0, nxpk= 0, iat= 856, -1, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,
igr2= 913, 914, 915,
&end
#
# 56 LEU HB3 78 LEU QD2 3.20
&rst
ixpk= 0, nxpk= 0, iat= 856, -1, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
igr2=1236,1237,1238,
&end
#
# 56 LEU HN 56 LEU HG 4.43
&rst
ixpk= 0, nxpk= 0, iat= 851, 858, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93, &end
#
# 56 LEU HN 56 LEU QD1 4.42
&rst
ixpk= 0, nxpk= 0, iat= 851, -1, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
igr2= 860, 861, 862,
&end
#
# 56 LEU HN 56 LEU QD2 4.79
&rst
ixpk= 0, nxpk= 0, iat= 851, -1, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
igr2= 864, 865, 866,
&end
#
# 56 LEU HN 57 ILE HN 4.20
&rst
ixpk= 0, nxpk= 0, iat= 851, 870, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 56 LEU HN 57 ILE QD1 4.73
&rst
ixpk= 0, nxpk= 0, iat= 851, -1, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
igr2= 883, 884, 885,
&end
#
# 56 LEU HN 57 ILE QG1 3.97
&rst
ixpk= 0, nxpk= 0, iat= 851, -1, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
igr2= 880, 881,
&end
#
# 56 LEU HN 76 LEU QD1 4.97
&rst
ixpk= 0, nxpk= 0, iat= 851, -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr2=1198,1199,1200,
&end
#
# 56 LEU HN 77 GLU HB2 4.12
&rst
ixpk= 0, nxpk= 0, iat= 851,1212, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62, &end
#
# 56 LEU HN 77 GLU HB3 4.18
&rst
ixpk= 0, nxpk= 0, iat= 851,1213, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68, &end
#
# 56 LEU HN 77 GLU HN 4.48
&rst
ixpk= 0, nxpk= 0, iat= 851,1208, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98, &end
#
# 56 LEU QD1 78 LEU HA 5.08
&rst
ixpk= 0, nxpk= 0, iat= -1,1225, r1= 1.30, r2= 1.80, r3= 6.10, r4= 6.60,
igr1= 860, 861, 862,
&end
#
# 57 ILE HA 57 ILE QD1 3.98
&rst
ixpk= 0, nxpk= 0, iat= 872, -1, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
igr2= 883, 884, 885,
&end
#
# 57 ILE HA 57 ILE QG1 3.68
&rst
ixpk= 0, nxpk= 0, iat= 872, -1, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
igr2= 880, 881,
&end
#
# 57 ILE HA 57 ILE QG2 3.34
&rst
ixpk= 0, nxpk= 0, iat= 872, -1, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,
igr2= 876, 877, 878,
&end
#
# 57 ILE HA 58 ASN HN 3.42
&rst
ixpk= 0, nxpk= 0, iat= 872, 889, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92, &end
#
# 57 ILE HA 79 SER HN 4.49
&rst
ixpk= 0, nxpk= 0, iat= 872,1242, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99, &end
#
# 57 ILE HA 80 GLU HB2 4.72
&rst
ixpk= 0, nxpk= 0, iat= 872,1257, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22, &end
#
# 57 ILE HA 81 ASN QD2 4.70
&rst
ixpk= 0, nxpk= 0, iat= 872, -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
igr2=1277,1278,
&end
#
# 57 ILE HB 57 ILE QD1 3.23
&rst
ixpk= 0, nxpk= 0, iat= 874, -1, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,
igr2= 883, 884, 885,
&end
#
# 57 ILE HG12 79 SER HN 4.97
&rst
ixpk= 0, nxpk= 0, iat= 880,1242, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 57 ILE HG12 79 SER QB 4.76
&rst
ixpk= 0, nxpk= 0, iat= 880, -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr2=1246,1247,
&end
#
# 57 ILE HG13 79 SER HN 4.97
&rst
ixpk= 0, nxpk= 0, iat= 881,1242, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 57 ILE HG13 79 SER QB 4.76
&rst
ixpk= 0, nxpk= 0, iat= 881, -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr2=1246,1247,
&end
#
# 57 ILE HN 57 ILE HB 3.53
&rst
ixpk= 0, nxpk= 0, iat= 870, 874, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03, &end
#
# 57 ILE HN 57 ILE HG12 4.31
&rst
ixpk= 0, nxpk= 0, iat= 870, 880, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81, &end
#
# 57 ILE HN 57 ILE HG13 4.31
&rst
ixpk= 0, nxpk= 0, iat= 870, 881, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81, &end
#
# 57 ILE HN 57 ILE QD1 4.50
&rst
ixpk= 0, nxpk= 0, iat= 870, -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr2= 883, 884, 885,
&end
#
# 57 ILE HN 57 ILE QG1 3.44
&rst
ixpk= 0, nxpk= 0, iat= 870, -1, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,
igr2= 880, 881,
&end
#
# 57 ILE HN 57 ILE QG2 4.12
&rst
ixpk= 0, nxpk= 0, iat= 870, -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr2= 876, 877, 878,
&end
#
# 57 ILE HN 59 VAL QG1 3.34
&rst
ixpk= 0, nxpk= 0, iat= 870, -1, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,
igr2= 909, 910, 911,
&end
#
# 57 ILE QD1 58 ASN HN 4.94
&rst
ixpk= 0, nxpk= 0, iat= -1, 889, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr1= 883, 884, 885,
&end
#
# 57 ILE QD1 77 GLU HB2 4.90
&rst
ixpk= 0, nxpk= 0, iat= -1,1212, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
igr1= 883, 884, 885,
&end
#
# 57 ILE QD1 77 GLU HB3 3.74
&rst
ixpk= 0, nxpk= 0, iat= -1,1213, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
igr1= 883, 884, 885,
&end
#
# 57 ILE QD1 77 GLU HG2 4.07
&rst
ixpk= 0, nxpk= 0, iat= -1,1215, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
igr1= 883, 884, 885,
&end
#
# 57 ILE QD1 77 GLU HG3 4.07
&rst
ixpk= 0, nxpk= 0, iat= -1,1216, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
igr1= 883, 884, 885,
&end
#
# 57 ILE QD1 77 GLU QG 3.57
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31,
igr1= 883, 884, 885,
igr2=1215,1216,
&end
#
# 57 ILE QD1 78 LEU HN 4.72
&rst
ixpk= 0, nxpk= 0, iat= -1,1223, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
igr1= 883, 884, 885,
&end
#
# 57 ILE QD1 79 SER HN 3.96
&rst
ixpk= 0, nxpk= 0, iat= -1,1242, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
igr1= 883, 884, 885,
&end
#
# 57 ILE QD1 79 SER QB 3.78
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
igr1= 883, 884, 885,
igr2=1246,1247,
&end
#
# 57 ILE QD1 80 GLU HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1253, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 883, 884, 885,
&end
#
# 57 ILE QD1 80 GLU QG 5.16
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.96, r4= 7.46,
igr1= 883, 884, 885,
igr2=1260,1261,
&end
#
# 57 ILE QG1 77 GLU HB3 4.79
&rst
ixpk= 0, nxpk= 0, iat= -1,1213, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
igr1= 880, 881,
&end
#
# 57 ILE QG1 77 GLU QG 5.07
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.39, r4= 6.89,
igr1= 880, 881,
igr2=1215,1216,
&end
#
# 57 ILE QG1 79 SER HN 4.24
&rst
ixpk= 0, nxpk= 0, iat= -1,1242, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
igr1= 880, 881,
&end
#
# 57 ILE QG1 79 SER QB 3.99
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
igr1= 880, 881,
igr2=1246,1247,
&end
#
# 57 ILE QG2 57 ILE HG12 3.69
&rst
ixpk= 0, nxpk= 0, iat= -1, 880, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
igr1= 876, 877, 878,
&end
#
# 57 ILE QG2 57 ILE HG13 3.69
&rst
ixpk= 0, nxpk= 0, iat= -1, 881, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
igr1= 876, 877, 878,
&end
#
# 57 ILE QG2 57 ILE QG1 3.15
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,
igr1= 876, 877, 878,
igr2= 880, 881,
&end
#
# 57 ILE QG2 58 ASN HD21 4.85
&rst
ixpk= 0, nxpk= 0, iat= -1, 898, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32,
igr1= 876, 877, 878,
&end
#
# 57 ILE QG2 58 ASN HD22 4.85
&rst
ixpk= 0, nxpk= 0, iat= -1, 899, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32,
igr1= 876, 877, 878,
&end
#
# 57 ILE QG2 58 ASN HN 3.44
&rst
ixpk= 0, nxpk= 0, iat= -1, 889, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
igr1= 876, 877, 878,
&end
#
# 57 ILE QG2 58 ASN QB 3.40
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
igr1= 876, 877, 878,
igr2= 893, 894,
&end
#
# 57 ILE QG2 60 GLY HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 919, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 876, 877, 878,
&end
#
# 57 ILE QG2 79 SER HN 4.45
&rst
ixpk= 0, nxpk= 0, iat= -1,1242, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr1= 876, 877, 878,
&end
#
# 57 ILE QG2 79 SER QB 3.41
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
igr1= 876, 877, 878,
igr2=1246,1247,
&end
#
# 57 ILE QG2 80 GLU HA 4.97
&rst
ixpk= 0, nxpk= 0, iat= -1,1255, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr1= 876, 877, 878,
&end
#
# 57 ILE QG2 80 GLU HB2 3.22
&rst
ixpk= 0, nxpk= 0, iat= -1,1257, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,
igr1= 876, 877, 878,
&end
#
# 57 ILE QG2 80 GLU HB3 4.08
&rst
ixpk= 0, nxpk= 0, iat= -1,1258, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,
igr1= 876, 877, 878,
&end
#
# 57 ILE QG2 80 GLU HG2 3.64
&rst
ixpk= 0, nxpk= 0, iat= -1,1260, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
igr1= 876, 877, 878,
&end
#
# 57 ILE QG2 80 GLU HG3 3.64
&rst
ixpk= 0, nxpk= 0, iat= -1,1261, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
igr1= 876, 877, 878,
&end
#
# 57 ILE QG2 80 GLU QG 3.04
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,
igr1= 876, 877, 878,
igr2=1260,1261,
&end
#
# 57 ILE QG2 81 ASN QD2 4.80
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.47, r4= 6.97,
igr1= 876, 877, 878,
igr2=1277,1278,
&end
#
# 58 ASN HN 59 VAL HN 3.98
&rst
ixpk= 0, nxpk= 0, iat= 889, 903, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48, &end
#
# 58 ASN HN 60 GLY HN 4.57
&rst
ixpk= 0, nxpk= 0, iat= 889, 919, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07, &end
#
# 58 ASN HN 80 GLU HB2 3.84
&rst
ixpk= 0, nxpk= 0, iat= 889,1257, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34, &end
#
# 58 ASN HN 80 GLU HB3 4.11
&rst
ixpk= 0, nxpk= 0, iat= 889,1258, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 58 ASN HN 80 GLU HG2 4.57
&rst
ixpk= 0, nxpk= 0, iat= 889,1260, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07, &end
#
# 58 ASN HN 80 GLU HG3 4.57
&rst
ixpk= 0, nxpk= 0, iat= 889,1261, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07, &end
#
# 58 ASN HN 80 GLU QG 3.99
&rst
ixpk= 0, nxpk= 0, iat= 889, -1, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
igr2=1260,1261,
&end
#
# 58 ASN HN 81 ASN QD2 4.78
&rst
ixpk= 0, nxpk= 0, iat= 889, -1, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr2=1277,1278,
&end
#
# 58 ASN QB 58 ASN QD2 3.11
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
igr1= 893, 894,
igr2= 898, 899,
&end
#
# 58 ASN QB 80 GLU HB2 4.69
&rst
ixpk= 0, nxpk= 0, iat= -1,1257, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr1= 893, 894,
&end
#
# 58 ASN QB 80 GLU HB3 5.33
&rst
ixpk= 0, nxpk= 0, iat= -1,1258, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
igr1= 893, 894,
&end
#
# 58 ASN QB 80 GLU QG 4.74
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr1= 893, 894,
igr2=1260,1261,
&end
#
# 59 VAL HA 59 VAL QG1 3.22
&rst
ixpk= 0, nxpk= 0, iat= 905, -1, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,
igr2= 909, 910, 911,
&end
#
# 59 VAL HA 59 VAL QG2 3.72
&rst
ixpk= 0, nxpk= 0, iat= 905, -1, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
igr2= 913, 914, 915,
&end
#
# 59 VAL HB 60 GLY HN 4.74
&rst
ixpk= 0, nxpk= 0, iat= 907, 919, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24, &end
#
# 59 VAL HB 61 LEU HB2 4.55
&rst
ixpk= 0, nxpk= 0, iat= 907, 930, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05, &end
#
# 59 VAL HN 59 VAL HB 4.18
&rst
ixpk= 0, nxpk= 0, iat= 903, 907, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68, &end
#
# 59 VAL HN 59 VAL QG1 3.62
&rst
ixpk= 0, nxpk= 0, iat= 903, -1, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,
igr2= 909, 910, 911,
&end
#
# 59 VAL HN 59 VAL QG2 3.28
&rst
ixpk= 0, nxpk= 0, iat= 903, -1, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,
igr2= 913, 914, 915,
&end
#
# 59 VAL HN 60 GLY HA2 4.96
&rst
ixpk= 0, nxpk= 0, iat= 903, 921, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46, &end
#
# 59 VAL HN 60 GLY HA3 4.96
&rst
ixpk= 0, nxpk= 0, iat= 903, 922, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46, &end
#
# 59 VAL HN 60 GLY HN 3.31
&rst
ixpk= 0, nxpk= 0, iat= 903, 919, r1= 1.30, r2= 1.80, r3= 3.31, r4= 3.81, &end
#
# 59 VAL HN 60 GLY QA 4.22
&rst
ixpk= 0, nxpk= 0, iat= 903, -1, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr2= 921, 922,
&end
#
# 59 VAL HN 61 LEU HN 4.47
&rst
ixpk= 0, nxpk= 0, iat= 903, 926, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97, &end
#
# 59 VAL HN 80 GLU HB2 4.59
&rst
ixpk= 0, nxpk= 0, iat= 903,1257, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 59 VAL HN 81 ASN HA 5.30
&rst
ixpk= 0, nxpk= 0, iat= 903,1270, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80, &end
#
# 59 VAL HN 81 ASN QD2 4.49
&rst
ixpk= 0, nxpk= 0, iat= 903, -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr2=1277,1278,
&end
#
# 59 VAL QG2 60 GLY HN 3.70
&rst
ixpk= 0, nxpk= 0, iat= -1, 919, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
igr1= 913, 914, 915,
&end
#
# 59 VAL QG2 61 LEU HA 4.07
&rst
ixpk= 0, nxpk= 0, iat= -1, 928, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
igr1= 913, 914, 915,
&end
#
# 59 VAL QG2 61 LEU HB2 3.31
&rst
ixpk= 0, nxpk= 0, iat= -1, 930, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,
igr1= 913, 914, 915,
&end
#
# 59 VAL QG2 61 LEU HB3 3.42
&rst
ixpk= 0, nxpk= 0, iat= -1, 931, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
igr1= 913, 914, 915,
&end
#
# 59 VAL QG2 61 LEU HN 3.28
&rst
ixpk= 0, nxpk= 0, iat= -1, 926, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,
igr1= 913, 914, 915,
&end
#
# 59 VAL QG2 81 ASN HA 4.28
&rst
ixpk= 0, nxpk= 0, iat= -1,1270, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
igr1= 913, 914, 915,
&end
#
# 59 VAL QG2 81 ASN HD21 4.11
&rst
ixpk= 0, nxpk= 0, iat= -1,1277, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
igr1= 913, 914, 915,
&end
#
# 59 VAL QG2 81 ASN HD22 4.11
&rst
ixpk= 0, nxpk= 0, iat= -1,1278, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
igr1= 913, 914, 915,
&end
#
# 59 VAL QG2 81 ASN QD2 3.59
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
igr1= 913, 914, 915,
igr2=1277,1278,
&end
#
# 60 GLY HA2 82 ARG QD 4.54
&rst
ixpk= 0, nxpk= 0, iat= 921, -1, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
igr2=1292,1293,
&end
#
# 60 GLY HA3 82 ARG QD 4.54
&rst
ixpk= 0, nxpk= 0, iat= 922, -1, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
igr2=1292,1293,
&end
#
# 60 GLY HN 61 LEU HB2 4.64
&rst
ixpk= 0, nxpk= 0, iat= 919, 930, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14, &end
#
# 60 GLY HN 61 LEU HB3 5.50
&rst
ixpk= 0, nxpk= 0, iat= 919, 931, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 60 GLY HN 80 GLU HB2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 919,1257, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 60 GLY HN 81 ASN HA 4.32
&rst
ixpk= 0, nxpk= 0, iat= 919,1270, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82, &end
#
# 60 GLY HN 81 ASN HD21 5.14
&rst
ixpk= 0, nxpk= 0, iat= 919,1277, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64, &end
#
# 60 GLY HN 81 ASN HD22 5.14
&rst
ixpk= 0, nxpk= 0, iat= 919,1278, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64, &end
#
# 60 GLY HN 81 ASN QD2 4.52
&rst
ixpk= 0, nxpk= 0, iat= 919, -1, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
igr2=1277,1278,
&end
#
# 60 GLY QA 82 ARG HN 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1,1282, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1= 921, 922,
&end
#
# 60 GLY QA 82 ARG QD 3.97
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,
igr1= 921, 922,
igr2=1292,1293,
&end
#
# 61 LEU HA 61 LEU HG 3.88
&rst
ixpk= 0, nxpk= 0, iat= 928, 933, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38, &end
#
# 61 LEU HA 61 LEU QD1 3.30
&rst
ixpk= 0, nxpk= 0, iat= 928, -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
igr2= 935, 936, 937,
&end
#
# 61 LEU HA 61 LEU QD2 4.03
&rst
ixpk= 0, nxpk= 0, iat= 928, -1, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
igr2= 939, 940, 941,
&end
#
# 61 LEU HA 62 ILE HB 5.18
&rst
ixpk= 0, nxpk= 0, iat= 928, 949, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68, &end
#
# 61 LEU HA 62 ILE HG13 4.69
&rst
ixpk= 0, nxpk= 0, iat= 928, 956, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, &end
#
# 61 LEU HA 62 ILE HN 3.52
&rst
ixpk= 0, nxpk= 0, iat= 928, 945, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02, &end
#
# 61 LEU HA 62 ILE QD1 4.43
&rst
ixpk= 0, nxpk= 0, iat= 928, -1, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
igr2= 958, 959, 960,
&end
#
# 61 LEU HA 63 SER HN 4.04
&rst
ixpk= 0, nxpk= 0, iat= 928, 964, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, &end
#
# 61 LEU HB2 61 LEU QD1 3.68
&rst
ixpk= 0, nxpk= 0, iat= 930, -1, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
igr2= 935, 936, 937,
&end
#
# 61 LEU HB2 62 ILE HN 4.70
&rst
ixpk= 0, nxpk= 0, iat= 930, 945, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 61 LEU HB2 63 SER HN 5.32
&rst
ixpk= 0, nxpk= 0, iat= 930, 964, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82, &end
#
# 61 LEU HB2 81 ASN HB3 5.39
&rst
ixpk= 0, nxpk= 0, iat= 930,1273, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89, &end
#
# 61 LEU HB3 61 LEU QD1 3.86
&rst
ixpk= 0, nxpk= 0, iat= 931, -1, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
igr2= 935, 936, 937,
&end
#
# 61 LEU HB3 61 LEU QD2 3.34
&rst
ixpk= 0, nxpk= 0, iat= 931, -1, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,
igr2= 939, 940, 941,
&end
#
# 61 LEU HB3 62 ILE HN 4.99
&rst
ixpk= 0, nxpk= 0, iat= 931, 945, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49, &end
#
# 61 LEU HB3 63 SER HN 5.12
&rst
ixpk= 0, nxpk= 0, iat= 931, 964, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, &end
#
# 61 LEU HB3 81 ASN HB2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 931,1272, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 61 LEU HB3 81 ASN HB3 4.28
&rst
ixpk= 0, nxpk= 0, iat= 931,1273, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78, &end
#
# 61 LEU HB3 82 ARG HN 4.99
&rst
ixpk= 0, nxpk= 0, iat= 931,1282, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49, &end
#
# 61 LEU HG 62 ILE HN 3.95
&rst
ixpk= 0, nxpk= 0, iat= 933, 945, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45, &end
#
# 61 LEU HG 63 SER HN 3.60
&rst
ixpk= 0, nxpk= 0, iat= 933, 964, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10, &end
#
# 61 LEU HG 63 SER QB 4.11
&rst
ixpk= 0, nxpk= 0, iat= 933, -1, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
igr2= 968, 969,
&end
#
# 61 LEU HN 61 LEU HB2 3.71
&rst
ixpk= 0, nxpk= 0, iat= 926, 930, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21, &end
#
# 61 LEU HN 61 LEU HB3 3.53
&rst
ixpk= 0, nxpk= 0, iat= 926, 931, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03, &end
#
# 61 LEU HN 61 LEU HG 4.69
&rst
ixpk= 0, nxpk= 0, iat= 926, 933, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, &end
#
# 61 LEU HN 61 LEU QD1 4.06
&rst
ixpk= 0, nxpk= 0, iat= 926, -1, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
igr2= 935, 936, 937,
&end
#
# 61 LEU HN 81 ASN HA 4.25
&rst
ixpk= 0, nxpk= 0, iat= 926,1270, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75, &end
#
# 61 LEU HN 81 ASN HB3 4.03
&rst
ixpk= 0, nxpk= 0, iat= 926,1273, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53, &end
#
# 61 LEU QD1 62 ILE HN 4.02
&rst
ixpk= 0, nxpk= 0, iat= -1, 945, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
igr1= 935, 936, 937,
&end
#
# 61 LEU QD1 63 SER HN 4.03
&rst
ixpk= 0, nxpk= 0, iat= -1, 964, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
igr1= 935, 936, 937,
&end
#
# 61 LEU QD1 66 ASN HD21 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1011, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 935, 936, 937,
&end
#
# 61 LEU QD2 62 ILE HN 4.30
&rst
ixpk= 0, nxpk= 0, iat= -1, 945, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
igr1= 939, 940, 941,
&end
#
# 61 LEU QD2 63 SER HN 4.57
&rst
ixpk= 0, nxpk= 0, iat= -1, 964, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
igr1= 939, 940, 941,
&end
#
# 62 ILE HA 62 ILE HG12 3.60
&rst
ixpk= 0, nxpk= 0, iat= 947, 955, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10, &end
#
# 62 ILE HA 62 ILE HG13 3.84
&rst
ixpk= 0, nxpk= 0, iat= 947, 956, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34, &end
#
# 62 ILE HA 62 ILE QD1 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
#
# 62 ILE HA 62 ILE QG2 3.07
&rst
ixpk= 0, nxpk= 0, iat= 947, -1, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19,
igr2= 951, 952, 953,
&end
#
# 62 ILE HA 82 ARG HB2 4.93
&rst
ixpk= 0, nxpk= 0, iat= 947,1286, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43, &end
#
# 62 ILE HA 82 ARG HB3 4.93
&rst
ixpk= 0, nxpk= 0, iat= 947,1287, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43, &end
#
# 62 ILE HA 82 ARG HN 4.87
&rst
ixpk= 0, nxpk= 0, iat= 947,1282, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37, &end
#
# 62 ILE HA 82 ARG QB 4.16
&rst
ixpk= 0, nxpk= 0, iat= 947, -1, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
igr2=1286,1287,
&end
#
# 62 ILE HA 82 ARG QD 4.73
&rst
ixpk= 0, nxpk= 0, iat= 947, -1, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
igr2=1292,1293,
&end
#
# 62 ILE HA 83 ILE HA 3.86
&rst
ixpk= 0, nxpk= 0, iat= 947,1308, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 62 ILE HA 83 ILE HN 4.95
&rst
ixpk= 0, nxpk= 0, iat= 947,1306, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45, &end
#
# 62 ILE HA 83 ILE QD1 4.88
&rst
ixpk= 0, nxpk= 0, iat= 947, -1, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
igr2=1319,1320,1321,
&end
#
# 62 ILE HA 83 ILE QG1 3.66
&rst
ixpk= 0, nxpk= 0, iat= 947, -1, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
igr2=1316,1317,
&end
#
# 62 ILE HA 84 PHE HN 5.04
&rst
ixpk= 0, nxpk= 0, iat= 947,1325, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54, &end
#
# 62 ILE HB 62 ILE QD1 3.19
&rst
ixpk= 0, nxpk= 0, iat= 949, -1, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,
igr2= 958, 959, 960,
&end
#
# 62 ILE HB 63 SER HN 3.76
&rst
ixpk= 0, nxpk= 0, iat= 949, 964, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26, &end
#
# 62 ILE HB 84 PHE QE 4.69
&rst
ixpk= 0, nxpk= 0, iat= 949, -1, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr2=1335,1339,
&end
#
# 62 ILE HG12 82 ARG QD 3.83
&rst
ixpk= 0, nxpk= 0, iat= 955, -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
igr2=1292,1293,
&end
#
# 62 ILE HG12 84 PHE QD 5.50
&rst
ixpk= 0, nxpk= 0, iat= 955, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2=1333,1341,
&end
#
# 62 ILE HG12 84 PHE QE 5.08
&rst
ixpk= 0, nxpk= 0, iat= 955, -1, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr2=1335,1339,
&end
#
# 62 ILE HG13 63 SER HN 4.67
&rst
ixpk= 0, nxpk= 0, iat= 956, 964, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, &end
#
# 62 ILE HG13 82 ARG QB 4.46
&rst
ixpk= 0, nxpk= 0, iat= 956, -1, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
igr2=1286,1287,
&end
#
# 62 ILE HG13 82 ARG QD 4.28
&rst
ixpk= 0, nxpk= 0, iat= 956, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2=1292,1293,
&end
#
# 62 ILE HN 62 ILE HB 3.78
&rst
ixpk= 0, nxpk= 0, iat= 945, 949, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28, &end
#
# 62 ILE HN 62 ILE HG13 4.23
&rst
ixpk= 0, nxpk= 0, iat= 945, 956, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73, &end
#
# 62 ILE HN 62 ILE QD1 4.15
&rst
ixpk= 0, nxpk= 0, iat= 945, -1, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
igr2= 958, 959, 960,
&end
#
# 62 ILE HN 62 ILE QG2 3.99
&rst
ixpk= 0, nxpk= 0, iat= 945, -1, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
igr2= 951, 952, 953,
&end
#
# 62 ILE HN 63 SER HN 3.23
&rst
ixpk= 0, nxpk= 0, iat= 945, 964, r1= 1.30, r2= 1.80, r3= 3.23, r4= 3.73, &end
#
# 62 ILE QD1 63 SER HN 4.53
&rst
ixpk= 0, nxpk= 0, iat= -1, 964, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
igr1= 958, 959, 960,
&end
#
# 62 ILE QD1 82 ARG QB 4.33
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
igr1= 958, 959, 960,
igr2=1286,1287,
&end
#
# 62 ILE QD1 82 ARG QD 3.94
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
igr1= 958, 959, 960,
igr2=1292,1293,
&end
#
# 62 ILE QD1 84 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= 958, 959, 960,
igr2=1335,1339,
&end
#
# 62 ILE QG2 62 ILE HG12 3.08
&rst
ixpk= 0, nxpk= 0, iat= -1, 955, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,
igr1= 951, 952, 953,
&end
#
# 62 ILE QG2 63 SER HA 4.65
&rst
ixpk= 0, nxpk= 0, iat= -1, 966, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr1= 951, 952, 953,
&end
#
# 62 ILE QG2 63 SER HN 4.20
&rst
ixpk= 0, nxpk= 0, iat= -1, 964, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr1= 951, 952, 953,
&end
#
# 62 ILE QG2 63 SER QB 4.71
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
igr1= 951, 952, 953,
igr2= 968, 969,
&end
#
# 62 ILE QG2 82 ARG HB2 3.83
&rst
ixpk= 0, nxpk= 0, iat= -1,1286, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
igr1= 951, 952, 953,
&end
#
# 62 ILE QG2 82 ARG HB3 3.83
&rst
ixpk= 0, nxpk= 0, iat= -1,1287, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
igr1= 951, 952, 953,
&end
#
# 62 ILE QG2 82 ARG HN 4.76
&rst
ixpk= 0, nxpk= 0, iat= -1,1282, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
igr1= 951, 952, 953,
&end
#
# 62 ILE QG2 82 ARG QD 4.26
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
igr1= 951, 952, 953,
igr2=1292,1293,
&end
#
# 62 ILE QG2 83 ILE HA 3.86
&rst
ixpk= 0, nxpk= 0, iat= -1,1308, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
igr1= 951, 952, 953,
&end
#
# 62 ILE QG2 83 ILE QG1 4.51
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
igr1= 951, 952, 953,
igr2=1316,1317,
&end
#
# 62 ILE QG2 84 PHE HN 4.53
&rst
ixpk= 0, nxpk= 0, iat= -1,1325, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
igr1= 951, 952, 953,
&end
#
# 62 ILE QG2 84 PHE QD 3.98
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr1= 951, 952, 953,
igr2=1333,1341,
&end
#
# 62 ILE QG2 84 PHE QE 3.19
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
igr1= 951, 952, 953,
igr2=1335,1339,
&end
#
# 63 SER HA 64 VAL HN 3.38
&rst
ixpk= 0, nxpk= 0, iat= 966, 975, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88, &end
#
# 63 SER HA 64 VAL QG1 4.31
&rst
ixpk= 0, nxpk= 0, iat= 966, -1, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
igr2= 981, 982, 983,
&end
#
# 63 SER HA 64 VAL QG2 4.27
&rst
ixpk= 0, nxpk= 0, iat= 966, -1, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
igr2= 985, 986, 987,
&end
#
# 63 SER HA 65 SER HN 4.29
&rst
ixpk= 0, nxpk= 0, iat= 966, 991, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79, &end
#
# 63 SER HB2 64 VAL HN 4.56
&rst
ixpk= 0, nxpk= 0, iat= 968, 975, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06, &end
#
# 63 SER HB3 64 VAL HN 4.56
&rst
ixpk= 0, nxpk= 0, iat= 969, 975, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06, &end
#
# 63 SER HN 63 SER HB2 3.79
&rst
ixpk= 0, nxpk= 0, iat= 964, 968, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29, &end
#
# 63 SER HN 63 SER HB3 3.79
&rst
ixpk= 0, nxpk= 0, iat= 964, 969, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29, &end
#
# 63 SER HN 64 VAL HN 4.67
&rst
ixpk= 0, nxpk= 0, iat= 964, 975, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, &end
#
# 63 SER QB 64 VAL HN 4.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 975, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
igr1= 968, 969,
&end
#
# 63 SER QB 65 SER HN 4.62
&rst
ixpk= 0, nxpk= 0, iat= -1, 991, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
igr1= 968, 969,
&end
#
# 64 VAL HA 64 VAL QG1 3.13
&rst
ixpk= 0, nxpk= 0, iat= 977, -1, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,
igr2= 981, 982, 983,
&end
#
# 64 VAL HA 64 VAL QG2 3.61
&rst
ixpk= 0, nxpk= 0, iat= 977, -1, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,
igr2= 985, 986, 987,
&end
#
# 64 VAL HA 67 LEU QD1 3.78
&rst
ixpk= 0, nxpk= 0, iat= 977, -1, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
igr2=1025,1026,1027,
&end
#
# 64 VAL HA 67 LEU QD2 4.23
&rst
ixpk= 0, nxpk= 0, iat= 977, -1, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
igr2=1029,1030,1031,
&end
#
# 64 VAL HA 90 LEU QD2 5.31
&rst
ixpk= 0, nxpk= 0, iat= 977, -1, r1= 1.30, r2= 1.80, r3= 6.38, r4= 6.88,
igr2=1420,1421,1422,
&end
#
# 64 VAL HB 67 LEU HB2 4.42
&rst
ixpk= 0, nxpk= 0, iat= 979,1020, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92, &end
#
# 64 VAL HB 67 LEU HG 4.22
&rst
ixpk= 0, nxpk= 0, iat= 979,1023, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 64 VAL HB 67 LEU QD1 3.45
&rst
ixpk= 0, nxpk= 0, iat= 979, -1, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,
igr2=1025,1026,1027,
&end
#
# 64 VAL HB 87 LEU QD2 5.12
&rst
ixpk= 0, nxpk= 0, iat= 979, -1, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
igr2=1372,1373,1374,
&end
#
# 64 VAL HB 90 LEU QD1 4.27
&rst
ixpk= 0, nxpk= 0, iat= 979, -1, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
igr2=1416,1417,1418,
&end
#
# 64 VAL HB 90 LEU QD2 3.85
&rst
ixpk= 0, nxpk= 0, iat= 979, -1, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
igr2=1420,1421,1422,
&end
#
# 64 VAL HN 64 VAL QG1 3.64
&rst
ixpk= 0, nxpk= 0, iat= 975, -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
igr2= 981, 982, 983,
&end
#
# 64 VAL HN 64 VAL QG2 3.26
&rst
ixpk= 0, nxpk= 0, iat= 975, -1, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
igr2= 985, 986, 987,
&end
#
# 64 VAL HN 65 SER HN 3.68
&rst
ixpk= 0, nxpk= 0, iat= 975, 991, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18, &end
#
# 64 VAL HN 65 SER QB 5.07
&rst
ixpk= 0, nxpk= 0, iat= 975, -1, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
igr2= 995, 996,
&end
#
# 64 VAL QG2 65 SER HA 3.95
&rst
ixpk= 0, nxpk= 0, iat= -1, 993, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr1= 985, 986, 987,
&end
#
# 64 VAL QG2 65 SER HN 3.82
&rst
ixpk= 0, nxpk= 0, iat= -1, 991, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
igr1= 985, 986, 987,
&end
#
# 64 VAL QG2 67 LEU HB2 4.78
&rst
ixpk= 0, nxpk= 0, iat= -1,1020, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
igr1= 985, 986, 987,
&end
#
# 64 VAL QG2 86 GLY QA 4.51
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
igr1= 985, 986, 987,
igr2=1354,1355,
&end
#
# 64 VAL QG2 87 LEU HA 3.54
&rst
ixpk= 0, nxpk= 0, iat= -1,1361, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,
igr1= 985, 986, 987,
&end
#
# 64 VAL QG2 87 LEU HB3 5.42
&rst
ixpk= 0, nxpk= 0, iat= -1,1364, r1= 1.30, r2= 1.80, r3= 6.51, r4= 7.01,
igr1= 985, 986, 987,
&end
#
# 64 VAL QG2 87 LEU HN 5.18
&rst
ixpk= 0, nxpk= 0, iat= -1,1359, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
igr1= 985, 986, 987,
&end
#
# 64 VAL QG2 88 ASP HN 4.73
&rst
ixpk= 0, nxpk= 0, iat= -1,1378, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
igr1= 985, 986, 987,
&end
#
# 64 VAL QG2 88 ASP QB 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.20, r4= 7.70,
igr1= 985, 986, 987,
igr2=1382,1383,
&end
#
# 64 VAL QG2 89 MET HB2 4.07
&rst
ixpk= 0, nxpk= 0, iat= -1,1394, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
igr1= 985, 986, 987,
&end
#
# 64 VAL QG2 89 MET HB3 4.07
&rst
ixpk= 0, nxpk= 0, iat= -1,1395, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
igr1= 985, 986, 987,
&end
#
# 64 VAL QG2 89 MET HN 4.71
&rst
ixpk= 0, nxpk= 0, iat= -1,1390, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr1= 985, 986, 987,
&end
#
# 64 VAL QG2 89 MET QB 3.47
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
igr1= 985, 986, 987,
igr2=1394,1395,
&end
#
# 64 VAL QG2 89 MET QE 4.07
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,
igr1= 985, 986, 987,
igr2=1401,1402,1403,
&end
#
# 64 VAL QG2 89 MET QG 3.74
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr1= 985, 986, 987,
igr2=1397,1398,
&end
#
# 64 VAL QG2 90 LEU HA 4.81
&rst
ixpk= 0, nxpk= 0, iat= -1,1409, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr1= 985, 986, 987,
&end
#
# 64 VAL QG2 90 LEU HG 3.70
&rst
ixpk= 0, nxpk= 0, iat= -1,1414, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
igr1= 985, 986, 987,
&end
#
# 64 VAL QG2 90 LEU HN 3.68
&rst
ixpk= 0, nxpk= 0, iat= -1,1407, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
igr1= 985, 986, 987,
&end
#
# 65 SER HA 89 MET QB 4.02
&rst
ixpk= 0, nxpk= 0, iat= 993, -1, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,
igr2=1394,1395,
&end
#
# 65 SER HA 89 MET QE 3.70
&rst
ixpk= 0, nxpk= 0, iat= 993, -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
igr2=1401,1402,1403,
&end
#
# 65 SER HA 89 MET QG 3.89
&rst
ixpk= 0, nxpk= 0, iat= 993, -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
igr2=1397,1398,
&end
#
# 65 SER HB2 89 MET QE 4.52
&rst
ixpk= 0, nxpk= 0, iat= 995, -1, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
igr2=1401,1402,1403,
&end
#
# 65 SER HB2 89 MET QG 4.99
&rst
ixpk= 0, nxpk= 0, iat= 995, -1, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
igr2=1397,1398,
&end
#
# 65 SER HB3 89 MET QE 4.52
&rst
ixpk= 0, nxpk= 0, iat= 996, -1, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
igr2=1401,1402,1403,
&end
#
# 65 SER HB3 89 MET QG 4.99
&rst
ixpk= 0, nxpk= 0, iat= 996, -1, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
igr2=1397,1398,
&end
#
# 65 SER HN 65 SER HB2 3.91
&rst
ixpk= 0, nxpk= 0, iat= 991, 995, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41, &end
#
# 65 SER HN 65 SER HB3 3.91
&rst
ixpk= 0, nxpk= 0, iat= 991, 996, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41, &end
#
# 65 SER HN 65 SER QB 3.41
&rst
ixpk= 0, nxpk= 0, iat= 991, -1, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,
igr2= 995, 996,
&end
#
# 65 SER HN 89 MET QE 4.88
&rst
ixpk= 0, nxpk= 0, iat= 991, -1, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
igr2=1401,1402,1403,
&end
#
# 65 SER QB 89 MET QE 3.88
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73,
igr1= 995, 996,
igr2=1401,1402,1403,
&end
#
# 65 SER QB 89 MET QG 4.34
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,
igr1= 995, 996,
igr2=1397,1398,
&end
#
# 66 ASN HB2 67 LEU HN 4.84
&rst
ixpk= 0, nxpk= 0, iat=1006,1016, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34, &end
#
# 66 ASN HB3 67 LEU HN 4.84
&rst
ixpk= 0, nxpk= 0, iat=1007,1016, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34, &end
#
# 66 ASN QB 66 ASN HD22 3.52
&rst
ixpk= 0, nxpk= 0, iat= -1,1012, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
igr1=1006,1007,
&end
#
# 66 ASN QB 67 LEU HN 4.11
&rst
ixpk= 0, nxpk= 0, iat= -1,1016, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
igr1=1006,1007,
&end
#
# 67 LEU HA 67 LEU HG 4.18
&rst
ixpk= 0, nxpk= 0, iat=1018,1023, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68, &end
#
# 67 LEU HA 67 LEU QD2 3.32
&rst
ixpk= 0, nxpk= 0, iat=1018, -1, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,
igr2=1029,1030,1031,
&end
#
# 67 LEU HA 68 PRO HD2 3.42
&rst
ixpk= 0, nxpk= 0, iat=1018,1036, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92, &end
#
# 67 LEU HA 68 PRO HD3 3.47
&rst
ixpk= 0, nxpk= 0, iat=1018,1037, r1= 1.30, r2= 1.80, r3= 3.47, r4= 3.97, &end
#
# 67 LEU HB2 67 LEU QD1 2.93
&rst
ixpk= 0, nxpk= 0, iat=1020, -1, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02,
igr2=1025,1026,1027,
&end
#
# 67 LEU HB2 68 PRO HD2 4.46
&rst
ixpk= 0, nxpk= 0, iat=1020,1036, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, &end
#
# 67 LEU HB2 68 PRO HD3 5.23
&rst
ixpk= 0, nxpk= 0, iat=1020,1037, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73, &end
#
# 67 LEU HB3 67 LEU QD2 3.05
&rst
ixpk= 0, nxpk= 0, iat=1021, -1, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,
igr2=1029,1030,1031,
&end
#
# 67 LEU HB3 68 PRO HD2 4.47
&rst
ixpk= 0, nxpk= 0, iat=1021,1036, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97, &end
#
# 67 LEU HB3 68 PRO HD3 4.53
&rst
ixpk= 0, nxpk= 0, iat=1021,1037, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03, &end
#
# 67 LEU HN 67 LEU HB2 2.97
&rst
ixpk= 0, nxpk= 0, iat=1016,1020, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 67 LEU HN 67 LEU HG 3.44
&rst
ixpk= 0, nxpk= 0, iat=1016,1023, r1= 1.30, r2= 1.80, r3= 3.44, r4= 3.94, &end
#
# 67 LEU HN 67 LEU QD1 4.10
&rst
ixpk= 0, nxpk= 0, iat=1016, -1, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
igr2=1025,1026,1027,
&end
#
# 67 LEU HN 67 LEU QD2 4.28
&rst
ixpk= 0, nxpk= 0, iat=1016, -1, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
igr2=1029,1030,1031,
&end
#
# 67 LEU QD1 68 PRO HD2 4.83
&rst
ixpk= 0, nxpk= 0, iat= -1,1036, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
igr1=1025,1026,1027,
&end
#
# 67 LEU QD2 68 PRO HD2 3.74
&rst
ixpk= 0, nxpk= 0, iat= -1,1036, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
igr1=1029,1030,1031,
&end
#
# 67 LEU QD2 68 PRO HD3 3.72
&rst
ixpk= 0, nxpk= 0, iat= -1,1037, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
igr1=1029,1030,1031,
&end
#
# 68 PRO HA 69 LYS HN 3.20
&rst
ixpk= 0, nxpk= 0, iat=1045,1049, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 68 PRO HB2 69 LYS HN 4.00
&rst
ixpk= 0, nxpk= 0, iat=1042,1049, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 68 PRO HB3 69 LYS HN 4.00
&rst
ixpk= 0, nxpk= 0, iat=1043,1049, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 68 PRO HG2 70 LEU QD2 3.79
&rst
ixpk= 0, nxpk= 0, iat=1039, -1, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,
igr2=1084,1085,1086,
&end
#
# 68 PRO QB 69 LYS HN 3.27
&rst
ixpk= 0, nxpk= 0, iat= -1,1049, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,
igr1=1042,1043,
&end
#
# 68 PRO QB 70 LEU QD2 4.18
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr1=1042,1043,
igr2=1084,1085,1086,
&end
#
# 69 LYS HA 69 LYS HG2 4.12
&rst
ixpk= 0, nxpk= 0, iat=1051,1056, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62, &end
#
# 69 LYS HA 69 LYS HG3 4.12
&rst
ixpk= 0, nxpk= 0, iat=1051,1057, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62, &end
#
# 69 LYS HA 69 LYS QD 4.23
&rst
ixpk= 0, nxpk= 0, iat=1051, -1, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25,
igr2=1059,1060,
&end
#
# 69 LYS HA 69 LYS QG 3.59
&rst
ixpk= 0, nxpk= 0, iat=1051, -1, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,
igr2=1056,1057,
&end
#
# 69 LYS HA 70 LEU HA 5.12
&rst
ixpk= 0, nxpk= 0, iat=1051,1073, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, &end
#
# 69 LYS HA 70 LEU HG 4.45
&rst
ixpk= 0, nxpk= 0, iat=1051,1078, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95, &end
#
# 69 LYS HA 70 LEU HN 3.23
&rst
ixpk= 0, nxpk= 0, iat=1051,1071, r1= 1.30, r2= 1.80, r3= 3.23, r4= 3.73, &end
#
# 69 LYS HA 93 LYS HA 3.78
&rst
ixpk= 0, nxpk= 0, iat=1051,1453, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28, &end
#
# 69 LYS HA 93 LYS HB2 5.29
&rst
ixpk= 0, nxpk= 0, iat=1051,1455, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79, &end
#
# 69 LYS HA 93 LYS HB3 4.22
&rst
ixpk= 0, nxpk= 0, iat=1051,1456, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 69 LYS HA 93 LYS HD2 4.71
&rst
ixpk= 0, nxpk= 0, iat=1051,1461, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21, &end
#
# 69 LYS HA 93 LYS HD3 4.71
&rst
ixpk= 0, nxpk= 0, iat=1051,1462, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21, &end
#
# 69 LYS HA 93 LYS QD 4.14
&rst
ixpk= 0, nxpk= 0, iat=1051, -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
igr2=1461,1462,
&end
#
# 69 LYS HA 93 LYS QE 5.14
&rst
ixpk= 0, nxpk= 0, iat=1051, -1, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,
igr2=1464,1465,
&end
#
# 69 LYS HA 94 LEU HA 5.50
&rst
ixpk= 0, nxpk= 0, iat=1051,1475, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 69 LYS HA 94 LEU QD2 4.28
&rst
ixpk= 0, nxpk= 0, iat=1051, -1, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
igr2=1486,1487,1488,
&end
#
# 69 LYS HB2 69 LYS QE 4.50
&rst
ixpk= 0, nxpk= 0, iat=1053, -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
igr2=1062,1063,
&end
#
# 69 LYS HB2 70 LEU HN 4.38
&rst
ixpk= 0, nxpk= 0, iat=1053,1071, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88, &end
#
# 69 LYS HB2 93 LYS HA 4.33
&rst
ixpk= 0, nxpk= 0, iat=1053,1453, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83, &end
#
# 69 LYS HB2 93 LYS QE 4.90
&rst
ixpk= 0, nxpk= 0, iat=1053, -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
igr2=1464,1465,
&end
#
# 69 LYS HG2 71 PRO HA 5.50
&rst
ixpk= 0, nxpk= 0, iat=1056,1100, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 69 LYS HG2 71 PRO HD3 4.13
&rst
ixpk= 0, nxpk= 0, iat=1056,1092, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63, &end
#
# 69 LYS HG2 71 PRO HG3 5.50
&rst
ixpk= 0, nxpk= 0, iat=1056,1095, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 69 LYS HG3 71 PRO HA 5.50
&rst
ixpk= 0, nxpk= 0, iat=1057,1100, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 69 LYS HG3 71 PRO HD3 4.13
&rst
ixpk= 0, nxpk= 0, iat=1057,1092, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63, &end
#
# 69 LYS HG3 71 PRO HG3 5.50
&rst
ixpk= 0, nxpk= 0, iat=1057,1095, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 69 LYS HN 69 LYS HB2 3.72
&rst
ixpk= 0, nxpk= 0, iat=1049,1053, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22, &end
#
# 69 LYS HN 69 LYS HB3 3.30
&rst
ixpk= 0, nxpk= 0, iat=1049,1054, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80, &end
#
# 69 LYS HN 69 LYS QD 5.07
&rst
ixpk= 0, nxpk= 0, iat=1049, -1, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
igr2=1059,1060,
&end
#
# 69 LYS HN 69 LYS QE 5.34
&rst
ixpk= 0, nxpk= 0, iat=1049, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2=1062,1063,
&end
#
# 69 LYS HN 69 LYS QG 4.40
&rst
ixpk= 0, nxpk= 0, iat=1049, -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
igr2=1056,1057,
&end
#
# 69 LYS HN 70 LEU QD2 4.90
&rst
ixpk= 0, nxpk= 0, iat=1049, -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
igr2=1084,1085,1086,
&end
#
# 69 LYS HN 93 LYS HD2 4.60
&rst
ixpk= 0, nxpk= 0, iat=1049,1461, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 69 LYS HN 93 LYS HD3 4.60
&rst
ixpk= 0, nxpk= 0, iat=1049,1462, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 69 LYS HN 93 LYS QD 3.86
&rst
ixpk= 0, nxpk= 0, iat=1049, -1, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,
igr2=1461,1462,
&end
#
# 69 LYS HN 93 LYS QE 5.34
&rst
ixpk= 0, nxpk= 0, iat=1049, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2=1464,1465,
&end
#
# 69 LYS QD 70 LEU HN 5.42
&rst
ixpk= 0, nxpk= 0, iat= -1,1071, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
igr1=1059,1060,
&end
#
# 69 LYS QD 93 LYS HA 5.06
&rst
ixpk= 0, nxpk= 0, iat= -1,1453, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
igr1=1059,1060,
&end
#
# 69 LYS QE 71 PRO HB3 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1,1098, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1=1062,1063,
&end
#
# 69 LYS QG 69 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=1056,1057,
igr2=1062,1063,
&end
#
# 69 LYS QG 70 LEU HN 3.88
&rst
ixpk= 0, nxpk= 0, iat= -1,1071, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,
igr1=1056,1057,
&end
#
# 69 LYS QG 71 PRO HA 4.81
&rst
ixpk= 0, nxpk= 0, iat= -1,1100, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr1=1056,1057,
&end
#
# 69 LYS QG 71 PRO HB3 4.59
&rst
ixpk= 0, nxpk= 0, iat= -1,1098, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
igr1=1056,1057,
&end
#
# 69 LYS QG 71 PRO HD2 4.26
&rst
ixpk= 0, nxpk= 0, iat= -1,1091, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
igr1=1056,1057,
&end
#
# 69 LYS QG 71 PRO HD3 3.56
&rst
ixpk= 0, nxpk= 0, iat= -1,1092, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,
igr1=1056,1057,
&end
#
# 70 LEU HA 70 LEU QD1 4.23
&rst
ixpk= 0, nxpk= 0, iat=1073, -1, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
igr2=1080,1081,1082,
&end
#
# 70 LEU HA 70 LEU QD2 3.36
&rst
ixpk= 0, nxpk= 0, iat=1073, -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
igr2=1084,1085,1086,
&end
#
# 70 LEU HA 71 PRO HB3 5.09
&rst
ixpk= 0, nxpk= 0, iat=1073,1098, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59, &end
#
# 70 LEU HA 71 PRO HD2 3.53
&rst
ixpk= 0, nxpk= 0, iat=1073,1091, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03, &end
#
# 70 LEU HA 71 PRO HD3 3.53
&rst
ixpk= 0, nxpk= 0, iat=1073,1092, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03, &end
#
# 70 LEU HA 71 PRO HG2 4.54
&rst
ixpk= 0, nxpk= 0, iat=1073,1094, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 70 LEU HA 71 PRO HG3 4.48
&rst
ixpk= 0, nxpk= 0, iat=1073,1095, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98, &end
#
# 70 LEU HA 72 LYS HN 4.70
&rst
ixpk= 0, nxpk= 0, iat=1073,1104, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 70 LEU HB2 70 LEU QD1 3.20
&rst
ixpk= 0, nxpk= 0, iat=1075, -1, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
igr2=1080,1081,1082,
&end
#
# 70 LEU HB2 71 PRO HA 5.50
&rst
ixpk= 0, nxpk= 0, iat=1075,1100, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 70 LEU HB2 71 PRO HD2 5.17
&rst
ixpk= 0, nxpk= 0, iat=1075,1091, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67, &end
#
# 70 LEU HB2 94 LEU HB3 4.82
&rst
ixpk= 0, nxpk= 0, iat=1075,1478, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32, &end
#
# 70 LEU HB2 94 LEU QD2 3.30
&rst
ixpk= 0, nxpk= 0, iat=1075, -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
igr2=1486,1487,1488,
&end
#
# 70 LEU HB3 70 LEU QD2 3.43
&rst
ixpk= 0, nxpk= 0, iat=1076, -1, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
igr2=1084,1085,1086,
&end
#
# 70 LEU HB3 94 LEU QD2 3.70
&rst
ixpk= 0, nxpk= 0, iat=1076, -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
igr2=1486,1487,1488,
&end
#
# 70 LEU HG 71 PRO HD2 5.50
&rst
ixpk= 0, nxpk= 0, iat=1078,1091, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 70 LEU HN 70 LEU HB2 3.87
&rst
ixpk= 0, nxpk= 0, iat=1071,1075, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37, &end
#
# 70 LEU HN 70 LEU HB3 4.16
&rst
ixpk= 0, nxpk= 0, iat=1071,1076, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66, &end
#
# 70 LEU HN 70 LEU HG 3.79
&rst
ixpk= 0, nxpk= 0, iat=1071,1078, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29, &end
#
# 70 LEU HN 70 LEU QD1 4.15
&rst
ixpk= 0, nxpk= 0, iat=1071, -1, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
igr2=1080,1081,1082,
&end
#
# 70 LEU HN 70 LEU QD2 4.48
&rst
ixpk= 0, nxpk= 0, iat=1071, -1, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
igr2=1084,1085,1086,
&end
#
# 70 LEU HN 71 PRO HA 4.88
&rst
ixpk= 0, nxpk= 0, iat=1071,1100, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38, &end
#
# 70 LEU HN 71 PRO HD3 4.86
&rst
ixpk= 0, nxpk= 0, iat=1071,1092, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36, &end
#
# 70 LEU HN 93 LYS HA 4.27
&rst
ixpk= 0, nxpk= 0, iat=1071,1453, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77, &end
#
# 70 LEU HN 93 LYS HB3 4.26
&rst
ixpk= 0, nxpk= 0, iat=1071,1456, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76, &end
#
# 70 LEU HN 94 LEU HG 4.63
&rst
ixpk= 0, nxpk= 0, iat=1071,1480, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, &end
#
# 70 LEU HN 94 LEU QD2 3.65
&rst
ixpk= 0, nxpk= 0, iat=1071, -1, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
igr2=1486,1487,1488,
&end
#
# 70 LEU QD1 72 LYS HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1104, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1=1080,1081,1082,
&end
#
# 70 LEU QD1 94 LEU QD2 2.89
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,
igr1=1080,1081,1082,
igr2=1486,1487,1488,
&end
#
# 70 LEU QD2 71 PRO HD2 4.14
&rst
ixpk= 0, nxpk= 0, iat= -1,1091, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
igr1=1084,1085,1086,
&end
#
# 70 LEU QD2 71 PRO HD3 4.49
&rst
ixpk= 0, nxpk= 0, iat= -1,1092, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr1=1084,1085,1086,
&end
#
# 70 LEU QD2 73 LEU HN 4.78
&rst
ixpk= 0, nxpk= 0, iat= -1,1126, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
igr1=1084,1085,1086,
&end
#
# 71 PRO HA 94 LEU HA 4.32
&rst
ixpk= 0, nxpk= 0, iat=1100,1475, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82, &end
#
# 71 PRO HA 94 LEU QD2 4.92
&rst
ixpk= 0, nxpk= 0, iat=1100, -1, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41,
igr2=1486,1487,1488,
&end
#
# 71 PRO HA 95 PRO HD2 4.09
&rst
ixpk= 0, nxpk= 0, iat=1100,1493, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59, &end
#
# 71 PRO HA 95 PRO HD3 4.09
&rst
ixpk= 0, nxpk= 0, iat=1100,1494, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59, &end
#
# 71 PRO HA 95 PRO QD 3.49
&rst
ixpk= 0, nxpk= 0, iat=1100, -1, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
igr2=1493,1494,
&end
#
# 71 PRO HA 95 PRO QG 3.56
&rst
ixpk= 0, nxpk= 0, iat=1100, -1, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,
igr2=1496,1497,
&end
#
# 71 PRO HA 96 ASN HD21 4.78
&rst
ixpk= 0, nxpk= 0, iat=1100,1515, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, &end
#
# 71 PRO HA 96 ASN HD22 4.78
&rst
ixpk= 0, nxpk= 0, iat=1100,1516, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, &end
#
# 71 PRO HA 96 ASN HN 5.01
&rst
ixpk= 0, nxpk= 0, iat=1100,1506, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51, &end
#
# 71 PRO HA 96 ASN QD2 4.07
&rst
ixpk= 0, nxpk= 0, iat=1100, -1, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,
igr2=1515,1516,
&end
#
# 71 PRO HB2 72 LYS HN 4.07
&rst
ixpk= 0, nxpk= 0, iat=1097,1104, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57, &end
#
# 71 PRO HB3 72 LYS HN 4.66
&rst
ixpk= 0, nxpk= 0, iat=1098,1104, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16, &end
#
# 71 PRO HB3 95 PRO QD 4.41
&rst
ixpk= 0, nxpk= 0, iat=1098, -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr2=1493,1494,
&end
#
# 71 PRO HB3 96 ASN HD21 5.50
&rst
ixpk= 0, nxpk= 0, iat=1098,1515, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 71 PRO HB3 96 ASN HD22 5.50
&rst
ixpk= 0, nxpk= 0, iat=1098,1516, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 71 PRO HB3 96 ASN QD2 4.73
&rst
ixpk= 0, nxpk= 0, iat=1098, -1, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
igr2=1515,1516,
&end
#
# 71 PRO HD2 72 LYS HB2 5.16
&rst
ixpk= 0, nxpk= 0, iat=1091,1108, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66, &end
#
# 71 PRO HD2 72 LYS HN 4.34
&rst
ixpk= 0, nxpk= 0, iat=1091,1104, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84, &end
#
# 71 PRO HD3 72 LYS HN 4.59
&rst
ixpk= 0, nxpk= 0, iat=1092,1104, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 71 PRO HG2 72 LYS HB2 4.63
&rst
ixpk= 0, nxpk= 0, iat=1094,1108, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, &end
#
# 71 PRO HG2 72 LYS HG2 4.25
&rst
ixpk= 0, nxpk= 0, iat=1094,1111, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75, &end
#
# 71 PRO HG2 72 LYS HG3 4.78
&rst
ixpk= 0, nxpk= 0, iat=1094,1112, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, &end
#
# 71 PRO HG2 72 LYS HN 4.72
&rst
ixpk= 0, nxpk= 0, iat=1094,1104, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22, &end
#
# 71 PRO HG3 72 LYS HG2 5.50
&rst
ixpk= 0, nxpk= 0, iat=1095,1111, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 71 PRO HG3 72 LYS HG3 4.67
&rst
ixpk= 0, nxpk= 0, iat=1095,1112, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, &end
#
# 71 PRO HG3 72 LYS HN 4.30
&rst
ixpk= 0, nxpk= 0, iat=1095,1104, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80, &end
#
# 72 LYS HA 72 LYS HG2 3.44
&rst
ixpk= 0, nxpk= 0, iat=1106,1111, r1= 1.30, r2= 1.80, r3= 3.44, r4= 3.94, &end
#
# 72 LYS HA 72 LYS HG3 3.73
&rst
ixpk= 0, nxpk= 0, iat=1106,1112, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23, &end
#
# 72 LYS HA 72 LYS QE 4.06
&rst
ixpk= 0, nxpk= 0, iat=1106, -1, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
igr2=1117,1118,
&end
#
# 72 LYS HA 96 ASN QD2 4.57
&rst
ixpk= 0, nxpk= 0, iat=1106, -1, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
igr2=1515,1516,
&end
#
# 72 LYS HB2 73 LEU HN 3.93
&rst
ixpk= 0, nxpk= 0, iat=1108,1126, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43, &end
#
# 72 LYS HB3 72 LYS QE 3.82
&rst
ixpk= 0, nxpk= 0, iat=1109, -1, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,
igr2=1117,1118,
&end
#
# 72 LYS HB3 73 LEU HN 4.20
&rst
ixpk= 0, nxpk= 0, iat=1109,1126, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 72 LYS HG2 72 LYS QE 3.03
&rst
ixpk= 0, nxpk= 0, iat=1111, -1, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,
igr2=1117,1118,
&end
#
# 72 LYS HG3 72 LYS QE 3.54
&rst
ixpk= 0, nxpk= 0, iat=1112, -1, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47,
igr2=1117,1118,
&end
#
# 72 LYS HN 72 LYS HB2 3.60
&rst
ixpk= 0, nxpk= 0, iat=1104,1108, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10, &end
#
# 72 LYS HN 72 LYS HB3 3.67
&rst
ixpk= 0, nxpk= 0, iat=1104,1109, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17, &end
#
# 72 LYS HN 72 LYS HG2 4.28
&rst
ixpk= 0, nxpk= 0, iat=1104,1111, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78, &end
#
# 72 LYS HN 72 LYS HG3 3.98
&rst
ixpk= 0, nxpk= 0, iat=1104,1112, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48, &end
#
# 72 LYS HN 72 LYS QE 5.34
&rst
ixpk= 0, nxpk= 0, iat=1104, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2=1117,1118,
&end
#
# 72 LYS HN 73 LEU HN 3.37
&rst
ixpk= 0, nxpk= 0, iat=1104,1126, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87, &end
#
# 72 LYS HN 73 LEU QD1 5.50
&rst
ixpk= 0, nxpk= 0, iat=1104, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2=1135,1136,1137,
&end
#
# 72 LYS QD 73 LEU HN 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1,1126, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1=1114,1115,
&end
#
# 73 LEU HA 73 LEU QD1 3.10
&rst
ixpk= 0, nxpk= 0, iat=1128, -1, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,
igr2=1135,1136,1137,
&end
#
# 73 LEU HA 73 LEU QD2 4.11
&rst
ixpk= 0, nxpk= 0, iat=1128, -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
igr2=1139,1140,1141,
&end
#
# 73 LEU HA 74 LYS QB 4.93
&rst
ixpk= 0, nxpk= 0, iat=1128, -1, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03,
igr2=1149,1150,
&end
#
# 73 LEU HA 74 LYS QG 4.39
&rst
ixpk= 0, nxpk= 0, iat=1128, -1, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,
igr2=1152,1153,
&end
#
# 73 LEU HA 75 LYS HB3 5.50
&rst
ixpk= 0, nxpk= 0, iat=1128,1172, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 73 LEU HA 75 LYS HN 4.00
&rst
ixpk= 0, nxpk= 0, iat=1128,1167, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 73 LEU HA 94 LEU QD2 5.36
&rst
ixpk= 0, nxpk= 0, iat=1128, -1, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,
igr2=1486,1487,1488,
&end
#
# 73 LEU HB2 94 LEU QD2 3.95
&rst
ixpk= 0, nxpk= 0, iat=1130, -1, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr2=1486,1487,1488,
&end
#
# 73 LEU HB3 94 LEU QD2 3.95
&rst
ixpk= 0, nxpk= 0, iat=1131, -1, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr2=1486,1487,1488,
&end
#
# 73 LEU HG 74 LYS HN 4.21
&rst
ixpk= 0, nxpk= 0, iat=1133,1145, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71, &end
#
# 73 LEU HG 75 LYS HN 3.73
&rst
ixpk= 0, nxpk= 0, iat=1133,1167, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23, &end
#
# 73 LEU HN 73 LEU HB2 3.61
&rst
ixpk= 0, nxpk= 0, iat=1126,1130, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11, &end
#
# 73 LEU HN 73 LEU HB3 3.61
&rst
ixpk= 0, nxpk= 0, iat=1126,1131, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11, &end
#
# 73 LEU HN 73 LEU QD1 3.87
&rst
ixpk= 0, nxpk= 0, iat=1126, -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
igr2=1135,1136,1137,
&end
#
# 73 LEU HN 73 LEU QD2 5.15
&rst
ixpk= 0, nxpk= 0, iat=1126, -1, r1= 1.30, r2= 1.80, r3= 6.18, r4= 6.68,
igr2=1139,1140,1141,
&end
#
# 73 LEU HN 94 LEU QD2 4.83
&rst
ixpk= 0, nxpk= 0, iat=1126, -1, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
igr2=1486,1487,1488,
&end
#
# 73 LEU QB 73 LEU QD1 2.91
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
igr1=1130,1131,
igr2=1135,1136,1137,
&end
#
# 73 LEU QB 73 LEU QD2 3.20
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,
igr1=1130,1131,
igr2=1139,1140,1141,
&end
#
# 73 LEU QB 94 LEU QD2 3.18
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,
igr1=1130,1131,
igr2=1486,1487,1488,
&end
#
# 73 LEU QD1 74 LYS HN 4.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1145, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1=1135,1136,1137,
&end
#
# 73 LEU QD1 75 LYS HN 4.21
&rst
ixpk= 0, nxpk= 0, iat= -1,1167, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
igr1=1135,1136,1137,
&end
#
# 73 LEU QD2 74 LYS HN 4.74
&rst
ixpk= 0, nxpk= 0, iat= -1,1145, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
igr1=1139,1140,1141,
&end
#
# 73 LEU QD2 75 LYS HN 4.40
&rst
ixpk= 0, nxpk= 0, iat= -1,1167, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
igr1=1139,1140,1141,
&end
#
# 73 LEU QD2 76 LEU HA 4.36
&rst
ixpk= 0, nxpk= 0, iat= -1,1191, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr1=1139,1140,1141,
&end
#
# 73 LEU QD2 76 LEU HN 5.11
&rst
ixpk= 0, nxpk= 0, iat= -1,1189, r1= 1.30, r2= 1.80, r3= 6.14, r4= 6.64,
igr1=1139,1140,1141,
&end
#
# 73 LEU QD2 77 GLU HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1208, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1=1139,1140,1141,
&end
#
# 74 LYS HA 74 LYS HG2 4.06
&rst
ixpk= 0, nxpk= 0, iat=1147,1152, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56, &end
#
# 74 LYS HA 74 LYS HG3 4.06
&rst
ixpk= 0, nxpk= 0, iat=1147,1153, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56, &end
#
# 74 LYS HA 74 LYS QG 3.57
&rst
ixpk= 0, nxpk= 0, iat=1147, -1, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,
igr2=1152,1153,
&end
#
# 74 LYS HA 97 LEU HA 3.54
&rst
ixpk= 0, nxpk= 0, iat=1147,1522, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04, &end
#
# 74 LYS HA 97 LEU QD1 3.94
&rst
ixpk= 0, nxpk= 0, iat=1147, -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
igr2=1529,1530,1531,
&end
#
# 74 LYS HA 98 THR HN 3.95
&rst
ixpk= 0, nxpk= 0, iat=1147,1539, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45, &end
#
# 74 LYS HA 98 THR QG2 4.81
&rst
ixpk= 0, nxpk= 0, iat=1147, -1, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr2=1545,1546,1547,
&end
#
# 74 LYS HA 99 HIS HN 4.73
&rst
ixpk= 0, nxpk= 0, iat=1147,1553, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, &end
#
# 74 LYS HN 74 LYS HG2 4.39
&rst
ixpk= 0, nxpk= 0, iat=1145,1152, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89, &end
#
# 74 LYS HN 74 LYS HG3 4.39
&rst
ixpk= 0, nxpk= 0, iat=1145,1153, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89, &end
#
# 74 LYS HN 74 LYS QB 3.63
&rst
ixpk= 0, nxpk= 0, iat=1145, -1, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,
igr2=1149,1150,
&end
#
# 74 LYS HN 74 LYS QD 4.64
&rst
ixpk= 0, nxpk= 0, iat=1145, -1, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,
igr2=1155,1156,
&end
#
# 74 LYS HN 74 LYS QG 3.84
&rst
ixpk= 0, nxpk= 0, iat=1145, -1, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,
igr2=1152,1153,
&end
#
# 74 LYS HN 75 LYS HN 3.40
&rst
ixpk= 0, nxpk= 0, iat=1145,1167, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90, &end
#
# 74 LYS QB 74 LYS QD 3.16
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,
igr1=1149,1150,
igr2=1155,1156,
&end
#
# 74 LYS QB 74 LYS QE 3.39
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,
igr1=1149,1150,
igr2=1158,1159,
&end
#
# 74 LYS QB 75 LYS HN 4.22
&rst
ixpk= 0, nxpk= 0, iat= -1,1167, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr1=1149,1150,
&end
#
# 74 LYS QB 97 LEU HA 4.29
&rst
ixpk= 0, nxpk= 0, iat= -1,1522, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
igr1=1149,1150,
&end
#
# 74 LYS QB 98 THR HB 4.90
&rst
ixpk= 0, nxpk= 0, iat= -1,1543, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
igr1=1149,1150,
&end
#
# 74 LYS QB 98 THR HN 4.95
&rst
ixpk= 0, nxpk= 0, iat= -1,1539, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
igr1=1149,1150,
&end
#
# 74 LYS QB 98 THR QG2 3.93
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr1=1149,1150,
igr2=1545,1546,1547,
&end
#
# 74 LYS QE 98 THR HB 4.81
&rst
ixpk= 0, nxpk= 0, iat= -1,1543, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr1=1158,1159,
&end
#
# 74 LYS QE 98 THR QG2 3.57
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31,
igr1=1158,1159,
igr2=1545,1546,1547,
&end
#
# 74 LYS QG 74 LYS QE 3.32
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
igr1=1152,1153,
igr2=1158,1159,
&end
#
# 74 LYS QG 75 LYS HN 4.45
&rst
ixpk= 0, nxpk= 0, iat= -1,1167, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,
igr1=1152,1153,
&end
#
# 74 LYS QG 97 LEU HA 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1,1522, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1=1152,1153,
&end
#
# 74 LYS QG 98 THR HN 4.32
&rst
ixpk= 0, nxpk= 0, iat= -1,1539, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
igr1=1152,1153,
&end
#
# 74 LYS QG 98 THR QG2 4.22
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
igr1=1152,1153,
igr2=1545,1546,1547,
&end
#
# 74 LYS QG 99 HIS HN 4.90
&rst
ixpk= 0, nxpk= 0, iat= -1,1553, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
igr1=1152,1153,
&end
#
# 75 LYS HA 75 LYS HD2 4.92
&rst
ixpk= 0, nxpk= 0, iat=1169,1177, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42, &end
#
# 75 LYS HA 75 LYS HD3 4.92
&rst
ixpk= 0, nxpk= 0, iat=1169,1178, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42, &end
#
# 75 LYS HA 75 LYS HG2 4.19
&rst
ixpk= 0, nxpk= 0, iat=1169,1174, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69, &end
#
# 75 LYS HA 75 LYS HG3 4.19
&rst
ixpk= 0, nxpk= 0, iat=1169,1175, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69, &end
#
# 75 LYS HA 75 LYS QD 4.27
&rst
ixpk= 0, nxpk= 0, iat=1169, -1, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
igr2=1177,1178,
&end
#
# 75 LYS HA 76 LEU HN 3.23
&rst
ixpk= 0, nxpk= 0, iat=1169,1189, r1= 1.30, r2= 1.80, r3= 3.23, r4= 3.73, &end
#
# 75 LYS HA 97 LEU QD1 4.01
&rst
ixpk= 0, nxpk= 0, iat=1169, -1, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
igr2=1529,1530,1531,
&end
#
# 75 LYS HA 99 HIS HB2 4.15
&rst
ixpk= 0, nxpk= 0, iat=1169,1557, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65, &end
#
# 75 LYS HA 99 HIS HB3 4.23
&rst
ixpk= 0, nxpk= 0, iat=1169,1558, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73, &end
#
# 75 LYS HA 99 HIS HN 3.97
&rst
ixpk= 0, nxpk= 0, iat=1169,1553, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47, &end
#
# 75 LYS HB2 75 LYS HD2 3.95
&rst
ixpk= 0, nxpk= 0, iat=1171,1177, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45, &end
#
# 75 LYS HB2 75 LYS HD3 3.95
&rst
ixpk= 0, nxpk= 0, iat=1171,1178, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45, &end
#
# 75 LYS HB2 75 LYS HE2 4.83
&rst
ixpk= 0, nxpk= 0, iat=1171,1180, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33, &end
#
# 75 LYS HB2 75 LYS HE3 4.83
&rst
ixpk= 0, nxpk= 0, iat=1171,1181, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33, &end
#
# 75 LYS HB2 75 LYS QD 3.35
&rst
ixpk= 0, nxpk= 0, iat=1171, -1, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,
igr2=1177,1178,
&end
#
# 75 LYS HB2 75 LYS QE 4.09
&rst
ixpk= 0, nxpk= 0, iat=1171, -1, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
igr2=1180,1181,
&end
#
# 75 LYS HB2 76 LEU HN 4.68
&rst
ixpk= 0, nxpk= 0, iat=1171,1189, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18, &end
#
# 75 LYS HB2 99 HIS HB2 4.37
&rst
ixpk= 0, nxpk= 0, iat=1171,1557, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87, &end
#
# 75 LYS HB2 99 HIS HB3 4.41
&rst
ixpk= 0, nxpk= 0, iat=1171,1558, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, &end
#
# 75 LYS HB2 99 HIS HD2 5.50
&rst
ixpk= 0, nxpk= 0, iat=1171,1566, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 75 LYS HB2 99 HIS HN 4.53
&rst
ixpk= 0, nxpk= 0, iat=1171,1553, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03, &end
#
# 75 LYS HB3 75 LYS HE2 5.22
&rst
ixpk= 0, nxpk= 0, iat=1172,1180, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72, &end
#
# 75 LYS HB3 75 LYS HE3 5.22
&rst
ixpk= 0, nxpk= 0, iat=1172,1181, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72, &end
#
# 75 LYS HB3 75 LYS QE 4.42
&rst
ixpk= 0, nxpk= 0, iat=1172, -1, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
igr2=1180,1181,
&end
#
# 75 LYS HB3 76 LEU HN 5.04
&rst
ixpk= 0, nxpk= 0, iat=1172,1189, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54, &end
#
# 75 LYS HD2 99 HIS HB2 4.76
&rst
ixpk= 0, nxpk= 0, iat=1177,1557, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26, &end
#
# 75 LYS HD2 99 HIS HB3 4.88
&rst
ixpk= 0, nxpk= 0, iat=1177,1558, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38, &end
#
# 75 LYS HD3 99 HIS HB2 4.76
&rst
ixpk= 0, nxpk= 0, iat=1178,1557, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26, &end
#
# 75 LYS HD3 99 HIS HB3 4.88
&rst
ixpk= 0, nxpk= 0, iat=1178,1558, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38, &end
#
# 75 LYS HG2 76 LEU HN 4.75
&rst
ixpk= 0, nxpk= 0, iat=1174,1189, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, &end
#
# 75 LYS HG2 99 HIS HB2 4.66
&rst
ixpk= 0, nxpk= 0, iat=1174,1557, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16, &end
#
# 75 LYS HG2 99 HIS HB3 4.54
&rst
ixpk= 0, nxpk= 0, iat=1174,1558, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 75 LYS HG3 76 LEU HN 4.75
&rst
ixpk= 0, nxpk= 0, iat=1175,1189, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, &end
#
# 75 LYS HG3 99 HIS HB2 4.66
&rst
ixpk= 0, nxpk= 0, iat=1175,1557, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16, &end
#
# 75 LYS HG3 99 HIS HB3 4.54
&rst
ixpk= 0, nxpk= 0, iat=1175,1558, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 75 LYS HN 75 LYS HB3 3.54
&rst
ixpk= 0, nxpk= 0, iat=1167,1172, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04, &end
#
# 75 LYS HN 75 LYS QG 4.61
&rst
ixpk= 0, nxpk= 0, iat=1167, -1, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67,
igr2=1174,1175,
&end
#
# 75 LYS HN 76 LEU HN 4.61
&rst
ixpk= 0, nxpk= 0, iat=1167,1189, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 75 LYS HN 97 LEU QD1 4.62
&rst
ixpk= 0, nxpk= 0, iat=1167, -1, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,
igr2=1529,1530,1531,
&end
#
# 75 LYS HN 99 HIS HB2 4.91
&rst
ixpk= 0, nxpk= 0, iat=1167,1557, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41, &end
#
# 75 LYS QD 77 GLU QG 4.76
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr1=1177,1178,
igr2=1215,1216,
&end
#
# 75 LYS QD 99 HIS HB2 4.12
&rst
ixpk= 0, nxpk= 0, iat= -1,1557, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
igr1=1177,1178,
&end
#
# 75 LYS QD 99 HIS HD2 4.68
&rst
ixpk= 0, nxpk= 0, iat= -1,1566, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
igr1=1177,1178,
&end
#
# 75 LYS QD 99 HIS HE1 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1,1562, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1=1177,1178,
&end
#
# 75 LYS QE 99 HIS HD2 5.33
&rst
ixpk= 0, nxpk= 0, iat= -1,1566, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
igr1=1180,1181,
&end
#
# 75 LYS QG 75 LYS QE 3.04
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,
igr1=1174,1175,
igr2=1180,1181,
&end
#
# 75 LYS QG 76 LEU HN 3.90
&rst
ixpk= 0, nxpk= 0, iat= -1,1189, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
igr1=1174,1175,
&end
#
# 75 LYS QG 77 GLU QG 4.76
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr1=1174,1175,
igr2=1215,1216,
&end
#
# 75 LYS QG 99 HIS HB2 4.04
&rst
ixpk= 0, nxpk= 0, iat= -1,1557, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
igr1=1174,1175,
&end
#
# 75 LYS QG 99 HIS HB3 3.96
&rst
ixpk= 0, nxpk= 0, iat= -1,1558, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
igr1=1174,1175,
&end
#
# 76 LEU HA 76 LEU QD1 3.27
&rst
ixpk= 0, nxpk= 0, iat=1191, -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
igr2=1198,1199,1200,
&end
#
# 76 LEU HA 76 LEU QD2 3.94
&rst
ixpk= 0, nxpk= 0, iat=1191, -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
igr2=1202,1203,1204,
&end
#
# 76 LEU HA 77 GLU HB2 4.64
&rst
ixpk= 0, nxpk= 0, iat=1191,1212, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14, &end
#
# 76 LEU HA 77 GLU HN 3.40
&rst
ixpk= 0, nxpk= 0, iat=1191,1208, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90, &end
#
# 76 LEU HA 97 LEU QD1 4.83
&rst
ixpk= 0, nxpk= 0, iat=1191, -1, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
igr2=1529,1530,1531,
&end
#
# 76 LEU HB2 97 LEU QD1 3.85
&rst
ixpk= 0, nxpk= 0, iat=1193, -1, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
igr2=1529,1530,1531,
&end
#
# 76 LEU HB3 97 LEU QD1 3.85
&rst
ixpk= 0, nxpk= 0, iat=1194, -1, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
igr2=1529,1530,1531,
&end
#
# 76 LEU HG 77 GLU HN 4.23
&rst
ixpk= 0, nxpk= 0, iat=1196,1208, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73, &end
#
# 76 LEU HG 78 LEU HN 4.80
&rst
ixpk= 0, nxpk= 0, iat=1196,1223, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30, &end
#
# 76 LEU HG 78 LEU QB 4.42
&rst
ixpk= 0, nxpk= 0, iat=1196, -1, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
igr2=1227,1228,
&end
#
# 76 LEU HN 100 LEU HA 4.19
&rst
ixpk= 0, nxpk= 0, iat=1189,1572, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69, &end
#
# 76 LEU HN 76 LEU HB2 3.84
&rst
ixpk= 0, nxpk= 0, iat=1189,1193, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34, &end
#
# 76 LEU HN 76 LEU HB3 3.84
&rst
ixpk= 0, nxpk= 0, iat=1189,1194, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34, &end
#
# 76 LEU HN 76 LEU HG 5.20
&rst
ixpk= 0, nxpk= 0, iat=1189,1196, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70, &end
#
# 76 LEU HN 76 LEU QB 3.34
&rst
ixpk= 0, nxpk= 0, iat=1189, -1, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,
igr2=1193,1194,
&end
#
# 76 LEU HN 76 LEU QD1 4.34
&rst
ixpk= 0, nxpk= 0, iat=1189, -1, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,
igr2=1198,1199,1200,
&end
#
# 76 LEU HN 76 LEU QD2 4.74
&rst
ixpk= 0, nxpk= 0, iat=1189, -1, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
igr2=1202,1203,1204,
&end
#
# 76 LEU HN 77 GLU HN 4.63
&rst
ixpk= 0, nxpk= 0, iat=1189,1208, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, &end
#
# 76 LEU HN 97 LEU QD1 3.62
&rst
ixpk= 0, nxpk= 0, iat=1189, -1, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,
igr2=1529,1530,1531,
&end
#
# 76 LEU HN 99 HIS HB2 4.46
&rst
ixpk= 0, nxpk= 0, iat=1189,1557, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, &end
#
# 76 LEU HN 99 HIS HB3 4.61
&rst
ixpk= 0, nxpk= 0, iat=1189,1558, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 76 LEU HN 99 HIS HN 4.51
&rst
ixpk= 0, nxpk= 0, iat=1189,1553, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01, &end
#
# 76 LEU QB 100 LEU HA 4.04
&rst
ixpk= 0, nxpk= 0, iat= -1,1572, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
igr1=1193,1194,
&end
#
# 76 LEU QB 76 LEU QD1 3.40
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
igr1=1193,1194,
igr2=1198,1199,1200,
&end
#
# 76 LEU QB 97 LEU QD1 3.07
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,
igr1=1193,1194,
igr2=1529,1530,1531,
&end
#
# 76 LEU QD1 77 GLU HN 3.44
&rst
ixpk= 0, nxpk= 0, iat= -1,1208, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
igr1=1198,1199,1200,
&end
#
# 77 GLU HB2 78 LEU HN 4.88
&rst
ixpk= 0, nxpk= 0, iat=1212,1223, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38, &end
#
# 77 GLU HB3 79 SER HN 5.50
&rst
ixpk= 0, nxpk= 0, iat=1213,1242, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 77 GLU HN 77 GLU HB2 3.82
&rst
ixpk= 0, nxpk= 0, iat=1208,1212, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32, &end
#
# 77 GLU HN 77 GLU HB3 4.04
&rst
ixpk= 0, nxpk= 0, iat=1208,1213, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, &end
#
# 77 GLU HN 77 GLU QG 4.53
&rst
ixpk= 0, nxpk= 0, iat=1208, -1, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
igr2=1215,1216,
&end
#
# 77 GLU QG 101 ASN QB 4.69
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41,
igr1=1215,1216,
igr2=1593,1594,
&end
#
# 78 LEU HA 78 LEU QD1 4.10
&rst
ixpk= 0, nxpk= 0, iat=1225, -1, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
igr2=1232,1233,1234,
&end
#
# 78 LEU HA 78 LEU QD2 3.12
&rst
ixpk= 0, nxpk= 0, iat=1225, -1, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,
igr2=1236,1237,1238,
&end
#
# 78 LEU HA 81 ASN HD21 4.99
&rst
ixpk= 0, nxpk= 0, iat=1225,1277, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49, &end
#
# 78 LEU HA 81 ASN HD22 4.99
&rst
ixpk= 0, nxpk= 0, iat=1225,1278, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49, &end
#
# 78 LEU HA 81 ASN QD2 4.29
&rst
ixpk= 0, nxpk= 0, iat=1225, -1, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
igr2=1277,1278,
&end
#
# 78 LEU HB2 79 SER HN 5.18
&rst
ixpk= 0, nxpk= 0, iat=1227,1242, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68, &end
#
# 78 LEU HB3 79 SER HN 5.18
&rst
ixpk= 0, nxpk= 0, iat=1228,1242, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68, &end
#
# 78 LEU HN 101 ASN HB2 4.22
&rst
ixpk= 0, nxpk= 0, iat=1223,1593, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 78 LEU HN 101 ASN HB3 4.22
&rst
ixpk= 0, nxpk= 0, iat=1223,1594, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 78 LEU HN 101 ASN HN 4.26
&rst
ixpk= 0, nxpk= 0, iat=1223,1589, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76, &end
#
# 78 LEU HN 101 ASN QB 3.71
&rst
ixpk= 0, nxpk= 0, iat=1223, -1, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
igr2=1593,1594,
&end
#
# 78 LEU HN 78 LEU HB2 4.11
&rst
ixpk= 0, nxpk= 0, iat=1223,1227, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 78 LEU HN 78 LEU HB3 4.11
&rst
ixpk= 0, nxpk= 0, iat=1223,1228, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 78 LEU HN 78 LEU HG 4.30
&rst
ixpk= 0, nxpk= 0, iat=1223,1230, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80, &end
#
# 78 LEU HN 78 LEU QB 3.55
&rst
ixpk= 0, nxpk= 0, iat=1223, -1, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,
igr2=1227,1228,
&end
#
# 78 LEU HN 78 LEU QD1 4.38
&rst
ixpk= 0, nxpk= 0, iat=1223, -1, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr2=1232,1233,1234,
&end
#
# 78 LEU HN 78 LEU QD2 4.56
&rst
ixpk= 0, nxpk= 0, iat=1223, -1, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
igr2=1236,1237,1238,
&end
#
# 78 LEU HN 79 SER HN 4.27
&rst
ixpk= 0, nxpk= 0, iat=1223,1242, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77, &end
#
# 78 LEU QB 78 LEU QD1 3.16
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,
igr1=1227,1228,
igr2=1232,1233,1234,
&end
#
# 78 LEU QB 78 LEU QD2 3.23
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,
igr1=1227,1228,
igr2=1236,1237,1238,
&end
#
# 78 LEU QD2 79 SER HN 4.34
&rst
ixpk= 0, nxpk= 0, iat= -1,1242, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,
igr1=1236,1237,1238,
&end
#
# 78 LEU QD2 81 ASN HD21 4.17
&rst
ixpk= 0, nxpk= 0, iat= -1,1277, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
igr1=1236,1237,1238,
&end
#
# 78 LEU QD2 81 ASN HD22 4.17
&rst
ixpk= 0, nxpk= 0, iat= -1,1278, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
igr1=1236,1237,1238,
&end
#
# 78 LEU QD2 81 ASN QD2 3.64
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
igr1=1236,1237,1238,
igr2=1277,1278,
&end
#
# 79 SER HA 105 ASN HD21 4.62
&rst
ixpk= 0, nxpk= 0, iat=1244,1649, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12, &end
#
# 79 SER HA 105 ASN HD22 4.62
&rst
ixpk= 0, nxpk= 0, iat=1244,1650, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12, &end
#
# 79 SER HA 80 GLU HA 4.59
&rst
ixpk= 0, nxpk= 0, iat=1244,1255, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 79 SER HA 80 GLU HN 3.48
&rst
ixpk= 0, nxpk= 0, iat=1244,1253, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98, &end
#
# 79 SER HA 80 GLU QG 4.62
&rst
ixpk= 0, nxpk= 0, iat=1244, -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
igr2=1260,1261,
&end
#
# 79 SER HA 81 ASN HN 4.07
&rst
ixpk= 0, nxpk= 0, iat=1244,1268, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57, &end
#
# 79 SER HN 101 ASN QB 5.34
&rst
ixpk= 0, nxpk= 0, iat=1242, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2=1593,1594,
&end
#
# 79 SER HN 79 SER QB 3.53
&rst
ixpk= 0, nxpk= 0, iat=1242, -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
igr2=1246,1247,
&end
#
# 79 SER HN 80 GLU QG 4.91
&rst
ixpk= 0, nxpk= 0, iat=1242, -1, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
igr2=1260,1261,
&end
#
# 79 SER HN 81 ASN HD21 5.50
&rst
ixpk= 0, nxpk= 0, iat=1242,1277, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 79 SER HN 81 ASN HD22 5.50
&rst
ixpk= 0, nxpk= 0, iat=1242,1278, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 79 SER QB 105 ASN QD2 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1=1246,1247,
igr2=1649,1650,
&end
#
# 79 SER QB 80 GLU HB2 4.55
&rst
ixpk= 0, nxpk= 0, iat= -1,1257, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,
igr1=1246,1247,
&end
#
# 79 SER QB 80 GLU HG2 4.17
&rst
ixpk= 0, nxpk= 0, iat= -1,1260, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
igr1=1246,1247,
&end
#
# 79 SER QB 80 GLU HG3 4.17
&rst
ixpk= 0, nxpk= 0, iat= -1,1261, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
igr1=1246,1247,
&end
#
# 79 SER QB 80 GLU HN 3.56
&rst
ixpk= 0, nxpk= 0, iat= -1,1253, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,
igr1=1246,1247,
&end
#
# 79 SER QB 80 GLU QG 3.44
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,
igr1=1246,1247,
igr2=1260,1261,
&end
#
# 80 GLU HA 80 GLU HG2 4.18
&rst
ixpk= 0, nxpk= 0, iat=1255,1260, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68, &end
#
# 80 GLU HA 80 GLU HG3 4.18
&rst
ixpk= 0, nxpk= 0, iat=1255,1261, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68, &end
#
# 80 GLU HA 80 GLU QG 3.41
&rst
ixpk= 0, nxpk= 0, iat=1255, -1, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,
igr2=1260,1261,
&end
#
# 80 GLU HA 81 ASN HN 3.29
&rst
ixpk= 0, nxpk= 0, iat=1255,1268, r1= 1.30, r2= 1.80, r3= 3.29, r4= 3.79, &end
#
# 80 GLU HB2 81 ASN HN 4.30
&rst
ixpk= 0, nxpk= 0, iat=1257,1268, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80, &end
#
# 80 GLU HB3 81 ASN HN 4.56
&rst
ixpk= 0, nxpk= 0, iat=1258,1268, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06, &end
#
# 80 GLU HN 104 GLY HA2 4.47
&rst
ixpk= 0, nxpk= 0, iat=1253,1635, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97, &end
#
# 80 GLU HN 104 GLY HA3 4.34
&rst
ixpk= 0, nxpk= 0, iat=1253,1636, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84, &end
#
# 80 GLU HN 105 ASN HD21 5.01
&rst
ixpk= 0, nxpk= 0, iat=1253,1649, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51, &end
#
# 80 GLU HN 105 ASN HD22 5.01
&rst
ixpk= 0, nxpk= 0, iat=1253,1650, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51, &end
#
# 80 GLU HN 105 ASN QD2 4.21
&rst
ixpk= 0, nxpk= 0, iat=1253, -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
igr2=1649,1650,
&end
#
# 80 GLU HN 80 GLU HG2 4.44
&rst
ixpk= 0, nxpk= 0, iat=1253,1260, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94, &end
#
# 80 GLU HN 80 GLU HG3 4.44
&rst
ixpk= 0, nxpk= 0, iat=1253,1261, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94, &end
#
# 80 GLU HN 80 GLU QG 3.78
&rst
ixpk= 0, nxpk= 0, iat=1253, -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
igr2=1260,1261,
&end
#
# 80 GLU HN 81 ASN HN 3.47
&rst
ixpk= 0, nxpk= 0, iat=1253,1268, r1= 1.30, r2= 1.80, r3= 3.47, r4= 3.97, &end
#
# 80 GLU QG 81 ASN HN 5.19
&rst
ixpk= 0, nxpk= 0, iat= -1,1268, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33,
igr1=1260,1261,
&end
#
# 81 ASN HA 82 ARG QD 4.85
&rst
ixpk= 0, nxpk= 0, iat=1270, -1, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
igr2=1292,1293,
&end
#
# 81 ASN HA 82 ARG QG 4.22
&rst
ixpk= 0, nxpk= 0, iat=1270, -1, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr2=1289,1290,
&end
#
# 81 ASN HB2 82 ARG HN 3.94
&rst
ixpk= 0, nxpk= 0, iat=1272,1282, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44, &end
#
# 81 ASN HB2 83 ILE HB 4.66
&rst
ixpk= 0, nxpk= 0, iat=1272,1310, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16, &end
#
# 81 ASN HB2 83 ILE HN 4.16
&rst
ixpk= 0, nxpk= 0, iat=1272,1306, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66, &end
#
# 81 ASN HB2 83 ILE QD1 3.81
&rst
ixpk= 0, nxpk= 0, iat=1272, -1, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
igr2=1319,1320,1321,
&end
#
# 81 ASN HB3 105 ASN QD2 4.97
&rst
ixpk= 0, nxpk= 0, iat=1273, -1, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr2=1649,1650,
&end
#
# 81 ASN HB3 82 ARG HN 3.57
&rst
ixpk= 0, nxpk= 0, iat=1273,1282, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07, &end
#
# 81 ASN HB3 83 ILE HG12 4.55
&rst
ixpk= 0, nxpk= 0, iat=1273,1316, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05, &end
#
# 81 ASN HB3 83 ILE HG13 4.55
&rst
ixpk= 0, nxpk= 0, iat=1273,1317, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05, &end
#
# 81 ASN HB3 83 ILE HN 5.15
&rst
ixpk= 0, nxpk= 0, iat=1273,1306, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65, &end
#
# 81 ASN HB3 83 ILE QD1 4.58
&rst
ixpk= 0, nxpk= 0, iat=1273, -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
igr2=1319,1320,1321,
&end
#
# 81 ASN HD21 83 ILE QD1 4.91
&rst
ixpk= 0, nxpk= 0, iat=1277, -1, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
igr2=1319,1320,1321,
&end
#
# 81 ASN HD22 83 ILE QD1 4.91
&rst
ixpk= 0, nxpk= 0, iat=1278, -1, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
igr2=1319,1320,1321,
&end
#
# 81 ASN HN 104 GLY HA3 4.30
&rst
ixpk= 0, nxpk= 0, iat=1268,1636, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80, &end
#
# 81 ASN HN 105 ASN HA 4.11
&rst
ixpk= 0, nxpk= 0, iat=1268,1642, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 81 ASN HN 105 ASN HD21 3.93
&rst
ixpk= 0, nxpk= 0, iat=1268,1649, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43, &end
#
# 81 ASN HN 105 ASN HD22 3.93
&rst
ixpk= 0, nxpk= 0, iat=1268,1650, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43, &end
#
# 81 ASN HN 105 ASN QD2 3.37
&rst
ixpk= 0, nxpk= 0, iat=1268, -1, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,
igr2=1649,1650,
&end
#
# 81 ASN HN 81 ASN HB2 3.59
&rst
ixpk= 0, nxpk= 0, iat=1268,1272, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09, &end
#
# 81 ASN HN 81 ASN HD21 4.47
&rst
ixpk= 0, nxpk= 0, iat=1268,1277, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97, &end
#
# 81 ASN HN 81 ASN HD22 4.47
&rst
ixpk= 0, nxpk= 0, iat=1268,1278, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97, &end
#
# 81 ASN HN 81 ASN QD2 3.84
&rst
ixpk= 0, nxpk= 0, iat=1268, -1, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,
igr2=1277,1278,
&end
#
# 81 ASN HN 82 ARG HN 4.94
&rst
ixpk= 0, nxpk= 0, iat=1268,1282, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44, &end
#
# 81 ASN HN 83 ILE QD1 4.66
&rst
ixpk= 0, nxpk= 0, iat=1268, -1, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
igr2=1319,1320,1321,
&end
#
# 81 ASN QD2 82 ARG HN 4.92
&rst
ixpk= 0, nxpk= 0, iat= -1,1282, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
igr1=1277,1278,
&end
#
# 81 ASN QD2 83 ILE QD1 4.22
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
igr1=1277,1278,
igr2=1319,1320,1321,
&end
#
# 82 ARG HA 105 ASN HA 4.13
&rst
ixpk= 0, nxpk= 0, iat=1284,1642, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63, &end
#
# 82 ARG HA 106 LYS HG2 3.94
&rst
ixpk= 0, nxpk= 0, iat=1284,1661, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44, &end
#
# 82 ARG HA 106 LYS HG3 3.94
&rst
ixpk= 0, nxpk= 0, iat=1284,1662, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44, &end
#
# 82 ARG HA 106 LYS QG 3.40
&rst
ixpk= 0, nxpk= 0, iat=1284, -1, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,
igr2=1661,1662,
&end
#
# 82 ARG HA 82 ARG HG2 3.77
&rst
ixpk= 0, nxpk= 0, iat=1284,1289, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27, &end
#
# 82 ARG HA 82 ARG HG3 3.77
&rst
ixpk= 0, nxpk= 0, iat=1284,1290, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27, &end
#
# 82 ARG HB2 82 ARG QD 3.96
&rst
ixpk= 0, nxpk= 0, iat=1286, -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
igr2=1292,1293,
&end
#
# 82 ARG HB3 82 ARG QD 3.96
&rst
ixpk= 0, nxpk= 0, iat=1287, -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
igr2=1292,1293,
&end
#
# 82 ARG HN 82 ARG HG2 4.19
&rst
ixpk= 0, nxpk= 0, iat=1282,1289, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69, &end
#
# 82 ARG HN 82 ARG HG3 4.19
&rst
ixpk= 0, nxpk= 0, iat=1282,1290, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69, &end
#
# 82 ARG HN 82 ARG QD 4.24
&rst
ixpk= 0, nxpk= 0, iat=1282, -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
igr2=1292,1293,
&end
#
# 82 ARG HN 82 ARG QG 3.58
&rst
ixpk= 0, nxpk= 0, iat=1282, -1, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,
igr2=1289,1290,
&end
#
# 82 ARG HN 83 ILE HA 5.50
&rst
ixpk= 0, nxpk= 0, iat=1282,1308, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 82 ARG HN 83 ILE HB 5.16
&rst
ixpk= 0, nxpk= 0, iat=1282,1310, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66, &end
#
# 82 ARG HN 83 ILE HN 3.80
&rst
ixpk= 0, nxpk= 0, iat=1282,1306, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30, &end
#
# 82 ARG HN 83 ILE QG1 4.58
&rst
ixpk= 0, nxpk= 0, iat=1282, -1, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
igr2=1316,1317,
&end
#
# 82 ARG QB 82 ARG QD 3.15
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47,
igr1=1286,1287,
igr2=1292,1293,
&end
#
# 82 ARG QB 84 PHE QD 4.54
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
igr1=1286,1287,
igr2=1333,1341,
&end
#
# 83 ILE HA 83 ILE QG1 3.25
&rst
ixpk= 0, nxpk= 0, iat=1308, -1, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15,
igr2=1316,1317,
&end
#
# 83 ILE HA 83 ILE QG2 3.23
&rst
ixpk= 0, nxpk= 0, iat=1308, -1, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,
igr2=1312,1313,1314,
&end
#
# 83 ILE HA 84 PHE HN 3.19
&rst
ixpk= 0, nxpk= 0, iat=1308,1325, r1= 1.30, r2= 1.80, r3= 3.19, r4= 3.69, &end
#
# 83 ILE HA 84 PHE QD 3.99
&rst
ixpk= 0, nxpk= 0, iat=1308, -1, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
igr2=1333,1341,
&end
#
# 83 ILE HA 85 GLY HN 3.90
&rst
ixpk= 0, nxpk= 0, iat=1308,1345, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40, &end
#
# 83 ILE HB 105 ASN HA 4.19
&rst
ixpk= 0, nxpk= 0, iat=1310,1642, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69, &end
#
# 83 ILE HB 105 ASN HB2 4.57
&rst
ixpk= 0, nxpk= 0, iat=1310,1644, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07, &end
#
# 83 ILE HB 105 ASN HB3 4.35
&rst
ixpk= 0, nxpk= 0, iat=1310,1645, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85, &end
#
# 83 ILE HB 83 ILE QD1 3.02
&rst
ixpk= 0, nxpk= 0, iat=1310, -1, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13,
igr2=1319,1320,1321,
&end
#
# 83 ILE HN 105 ASN HA 4.38
&rst
ixpk= 0, nxpk= 0, iat=1306,1642, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88, &end
#
# 83 ILE HN 105 ASN HB2 5.50
&rst
ixpk= 0, nxpk= 0, iat=1306,1644, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 83 ILE HN 105 ASN HB3 4.19
&rst
ixpk= 0, nxpk= 0, iat=1306,1645, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69, &end
#
# 83 ILE HN 106 LYS HN 4.34
&rst
ixpk= 0, nxpk= 0, iat=1306,1654, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84, &end
#
# 83 ILE HN 83 ILE HB 3.09
&rst
ixpk= 0, nxpk= 0, iat=1306,1310, r1= 1.30, r2= 1.80, r3= 3.09, r4= 3.59, &end
#
# 83 ILE HN 83 ILE HG12 3.83
&rst
ixpk= 0, nxpk= 0, iat=1306,1316, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33, &end
#
# 83 ILE HN 83 ILE HG13 3.83
&rst
ixpk= 0, nxpk= 0, iat=1306,1317, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33, &end
#
# 83 ILE HN 83 ILE QD1 3.45
&rst
ixpk= 0, nxpk= 0, iat=1306, -1, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,
igr2=1319,1320,1321,
&end
#
# 83 ILE HN 83 ILE QG1 3.13
&rst
ixpk= 0, nxpk= 0, iat=1306, -1, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01,
igr2=1316,1317,
&end
#
# 83 ILE HN 83 ILE QG2 3.82
&rst
ixpk= 0, nxpk= 0, iat=1306, -1, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
igr2=1312,1313,1314,
&end
#
# 83 ILE QD1 105 ASN HA 4.64
&rst
ixpk= 0, nxpk= 0, iat= -1,1642, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
igr1=1319,1320,1321,
&end
#
# 83 ILE QD1 105 ASN HB3 4.47
&rst
ixpk= 0, nxpk= 0, iat= -1,1645, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr1=1319,1320,1321,
&end
#
# 83 ILE QD1 105 ASN HD21 4.32
&rst
ixpk= 0, nxpk= 0, iat= -1,1649, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
igr1=1319,1320,1321,
&end
#
# 83 ILE QD1 105 ASN HD22 4.32
&rst
ixpk= 0, nxpk= 0, iat= -1,1650, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
igr1=1319,1320,1321,
&end
#
# 83 ILE QG2 105 ASN HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1642, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1=1312,1313,1314,
&end
#
# 83 ILE QG2 105 ASN HB3 4.38
&rst
ixpk= 0, nxpk= 0, iat= -1,1645, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr1=1312,1313,1314,
&end
#
# 83 ILE QG2 105 ASN QD2 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.20, r4= 7.70,
igr1=1312,1313,1314,
igr2=1649,1650,
&end
#
# 83 ILE QG2 106 LYS HN 4.64
&rst
ixpk= 0, nxpk= 0, iat= -1,1654, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
igr1=1312,1313,1314,
&end
#
# 83 ILE QG2 107 LEU HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1676, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1=1312,1313,1314,
&end
#
# 83 ILE QG2 83 ILE QG1 3.19
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
igr1=1312,1313,1314,
igr2=1316,1317,
&end
#
# 83 ILE QG2 84 PHE HB2 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1329, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1=1312,1313,1314,
&end
#
# 83 ILE QG2 84 PHE HB3 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1330, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1=1312,1313,1314,
&end
#
# 83 ILE QG2 84 PHE HN 3.16
&rst
ixpk= 0, nxpk= 0, iat= -1,1325, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,
igr1=1312,1313,1314,
&end
#
# 83 ILE QG2 84 PHE QD 4.61
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,
igr1=1312,1313,1314,
igr2=1333,1341,
&end
#
# 83 ILE QG2 85 GLY HN 3.15
&rst
ixpk= 0, nxpk= 0, iat= -1,1345, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,
igr1=1312,1313,1314,
&end
#
# 84 PHE HA 106 LYS HB2 4.59
&rst
ixpk= 0, nxpk= 0, iat=1327,1658, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 84 PHE HA 106 LYS HB3 4.59
&rst
ixpk= 0, nxpk= 0, iat=1327,1659, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 84 PHE HA 106 LYS QB 3.99
&rst
ixpk= 0, nxpk= 0, iat=1327, -1, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
igr2=1658,1659,
&end
#
# 84 PHE HA 107 LEU HA 4.39
&rst
ixpk= 0, nxpk= 0, iat=1327,1678, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89, &end
#
# 84 PHE HA 107 LEU HN 4.93
&rst
ixpk= 0, nxpk= 0, iat=1327,1676, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43, &end
#
# 84 PHE HA 107 LEU QD1 5.50
&rst
ixpk= 0, nxpk= 0, iat=1327, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2=1685,1686,1687,
&end
#
# 84 PHE HA 107 LEU QD2 3.39
&rst
ixpk= 0, nxpk= 0, iat=1327, -1, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,
igr2=1689,1690,1691,
&end
#
# 84 PHE HA 112 THR QG2 4.69
&rst
ixpk= 0, nxpk= 0, iat=1327, -1, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr2=1765,1766,1767,
&end
#
# 84 PHE HA 84 PHE QD 3.97
&rst
ixpk= 0, nxpk= 0, iat=1327, -1, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
igr2=1333,1341,
&end
#
# 84 PHE HB2 106 LYS HB2 4.48
&rst
ixpk= 0, nxpk= 0, iat=1329,1658, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98, &end
#
# 84 PHE HB2 106 LYS HB3 4.48
&rst
ixpk= 0, nxpk= 0, iat=1329,1659, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98, &end
#
# 84 PHE HB2 106 LYS QB 3.81
&rst
ixpk= 0, nxpk= 0, iat=1329, -1, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,
igr2=1658,1659,
&end
#
# 84 PHE HB2 107 LEU QD2 4.88
&rst
ixpk= 0, nxpk= 0, iat=1329, -1, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
igr2=1689,1690,1691,
&end
#
# 84 PHE HB2 112 THR QG2 4.63
&rst
ixpk= 0, nxpk= 0, iat=1329, -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
igr2=1765,1766,1767,
&end
#
# 84 PHE HB2 85 GLY HN 4.66
&rst
ixpk= 0, nxpk= 0, iat=1329,1345, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16, &end
#
# 84 PHE HB3 106 LYS HB2 4.05
&rst
ixpk= 0, nxpk= 0, iat=1330,1658, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55, &end
#
# 84 PHE HB3 106 LYS HB3 4.05
&rst
ixpk= 0, nxpk= 0, iat=1330,1659, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55, &end
#
# 84 PHE HB3 106 LYS QG 4.82
&rst
ixpk= 0, nxpk= 0, iat=1330, -1, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,
igr2=1661,1662,
&end
#
# 84 PHE HB3 107 LEU QD2 5.21
&rst
ixpk= 0, nxpk= 0, iat=1330, -1, r1= 1.30, r2= 1.80, r3= 6.26, r4= 6.76,
igr2=1689,1690,1691,
&end
#
# 84 PHE HB3 85 GLY HN 4.52
&rst
ixpk= 0, nxpk= 0, iat=1330,1345, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02, &end
#
# 84 PHE HN 107 LEU QD2 4.44
&rst
ixpk= 0, nxpk= 0, iat=1325, -1, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
igr2=1689,1690,1691,
&end
#
# 84 PHE HN 84 PHE QD 3.55
&rst
ixpk= 0, nxpk= 0, iat=1325, -1, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,
igr2=1333,1341,
&end
#
# 84 PHE HN 84 PHE QE 4.57
&rst
ixpk= 0, nxpk= 0, iat=1325, -1, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
igr2=1335,1339,
&end
#
# 84 PHE HN 85 GLY HA3 5.13
&rst
ixpk= 0, nxpk= 0, iat=1325,1348, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63, &end
#
# 84 PHE HN 85 GLY HN 3.01
&rst
ixpk= 0, nxpk= 0, iat=1325,1345, r1= 1.30, r2= 1.80, r3= 3.01, r4= 3.51, &end
#
# 84 PHE QD 106 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=1333,1341,
igr2=1658,1659,
&end
#
# 84 PHE QD 106 LYS QG 4.23
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
igr1=1333,1341,
igr2=1661,1662,
&end
#
# 84 PHE QD 107 LEU QD2 5.19
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,
igr1=1333,1341,
igr2=1689,1690,1691,
&end
#
# 84 PHE QD 112 THR QG2 4.87
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.56, r4= 7.06,
igr1=1333,1341,
igr2=1765,1766,1767,
&end
#
# 84 PHE QD 85 GLY HA3 4.64
&rst
ixpk= 0, nxpk= 0, iat= -1,1348, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,
igr1=1333,1341,
&end
#
# 85 GLY HA2 107 LEU QD1 4.86
&rst
ixpk= 0, nxpk= 0, iat=1347, -1, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
igr2=1685,1686,1687,
&end
#
# 85 GLY HA2 107 LEU QD2 3.89
&rst
ixpk= 0, nxpk= 0, iat=1347, -1, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
igr2=1689,1690,1691,
&end
#
# 85 GLY HA2 112 THR HB 4.09
&rst
ixpk= 0, nxpk= 0, iat=1347,1763, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59, &end
#
# 85 GLY HA2 112 THR QG2 3.29
&rst
ixpk= 0, nxpk= 0, iat=1347, -1, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
igr2=1765,1766,1767,
&end
#
# 85 GLY HA2 87 LEU HG 4.17
&rst
ixpk= 0, nxpk= 0, iat=1347,1366, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67, &end
#
# 85 GLY HA2 87 LEU HN 4.44
&rst
ixpk= 0, nxpk= 0, iat=1347,1359, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94, &end
#
# 85 GLY HA2 87 LEU QD1 4.40
&rst
ixpk= 0, nxpk= 0, iat=1347, -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
igr2=1368,1369,1370,
&end
#
# 85 GLY HA2 87 LEU QD2 4.32
&rst
ixpk= 0, nxpk= 0, iat=1347, -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
igr2=1372,1373,1374,
&end
#
# 85 GLY HA3 112 THR QG2 3.16
&rst
ixpk= 0, nxpk= 0, iat=1348, -1, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,
igr2=1765,1766,1767,
&end
#
# 85 GLY HA3 87 LEU HG 4.79
&rst
ixpk= 0, nxpk= 0, iat=1348,1366, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29, &end
#
# 85 GLY HA3 87 LEU HN 4.77
&rst
ixpk= 0, nxpk= 0, iat=1348,1359, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27, &end
#
# 85 GLY HN 107 LEU QD2 3.87
&rst
ixpk= 0, nxpk= 0, iat=1345, -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
igr2=1689,1690,1691,
&end
#
# 85 GLY HN 112 THR QG2 4.68
&rst
ixpk= 0, nxpk= 0, iat=1345, -1, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
igr2=1765,1766,1767,
&end
#
# 86 GLY HN 112 THR QG2 4.70
&rst
ixpk= 0, nxpk= 0, iat=1352, -1, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14,
igr2=1765,1766,1767,
&end
#
# 86 GLY HN 87 LEU HG 4.81
&rst
ixpk= 0, nxpk= 0, iat=1352,1366, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31, &end
#
# 86 GLY HN 87 LEU HN 4.11
&rst
ixpk= 0, nxpk= 0, iat=1352,1359, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 86 GLY QA 88 ASP HN 3.85
&rst
ixpk= 0, nxpk= 0, iat= -1,1378, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,
igr1=1354,1355,
&end
#
# 87 LEU HA 87 LEU HG 4.11
&rst
ixpk= 0, nxpk= 0, iat=1361,1366, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 87 LEU HA 87 LEU QD2 3.01
&rst
ixpk= 0, nxpk= 0, iat=1361, -1, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11,
igr2=1372,1373,1374,
&end
#
# 87 LEU HA 89 MET HN 4.99
&rst
ixpk= 0, nxpk= 0, iat=1361,1390, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49, &end
#
# 87 LEU HA 90 LEU HG 4.38
&rst
ixpk= 0, nxpk= 0, iat=1361,1414, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88, &end
#
# 87 LEU HA 90 LEU HN 4.47
&rst
ixpk= 0, nxpk= 0, iat=1361,1407, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97, &end
#
# 87 LEU HA 90 LEU QD1 3.51
&rst
ixpk= 0, nxpk= 0, iat=1361, -1, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
igr2=1416,1417,1418,
&end
#
# 87 LEU HB2 113 LEU HA 4.50
&rst
ixpk= 0, nxpk= 0, iat=1363,1775, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 87 LEU HB2 115 PRO HB2 5.39
&rst
ixpk= 0, nxpk= 0, iat=1363,1814, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89, &end
#
# 87 LEU HB2 115 PRO QD 4.41
&rst
ixpk= 0, nxpk= 0, iat=1363, -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr2=1808,1809,
&end
#
# 87 LEU HB2 87 LEU QD1 3.70
&rst
ixpk= 0, nxpk= 0, iat=1363, -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
igr2=1368,1369,1370,
&end
#
# 87 LEU HB2 87 LEU QD2 3.38
&rst
ixpk= 0, nxpk= 0, iat=1363, -1, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,
igr2=1372,1373,1374,
&end
#
# 87 LEU HB2 88 ASP HN 4.55
&rst
ixpk= 0, nxpk= 0, iat=1363,1378, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05, &end
#
# 87 LEU HB3 115 PRO HB2 5.50
&rst
ixpk= 0, nxpk= 0, iat=1364,1814, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 87 LEU HB3 115 PRO HG2 4.95
&rst
ixpk= 0, nxpk= 0, iat=1364,1811, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45, &end
#
# 87 LEU HB3 115 PRO HG3 5.50
&rst
ixpk= 0, nxpk= 0, iat=1364,1812, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 87 LEU HB3 87 LEU QD1 3.15
&rst
ixpk= 0, nxpk= 0, iat=1364, -1, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,
igr2=1368,1369,1370,
&end
#
# 87 LEU HB3 87 LEU QD2 3.18
&rst
ixpk= 0, nxpk= 0, iat=1364, -1, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,
igr2=1372,1373,1374,
&end
#
# 87 LEU HB3 88 ASP HN 4.55
&rst
ixpk= 0, nxpk= 0, iat=1364,1378, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05, &end
#
# 87 LEU HG 115 PRO HG2 5.50
&rst
ixpk= 0, nxpk= 0, iat=1366,1811, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 87 LEU HG 115 PRO HG3 5.50
&rst
ixpk= 0, nxpk= 0, iat=1366,1812, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 87 LEU HN 112 THR QG2 5.50
&rst
ixpk= 0, nxpk= 0, iat=1359, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2=1765,1766,1767,
&end
#
# 87 LEU HN 115 PRO HB3 5.50
&rst
ixpk= 0, nxpk= 0, iat=1359,1815, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 87 LEU HN 115 PRO HG2 4.54
&rst
ixpk= 0, nxpk= 0, iat=1359,1811, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 87 LEU HN 115 PRO HG3 4.76
&rst
ixpk= 0, nxpk= 0, iat=1359,1812, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26, &end
#
# 87 LEU HN 87 LEU HB2 3.68
&rst
ixpk= 0, nxpk= 0, iat=1359,1363, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18, &end
#
# 87 LEU HN 87 LEU HB3 4.13
&rst
ixpk= 0, nxpk= 0, iat=1359,1364, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63, &end
#
# 87 LEU HN 87 LEU HG 3.24
&rst
ixpk= 0, nxpk= 0, iat=1359,1366, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74, &end
#
# 87 LEU HN 87 LEU QD1 4.06
&rst
ixpk= 0, nxpk= 0, iat=1359, -1, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
igr2=1368,1369,1370,
&end
#
# 87 LEU HN 87 LEU QD2 3.86
&rst
ixpk= 0, nxpk= 0, iat=1359, -1, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
igr2=1372,1373,1374,
&end
#
# 87 LEU HN 90 LEU QD1 5.40
&rst
ixpk= 0, nxpk= 0, iat=1359, -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
igr2=1416,1417,1418,
&end
#
# 87 LEU QD1 113 LEU HA 3.42
&rst
ixpk= 0, nxpk= 0, iat= -1,1775, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
igr1=1368,1369,1370,
&end
#
# 87 LEU QD1 115 PRO QD 4.82
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
igr1=1368,1369,1370,
igr2=1808,1809,
&end
#
# 87 LEU QD2 88 ASP HN 4.76
&rst
ixpk= 0, nxpk= 0, iat= -1,1378, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
igr1=1372,1373,1374,
&end
#
# 88 ASP HA 115 PRO HB2 3.48
&rst
ixpk= 0, nxpk= 0, iat=1380,1814, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98, &end
#
# 88 ASP HA 115 PRO HB3 3.71
&rst
ixpk= 0, nxpk= 0, iat=1380,1815, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21, &end
#
# 88 ASP HA 115 PRO HG3 4.26
&rst
ixpk= 0, nxpk= 0, iat=1380,1812, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76, &end
#
# 88 ASP HA 90 LEU HN 4.56
&rst
ixpk= 0, nxpk= 0, iat=1380,1407, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06, &end
#
# 88 ASP HA 91 ALA HN 4.70
&rst
ixpk= 0, nxpk= 0, iat=1380,1426, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 88 ASP HA 91 ALA QB 3.67
&rst
ixpk= 0, nxpk= 0, iat=1380, -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
igr2=1430,1431,1432,
&end
#
# 88 ASP HB2 115 PRO HB2 4.26
&rst
ixpk= 0, nxpk= 0, iat=1382,1814, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76, &end
#
# 88 ASP HB2 89 MET HN 4.73
&rst
ixpk= 0, nxpk= 0, iat=1382,1390, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, &end
#
# 88 ASP HB3 115 PRO HB2 4.26
&rst
ixpk= 0, nxpk= 0, iat=1383,1814, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76, &end
#
# 88 ASP HB3 89 MET HN 4.73
&rst
ixpk= 0, nxpk= 0, iat=1383,1390, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, &end
#
# 88 ASP HN 115 PRO HB2 4.78
&rst
ixpk= 0, nxpk= 0, iat=1378,1814, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, &end
#
# 88 ASP HN 115 PRO HB3 5.06
&rst
ixpk= 0, nxpk= 0, iat=1378,1815, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56, &end
#
# 88 ASP HN 115 PRO HG2 4.18
&rst
ixpk= 0, nxpk= 0, iat=1378,1811, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68, &end
#
# 88 ASP HN 115 PRO HG3 5.20
&rst
ixpk= 0, nxpk= 0, iat=1378,1812, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70, &end
#
# 88 ASP HN 88 ASP HB2 3.76
&rst
ixpk= 0, nxpk= 0, iat=1378,1382, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26, &end
#
# 88 ASP HN 88 ASP HB3 3.76
&rst
ixpk= 0, nxpk= 0, iat=1378,1383, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26, &end
#
# 88 ASP HN 88 ASP QB 3.22
&rst
ixpk= 0, nxpk= 0, iat=1378, -1, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11,
igr2=1382,1383,
&end
#
# 88 ASP HN 89 MET HN 4.02
&rst
ixpk= 0, nxpk= 0, iat=1378,1390, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52, &end
#
# 88 ASP HN 89 MET QG 5.50
&rst
ixpk= 0, nxpk= 0, iat=1378, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2=1397,1398,
&end
#
# 88 ASP QB 115 PRO HA 4.57
&rst
ixpk= 0, nxpk= 0, iat= -1,1817, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
igr1=1382,1383,
&end
#
# 88 ASP QB 115 PRO HB3 3.64
&rst
ixpk= 0, nxpk= 0, iat= -1,1815, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59,
igr1=1382,1383,
&end
#
# 88 ASP QB 115 PRO HG3 4.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1812, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,
igr1=1382,1383,
&end
#
# 88 ASP QB 90 LEU HN 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1,1407, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1=1382,1383,
&end
#
# 89 MET HA 89 MET QE 3.92
&rst
ixpk= 0, nxpk= 0, iat=1392, -1, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
igr2=1401,1402,1403,
&end
#
# 89 MET HA 89 MET QG 3.45
&rst
ixpk= 0, nxpk= 0, iat=1392, -1, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,
igr2=1397,1398,
&end
#
# 89 MET HA 91 ALA HN 4.65
&rst
ixpk= 0, nxpk= 0, iat=1392,1426, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15, &end
#
# 89 MET HA 92 GLU HB3 4.56
&rst
ixpk= 0, nxpk= 0, iat=1392,1441, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06, &end
#
# 89 MET HA 92 GLU HG2 4.35
&rst
ixpk= 0, nxpk= 0, iat=1392,1443, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85, &end
#
# 89 MET HA 92 GLU HG3 4.37
&rst
ixpk= 0, nxpk= 0, iat=1392,1444, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87, &end
#
# 89 MET HA 92 GLU HN 4.07
&rst
ixpk= 0, nxpk= 0, iat=1392,1436, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57, &end
#
# 89 MET HA 93 LYS HB2 5.50
&rst
ixpk= 0, nxpk= 0, iat=1392,1455, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 89 MET HA 93 LYS HG2 4.49
&rst
ixpk= 0, nxpk= 0, iat=1392,1458, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99, &end
#
# 89 MET HA 93 LYS HN 4.45
&rst
ixpk= 0, nxpk= 0, iat=1392,1451, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95, &end
#
# 89 MET HA 93 LYS QE 5.34
&rst
ixpk= 0, nxpk= 0, iat=1392, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2=1464,1465,
&end
#
# 89 MET HB2 89 MET QG 2.90
&rst
ixpk= 0, nxpk= 0, iat=1394, -1, r1= 1.30, r2= 1.80, r3= 3.26, r4= 3.76,
igr2=1397,1398,
&end
#
# 89 MET HB3 89 MET QG 2.90
&rst
ixpk= 0, nxpk= 0, iat=1395, -1, r1= 1.30, r2= 1.80, r3= 3.26, r4= 3.76,
igr2=1397,1398,
&end
#
# 89 MET HN 89 MET HB2 3.83
&rst
ixpk= 0, nxpk= 0, iat=1390,1394, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33, &end
#
# 89 MET HN 89 MET HB3 3.83
&rst
ixpk= 0, nxpk= 0, iat=1390,1395, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33, &end
#
# 89 MET HN 89 MET QB 3.36
&rst
ixpk= 0, nxpk= 0, iat=1390, -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
igr2=1394,1395,
&end
#
# 89 MET HN 89 MET QE 4.53
&rst
ixpk= 0, nxpk= 0, iat=1390, -1, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
igr2=1401,1402,1403,
&end
#
# 89 MET HN 89 MET QG 3.85
&rst
ixpk= 0, nxpk= 0, iat=1390, -1, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,
igr2=1397,1398,
&end
#
# 89 MET HN 90 LEU HN 3.89
&rst
ixpk= 0, nxpk= 0, iat=1390,1407, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39, &end
#
# 89 MET QB 90 LEU HN 3.88
&rst
ixpk= 0, nxpk= 0, iat= -1,1407, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,
igr1=1394,1395,
&end
#
# 89 MET QE 90 LEU HN 5.08
&rst
ixpk= 0, nxpk= 0, iat= -1,1407, r1= 1.30, r2= 1.80, r3= 6.10, r4= 6.60,
igr1=1401,1402,1403,
&end
#
# 89 MET QG 89 MET QE 3.12
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,
igr1=1397,1398,
igr2=1401,1402,1403,
&end
#
# 89 MET QG 90 LEU HN 4.63
&rst
ixpk= 0, nxpk= 0, iat= -1,1407, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
igr1=1397,1398,
&end
#
# 89 MET QG 93 LYS HG2 5.02
&rst
ixpk= 0, nxpk= 0, iat= -1,1458, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr1=1397,1398,
&end
#
# 90 LEU HA 90 LEU HG 3.62
&rst
ixpk= 0, nxpk= 0, iat=1409,1414, r1= 1.30, r2= 1.80, r3= 3.62, r4= 4.12, &end
#
# 90 LEU HA 90 LEU QD1 3.99
&rst
ixpk= 0, nxpk= 0, iat=1409, -1, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
igr2=1416,1417,1418,
&end
#
# 90 LEU HA 90 LEU QD2 3.09
&rst
ixpk= 0, nxpk= 0, iat=1409, -1, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21,
igr2=1420,1421,1422,
&end
#
# 90 LEU HA 93 LYS HB3 4.44
&rst
ixpk= 0, nxpk= 0, iat=1409,1456, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94, &end
#
# 90 LEU HA 93 LYS HN 4.41
&rst
ixpk= 0, nxpk= 0, iat=1409,1451, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, &end
#
# 90 LEU HA 94 LEU HN 4.32
&rst
ixpk= 0, nxpk= 0, iat=1409,1473, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82, &end
#
# 90 LEU HA 94 LEU QD1 3.91
&rst
ixpk= 0, nxpk= 0, iat=1409, -1, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
igr2=1482,1483,1484,
&end
#
# 90 LEU HB2 119 LEU QD1 4.02
&rst
ixpk= 0, nxpk= 0, iat=1411, -1, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
igr2=1893,1894,1895,
&end
#
# 90 LEU HB2 90 LEU QD1 3.34
&rst
ixpk= 0, nxpk= 0, iat=1411, -1, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,
igr2=1416,1417,1418,
&end
#
# 90 LEU HB2 90 LEU QD2 3.40
&rst
ixpk= 0, nxpk= 0, iat=1411, -1, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,
igr2=1420,1421,1422,
&end
#
# 90 LEU HB2 91 ALA HN 4.10
&rst
ixpk= 0, nxpk= 0, iat=1411,1426, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60, &end
#
# 90 LEU HB3 119 LEU QD1 4.02
&rst
ixpk= 0, nxpk= 0, iat=1412, -1, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
igr2=1893,1894,1895,
&end
#
# 90 LEU HB3 90 LEU QD1 3.34
&rst
ixpk= 0, nxpk= 0, iat=1412, -1, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,
igr2=1416,1417,1418,
&end
#
# 90 LEU HB3 90 LEU QD2 3.40
&rst
ixpk= 0, nxpk= 0, iat=1412, -1, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,
igr2=1420,1421,1422,
&end
#
# 90 LEU HB3 91 ALA HN 4.10
&rst
ixpk= 0, nxpk= 0, iat=1412,1426, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60, &end
#
# 90 LEU HG 91 ALA HN 4.76
&rst
ixpk= 0, nxpk= 0, iat=1414,1426, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26, &end
#
# 90 LEU HN 90 LEU HB2 3.73
&rst
ixpk= 0, nxpk= 0, iat=1407,1411, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23, &end
#
# 90 LEU HN 90 LEU HB3 3.73
&rst
ixpk= 0, nxpk= 0, iat=1407,1412, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23, &end
#
# 90 LEU HN 90 LEU HG 3.34
&rst
ixpk= 0, nxpk= 0, iat=1407,1414, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84, &end
#
# 90 LEU HN 90 LEU QB 3.16
&rst
ixpk= 0, nxpk= 0, iat=1407, -1, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05,
igr2=1411,1412,
&end
#
# 90 LEU HN 90 LEU QD1 4.09
&rst
ixpk= 0, nxpk= 0, iat=1407, -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
igr2=1416,1417,1418,
&end
#
# 90 LEU HN 90 LEU QD2 3.95
&rst
ixpk= 0, nxpk= 0, iat=1407, -1, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr2=1420,1421,1422,
&end
#
# 90 LEU HN 91 ALA HN 3.22
&rst
ixpk= 0, nxpk= 0, iat=1407,1426, r1= 1.30, r2= 1.80, r3= 3.22, r4= 3.72, &end
#
# 90 LEU QB 119 LEU QD1 3.49
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
igr1=1411,1412,
igr2=1893,1894,1895,
&end
#
# 90 LEU QB 90 LEU QD1 2.80
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
igr1=1411,1412,
igr2=1416,1417,1418,
&end
#
# 90 LEU QB 90 LEU QD2 2.90
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41,
igr1=1411,1412,
igr2=1420,1421,1422,
&end
#
# 90 LEU QB 91 ALA HN 3.55
&rst
ixpk= 0, nxpk= 0, iat= -1,1426, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,
igr1=1411,1412,
&end
#
# 90 LEU QD1 91 ALA HN 4.65
&rst
ixpk= 0, nxpk= 0, iat= -1,1426, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr1=1416,1417,1418,
&end
#
# 90 LEU QD2 91 ALA HN 4.85
&rst
ixpk= 0, nxpk= 0, iat= -1,1426, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32,
igr1=1420,1421,1422,
&end
#
# 90 LEU QD2 94 LEU QD1 2.75
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47,
igr1=1420,1421,1422,
igr2=1482,1483,1484,
&end
#
# 91 ALA HA 116 LEU QD2 4.69
&rst
ixpk= 0, nxpk= 0, iat=1428, -1, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr2=1834,1835,1836,
&end
#
# 91 ALA HA 118 LYS QB 5.34
&rst
ixpk= 0, nxpk= 0, iat=1428, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2=1866,1867,
&end
#
# 91 ALA HA 119 LEU HA 5.33
&rst
ixpk= 0, nxpk= 0, iat=1428,1886, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83, &end
#
# 91 ALA HA 119 LEU HB2 5.50
&rst
ixpk= 0, nxpk= 0, iat=1428,1888, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 91 ALA HA 119 LEU HB3 4.72
&rst
ixpk= 0, nxpk= 0, iat=1428,1889, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22, &end
#
# 91 ALA HA 119 LEU HG 3.81
&rst
ixpk= 0, nxpk= 0, iat=1428,1891, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31, &end
#
# 91 ALA HA 119 LEU QD1 3.50
&rst
ixpk= 0, nxpk= 0, iat=1428, -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
igr2=1893,1894,1895,
&end
#
# 91 ALA HA 119 LEU QD2 2.95
&rst
ixpk= 0, nxpk= 0, iat=1428, -1, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04,
igr2=1897,1898,1899,
&end
#
# 91 ALA HN 119 LEU QD1 4.52
&rst
ixpk= 0, nxpk= 0, iat=1426, -1, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
igr2=1893,1894,1895,
&end
#
# 91 ALA HN 119 LEU QD2 4.33
&rst
ixpk= 0, nxpk= 0, iat=1426, -1, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
igr2=1897,1898,1899,
&end
#
# 91 ALA HN 91 ALA QB 2.90
&rst
ixpk= 0, nxpk= 0, iat=1426, -1, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98,
igr2=1430,1431,1432,
&end
#
# 91 ALA HN 92 GLU HN 3.42
&rst
ixpk= 0, nxpk= 0, iat=1426,1436, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92, &end
#
# 91 ALA QB 115 PRO HB3 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1815, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1=1430,1431,1432,
&end
#
# 91 ALA QB 116 LEU QD2 3.84
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
igr1=1430,1431,1432,
igr2=1834,1835,1836,
&end
#
# 91 ALA QB 118 LYS HB2 3.57
&rst
ixpk= 0, nxpk= 0, iat= -1,1866, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,
igr1=1430,1431,1432,
&end
#
# 91 ALA QB 118 LYS HB3 3.57
&rst
ixpk= 0, nxpk= 0, iat= -1,1867, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,
igr1=1430,1431,1432,
&end
#
# 91 ALA QB 118 LYS HN 4.22
&rst
ixpk= 0, nxpk= 0, iat= -1,1862, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
igr1=1430,1431,1432,
&end
#
# 91 ALA QB 118 LYS QB 2.91
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
igr1=1430,1431,1432,
igr2=1866,1867,
&end
#
# 91 ALA QB 118 LYS QE 4.81
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.48, r4= 6.98,
igr1=1430,1431,1432,
igr2=1875,1876,
&end
#
# 91 ALA QB 119 LEU HA 4.86
&rst
ixpk= 0, nxpk= 0, iat= -1,1886, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
igr1=1430,1431,1432,
&end
#
# 91 ALA QB 119 LEU HN 4.16
&rst
ixpk= 0, nxpk= 0, iat= -1,1884, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,
igr1=1430,1431,1432,
&end
#
# 91 ALA QB 119 LEU QD1 3.59
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
igr1=1430,1431,1432,
igr2=1893,1894,1895,
&end
#
# 91 ALA QB 119 LEU QD2 3.21
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13,
igr1=1430,1431,1432,
igr2=1897,1898,1899,
&end
#
# 91 ALA QB 92 GLU HG2 4.17
&rst
ixpk= 0, nxpk= 0, iat= -1,1443, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
igr1=1430,1431,1432,
&end
#
# 91 ALA QB 92 GLU HN 3.19
&rst
ixpk= 0, nxpk= 0, iat= -1,1436, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,
igr1=1430,1431,1432,
&end
#
# 91 ALA QB 95 PRO HA 5.44
&rst
ixpk= 0, nxpk= 0, iat= -1,1502, r1= 1.30, r2= 1.80, r3= 6.53, r4= 7.03,
igr1=1430,1431,1432,
&end
#
# 92 GLU HB2 92 GLU HG3 2.99
&rst
ixpk= 0, nxpk= 0, iat=1440,1444, r1= 1.30, r2= 1.80, r3= 2.99, r4= 3.49, &end
#
# 92 GLU HB2 93 LYS QE 4.42
&rst
ixpk= 0, nxpk= 0, iat=1440, -1, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
igr2=1464,1465,
&end
#
# 92 GLU HG2 93 LYS HG2 3.90
&rst
ixpk= 0, nxpk= 0, iat=1443,1458, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40, &end
#
# 92 GLU HG2 93 LYS HG3 5.32
&rst
ixpk= 0, nxpk= 0, iat=1443,1459, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82, &end
#
# 92 GLU HG2 93 LYS HN 4.18
&rst
ixpk= 0, nxpk= 0, iat=1443,1451, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68, &end
#
# 92 GLU HG2 93 LYS QE 4.53
&rst
ixpk= 0, nxpk= 0, iat=1443, -1, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
igr2=1464,1465,
&end
#
# 92 GLU HG3 93 LYS HE2 4.24
&rst
ixpk= 0, nxpk= 0, iat=1444,1464, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74, &end
#
# 92 GLU HG3 93 LYS HE3 4.24
&rst
ixpk= 0, nxpk= 0, iat=1444,1465, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74, &end
#
# 92 GLU HG3 93 LYS HG2 4.03
&rst
ixpk= 0, nxpk= 0, iat=1444,1458, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53, &end
#
# 92 GLU HG3 93 LYS HN 3.59
&rst
ixpk= 0, nxpk= 0, iat=1444,1451, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09, &end
#
# 92 GLU HG3 93 LYS QD 4.83
&rst
ixpk= 0, nxpk= 0, iat=1444, -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr2=1461,1462,
&end
#
# 92 GLU HN 119 LEU QD2 4.87
&rst
ixpk= 0, nxpk= 0, iat=1436, -1, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
igr2=1897,1898,1899,
&end
#
# 92 GLU HN 92 GLU HB3 2.98
&rst
ixpk= 0, nxpk= 0, iat=1436,1441, r1= 1.30, r2= 1.80, r3= 2.98, r4= 3.48, &end
#
# 92 GLU HN 92 GLU HG2 3.70
&rst
ixpk= 0, nxpk= 0, iat=1436,1443, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20, &end
#
# 93 LYS HA 93 LYS HD2 4.03
&rst
ixpk= 0, nxpk= 0, iat=1453,1461, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53, &end
#
# 93 LYS HA 93 LYS HD3 4.03
&rst
ixpk= 0, nxpk= 0, iat=1453,1462, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53, &end
#
# 93 LYS HA 93 LYS HE2 4.63
&rst
ixpk= 0, nxpk= 0, iat=1453,1464, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, &end
#
# 93 LYS HA 93 LYS HE3 4.63
&rst
ixpk= 0, nxpk= 0, iat=1453,1465, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, &end
#
# 93 LYS HA 93 LYS HG2 3.57
&rst
ixpk= 0, nxpk= 0, iat=1453,1458, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07, &end
#
# 93 LYS HA 93 LYS QD 3.49
&rst
ixpk= 0, nxpk= 0, iat=1453, -1, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
igr2=1461,1462,
&end
#
# 93 LYS HA 93 LYS QE 4.05
&rst
ixpk= 0, nxpk= 0, iat=1453, -1, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,
igr2=1464,1465,
&end
#
# 93 LYS HA 94 LEU QD2 5.10
&rst
ixpk= 0, nxpk= 0, iat=1453, -1, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,
igr2=1486,1487,1488,
&end
#
# 93 LYS HB2 94 LEU HN 4.69
&rst
ixpk= 0, nxpk= 0, iat=1455,1473, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, &end
#
# 93 LYS HB3 93 LYS HD2 4.19
&rst
ixpk= 0, nxpk= 0, iat=1456,1461, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69, &end
#
# 93 LYS HB3 93 LYS HD3 4.19
&rst
ixpk= 0, nxpk= 0, iat=1456,1462, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69, &end
#
# 93 LYS HB3 94 LEU HG 3.97
&rst
ixpk= 0, nxpk= 0, iat=1456,1480, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47, &end
#
# 93 LYS HB3 94 LEU HN 3.50
&rst
ixpk= 0, nxpk= 0, iat=1456,1473, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 93 LYS HB3 94 LEU QD2 4.34
&rst
ixpk= 0, nxpk= 0, iat=1456, -1, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,
igr2=1486,1487,1488,
&end
#
# 93 LYS HG2 93 LYS HE2 3.44
&rst
ixpk= 0, nxpk= 0, iat=1458,1464, r1= 1.30, r2= 1.80, r3= 3.44, r4= 3.94, &end
#
# 93 LYS HG2 93 LYS HE3 3.44
&rst
ixpk= 0, nxpk= 0, iat=1458,1465, r1= 1.30, r2= 1.80, r3= 3.44, r4= 3.94, &end
#
# 93 LYS HG2 93 LYS QE 3.01
&rst
ixpk= 0, nxpk= 0, iat=1458, -1, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88,
igr2=1464,1465,
&end
#
# 93 LYS HN 93 LYS HB2 3.60
&rst
ixpk= 0, nxpk= 0, iat=1451,1455, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10, &end
#
# 93 LYS HN 93 LYS HB3 4.17
&rst
ixpk= 0, nxpk= 0, iat=1451,1456, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67, &end
#
# 93 LYS HN 93 LYS HD2 5.09
&rst
ixpk= 0, nxpk= 0, iat=1451,1461, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59, &end
#
# 93 LYS HN 93 LYS HD3 5.09
&rst
ixpk= 0, nxpk= 0, iat=1451,1462, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59, &end
#
# 93 LYS HN 93 LYS HE2 4.66
&rst
ixpk= 0, nxpk= 0, iat=1451,1464, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16, &end
#
# 93 LYS HN 93 LYS HE3 4.66
&rst
ixpk= 0, nxpk= 0, iat=1451,1465, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16, &end
#
# 93 LYS HN 93 LYS HG2 3.38
&rst
ixpk= 0, nxpk= 0, iat=1451,1458, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88, &end
#
# 93 LYS HN 93 LYS HG3 4.64
&rst
ixpk= 0, nxpk= 0, iat=1451,1459, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14, &end
#
# 93 LYS HN 93 LYS QE 4.09
&rst
ixpk= 0, nxpk= 0, iat=1451, -1, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
igr2=1464,1465,
&end
#
# 93 LYS HN 94 LEU HN 3.32
&rst
ixpk= 0, nxpk= 0, iat=1451,1473, r1= 1.30, r2= 1.80, r3= 3.32, r4= 3.82, &end
#
# 94 LEU HA 94 LEU QD1 4.19
&rst
ixpk= 0, nxpk= 0, iat=1475, -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
igr2=1482,1483,1484,
&end
#
# 94 LEU HA 94 LEU QD2 3.41
&rst
ixpk= 0, nxpk= 0, iat=1475, -1, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,
igr2=1486,1487,1488,
&end
#
# 94 LEU HA 95 PRO HD2 3.81
&rst
ixpk= 0, nxpk= 0, iat=1475,1493, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31, &end
#
# 94 LEU HA 95 PRO HD3 3.81
&rst
ixpk= 0, nxpk= 0, iat=1475,1494, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31, &end
#
# 94 LEU HA 95 PRO QG 4.75
&rst
ixpk= 0, nxpk= 0, iat=1475, -1, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
igr2=1496,1497,
&end
#
# 94 LEU HB2 94 LEU QD1 3.15
&rst
ixpk= 0, nxpk= 0, iat=1477, -1, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,
igr2=1482,1483,1484,
&end
#
# 94 LEU HB2 95 PRO HD2 5.30
&rst
ixpk= 0, nxpk= 0, iat=1477,1493, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80, &end
#
# 94 LEU HB2 95 PRO HD3 5.30
&rst
ixpk= 0, nxpk= 0, iat=1477,1494, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80, &end
#
# 94 LEU HB2 95 PRO QD 4.48
&rst
ixpk= 0, nxpk= 0, iat=1477, -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
igr2=1493,1494,
&end
#
# 94 LEU HB2 97 LEU HN 4.20
&rst
ixpk= 0, nxpk= 0, iat=1477,1520, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 94 LEU HB2 97 LEU QB 3.55
&rst
ixpk= 0, nxpk= 0, iat=1477, -1, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,
igr2=1524,1525,
&end
#
# 94 LEU HB3 94 LEU QD1 3.32
&rst
ixpk= 0, nxpk= 0, iat=1478, -1, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,
igr2=1482,1483,1484,
&end
#
# 94 LEU HB3 94 LEU QD2 3.56
&rst
ixpk= 0, nxpk= 0, iat=1478, -1, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,
igr2=1486,1487,1488,
&end
#
# 94 LEU HB3 97 LEU HN 4.49
&rst
ixpk= 0, nxpk= 0, iat=1478,1520, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99, &end
#
# 94 LEU HB3 97 LEU QB 4.39
&rst
ixpk= 0, nxpk= 0, iat=1478, -1, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,
igr2=1524,1525,
&end
#
# 94 LEU HB3 97 LEU QD1 3.92
&rst
ixpk= 0, nxpk= 0, iat=1478, -1, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
igr2=1529,1530,1531,
&end
#
# 94 LEU HB3 97 LEU QD2 3.97
&rst
ixpk= 0, nxpk= 0, iat=1478, -1, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
igr2=1533,1534,1535,
&end
#
# 94 LEU HN 94 LEU HB2 3.65
&rst
ixpk= 0, nxpk= 0, iat=1473,1477, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15, &end
#
# 94 LEU HN 94 LEU HG 3.40
&rst
ixpk= 0, nxpk= 0, iat=1473,1480, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90, &end
#
# 94 LEU HN 94 LEU QD1 3.61
&rst
ixpk= 0, nxpk= 0, iat=1473, -1, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,
igr2=1482,1483,1484,
&end
#
# 94 LEU HN 94 LEU QD2 4.23
&rst
ixpk= 0, nxpk= 0, iat=1473, -1, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
igr2=1486,1487,1488,
&end
#
# 94 LEU HN 95 PRO HD2 4.80
&rst
ixpk= 0, nxpk= 0, iat=1473,1493, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30, &end
#
# 94 LEU HN 95 PRO HD3 4.80
&rst
ixpk= 0, nxpk= 0, iat=1473,1494, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30, &end
#
# 94 LEU HN 95 PRO QD 3.99
&rst
ixpk= 0, nxpk= 0, iat=1473, -1, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
igr2=1493,1494,
&end
#
# 94 LEU QD2 95 PRO QD 4.46
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51,
igr1=1486,1487,1488,
igr2=1493,1494,
&end
#
# 95 PRO HA 119 LEU QD2 3.52
&rst
ixpk= 0, nxpk= 0, iat=1502, -1, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,
igr2=1897,1898,1899,
&end
#
# 95 PRO HA 97 LEU HN 4.61
&rst
ixpk= 0, nxpk= 0, iat=1502,1520, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 95 PRO HD2 96 ASN HN 4.63
&rst
ixpk= 0, nxpk= 0, iat=1493,1506, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, &end
#
# 95 PRO HD3 96 ASN HN 4.63
&rst
ixpk= 0, nxpk= 0, iat=1494,1506, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, &end
#
# 95 PRO QB 96 ASN QD2 4.64
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
igr1=1499,1500,
igr2=1515,1516,
&end
#
# 95 PRO QD 96 ASN HN 4.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1506, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,
igr1=1493,1494,
&end
#
# 95 PRO QG 96 ASN HN 3.67
&rst
ixpk= 0, nxpk= 0, iat= -1,1506, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
igr1=1496,1497,
&end
#
# 95 PRO QG 96 ASN QD2 3.67
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
igr1=1496,1497,
igr2=1515,1516,
&end
#
# 96 ASN HA 121 CYS HB2 4.77
&rst
ixpk= 0, nxpk= 0, iat=1508,1922, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27, &end
#
# 96 ASN HA 121 CYS HB3 4.77
&rst
ixpk= 0, nxpk= 0, iat=1508,1923, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27, &end
#
# 96 ASN HA 96 ASN HD21 5.13
&rst
ixpk= 0, nxpk= 0, iat=1508,1515, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63, &end
#
# 96 ASN HA 96 ASN HD22 5.13
&rst
ixpk= 0, nxpk= 0, iat=1508,1516, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63, &end
#
# 96 ASN HA 96 ASN QD2 4.47
&rst
ixpk= 0, nxpk= 0, iat=1508, -1, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
igr2=1515,1516,
&end
#
# 96 ASN HB2 96 ASN HD21 4.08
&rst
ixpk= 0, nxpk= 0, iat=1510,1515, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58, &end
#
# 96 ASN HB2 96 ASN HD22 4.08
&rst
ixpk= 0, nxpk= 0, iat=1510,1516, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58, &end
#
# 96 ASN HB2 97 LEU HN 4.58
&rst
ixpk= 0, nxpk= 0, iat=1510,1520, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08, &end
#
# 96 ASN HB3 96 ASN HD21 4.08
&rst
ixpk= 0, nxpk= 0, iat=1511,1515, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58, &end
#
# 96 ASN HB3 96 ASN HD22 4.08
&rst
ixpk= 0, nxpk= 0, iat=1511,1516, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58, &end
#
# 96 ASN HB3 97 LEU HN 4.58
&rst
ixpk= 0, nxpk= 0, iat=1511,1520, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08, &end
#
# 96 ASN HN 96 ASN HB2 3.80
&rst
ixpk= 0, nxpk= 0, iat=1506,1510, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30, &end
#
# 96 ASN HN 96 ASN HB3 3.80
&rst
ixpk= 0, nxpk= 0, iat=1506,1511, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30, &end
#
# 96 ASN HN 96 ASN QB 3.32
&rst
ixpk= 0, nxpk= 0, iat=1506, -1, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23,
igr2=1510,1511,
&end
#
# 96 ASN HN 96 ASN QD2 4.51
&rst
ixpk= 0, nxpk= 0, iat=1506, -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
igr2=1515,1516,
&end
#
# 96 ASN HN 97 LEU HN 3.37
&rst
ixpk= 0, nxpk= 0, iat=1506,1520, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87, &end
#
# 96 ASN HN 97 LEU QB 4.71
&rst
ixpk= 0, nxpk= 0, iat=1506, -1, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,
igr2=1524,1525,
&end
#
# 96 ASN QB 96 ASN QD2 3.09
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,
igr1=1510,1511,
igr2=1515,1516,
&end
#
# 97 LEU HA 97 LEU QD1 3.30
&rst
ixpk= 0, nxpk= 0, iat=1522, -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
igr2=1529,1530,1531,
&end
#
# 97 LEU HA 97 LEU QD2 4.08
&rst
ixpk= 0, nxpk= 0, iat=1522, -1, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,
igr2=1533,1534,1535,
&end
#
# 97 LEU HA 98 THR HN 3.54
&rst
ixpk= 0, nxpk= 0, iat=1522,1539, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04, &end
#
# 97 LEU HA 98 THR QG2 4.27
&rst
ixpk= 0, nxpk= 0, iat=1522, -1, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
igr2=1545,1546,1547,
&end
#
# 97 LEU HA 99 HIS HN 3.96
&rst
ixpk= 0, nxpk= 0, iat=1522,1553, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46, &end
#
# 97 LEU HB2 97 LEU QD2 4.19
&rst
ixpk= 0, nxpk= 0, iat=1524, -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
igr2=1533,1534,1535,
&end
#
# 97 LEU HB2 98 THR HN 5.50
&rst
ixpk= 0, nxpk= 0, iat=1524,1539, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 97 LEU HB3 97 LEU QD2 4.19
&rst
ixpk= 0, nxpk= 0, iat=1525, -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
igr2=1533,1534,1535,
&end
#
# 97 LEU HB3 98 THR HN 5.50
&rst
ixpk= 0, nxpk= 0, iat=1525,1539, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 97 LEU HG 98 THR HN 4.64
&rst
ixpk= 0, nxpk= 0, iat=1527,1539, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14, &end
#
# 97 LEU HG 99 HIS HN 5.20
&rst
ixpk= 0, nxpk= 0, iat=1527,1553, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70, &end
#
# 97 LEU HN 119 LEU QD2 3.53
&rst
ixpk= 0, nxpk= 0, iat=1520, -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
igr2=1897,1898,1899,
&end
#
# 97 LEU HN 97 LEU HB2 3.51
&rst
ixpk= 0, nxpk= 0, iat=1520,1524, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01, &end
#
# 97 LEU HN 97 LEU HB3 3.51
&rst
ixpk= 0, nxpk= 0, iat=1520,1525, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01, &end
#
# 97 LEU HN 97 LEU HG 4.69
&rst
ixpk= 0, nxpk= 0, iat=1520,1527, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, &end
#
# 97 LEU HN 97 LEU QB 2.97
&rst
ixpk= 0, nxpk= 0, iat=1520, -1, r1= 1.30, r2= 1.80, r3= 3.33, r4= 3.83,
igr2=1524,1525,
&end
#
# 97 LEU HN 97 LEU QD1 4.18
&rst
ixpk= 0, nxpk= 0, iat=1520, -1, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
igr2=1529,1530,1531,
&end
#
# 97 LEU HN 97 LEU QD2 4.42
&rst
ixpk= 0, nxpk= 0, iat=1520, -1, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
igr2=1533,1534,1535,
&end
#
# 97 LEU HN 98 THR HN 4.54
&rst
ixpk= 0, nxpk= 0, iat=1520,1539, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 97 LEU QB 119 LEU QD2 4.04
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,
igr1=1524,1525,
igr2=1897,1898,1899,
&end
#
# 97 LEU QB 97 LEU QD1 3.13
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
igr1=1524,1525,
igr2=1529,1530,1531,
&end
#
# 97 LEU QD1 100 LEU HA 4.61
&rst
ixpk= 0, nxpk= 0, iat= -1,1572, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
igr1=1529,1530,1531,
&end
#
# 97 LEU QD1 100 LEU QB 3.95
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
igr1=1529,1530,1531,
igr2=1574,1575,
&end
#
# 97 LEU QD1 98 THR HA 5.06
&rst
ixpk= 0, nxpk= 0, iat= -1,1541, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
igr1=1529,1530,1531,
&end
#
# 97 LEU QD1 98 THR HN 3.78
&rst
ixpk= 0, nxpk= 0, iat= -1,1539, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
igr1=1529,1530,1531,
&end
#
# 97 LEU QD1 99 HIS HA 5.10
&rst
ixpk= 0, nxpk= 0, iat= -1,1555, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,
igr1=1529,1530,1531,
&end
#
# 97 LEU QD1 99 HIS HN 3.98
&rst
ixpk= 0, nxpk= 0, iat= -1,1553, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
igr1=1529,1530,1531,
&end
#
# 97 LEU QD2 100 LEU HA 4.80
&rst
ixpk= 0, nxpk= 0, iat= -1,1572, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
igr1=1533,1534,1535,
&end
#
# 97 LEU QD2 100 LEU QB 3.81
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
igr1=1533,1534,1535,
igr2=1574,1575,
&end
#
# 97 LEU QD2 98 THR HN 5.06
&rst
ixpk= 0, nxpk= 0, iat= -1,1539, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
igr1=1533,1534,1535,
&end
#
# 97 LEU QD2 99 HIS HN 5.48
&rst
ixpk= 0, nxpk= 0, iat= -1,1553, r1= 1.30, r2= 1.80, r3= 6.58, r4= 7.08,
igr1=1533,1534,1535,
&end
#
# 98 THR HA 122 LEU HA 3.56
&rst
ixpk= 0, nxpk= 0, iat=1541,1931, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06, &end
#
# 98 THR HA 122 LEU HN 5.04
&rst
ixpk= 0, nxpk= 0, iat=1541,1929, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54, &end
#
# 98 THR HA 122 LEU QB 5.17
&rst
ixpk= 0, nxpk= 0, iat=1541, -1, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
igr2=1933,1934,
&end
#
# 98 THR HA 122 LEU QD1 3.75
&rst
ixpk= 0, nxpk= 0, iat=1541, -1, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
igr2=1938,1939,1940,
&end
#
# 98 THR HA 123 LYS HN 3.78
&rst
ixpk= 0, nxpk= 0, iat=1541,1948, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28, &end
#
# 98 THR HA 123 LYS QB 4.59
&rst
ixpk= 0, nxpk= 0, iat=1541, -1, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
igr2=1952,1953,
&end
#
# 98 THR HA 124 SER HN 4.33
&rst
ixpk= 0, nxpk= 0, iat=1541,1970, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83, &end
#
# 98 THR HA 98 THR QG2 3.21
&rst
ixpk= 0, nxpk= 0, iat=1541, -1, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,
igr2=1545,1546,1547,
&end
#
# 98 THR HB 122 LEU HA 4.42
&rst
ixpk= 0, nxpk= 0, iat=1543,1931, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92, &end
#
# 98 THR HB 123 LYS HN 4.32
&rst
ixpk= 0, nxpk= 0, iat=1543,1948, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82, &end
#
# 98 THR HB 123 LYS QB 3.72
&rst
ixpk= 0, nxpk= 0, iat=1543, -1, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
igr2=1952,1953,
&end
#
# 98 THR HB 123 LYS QG 5.50
&rst
ixpk= 0, nxpk= 0, iat=1543, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2=1955,1956,
&end
#
# 98 THR HB 99 HIS HE1 4.72
&rst
ixpk= 0, nxpk= 0, iat=1543,1562, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22, &end
#
# 98 THR HB 99 HIS HN 4.54
&rst
ixpk= 0, nxpk= 0, iat=1543,1553, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 98 THR HN 98 THR QG2 3.63
&rst
ixpk= 0, nxpk= 0, iat=1539, -1, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,
igr2=1545,1546,1547,
&end
#
# 98 THR HN 99 HIS HA 5.21
&rst
ixpk= 0, nxpk= 0, iat=1539,1555, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71, &end
#
# 98 THR HN 99 HIS HN 3.32
&rst
ixpk= 0, nxpk= 0, iat=1539,1553, r1= 1.30, r2= 1.80, r3= 3.32, r4= 3.82, &end
#
# 98 THR QG2 121 CYS HA 4.16
&rst
ixpk= 0, nxpk= 0, iat= -1,1920, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,
igr1=1545,1546,1547,
&end
#
# 98 THR QG2 121 CYS HB2 3.63
&rst
ixpk= 0, nxpk= 0, iat= -1,1922, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,
igr1=1545,1546,1547,
&end
#
# 98 THR QG2 121 CYS HB3 3.63
&rst
ixpk= 0, nxpk= 0, iat= -1,1923, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,
igr1=1545,1546,1547,
&end
#
# 98 THR QG2 122 LEU HA 3.88
&rst
ixpk= 0, nxpk= 0, iat= -1,1931, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
igr1=1545,1546,1547,
&end
#
# 98 THR QG2 122 LEU HN 4.76
&rst
ixpk= 0, nxpk= 0, iat= -1,1929, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
igr1=1545,1546,1547,
&end
#
# 98 THR QG2 122 LEU QD1 4.62
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.66, r4= 7.16,
igr1=1545,1546,1547,
igr2=1938,1939,1940,
&end
#
# 98 THR QG2 123 LYS HB2 4.89
&rst
ixpk= 0, nxpk= 0, iat= -1,1952, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,
igr1=1545,1546,1547,
&end
#
# 98 THR QG2 123 LYS HB3 4.89
&rst
ixpk= 0, nxpk= 0, iat= -1,1953, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,
igr1=1545,1546,1547,
&end
#
# 98 THR QG2 123 LYS HN 3.99
&rst
ixpk= 0, nxpk= 0, iat= -1,1948, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
igr1=1545,1546,1547,
&end
#
# 98 THR QG2 123 LYS QB 4.27
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
igr1=1545,1546,1547,
igr2=1952,1953,
&end
#
# 98 THR QG2 124 SER HN 5.36
&rst
ixpk= 0, nxpk= 0, iat= -1,1970, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,
igr1=1545,1546,1547,
&end
#
# 98 THR QG2 99 HIS HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1555, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1=1545,1546,1547,
&end
#
# 98 THR QG2 99 HIS HE1 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1562, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1=1545,1546,1547,
&end
#
# 98 THR QG2 99 HIS HN 4.12
&rst
ixpk= 0, nxpk= 0, iat= -1,1553, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr1=1545,1546,1547,
&end
#
# 99 HIS HA 100 LEU HB2 4.90
&rst
ixpk= 0, nxpk= 0, iat=1555,1574, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40, &end
#
# 99 HIS HA 100 LEU HB3 4.90
&rst
ixpk= 0, nxpk= 0, iat=1555,1575, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40, &end
#
# 99 HIS HA 100 LEU HN 3.04
&rst
ixpk= 0, nxpk= 0, iat=1555,1570, r1= 1.30, r2= 1.80, r3= 3.04, r4= 3.54, &end
#
# 99 HIS HA 100 LEU QB 4.21
&rst
ixpk= 0, nxpk= 0, iat=1555, -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
igr2=1574,1575,
&end
#
# 99 HIS HA 122 LEU QD1 4.11
&rst
ixpk= 0, nxpk= 0, iat=1555, -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
igr2=1938,1939,1940,
&end
#
# 99 HIS HA 123 LYS HN 4.92
&rst
ixpk= 0, nxpk= 0, iat=1555,1948, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42, &end
#
# 99 HIS HA 124 SER HN 4.00
&rst
ixpk= 0, nxpk= 0, iat=1555,1970, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 99 HIS HA 124 SER QB 3.78
&rst
ixpk= 0, nxpk= 0, iat=1555, -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
igr2=1974,1975,
&end
#
# 99 HIS HA 99 HIS HD2 4.49
&rst
ixpk= 0, nxpk= 0, iat=1555,1566, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99, &end
#
# 99 HIS HB3 100 LEU HN 4.28
&rst
ixpk= 0, nxpk= 0, iat=1558,1570, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78, &end
#
# 99 HIS HD2 100 LEU HN 4.90
&rst
ixpk= 0, nxpk= 0, iat=1566,1570, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40, &end
#
# 99 HIS HD2 124 SER QB 3.92
&rst
ixpk= 0, nxpk= 0, iat=1566, -1, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,
igr2=1974,1975,
&end
#
# 99 HIS HE1 123 LYS QB 5.12
&rst
ixpk= 0, nxpk= 0, iat=1562, -1, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
igr2=1952,1953,
&end
#
# 99 HIS HE1 123 LYS QD 4.41
&rst
ixpk= 0, nxpk= 0, iat=1562, -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr2=1958,1959,
&end
#
# 99 HIS HE1 123 LYS QE 4.80
&rst
ixpk= 0, nxpk= 0, iat=1562, -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr2=1961,1962,
&end
#
# 99 HIS HN 100 LEU HN 4.58
&rst
ixpk= 0, nxpk= 0, iat=1553,1570, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08, &end
#
# 99 HIS HN 99 HIS HB2 3.95
&rst
ixpk= 0, nxpk= 0, iat=1553,1557, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45, &end
#
# 99 HIS HN 99 HIS HB3 4.06
&rst
ixpk= 0, nxpk= 0, iat=1553,1558, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56, &end
#
# 100 LEU HA 100 LEU QD1 3.29
&rst
ixpk= 0, nxpk= 0, iat=1572, -1, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
igr2=1579,1580,1581,
&end
#
# 100 LEU HA 100 LEU QD2 4.01
&rst
ixpk= 0, nxpk= 0, iat=1572, -1, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
igr2=1583,1584,1585,
&end
#
# 100 LEU HA 101 ASN HN 3.20
&rst
ixpk= 0, nxpk= 0, iat=1572,1589, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 100 LEU HB2 100 LEU QD1 3.34
&rst
ixpk= 0, nxpk= 0, iat=1574, -1, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,
igr2=1579,1580,1581,
&end
#
# 100 LEU HB2 100 LEU QD2 3.94
&rst
ixpk= 0, nxpk= 0, iat=1574, -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
igr2=1583,1584,1585,
&end
#
# 100 LEU HB3 100 LEU QD1 3.34
&rst
ixpk= 0, nxpk= 0, iat=1575, -1, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,
igr2=1579,1580,1581,
&end
#
# 100 LEU HB3 100 LEU QD2 3.94
&rst
ixpk= 0, nxpk= 0, iat=1575, -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
igr2=1583,1584,1585,
&end
#
# 100 LEU HG 101 ASN HA 5.50
&rst
ixpk= 0, nxpk= 0, iat=1577,1591, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 100 LEU HG 101 ASN HN 4.57
&rst
ixpk= 0, nxpk= 0, iat=1577,1589, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07, &end
#
# 100 LEU HN 100 LEU HB2 3.61
&rst
ixpk= 0, nxpk= 0, iat=1570,1574, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11, &end
#
# 100 LEU HN 100 LEU HB3 3.61
&rst
ixpk= 0, nxpk= 0, iat=1570,1575, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11, &end
#
# 100 LEU HN 100 LEU QD2 5.42
&rst
ixpk= 0, nxpk= 0, iat=1570, -1, r1= 1.30, r2= 1.80, r3= 6.51, r4= 7.01,
igr2=1583,1584,1585,
&end
#
# 100 LEU HN 122 LEU QD1 3.73
&rst
ixpk= 0, nxpk= 0, iat=1570, -1, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
igr2=1938,1939,1940,
&end
#
# 100 LEU HN 124 SER HN 5.22
&rst
ixpk= 0, nxpk= 0, iat=1570,1970, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72, &end
#
# 100 LEU HN 124 SER QB 4.48
&rst
ixpk= 0, nxpk= 0, iat=1570, -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
igr2=1974,1975,
&end
#
# 100 LEU HN 125 LEU HA 4.38
&rst
ixpk= 0, nxpk= 0, iat=1570,1983, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88, &end
#
# 100 LEU HN 126 ASP HN 5.03
&rst
ixpk= 0, nxpk= 0, iat=1570,2000, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53, &end
#
# 100 LEU QB 100 LEU QD2 3.22
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,
igr1=1574,1575,
igr2=1583,1584,1585,
&end
#
# 100 LEU QD1 101 ASN HA 5.13
&rst
ixpk= 0, nxpk= 0, iat= -1,1591, r1= 1.30, r2= 1.80, r3= 6.16, r4= 6.66,
igr1=1579,1580,1581,
&end
#
# 100 LEU QD1 101 ASN HN 3.21
&rst
ixpk= 0, nxpk= 0, iat= -1,1589, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,
igr1=1579,1580,1581,
&end
#
# 101 ASN HA 102 LEU HA 4.91
&rst
ixpk= 0, nxpk= 0, iat=1591,1605, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41, &end
#
# 101 ASN HA 102 LEU HG 5.50
&rst
ixpk= 0, nxpk= 0, iat=1591,1610, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 101 ASN HA 102 LEU HN 3.43
&rst
ixpk= 0, nxpk= 0, iat=1591,1603, r1= 1.30, r2= 1.80, r3= 3.43, r4= 3.93, &end
#
# 101 ASN HA 103 SER HN 4.12
&rst
ixpk= 0, nxpk= 0, iat=1591,1622, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62, &end
#
# 101 ASN HA 125 LEU QD1 5.34
&rst
ixpk= 0, nxpk= 0, iat=1591, -1, r1= 1.30, r2= 1.80, r3= 6.41, r4= 6.91,
igr2=1990,1991,1992,
&end
#
# 101 ASN HA 126 ASP HB2 4.42
&rst
ixpk= 0, nxpk= 0, iat=1591,2004, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92, &end
#
# 101 ASN HA 126 ASP HB3 4.42
&rst
ixpk= 0, nxpk= 0, iat=1591,2005, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92, &end
#
# 101 ASN HA 126 ASP HN 4.03
&rst
ixpk= 0, nxpk= 0, iat=1591,2000, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53, &end
#
# 101 ASN HA 126 ASP QB 3.74
&rst
ixpk= 0, nxpk= 0, iat=1591, -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
igr2=2004,2005,
&end
#
# 101 ASN HN 101 ASN HB2 3.84
&rst
ixpk= 0, nxpk= 0, iat=1589,1593, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34, &end
#
# 101 ASN HN 101 ASN HB3 3.84
&rst
ixpk= 0, nxpk= 0, iat=1589,1594, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34, &end
#
# 101 ASN HN 101 ASN QB 3.36
&rst
ixpk= 0, nxpk= 0, iat=1589, -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
igr2=1593,1594,
&end
#
# 101 ASN HN 102 LEU HN 4.75
&rst
ixpk= 0, nxpk= 0, iat=1589,1603, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, &end
#
# 101 ASN QB 103 SER HN 4.16
&rst
ixpk= 0, nxpk= 0, iat= -1,1622, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
igr1=1593,1594,
&end
#
# 102 LEU HA 102 LEU HG 4.10
&rst
ixpk= 0, nxpk= 0, iat=1605,1610, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60, &end
#
# 102 LEU HA 102 LEU QD2 3.08
&rst
ixpk= 0, nxpk= 0, iat=1605, -1, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,
igr2=1616,1617,1618,
&end
#
# 102 LEU HA 105 ASN HD21 4.34
&rst
ixpk= 0, nxpk= 0, iat=1605,1649, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84, &end
#
# 102 LEU HA 105 ASN HD22 4.34
&rst
ixpk= 0, nxpk= 0, iat=1605,1650, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84, &end
#
# 102 LEU HA 107 LEU QD1 3.99
&rst
ixpk= 0, nxpk= 0, iat=1605, -1, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
igr2=1685,1686,1687,
&end
#
# 102 LEU HA 126 ASP HN 5.50
&rst
ixpk= 0, nxpk= 0, iat=1605,2000, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 102 LEU HN 102 LEU HG 4.35
&rst
ixpk= 0, nxpk= 0, iat=1603,1610, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85, &end
#
# 102 LEU HN 102 LEU QB 3.67
&rst
ixpk= 0, nxpk= 0, iat=1603, -1, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
igr2=1607,1608,
&end
#
# 102 LEU HN 102 LEU QD1 4.39
&rst
ixpk= 0, nxpk= 0, iat=1603, -1, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77,
igr2=1612,1613,1614,
&end
#
# 102 LEU HN 102 LEU QD2 4.10
&rst
ixpk= 0, nxpk= 0, iat=1603, -1, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
igr2=1616,1617,1618,
&end
#
# 102 LEU HN 103 SER HN 3.43
&rst
ixpk= 0, nxpk= 0, iat=1603,1622, r1= 1.30, r2= 1.80, r3= 3.43, r4= 3.93, &end
#
# 102 LEU HN 107 LEU QD1 5.35
&rst
ixpk= 0, nxpk= 0, iat=1603, -1, r1= 1.30, r2= 1.80, r3= 6.43, r4= 6.93,
igr2=1685,1686,1687,
&end
#
# 102 LEU HN 125 LEU QD1 4.30
&rst
ixpk= 0, nxpk= 0, iat=1603, -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
igr2=1990,1991,1992,
&end
#
# 102 LEU HN 126 ASP HB2 4.64
&rst
ixpk= 0, nxpk= 0, iat=1603,2004, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14, &end
#
# 102 LEU HN 126 ASP HB3 4.64
&rst
ixpk= 0, nxpk= 0, iat=1603,2005, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14, &end
#
# 102 LEU HN 126 ASP HN 4.22
&rst
ixpk= 0, nxpk= 0, iat=1603,2000, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 102 LEU HN 126 ASP QB 4.00
&rst
ixpk= 0, nxpk= 0, iat=1603, -1, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
igr2=2004,2005,
&end
#
# 102 LEU QB 102 LEU QD1 3.10
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
igr1=1607,1608,
igr2=1612,1613,1614,
&end
#
# 102 LEU QB 102 LEU QD2 2.88
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,
igr1=1607,1608,
igr2=1616,1617,1618,
&end
#
# 102 LEU QB 107 LEU QD1 3.37
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
igr1=1607,1608,
igr2=1685,1686,1687,
&end
#
# 102 LEU QB 126 ASP HN 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1,2000, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1=1607,1608,
&end
#
# 102 LEU QD2 103 SER HN 4.82
&rst
ixpk= 0, nxpk= 0, iat= -1,1622, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,
igr1=1616,1617,1618,
&end
#
# 102 LEU QD2 105 ASN HB2 4.43
&rst
ixpk= 0, nxpk= 0, iat= -1,1644, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
igr1=1616,1617,1618,
&end
#
# 102 LEU QD2 105 ASN HB3 4.85
&rst
ixpk= 0, nxpk= 0, iat= -1,1645, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32,
igr1=1616,1617,1618,
&end
#
# 102 LEU QD2 105 ASN QD2 4.49
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
igr1=1616,1617,1618,
igr2=1649,1650,
&end
#
# 103 SER HA 104 GLY HN 3.41
&rst
ixpk= 0, nxpk= 0, iat=1624,1633, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91, &end
#
# 103 SER HA 105 ASN HN 4.10
&rst
ixpk= 0, nxpk= 0, iat=1624,1640, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60, &end
#
# 103 SER HA 128 PHE HN 3.57
&rst
ixpk= 0, nxpk= 0, iat=1624,2031, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07, &end
#
# 103 SER HA 128 PHE QB 4.65
&rst
ixpk= 0, nxpk= 0, iat=1624, -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
igr2=2035,2036,
&end
#
# 103 SER HA 129 ASN QB 4.98
&rst
ixpk= 0, nxpk= 0, iat=1624, -1, r1= 1.30, r2= 1.80, r3= 5.59, r4= 6.09,
igr2=2055,2056,
&end
#
# 103 SER HB2 104 GLY HN 4.59
&rst
ixpk= 0, nxpk= 0, iat=1626,1633, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 103 SER HB2 128 PHE HB2 5.06
&rst
ixpk= 0, nxpk= 0, iat=1626,2035, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56, &end
#
# 103 SER HB2 128 PHE HB3 5.06
&rst
ixpk= 0, nxpk= 0, iat=1626,2036, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56, &end
#
# 103 SER HB2 128 PHE HN 4.70
&rst
ixpk= 0, nxpk= 0, iat=1626,2031, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 103 SER HB3 104 GLY HN 4.59
&rst
ixpk= 0, nxpk= 0, iat=1627,1633, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 103 SER HB3 128 PHE HB2 5.06
&rst
ixpk= 0, nxpk= 0, iat=1627,2035, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56, &end
#
# 103 SER HB3 128 PHE HB3 5.06
&rst
ixpk= 0, nxpk= 0, iat=1627,2036, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56, &end
#
# 103 SER HB3 128 PHE HN 4.70
&rst
ixpk= 0, nxpk= 0, iat=1627,2031, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 103 SER HN 103 SER HB2 4.12
&rst
ixpk= 0, nxpk= 0, iat=1622,1626, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62, &end
#
# 103 SER HN 103 SER HB3 4.12
&rst
ixpk= 0, nxpk= 0, iat=1622,1627, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62, &end
#
# 103 SER QB 104 GLY HN 4.01
&rst
ixpk= 0, nxpk= 0, iat= -1,1633, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
igr1=1626,1627,
&end
#
# 103 SER QB 126 ASP QB 5.16
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
igr1=1626,1627,
igr2=2004,2005,
&end
#
# 103 SER QB 128 PHE QB 3.41
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
igr1=1626,1627,
igr2=2035,2036,
&end
#
# 103 SER QB 128 PHE QD 4.87
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.14, r4= 6.64,
igr1=1626,1627,
igr2=2039,2047,
&end
#
# 103 SER QB 129 ASN QB 4.65
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
igr1=1626,1627,
igr2=2055,2056,
&end
#
# 104 GLY HA2 105 ASN HA 4.85
&rst
ixpk= 0, nxpk= 0, iat=1635,1642, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35, &end
#
# 104 GLY HA2 129 ASN QB 4.09
&rst
ixpk= 0, nxpk= 0, iat=1635, -1, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
igr2=2055,2056,
&end
#
# 104 GLY HA2 129 ASN QD2 4.75
&rst
ixpk= 0, nxpk= 0, iat=1635, -1, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
igr2=2060,2061,
&end
#
# 104 GLY HA3 105 ASN QD2 4.21
&rst
ixpk= 0, nxpk= 0, iat=1636, -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
igr2=1649,1650,
&end
#
# 104 GLY HA3 129 ASN QB 3.96
&rst
ixpk= 0, nxpk= 0, iat=1636, -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
igr2=2055,2056,
&end
#
# 104 GLY HN 105 ASN HN 3.62
&rst
ixpk= 0, nxpk= 0, iat=1633,1640, r1= 1.30, r2= 1.80, r3= 3.62, r4= 4.12, &end
#
# 104 GLY HN 128 PHE HN 5.14
&rst
ixpk= 0, nxpk= 0, iat=1633,2031, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64, &end
#
# 104 GLY HN 129 ASN QB 3.82
&rst
ixpk= 0, nxpk= 0, iat=1633, -1, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,
igr2=2055,2056,
&end
#
# 104 GLY HN 130 CYS HG 4.45
&rst
ixpk= 0, nxpk= 0, iat=1633,2072, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95, &end
#
# 104 GLY HN 130 CYS HN 5.04
&rst
ixpk= 0, nxpk= 0, iat=1633,2065, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54, &end
#
# 105 ASN HA 105 ASN HD21 4.94
&rst
ixpk= 0, nxpk= 0, iat=1642,1649, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44, &end
#
# 105 ASN HA 105 ASN HD22 4.94
&rst
ixpk= 0, nxpk= 0, iat=1642,1650, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44, &end
#
# 105 ASN HA 105 ASN QD2 4.26
&rst
ixpk= 0, nxpk= 0, iat=1642, -1, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
igr2=1649,1650,
&end
#
# 105 ASN HA 106 LYS QD 5.24
&rst
ixpk= 0, nxpk= 0, iat=1642, -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
igr2=1664,1665,
&end
#
# 105 ASN HA 106 LYS QG 4.16
&rst
ixpk= 0, nxpk= 0, iat=1642, -1, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
igr2=1661,1662,
&end
#
# 105 ASN HA 107 LEU HG 4.55
&rst
ixpk= 0, nxpk= 0, iat=1642,1683, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05, &end
#
# 105 ASN HA 107 LEU HN 5.04
&rst
ixpk= 0, nxpk= 0, iat=1642,1676, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54, &end
#
# 105 ASN HA 107 LEU QD1 5.41
&rst
ixpk= 0, nxpk= 0, iat=1642, -1, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
igr2=1685,1686,1687,
&end
#
# 105 ASN HB2 106 LYS HN 3.71
&rst
ixpk= 0, nxpk= 0, iat=1644,1654, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21, &end
#
# 105 ASN HB2 107 LEU HG 4.68
&rst
ixpk= 0, nxpk= 0, iat=1644,1683, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18, &end
#
# 105 ASN HB2 107 LEU HN 4.34
&rst
ixpk= 0, nxpk= 0, iat=1644,1676, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84, &end
#
# 105 ASN HB2 107 LEU QD1 3.98
&rst
ixpk= 0, nxpk= 0, iat=1644, -1, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
igr2=1685,1686,1687,
&end
#
# 105 ASN HB2 107 LEU QD2 4.85
&rst
ixpk= 0, nxpk= 0, iat=1644, -1, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32,
igr2=1689,1690,1691,
&end
#
# 105 ASN HB3 106 LYS HN 3.52
&rst
ixpk= 0, nxpk= 0, iat=1645,1654, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02, &end
#
# 105 ASN HB3 107 LEU HN 4.15
&rst
ixpk= 0, nxpk= 0, iat=1645,1676, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65, &end
#
# 105 ASN HB3 107 LEU QD1 4.00
&rst
ixpk= 0, nxpk= 0, iat=1645, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2=1685,1686,1687,
&end
#
# 105 ASN HB3 107 LEU QD2 4.44
&rst
ixpk= 0, nxpk= 0, iat=1645, -1, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
igr2=1689,1690,1691,
&end
#
# 105 ASN HN 105 ASN HB2 3.40
&rst
ixpk= 0, nxpk= 0, iat=1640,1644, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90, &end
#
# 105 ASN HN 105 ASN HB3 3.78
&rst
ixpk= 0, nxpk= 0, iat=1640,1645, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28, &end
#
# 105 ASN HN 105 ASN HD21 3.68
&rst
ixpk= 0, nxpk= 0, iat=1640,1649, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18, &end
#
# 105 ASN HN 105 ASN HD22 3.68
&rst
ixpk= 0, nxpk= 0, iat=1640,1650, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18, &end
#
# 105 ASN HN 105 ASN QD2 3.14
&rst
ixpk= 0, nxpk= 0, iat=1640, -1, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02,
igr2=1649,1650,
&end
#
# 105 ASN HN 106 LYS HN 4.60
&rst
ixpk= 0, nxpk= 0, iat=1640,1654, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 105 ASN HN 107 LEU HN 4.89
&rst
ixpk= 0, nxpk= 0, iat=1640,1676, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39, &end
#
# 105 ASN HN 107 LEU QD1 4.37
&rst
ixpk= 0, nxpk= 0, iat=1640, -1, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
igr2=1685,1686,1687,
&end
#
# 105 ASN HN 130 CYS HG 3.81
&rst
ixpk= 0, nxpk= 0, iat=1640,2072, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31, &end
#
# 106 LYS HB2 107 LEU HN 4.59
&rst
ixpk= 0, nxpk= 0, iat=1658,1676, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 106 LYS HB3 107 LEU HN 4.59
&rst
ixpk= 0, nxpk= 0, iat=1659,1676, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 106 LYS HN 106 LYS HB2 4.12
&rst
ixpk= 0, nxpk= 0, iat=1654,1658, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62, &end
#
# 106 LYS HN 106 LYS HB3 4.12
&rst
ixpk= 0, nxpk= 0, iat=1654,1659, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62, &end
#
# 106 LYS HN 106 LYS HG2 4.41
&rst
ixpk= 0, nxpk= 0, iat=1654,1661, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, &end
#
# 106 LYS HN 106 LYS HG3 4.41
&rst
ixpk= 0, nxpk= 0, iat=1654,1662, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, &end
#
# 106 LYS HN 106 LYS QB 3.55
&rst
ixpk= 0, nxpk= 0, iat=1654, -1, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,
igr2=1658,1659,
&end
#
# 106 LYS HN 106 LYS QD 4.61
&rst
ixpk= 0, nxpk= 0, iat=1654, -1, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67,
igr2=1664,1665,
&end
#
# 106 LYS HN 106 LYS QG 3.78
&rst
ixpk= 0, nxpk= 0, iat=1654, -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
igr2=1661,1662,
&end
#
# 106 LYS HN 107 LEU HG 4.46
&rst
ixpk= 0, nxpk= 0, iat=1654,1683, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, &end
#
# 106 LYS HN 107 LEU HN 3.86
&rst
ixpk= 0, nxpk= 0, iat=1654,1676, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 106 LYS HN 107 LEU QD1 5.16
&rst
ixpk= 0, nxpk= 0, iat=1654, -1, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
igr2=1685,1686,1687,
&end
#
# 106 LYS HN 107 LEU QD2 4.21
&rst
ixpk= 0, nxpk= 0, iat=1654, -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
igr2=1689,1690,1691,
&end
#
# 106 LYS QB 106 LYS QD 3.21
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
igr1=1658,1659,
igr2=1664,1665,
&end
#
# 106 LYS QB 106 LYS QE 3.40
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,
igr1=1658,1659,
igr2=1667,1668,
&end
#
# 106 LYS QB 107 LEU HN 4.01
&rst
ixpk= 0, nxpk= 0, iat= -1,1676, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
igr1=1658,1659,
&end
#
# 106 LYS QD 107 LEU HN 5.15
&rst
ixpk= 0, nxpk= 0, iat= -1,1676, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr1=1664,1665,
&end
#
# 106 LYS QG 106 LYS QE 3.21
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
igr1=1661,1662,
igr2=1667,1668,
&end
#
# 107 LEU HA 107 LEU HG 4.18
&rst
ixpk= 0, nxpk= 0, iat=1678,1683, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68, &end
#
# 107 LEU HA 107 LEU QD1 4.10
&rst
ixpk= 0, nxpk= 0, iat=1678, -1, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
igr2=1685,1686,1687,
&end
#
# 107 LEU HA 107 LEU QD2 3.11
&rst
ixpk= 0, nxpk= 0, iat=1678, -1, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23,
igr2=1689,1690,1691,
&end
#
# 107 LEU HA 108 LYS HN 3.25
&rst
ixpk= 0, nxpk= 0, iat=1678,1695, r1= 1.30, r2= 1.80, r3= 3.25, r4= 3.75, &end
#
# 107 LEU HA 108 LYS QB 4.28
&rst
ixpk= 0, nxpk= 0, iat=1678, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2=1699,1700,
&end
#
# 107 LEU HA 109 ASP HN 3.94
&rst
ixpk= 0, nxpk= 0, iat=1678,1717, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44, &end
#
# 107 LEU HA 112 THR QG2 3.93
&rst
ixpk= 0, nxpk= 0, iat=1678, -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
igr2=1765,1766,1767,
&end
#
# 107 LEU HB2 107 LEU QD2 3.62
&rst
ixpk= 0, nxpk= 0, iat=1680, -1, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,
igr2=1689,1690,1691,
&end
#
# 107 LEU HB2 130 CYS HB3 4.78
&rst
ixpk= 0, nxpk= 0, iat=1680,2070, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, &end
#
# 107 LEU HB2 132 VAL QG1 3.75
&rst
ixpk= 0, nxpk= 0, iat=1680, -1, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
igr2=2097,2098,2099,
&end
#
# 107 LEU HB3 107 LEU QD2 3.62
&rst
ixpk= 0, nxpk= 0, iat=1681, -1, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,
igr2=1689,1690,1691,
&end
#
# 107 LEU HB3 130 CYS HB3 4.78
&rst
ixpk= 0, nxpk= 0, iat=1681,2070, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, &end
#
# 107 LEU HB3 132 VAL QG1 3.75
&rst
ixpk= 0, nxpk= 0, iat=1681, -1, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
igr2=2097,2098,2099,
&end
#
# 107 LEU HG 130 CYS HB3 5.44
&rst
ixpk= 0, nxpk= 0, iat=1683,2070, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94, &end
#
# 107 LEU HN 107 LEU HB2 3.72
&rst
ixpk= 0, nxpk= 0, iat=1676,1680, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22, &end
#
# 107 LEU HN 107 LEU HB3 3.72
&rst
ixpk= 0, nxpk= 0, iat=1676,1681, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22, &end
#
# 107 LEU HN 107 LEU HG 3.37
&rst
ixpk= 0, nxpk= 0, iat=1676,1683, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87, &end
#
# 107 LEU HN 107 LEU QB 3.22
&rst
ixpk= 0, nxpk= 0, iat=1676, -1, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11,
igr2=1680,1681,
&end
#
# 107 LEU HN 107 LEU QD1 3.60
&rst
ixpk= 0, nxpk= 0, iat=1676, -1, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,
igr2=1685,1686,1687,
&end
#
# 107 LEU HN 107 LEU QD2 3.77
&rst
ixpk= 0, nxpk= 0, iat=1676, -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
igr2=1689,1690,1691,
&end
#
# 107 LEU HN 112 THR QG2 5.41
&rst
ixpk= 0, nxpk= 0, iat=1676, -1, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
igr2=1765,1766,1767,
&end
#
# 107 LEU HN 130 CYS HB2 5.50
&rst
ixpk= 0, nxpk= 0, iat=1676,2069, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 107 LEU HN 130 CYS HB3 4.21
&rst
ixpk= 0, nxpk= 0, iat=1676,2070, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71, &end
#
# 107 LEU HN 130 CYS HG 5.50
&rst
ixpk= 0, nxpk= 0, iat=1676,2072, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 107 LEU HN 132 VAL QG1 4.68
&rst
ixpk= 0, nxpk= 0, iat=1676, -1, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
igr2=2097,2098,2099,
&end
#
# 107 LEU QB 107 LEU QD1 2.97
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,
igr1=1680,1681,
igr2=1685,1686,1687,
&end
#
# 107 LEU QB 108 LYS HN 4.37
&rst
ixpk= 0, nxpk= 0, iat= -1,1695, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
igr1=1680,1681,
&end
#
# 107 LEU QB 132 VAL QG2 4.63
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
igr1=1680,1681,
igr2=2101,2102,2103,
&end
#
# 107 LEU QD1 108 LYS HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1695, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1=1685,1686,1687,
&end
#
# 107 LEU QD1 130 CYS HB3 4.49
&rst
ixpk= 0, nxpk= 0, iat= -1,2070, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr1=1685,1686,1687,
&end
#
# 107 LEU QD1 130 CYS HG 4.96
&rst
ixpk= 0, nxpk= 0, iat= -1,2072, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
igr1=1685,1686,1687,
&end
#
# 107 LEU QD2 108 LYS HN 4.06
&rst
ixpk= 0, nxpk= 0, iat= -1,1695, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
igr1=1689,1690,1691,
&end
#
# 107 LEU QD2 109 ASP QB 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr1=1689,1690,1691,
igr2=1721,1722,
&end
#
# 107 LEU QD2 112 THR HA 4.28
&rst
ixpk= 0, nxpk= 0, iat= -1,1761, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
igr1=1689,1690,1691,
&end
#
# 107 LEU QD2 112 THR HB 3.37
&rst
ixpk= 0, nxpk= 0, iat= -1,1763, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,
igr1=1689,1690,1691,
&end
#
# 107 LEU QD2 112 THR QG2 2.88
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65,
igr1=1689,1690,1691,
igr2=1765,1766,1767,
&end
#
# 108 LYS HA 108 LYS QG 3.64
&rst
ixpk= 0, nxpk= 0, iat=1697, -1, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59,
igr2=1702,1703,
&end
#
# 108 LYS HA 131 GLU HA 4.59
&rst
ixpk= 0, nxpk= 0, iat=1697,2078, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 108 LYS HA 131 GLU HB2 3.84
&rst
ixpk= 0, nxpk= 0, iat=1697,2080, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34, &end
#
# 108 LYS HA 131 GLU HB3 3.84
&rst
ixpk= 0, nxpk= 0, iat=1697,2081, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34, &end
#
# 108 LYS HA 131 GLU HG2 4.83
&rst
ixpk= 0, nxpk= 0, iat=1697,2083, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33, &end
#
# 108 LYS HA 131 GLU HG3 4.83
&rst
ixpk= 0, nxpk= 0, iat=1697,2084, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33, &end
#
# 108 LYS HA 131 GLU QB 3.07
&rst
ixpk= 0, nxpk= 0, iat=1697, -1, r1= 1.30, r2= 1.80, r3= 3.45, r4= 3.95,
igr2=2080,2081,
&end
#
# 108 LYS HA 131 GLU QG 4.10
&rst
ixpk= 0, nxpk= 0, iat=1697, -1, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
igr2=2083,2084,
&end
#
# 108 LYS HA 132 VAL HA 4.00
&rst
ixpk= 0, nxpk= 0, iat=1697,2093, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 108 LYS HA 132 VAL HB 4.07
&rst
ixpk= 0, nxpk= 0, iat=1697,2095, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57, &end
#
# 108 LYS HA 132 VAL HN 3.48
&rst
ixpk= 0, nxpk= 0, iat=1697,2091, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98, &end
#
# 108 LYS HA 132 VAL QG1 3.86
&rst
ixpk= 0, nxpk= 0, iat=1697, -1, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
igr2=2097,2098,2099,
&end
#
# 108 LYS HA 132 VAL QG2 4.66
&rst
ixpk= 0, nxpk= 0, iat=1697, -1, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
igr2=2101,2102,2103,
&end
#
# 108 LYS HA 133 THR HN 4.96
&rst
ixpk= 0, nxpk= 0, iat=1697,2107, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46, &end
#
# 108 LYS HN 108 LYS QB 3.51
&rst
ixpk= 0, nxpk= 0, iat=1695, -1, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,
igr2=1699,1700,
&end
#
# 108 LYS HN 108 LYS QD 5.15
&rst
ixpk= 0, nxpk= 0, iat=1695, -1, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr2=1705,1706,
&end
#
# 108 LYS HN 108 LYS QG 3.99
&rst
ixpk= 0, nxpk= 0, iat=1695, -1, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
igr2=1702,1703,
&end
#
# 108 LYS HN 109 ASP HN 3.27
&rst
ixpk= 0, nxpk= 0, iat=1695,1717, r1= 1.30, r2= 1.80, r3= 3.27, r4= 3.77, &end
#
# 108 LYS HN 109 ASP QB 4.59
&rst
ixpk= 0, nxpk= 0, iat=1695, -1, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
igr2=1721,1722,
&end
#
# 108 LYS HN 112 THR QG2 4.01
&rst
ixpk= 0, nxpk= 0, iat=1695, -1, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
igr2=1765,1766,1767,
&end
#
# 108 LYS HN 132 VAL QG1 4.93
&rst
ixpk= 0, nxpk= 0, iat=1695, -1, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
igr2=2097,2098,2099,
&end
#
# 108 LYS QB 108 LYS QE 4.58
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,
igr1=1699,1700,
igr2=1708,1709,
&end
#
# 108 LYS QB 109 ASP HN 4.09
&rst
ixpk= 0, nxpk= 0, iat= -1,1717, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
igr1=1699,1700,
&end
#
# 108 LYS QB 109 ASP QB 4.95
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
igr1=1699,1700,
igr2=1721,1722,
&end
#
# 108 LYS QB 131 GLU QB 3.49
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,
igr1=1699,1700,
igr2=2080,2081,
&end
#
# 108 LYS QB 131 GLU QG 4.34
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,
igr1=1699,1700,
igr2=2083,2084,
&end
#
# 108 LYS QB 132 VAL HN 4.78
&rst
ixpk= 0, nxpk= 0, iat= -1,2091, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr1=1699,1700,
&end
#
# 108 LYS QG 108 LYS QE 3.40
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,
igr1=1702,1703,
igr2=1708,1709,
&end
#
# 108 LYS QG 109 ASP HN 4.08
&rst
ixpk= 0, nxpk= 0, iat= -1,1717, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
igr1=1702,1703,
&end
#
# 108 LYS QG 109 ASP QB 4.54
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
igr1=1702,1703,
igr2=1721,1722,
&end
#
# 108 LYS QG 131 GLU HB2 4.31
&rst
ixpk= 0, nxpk= 0, iat= -1,2080, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
igr1=1702,1703,
&end
#
# 108 LYS QG 131 GLU HB3 4.31
&rst
ixpk= 0, nxpk= 0, iat= -1,2081, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
igr1=1702,1703,
&end
#
# 108 LYS QG 131 GLU QB 3.69
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
igr1=1702,1703,
igr2=2080,2081,
&end
#
# 108 LYS QG 131 GLU QG 4.15
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73,
igr1=1702,1703,
igr2=2083,2084,
&end
#
# 109 ASP HA 110 ILE HA 4.45
&rst
ixpk= 0, nxpk= 0, iat=1719,1731, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95, &end
#
# 109 ASP HA 110 ILE HB 4.87
&rst
ixpk= 0, nxpk= 0, iat=1719,1733, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37, &end
#
# 109 ASP HA 110 ILE HG12 4.63
&rst
ixpk= 0, nxpk= 0, iat=1719,1739, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, &end
#
# 109 ASP HA 110 ILE HG13 5.50
&rst
ixpk= 0, nxpk= 0, iat=1719,1740, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 109 ASP HA 110 ILE HN 3.22
&rst
ixpk= 0, nxpk= 0, iat=1719,1729, r1= 1.30, r2= 1.80, r3= 3.22, r4= 3.72, &end
#
# 109 ASP HA 111 SER HN 4.66
&rst
ixpk= 0, nxpk= 0, iat=1719,1748, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16, &end
#
# 109 ASP HA 132 VAL QG1 5.17
&rst
ixpk= 0, nxpk= 0, iat=1719, -1, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,
igr2=2097,2098,2099,
&end
#
# 109 ASP HA 132 VAL QG2 3.77
&rst
ixpk= 0, nxpk= 0, iat=1719, -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
igr2=2101,2102,2103,
&end
#
# 109 ASP HA 135 LEU QD1 3.74
&rst
ixpk= 0, nxpk= 0, iat=1719, -1, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
igr2=2144,2145,2146,
&end
#
# 109 ASP HA 135 LEU QD2 4.81
&rst
ixpk= 0, nxpk= 0, iat=1719, -1, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr2=2148,2149,2150,
&end
#
# 109 ASP HN 109 ASP QB 3.37
&rst
ixpk= 0, nxpk= 0, iat=1717, -1, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,
igr2=1721,1722,
&end
#
# 109 ASP HN 112 THR HB 5.50
&rst
ixpk= 0, nxpk= 0, iat=1717,1763, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 109 ASP HN 112 THR QG2 3.71
&rst
ixpk= 0, nxpk= 0, iat=1717, -1, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
igr2=1765,1766,1767,
&end
#
# 109 ASP HN 132 VAL QG1 4.29
&rst
ixpk= 0, nxpk= 0, iat=1717, -1, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
igr2=2097,2098,2099,
&end
#
# 109 ASP HN 132 VAL QG2 4.36
&rst
ixpk= 0, nxpk= 0, iat=1717, -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr2=2101,2102,2103,
&end
#
# 109 ASP QB 110 ILE HA 4.71
&rst
ixpk= 0, nxpk= 0, iat= -1,1731, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,
igr1=1721,1722,
&end
#
# 109 ASP QB 110 ILE HB 4.35
&rst
ixpk= 0, nxpk= 0, iat= -1,1733, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
igr1=1721,1722,
&end
#
# 109 ASP QB 110 ILE HG12 4.76
&rst
ixpk= 0, nxpk= 0, iat= -1,1739, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr1=1721,1722,
&end
#
# 109 ASP QB 110 ILE HN 3.34
&rst
ixpk= 0, nxpk= 0, iat= -1,1729, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,
igr1=1721,1722,
&end
#
# 109 ASP QB 110 ILE QD1 5.45
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.35, r4= 7.85,
igr1=1721,1722,
igr2=1742,1743,1744,
&end
#
# 109 ASP QB 110 ILE QG2 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr1=1721,1722,
igr2=1735,1736,1737,
&end
#
# 109 ASP QB 111 SER HN 3.49
&rst
ixpk= 0, nxpk= 0, iat= -1,1748, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
igr1=1721,1722,
&end
#
# 109 ASP QB 111 SER QB 4.30
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr1=1721,1722,
igr2=1752,1753,
&end
#
# 109 ASP QB 112 THR HB 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1763, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1=1721,1722,
&end
#
# 109 ASP QB 112 THR HN 3.94
&rst
ixpk= 0, nxpk= 0, iat= -1,1759, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
igr1=1721,1722,
&end
#
# 109 ASP QB 112 THR QG2 3.54
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
igr1=1721,1722,
igr2=1765,1766,1767,
&end
#
# 109 ASP QB 132 VAL QG1 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr1=1721,1722,
igr2=2097,2098,2099,
&end
#
# 109 ASP QB 132 VAL QG2 4.61
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,
igr1=1721,1722,
igr2=2101,2102,2103,
&end
#
# 109 ASP QB 135 LEU QD1 4.28
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,
igr1=1721,1722,
igr2=2144,2145,2146,
&end
#
# 110 ILE HA 110 ILE HG12 3.68
&rst
ixpk= 0, nxpk= 0, iat=1731,1739, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18, &end
#
# 110 ILE HA 110 ILE QD1 3.00
&rst
ixpk= 0, nxpk= 0, iat=1731, -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr2=1742,1743,1744,
&end
#
# 110 ILE HA 110 ILE QG2 3.03
&rst
ixpk= 0, nxpk= 0, iat=1731, -1, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
igr2=1735,1736,1737,
&end
#
# 110 ILE HA 112 THR HN 4.33
&rst
ixpk= 0, nxpk= 0, iat=1731,1759, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83, &end
#
# 110 ILE HA 113 LEU HG 3.76
&rst
ixpk= 0, nxpk= 0, iat=1731,1780, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26, &end
#
# 110 ILE HA 113 LEU HN 4.12
&rst
ixpk= 0, nxpk= 0, iat=1731,1773, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62, &end
#
# 110 ILE HA 113 LEU QD1 3.65
&rst
ixpk= 0, nxpk= 0, iat=1731, -1, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
igr2=1782,1783,1784,
&end
#
# 110 ILE HA 113 LEU QD2 4.55
&rst
ixpk= 0, nxpk= 0, iat=1731, -1, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
igr2=1786,1787,1788,
&end
#
# 110 ILE HA 132 VAL QG1 5.15
&rst
ixpk= 0, nxpk= 0, iat=1731, -1, r1= 1.30, r2= 1.80, r3= 6.18, r4= 6.68,
igr2=2097,2098,2099,
&end
#
# 110 ILE HA 132 VAL QG2 3.51
&rst
ixpk= 0, nxpk= 0, iat=1731, -1, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
igr2=2101,2102,2103,
&end
#
# 110 ILE HA 135 LEU QD1 4.17
&rst
ixpk= 0, nxpk= 0, iat=1731, -1, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
igr2=2144,2145,2146,
&end
#
# 110 ILE HB 110 ILE QD1 3.33
&rst
ixpk= 0, nxpk= 0, iat=1733, -1, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,
igr2=1742,1743,1744,
&end
#
# 110 ILE HB 111 SER HN 3.58
&rst
ixpk= 0, nxpk= 0, iat=1733,1748, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08, &end
#
# 110 ILE HB 135 LEU QD1 4.00
&rst
ixpk= 0, nxpk= 0, iat=1733, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2=2144,2145,2146,
&end
#
# 110 ILE HG12 111 SER HN 4.63
&rst
ixpk= 0, nxpk= 0, iat=1739,1748, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, &end
#
# 110 ILE HG12 132 VAL QG2 3.70
&rst
ixpk= 0, nxpk= 0, iat=1739, -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
igr2=2101,2102,2103,
&end
#
# 110 ILE HG12 135 LEU QD1 3.57
&rst
ixpk= 0, nxpk= 0, iat=1739, -1, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,
igr2=2144,2145,2146,
&end
#
# 110 ILE HG12 141 SER QB 4.35
&rst
ixpk= 0, nxpk= 0, iat=1739, -1, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
igr2=2244,2245,
&end
#
# 110 ILE HG13 111 SER HN 5.50
&rst
ixpk= 0, nxpk= 0, iat=1740,1748, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 110 ILE HG13 135 LEU QD1 3.74
&rst
ixpk= 0, nxpk= 0, iat=1740, -1, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
igr2=2144,2145,2146,
&end
#
# 110 ILE HG13 141 SER HA 4.48
&rst
ixpk= 0, nxpk= 0, iat=1740,2242, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98, &end
#
# 110 ILE HG13 141 SER HN 5.50
&rst
ixpk= 0, nxpk= 0, iat=1740,2240, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 110 ILE HG13 141 SER QB 3.63
&rst
ixpk= 0, nxpk= 0, iat=1740, -1, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,
igr2=2244,2245,
&end
#
# 110 ILE HN 110 ILE HB 3.19
&rst
ixpk= 0, nxpk= 0, iat=1729,1733, r1= 1.30, r2= 1.80, r3= 3.19, r4= 3.69, &end
#
# 110 ILE HN 110 ILE HG12 3.61
&rst
ixpk= 0, nxpk= 0, iat=1729,1739, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11, &end
#
# 110 ILE HN 110 ILE HG13 4.03
&rst
ixpk= 0, nxpk= 0, iat=1729,1740, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53, &end
#
# 110 ILE HN 110 ILE QD1 3.95
&rst
ixpk= 0, nxpk= 0, iat=1729, -1, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr2=1742,1743,1744,
&end
#
# 110 ILE HN 110 ILE QG2 3.87
&rst
ixpk= 0, nxpk= 0, iat=1729, -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
igr2=1735,1736,1737,
&end
#
# 110 ILE HN 111 SER HN 3.40
&rst
ixpk= 0, nxpk= 0, iat=1729,1748, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90, &end
#
# 110 ILE HN 112 THR HN 5.10
&rst
ixpk= 0, nxpk= 0, iat=1729,1759, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, &end
#
# 110 ILE HN 132 VAL QG2 3.99
&rst
ixpk= 0, nxpk= 0, iat=1729, -1, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
igr2=2101,2102,2103,
&end
#
# 110 ILE HN 135 LEU QD1 3.90
&rst
ixpk= 0, nxpk= 0, iat=1729, -1, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
igr2=2144,2145,2146,
&end
#
# 110 ILE QD1 111 SER HN 5.26
&rst
ixpk= 0, nxpk= 0, iat= -1,1748, r1= 1.30, r2= 1.80, r3= 6.32, r4= 6.82,
igr1=1742,1743,1744,
&end
#
# 110 ILE QD1 113 LEU HN 5.19
&rst
ixpk= 0, nxpk= 0, iat= -1,1773, r1= 1.30, r2= 1.80, r3= 6.23, r4= 6.73,
igr1=1742,1743,1744,
&end
#
# 110 ILE QD1 135 LEU QD1 3.31
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
igr1=1742,1743,1744,
igr2=2144,2145,2146,
&end
#
# 110 ILE QD1 138 TYR HA 4.43
&rst
ixpk= 0, nxpk= 0, iat= -1,2182, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
igr1=1742,1743,1744,
&end
#
# 110 ILE QD1 141 SER HA 5.10
&rst
ixpk= 0, nxpk= 0, iat= -1,2242, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,
igr1=1742,1743,1744,
&end
#
# 110 ILE QD1 141 SER HB2 3.37
&rst
ixpk= 0, nxpk= 0, iat= -1,2244, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,
igr1=1742,1743,1744,
&end
#
# 110 ILE QD1 141 SER HB3 3.37
&rst
ixpk= 0, nxpk= 0, iat= -1,2245, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,
igr1=1742,1743,1744,
&end
#
# 110 ILE QD1 141 SER HN 4.37
&rst
ixpk= 0, nxpk= 0, iat= -1,2240, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
igr1=1742,1743,1744,
&end
#
# 110 ILE QD1 141 SER QB 2.92
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,
igr1=1742,1743,1744,
igr2=2244,2245,
&end
#
# 110 ILE QD1 142 VAL HA 3.82
&rst
ixpk= 0, nxpk= 0, iat= -1,2253, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
igr1=1742,1743,1744,
&end
#
# 110 ILE QD1 142 VAL HN 3.86
&rst
ixpk= 0, nxpk= 0, iat= -1,2251, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
igr1=1742,1743,1744,
&end
#
# 110 ILE QG2 110 ILE HG12 3.28
&rst
ixpk= 0, nxpk= 0, iat= -1,1739, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,
igr1=1735,1736,1737,
&end
#
# 110 ILE QG2 110 ILE HG13 3.71
&rst
ixpk= 0, nxpk= 0, iat= -1,1740, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
igr1=1735,1736,1737,
&end
#
# 110 ILE QG2 110 ILE QD1 2.47
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06,
igr1=1735,1736,1737,
igr2=1742,1743,1744,
&end
#
# 110 ILE QG2 111 SER HA 3.70
&rst
ixpk= 0, nxpk= 0, iat= -1,1750, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
igr1=1735,1736,1737,
&end
#
# 110 ILE QG2 111 SER HN 3.62
&rst
ixpk= 0, nxpk= 0, iat= -1,1748, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,
igr1=1735,1736,1737,
&end
#
# 110 ILE QG2 111 SER QB 4.96
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.69, r4= 7.19,
igr1=1735,1736,1737,
igr2=1752,1753,
&end
#
# 110 ILE QG2 113 LEU HN 4.65
&rst
ixpk= 0, nxpk= 0, iat= -1,1773, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr1=1735,1736,1737,
&end
#
# 110 ILE QG2 114 GLU HB2 5.20
&rst
ixpk= 0, nxpk= 0, iat= -1,1796, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
igr1=1735,1736,1737,
&end
#
# 110 ILE QG2 114 GLU HG3 5.21
&rst
ixpk= 0, nxpk= 0, iat= -1,1800, r1= 1.30, r2= 1.80, r3= 6.26, r4= 6.76,
igr1=1735,1736,1737,
&end
#
# 110 ILE QG2 114 GLU HN 5.13
&rst
ixpk= 0, nxpk= 0, iat= -1,1792, r1= 1.30, r2= 1.80, r3= 6.16, r4= 6.66,
igr1=1735,1736,1737,
&end
#
# 110 ILE QG2 141 SER QB 3.57
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31,
igr1=1735,1736,1737,
igr2=2244,2245,
&end
#
# 110 ILE QG2 142 VAL HA 4.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2253, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1=1735,1736,1737,
&end
#
# 110 ILE QG2 145 LEU HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2309, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1=1735,1736,1737,
&end
#
# 111 SER HA 114 GLU HB2 3.95
&rst
ixpk= 0, nxpk= 0, iat=1750,1796, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45, &end
#
# 111 SER HA 114 GLU HG3 3.64
&rst
ixpk= 0, nxpk= 0, iat=1750,1800, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14, &end
#
# 111 SER HA 114 GLU HN 3.87
&rst
ixpk= 0, nxpk= 0, iat=1750,1792, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37, &end
#
# 111 SER HA 145 LEU QD2 4.19
&rst
ixpk= 0, nxpk= 0, iat=1750, -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
igr2=2322,2323,2324,
&end
#
# 111 SER HB2 112 THR HN 4.22
&rst
ixpk= 0, nxpk= 0, iat=1752,1759, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 111 SER HB3 112 THR HN 4.22
&rst
ixpk= 0, nxpk= 0, iat=1753,1759, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 111 SER HN 111 SER QB 2.99
&rst
ixpk= 0, nxpk= 0, iat=1748, -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
igr2=1752,1753,
&end
#
# 111 SER HN 112 THR HN 3.34
&rst
ixpk= 0, nxpk= 0, iat=1748,1759, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84, &end
#
# 111 SER HN 112 THR QG2 4.52
&rst
ixpk= 0, nxpk= 0, iat=1748, -1, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
igr2=1765,1766,1767,
&end
#
# 111 SER HN 145 LEU QD2 5.50
&rst
ixpk= 0, nxpk= 0, iat=1748, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2=2322,2323,2324,
&end
#
# 111 SER QB 112 THR HN 3.57
&rst
ixpk= 0, nxpk= 0, iat= -1,1759, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,
igr1=1752,1753,
&end
#
# 111 SER QB 112 THR QG2 5.15
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.94, r4= 7.44,
igr1=1752,1753,
igr2=1765,1766,1767,
&end
#
# 111 SER QB 114 GLU HB2 4.89
&rst
ixpk= 0, nxpk= 0, iat= -1,1796, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
igr1=1752,1753,
&end
#
# 111 SER QB 114 GLU HN 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1,1792, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1=1752,1753,
&end
#
# 112 THR HA 112 THR QG2 3.14
&rst
ixpk= 0, nxpk= 0, iat=1761, -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
igr2=1765,1766,1767,
&end
#
# 112 THR HA 114 GLU HN 4.37
&rst
ixpk= 0, nxpk= 0, iat=1761,1792, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87, &end
#
# 112 THR HA 115 PRO QD 4.76
&rst
ixpk= 0, nxpk= 0, iat=1761, -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr2=1808,1809,
&end
#
# 112 THR HB 113 LEU HG 4.19
&rst
ixpk= 0, nxpk= 0, iat=1763,1780, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69, &end
#
# 112 THR HB 113 LEU HN 4.22
&rst
ixpk= 0, nxpk= 0, iat=1763,1773, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 112 THR HN 112 THR HB 3.75
&rst
ixpk= 0, nxpk= 0, iat=1759,1763, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25, &end
#
# 112 THR HN 112 THR QG2 3.25
&rst
ixpk= 0, nxpk= 0, iat=1759, -1, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40,
igr2=1765,1766,1767,
&end
#
# 112 THR HN 113 LEU HG 4.73
&rst
ixpk= 0, nxpk= 0, iat=1759,1780, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, &end
#
# 112 THR HN 113 LEU HN 3.43
&rst
ixpk= 0, nxpk= 0, iat=1759,1773, r1= 1.30, r2= 1.80, r3= 3.43, r4= 3.93, &end
#
# 112 THR HN 132 VAL QG2 5.50
&rst
ixpk= 0, nxpk= 0, iat=1759, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2=2101,2102,2103,
&end
#
# 112 THR QG2 113 LEU HN 4.32
&rst
ixpk= 0, nxpk= 0, iat= -1,1773, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
igr1=1765,1766,1767,
&end
#
# 113 LEU HA 113 LEU HG 4.26
&rst
ixpk= 0, nxpk= 0, iat=1775,1780, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76, &end
#
# 113 LEU HA 113 LEU QD2 3.06
&rst
ixpk= 0, nxpk= 0, iat=1775, -1, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,
igr2=1786,1787,1788,
&end
#
# 113 LEU HA 116 LEU HN 4.47
&rst
ixpk= 0, nxpk= 0, iat=1775,1821, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97, &end
#
# 113 LEU HA 116 LEU QB 4.04
&rst
ixpk= 0, nxpk= 0, iat=1775, -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
igr2=1825,1826,
&end
#
# 113 LEU HA 116 LEU QD1 3.29
&rst
ixpk= 0, nxpk= 0, iat=1775, -1, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
igr2=1830,1831,1832,
&end
#
# 113 LEU HB2 113 LEU QD1 3.60
&rst
ixpk= 0, nxpk= 0, iat=1777, -1, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,
igr2=1782,1783,1784,
&end
#
# 113 LEU HB2 113 LEU QD2 3.52
&rst
ixpk= 0, nxpk= 0, iat=1777, -1, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,
igr2=1786,1787,1788,
&end
#
# 113 LEU HB2 114 GLU HN 4.87
&rst
ixpk= 0, nxpk= 0, iat=1777,1792, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37, &end
#
# 113 LEU HB3 113 LEU QD1 3.60
&rst
ixpk= 0, nxpk= 0, iat=1778, -1, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,
igr2=1782,1783,1784,
&end
#
# 113 LEU HB3 113 LEU QD2 3.52
&rst
ixpk= 0, nxpk= 0, iat=1778, -1, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,
igr2=1786,1787,1788,
&end
#
# 113 LEU HB3 114 GLU HN 4.87
&rst
ixpk= 0, nxpk= 0, iat=1778,1792, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37, &end
#
# 113 LEU HG 114 GLU HN 4.59
&rst
ixpk= 0, nxpk= 0, iat=1780,1792, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 113 LEU HN 113 LEU HB2 3.85
&rst
ixpk= 0, nxpk= 0, iat=1773,1777, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35, &end
#
# 113 LEU HN 113 LEU HB3 3.85
&rst
ixpk= 0, nxpk= 0, iat=1773,1778, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35, &end
#
# 113 LEU HN 113 LEU HG 3.41
&rst
ixpk= 0, nxpk= 0, iat=1773,1780, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91, &end
#
# 113 LEU HN 113 LEU QD1 3.65
&rst
ixpk= 0, nxpk= 0, iat=1773, -1, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
igr2=1782,1783,1784,
&end
#
# 113 LEU HN 113 LEU QD2 3.54
&rst
ixpk= 0, nxpk= 0, iat=1773, -1, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,
igr2=1786,1787,1788,
&end
#
# 113 LEU HN 114 GLU HA 4.75
&rst
ixpk= 0, nxpk= 0, iat=1773,1794, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, &end
#
# 113 LEU HN 114 GLU HB2 4.37
&rst
ixpk= 0, nxpk= 0, iat=1773,1796, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87, &end
#
# 113 LEU HN 114 GLU HG3 5.50
&rst
ixpk= 0, nxpk= 0, iat=1773,1800, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 113 LEU HN 114 GLU HN 3.38
&rst
ixpk= 0, nxpk= 0, iat=1773,1792, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88, &end
#
# 113 LEU HN 115 PRO QD 4.69
&rst
ixpk= 0, nxpk= 0, iat=1773, -1, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr2=1808,1809,
&end
#
# 113 LEU HN 145 LEU QD2 4.50
&rst
ixpk= 0, nxpk= 0, iat=1773, -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr2=2322,2323,2324,
&end
#
# 113 LEU QB 113 LEU QD1 3.12
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,
igr1=1777,1778,
igr2=1782,1783,1784,
&end
#
# 113 LEU QB 113 LEU QD2 3.01
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,
igr1=1777,1778,
igr2=1786,1787,1788,
&end
#
# 113 LEU QB 114 GLU HN 4.09
&rst
ixpk= 0, nxpk= 0, iat= -1,1792, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
igr1=1777,1778,
&end
#
# 113 LEU QB 116 LEU QD1 3.72
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
igr1=1777,1778,
igr2=1830,1831,1832,
&end
#
# 113 LEU QB 145 LEU QD2 3.28
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
igr1=1777,1778,
igr2=2322,2323,2324,
&end
#
# 113 LEU QD2 114 GLU HN 4.76
&rst
ixpk= 0, nxpk= 0, iat= -1,1792, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
igr1=1786,1787,1788,
&end
#
# 114 GLU HA 114 GLU HG3 3.30
&rst
ixpk= 0, nxpk= 0, iat=1794,1800, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80, &end
#
# 114 GLU HA 117 LYS QE 4.85
&rst
ixpk= 0, nxpk= 0, iat=1794, -1, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
igr2=1853,1854,
&end
#
# 114 GLU HA 117 LYS QG 3.98
&rst
ixpk= 0, nxpk= 0, iat=1794, -1, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
igr2=1847,1848,
&end
#
# 114 GLU HA 145 LEU HG 4.34
&rst
ixpk= 0, nxpk= 0, iat=1794,2316, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84, &end
#
# 114 GLU HA 145 LEU QD1 3.14
&rst
ixpk= 0, nxpk= 0, iat=1794, -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
igr2=2318,2319,2320,
&end
#
# 114 GLU HA 145 LEU QD2 3.24
&rst
ixpk= 0, nxpk= 0, iat=1794, -1, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,
igr2=2322,2323,2324,
&end
#
# 114 GLU HB2 115 PRO QD 4.05
&rst
ixpk= 0, nxpk= 0, iat=1796, -1, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,
igr2=1808,1809,
&end
#
# 114 GLU HB2 145 LEU QD1 4.36
&rst
ixpk= 0, nxpk= 0, iat=1796, -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr2=2318,2319,2320,
&end
#
# 114 GLU HB2 145 LEU QD2 3.76
&rst
ixpk= 0, nxpk= 0, iat=1796, -1, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
igr2=2322,2323,2324,
&end
#
# 114 GLU HB3 115 PRO HD2 3.80
&rst
ixpk= 0, nxpk= 0, iat=1797,1808, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30, &end
#
# 114 GLU HB3 115 PRO HD3 3.80
&rst
ixpk= 0, nxpk= 0, iat=1797,1809, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30, &end
#
# 114 GLU HB3 115 PRO QD 3.19
&rst
ixpk= 0, nxpk= 0, iat=1797, -1, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08,
igr2=1808,1809,
&end
#
# 114 GLU HB3 117 LYS QG 5.34
&rst
ixpk= 0, nxpk= 0, iat=1797, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2=1847,1848,
&end
#
# 114 GLU HB3 145 LEU QD1 5.16
&rst
ixpk= 0, nxpk= 0, iat=1797, -1, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
igr2=2318,2319,2320,
&end
#
# 114 GLU HG2 117 LYS QE 4.11
&rst
ixpk= 0, nxpk= 0, iat=1799, -1, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
igr2=1853,1854,
&end
#
# 114 GLU HG2 117 LYS QG 4.57
&rst
ixpk= 0, nxpk= 0, iat=1799, -1, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
igr2=1847,1848,
&end
#
# 114 GLU HG2 145 LEU QD1 3.61
&rst
ixpk= 0, nxpk= 0, iat=1799, -1, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,
igr2=2318,2319,2320,
&end
#
# 114 GLU HG2 145 LEU QD2 4.17
&rst
ixpk= 0, nxpk= 0, iat=1799, -1, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
igr2=2322,2323,2324,
&end
#
# 114 GLU HG3 117 LYS HD2 4.61
&rst
ixpk= 0, nxpk= 0, iat=1800,1850, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 114 GLU HG3 117 LYS HD3 4.61
&rst
ixpk= 0, nxpk= 0, iat=1800,1851, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 114 GLU HG3 117 LYS QD 3.81
&rst
ixpk= 0, nxpk= 0, iat=1800, -1, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,
igr2=1850,1851,
&end
#
# 114 GLU HG3 117 LYS QE 4.87
&rst
ixpk= 0, nxpk= 0, iat=1800, -1, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,
igr2=1853,1854,
&end
#
# 114 GLU HG3 117 LYS QG 5.34
&rst
ixpk= 0, nxpk= 0, iat=1800, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2=1847,1848,
&end
#
# 114 GLU HG3 145 LEU HG 5.50
&rst
ixpk= 0, nxpk= 0, iat=1800,2316, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 114 GLU HG3 145 LEU QD1 3.38
&rst
ixpk= 0, nxpk= 0, iat=1800, -1, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,
igr2=2318,2319,2320,
&end
#
# 114 GLU HG3 145 LEU QD2 4.33
&rst
ixpk= 0, nxpk= 0, iat=1800, -1, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
igr2=2322,2323,2324,
&end
#
# 114 GLU HN 114 GLU HB2 3.16
&rst
ixpk= 0, nxpk= 0, iat=1792,1796, r1= 1.30, r2= 1.80, r3= 3.16, r4= 3.66, &end
#
# 114 GLU HN 114 GLU HG2 4.83
&rst
ixpk= 0, nxpk= 0, iat=1792,1799, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33, &end
#
# 114 GLU HN 114 GLU HG3 4.10
&rst
ixpk= 0, nxpk= 0, iat=1792,1800, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60, &end
#
# 114 GLU HN 115 PRO HD2 3.70
&rst
ixpk= 0, nxpk= 0, iat=1792,1808, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20, &end
#
# 114 GLU HN 115 PRO HD3 3.70
&rst
ixpk= 0, nxpk= 0, iat=1792,1809, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20, &end
#
# 114 GLU HN 115 PRO HG2 5.15
&rst
ixpk= 0, nxpk= 0, iat=1792,1811, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65, &end
#
# 114 GLU HN 115 PRO HG3 5.41
&rst
ixpk= 0, nxpk= 0, iat=1792,1812, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91, &end
#
# 114 GLU HN 115 PRO QD 3.24
&rst
ixpk= 0, nxpk= 0, iat=1792, -1, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
igr2=1808,1809,
&end
#
# 114 GLU HN 145 LEU QD1 5.50
&rst
ixpk= 0, nxpk= 0, iat=1792, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2=2318,2319,2320,
&end
#
# 114 GLU HN 145 LEU QD2 3.46
&rst
ixpk= 0, nxpk= 0, iat=1792, -1, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
igr2=2322,2323,2324,
&end
#
# 115 PRO HA 116 LEU QD2 5.50
&rst
ixpk= 0, nxpk= 0, iat=1817, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2=1834,1835,1836,
&end
#
# 115 PRO HA 118 LYS HN 4.67
&rst
ixpk= 0, nxpk= 0, iat=1817,1862, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, &end
#
# 115 PRO HA 118 LYS QD 4.18
&rst
ixpk= 0, nxpk= 0, iat=1817, -1, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,
igr2=1872,1873,
&end
#
# 115 PRO HA 118 LYS QE 4.15
&rst
ixpk= 0, nxpk= 0, iat=1817, -1, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
igr2=1875,1876,
&end
#
# 115 PRO HB2 116 LEU HG 5.50
&rst
ixpk= 0, nxpk= 0, iat=1814,1828, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 115 PRO HB2 116 LEU QD2 4.57
&rst
ixpk= 0, nxpk= 0, iat=1814, -1, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
igr2=1834,1835,1836,
&end
#
# 115 PRO HB2 118 LYS QD 5.50
&rst
ixpk= 0, nxpk= 0, iat=1814, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2=1872,1873,
&end
#
# 115 PRO HB3 116 LEU HN 4.59
&rst
ixpk= 0, nxpk= 0, iat=1815,1821, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 115 PRO HD2 116 LEU HN 4.55
&rst
ixpk= 0, nxpk= 0, iat=1808,1821, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05, &end
#
# 115 PRO HD3 116 LEU HN 4.55
&rst
ixpk= 0, nxpk= 0, iat=1809,1821, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05, &end
#
# 115 PRO HG2 116 LEU HN 4.21
&rst
ixpk= 0, nxpk= 0, iat=1811,1821, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71, &end
#
# 115 PRO QD 116 LEU HG 5.35
&rst
ixpk= 0, nxpk= 0, iat= -1,1828, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51,
igr1=1808,1809,
&end
#
# 115 PRO QD 116 LEU HN 3.97
&rst
ixpk= 0, nxpk= 0, iat= -1,1821, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
igr1=1808,1809,
&end
#
# 115 PRO QD 145 LEU QD2 4.82
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
igr1=1808,1809,
igr2=2322,2323,2324,
&end
#
# 116 LEU HA 116 LEU HG 3.79
&rst
ixpk= 0, nxpk= 0, iat=1823,1828, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29, &end
#
# 116 LEU HA 116 LEU QD2 3.04
&rst
ixpk= 0, nxpk= 0, iat=1823, -1, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15,
igr2=1834,1835,1836,
&end
#
# 116 LEU HA 118 LYS HN 4.06
&rst
ixpk= 0, nxpk= 0, iat=1823,1862, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56, &end
#
# 116 LEU HA 119 LEU HB2 5.23
&rst
ixpk= 0, nxpk= 0, iat=1823,1888, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73, &end
#
# 116 LEU HA 119 LEU HN 4.18
&rst
ixpk= 0, nxpk= 0, iat=1823,1884, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68, &end
#
# 116 LEU HA 119 LEU QD1 3.55
&rst
ixpk= 0, nxpk= 0, iat=1823, -1, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,
igr2=1893,1894,1895,
&end
#
# 116 LEU HB2 116 LEU QD2 3.51
&rst
ixpk= 0, nxpk= 0, iat=1825, -1, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
igr2=1834,1835,1836,
&end
#
# 116 LEU HB2 146 LEU QD1 3.90
&rst
ixpk= 0, nxpk= 0, iat=1825, -1, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
igr2=2337,2338,2339,
&end
#
# 116 LEU HB3 116 LEU QD2 3.51
&rst
ixpk= 0, nxpk= 0, iat=1826, -1, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
igr2=1834,1835,1836,
&end
#
# 116 LEU HB3 146 LEU QD1 3.90
&rst
ixpk= 0, nxpk= 0, iat=1826, -1, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
igr2=2337,2338,2339,
&end
#
# 116 LEU HN 116 LEU HB2 3.76
&rst
ixpk= 0, nxpk= 0, iat=1821,1825, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26, &end
#
# 116 LEU HN 116 LEU HB3 3.76
&rst
ixpk= 0, nxpk= 0, iat=1821,1826, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26, &end
#
# 116 LEU HN 116 LEU HG 3.35
&rst
ixpk= 0, nxpk= 0, iat=1821,1828, r1= 1.30, r2= 1.80, r3= 3.35, r4= 3.85, &end
#
# 116 LEU HN 116 LEU QD2 4.06
&rst
ixpk= 0, nxpk= 0, iat=1821, -1, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
igr2=1834,1835,1836,
&end
#
# 116 LEU HN 118 LYS QD 4.91
&rst
ixpk= 0, nxpk= 0, iat=1821, -1, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
igr2=1872,1873,
&end
#
# 116 LEU HN 119 LEU QD1 5.50
&rst
ixpk= 0, nxpk= 0, iat=1821, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2=1893,1894,1895,
&end
#
# 116 LEU HN 146 LEU QD1 5.04
&rst
ixpk= 0, nxpk= 0, iat=1821, -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
igr2=2337,2338,2339,
&end
#
# 116 LEU HN 146 LEU QD2 4.60
&rst
ixpk= 0, nxpk= 0, iat=1821, -1, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
igr2=2341,2342,2343,
&end
#
# 116 LEU QB 116 LEU QD1 3.18
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,
igr1=1825,1826,
igr2=1830,1831,1832,
&end
#
# 116 LEU QB 116 LEU QD2 3.06
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
igr1=1825,1826,
igr2=1834,1835,1836,
&end
#
# 116 LEU QB 117 LYS HN 4.12
&rst
ixpk= 0, nxpk= 0, iat= -1,1840, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
igr1=1825,1826,
&end
#
# 116 LEU QB 146 LEU QD1 3.40
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
igr1=1825,1826,
igr2=2337,2338,2339,
&end
#
# 116 LEU QB 146 LEU QD2 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
igr1=1825,1826,
igr2=2341,2342,2343,
&end
#
# 116 LEU QD2 119 LEU HN 5.29
&rst
ixpk= 0, nxpk= 0, iat= -1,1884, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
igr1=1834,1835,1836,
&end
#
# 117 LYS HA 117 LYS HG2 4.00
&rst
ixpk= 0, nxpk= 0, iat=1842,1847, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 117 LYS HA 117 LYS HG3 4.00
&rst
ixpk= 0, nxpk= 0, iat=1842,1848, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 117 LYS HA 119 LEU HN 4.29
&rst
ixpk= 0, nxpk= 0, iat=1842,1884, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79, &end
#
# 117 LYS HA 146 LEU HB3 4.13
&rst
ixpk= 0, nxpk= 0, iat=1842,2333, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63, &end
#
# 117 LYS HA 146 LEU QD2 3.09
&rst
ixpk= 0, nxpk= 0, iat=1842, -1, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21,
igr2=2341,2342,2343,
&end
#
# 117 LYS HA 148 GLN QE2 3.30
&rst
ixpk= 0, nxpk= 0, iat=1842, -1, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,
igr2=2373,2374,
&end
#
# 117 LYS HD2 117 LYS QE 2.98
&rst
ixpk= 0, nxpk= 0, iat=1850, -1, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84,
igr2=1853,1854,
&end
#
# 117 LYS HD2 118 LYS HN 5.50
&rst
ixpk= 0, nxpk= 0, iat=1850,1862, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 117 LYS HD3 117 LYS QE 2.98
&rst
ixpk= 0, nxpk= 0, iat=1851, -1, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84,
igr2=1853,1854,
&end
#
# 117 LYS HD3 118 LYS HN 5.50
&rst
ixpk= 0, nxpk= 0, iat=1851,1862, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 117 LYS HN 117 LYS HD2 4.34
&rst
ixpk= 0, nxpk= 0, iat=1840,1850, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84, &end
#
# 117 LYS HN 117 LYS HD3 4.34
&rst
ixpk= 0, nxpk= 0, iat=1840,1851, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84, &end
#
# 117 LYS HN 117 LYS HG2 3.94
&rst
ixpk= 0, nxpk= 0, iat=1840,1847, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44, &end
#
# 117 LYS HN 117 LYS HG3 3.94
&rst
ixpk= 0, nxpk= 0, iat=1840,1848, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44, &end
#
# 117 LYS HN 117 LYS QB 3.04
&rst
ixpk= 0, nxpk= 0, iat=1840, -1, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91,
igr2=1844,1845,
&end
#
# 117 LYS HN 117 LYS QE 4.76
&rst
ixpk= 0, nxpk= 0, iat=1840, -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr2=1853,1854,
&end
#
# 117 LYS HN 117 LYS QG 3.35
&rst
ixpk= 0, nxpk= 0, iat=1840, -1, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,
igr2=1847,1848,
&end
#
# 117 LYS HN 118 LYS HN 3.54
&rst
ixpk= 0, nxpk= 0, iat=1840,1862, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04, &end
#
# 117 LYS HN 119 LEU HN 4.60
&rst
ixpk= 0, nxpk= 0, iat=1840,1884, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 117 LYS HN 146 LEU QD2 3.43
&rst
ixpk= 0, nxpk= 0, iat=1840, -1, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
igr2=2341,2342,2343,
&end
#
# 117 LYS QB 117 LYS QE 4.17
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
igr1=1844,1845,
igr2=1853,1854,
&end
#
# 117 LYS QB 118 LYS HN 4.15
&rst
ixpk= 0, nxpk= 0, iat= -1,1862, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
igr1=1844,1845,
&end
#
# 117 LYS QB 146 LEU QD2 3.33
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
igr1=1844,1845,
igr2=2341,2342,2343,
&end
#
# 117 LYS QB 148 GLN QE2 4.95
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
igr1=1844,1845,
igr2=2373,2374,
&end
#
# 117 LYS QD 118 LYS HN 4.66
&rst
ixpk= 0, nxpk= 0, iat= -1,1862, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73,
igr1=1850,1851,
&end
#
# 117 LYS QD 145 LEU QD1 3.75
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
igr1=1850,1851,
igr2=2318,2319,2320,
&end
#
# 117 LYS QD 145 LEU QD2 4.11
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
igr1=1850,1851,
igr2=2322,2323,2324,
&end
#
# 117 LYS QD 146 LEU QD2 4.51
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
igr1=1850,1851,
igr2=2341,2342,2343,
&end
#
# 117 LYS QE 145 LEU HA 4.83
&rst
ixpk= 0, nxpk= 0, iat= -1,2311, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr1=1853,1854,
&end
#
# 117 LYS QE 145 LEU HG 3.91
&rst
ixpk= 0, nxpk= 0, iat= -1,2316, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,
igr1=1853,1854,
&end
#
# 117 LYS QE 145 LEU QD1 3.26
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,
igr1=1853,1854,
igr2=2318,2319,2320,
&end
#
# 117 LYS QE 145 LEU QD2 4.36
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
igr1=1853,1854,
igr2=2322,2323,2324,
&end
#
# 117 LYS QE 146 LEU QD2 4.59
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.19, r4= 6.69,
igr1=1853,1854,
igr2=2341,2342,2343,
&end
#
# 117 LYS QG 117 LYS QE 2.72
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.43, r4= 3.93,
igr1=1847,1848,
igr2=1853,1854,
&end
#
# 117 LYS QG 118 LYS HN 4.46
&rst
ixpk= 0, nxpk= 0, iat= -1,1862, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
igr1=1847,1848,
&end
#
# 117 LYS QG 146 LEU QD2 3.72
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
igr1=1847,1848,
igr2=2341,2342,2343,
&end
#
# 118 LYS HA 118 LYS HG2 3.80
&rst
ixpk= 0, nxpk= 0, iat=1864,1869, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30, &end
#
# 118 LYS HA 118 LYS HG3 3.80
&rst
ixpk= 0, nxpk= 0, iat=1864,1870, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30, &end
#
# 118 LYS HA 118 LYS QD 3.79
&rst
ixpk= 0, nxpk= 0, iat=1864, -1, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,
igr2=1872,1873,
&end
#
# 118 LYS HA 118 LYS QE 3.98
&rst
ixpk= 0, nxpk= 0, iat=1864, -1, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
igr2=1875,1876,
&end
#
# 118 LYS HA 118 LYS QG 3.19
&rst
ixpk= 0, nxpk= 0, iat=1864, -1, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08,
igr2=1869,1870,
&end
#
# 118 LYS HA 119 LEU QD2 5.50
&rst
ixpk= 0, nxpk= 0, iat=1864, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2=1897,1898,1899,
&end
#
# 118 LYS HN 118 LYS HB2 3.63
&rst
ixpk= 0, nxpk= 0, iat=1862,1866, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13, &end
#
# 118 LYS HN 118 LYS HB3 3.63
&rst
ixpk= 0, nxpk= 0, iat=1862,1867, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13, &end
#
# 118 LYS HN 118 LYS HG2 4.39
&rst
ixpk= 0, nxpk= 0, iat=1862,1869, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89, &end
#
# 118 LYS HN 118 LYS HG3 4.39
&rst
ixpk= 0, nxpk= 0, iat=1862,1870, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89, &end
#
# 118 LYS HN 118 LYS QB 3.01
&rst
ixpk= 0, nxpk= 0, iat=1862, -1, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88,
igr2=1866,1867,
&end
#
# 118 LYS HN 118 LYS QD 3.83
&rst
ixpk= 0, nxpk= 0, iat=1862, -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
igr2=1872,1873,
&end
#
# 118 LYS HN 118 LYS QE 4.33
&rst
ixpk= 0, nxpk= 0, iat=1862, -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
igr2=1875,1876,
&end
#
# 118 LYS HN 118 LYS QG 3.59
&rst
ixpk= 0, nxpk= 0, iat=1862, -1, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,
igr2=1869,1870,
&end
#
# 118 LYS HN 119 LEU HG 4.71
&rst
ixpk= 0, nxpk= 0, iat=1862,1891, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21, &end
#
# 118 LYS HN 119 LEU HN 3.35
&rst
ixpk= 0, nxpk= 0, iat=1862,1884, r1= 1.30, r2= 1.80, r3= 3.35, r4= 3.85, &end
#
# 118 LYS HN 119 LEU QD1 5.26
&rst
ixpk= 0, nxpk= 0, iat=1862, -1, r1= 1.30, r2= 1.80, r3= 6.32, r4= 6.82,
igr2=1893,1894,1895,
&end
#
# 118 LYS HN 119 LEU QD2 5.50
&rst
ixpk= 0, nxpk= 0, iat=1862, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2=1897,1898,1899,
&end
#
# 118 LYS HN 146 LEU QD2 4.51
&rst
ixpk= 0, nxpk= 0, iat=1862, -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr2=2341,2342,2343,
&end
#
# 118 LYS HN 148 GLN QE2 5.34
&rst
ixpk= 0, nxpk= 0, iat=1862, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2=2373,2374,
&end
#
# 118 LYS QB 118 LYS QD 3.28
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
igr1=1866,1867,
igr2=1872,1873,
&end
#
# 118 LYS QB 118 LYS QE 4.66
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,
igr1=1866,1867,
igr2=1875,1876,
&end
#
# 118 LYS QD 118 LYS QE 2.79
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02,
igr1=1872,1873,
igr2=1875,1876,
&end
#
# 118 LYS QD 119 LEU HN 4.76
&rst
ixpk= 0, nxpk= 0, iat= -1,1884, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr1=1872,1873,
&end
#
# 118 LYS QG 118 LYS QE 3.43
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,
igr1=1869,1870,
igr2=1875,1876,
&end
#
# 119 LEU HA 119 LEU QD1 4.11
&rst
ixpk= 0, nxpk= 0, iat=1886, -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
igr2=1893,1894,1895,
&end
#
# 119 LEU HA 119 LEU QD2 3.08
&rst
ixpk= 0, nxpk= 0, iat=1886, -1, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,
igr2=1897,1898,1899,
&end
#
# 119 LEU HA 120 GLU HA 4.36
&rst
ixpk= 0, nxpk= 0, iat=1886,1905, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86, &end
#
# 119 LEU HA 120 GLU HN 3.09
&rst
ixpk= 0, nxpk= 0, iat=1886,1903, r1= 1.30, r2= 1.80, r3= 3.09, r4= 3.59, &end
#
# 119 LEU HA 120 GLU QG 4.18
&rst
ixpk= 0, nxpk= 0, iat=1886, -1, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,
igr2=1910,1911,
&end
#
# 119 LEU HA 121 CYS HN 4.41
&rst
ixpk= 0, nxpk= 0, iat=1886,1918, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, &end
#
# 119 LEU HB2 119 LEU QD1 3.31
&rst
ixpk= 0, nxpk= 0, iat=1888, -1, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,
igr2=1893,1894,1895,
&end
#
# 119 LEU HB2 120 GLU HA 5.48
&rst
ixpk= 0, nxpk= 0, iat=1888,1905, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98, &end
#
# 119 LEU HB2 121 CYS HN 4.06
&rst
ixpk= 0, nxpk= 0, iat=1888,1918, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56, &end
#
# 119 LEU HB2 122 LEU HN 4.07
&rst
ixpk= 0, nxpk= 0, iat=1888,1929, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57, &end
#
# 119 LEU HB2 148 GLN QE2 4.79
&rst
ixpk= 0, nxpk= 0, iat=1888, -1, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
igr2=2373,2374,
&end
#
# 119 LEU HB3 119 LEU QD1 3.06
&rst
ixpk= 0, nxpk= 0, iat=1889, -1, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,
igr2=1893,1894,1895,
&end
#
# 119 LEU HB3 119 LEU QD2 3.24
&rst
ixpk= 0, nxpk= 0, iat=1889, -1, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,
igr2=1897,1898,1899,
&end
#
# 119 LEU HB3 120 GLU HN 4.38
&rst
ixpk= 0, nxpk= 0, iat=1889,1903, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88, &end
#
# 119 LEU HB3 121 CYS HN 4.68
&rst
ixpk= 0, nxpk= 0, iat=1889,1918, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18, &end
#
# 119 LEU HB3 122 LEU HN 3.93
&rst
ixpk= 0, nxpk= 0, iat=1889,1929, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43, &end
#
# 119 LEU HG 120 GLU HN 5.24
&rst
ixpk= 0, nxpk= 0, iat=1891,1903, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74, &end
#
# 119 LEU HN 119 LEU HB2 3.30
&rst
ixpk= 0, nxpk= 0, iat=1884,1888, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80, &end
#
# 119 LEU HN 119 LEU HB3 4.12
&rst
ixpk= 0, nxpk= 0, iat=1884,1889, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62, &end
#
# 119 LEU HN 119 LEU HG 3.37
&rst
ixpk= 0, nxpk= 0, iat=1884,1891, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87, &end
#
# 119 LEU HN 119 LEU QD1 3.75
&rst
ixpk= 0, nxpk= 0, iat=1884, -1, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
igr2=1893,1894,1895,
&end
#
# 119 LEU HN 119 LEU QD2 3.54
&rst
ixpk= 0, nxpk= 0, iat=1884, -1, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,
igr2=1897,1898,1899,
&end
#
# 119 LEU HN 120 GLU HN 4.35
&rst
ixpk= 0, nxpk= 0, iat=1884,1903, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85, &end
#
# 119 LEU HN 146 LEU QD2 5.50
&rst
ixpk= 0, nxpk= 0, iat=1884, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2=2341,2342,2343,
&end
#
# 119 LEU HN 148 GLN HE21 5.01
&rst
ixpk= 0, nxpk= 0, iat=1884,2373, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51, &end
#
# 119 LEU HN 148 GLN HE22 5.01
&rst
ixpk= 0, nxpk= 0, iat=1884,2374, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51, &end
#
# 119 LEU HN 148 GLN QE2 4.35
&rst
ixpk= 0, nxpk= 0, iat=1884, -1, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
igr2=2373,2374,
&end
#
# 119 LEU QD1 120 GLU HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1903, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1=1893,1894,1895,
&end
#
# 119 LEU QD1 122 LEU HN 4.36
&rst
ixpk= 0, nxpk= 0, iat= -1,1929, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr1=1893,1894,1895,
&end
#
# 119 LEU QD2 120 GLU HN 4.45
&rst
ixpk= 0, nxpk= 0, iat= -1,1903, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr1=1897,1898,1899,
&end
#
# 119 LEU QD2 121 CYS HN 4.54
&rst
ixpk= 0, nxpk= 0, iat= -1,1918, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,
igr1=1897,1898,1899,
&end
#
# 120 GLU HA 120 GLU HG2 4.17
&rst
ixpk= 0, nxpk= 0, iat=1905,1910, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67, &end
#
# 120 GLU HA 120 GLU HG3 4.17
&rst
ixpk= 0, nxpk= 0, iat=1905,1911, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67, &end
#
# 120 GLU HA 120 GLU QG 3.44
&rst
ixpk= 0, nxpk= 0, iat=1905, -1, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,
igr2=1910,1911,
&end
#
# 120 GLU HA 121 CYS HA 4.96
&rst
ixpk= 0, nxpk= 0, iat=1905,1920, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46, &end
#
# 120 GLU HA 122 LEU HN 4.67
&rst
ixpk= 0, nxpk= 0, iat=1905,1929, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, &end
#
# 120 GLU HA 148 GLN HG2 4.69
&rst
ixpk= 0, nxpk= 0, iat=1905,2368, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, &end
#
# 120 GLU HA 148 GLN HG3 4.69
&rst
ixpk= 0, nxpk= 0, iat=1905,2369, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, &end
#
# 120 GLU HA 148 GLN QE2 4.67
&rst
ixpk= 0, nxpk= 0, iat=1905, -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr2=2373,2374,
&end
#
# 120 GLU HA 148 GLN QG 3.86
&rst
ixpk= 0, nxpk= 0, iat=1905, -1, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,
igr2=2368,2369,
&end
#
# 120 GLU HB2 121 CYS HN 4.61
&rst
ixpk= 0, nxpk= 0, iat=1907,1918, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 120 GLU HB3 121 CYS HN 4.61
&rst
ixpk= 0, nxpk= 0, iat=1908,1918, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 120 GLU HN 120 GLU HB2 3.72
&rst
ixpk= 0, nxpk= 0, iat=1903,1907, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22, &end
#
# 120 GLU HN 120 GLU HB3 3.72
&rst
ixpk= 0, nxpk= 0, iat=1903,1908, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22, &end
#
# 120 GLU HN 120 GLU HG2 3.65
&rst
ixpk= 0, nxpk= 0, iat=1903,1910, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15, &end
#
# 120 GLU HN 120 GLU HG3 3.65
&rst
ixpk= 0, nxpk= 0, iat=1903,1911, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15, &end
#
# 120 GLU HN 120 GLU QG 3.06
&rst
ixpk= 0, nxpk= 0, iat=1903, -1, r1= 1.30, r2= 1.80, r3= 3.43, r4= 3.93,
igr2=1910,1911,
&end
#
# 120 GLU HN 121 CYS HN 3.72
&rst
ixpk= 0, nxpk= 0, iat=1903,1918, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22, &end
#
# 120 GLU HN 122 LEU HN 4.59
&rst
ixpk= 0, nxpk= 0, iat=1903,1929, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 120 GLU QB 121 CYS HA 4.87
&rst
ixpk= 0, nxpk= 0, iat= -1,1920, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,
igr1=1907,1908,
&end
#
# 120 GLU QG 121 CYS HN 4.61
&rst
ixpk= 0, nxpk= 0, iat= -1,1918, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67,
igr1=1910,1911,
&end
#
# 121 CYS HA 122 LEU QB 5.34
&rst
ixpk= 0, nxpk= 0, iat=1920, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2=1933,1934,
&end
#
# 121 CYS HB2 122 LEU HN 4.78
&rst
ixpk= 0, nxpk= 0, iat=1922,1929, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, &end
#
# 121 CYS HB3 122 LEU HN 4.78
&rst
ixpk= 0, nxpk= 0, iat=1923,1929, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, &end
#
# 121 CYS HN 121 CYS HB2 3.85
&rst
ixpk= 0, nxpk= 0, iat=1918,1922, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35, &end
#
# 121 CYS HN 121 CYS HB3 3.85
&rst
ixpk= 0, nxpk= 0, iat=1918,1923, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35, &end
#
# 121 CYS HN 121 CYS QB 3.35
&rst
ixpk= 0, nxpk= 0, iat=1918, -1, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,
igr2=1922,1923,
&end
#
# 121 CYS HN 122 LEU HB2 5.10
&rst
ixpk= 0, nxpk= 0, iat=1918,1933, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, &end
#
# 121 CYS HN 122 LEU HB3 5.10
&rst
ixpk= 0, nxpk= 0, iat=1918,1934, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, &end
#
# 121 CYS HN 122 LEU HN 3.31
&rst
ixpk= 0, nxpk= 0, iat=1918,1929, r1= 1.30, r2= 1.80, r3= 3.31, r4= 3.81, &end
#
# 121 CYS HN 122 LEU QB 4.30
&rst
ixpk= 0, nxpk= 0, iat=1918, -1, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
igr2=1933,1934,
&end
#
# 121 CYS HN 148 GLN QB 5.34
&rst
ixpk= 0, nxpk= 0, iat=1918, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2=2365,2366,
&end
#
# 121 CYS QB 122 LEU HN 4.15
&rst
ixpk= 0, nxpk= 0, iat= -1,1929, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
igr1=1922,1923,
&end
#
# 121 CYS QB 122 LEU QD1 5.27
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.10, r4= 7.60,
igr1=1922,1923,
igr2=1938,1939,1940,
&end
#
# 122 LEU HA 122 LEU QD1 3.28
&rst
ixpk= 0, nxpk= 0, iat=1931, -1, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,
igr2=1938,1939,1940,
&end
#
# 122 LEU HA 122 LEU QD2 3.99
&rst
ixpk= 0, nxpk= 0, iat=1931, -1, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
igr2=1942,1943,1944,
&end
#
# 122 LEU HA 123 LYS QB 4.51
&rst
ixpk= 0, nxpk= 0, iat=1931, -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
igr2=1952,1953,
&end
#
# 122 LEU HA 124 SER HN 4.08
&rst
ixpk= 0, nxpk= 0, iat=1931,1970, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58, &end
#
# 122 LEU HB2 122 LEU QD2 3.36
&rst
ixpk= 0, nxpk= 0, iat=1933, -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
igr2=1942,1943,1944,
&end
#
# 122 LEU HB2 148 GLN HE21 5.50
&rst
ixpk= 0, nxpk= 0, iat=1933,2373, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 122 LEU HB2 148 GLN HE22 5.50
&rst
ixpk= 0, nxpk= 0, iat=1933,2374, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 122 LEU HB3 122 LEU QD2 3.36
&rst
ixpk= 0, nxpk= 0, iat=1934, -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
igr2=1942,1943,1944,
&end
#
# 122 LEU HB3 148 GLN HE21 5.50
&rst
ixpk= 0, nxpk= 0, iat=1934,2373, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 122 LEU HB3 148 GLN HE22 5.50
&rst
ixpk= 0, nxpk= 0, iat=1934,2374, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 122 LEU HN 122 LEU HB2 3.37
&rst
ixpk= 0, nxpk= 0, iat=1929,1933, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87, &end
#
# 122 LEU HN 122 LEU HB3 3.37
&rst
ixpk= 0, nxpk= 0, iat=1929,1934, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87, &end
#
# 122 LEU HN 122 LEU QD1 4.22
&rst
ixpk= 0, nxpk= 0, iat=1929, -1, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
igr2=1938,1939,1940,
&end
#
# 122 LEU HN 122 LEU QD2 4.24
&rst
ixpk= 0, nxpk= 0, iat=1929, -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
igr2=1942,1943,1944,
&end
#
# 122 LEU HN 148 GLN HG2 4.85
&rst
ixpk= 0, nxpk= 0, iat=1929,2368, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35, &end
#
# 122 LEU HN 148 GLN HG3 4.85
&rst
ixpk= 0, nxpk= 0, iat=1929,2369, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35, &end
#
# 122 LEU HN 148 GLN QE2 4.13
&rst
ixpk= 0, nxpk= 0, iat=1929, -1, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
igr2=2373,2374,
&end
#
# 122 LEU HN 148 GLN QG 4.03
&rst
ixpk= 0, nxpk= 0, iat=1929, -1, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
igr2=2368,2369,
&end
#
# 122 LEU QB 122 LEU QD1 3.17
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,
igr1=1933,1934,
igr2=1938,1939,1940,
&end
#
# 122 LEU QB 122 LEU QD2 2.80
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
igr1=1933,1934,
igr2=1942,1943,1944,
&end
#
# 122 LEU QB 148 GLN QE2 3.85
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
igr1=1933,1934,
igr2=2373,2374,
&end
#
# 122 LEU QD1 123 LYS HN 3.67
&rst
ixpk= 0, nxpk= 0, iat= -1,1948, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
igr1=1938,1939,1940,
&end
#
# 122 LEU QD1 124 SER HN 3.86
&rst
ixpk= 0, nxpk= 0, iat= -1,1970, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
igr1=1938,1939,1940,
&end
#
# 122 LEU QD1 125 LEU HA 4.55
&rst
ixpk= 0, nxpk= 0, iat= -1,1983, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
igr1=1938,1939,1940,
&end
#
# 122 LEU QD2 123 LYS HN 5.25
&rst
ixpk= 0, nxpk= 0, iat= -1,1948, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
igr1=1942,1943,1944,
&end
#
# 122 LEU QD2 124 SER HN 5.26
&rst
ixpk= 0, nxpk= 0, iat= -1,1970, r1= 1.30, r2= 1.80, r3= 6.32, r4= 6.82,
igr1=1942,1943,1944,
&end
#
# 122 LEU QD2 125 LEU HA 5.03
&rst
ixpk= 0, nxpk= 0, iat= -1,1983, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54,
igr1=1942,1943,1944,
&end
#
# 122 LEU QD2 148 GLN HE21 4.73
&rst
ixpk= 0, nxpk= 0, iat= -1,2373, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
igr1=1942,1943,1944,
&end
#
# 122 LEU QD2 148 GLN HE22 4.73
&rst
ixpk= 0, nxpk= 0, iat= -1,2374, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
igr1=1942,1943,1944,
&end
#
# 122 LEU QD2 148 GLN QE2 4.05
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
igr1=1942,1943,1944,
igr2=2373,2374,
&end
#
# 122 LEU QD2 148 GLN QG 4.80
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.47, r4= 6.97,
igr1=1942,1943,1944,
igr2=2368,2369,
&end
#
# 123 LYS HA 123 LYS QD 4.23
&rst
ixpk= 0, nxpk= 0, iat=1950, -1, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25,
igr2=1958,1959,
&end
#
# 123 LYS HA 123 LYS QG 3.80
&rst
ixpk= 0, nxpk= 0, iat=1950, -1, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,
igr2=1955,1956,
&end
#
# 123 LYS HA 149 LEU HA 3.79
&rst
ixpk= 0, nxpk= 0, iat=1950,2380, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29, &end
#
# 123 LYS HA 149 LEU QD1 4.43
&rst
ixpk= 0, nxpk= 0, iat=1950, -1, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
igr2=2387,2388,2389,
&end
#
# 123 LYS HA 150 THR HB 4.46
&rst
ixpk= 0, nxpk= 0, iat=1950,2401, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, &end
#
# 123 LYS HA 150 THR HN 3.75
&rst
ixpk= 0, nxpk= 0, iat=1950,2397, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25, &end
#
# 123 LYS HA 151 TYR HN 4.35
&rst
ixpk= 0, nxpk= 0, iat=1950,2411, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85, &end
#
# 123 LYS HN 123 LYS QB 3.53
&rst
ixpk= 0, nxpk= 0, iat=1948, -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
igr2=1952,1953,
&end
#
# 123 LYS HN 123 LYS QG 4.33
&rst
ixpk= 0, nxpk= 0, iat=1948, -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
igr2=1955,1956,
&end
#
# 123 LYS HN 124 SER HN 3.33
&rst
ixpk= 0, nxpk= 0, iat=1948,1970, r1= 1.30, r2= 1.80, r3= 3.33, r4= 3.83, &end
#
# 123 LYS QB 123 LYS QE 4.62
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32,
igr1=1952,1953,
igr2=1961,1962,
&end
#
# 123 LYS QB 124 SER HN 3.86
&rst
ixpk= 0, nxpk= 0, iat= -1,1970, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,
igr1=1952,1953,
&end
#
# 123 LYS QB 149 LEU HA 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1,2380, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1=1952,1953,
&end
#
# 123 LYS QB 150 THR HB 4.71
&rst
ixpk= 0, nxpk= 0, iat= -1,2401, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,
igr1=1952,1953,
&end
#
# 123 LYS QD 124 SER HA 4.59
&rst
ixpk= 0, nxpk= 0, iat= -1,1972, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
igr1=1958,1959,
&end
#
# 123 LYS QD 124 SER HN 4.40
&rst
ixpk= 0, nxpk= 0, iat= -1,1970, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
igr1=1958,1959,
&end
#
# 123 LYS QD 124 SER QB 3.99
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
igr1=1958,1959,
igr2=1974,1975,
&end
#
# 123 LYS QD 150 THR HB 4.89
&rst
ixpk= 0, nxpk= 0, iat= -1,2401, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
igr1=1958,1959,
&end
#
# 123 LYS QD 150 THR QG2 4.74
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.39, r4= 6.89,
igr1=1958,1959,
igr2=2403,2404,2405,
&end
#
# 123 LYS QD 151 TYR HN 4.57
&rst
ixpk= 0, nxpk= 0, iat= -1,2411, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
igr1=1958,1959,
&end
#
# 123 LYS QD 151 TYR QD 4.49
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr1=1958,1959,
igr2=2419,2428,
&end
#
# 123 LYS QD 151 TYR QE 4.48
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14,
igr1=1958,1959,
igr2=2421,2426,
&end
#
# 123 LYS QE 150 THR HB 4.69
&rst
ixpk= 0, nxpk= 0, iat= -1,2401, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr1=1961,1962,
&end
#
# 123 LYS QE 150 THR QG2 4.48
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54,
igr1=1961,1962,
igr2=2403,2404,2405,
&end
#
# 123 LYS QE 151 TYR QD 4.04
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
igr1=1961,1962,
igr2=2419,2428,
&end
#
# 123 LYS QE 151 TYR QE 4.11
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
igr1=1961,1962,
igr2=2421,2426,
&end
#
# 123 LYS QG 123 LYS QE 3.41
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
igr1=1955,1956,
igr2=1961,1962,
&end
#
# 123 LYS QG 124 SER HN 4.56
&rst
ixpk= 0, nxpk= 0, iat= -1,1970, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
igr1=1955,1956,
&end
#
# 123 LYS QG 124 SER QB 4.62
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32,
igr1=1955,1956,
igr2=1974,1975,
&end
#
# 123 LYS QG 150 THR HA 5.38
&rst
ixpk= 0, nxpk= 0, iat= -1,2399, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54,
igr1=1955,1956,
&end
#
# 123 LYS QG 150 THR HB 3.67
&rst
ixpk= 0, nxpk= 0, iat= -1,2401, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
igr1=1955,1956,
&end
#
# 123 LYS QG 150 THR HN 4.63
&rst
ixpk= 0, nxpk= 0, iat= -1,2397, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
igr1=1955,1956,
&end
#
# 123 LYS QG 150 THR QG2 4.01
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,
igr1=1955,1956,
igr2=2403,2404,2405,
&end
#
# 123 LYS QG 151 TYR QD 4.01
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
igr1=1955,1956,
igr2=2419,2428,
&end
#
# 123 LYS QG 151 TYR QE 5.12
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.45, r4= 6.95,
igr1=1955,1956,
igr2=2421,2426,
&end
#
# 124 SER HA 125 LEU HN 3.23
&rst
ixpk= 0, nxpk= 0, iat=1972,1981, r1= 1.30, r2= 1.80, r3= 3.23, r4= 3.73, &end
#
# 124 SER HA 149 LEU QD1 3.96
&rst
ixpk= 0, nxpk= 0, iat=1972, -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
igr2=2387,2388,2389,
&end
#
# 124 SER HA 149 LEU QD2 5.50
&rst
ixpk= 0, nxpk= 0, iat=1972, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2=2391,2392,2393,
&end
#
# 124 SER HA 151 TYR HB2 4.21
&rst
ixpk= 0, nxpk= 0, iat=1972,2415, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71, &end
#
# 124 SER HA 151 TYR HB3 4.51
&rst
ixpk= 0, nxpk= 0, iat=1972,2416, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01, &end
#
# 124 SER HA 151 TYR HN 3.85
&rst
ixpk= 0, nxpk= 0, iat=1972,2411, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35, &end
#
# 124 SER HA 151 TYR QD 4.52
&rst
ixpk= 0, nxpk= 0, iat=1972, -1, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
igr2=2419,2428,
&end
#
# 124 SER HB2 125 LEU HN 4.49
&rst
ixpk= 0, nxpk= 0, iat=1974,1981, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99, &end
#
# 124 SER HB2 151 TYR HB2 4.36
&rst
ixpk= 0, nxpk= 0, iat=1974,2415, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86, &end
#
# 124 SER HB3 125 LEU HN 4.49
&rst
ixpk= 0, nxpk= 0, iat=1975,1981, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99, &end
#
# 124 SER HB3 151 TYR HB2 4.36
&rst
ixpk= 0, nxpk= 0, iat=1975,2415, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86, &end
#
# 124 SER HN 124 SER HB2 4.03
&rst
ixpk= 0, nxpk= 0, iat=1970,1974, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53, &end
#
# 124 SER HN 124 SER HB3 4.03
&rst
ixpk= 0, nxpk= 0, iat=1970,1975, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53, &end
#
# 124 SER HN 124 SER QB 3.54
&rst
ixpk= 0, nxpk= 0, iat=1970, -1, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47,
igr2=1974,1975,
&end
#
# 124 SER HN 125 LEU HN 4.76
&rst
ixpk= 0, nxpk= 0, iat=1970,1981, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26, &end
#
# 124 SER HN 149 LEU QD1 4.31
&rst
ixpk= 0, nxpk= 0, iat=1970, -1, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
igr2=2387,2388,2389,
&end
#
# 124 SER QB 125 LEU HN 3.78
&rst
ixpk= 0, nxpk= 0, iat= -1,1981, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
igr1=1974,1975,
&end
#
# 124 SER QB 151 TYR HN 4.56
&rst
ixpk= 0, nxpk= 0, iat= -1,2411, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
igr1=1974,1975,
&end
#
# 124 SER QB 151 TYR QD 3.86
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
igr1=1974,1975,
igr2=2419,2428,
&end
#
# 125 LEU HA 125 LEU HG 3.99
&rst
ixpk= 0, nxpk= 0, iat=1983,1988, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49, &end
#
# 125 LEU HA 125 LEU QD1 3.26
&rst
ixpk= 0, nxpk= 0, iat=1983, -1, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
igr2=1990,1991,1992,
&end
#
# 125 LEU HA 125 LEU QD2 4.24
&rst
ixpk= 0, nxpk= 0, iat=1983, -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
igr2=1994,1995,1996,
&end
#
# 125 LEU HA 126 ASP HN 3.44
&rst
ixpk= 0, nxpk= 0, iat=1983,2000, r1= 1.30, r2= 1.80, r3= 3.44, r4= 3.94, &end
#
# 125 LEU HA 149 LEU QD1 4.36
&rst
ixpk= 0, nxpk= 0, iat=1983, -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr2=2387,2388,2389,
&end
#
# 125 LEU HB2 125 LEU QD1 3.83
&rst
ixpk= 0, nxpk= 0, iat=1985, -1, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
igr2=1990,1991,1992,
&end
#
# 125 LEU HB2 125 LEU QD2 3.73
&rst
ixpk= 0, nxpk= 0, iat=1985, -1, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
igr2=1994,1995,1996,
&end
#
# 125 LEU HB2 149 LEU QD1 3.67
&rst
ixpk= 0, nxpk= 0, iat=1985, -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
igr2=2387,2388,2389,
&end
#
# 125 LEU HB3 125 LEU QD1 3.83
&rst
ixpk= 0, nxpk= 0, iat=1986, -1, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
igr2=1990,1991,1992,
&end
#
# 125 LEU HB3 125 LEU QD2 3.73
&rst
ixpk= 0, nxpk= 0, iat=1986, -1, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
igr2=1994,1995,1996,
&end
#
# 125 LEU HB3 149 LEU QD1 3.67
&rst
ixpk= 0, nxpk= 0, iat=1986, -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
igr2=2387,2388,2389,
&end
#
# 125 LEU HG 126 ASP HA 4.90
&rst
ixpk= 0, nxpk= 0, iat=1988,2002, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40, &end
#
# 125 LEU HG 126 ASP HN 4.42
&rst
ixpk= 0, nxpk= 0, iat=1988,2000, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92, &end
#
# 125 LEU HN 125 LEU HB2 4.13
&rst
ixpk= 0, nxpk= 0, iat=1981,1985, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63, &end
#
# 125 LEU HN 125 LEU HB3 4.13
&rst
ixpk= 0, nxpk= 0, iat=1981,1986, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63, &end
#
# 125 LEU HN 125 LEU HG 4.78
&rst
ixpk= 0, nxpk= 0, iat=1981,1988, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, &end
#
# 125 LEU HN 125 LEU QB 3.59
&rst
ixpk= 0, nxpk= 0, iat=1981, -1, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,
igr2=1985,1986,
&end
#
# 125 LEU HN 125 LEU QD1 4.62
&rst
ixpk= 0, nxpk= 0, iat=1981, -1, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,
igr2=1990,1991,1992,
&end
#
# 125 LEU HN 126 ASP HN 5.06
&rst
ixpk= 0, nxpk= 0, iat=1981,2000, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56, &end
#
# 125 LEU HN 149 LEU QD1 3.89
&rst
ixpk= 0, nxpk= 0, iat=1981, -1, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
igr2=2387,2388,2389,
&end
#
# 125 LEU HN 149 LEU QD2 5.34
&rst
ixpk= 0, nxpk= 0, iat=1981, -1, r1= 1.30, r2= 1.80, r3= 6.41, r4= 6.91,
igr2=2391,2392,2393,
&end
#
# 125 LEU HN 151 TYR HB2 4.50
&rst
ixpk= 0, nxpk= 0, iat=1981,2415, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 125 LEU HN 151 TYR HN 4.64
&rst
ixpk= 0, nxpk= 0, iat=1981,2411, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14, &end
#
# 125 LEU HN 151 TYR QD 5.20
&rst
ixpk= 0, nxpk= 0, iat=1981, -1, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
igr2=2419,2428,
&end
#
# 125 LEU QB 125 LEU QD1 3.06
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
igr1=1985,1986,
igr2=1990,1991,1992,
&end
#
# 125 LEU QB 149 LEU QD1 3.07
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,
igr1=1985,1986,
igr2=2387,2388,2389,
&end
#
# 125 LEU QD1 126 ASP HN 3.40
&rst
ixpk= 0, nxpk= 0, iat= -1,2000, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,
igr1=1990,1991,1992,
&end
#
# 125 LEU QD2 126 ASP HN 4.53
&rst
ixpk= 0, nxpk= 0, iat= -1,2000, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
igr1=1994,1995,1996,
&end
#
# 126 ASP HA 127 LEU HG 5.46
&rst
ixpk= 0, nxpk= 0, iat=2002,2019, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96, &end
#
# 126 ASP HA 127 LEU HN 3.30
&rst
ixpk= 0, nxpk= 0, iat=2002,2012, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80, &end
#
# 126 ASP HA 128 PHE HN 4.04
&rst
ixpk= 0, nxpk= 0, iat=2002,2031, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, &end
#
# 126 ASP HA 128 PHE QD 5.14
&rst
ixpk= 0, nxpk= 0, iat=2002, -1, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,
igr2=2039,2047,
&end
#
# 126 ASP HA 128 PHE QE 5.50
&rst
ixpk= 0, nxpk= 0, iat=2002, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2=2041,2045,
&end
#
# 126 ASP HA 153 ASP HA 4.10
&rst
ixpk= 0, nxpk= 0, iat=2002,2453, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60, &end
#
# 126 ASP HB2 127 LEU HN 4.71
&rst
ixpk= 0, nxpk= 0, iat=2004,2012, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21, &end
#
# 126 ASP HB2 128 PHE HN 4.88
&rst
ixpk= 0, nxpk= 0, iat=2004,2031, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38, &end
#
# 126 ASP HB2 128 PHE QD 4.61
&rst
ixpk= 0, nxpk= 0, iat=2004, -1, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67,
igr2=2039,2047,
&end
#
# 126 ASP HB3 127 LEU HN 4.71
&rst
ixpk= 0, nxpk= 0, iat=2005,2012, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21, &end
#
# 126 ASP HB3 128 PHE HN 4.88
&rst
ixpk= 0, nxpk= 0, iat=2005,2031, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38, &end
#
# 126 ASP HB3 128 PHE QD 4.61
&rst
ixpk= 0, nxpk= 0, iat=2005, -1, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67,
igr2=2039,2047,
&end
#
# 126 ASP QB 127 LEU HN 4.04
&rst
ixpk= 0, nxpk= 0, iat= -1,2012, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
igr1=2004,2005,
&end
#
# 126 ASP QB 128 PHE HN 4.05
&rst
ixpk= 0, nxpk= 0, iat= -1,2031, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,
igr1=2004,2005,
&end
#
# 126 ASP QB 128 PHE QD 3.92
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
igr1=2004,2005,
igr2=2039,2047,
&end
#
# 127 LEU HA 127 LEU HG 3.97
&rst
ixpk= 0, nxpk= 0, iat=2014,2019, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47, &end
#
# 127 LEU HA 127 LEU QD1 3.93
&rst
ixpk= 0, nxpk= 0, iat=2014, -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
igr2=2021,2022,2023,
&end
#
# 127 LEU HA 127 LEU QD2 3.25
&rst
ixpk= 0, nxpk= 0, iat=2014, -1, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40,
igr2=2025,2026,2027,
&end
#
# 127 LEU HA 130 CYS HG 4.42
&rst
ixpk= 0, nxpk= 0, iat=2014,2072, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92, &end
#
# 127 LEU HB2 127 LEU QD1 3.52
&rst
ixpk= 0, nxpk= 0, iat=2016, -1, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,
igr2=2021,2022,2023,
&end
#
# 127 LEU HB2 132 VAL QG1 4.27
&rst
ixpk= 0, nxpk= 0, iat=2016, -1, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
igr2=2097,2098,2099,
&end
#
# 127 LEU HB2 133 THR QG2 4.14
&rst
ixpk= 0, nxpk= 0, iat=2016, -1, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
igr2=2113,2114,2115,
&end
#
# 127 LEU HB3 127 LEU QD1 3.52
&rst
ixpk= 0, nxpk= 0, iat=2017, -1, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,
igr2=2021,2022,2023,
&end
#
# 127 LEU HB3 132 VAL QG1 4.27
&rst
ixpk= 0, nxpk= 0, iat=2017, -1, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
igr2=2097,2098,2099,
&end
#
# 127 LEU HB3 133 THR QG2 4.14
&rst
ixpk= 0, nxpk= 0, iat=2017, -1, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
igr2=2113,2114,2115,
&end
#
# 127 LEU HN 127 LEU HG 4.46
&rst
ixpk= 0, nxpk= 0, iat=2012,2019, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, &end
#
# 127 LEU HN 127 LEU QD1 4.60
&rst
ixpk= 0, nxpk= 0, iat=2012, -1, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
igr2=2021,2022,2023,
&end
#
# 127 LEU HN 128 PHE HN 3.31
&rst
ixpk= 0, nxpk= 0, iat=2012,2031, r1= 1.30, r2= 1.80, r3= 3.31, r4= 3.81, &end
#
# 127 LEU HN 133 THR QG2 5.18
&rst
ixpk= 0, nxpk= 0, iat=2012, -1, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
igr2=2113,2114,2115,
&end
#
# 127 LEU HN 153 ASP HA 4.78
&rst
ixpk= 0, nxpk= 0, iat=2012,2453, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, &end
#
# 127 LEU QB 127 LEU QD1 3.08
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65,
igr1=2016,2017,
igr2=2021,2022,2023,
&end
#
# 127 LEU QB 132 VAL QG1 3.61
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,
igr1=2016,2017,
igr2=2097,2098,2099,
&end
#
# 127 LEU QB 133 THR QG2 3.48
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,
igr1=2016,2017,
igr2=2113,2114,2115,
&end
#
# 127 LEU QD2 130 CYS HB2 4.59
&rst
ixpk= 0, nxpk= 0, iat= -1,2069, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
igr1=2025,2026,2027,
&end
#
# 127 LEU QD2 130 CYS HG 4.42
&rst
ixpk= 0, nxpk= 0, iat= -1,2072, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
igr1=2025,2026,2027,
&end
#
# 128 PHE HA 128 PHE QD 3.81
&rst
ixpk= 0, nxpk= 0, iat=2033, -1, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,
igr2=2039,2047,
&end
#
# 128 PHE HA 129 ASN HN 3.21
&rst
ixpk= 0, nxpk= 0, iat=2033,2051, r1= 1.30, r2= 1.80, r3= 3.21, r4= 3.71, &end
#
# 128 PHE HA 130 CYS HN 4.45
&rst
ixpk= 0, nxpk= 0, iat=2033,2065, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95, &end
#
# 128 PHE HA 133 THR QG2 3.82
&rst
ixpk= 0, nxpk= 0, iat=2033, -1, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
igr2=2113,2114,2115,
&end
#
# 128 PHE HB2 129 ASN HN 4.33
&rst
ixpk= 0, nxpk= 0, iat=2035,2051, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83, &end
#
# 128 PHE HB3 129 ASN HN 4.33
&rst
ixpk= 0, nxpk= 0, iat=2036,2051, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83, &end
#
# 128 PHE HN 128 PHE HB2 3.85
&rst
ixpk= 0, nxpk= 0, iat=2031,2035, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35, &end
#
# 128 PHE HN 128 PHE HB3 3.85
&rst
ixpk= 0, nxpk= 0, iat=2031,2036, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35, &end
#
# 128 PHE HN 128 PHE QD 3.69
&rst
ixpk= 0, nxpk= 0, iat=2031, -1, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,
igr2=2039,2047,
&end
#
# 128 PHE HZ 153 ASP HA 4.38
&rst
ixpk= 0, nxpk= 0, iat=2043,2453, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88, &end
#
# 128 PHE HZ 153 ASP QB 4.18
&rst
ixpk= 0, nxpk= 0, iat=2043, -1, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,
igr2=2455,2456,
&end
#
# 128 PHE HZ 154 GLY HA3 4.93
&rst
ixpk= 0, nxpk= 0, iat=2043,2466, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43, &end
#
# 128 PHE QB 129 ASN HN 3.60
&rst
ixpk= 0, nxpk= 0, iat= -1,2051, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
igr1=2035,2036,
&end
#
# 128 PHE QD 129 ASN HN 4.46
&rst
ixpk= 0, nxpk= 0, iat= -1,2051, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
igr1=2039,2047,
&end
#
# 128 PHE QE 153 ASP HA 4.54
&rst
ixpk= 0, nxpk= 0, iat= -1,2453, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
igr1=2041,2045,
&end
#
# 128 PHE QE 153 ASP QB 3.94
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
igr1=2041,2045,
igr2=2455,2456,
&end
#
# 129 ASN HA 129 ASN HD21 4.59
&rst
ixpk= 0, nxpk= 0, iat=2053,2060, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 129 ASN HA 129 ASN HD22 4.59
&rst
ixpk= 0, nxpk= 0, iat=2053,2061, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 129 ASN HA 129 ASN HN 2.30
&rst
ixpk= 0, nxpk= 0, iat=2053,2051, r1= 1.30, r2= 1.80, r3= 2.30, r4= 2.80, &end
#
# 129 ASN HA 130 CYS HN 3.38
&rst
ixpk= 0, nxpk= 0, iat=2053,2065, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88, &end
#
# 129 ASN HN 129 ASN QB 4.11
&rst
ixpk= 0, nxpk= 0, iat=2051, -1, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
igr2=2055,2056,
&end
#
# 129 ASN HN 130 CYS HN 3.63
&rst
ixpk= 0, nxpk= 0, iat=2051,2065, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13, &end
#
# 129 ASN HN 133 THR QG2 3.95
&rst
ixpk= 0, nxpk= 0, iat=2051, -1, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr2=2113,2114,2115,
&end
#
# 129 ASN QB 129 ASN HD21 3.40
&rst
ixpk= 0, nxpk= 0, iat= -1,2060, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,
igr1=2055,2056,
&end
#
# 129 ASN QB 129 ASN HD22 3.40
&rst
ixpk= 0, nxpk= 0, iat= -1,2061, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,
igr1=2055,2056,
&end
#
# 130 CYS HB2 132 VAL HN 4.37
&rst
ixpk= 0, nxpk= 0, iat=2069,2091, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87, &end
#
# 130 CYS HB2 132 VAL QG1 3.51
&rst
ixpk= 0, nxpk= 0, iat=2069, -1, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
igr2=2097,2098,2099,
&end
#
# 130 CYS HB2 132 VAL QG2 4.88
&rst
ixpk= 0, nxpk= 0, iat=2069, -1, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
igr2=2101,2102,2103,
&end
#
# 130 CYS HB2 133 THR HN 4.83
&rst
ixpk= 0, nxpk= 0, iat=2069,2107, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33, &end
#
# 130 CYS HB2 133 THR QG2 3.58
&rst
ixpk= 0, nxpk= 0, iat=2069, -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
igr2=2113,2114,2115,
&end
#
# 130 CYS HB3 132 VAL HN 4.16
&rst
ixpk= 0, nxpk= 0, iat=2070,2091, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66, &end
#
# 130 CYS HB3 132 VAL QG1 3.51
&rst
ixpk= 0, nxpk= 0, iat=2070, -1, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
igr2=2097,2098,2099,
&end
#
# 130 CYS HB3 132 VAL QG2 4.82
&rst
ixpk= 0, nxpk= 0, iat=2070, -1, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,
igr2=2101,2102,2103,
&end
#
# 130 CYS HB3 133 THR QG2 3.98
&rst
ixpk= 0, nxpk= 0, iat=2070, -1, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
igr2=2113,2114,2115,
&end
#
# 130 CYS HG 132 VAL QG1 4.52
&rst
ixpk= 0, nxpk= 0, iat=2072, -1, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
igr2=2097,2098,2099,
&end
#
# 130 CYS HN 130 CYS HB2 3.26
&rst
ixpk= 0, nxpk= 0, iat=2065,2069, r1= 1.30, r2= 1.80, r3= 3.26, r4= 3.76, &end
#
# 130 CYS HN 130 CYS HB3 3.89
&rst
ixpk= 0, nxpk= 0, iat=2065,2070, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39, &end
#
# 130 CYS HN 130 CYS HG 3.61
&rst
ixpk= 0, nxpk= 0, iat=2065,2072, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11, &end
#
# 130 CYS HN 132 VAL QG1 4.49
&rst
ixpk= 0, nxpk= 0, iat=2065, -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr2=2097,2098,2099,
&end
#
# 130 CYS HN 133 THR HB 4.76
&rst
ixpk= 0, nxpk= 0, iat=2065,2111, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26, &end
#
# 130 CYS HN 133 THR HG1 4.25
&rst
ixpk= 0, nxpk= 0, iat=2065,2117, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75, &end
#
# 130 CYS HN 133 THR HN 4.53
&rst
ixpk= 0, nxpk= 0, iat=2065,2107, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03, &end
#
# 130 CYS HN 133 THR QG2 3.33
&rst
ixpk= 0, nxpk= 0, iat=2065, -1, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,
igr2=2113,2114,2115,
&end
#
# 131 GLU HA 131 GLU HG2 3.76
&rst
ixpk= 0, nxpk= 0, iat=2078,2083, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26, &end
#
# 131 GLU HA 131 GLU HG3 3.76
&rst
ixpk= 0, nxpk= 0, iat=2078,2084, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26, &end
#
# 131 GLU HA 131 GLU QG 3.29
&rst
ixpk= 0, nxpk= 0, iat=2078, -1, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19,
igr2=2083,2084,
&end
#
# 131 GLU HA 133 THR HN 4.41
&rst
ixpk= 0, nxpk= 0, iat=2078,2107, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, &end
#
# 131 GLU HA 134 ASN HD21 3.79
&rst
ixpk= 0, nxpk= 0, iat=2078,2130, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29, &end
#
# 131 GLU HA 134 ASN HD22 3.79
&rst
ixpk= 0, nxpk= 0, iat=2078,2131, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29, &end
#
# 131 GLU HA 134 ASN HN 4.11
&rst
ixpk= 0, nxpk= 0, iat=2078,2121, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 131 GLU HA 134 ASN QB 4.26
&rst
ixpk= 0, nxpk= 0, iat=2078, -1, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
igr2=2125,2126,
&end
#
# 131 GLU HB2 132 VAL HN 4.07
&rst
ixpk= 0, nxpk= 0, iat=2080,2091, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57, &end
#
# 131 GLU HB3 132 VAL HN 4.07
&rst
ixpk= 0, nxpk= 0, iat=2081,2091, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57, &end
#
# 131 GLU HG2 132 VAL HN 4.93
&rst
ixpk= 0, nxpk= 0, iat=2083,2091, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43, &end
#
# 131 GLU HG2 134 ASN HD21 5.42
&rst
ixpk= 0, nxpk= 0, iat=2083,2130, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92, &end
#
# 131 GLU HG2 134 ASN HD22 5.42
&rst
ixpk= 0, nxpk= 0, iat=2083,2131, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92, &end
#
# 131 GLU HG3 132 VAL HN 4.93
&rst
ixpk= 0, nxpk= 0, iat=2084,2091, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43, &end
#
# 131 GLU HG3 134 ASN HD21 5.42
&rst
ixpk= 0, nxpk= 0, iat=2084,2130, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92, &end
#
# 131 GLU HG3 134 ASN HD22 5.42
&rst
ixpk= 0, nxpk= 0, iat=2084,2131, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92, &end
#
# 131 GLU QB 132 VAL HN 3.54
&rst
ixpk= 0, nxpk= 0, iat= -1,2091, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47,
igr1=2080,2081,
&end
#
# 131 GLU QB 132 VAL QG1 4.25
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23,
igr1=2080,2081,
igr2=2097,2098,2099,
&end
#
# 131 GLU QB 134 ASN QD2 4.29
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,
igr1=2080,2081,
igr2=2130,2131,
&end
#
# 131 GLU QG 134 ASN QD2 3.83
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
igr1=2083,2084,
igr2=2130,2131,
&end
#
# 132 VAL HA 132 VAL QG1 3.55
&rst
ixpk= 0, nxpk= 0, iat=2093, -1, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,
igr2=2097,2098,2099,
&end
#
# 132 VAL HA 132 VAL QG2 3.15
&rst
ixpk= 0, nxpk= 0, iat=2093, -1, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,
igr2=2101,2102,2103,
&end
#
# 132 VAL HA 134 ASN HN 4.34
&rst
ixpk= 0, nxpk= 0, iat=2093,2121, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84, &end
#
# 132 VAL HA 135 LEU HG 3.54
&rst
ixpk= 0, nxpk= 0, iat=2093,2142, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04, &end
#
# 132 VAL HA 135 LEU HN 4.33
&rst
ixpk= 0, nxpk= 0, iat=2093,2135, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83, &end
#
# 132 VAL HA 135 LEU QD1 3.59
&rst
ixpk= 0, nxpk= 0, iat=2093, -1, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,
igr2=2144,2145,2146,
&end
#
# 132 VAL HB 133 THR HN 4.69
&rst
ixpk= 0, nxpk= 0, iat=2095,2107, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, &end
#
# 132 VAL HB 134 ASN HN 5.50
&rst
ixpk= 0, nxpk= 0, iat=2095,2121, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 132 VAL HB 135 LEU QD1 4.60
&rst
ixpk= 0, nxpk= 0, iat=2095, -1, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
igr2=2144,2145,2146,
&end
#
# 132 VAL HN 132 VAL HB 3.34
&rst
ixpk= 0, nxpk= 0, iat=2091,2095, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84, &end
#
# 132 VAL HN 132 VAL QG1 3.22
&rst
ixpk= 0, nxpk= 0, iat=2091, -1, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,
igr2=2097,2098,2099,
&end
#
# 132 VAL HN 132 VAL QG2 3.90
&rst
ixpk= 0, nxpk= 0, iat=2091, -1, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
igr2=2101,2102,2103,
&end
#
# 132 VAL HN 133 THR HN 3.99
&rst
ixpk= 0, nxpk= 0, iat=2091,2107, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49, &end
#
# 132 VAL HN 133 THR QG2 4.35
&rst
ixpk= 0, nxpk= 0, iat=2091, -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
igr2=2113,2114,2115,
&end
#
# 132 VAL HN 134 ASN HN 5.05
&rst
ixpk= 0, nxpk= 0, iat=2091,2121, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55, &end
#
# 132 VAL QG1 133 THR HA 4.18
&rst
ixpk= 0, nxpk= 0, iat= -1,2109, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
igr1=2097,2098,2099,
&end
#
# 132 VAL QG1 133 THR HB 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2111, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1=2097,2098,2099,
&end
#
# 132 VAL QG1 133 THR HN 3.58
&rst
ixpk= 0, nxpk= 0, iat= -1,2107, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
igr1=2097,2098,2099,
&end
#
# 132 VAL QG1 133 THR QG2 2.94
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
igr1=2097,2098,2099,
igr2=2113,2114,2115,
&end
#
# 132 VAL QG1 134 ASN HN 4.87
&rst
ixpk= 0, nxpk= 0, iat= -1,2121, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
igr1=2097,2098,2099,
&end
#
# 132 VAL QG1 135 LEU QD1 4.31
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
igr1=2097,2098,2099,
igr2=2144,2145,2146,
&end
#
# 132 VAL QG2 133 THR HA 4.51
&rst
ixpk= 0, nxpk= 0, iat= -1,2109, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr1=2101,2102,2103,
&end
#
# 132 VAL QG2 133 THR HN 4.30
&rst
ixpk= 0, nxpk= 0, iat= -1,2107, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
igr1=2101,2102,2103,
&end
#
# 132 VAL QG2 134 ASN HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2121, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1=2101,2102,2103,
&end
#
# 132 VAL QG2 135 LEU HB2 3.88
&rst
ixpk= 0, nxpk= 0, iat= -1,2139, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
igr1=2101,2102,2103,
&end
#
# 132 VAL QG2 135 LEU HG 3.77
&rst
ixpk= 0, nxpk= 0, iat= -1,2142, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
igr1=2101,2102,2103,
&end
#
# 132 VAL QG2 135 LEU HN 4.83
&rst
ixpk= 0, nxpk= 0, iat= -1,2135, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
igr1=2101,2102,2103,
&end
#
# 132 VAL QG2 135 LEU QD1 3.06
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
igr1=2101,2102,2103,
igr2=2144,2145,2146,
&end
#
# 132 VAL QG2 138 TYR HD1 4.25
&rst
ixpk= 0, nxpk= 0, iat= -1,2188, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
igr1=2101,2102,2103,
&end
#
# 132 VAL QG2 138 TYR HE1 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2190, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1=2101,2102,2103,
&end
#
# 133 THR HA 133 THR QG2 3.32
&rst
ixpk= 0, nxpk= 0, iat=2109, -1, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,
igr2=2113,2114,2115,
&end
#
# 133 THR HA 135 LEU HN 4.52
&rst
ixpk= 0, nxpk= 0, iat=2109,2135, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02, &end
#
# 133 THR HA 138 TYR HD1 4.65
&rst
ixpk= 0, nxpk= 0, iat=2109,2188, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15, &end
#
# 133 THR HA 138 TYR HE1 4.96
&rst
ixpk= 0, nxpk= 0, iat=2109,2190, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46, &end
#
# 133 THR HA 138 TYR HE2 5.50
&rst
ixpk= 0, nxpk= 0, iat=2109,2195, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 133 THR HA 138 TYR QB 4.44
&rst
ixpk= 0, nxpk= 0, iat=2109, -1, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
igr2=2184,2185,
&end
#
# 133 THR HA 139 ARG HN 5.50
&rst
ixpk= 0, nxpk= 0, iat=2109,2201, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 133 THR HB 134 ASN HN 4.99
&rst
ixpk= 0, nxpk= 0, iat=2111,2121, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49, &end
#
# 133 THR HB 138 TYR HD1 5.45
&rst
ixpk= 0, nxpk= 0, iat=2111,2188, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95, &end
#
# 133 THR HB 138 TYR HD2 5.50
&rst
ixpk= 0, nxpk= 0, iat=2111,2197, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 133 THR HN 133 THR HB 4.11
&rst
ixpk= 0, nxpk= 0, iat=2107,2111, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 133 THR HN 133 THR HG1 3.42
&rst
ixpk= 0, nxpk= 0, iat=2107,2117, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92, &end
#
# 133 THR HN 133 THR QG2 3.12
&rst
ixpk= 0, nxpk= 0, iat=2107, -1, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,
igr2=2113,2114,2115,
&end
#
# 133 THR HN 134 ASN HN 3.40
&rst
ixpk= 0, nxpk= 0, iat=2107,2121, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90, &end
#
# 133 THR HN 134 ASN QB 5.02
&rst
ixpk= 0, nxpk= 0, iat=2107, -1, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr2=2125,2126,
&end
#
# 133 THR QG2 133 THR HG1 3.30
&rst
ixpk= 0, nxpk= 0, iat= -1,2117, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
igr1=2113,2114,2115,
&end
#
# 133 THR QG2 134 ASN HN 4.17
&rst
ixpk= 0, nxpk= 0, iat= -1,2121, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
igr1=2113,2114,2115,
&end
#
# 133 THR QG2 138 TYR HD1 4.84
&rst
ixpk= 0, nxpk= 0, iat= -1,2188, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
igr1=2113,2114,2115,
&end
#
# 133 THR QG2 138 TYR HE1 4.17
&rst
ixpk= 0, nxpk= 0, iat= -1,2190, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
igr1=2113,2114,2115,
&end
#
# 134 ASN HA 134 ASN QD2 4.43
&rst
ixpk= 0, nxpk= 0, iat=2123, -1, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
igr2=2130,2131,
&end
#
# 134 ASN HB2 135 LEU HN 4.40
&rst
ixpk= 0, nxpk= 0, iat=2125,2135, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 134 ASN HB3 135 LEU HN 4.40
&rst
ixpk= 0, nxpk= 0, iat=2126,2135, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 134 ASN HN 134 ASN HB2 3.69
&rst
ixpk= 0, nxpk= 0, iat=2121,2125, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19, &end
#
# 134 ASN HN 134 ASN HB3 3.69
&rst
ixpk= 0, nxpk= 0, iat=2121,2126, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19, &end
#
# 134 ASN HN 134 ASN HD21 4.70
&rst
ixpk= 0, nxpk= 0, iat=2121,2130, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 134 ASN HN 134 ASN HD22 4.70
&rst
ixpk= 0, nxpk= 0, iat=2121,2131, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 134 ASN HN 134 ASN QB 3.08
&rst
ixpk= 0, nxpk= 0, iat=2121, -1, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96,
igr2=2125,2126,
&end
#
# 134 ASN HN 134 ASN QD2 3.88
&rst
ixpk= 0, nxpk= 0, iat=2121, -1, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,
igr2=2130,2131,
&end
#
# 134 ASN HN 135 LEU HA 5.19
&rst
ixpk= 0, nxpk= 0, iat=2121,2137, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69, &end
#
# 134 ASN HN 135 LEU HB2 4.75
&rst
ixpk= 0, nxpk= 0, iat=2121,2139, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, &end
#
# 134 ASN HN 135 LEU HG 4.65
&rst
ixpk= 0, nxpk= 0, iat=2121,2142, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15, &end
#
# 134 ASN HN 135 LEU HN 3.22
&rst
ixpk= 0, nxpk= 0, iat=2121,2135, r1= 1.30, r2= 1.80, r3= 3.22, r4= 3.72, &end
#
# 134 ASN QB 134 ASN QD2 2.97
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24,
igr1=2125,2126,
igr2=2130,2131,
&end
#
# 134 ASN QB 135 LEU HA 5.13
&rst
ixpk= 0, nxpk= 0, iat= -1,2137, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
igr1=2125,2126,
&end
#
# 134 ASN QB 135 LEU HN 3.76
&rst
ixpk= 0, nxpk= 0, iat= -1,2135, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
igr1=2125,2126,
&end
#
# 134 ASN QB 135 LEU QD2 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.20, r4= 7.70,
igr1=2125,2126,
igr2=2148,2149,2150,
&end
#
# 135 LEU HA 135 LEU HG 3.86
&rst
ixpk= 0, nxpk= 0, iat=2137,2142, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 135 LEU HA 135 LEU QD1 3.93
&rst
ixpk= 0, nxpk= 0, iat=2137, -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
igr2=2144,2145,2146,
&end
#
# 135 LEU HA 135 LEU QD2 2.96
&rst
ixpk= 0, nxpk= 0, iat=2137, -1, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05,
igr2=2148,2149,2150,
&end
#
# 135 LEU HA 136 ASN QB 5.50
&rst
ixpk= 0, nxpk= 0, iat=2137, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2=2158,2159,
&end
#
# 135 LEU HA 138 TYR QB 5.34
&rst
ixpk= 0, nxpk= 0, iat=2137, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2=2184,2185,
&end
#
# 135 LEU HB2 135 LEU QD1 3.26
&rst
ixpk= 0, nxpk= 0, iat=2139, -1, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
igr2=2144,2145,2146,
&end
#
# 135 LEU HB2 135 LEU QD2 3.26
&rst
ixpk= 0, nxpk= 0, iat=2139, -1, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
igr2=2148,2149,2150,
&end
#
# 135 LEU HB2 136 ASN HA 5.50
&rst
ixpk= 0, nxpk= 0, iat=2139,2156, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 135 LEU HB2 138 TYR HA 4.32
&rst
ixpk= 0, nxpk= 0, iat=2139,2182, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82, &end
#
# 135 LEU HB2 138 TYR HB2 4.44
&rst
ixpk= 0, nxpk= 0, iat=2139,2184, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94, &end
#
# 135 LEU HB2 138 TYR HB3 4.44
&rst
ixpk= 0, nxpk= 0, iat=2139,2185, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94, &end
#
# 135 LEU HB3 135 LEU QD1 3.28
&rst
ixpk= 0, nxpk= 0, iat=2140, -1, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,
igr2=2144,2145,2146,
&end
#
# 135 LEU HB3 135 LEU QD2 3.17
&rst
ixpk= 0, nxpk= 0, iat=2140, -1, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,
igr2=2148,2149,2150,
&end
#
# 135 LEU HB3 138 TYR HA 4.54
&rst
ixpk= 0, nxpk= 0, iat=2140,2182, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 135 LEU HB3 138 TYR HB2 4.66
&rst
ixpk= 0, nxpk= 0, iat=2140,2184, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16, &end
#
# 135 LEU HB3 138 TYR HB3 4.66
&rst
ixpk= 0, nxpk= 0, iat=2140,2185, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16, &end
#
# 135 LEU HG 138 TYR QB 5.07
&rst
ixpk= 0, nxpk= 0, iat=2142, -1, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
igr2=2184,2185,
&end
#
# 135 LEU HN 135 LEU HB2 3.36
&rst
ixpk= 0, nxpk= 0, iat=2135,2139, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86, &end
#
# 135 LEU HN 135 LEU HB3 3.79
&rst
ixpk= 0, nxpk= 0, iat=2135,2140, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29, &end
#
# 135 LEU HN 135 LEU HG 3.29
&rst
ixpk= 0, nxpk= 0, iat=2135,2142, r1= 1.30, r2= 1.80, r3= 3.29, r4= 3.79, &end
#
# 135 LEU HN 135 LEU QD1 3.85
&rst
ixpk= 0, nxpk= 0, iat=2135, -1, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
igr2=2144,2145,2146,
&end
#
# 135 LEU HN 135 LEU QD2 4.00
&rst
ixpk= 0, nxpk= 0, iat=2135, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2=2148,2149,2150,
&end
#
# 135 LEU HN 138 TYR HB2 4.36
&rst
ixpk= 0, nxpk= 0, iat=2135,2184, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86, &end
#
# 135 LEU HN 138 TYR HB3 4.36
&rst
ixpk= 0, nxpk= 0, iat=2135,2185, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86, &end
#
# 135 LEU HN 138 TYR QB 3.77
&rst
ixpk= 0, nxpk= 0, iat=2135, -1, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,
igr2=2184,2185,
&end
#
# 135 LEU QD1 138 TYR HA 4.34
&rst
ixpk= 0, nxpk= 0, iat= -1,2182, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,
igr1=2144,2145,2146,
&end
#
# 135 LEU QD1 141 SER HB2 5.40
&rst
ixpk= 0, nxpk= 0, iat= -1,2244, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
igr1=2144,2145,2146,
&end
#
# 135 LEU QD1 141 SER HB3 5.40
&rst
ixpk= 0, nxpk= 0, iat= -1,2245, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
igr1=2144,2145,2146,
&end
#
# 135 LEU QD1 141 SER QB 4.54
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,
igr1=2144,2145,2146,
igr2=2244,2245,
&end
#
# 135 LEU QD2 136 ASN HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2156, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1=2148,2149,2150,
&end
#
# 135 LEU QD2 136 ASN HN 4.47
&rst
ixpk= 0, nxpk= 0, iat= -1,2154, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr1=2148,2149,2150,
&end
#
# 135 LEU QD2 136 ASN QB 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.20, r4= 7.70,
igr1=2148,2149,2150,
igr2=2158,2159,
&end
#
# 135 LEU QD2 138 TYR HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2182, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1=2148,2149,2150,
&end
#
# 136 ASN HA 137 ASP HN 2.20
&rst
ixpk= 0, nxpk= 0, iat=2156,2168, r1= 1.30, r2= 1.80, r3= 2.20, r4= 2.70, &end
#
# 136 ASN HA 138 TYR HN 4.28
&rst
ixpk= 0, nxpk= 0, iat=2156,2180, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78, &end
#
# 136 ASN QB 136 ASN HD21 4.02
&rst
ixpk= 0, nxpk= 0, iat= -1,2163, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,
igr1=2158,2159,
&end
#
# 136 ASN QB 136 ASN HD22 4.02
&rst
ixpk= 0, nxpk= 0, iat= -1,2164, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,
igr1=2158,2159,
&end
#
# 136 ASN QB 137 ASP HN 4.02
&rst
ixpk= 0, nxpk= 0, iat= -1,2168, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,
igr1=2158,2159,
&end
#
# 137 ASP HN 138 TYR HN 3.64
&rst
ixpk= 0, nxpk= 0, iat=2168,2180, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14, &end
#
# 137 ASP QB 140 GLU HN 4.02
&rst
ixpk= 0, nxpk= 0, iat= -1,2225, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,
igr1=2172,2173,
&end
#
# 137 ASP QB 140 GLU QB 3.57
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
igr1=2172,2173,
igr2=2229,2230,
&end
#
# 137 ASP QB 140 GLU QG 4.32
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
igr1=2172,2173,
igr2=2232,2233,
&end
#
# 137 ASP QB 141 SER HN 4.33
&rst
ixpk= 0, nxpk= 0, iat= -1,2240, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
igr1=2172,2173,
&end
#
# 138 TYR HA 138 TYR HD1 4.39
&rst
ixpk= 0, nxpk= 0, iat=2182,2188, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89, &end
#
# 138 TYR HA 138 TYR HD2 4.83
&rst
ixpk= 0, nxpk= 0, iat=2182,2197, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33, &end
#
# 138 TYR HA 141 SER HN 3.40
&rst
ixpk= 0, nxpk= 0, iat=2182,2240, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90, &end
#
# 138 TYR HB2 139 ARG HN 4.54
&rst
ixpk= 0, nxpk= 0, iat=2184,2201, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 138 TYR HB3 139 ARG HN 4.54
&rst
ixpk= 0, nxpk= 0, iat=2185,2201, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 138 TYR HD1 142 VAL QG2 4.06
&rst
ixpk= 0, nxpk= 0, iat=2188, -1, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
igr2=2261,2262,2263,
&end
#
# 138 TYR HD2 139 ARG HN 4.16
&rst
ixpk= 0, nxpk= 0, iat=2197,2201, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66, &end
#
# 138 TYR HE1 142 VAL QG2 3.97
&rst
ixpk= 0, nxpk= 0, iat=2190, -1, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
igr2=2261,2262,2263,
&end
#
# 138 TYR HN 138 TYR HB2 3.71
&rst
ixpk= 0, nxpk= 0, iat=2180,2184, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21, &end
#
# 138 TYR HN 138 TYR HB3 3.71
&rst
ixpk= 0, nxpk= 0, iat=2180,2185, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21, &end
#
# 138 TYR HN 138 TYR HD2 4.22
&rst
ixpk= 0, nxpk= 0, iat=2180,2197, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 138 TYR HN 138 TYR QB 2.99
&rst
ixpk= 0, nxpk= 0, iat=2180, -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
igr2=2184,2185,
&end
#
# 138 TYR HN 139 ARG HN 3.86
&rst
ixpk= 0, nxpk= 0, iat=2180,2201, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 138 TYR QB 139 ARG HN 3.95
&rst
ixpk= 0, nxpk= 0, iat= -1,2201, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
igr1=2184,2185,
&end
#
# 139 ARG HA 139 ARG HG2 4.19
&rst
ixpk= 0, nxpk= 0, iat=2203,2208, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69, &end
#
# 139 ARG HA 139 ARG HG3 4.19
&rst
ixpk= 0, nxpk= 0, iat=2203,2209, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69, &end
#
# 139 ARG HA 139 ARG QG 3.62
&rst
ixpk= 0, nxpk= 0, iat=2203, -1, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,
igr2=2208,2209,
&end
#
# 139 ARG HA 142 VAL HB 4.08
&rst
ixpk= 0, nxpk= 0, iat=2203,2255, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58, &end
#
# 139 ARG HA 142 VAL HN 4.17
&rst
ixpk= 0, nxpk= 0, iat=2203,2251, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67, &end
#
# 139 ARG HA 142 VAL QG1 5.06
&rst
ixpk= 0, nxpk= 0, iat=2203, -1, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
igr2=2257,2258,2259,
&end
#
# 139 ARG HA 142 VAL QG2 4.09
&rst
ixpk= 0, nxpk= 0, iat=2203, -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
igr2=2261,2262,2263,
&end
#
# 139 ARG HA 143 PHE HN 4.86
&rst
ixpk= 0, nxpk= 0, iat=2203,2267, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36, &end
#
# 139 ARG HA 152 LEU QD1 4.81
&rst
ixpk= 0, nxpk= 0, iat=2203, -1, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr2=2441,2442,2443,
&end
#
# 139 ARG HA 152 LEU QD2 3.40
&rst
ixpk= 0, nxpk= 0, iat=2203, -1, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,
igr2=2445,2446,2447,
&end
#
# 139 ARG HB2 140 GLU HN 4.13
&rst
ixpk= 0, nxpk= 0, iat=2205,2225, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63, &end
#
# 139 ARG HB3 140 GLU HN 4.13
&rst
ixpk= 0, nxpk= 0, iat=2206,2225, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63, &end
#
# 139 ARG HD2 139 ARG QH1 4.75
&rst
ixpk= 0, nxpk= 0, iat=2211, -1, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
igr2=2217,2218,
&end
#
# 139 ARG HD2 152 LEU QD2 4.94
&rst
ixpk= 0, nxpk= 0, iat=2211, -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr2=2445,2446,2447,
&end
#
# 139 ARG HD3 139 ARG QH1 4.75
&rst
ixpk= 0, nxpk= 0, iat=2212, -1, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
igr2=2217,2218,
&end
#
# 139 ARG HD3 152 LEU QD2 4.94
&rst
ixpk= 0, nxpk= 0, iat=2212, -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr2=2445,2446,2447,
&end
#
# 139 ARG HG2 152 LEU QD2 4.26
&rst
ixpk= 0, nxpk= 0, iat=2208, -1, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
igr2=2445,2446,2447,
&end
#
# 139 ARG HG3 152 LEU QD2 4.26
&rst
ixpk= 0, nxpk= 0, iat=2209, -1, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
igr2=2445,2446,2447,
&end
#
# 139 ARG HN 139 ARG HB2 3.89
&rst
ixpk= 0, nxpk= 0, iat=2201,2205, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39, &end
#
# 139 ARG HN 139 ARG HB3 3.89
&rst
ixpk= 0, nxpk= 0, iat=2201,2206, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39, &end
#
# 139 ARG HN 139 ARG HG2 4.46
&rst
ixpk= 0, nxpk= 0, iat=2201,2208, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, &end
#
# 139 ARG HN 139 ARG HG3 4.46
&rst
ixpk= 0, nxpk= 0, iat=2201,2209, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, &end
#
# 139 ARG HN 139 ARG QB 3.25
&rst
ixpk= 0, nxpk= 0, iat=2201, -1, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15,
igr2=2205,2206,
&end
#
# 139 ARG HN 139 ARG QD 4.70
&rst
ixpk= 0, nxpk= 0, iat=2201, -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
igr2=2211,2212,
&end
#
# 139 ARG HN 139 ARG QG 3.88
&rst
ixpk= 0, nxpk= 0, iat=2201, -1, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,
igr2=2208,2209,
&end
#
# 139 ARG HN 152 LEU QD2 4.51
&rst
ixpk= 0, nxpk= 0, iat=2201, -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr2=2445,2446,2447,
&end
#
# 139 ARG QB 140 GLU HN 3.43
&rst
ixpk= 0, nxpk= 0, iat= -1,2225, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35,
igr1=2205,2206,
&end
#
# 139 ARG QB 152 LEU QD2 3.89
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr1=2205,2206,
igr2=2445,2446,2447,
&end
#
# 139 ARG QD 152 LEU QD2 4.29
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr1=2211,2212,
igr2=2445,2446,2447,
&end
#
# 139 ARG QG 143 PHE QE 5.08
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.40, r4= 6.90,
igr1=2208,2209,
igr2=2277,2281,
&end
#
# 139 ARG QG 152 LEU QD2 3.57
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31,
igr1=2208,2209,
igr2=2445,2446,2447,
&end
#
# 139 ARG QH1 152 LEU QD2 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr1=2217,2218,
igr2=2445,2446,2447,
&end
#
# 139 ARG QH2 152 LEU QD2 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr1=2220,2221,
igr2=2445,2446,2447,
&end
#
# 140 GLU HA 140 GLU QG 3.34
&rst
ixpk= 0, nxpk= 0, iat=2227, -1, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,
igr2=2232,2233,
&end
#
# 140 GLU HA 142 VAL HN 4.42
&rst
ixpk= 0, nxpk= 0, iat=2227,2251, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92, &end
#
# 140 GLU HA 143 PHE HB2 4.26
&rst
ixpk= 0, nxpk= 0, iat=2227,2271, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76, &end
#
# 140 GLU HA 143 PHE HB3 4.26
&rst
ixpk= 0, nxpk= 0, iat=2227,2272, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76, &end
#
# 140 GLU HA 143 PHE HN 3.79
&rst
ixpk= 0, nxpk= 0, iat=2227,2267, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29, &end
#
# 140 GLU HA 143 PHE QB 3.51
&rst
ixpk= 0, nxpk= 0, iat=2227, -1, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,
igr2=2271,2272,
&end
#
# 140 GLU HA 143 PHE QD 3.76
&rst
ixpk= 0, nxpk= 0, iat=2227, -1, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
igr2=2275,2283,
&end
#
# 140 GLU HB2 141 SER HN 4.11
&rst
ixpk= 0, nxpk= 0, iat=2229,2240, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 140 GLU HB3 141 SER HN 4.11
&rst
ixpk= 0, nxpk= 0, iat=2230,2240, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 140 GLU HN 140 GLU HB2 3.75
&rst
ixpk= 0, nxpk= 0, iat=2225,2229, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25, &end
#
# 140 GLU HN 140 GLU HB3 3.75
&rst
ixpk= 0, nxpk= 0, iat=2225,2230, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25, &end
#
# 140 GLU HN 140 GLU QB 3.02
&rst
ixpk= 0, nxpk= 0, iat=2225, -1, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89,
igr2=2229,2230,
&end
#
# 140 GLU HN 140 GLU QG 3.86
&rst
ixpk= 0, nxpk= 0, iat=2225, -1, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,
igr2=2232,2233,
&end
#
# 140 GLU HN 142 VAL HN 4.43
&rst
ixpk= 0, nxpk= 0, iat=2225,2251, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93, &end
#
# 140 GLU QB 141 SER HN 3.45
&rst
ixpk= 0, nxpk= 0, iat= -1,2240, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,
igr1=2229,2230,
&end
#
# 140 GLU QG 141 SER HN 4.41
&rst
ixpk= 0, nxpk= 0, iat= -1,2240, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr1=2232,2233,
&end
#
# 141 SER HA 144 LYS HN 4.42
&rst
ixpk= 0, nxpk= 0, iat=2242,2287, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92, &end
#
# 141 SER HA 144 LYS QB 4.01
&rst
ixpk= 0, nxpk= 0, iat=2242, -1, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
igr2=2291,2292,
&end
#
# 141 SER HA 144 LYS QD 4.05
&rst
ixpk= 0, nxpk= 0, iat=2242, -1, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,
igr2=2297,2298,
&end
#
# 141 SER HA 144 LYS QE 3.81
&rst
ixpk= 0, nxpk= 0, iat=2242, -1, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,
igr2=2300,2301,
&end
#
# 141 SER HB2 142 VAL HN 4.22
&rst
ixpk= 0, nxpk= 0, iat=2244,2251, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 141 SER HB3 142 VAL HN 4.22
&rst
ixpk= 0, nxpk= 0, iat=2245,2251, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 141 SER HN 141 SER HB2 3.83
&rst
ixpk= 0, nxpk= 0, iat=2240,2244, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33, &end
#
# 141 SER HN 141 SER HB3 3.83
&rst
ixpk= 0, nxpk= 0, iat=2240,2245, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33, &end
#
# 141 SER HN 141 SER QB 3.28
&rst
ixpk= 0, nxpk= 0, iat=2240, -1, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18,
igr2=2244,2245,
&end
#
# 141 SER HN 142 VAL HA 5.50
&rst
ixpk= 0, nxpk= 0, iat=2240,2253, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 141 SER HN 142 VAL HB 5.50
&rst
ixpk= 0, nxpk= 0, iat=2240,2255, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 141 SER HN 142 VAL HN 3.36
&rst
ixpk= 0, nxpk= 0, iat=2240,2251, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86, &end
#
# 141 SER HN 142 VAL QG2 4.25
&rst
ixpk= 0, nxpk= 0, iat=2240, -1, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
igr2=2261,2262,2263,
&end
#
# 141 SER HN 144 LYS QD 4.81
&rst
ixpk= 0, nxpk= 0, iat=2240, -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr2=2297,2298,
&end
#
# 141 SER HN 144 LYS QE 4.78
&rst
ixpk= 0, nxpk= 0, iat=2240, -1, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr2=2300,2301,
&end
#
# 141 SER QB 142 VAL HA 4.56
&rst
ixpk= 0, nxpk= 0, iat= -1,2253, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
igr1=2244,2245,
&end
#
# 141 SER QB 142 VAL HN 3.71
&rst
ixpk= 0, nxpk= 0, iat= -1,2251, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
igr1=2244,2245,
&end
#
# 141 SER QB 144 LYS QE 4.43
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr1=2244,2245,
igr2=2300,2301,
&end
#
# 142 VAL HA 142 VAL QG1 3.31
&rst
ixpk= 0, nxpk= 0, iat=2253, -1, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,
igr2=2257,2258,2259,
&end
#
# 142 VAL HA 142 VAL QG2 3.07
&rst
ixpk= 0, nxpk= 0, iat=2253, -1, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19,
igr2=2261,2262,2263,
&end
#
# 142 VAL HA 144 LYS HN 4.73
&rst
ixpk= 0, nxpk= 0, iat=2253,2287, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, &end
#
# 142 VAL HA 145 LEU HB2 3.69
&rst
ixpk= 0, nxpk= 0, iat=2253,2313, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19, &end
#
# 142 VAL HA 145 LEU HB3 3.69
&rst
ixpk= 0, nxpk= 0, iat=2253,2314, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19, &end
#
# 142 VAL HA 145 LEU HN 3.95
&rst
ixpk= 0, nxpk= 0, iat=2253,2309, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45, &end
#
# 142 VAL HA 145 LEU QD2 3.85
&rst
ixpk= 0, nxpk= 0, iat=2253, -1, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
igr2=2322,2323,2324,
&end
#
# 142 VAL HA 146 LEU HG 4.78
&rst
ixpk= 0, nxpk= 0, iat=2253,2335, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, &end
#
# 142 VAL HA 146 LEU HN 4.46
&rst
ixpk= 0, nxpk= 0, iat=2253,2328, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, &end
#
# 142 VAL HA 146 LEU QD1 4.79
&rst
ixpk= 0, nxpk= 0, iat=2253, -1, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
igr2=2337,2338,2339,
&end
#
# 142 VAL HA 152 LEU QD2 4.94
&rst
ixpk= 0, nxpk= 0, iat=2253, -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr2=2445,2446,2447,
&end
#
# 142 VAL HB 143 PHE HN 3.58
&rst
ixpk= 0, nxpk= 0, iat=2255,2267, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08, &end
#
# 142 VAL HB 152 LEU QD2 3.46
&rst
ixpk= 0, nxpk= 0, iat=2255, -1, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
igr2=2445,2446,2447,
&end
#
# 142 VAL HN 142 VAL HB 3.35
&rst
ixpk= 0, nxpk= 0, iat=2251,2255, r1= 1.30, r2= 1.80, r3= 3.35, r4= 3.85, &end
#
# 142 VAL HN 142 VAL QG1 3.89
&rst
ixpk= 0, nxpk= 0, iat=2251, -1, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
igr2=2257,2258,2259,
&end
#
# 142 VAL HN 142 VAL QG2 3.05
&rst
ixpk= 0, nxpk= 0, iat=2251, -1, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,
igr2=2261,2262,2263,
&end
#
# 142 VAL HN 144 LYS HN 4.71
&rst
ixpk= 0, nxpk= 0, iat=2251,2287, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21, &end
#
# 142 VAL HN 144 LYS QD 5.34
&rst
ixpk= 0, nxpk= 0, iat=2251, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2=2297,2298,
&end
#
# 142 VAL HN 152 LEU QD2 4.22
&rst
ixpk= 0, nxpk= 0, iat=2251, -1, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
igr2=2445,2446,2447,
&end
#
# 142 VAL QG1 143 PHE HA 4.46
&rst
ixpk= 0, nxpk= 0, iat= -1,2269, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
igr1=2257,2258,2259,
&end
#
# 142 VAL QG1 143 PHE HN 3.98
&rst
ixpk= 0, nxpk= 0, iat= -1,2267, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
igr1=2257,2258,2259,
&end
#
# 142 VAL QG1 143 PHE QD 4.82
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
igr1=2257,2258,2259,
igr2=2275,2283,
&end
#
# 142 VAL QG1 145 LEU HN 4.73
&rst
ixpk= 0, nxpk= 0, iat= -1,2309, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
igr1=2257,2258,2259,
&end
#
# 142 VAL QG1 146 LEU HN 4.46
&rst
ixpk= 0, nxpk= 0, iat= -1,2328, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
igr1=2257,2258,2259,
&end
#
# 142 VAL QG1 149 LEU QD2 3.11
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
igr1=2257,2258,2259,
igr2=2391,2392,2393,
&end
#
# 142 VAL QG1 152 LEU HA 4.99
&rst
ixpk= 0, nxpk= 0, iat= -1,2434, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1=2257,2258,2259,
&end
#
# 142 VAL QG1 152 LEU QD1 3.15
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
igr1=2257,2258,2259,
igr2=2441,2442,2443,
&end
#
# 142 VAL QG1 152 LEU QD2 3.31
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
igr1=2257,2258,2259,
igr2=2445,2446,2447,
&end
#
# 142 VAL QG2 144 LYS HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2287, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1=2261,2262,2263,
&end
#
# 142 VAL QG2 152 LEU QD2 3.51
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
igr1=2261,2262,2263,
igr2=2445,2446,2447,
&end
#
# 143 PHE HA 143 PHE QD 3.22
&rst
ixpk= 0, nxpk= 0, iat=2269, -1, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11,
igr2=2275,2283,
&end
#
# 143 PHE HA 143 PHE QE 4.51
&rst
ixpk= 0, nxpk= 0, iat=2269, -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
igr2=2277,2281,
&end
#
# 143 PHE HA 146 LEU HN 4.26
&rst
ixpk= 0, nxpk= 0, iat=2269,2328, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76, &end
#
# 143 PHE HB2 144 LYS HN 3.95
&rst
ixpk= 0, nxpk= 0, iat=2271,2287, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45, &end
#
# 143 PHE HB3 144 LYS HN 3.95
&rst
ixpk= 0, nxpk= 0, iat=2272,2287, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45, &end
#
# 143 PHE HN 143 PHE HB2 3.96
&rst
ixpk= 0, nxpk= 0, iat=2267,2271, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46, &end
#
# 143 PHE HN 143 PHE HB3 3.96
&rst
ixpk= 0, nxpk= 0, iat=2267,2272, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46, &end
#
# 143 PHE HN 143 PHE QB 3.17
&rst
ixpk= 0, nxpk= 0, iat=2267, -1, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06,
igr2=2271,2272,
&end
#
# 143 PHE HN 143 PHE QD 3.58
&rst
ixpk= 0, nxpk= 0, iat=2267, -1, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,
igr2=2275,2283,
&end
#
# 143 PHE HN 143 PHE QE 5.15
&rst
ixpk= 0, nxpk= 0, iat=2267, -1, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr2=2277,2281,
&end
#
# 143 PHE HN 144 LYS HN 3.36
&rst
ixpk= 0, nxpk= 0, iat=2267,2287, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86, &end
#
# 143 PHE HN 144 LYS QB 4.99
&rst
ixpk= 0, nxpk= 0, iat=2267, -1, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
igr2=2291,2292,
&end
#
# 143 PHE HN 145 LEU HN 4.37
&rst
ixpk= 0, nxpk= 0, iat=2267,2309, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87, &end
#
# 143 PHE HN 149 LEU QD2 5.12
&rst
ixpk= 0, nxpk= 0, iat=2267, -1, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
igr2=2391,2392,2393,
&end
#
# 143 PHE HN 152 LEU QD2 3.97
&rst
ixpk= 0, nxpk= 0, iat=2267, -1, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
igr2=2445,2446,2447,
&end
#
# 143 PHE HZ 152 LEU HB2 4.81
&rst
ixpk= 0, nxpk= 0, iat=2279,2436, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31, &end
#
# 143 PHE HZ 152 LEU HB3 4.81
&rst
ixpk= 0, nxpk= 0, iat=2279,2437, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31, &end
#
# 143 PHE HZ 152 LEU HN 4.13
&rst
ixpk= 0, nxpk= 0, iat=2279,2432, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63, &end
#
# 143 PHE HZ 156 ASP HA 4.18
&rst
ixpk= 0, nxpk= 0, iat=2279,2493, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68, &end
#
# 143 PHE HZ 157 ARG HA 3.93
&rst
ixpk= 0, nxpk= 0, iat=2279,2505, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43, &end
#
# 143 PHE HZ 157 ARG HN 4.49
&rst
ixpk= 0, nxpk= 0, iat=2279,2503, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99, &end
#
# 143 PHE HZ 157 ARG QB 5.17
&rst
ixpk= 0, nxpk= 0, iat=2279, -1, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
igr2=2507,2508,
&end
#
# 143 PHE HZ 157 ARG QG 4.83
&rst
ixpk= 0, nxpk= 0, iat=2279, -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr2=2510,2511,
&end
#
# 143 PHE QB 144 LYS HA 4.74
&rst
ixpk= 0, nxpk= 0, iat= -1,2289, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
igr1=2271,2272,
&end
#
# 143 PHE QD 144 LYS HN 4.60
&rst
ixpk= 0, nxpk= 0, iat= -1,2287, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
igr1=2275,2283,
&end
#
# 143 PHE QD 147 PRO HA 4.97
&rst
ixpk= 0, nxpk= 0, iat= -1,2357, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr1=2275,2283,
&end
#
# 143 PHE QD 149 LEU HB2 4.40
&rst
ixpk= 0, nxpk= 0, iat= -1,2382, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
igr1=2275,2283,
&end
#
# 143 PHE QD 149 LEU HB3 4.40
&rst
ixpk= 0, nxpk= 0, iat= -1,2383, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
igr1=2275,2283,
&end
#
# 143 PHE QD 149 LEU HN 4.94
&rst
ixpk= 0, nxpk= 0, iat= -1,2378, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
igr1=2275,2283,
&end
#
# 143 PHE QD 149 LEU QB 3.82
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31,
igr1=2275,2283,
igr2=2382,2383,
&end
#
# 143 PHE QD 149 LEU QD1 5.16
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.96, r4= 7.46,
igr1=2275,2283,
igr2=2387,2388,2389,
&end
#
# 143 PHE QD 149 LEU QD2 3.99
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
igr1=2275,2283,
igr2=2391,2392,2393,
&end
#
# 143 PHE QD 152 LEU QD2 4.40
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr1=2275,2283,
igr2=2445,2446,2447,
&end
#
# 143 PHE QE 149 LEU HB2 5.01
&rst
ixpk= 0, nxpk= 0, iat= -1,2382, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
igr1=2277,2281,
&end
#
# 143 PHE QE 149 LEU HB3 5.01
&rst
ixpk= 0, nxpk= 0, iat= -1,2383, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
igr1=2277,2281,
&end
#
# 143 PHE QE 149 LEU HG 4.92
&rst
ixpk= 0, nxpk= 0, iat= -1,2385, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
igr1=2277,2281,
&end
#
# 143 PHE QE 149 LEU HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2378, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1=2277,2281,
&end
#
# 143 PHE QE 149 LEU QB 4.33
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
igr1=2277,2281,
igr2=2382,2383,
&end
#
# 143 PHE QE 149 LEU QD2 4.26
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
igr1=2277,2281,
igr2=2391,2392,2393,
&end
#
# 143 PHE QE 152 LEU QB 4.72
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.95, r4= 6.45,
igr1=2277,2281,
igr2=2436,2437,
&end
#
# 143 PHE QE 152 LEU QD2 4.35
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
igr1=2277,2281,
igr2=2445,2446,2447,
&end
#
# 143 PHE QE 157 ARG HA 3.72
&rst
ixpk= 0, nxpk= 0, iat= -1,2505, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
igr1=2277,2281,
&end
#
# 143 PHE QE 157 ARG QG 4.80
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
igr1=2277,2281,
igr2=2510,2511,
&end
#
# 144 LYS HA 144 LYS HG2 3.93
&rst
ixpk= 0, nxpk= 0, iat=2289,2294, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43, &end
#
# 144 LYS HA 144 LYS HG3 3.93
&rst
ixpk= 0, nxpk= 0, iat=2289,2295, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43, &end
#
# 144 LYS HA 144 LYS QB 2.91
&rst
ixpk= 0, nxpk= 0, iat=2289, -1, r1= 1.30, r2= 1.80, r3= 3.27, r4= 3.77,
igr2=2291,2292,
&end
#
# 144 LYS HG2 145 LEU HA 4.55
&rst
ixpk= 0, nxpk= 0, iat=2294,2311, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05, &end
#
# 144 LYS HG3 145 LEU HA 4.55
&rst
ixpk= 0, nxpk= 0, iat=2295,2311, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05, &end
#
# 144 LYS HN 144 LYS HG2 4.05
&rst
ixpk= 0, nxpk= 0, iat=2287,2294, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55, &end
#
# 144 LYS HN 144 LYS HG3 4.05
&rst
ixpk= 0, nxpk= 0, iat=2287,2295, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55, &end
#
# 144 LYS HN 144 LYS QB 2.92
&rst
ixpk= 0, nxpk= 0, iat=2287, -1, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78,
igr2=2291,2292,
&end
#
# 144 LYS HN 144 LYS QD 4.36
&rst
ixpk= 0, nxpk= 0, iat=2287, -1, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
igr2=2297,2298,
&end
#
# 144 LYS HN 144 LYS QG 3.32
&rst
ixpk= 0, nxpk= 0, iat=2287, -1, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23,
igr2=2294,2295,
&end
#
# 144 LYS HN 145 LEU HN 3.28
&rst
ixpk= 0, nxpk= 0, iat=2287,2309, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78, &end
#
# 144 LYS QB 144 LYS QE 4.23
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
igr1=2291,2292,
igr2=2300,2301,
&end
#
# 144 LYS QB 145 LEU HN 3.52
&rst
ixpk= 0, nxpk= 0, iat= -1,2309, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
igr1=2291,2292,
&end
#
# 144 LYS QD 145 LEU HN 4.73
&rst
ixpk= 0, nxpk= 0, iat= -1,2309, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
igr1=2297,2298,
&end
#
# 144 LYS QG 145 LEU HA 3.96
&rst
ixpk= 0, nxpk= 0, iat= -1,2311, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
igr1=2294,2295,
&end
#
# 144 LYS QG 145 LEU HN 3.34
&rst
ixpk= 0, nxpk= 0, iat= -1,2309, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,
igr1=2294,2295,
&end
#
# 145 LEU HA 145 LEU HG 3.63
&rst
ixpk= 0, nxpk= 0, iat=2311,2316, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13, &end
#
# 145 LEU HA 145 LEU QD1 2.82
&rst
ixpk= 0, nxpk= 0, iat=2311, -1, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89,
igr2=2318,2319,2320,
&end
#
# 145 LEU HA 145 LEU QD2 3.90
&rst
ixpk= 0, nxpk= 0, iat=2311, -1, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
igr2=2322,2323,2324,
&end
#
# 145 LEU HG 146 LEU HN 4.50
&rst
ixpk= 0, nxpk= 0, iat=2316,2328, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 145 LEU HN 145 LEU HB2 3.58
&rst
ixpk= 0, nxpk= 0, iat=2309,2313, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08, &end
#
# 145 LEU HN 145 LEU HB3 3.58
&rst
ixpk= 0, nxpk= 0, iat=2309,2314, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08, &end
#
# 145 LEU HN 145 LEU HG 4.67
&rst
ixpk= 0, nxpk= 0, iat=2309,2316, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, &end
#
# 145 LEU HN 145 LEU QB 2.88
&rst
ixpk= 0, nxpk= 0, iat=2309, -1, r1= 1.30, r2= 1.80, r3= 3.23, r4= 3.73,
igr2=2313,2314,
&end
#
# 145 LEU HN 145 LEU QD1 4.06
&rst
ixpk= 0, nxpk= 0, iat=2309, -1, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
igr2=2318,2319,2320,
&end
#
# 145 LEU HN 145 LEU QD2 4.35
&rst
ixpk= 0, nxpk= 0, iat=2309, -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
igr2=2322,2323,2324,
&end
#
# 145 LEU HN 146 LEU HN 3.28
&rst
ixpk= 0, nxpk= 0, iat=2309,2328, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78, &end
#
# 145 LEU QB 145 LEU QD1 2.89
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40,
igr1=2313,2314,
igr2=2318,2319,2320,
&end
#
# 145 LEU QB 145 LEU QD2 3.12
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,
igr1=2313,2314,
igr2=2322,2323,2324,
&end
#
# 145 LEU QB 146 LEU HN 3.22
&rst
ixpk= 0, nxpk= 0, iat= -1,2328, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11,
igr1=2313,2314,
&end
#
# 145 LEU QD1 146 LEU HN 4.90
&rst
ixpk= 0, nxpk= 0, iat= -1,2328, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
igr1=2318,2319,2320,
&end
#
# 146 LEU HA 147 PRO HD2 3.48
&rst
ixpk= 0, nxpk= 0, iat=2330,2348, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98, &end
#
# 146 LEU HA 147 PRO HD3 3.48
&rst
ixpk= 0, nxpk= 0, iat=2330,2349, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98, &end
#
# 146 LEU HB2 146 LEU QD1 3.47
&rst
ixpk= 0, nxpk= 0, iat=2332, -1, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,
igr2=2337,2338,2339,
&end
#
# 146 LEU HB2 147 PRO QD 5.32
&rst
ixpk= 0, nxpk= 0, iat=2332, -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr2=2348,2349,
&end
#
# 146 LEU HB2 148 GLN QE2 5.34
&rst
ixpk= 0, nxpk= 0, iat=2332, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2=2373,2374,
&end
#
# 146 LEU HB2 149 LEU HN 3.86
&rst
ixpk= 0, nxpk= 0, iat=2332,2378, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 146 LEU HB2 149 LEU QB 4.42
&rst
ixpk= 0, nxpk= 0, iat=2332, -1, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
igr2=2382,2383,
&end
#
# 146 LEU HB3 146 LEU QD1 3.92
&rst
ixpk= 0, nxpk= 0, iat=2333, -1, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
igr2=2337,2338,2339,
&end
#
# 146 LEU HB3 146 LEU QD2 4.16
&rst
ixpk= 0, nxpk= 0, iat=2333, -1, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,
igr2=2341,2342,2343,
&end
#
# 146 LEU HB3 148 GLN QE2 4.53
&rst
ixpk= 0, nxpk= 0, iat=2333, -1, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
igr2=2373,2374,
&end
#
# 146 LEU HB3 149 LEU HN 4.24
&rst
ixpk= 0, nxpk= 0, iat=2333,2378, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74, &end
#
# 146 LEU HB3 149 LEU QB 4.09
&rst
ixpk= 0, nxpk= 0, iat=2333, -1, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
igr2=2382,2383,
&end
#
# 146 LEU HN 146 LEU HB3 3.88
&rst
ixpk= 0, nxpk= 0, iat=2328,2333, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38, &end
#
# 146 LEU HN 146 LEU HG 3.48
&rst
ixpk= 0, nxpk= 0, iat=2328,2335, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98, &end
#
# 146 LEU HN 146 LEU QD1 4.22
&rst
ixpk= 0, nxpk= 0, iat=2328, -1, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
igr2=2337,2338,2339,
&end
#
# 146 LEU HN 146 LEU QD2 4.05
&rst
ixpk= 0, nxpk= 0, iat=2328, -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
igr2=2341,2342,2343,
&end
#
# 146 LEU HN 147 PRO HD2 4.83
&rst
ixpk= 0, nxpk= 0, iat=2328,2348, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33, &end
#
# 146 LEU HN 147 PRO HD3 4.83
&rst
ixpk= 0, nxpk= 0, iat=2328,2349, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33, &end
#
# 146 LEU HN 147 PRO QD 4.11
&rst
ixpk= 0, nxpk= 0, iat=2328, -1, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
igr2=2348,2349,
&end
#
# 146 LEU QD1 148 GLN QE2 4.81
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.48, r4= 6.98,
igr1=2337,2338,2339,
igr2=2373,2374,
&end
#
# 146 LEU QD2 147 PRO QD 3.83
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
igr1=2341,2342,2343,
igr2=2348,2349,
&end
#
# 146 LEU QD2 148 GLN HE21 4.34
&rst
ixpk= 0, nxpk= 0, iat= -1,2373, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,
igr1=2341,2342,2343,
&end
#
# 146 LEU QD2 148 GLN HE22 4.34
&rst
ixpk= 0, nxpk= 0, iat= -1,2374, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,
igr1=2341,2342,2343,
&end
#
# 146 LEU QD2 148 GLN QE2 3.68
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
igr1=2341,2342,2343,
igr2=2373,2374,
&end
#
# 147 PRO HA 149 LEU HN 4.50
&rst
ixpk= 0, nxpk= 0, iat=2357,2378, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 147 PRO HD2 148 GLN HN 4.40
&rst
ixpk= 0, nxpk= 0, iat=2348,2361, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 147 PRO HD3 148 GLN HN 4.40
&rst
ixpk= 0, nxpk= 0, iat=2349,2361, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 147 PRO QB 148 GLN HN 4.02
&rst
ixpk= 0, nxpk= 0, iat= -1,2361, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,
igr1=2354,2355,
&end
#
# 147 PRO QD 148 GLN HN 3.82
&rst
ixpk= 0, nxpk= 0, iat= -1,2361, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,
igr1=2348,2349,
&end
#
# 147 PRO QG 148 GLN HN 4.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2361, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
igr1=2351,2352,
&end
#
# 148 GLN HA 148 GLN QG 3.61
&rst
ixpk= 0, nxpk= 0, iat=2363, -1, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,
igr2=2368,2369,
&end
#
# 148 GLN HN 148 GLN HB2 3.72
&rst
ixpk= 0, nxpk= 0, iat=2361,2365, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22, &end
#
# 148 GLN HN 148 GLN HB3 3.72
&rst
ixpk= 0, nxpk= 0, iat=2361,2366, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22, &end
#
# 148 GLN HN 148 GLN HG2 4.22
&rst
ixpk= 0, nxpk= 0, iat=2361,2368, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 148 GLN HN 148 GLN HG3 4.22
&rst
ixpk= 0, nxpk= 0, iat=2361,2369, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 148 GLN HN 148 GLN QB 3.06
&rst
ixpk= 0, nxpk= 0, iat=2361, -1, r1= 1.30, r2= 1.80, r3= 3.43, r4= 3.93,
igr2=2365,2366,
&end
#
# 148 GLN HN 148 GLN QG 3.70
&rst
ixpk= 0, nxpk= 0, iat=2361, -1, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65,
igr2=2368,2369,
&end
#
# 148 GLN HN 149 LEU HN 3.33
&rst
ixpk= 0, nxpk= 0, iat=2361,2378, r1= 1.30, r2= 1.80, r3= 3.33, r4= 3.83, &end
#
# 148 GLN HN 149 LEU QB 4.77
&rst
ixpk= 0, nxpk= 0, iat=2361, -1, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,
igr2=2382,2383,
&end
#
# 148 GLN QB 149 LEU HN 4.39
&rst
ixpk= 0, nxpk= 0, iat= -1,2378, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,
igr1=2365,2366,
&end
#
# 148 GLN QG 149 LEU HN 4.15
&rst
ixpk= 0, nxpk= 0, iat= -1,2378, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
igr1=2368,2369,
&end
#
# 149 LEU HA 149 LEU HG 4.04
&rst
ixpk= 0, nxpk= 0, iat=2380,2385, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, &end
#
# 149 LEU HA 149 LEU QD1 3.37
&rst
ixpk= 0, nxpk= 0, iat=2380, -1, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,
igr2=2387,2388,2389,
&end
#
# 149 LEU HA 149 LEU QD2 3.90
&rst
ixpk= 0, nxpk= 0, iat=2380, -1, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
igr2=2391,2392,2393,
&end
#
# 149 LEU HA 150 THR HB 4.93
&rst
ixpk= 0, nxpk= 0, iat=2380,2401, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43, &end
#
# 149 LEU HA 150 THR HN 3.45
&rst
ixpk= 0, nxpk= 0, iat=2380,2397, r1= 1.30, r2= 1.80, r3= 3.45, r4= 3.95, &end
#
# 149 LEU HA 151 TYR HN 4.17
&rst
ixpk= 0, nxpk= 0, iat=2380,2411, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67, &end
#
# 149 LEU HB2 149 LEU QD2 3.58
&rst
ixpk= 0, nxpk= 0, iat=2382, -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
igr2=2391,2392,2393,
&end
#
# 149 LEU HB2 150 THR HN 4.91
&rst
ixpk= 0, nxpk= 0, iat=2382,2397, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41, &end
#
# 149 LEU HB3 149 LEU QD2 3.58
&rst
ixpk= 0, nxpk= 0, iat=2383, -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
igr2=2391,2392,2393,
&end
#
# 149 LEU HB3 150 THR HN 4.91
&rst
ixpk= 0, nxpk= 0, iat=2383,2397, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41, &end
#
# 149 LEU HG 150 THR HA 5.50
&rst
ixpk= 0, nxpk= 0, iat=2385,2399, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 149 LEU HG 150 THR HN 4.55
&rst
ixpk= 0, nxpk= 0, iat=2385,2397, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05, &end
#
# 149 LEU HG 151 TYR HN 4.06
&rst
ixpk= 0, nxpk= 0, iat=2385,2411, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56, &end
#
# 149 LEU HN 149 LEU HB2 3.45
&rst
ixpk= 0, nxpk= 0, iat=2378,2382, r1= 1.30, r2= 1.80, r3= 3.45, r4= 3.95, &end
#
# 149 LEU HN 149 LEU HB3 3.45
&rst
ixpk= 0, nxpk= 0, iat=2378,2383, r1= 1.30, r2= 1.80, r3= 3.45, r4= 3.95, &end
#
# 149 LEU HN 149 LEU HG 4.73
&rst
ixpk= 0, nxpk= 0, iat=2378,2385, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, &end
#
# 149 LEU HN 149 LEU QD1 3.93
&rst
ixpk= 0, nxpk= 0, iat=2378, -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
igr2=2387,2388,2389,
&end
#
# 149 LEU HN 149 LEU QD2 4.36
&rst
ixpk= 0, nxpk= 0, iat=2378, -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr2=2391,2392,2393,
&end
#
# 149 LEU HN 150 THR HN 4.77
&rst
ixpk= 0, nxpk= 0, iat=2378,2397, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27, &end
#
# 149 LEU QB 149 LEU QD1 3.18
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,
igr1=2382,2383,
igr2=2387,2388,2389,
&end
#
# 149 LEU QB 149 LEU QD2 2.99
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,
igr1=2382,2383,
igr2=2391,2392,2393,
&end
#
# 149 LEU QB 150 THR HN 4.27
&rst
ixpk= 0, nxpk= 0, iat= -1,2397, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
igr1=2382,2383,
&end
#
# 149 LEU QD1 150 THR HN 3.88
&rst
ixpk= 0, nxpk= 0, iat= -1,2397, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
igr1=2387,2388,2389,
&end
#
# 149 LEU QD1 151 TYR HN 4.03
&rst
ixpk= 0, nxpk= 0, iat= -1,2411, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
igr1=2387,2388,2389,
&end
#
# 149 LEU QD2 150 THR HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2397, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1=2391,2392,2393,
&end
#
# 149 LEU QD2 151 TYR HN 4.66
&rst
ixpk= 0, nxpk= 0, iat= -1,2411, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
igr1=2391,2392,2393,
&end
#
# 149 LEU QD2 152 LEU HA 4.22
&rst
ixpk= 0, nxpk= 0, iat= -1,2434, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
igr1=2391,2392,2393,
&end
#
# 149 LEU QD2 152 LEU QD2 4.39
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.33, r4= 6.83,
igr1=2391,2392,2393,
igr2=2445,2446,2447,
&end
#
# 150 THR HA 150 THR QG2 3.20
&rst
ixpk= 0, nxpk= 0, iat=2399, -1, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
igr2=2403,2404,2405,
&end
#
# 150 THR HB 151 TYR HN 3.59
&rst
ixpk= 0, nxpk= 0, iat=2401,2411, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09, &end
#
# 150 THR HB 151 TYR QD 3.83
&rst
ixpk= 0, nxpk= 0, iat=2401, -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
igr2=2419,2428,
&end
#
# 150 THR HB 151 TYR QE 4.96
&rst
ixpk= 0, nxpk= 0, iat=2401, -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
igr2=2421,2426,
&end
#
# 150 THR HN 150 THR HB 3.65
&rst
ixpk= 0, nxpk= 0, iat=2397,2401, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15, &end
#
# 150 THR HN 150 THR QG2 4.01
&rst
ixpk= 0, nxpk= 0, iat=2397, -1, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
igr2=2403,2404,2405,
&end
#
# 150 THR HN 151 TYR HN 3.31
&rst
ixpk= 0, nxpk= 0, iat=2397,2411, r1= 1.30, r2= 1.80, r3= 3.31, r4= 3.81, &end
#
# 150 THR HN 151 TYR QD 5.50
&rst
ixpk= 0, nxpk= 0, iat=2397, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2=2419,2428,
&end
#
# 150 THR QG2 151 TYR HN 3.99
&rst
ixpk= 0, nxpk= 0, iat= -1,2411, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
igr1=2403,2404,2405,
&end
#
# 150 THR QG2 151 TYR QD 4.05
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
igr1=2403,2404,2405,
igr2=2419,2428,
&end
#
# 150 THR QG2 151 TYR QE 4.24
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
igr1=2403,2404,2405,
igr2=2421,2426,
&end
#
# 150 THR QG2 156 ASP HA 4.28
&rst
ixpk= 0, nxpk= 0, iat= -1,2493, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
igr1=2403,2404,2405,
&end
#
# 150 THR QG2 156 ASP HB2 4.45
&rst
ixpk= 0, nxpk= 0, iat= -1,2495, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr1=2403,2404,2405,
&end
#
# 150 THR QG2 156 ASP HB3 4.45
&rst
ixpk= 0, nxpk= 0, iat= -1,2496, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr1=2403,2404,2405,
&end
#
# 150 THR QG2 156 ASP QB 3.88
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73,
igr1=2403,2404,2405,
igr2=2495,2496,
&end
#
# 150 THR QG2 157 ARG HN 4.69
&rst
ixpk= 0, nxpk= 0, iat= -1,2503, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr1=2403,2404,2405,
&end
#
# 151 TYR HB2 152 LEU HN 4.97
&rst
ixpk= 0, nxpk= 0, iat=2415,2432, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 151 TYR HB3 152 LEU HA 5.12
&rst
ixpk= 0, nxpk= 0, iat=2416,2434, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, &end
#
# 151 TYR HB3 152 LEU HN 4.19
&rst
ixpk= 0, nxpk= 0, iat=2416,2432, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69, &end
#
# 151 TYR HB3 156 ASP HA 5.50
&rst
ixpk= 0, nxpk= 0, iat=2416,2493, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 151 TYR HB3 162 ALA QB 4.46
&rst
ixpk= 0, nxpk= 0, iat=2416, -1, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
igr2=2590,2591,2592,
&end
#
# 151 TYR HN 151 TYR HB2 3.59
&rst
ixpk= 0, nxpk= 0, iat=2411,2415, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09, &end
#
# 151 TYR HN 151 TYR QD 3.80
&rst
ixpk= 0, nxpk= 0, iat=2411, -1, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,
igr2=2419,2428,
&end
#
# 151 TYR HN 152 LEU HN 4.64
&rst
ixpk= 0, nxpk= 0, iat=2411,2432, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14, &end
#
# 151 TYR QD 152 LEU HN 4.11
&rst
ixpk= 0, nxpk= 0, iat= -1,2432, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
igr1=2419,2428,
&end
#
# 151 TYR QD 154 GLY HA2 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2465, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1=2419,2428,
&end
#
# 151 TYR QD 155 TYR HA 4.25
&rst
ixpk= 0, nxpk= 0, iat= -1,2472, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
igr1=2419,2428,
&end
#
# 151 TYR QD 155 TYR HN 4.98
&rst
ixpk= 0, nxpk= 0, iat= -1,2470, r1= 1.30, r2= 1.80, r3= 5.59, r4= 6.09,
igr1=2419,2428,
&end
#
# 151 TYR QD 156 ASP HA 3.84
&rst
ixpk= 0, nxpk= 0, iat= -1,2493, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,
igr1=2419,2428,
&end
#
# 151 TYR QD 156 ASP HB2 4.35
&rst
ixpk= 0, nxpk= 0, iat= -1,2495, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
igr1=2419,2428,
&end
#
# 151 TYR QD 156 ASP HB3 4.35
&rst
ixpk= 0, nxpk= 0, iat= -1,2496, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
igr1=2419,2428,
&end
#
# 151 TYR QD 156 ASP HN 4.16
&rst
ixpk= 0, nxpk= 0, iat= -1,2491, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
igr1=2419,2428,
&end
#
# 151 TYR QD 156 ASP QB 3.82
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31,
igr1=2419,2428,
igr2=2495,2496,
&end
#
# 151 TYR QD 157 ARG HN 5.35
&rst
ixpk= 0, nxpk= 0, iat= -1,2503, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51,
igr1=2419,2428,
&end
#
# 151 TYR QD 161 GLU HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2573, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1=2419,2428,
&end
#
# 151 TYR QD 162 ALA HA 4.64
&rst
ixpk= 0, nxpk= 0, iat= -1,2588, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,
igr1=2419,2428,
&end
#
# 151 TYR QD 162 ALA HN 5.20
&rst
ixpk= 0, nxpk= 0, iat= -1,2586, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
igr1=2419,2428,
&end
#
# 151 TYR QD 162 ALA QB 4.15
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.59, r4= 6.09,
igr1=2419,2428,
igr2=2590,2591,2592,
&end
#
# 151 TYR QE 152 LEU HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2432, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1=2421,2426,
&end
#
# 151 TYR QE 155 TYR HA 4.68
&rst
ixpk= 0, nxpk= 0, iat= -1,2472, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
igr1=2421,2426,
&end
#
# 151 TYR QE 156 ASP HA 4.34
&rst
ixpk= 0, nxpk= 0, iat= -1,2493, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,
igr1=2421,2426,
&end
#
# 151 TYR QE 156 ASP HB2 4.27
&rst
ixpk= 0, nxpk= 0, iat= -1,2495, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
igr1=2421,2426,
&end
#
# 151 TYR QE 156 ASP HB3 4.27
&rst
ixpk= 0, nxpk= 0, iat= -1,2496, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
igr1=2421,2426,
&end
#
# 151 TYR QE 156 ASP HN 4.35
&rst
ixpk= 0, nxpk= 0, iat= -1,2491, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
igr1=2421,2426,
&end
#
# 151 TYR QE 156 ASP QB 3.48
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
igr1=2421,2426,
igr2=2495,2496,
&end
#
# 151 TYR QE 160 GLN HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2554, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1=2421,2426,
&end
#
# 151 TYR QE 161 GLU HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2573, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1=2421,2426,
&end
#
# 151 TYR QE 162 ALA HA 3.70
&rst
ixpk= 0, nxpk= 0, iat= -1,2588, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65,
igr1=2421,2426,
&end
#
# 151 TYR QE 162 ALA HN 4.69
&rst
ixpk= 0, nxpk= 0, iat= -1,2586, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr1=2421,2426,
&end
#
# 151 TYR QE 162 ALA QB 4.34
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
igr1=2421,2426,
igr2=2590,2591,2592,
&end
#
# 151 TYR QE 163 PRO HD2 4.24
&rst
ixpk= 0, nxpk= 0, iat= -1,2597, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
igr1=2421,2426,
&end
#
# 151 TYR QE 163 PRO HD3 4.24
&rst
ixpk= 0, nxpk= 0, iat= -1,2598, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
igr1=2421,2426,
&end
#
# 151 TYR QE 163 PRO QD 3.71
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
igr1=2421,2426,
igr2=2597,2598,
&end
#
# 152 LEU HA 152 LEU HG 4.16
&rst
ixpk= 0, nxpk= 0, iat=2434,2439, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66, &end
#
# 152 LEU HA 152 LEU QD1 3.32
&rst
ixpk= 0, nxpk= 0, iat=2434, -1, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,
igr2=2441,2442,2443,
&end
#
# 152 LEU HA 152 LEU QD2 4.29
&rst
ixpk= 0, nxpk= 0, iat=2434, -1, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
igr2=2445,2446,2447,
&end
#
# 152 LEU HA 153 ASP HN 3.56
&rst
ixpk= 0, nxpk= 0, iat=2434,2451, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06, &end
#
# 152 LEU HA 154 GLY HN 4.70
&rst
ixpk= 0, nxpk= 0, iat=2434,2463, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 152 LEU HB2 152 LEU QD2 3.78
&rst
ixpk= 0, nxpk= 0, iat=2436, -1, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
igr2=2445,2446,2447,
&end
#
# 152 LEU HB3 152 LEU QD2 3.78
&rst
ixpk= 0, nxpk= 0, iat=2437, -1, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
igr2=2445,2446,2447,
&end
#
# 152 LEU HG 153 ASP HN 5.12
&rst
ixpk= 0, nxpk= 0, iat=2439,2451, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, &end
#
# 152 LEU HG 153 ASP QB 4.59
&rst
ixpk= 0, nxpk= 0, iat=2439, -1, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
igr2=2455,2456,
&end
#
# 152 LEU HN 152 LEU QD1 4.73
&rst
ixpk= 0, nxpk= 0, iat=2432, -1, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
igr2=2441,2442,2443,
&end
#
# 152 LEU HN 152 LEU QD2 4.91
&rst
ixpk= 0, nxpk= 0, iat=2432, -1, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
igr2=2445,2446,2447,
&end
#
# 152 LEU HN 155 TYR HN 4.28
&rst
ixpk= 0, nxpk= 0, iat=2432,2470, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78, &end
#
# 152 LEU HN 156 ASP HA 4.42
&rst
ixpk= 0, nxpk= 0, iat=2432,2493, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92, &end
#
# 152 LEU QB 152 LEU QD2 3.24
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
igr1=2436,2437,
igr2=2445,2446,2447,
&end
#
# 152 LEU QD1 153 ASP HN 4.13
&rst
ixpk= 0, nxpk= 0, iat= -1,2451, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
igr1=2441,2442,2443,
&end
#
# 152 LEU QD1 153 ASP QB 5.06
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.82, r4= 7.32,
igr1=2441,2442,2443,
igr2=2455,2456,
&end
#
# 153 ASP HN 154 GLY HN 4.03
&rst
ixpk= 0, nxpk= 0, iat=2451,2463, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53, &end
#
# 153 ASP QB 154 GLY HN 4.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2463, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
igr1=2455,2456,
&end
#
# 154 GLY HA2 155 TYR QD 4.58
&rst
ixpk= 0, nxpk= 0, iat=2465, -1, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
igr2=2478,2487,
&end
#
# 154 GLY HA2 162 ALA QB 3.99
&rst
ixpk= 0, nxpk= 0, iat=2465, -1, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
igr2=2590,2591,2592,
&end
#
# 154 GLY HA3 155 TYR QD 4.81
&rst
ixpk= 0, nxpk= 0, iat=2466, -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr2=2478,2487,
&end
#
# 154 GLY HA3 155 TYR QE 5.12
&rst
ixpk= 0, nxpk= 0, iat=2466, -1, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
igr2=2480,2485,
&end
#
# 154 GLY HA3 162 ALA HN 5.04
&rst
ixpk= 0, nxpk= 0, iat=2466,2586, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54, &end
#
# 154 GLY HA3 162 ALA QB 4.29
&rst
ixpk= 0, nxpk= 0, iat=2466, -1, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
igr2=2590,2591,2592,
&end
#
# 154 GLY HN 155 TYR HN 3.39
&rst
ixpk= 0, nxpk= 0, iat=2463,2470, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89, &end
#
# 154 GLY HN 162 ALA QB 5.06
&rst
ixpk= 0, nxpk= 0, iat=2463, -1, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
igr2=2590,2591,2592,
&end
#
# 155 TYR HA 155 TYR QD 3.81
&rst
ixpk= 0, nxpk= 0, iat=2472, -1, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,
igr2=2478,2487,
&end
#
# 155 TYR HA 155 TYR QE 4.50
&rst
ixpk= 0, nxpk= 0, iat=2472, -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
igr2=2480,2485,
&end
#
# 155 TYR HA 156 ASP HN 3.26
&rst
ixpk= 0, nxpk= 0, iat=2472,2491, r1= 1.30, r2= 1.80, r3= 3.26, r4= 3.76, &end
#
# 155 TYR HA 159 ASP HA 5.27
&rst
ixpk= 0, nxpk= 0, iat=2472,2544, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77, &end
#
# 155 TYR HA 160 GLN HN 4.49
&rst
ixpk= 0, nxpk= 0, iat=2472,2554, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99, &end
#
# 155 TYR HA 161 GLU HA 3.58
&rst
ixpk= 0, nxpk= 0, iat=2472,2573, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08, &end
#
# 155 TYR HA 161 GLU HB2 5.13
&rst
ixpk= 0, nxpk= 0, iat=2472,2575, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63, &end
#
# 155 TYR HA 161 GLU HB3 5.43
&rst
ixpk= 0, nxpk= 0, iat=2472,2576, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93, &end
#
# 155 TYR HA 161 GLU HN 5.07
&rst
ixpk= 0, nxpk= 0, iat=2472,2571, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, &end
#
# 155 TYR HA 162 ALA HN 3.81
&rst
ixpk= 0, nxpk= 0, iat=2472,2586, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31, &end
#
# 155 TYR HA 162 ALA QB 4.51
&rst
ixpk= 0, nxpk= 0, iat=2472, -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr2=2590,2591,2592,
&end
#
# 155 TYR HB2 156 ASP HN 4.60
&rst
ixpk= 0, nxpk= 0, iat=2474,2491, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 155 TYR HB2 159 ASP HA 4.65
&rst
ixpk= 0, nxpk= 0, iat=2474,2544, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15, &end
#
# 155 TYR HB2 161 GLU HA 5.32
&rst
ixpk= 0, nxpk= 0, iat=2474,2573, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82, &end
#
# 155 TYR HB3 156 ASP HN 4.09
&rst
ixpk= 0, nxpk= 0, iat=2475,2491, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59, &end
#
# 155 TYR HB3 159 ASP HA 4.18
&rst
ixpk= 0, nxpk= 0, iat=2475,2544, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68, &end
#
# 155 TYR HB3 159 ASP HN 5.00
&rst
ixpk= 0, nxpk= 0, iat=2475,2542, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 155 TYR HB3 161 GLU HA 4.89
&rst
ixpk= 0, nxpk= 0, iat=2475,2573, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39, &end
#
# 155 TYR HN 155 TYR HB2 3.35
&rst
ixpk= 0, nxpk= 0, iat=2470,2474, r1= 1.30, r2= 1.80, r3= 3.35, r4= 3.85, &end
#
# 155 TYR HN 155 TYR QD 3.76
&rst
ixpk= 0, nxpk= 0, iat=2470, -1, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
igr2=2478,2487,
&end
#
# 155 TYR HN 155 TYR QE 5.08
&rst
ixpk= 0, nxpk= 0, iat=2470, -1, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr2=2480,2485,
&end
#
# 155 TYR HN 156 ASP HN 4.81
&rst
ixpk= 0, nxpk= 0, iat=2470,2491, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31, &end
#
# 155 TYR HN 162 ALA QB 5.16
&rst
ixpk= 0, nxpk= 0, iat=2470, -1, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
igr2=2590,2591,2592,
&end
#
# 155 TYR QD 156 ASP HN 4.34
&rst
ixpk= 0, nxpk= 0, iat= -1,2491, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,
igr1=2478,2487,
&end
#
# 155 TYR QD 159 ASP HA 3.77
&rst
ixpk= 0, nxpk= 0, iat= -1,2544, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,
igr1=2478,2487,
&end
#
# 155 TYR QD 159 ASP HN 4.98
&rst
ixpk= 0, nxpk= 0, iat= -1,2542, r1= 1.30, r2= 1.80, r3= 5.59, r4= 6.09,
igr1=2478,2487,
&end
#
# 155 TYR QD 160 GLN HA 4.20
&rst
ixpk= 0, nxpk= 0, iat= -1,2556, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
igr1=2478,2487,
&end
#
# 155 TYR QD 160 GLN HN 4.62
&rst
ixpk= 0, nxpk= 0, iat= -1,2554, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
igr1=2478,2487,
&end
#
# 155 TYR QD 161 GLU HA 3.88
&rst
ixpk= 0, nxpk= 0, iat= -1,2573, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,
igr1=2478,2487,
&end
#
# 155 TYR QD 161 GLU HB2 4.28
&rst
ixpk= 0, nxpk= 0, iat= -1,2575, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1=2478,2487,
&end
#
# 155 TYR QD 161 GLU HG2 4.60
&rst
ixpk= 0, nxpk= 0, iat= -1,2578, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
igr1=2478,2487,
&end
#
# 155 TYR QD 161 GLU HG3 4.60
&rst
ixpk= 0, nxpk= 0, iat= -1,2579, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
igr1=2478,2487,
&end
#
# 155 TYR QD 161 GLU HN 4.17
&rst
ixpk= 0, nxpk= 0, iat= -1,2571, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
igr1=2478,2487,
&end
#
# 155 TYR QD 162 ALA HN 4.65
&rst
ixpk= 0, nxpk= 0, iat= -1,2586, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
igr1=2478,2487,
&end
#
# 155 TYR QD 162 ALA QB 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.20, r4= 7.70,
igr1=2478,2487,
igr2=2590,2591,2592,
&end
#
# 155 TYR QE 159 ASP HA 4.94
&rst
ixpk= 0, nxpk= 0, iat= -1,2544, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
igr1=2480,2485,
&end
#
# 155 TYR QE 159 ASP QB 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
igr1=2480,2485,
igr2=2546,2547,
&end
#
# 155 TYR QE 161 GLU HA 4.12
&rst
ixpk= 0, nxpk= 0, iat= -1,2573, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
igr1=2480,2485,
&end
#
# 155 TYR QE 161 GLU HB2 3.66
&rst
ixpk= 0, nxpk= 0, iat= -1,2575, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
igr1=2480,2485,
&end
#
# 155 TYR QE 161 GLU HB3 4.31
&rst
ixpk= 0, nxpk= 0, iat= -1,2576, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
igr1=2480,2485,
&end
#
# 155 TYR QE 161 GLU HG2 3.97
&rst
ixpk= 0, nxpk= 0, iat= -1,2578, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
igr1=2480,2485,
&end
#
# 155 TYR QE 161 GLU HG3 3.97
&rst
ixpk= 0, nxpk= 0, iat= -1,2579, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
igr1=2480,2485,
&end
#
# 155 TYR QE 161 GLU HN 3.99
&rst
ixpk= 0, nxpk= 0, iat= -1,2571, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
igr1=2480,2485,
&end
#
# 155 TYR QE 161 GLU QG 3.42
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,
igr1=2480,2485,
igr2=2578,2579,
&end
#
# 155 TYR QE 162 ALA HN 4.94
&rst
ixpk= 0, nxpk= 0, iat= -1,2586, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
igr1=2480,2485,
&end
#
# 156 ASP HA 157 ARG HA 4.92
&rst
ixpk= 0, nxpk= 0, iat=2493,2505, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42, &end
#
# 156 ASP HA 158 GLU HN 4.88
&rst
ixpk= 0, nxpk= 0, iat=2493,2527, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38, &end
#
# 156 ASP HB2 157 ARG HN 3.79
&rst
ixpk= 0, nxpk= 0, iat=2495,2503, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29, &end
#
# 156 ASP HB2 158 GLU HN 4.60
&rst
ixpk= 0, nxpk= 0, iat=2495,2527, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 156 ASP HB3 157 ARG HN 3.79
&rst
ixpk= 0, nxpk= 0, iat=2496,2503, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29, &end
#
# 156 ASP HB3 158 GLU HN 4.60
&rst
ixpk= 0, nxpk= 0, iat=2496,2527, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 156 ASP HN 159 ASP HA 4.71
&rst
ixpk= 0, nxpk= 0, iat=2491,2544, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21, &end
#
# 156 ASP HN 159 ASP HN 4.90
&rst
ixpk= 0, nxpk= 0, iat=2491,2542, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40, &end
#
# 156 ASP HN 160 GLN HN 3.64
&rst
ixpk= 0, nxpk= 0, iat=2491,2554, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14, &end
#
# 156 ASP HN 161 GLU HA 4.27
&rst
ixpk= 0, nxpk= 0, iat=2491,2573, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77, &end
#
# 156 ASP HN 162 ALA HN 5.25
&rst
ixpk= 0, nxpk= 0, iat=2491,2586, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75, &end
#
# 156 ASP QB 157 ARG HA 4.78
&rst
ixpk= 0, nxpk= 0, iat= -1,2505, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr1=2495,2496,
&end
#
# 156 ASP QB 157 ARG HN 3.28
&rst
ixpk= 0, nxpk= 0, iat= -1,2503, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18,
igr1=2495,2496,
&end
#
# 156 ASP QB 158 GLU HN 4.04
&rst
ixpk= 0, nxpk= 0, iat= -1,2527, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
igr1=2495,2496,
&end
#
# 157 ARG HA 157 ARG QD 4.42
&rst
ixpk= 0, nxpk= 0, iat=2505, -1, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
igr2=2513,2514,
&end
#
# 157 ARG HA 157 ARG QG 3.47
&rst
ixpk= 0, nxpk= 0, iat=2505, -1, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,
igr2=2510,2511,
&end
#
# 157 ARG HA 158 GLU HA 5.24
&rst
ixpk= 0, nxpk= 0, iat=2505,2529, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74, &end
#
# 157 ARG HA 158 GLU QG 5.21
&rst
ixpk= 0, nxpk= 0, iat=2505, -1, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
igr2=2534,2535,
&end
#
# 157 ARG HA 159 ASP HA 5.50
&rst
ixpk= 0, nxpk= 0, iat=2505,2544, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 157 ARG HA 159 ASP HN 4.45
&rst
ixpk= 0, nxpk= 0, iat=2505,2542, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95, &end
#
# 157 ARG HB2 157 ARG HE 5.03
&rst
ixpk= 0, nxpk= 0, iat=2507,2516, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53, &end
#
# 157 ARG HB2 157 ARG QD 4.00
&rst
ixpk= 0, nxpk= 0, iat=2507, -1, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
igr2=2513,2514,
&end
#
# 157 ARG HB3 157 ARG HE 5.03
&rst
ixpk= 0, nxpk= 0, iat=2508,2516, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53, &end
#
# 157 ARG HB3 157 ARG QD 4.00
&rst
ixpk= 0, nxpk= 0, iat=2508, -1, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
igr2=2513,2514,
&end
#
# 157 ARG HN 157 ARG HG2 4.01
&rst
ixpk= 0, nxpk= 0, iat=2503,2510, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51, &end
#
# 157 ARG HN 157 ARG HG3 4.01
&rst
ixpk= 0, nxpk= 0, iat=2503,2511, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51, &end
#
# 157 ARG HN 157 ARG QB 3.46
&rst
ixpk= 0, nxpk= 0, iat=2503, -1, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,
igr2=2507,2508,
&end
#
# 157 ARG HN 157 ARG QD 4.25
&rst
ixpk= 0, nxpk= 0, iat=2503, -1, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
igr2=2513,2514,
&end
#
# 157 ARG QB 157 ARG QD 3.39
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,
igr1=2507,2508,
igr2=2513,2514,
&end
#
# 157 ARG QB 158 GLU HN 4.16
&rst
ixpk= 0, nxpk= 0, iat= -1,2527, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
igr1=2507,2508,
&end
#
# 157 ARG QB 158 GLU QG 4.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
igr1=2507,2508,
igr2=2534,2535,
&end
#
# 157 ARG QD 157 ARG QH1 4.42
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
igr1=2513,2514,
igr2=2519,2520,
&end
#
# 157 ARG QD 157 ARG QH2 4.40
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
igr1=2513,2514,
igr2=2522,2523,
&end
#
# 158 GLU HA 158 GLU QG 3.11
&rst
ixpk= 0, nxpk= 0, iat=2529, -1, r1= 1.30, r2= 1.80, r3= 3.49, r4= 3.99,
igr2=2534,2535,
&end
#
# 158 GLU HA 160 GLN HE21 5.19
&rst
ixpk= 0, nxpk= 0, iat=2529,2566, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69, &end
#
# 158 GLU HA 160 GLN QG 5.01
&rst
ixpk= 0, nxpk= 0, iat=2529, -1, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
igr2=2561,2562,
&end
#
# 158 GLU HB2 159 ASP HN 4.66
&rst
ixpk= 0, nxpk= 0, iat=2531,2542, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16, &end
#
# 158 GLU HB2 160 GLN HN 4.46
&rst
ixpk= 0, nxpk= 0, iat=2531,2554, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, &end
#
# 158 GLU HB3 159 ASP HN 4.66
&rst
ixpk= 0, nxpk= 0, iat=2532,2542, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16, &end
#
# 158 GLU HB3 160 GLN HN 4.46
&rst
ixpk= 0, nxpk= 0, iat=2532,2554, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, &end
#
# 158 GLU HN 158 GLU HB2 3.81
&rst
ixpk= 0, nxpk= 0, iat=2527,2531, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31, &end
#
# 158 GLU HN 158 GLU HB3 3.81
&rst
ixpk= 0, nxpk= 0, iat=2527,2532, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31, &end
#
# 158 GLU HN 158 GLU QG 3.47
&rst
ixpk= 0, nxpk= 0, iat=2527, -1, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,
igr2=2534,2535,
&end
#
# 158 GLU HN 159 ASP HA 5.03
&rst
ixpk= 0, nxpk= 0, iat=2527,2544, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53, &end
#
# 158 GLU HN 159 ASP HN 3.20
&rst
ixpk= 0, nxpk= 0, iat=2527,2542, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 158 GLU HN 159 ASP QB 5.38
&rst
ixpk= 0, nxpk= 0, iat=2527, -1, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54,
igr2=2546,2547,
&end
#
# 158 GLU HN 160 GLN HN 3.92
&rst
ixpk= 0, nxpk= 0, iat=2527,2554, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42, &end
#
# 158 GLU HN 160 GLN QG 4.91
&rst
ixpk= 0, nxpk= 0, iat=2527, -1, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
igr2=2561,2562,
&end
#
# 158 GLU QB 160 GLN HE21 3.51
&rst
ixpk= 0, nxpk= 0, iat= -1,2566, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,
igr1=2531,2532,
&end
#
# 158 GLU QB 160 GLN HE22 4.47
&rst
ixpk= 0, nxpk= 0, iat= -1,2567, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
igr1=2531,2532,
&end
#
# 158 GLU QB 160 GLN HN 3.86
&rst
ixpk= 0, nxpk= 0, iat= -1,2554, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,
igr1=2531,2532,
&end
#
# 158 GLU QB 160 GLN QG 3.51
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
igr1=2531,2532,
igr2=2561,2562,
&end
#
# 158 GLU QG 159 ASP HN 4.63
&rst
ixpk= 0, nxpk= 0, iat= -1,2542, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
igr1=2534,2535,
&end
#
# 159 ASP HA 160 GLN QB 5.34
&rst
ixpk= 0, nxpk= 0, iat=2544, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2=2558,2559,
&end
#
# 159 ASP HA 160 GLN QG 4.90
&rst
ixpk= 0, nxpk= 0, iat=2544, -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
igr2=2561,2562,
&end
#
# 159 ASP HN 159 ASP QB 3.72
&rst
ixpk= 0, nxpk= 0, iat=2542, -1, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
igr2=2546,2547,
&end
#
# 159 ASP HN 160 GLN HN 3.42
&rst
ixpk= 0, nxpk= 0, iat=2542,2554, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92, &end
#
# 159 ASP HN 160 GLN QG 4.98
&rst
ixpk= 0, nxpk= 0, iat=2542, -1, r1= 1.30, r2= 1.80, r3= 5.59, r4= 6.09,
igr2=2561,2562,
&end
#
# 159 ASP QB 160 GLN HE21 5.32
&rst
ixpk= 0, nxpk= 0, iat= -1,2566, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr1=2546,2547,
&end
#
# 159 ASP QB 160 GLN HN 3.94
&rst
ixpk= 0, nxpk= 0, iat= -1,2554, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
igr1=2546,2547,
&end
#
# 160 GLN HA 160 GLN HE21 5.37
&rst
ixpk= 0, nxpk= 0, iat=2556,2566, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87, &end
#
# 160 GLN HA 160 GLN HG2 3.87
&rst
ixpk= 0, nxpk= 0, iat=2556,2561, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37, &end
#
# 160 GLN HA 160 GLN HG3 3.87
&rst
ixpk= 0, nxpk= 0, iat=2556,2562, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37, &end
#
# 160 GLN HA 161 GLU HA 4.57
&rst
ixpk= 0, nxpk= 0, iat=2556,2573, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07, &end
#
# 160 GLN HA 161 GLU HB2 4.70
&rst
ixpk= 0, nxpk= 0, iat=2556,2575, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 160 GLN HA 161 GLU HB3 5.30
&rst
ixpk= 0, nxpk= 0, iat=2556,2576, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80, &end
#
# 160 GLN HA 161 GLU HN 2.94
&rst
ixpk= 0, nxpk= 0, iat=2556,2571, r1= 1.30, r2= 1.80, r3= 2.94, r4= 3.44, &end
#
# 160 GLN HB2 160 GLN HE21 4.48
&rst
ixpk= 0, nxpk= 0, iat=2558,2566, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98, &end
#
# 160 GLN HB3 160 GLN HE21 4.48
&rst
ixpk= 0, nxpk= 0, iat=2559,2566, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98, &end
#
# 160 GLN HG2 160 GLN HE22 4.08
&rst
ixpk= 0, nxpk= 0, iat=2561,2567, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58, &end
#
# 160 GLN HG3 160 GLN HE22 4.08
&rst
ixpk= 0, nxpk= 0, iat=2562,2567, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58, &end
#
# 160 GLN HN 160 GLN HE21 5.06
&rst
ixpk= 0, nxpk= 0, iat=2554,2566, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56, &end
#
# 160 GLN HN 160 GLN HG2 3.75
&rst
ixpk= 0, nxpk= 0, iat=2554,2561, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25, &end
#
# 160 GLN HN 160 GLN HG3 3.75
&rst
ixpk= 0, nxpk= 0, iat=2554,2562, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25, &end
#
# 160 GLN HN 160 GLN QB 3.41
&rst
ixpk= 0, nxpk= 0, iat=2554, -1, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,
igr2=2558,2559,
&end
#
# 160 GLN HN 160 GLN QG 3.08
&rst
ixpk= 0, nxpk= 0, iat=2554, -1, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96,
igr2=2561,2562,
&end
#
# 160 GLN QB 160 GLN HE21 3.88
&rst
ixpk= 0, nxpk= 0, iat= -1,2566, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,
igr1=2558,2559,
&end
#
# 160 GLN QB 161 GLU HN 3.42
&rst
ixpk= 0, nxpk= 0, iat= -1,2571, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
igr1=2558,2559,
&end
#
# 160 GLN QG 161 GLU HN 4.63
&rst
ixpk= 0, nxpk= 0, iat= -1,2571, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
igr1=2561,2562,
&end
#
# 161 GLU HA 161 GLU HG2 3.81
&rst
ixpk= 0, nxpk= 0, iat=2573,2578, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31, &end
#
# 161 GLU HA 161 GLU HG3 3.81
&rst
ixpk= 0, nxpk= 0, iat=2573,2579, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31, &end
#
# 161 GLU HA 162 ALA HN 2.88
&rst
ixpk= 0, nxpk= 0, iat=2573,2586, r1= 1.30, r2= 1.80, r3= 2.88, r4= 3.38, &end
#
# 161 GLU HA 162 ALA QB 4.26
&rst
ixpk= 0, nxpk= 0, iat=2573, -1, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
igr2=2590,2591,2592,
&end
#
# 161 GLU HB2 162 ALA HN 4.06
&rst
ixpk= 0, nxpk= 0, iat=2575,2586, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56, &end
#
# 161 GLU HB2 162 ALA QB 5.50
&rst
ixpk= 0, nxpk= 0, iat=2575, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2=2590,2591,2592,
&end
#
# 161 GLU HB3 162 ALA HN 3.73
&rst
ixpk= 0, nxpk= 0, iat=2576,2586, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23, &end
#
# 161 GLU HB3 162 ALA QB 5.07
&rst
ixpk= 0, nxpk= 0, iat=2576, -1, r1= 1.30, r2= 1.80, r3= 6.09, r4= 6.59,
igr2=2590,2591,2592,
&end
#
# 161 GLU HG2 162 ALA HN 4.14
&rst
ixpk= 0, nxpk= 0, iat=2578,2586, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64, &end
#
# 161 GLU HG2 162 ALA QB 4.82
&rst
ixpk= 0, nxpk= 0, iat=2578, -1, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,
igr2=2590,2591,2592,
&end
#
# 161 GLU HG3 162 ALA HN 4.14
&rst
ixpk= 0, nxpk= 0, iat=2579,2586, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64, &end
#
# 161 GLU HG3 162 ALA QB 4.82
&rst
ixpk= 0, nxpk= 0, iat=2579, -1, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,
igr2=2590,2591,2592,
&end
#
# 161 GLU HN 161 GLU HB2 3.33
&rst
ixpk= 0, nxpk= 0, iat=2571,2575, r1= 1.30, r2= 1.80, r3= 3.33, r4= 3.83, &end
#
# 161 GLU HN 161 GLU HB3 3.35
&rst
ixpk= 0, nxpk= 0, iat=2571,2576, r1= 1.30, r2= 1.80, r3= 3.35, r4= 3.85, &end
#
# 161 GLU HN 161 GLU HG2 4.70
&rst
ixpk= 0, nxpk= 0, iat=2571,2578, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 161 GLU HN 161 GLU HG3 4.70
&rst
ixpk= 0, nxpk= 0, iat=2571,2579, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 161 GLU HN 161 GLU QG 4.04
&rst
ixpk= 0, nxpk= 0, iat=2571, -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
igr2=2578,2579,
&end
#
# 161 GLU HN 162 ALA HN 4.78
&rst
ixpk= 0, nxpk= 0, iat=2571,2586, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, &end
#
# 161 GLU QG 162 ALA HN 3.53
&rst
ixpk= 0, nxpk= 0, iat= -1,2586, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
igr1=2578,2579,
&end
#
# 161 GLU QG 162 ALA QB 4.17
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
igr1=2578,2579,
igr2=2590,2591,2592,
&end
#
# 162 ALA HA 163 PRO HD2 3.16
&rst
ixpk= 0, nxpk= 0, iat=2588,2597, r1= 1.30, r2= 1.80, r3= 3.16, r4= 3.66, &end
#
# 162 ALA HA 163 PRO HD3 3.16
&rst
ixpk= 0, nxpk= 0, iat=2588,2598, r1= 1.30, r2= 1.80, r3= 3.16, r4= 3.66, &end
#
# 162 ALA HA 163 PRO HG2 4.83
&rst
ixpk= 0, nxpk= 0, iat=2588,2600, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33, &end
#
# 162 ALA HA 163 PRO HG3 4.83
&rst
ixpk= 0, nxpk= 0, iat=2588,2601, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33, &end
#
# 162 ALA HN 162 ALA QB 2.90
&rst
ixpk= 0, nxpk= 0, iat=2586, -1, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98,
igr2=2590,2591,2592,
&end
#
# 162 ALA HN 163 PRO QD 4.78
&rst
ixpk= 0, nxpk= 0, iat=2586, -1, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr2=2597,2598,
&end
#
# 162 ALA QB 163 PRO HA 4.64
&rst
ixpk= 0, nxpk= 0, iat= -1,2606, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
igr1=2590,2591,2592,
&end
#
# 162 ALA QB 163 PRO HB3 4.98
&rst
ixpk= 0, nxpk= 0, iat= -1,2604, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
igr1=2590,2591,2592,
&end
#
# 162 ALA QB 163 PRO HD2 3.41
&rst
ixpk= 0, nxpk= 0, iat= -1,2597, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,
igr1=2590,2591,2592,
&end
#
# 162 ALA QB 163 PRO HD3 3.41
&rst
ixpk= 0, nxpk= 0, iat= -1,2598, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,
igr1=2590,2591,2592,
&end
#
# 162 ALA QB 163 PRO HG2 4.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2600, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr1=2590,2591,2592,
&end
#
# 162 ALA QB 163 PRO HG3 4.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2601, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr1=2590,2591,2592,
&end
#
# 162 ALA QB 163 PRO QD 2.96
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,
igr1=2590,2591,2592,
igr2=2597,2598,
&end
#
# 162 ALA QB 164 ASP HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2610, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1=2590,2591,2592,
&end
#
# 162 ALA QB 167 ALA QB 5.24
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
igr1=2590,2591,2592,
igr2=2649,2650,2651,
&end
#
# 163 PRO HA 164 ASP HB2 5.50
&rst
ixpk= 0, nxpk= 0, iat=2606,2614, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 163 PRO HA 164 ASP HB3 5.50
&rst
ixpk= 0, nxpk= 0, iat=2606,2615, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 163 PRO HA 164 ASP HN 2.96
&rst
ixpk= 0, nxpk= 0, iat=2606,2610, r1= 1.30, r2= 1.80, r3= 2.96, r4= 3.46, &end
#
# 163 PRO HB2 164 ASP HB2 5.46
&rst
ixpk= 0, nxpk= 0, iat=2603,2614, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96, &end
#
# 163 PRO HB2 164 ASP HB3 5.46
&rst
ixpk= 0, nxpk= 0, iat=2603,2615, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96, &end
#
# 163 PRO HB2 164 ASP HN 3.69
&rst
ixpk= 0, nxpk= 0, iat=2603,2610, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19, &end
#
# 163 PRO HB2 164 ASP QB 4.60
&rst
ixpk= 0, nxpk= 0, iat=2603, -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
igr2=2614,2615,
&end
#
# 163 PRO HB2 165 SER HN 3.89
&rst
ixpk= 0, nxpk= 0, iat=2603,2622, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39, &end
#
# 163 PRO HB3 164 ASP HN 3.86
&rst
ixpk= 0, nxpk= 0, iat=2604,2610, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 163 PRO HB3 165 SER HN 4.61
&rst
ixpk= 0, nxpk= 0, iat=2604,2622, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 163 PRO HD2 167 ALA QB 5.01
&rst
ixpk= 0, nxpk= 0, iat=2597, -1, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,
igr2=2649,2650,2651,
&end
#
# 163 PRO HD3 167 ALA QB 5.01
&rst
ixpk= 0, nxpk= 0, iat=2598, -1, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,
igr2=2649,2650,2651,
&end
#
# 163 PRO QD 167 ALA QB 4.39
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
igr1=2597,2598,
igr2=2649,2650,2651,
&end
#
# 164 ASP HB2 165 SER HN 4.42
&rst
ixpk= 0, nxpk= 0, iat=2614,2622, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92, &end
#
# 164 ASP HB3 165 SER HN 4.42
&rst
ixpk= 0, nxpk= 0, iat=2615,2622, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92, &end
#
# 164 ASP HN 164 ASP HB2 3.80
&rst
ixpk= 0, nxpk= 0, iat=2610,2614, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30, &end
#
# 164 ASP HN 164 ASP HB3 3.80
&rst
ixpk= 0, nxpk= 0, iat=2610,2615, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30, &end
#
# 164 ASP HN 164 ASP QB 3.21
&rst
ixpk= 0, nxpk= 0, iat=2610, -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr2=2614,2615,
&end
#
# 164 ASP HN 165 SER HN 3.79
&rst
ixpk= 0, nxpk= 0, iat=2610,2622, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29, &end
#
# 164 ASP HN 165 SER QB 5.21
&rst
ixpk= 0, nxpk= 0, iat=2610, -1, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
igr2=2626,2627,
&end
#
# 165 SER HN 165 SER HB2 3.85
&rst
ixpk= 0, nxpk= 0, iat=2622,2626, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35, &end
#
# 165 SER HN 165 SER HB3 3.85
&rst
ixpk= 0, nxpk= 0, iat=2622,2627, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35, &end
#
# 165 SER HN 165 SER QB 3.35
&rst
ixpk= 0, nxpk= 0, iat=2622, -1, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,
igr2=2626,2627,
&end
#
# 166 ASP HB2 167 ALA HN 4.77
&rst
ixpk= 0, nxpk= 0, iat=2637,2645, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27, &end
#
# 166 ASP HB3 167 ALA HN 4.77
&rst
ixpk= 0, nxpk= 0, iat=2638,2645, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27, &end
#
# 166 ASP HN 166 ASP QB 3.49
&rst
ixpk= 0, nxpk= 0, iat=2633, -1, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
igr2=2637,2638,
&end
#
# 166 ASP HN 167 ALA HN 3.66
&rst
ixpk= 0, nxpk= 0, iat=2633,2645, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16, &end
#
# 166 ASP QB 167 ALA HN 3.98
&rst
ixpk= 0, nxpk= 0, iat= -1,2645, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
igr1=2637,2638,
&end
#
# 166 ASP QB 167 ALA QB 4.59
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.19, r4= 6.69,
igr1=2637,2638,
igr2=2649,2650,2651,
&end
#
# 167 ALA HA 168 GLU HN 3.17
&rst
ixpk= 0, nxpk= 0, iat=2647,2655, r1= 1.30, r2= 1.80, r3= 3.17, r4= 3.67, &end
#
# 167 ALA HN 167 ALA QB 3.20
&rst
ixpk= 0, nxpk= 0, iat=2645, -1, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
igr2=2649,2650,2651,
&end
#
# 167 ALA QB 168 GLU HN 4.09
&rst
ixpk= 0, nxpk= 0, iat= -1,2655, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
igr1=2649,2650,2651,
&end
#
# 168 GLU HA 168 GLU QG 3.37
&rst
ixpk= 0, nxpk= 0, iat=2657, -1, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,
igr2=2662,2663,
&end
#
# 168 GLU HN 168 GLU QB 3.49
&rst
ixpk= 0, nxpk= 0, iat=2655, -1, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
igr2=2659,2660,
&end
#
# 168 GLU HN 168 GLU QG 4.40
&rst
ixpk= 0, nxpk= 0, iat=2655, -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
igr2=2662,2663,
&end
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