NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
588786 |
2rv4   |
11484 | cing | 1-original | 3 | AMBER | distance | NOE | simple |
#
# 8 ILE HA 8 ILE QD1 4.35
&rst
ixpk= 0, nxpk= 0, iat= 71, -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
rk2 = 32.0, rk3 = 32.0, ir6=1, ialtd=0,
igr2= 82, 83, 84,
&end
#
# 8 ILE HA 8 ILE QG1 3.74
&rst
ixpk= 0, nxpk= 0, iat= 71, -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
igr2= 79, 80,
&end
#
# 8 ILE HA 8 ILE QG2 3.51
&rst
ixpk= 0, nxpk= 0, iat= 71, -1, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
igr2= 75, 76, 77,
&end
#
# 8 ILE HB 8 ILE QD1 3.55
&rst
ixpk= 0, nxpk= 0, iat= 73, -1, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,
igr2= 82, 83, 84,
&end
#
# 8 ILE HN 8 ILE HB 4.19
&rst
ixpk= 0, nxpk= 0, iat= 69, 73, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69, &end
#
# 8 ILE HN 8 ILE QG1 4.51
&rst
ixpk= 0, nxpk= 0, iat= 69, -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
igr2= 79, 80,
&end
#
# 8 ILE QG1 9 LYS HN 5.11
&rst
ixpk= 0, nxpk= 0, iat= -1, 88, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
igr1= 79, 80,
&end
#
# 8 ILE QG2 8 ILE HG12 3.73
&rst
ixpk= 0, nxpk= 0, iat= -1, 79, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
igr1= 75, 76, 77,
&end
#
# 8 ILE QG2 8 ILE HG13 3.73
&rst
ixpk= 0, nxpk= 0, iat= -1, 80, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
igr1= 75, 76, 77,
&end
#
# 9 LYS HA 9 LYS QD 4.62
&rst
ixpk= 0, nxpk= 0, iat= 90, -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
igr2= 98, 99,
&end
#
# 9 LYS HN 9 LYS QG 5.30
&rst
ixpk= 0, nxpk= 0, iat= 88, -1, r1= 1.30, r2= 1.80, r3= 5.95, r4= 6.45,
igr2= 95, 96,
&end
#
# 10 GLN HA 11 HIS HN 3.38
&rst
ixpk= 0, nxpk= 0, iat= 112, 127, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88, &end
#
# 10 GLN HA 25 LEU QQD 4.74
&rst
ixpk= 0, nxpk= 0, iat= 112, -1, r1= 1.30, r2= 1.80, r3= 6.39, r4= 6.89,
igr2= 379, 380, 381, 383, 384, 385,
&end
#
# 10 GLN HG2 22 VAL HA 4.71
&rst
ixpk= 0, nxpk= 0, iat= 117, 320, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21, &end
#
# 10 GLN HG3 22 VAL HA 4.71
&rst
ixpk= 0, nxpk= 0, iat= 118, 320, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21, &end
#
# 10 GLN QB 11 HIS HN 4.38
&rst
ixpk= 0, nxpk= 0, iat= -1, 127, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
igr1= 114, 115,
&end
#
# 10 GLN QB 19 TYR QB 4.46
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
igr1= 114, 115,
igr2= 278, 279,
&end
#
# 10 GLN QB 25 LEU HB2 4.76
&rst
ixpk= 0, nxpk= 0, iat= -1, 374, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr1= 114, 115,
&end
#
# 10 GLN QB 25 LEU QQD 3.49
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
igr1= 114, 115,
igr2= 379, 380, 381, 383, 384, 385,
&end
#
# 10 GLN QG 10 GLN QE2 3.22
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,
igr1= 117, 118,
igr2= 122, 123,
&end
#
# 10 GLN QG 22 VAL QG2 4.60
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
igr1= 117, 118,
igr2= 328, 329, 330,
&end
#
# 10 GLN QG 25 LEU QQD 4.09
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.19, r4= 6.69,
igr1= 117, 118,
igr2= 379, 380, 381, 383, 384, 385,
&end
#
# 11 HIS HA 12 CYM HB2 4.79
&rst
ixpk= 0, nxpk= 0, iat= 129, 149, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29, &end
#
# 11 HIS HA 12 CYM HB3 5.21
&rst
ixpk= 0, nxpk= 0, iat= 129, 148, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71, &end
#
# 11 HIS HA 12 CYM HN 3.17
&rst
ixpk= 0, nxpk= 0, iat= 129, 144, r1= 1.30, r2= 1.80, r3= 3.17, r4= 3.67, &end
#
# 11 HIS HA 18 LYS HA 3.81
&rst
ixpk= 0, nxpk= 0, iat= 129, 254, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31, &end
#
# 11 HIS HA 18 LYS QB 5.14
&rst
ixpk= 0, nxpk= 0, iat= 129, -1, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,
igr2= 256, 257,
&end
#
# 11 HIS HA 19 TYR HN 4.17
&rst
ixpk= 0, nxpk= 0, iat= 129, 274, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67, &end
#
# 11 HIS HN 11 HIS QB 3.77
&rst
ixpk= 0, nxpk= 0, iat= 127, -1, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,
igr2= 131, 132,
&end
#
# 11 HIS QB 12 CYM HN 3.97
&rst
ixpk= 0, nxpk= 0, iat= -1, 144, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
igr1= 131, 132,
&end
#
# 11 HIS QB 16 LYS HA 4.07
&rst
ixpk= 0, nxpk= 0, iat= -1, 210, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,
igr1= 131, 132,
&end
#
# 11 HIS QB 18 LYS HA 4.37
&rst
ixpk= 0, nxpk= 0, iat= -1, 254, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
igr1= 131, 132,
&end
#
# 11 HIS QB 18 LYS QG 4.38
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
igr1= 131, 132,
igr2= 259, 260,
&end
#
# 12 CYM HA 13 ARG QB 4.51
&rst
ixpk= 0, nxpk= 0, iat= 146, -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
igr2= 158, 159,
&end
#
# 12 CYM HA 25 LEU QD1 4.37
&rst
ixpk= 0, nxpk= 0, iat= 146, -1, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
igr2= 379, 380, 381,
&end
#
# 12 CYM HA 25 LEU QD2 4.37
&rst
ixpk= 0, nxpk= 0, iat= 146, -1, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
igr2= 383, 384, 385,
&end
#
# 12 CYM HA 25 LEU QQD 3.29
&rst
ixpk= 0, nxpk= 0, iat= 146, -1, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
igr2= 379, 380, 381, 383, 384, 385,
&end
#
# 12 CYM HA 29 ILE QD1 4.26
&rst
ixpk= 0, nxpk= 0, iat= 146, -1, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
igr2= 460, 461, 462,
&end
#
# 12 CYM HB2 15 CYM HN 4.61
&rst
ixpk= 0, nxpk= 0, iat= 149, 198, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 12 CYM HB2 16 LYS HN 4.67
&rst
ixpk= 0, nxpk= 0, iat= 149, 208, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, &end
#
# 12 CYM HB2 17 LYS HN 4.25
&rst
ixpk= 0, nxpk= 0, iat= 149, 230, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75, &end
#
# 12 CYM HB2 19 TYR QD 4.87
&rst
ixpk= 0, nxpk= 0, iat= 149, -1, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,
igr2= 282, 291,
&end
#
# 12 CYM HB2 19 TYR QE 4.25
&rst
ixpk= 0, nxpk= 0, iat= 149, -1, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
igr2= 284, 289,
&end
#
# 12 CYM HB2 25 LEU QQD 3.64
&rst
ixpk= 0, nxpk= 0, iat= 149, -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
igr2= 379, 380, 381, 383, 384, 385,
&end
#
# 12 CYM HB2 28 HIS HD2 3.87
&rst
ixpk= 0, nxpk= 0, iat= 149, 443, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37, &end
#
# 12 CYM HB3 15 CYM HN 4.01
&rst
ixpk= 0, nxpk= 0, iat= 148, 198, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51, &end
#
# 12 CYM HB3 16 LYS HN 4.23
&rst
ixpk= 0, nxpk= 0, iat= 148, 208, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73, &end
#
# 12 CYM HB3 17 LYS HB3 5.09
&rst
ixpk= 0, nxpk= 0, iat= 148, 235, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59, &end
#
# 12 CYM HB3 17 LYS HN 3.88
&rst
ixpk= 0, nxpk= 0, iat= 148, 230, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38, &end
#
# 12 CYM HB3 25 LEU QQD 4.23
&rst
ixpk= 0, nxpk= 0, iat= 148, -1, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr2= 379, 380, 381, 383, 384, 385,
&end
#
# 12 CYM HB3 28 HIS HD2 4.85
&rst
ixpk= 0, nxpk= 0, iat= 148, 443, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35, &end
#
# 12 CYM HN 12 CYM HB2 3.30
&rst
ixpk= 0, nxpk= 0, iat= 144, 149, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80, &end
#
# 12 CYM HN 12 CYM HB3 3.44
&rst
ixpk= 0, nxpk= 0, iat= 144, 148, r1= 1.30, r2= 1.80, r3= 3.44, r4= 3.94, &end
#
# 12 CYM HN 18 LYS HA 4.28
&rst
ixpk= 0, nxpk= 0, iat= 144, 254, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78, &end
#
# 12 CYM HN 25 LEU QQD 4.20
&rst
ixpk= 0, nxpk= 0, iat= 144, -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr2= 379, 380, 381, 383, 384, 385,
&end
#
# 13 ARG HB2 13 ARG HD2 4.01
&rst
ixpk= 0, nxpk= 0, iat= 158, 164, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51, &end
#
# 13 ARG HB2 13 ARG HD3 4.01
&rst
ixpk= 0, nxpk= 0, iat= 158, 165, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51, &end
#
# 13 ARG HB3 13 ARG HD2 4.01
&rst
ixpk= 0, nxpk= 0, iat= 159, 164, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51, &end
#
# 13 ARG HB3 13 ARG HD3 4.01
&rst
ixpk= 0, nxpk= 0, iat= 159, 165, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51, &end
#
# 14 PHE HA 14 PHE QD 4.07
&rst
ixpk= 0, nxpk= 0, iat= 180, -1, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,
igr2= 186, 194,
&end
#
# 14 PHE HB2 15 CYM HN 4.12
&rst
ixpk= 0, nxpk= 0, iat= 182, 198, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62, &end
#
# 14 PHE HB2 33 HIS HE1 4.75
&rst
ixpk= 0, nxpk= 0, iat= 182, 529, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, &end
#
# 14 PHE HB3 15 CYM HN 4.12
&rst
ixpk= 0, nxpk= 0, iat= 183, 198, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62, &end
#
# 14 PHE HB3 33 HIS HE1 4.75
&rst
ixpk= 0, nxpk= 0, iat= 183, 529, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, &end
#
# 14 PHE HN 14 PHE HB2 4.05
&rst
ixpk= 0, nxpk= 0, iat= 178, 182, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55, &end
#
# 14 PHE HN 14 PHE HB3 4.05
&rst
ixpk= 0, nxpk= 0, iat= 178, 183, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55, &end
#
# 14 PHE HN 14 PHE QB 3.39
&rst
ixpk= 0, nxpk= 0, iat= 178, -1, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,
igr2= 182, 183,
&end
#
# 14 PHE HN 14 PHE QD 4.03
&rst
ixpk= 0, nxpk= 0, iat= 178, -1, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
igr2= 186, 194,
&end
#
# 14 PHE HN 15 CYM HN 3.47
&rst
ixpk= 0, nxpk= 0, iat= 178, 198, r1= 1.30, r2= 1.80, r3= 3.47, r4= 3.97, &end
#
# 14 PHE HN 16 LYS HN 4.49
&rst
ixpk= 0, nxpk= 0, iat= 178, 208, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99, &end
#
# 14 PHE QB 15 CYM HN 3.46
&rst
ixpk= 0, nxpk= 0, iat= -1, 198, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,
igr1= 182, 183,
&end
#
# 14 PHE QB 33 HIS HE1 4.17
&rst
ixpk= 0, nxpk= 0, iat= -1, 529, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
igr1= 182, 183,
&end
#
# 14 PHE QD 14 PHE HZ 3.91
&rst
ixpk= 0, nxpk= 0, iat= -1, 190, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,
igr1= 186, 194,
&end
#
# 14 PHE QD 29 ILE QD1 4.39
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
igr1= 186, 194,
igr2= 460, 461, 462,
&end
#
# 14 PHE QD 29 ILE QG1 4.36
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
igr1= 186, 194,
igr2= 457, 458,
&end
#
# 14 PHE QD 29 ILE QG2 4.16
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr1= 186, 194,
igr2= 453, 454, 455,
&end
#
# 14 PHE QD 33 HIS HD2 4.14
&rst
ixpk= 0, nxpk= 0, iat= -1, 532, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
igr1= 186, 194,
&end
#
# 14 PHE QE 29 ILE QD1 4.13
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
igr1= 188, 192,
igr2= 460, 461, 462,
&end
#
# 14 PHE QE 29 ILE QG2 3.77
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
igr1= 188, 192,
igr2= 453, 454, 455,
&end
#
# 15 CYM HB2 16 LYS HN 4.65
&rst
ixpk= 0, nxpk= 0, iat= 203, 208, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15, &end
#
# 15 CYM HB2 33 HIS HE1 4.13
&rst
ixpk= 0, nxpk= 0, iat= 203, 529, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63, &end
#
# 15 CYM HB3 16 LYS HN 4.65
&rst
ixpk= 0, nxpk= 0, iat= 202, 208, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15, &end
#
# 15 CYM HB3 33 HIS HE1 4.13
&rst
ixpk= 0, nxpk= 0, iat= 202, 529, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63, &end
#
# 15 CYM HN 16 LYS HA 4.68
&rst
ixpk= 0, nxpk= 0, iat= 198, 210, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18, &end
#
# 15 CYM HN 16 LYS HN 3.46
&rst
ixpk= 0, nxpk= 0, iat= 198, 208, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96, &end
#
# 15 CYM HN 33 HIS HE1 4.59
&rst
ixpk= 0, nxpk= 0, iat= 198, 529, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 15 CYM QB 16 LYS HN 4.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 208, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,
igr1= 203, 202,
&end
#
# 15 CYM QB 33 HIS HE1 3.29
&rst
ixpk= 0, nxpk= 0, iat= -1, 529, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19,
igr1= 203, 202,
&end
#
# 16 LYS HA 16 LYS QE 4.79
&rst
ixpk= 0, nxpk= 0, iat= 210, -1, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
igr2= 221, 222,
&end
#
# 16 LYS HA 16 LYS QG 3.74
&rst
ixpk= 0, nxpk= 0, iat= 210, -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
igr2= 215, 216,
&end
#
# 16 LYS HN 16 LYS QD 4.52
&rst
ixpk= 0, nxpk= 0, iat= 208, -1, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
igr2= 218, 219,
&end
#
# 16 LYS HN 16 LYS QG 4.59
&rst
ixpk= 0, nxpk= 0, iat= 208, -1, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
igr2= 215, 216,
&end
#
# 16 LYS HN 17 LYS HB2 5.43
&rst
ixpk= 0, nxpk= 0, iat= 208, 234, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93, &end
#
# 16 LYS HN 17 LYS HN 4.28
&rst
ixpk= 0, nxpk= 0, iat= 208, 230, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78, &end
#
# 17 LYS HA 17 LYS HG2 3.87
&rst
ixpk= 0, nxpk= 0, iat= 232, 237, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37, &end
#
# 17 LYS HA 17 LYS HG3 3.87
&rst
ixpk= 0, nxpk= 0, iat= 232, 238, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37, &end
#
# 17 LYS HA 17 LYS QD 4.55
&rst
ixpk= 0, nxpk= 0, iat= 232, -1, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,
igr2= 240, 241,
&end
#
# 17 LYS HA 17 LYS QG 3.36
&rst
ixpk= 0, nxpk= 0, iat= 232, -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
igr2= 237, 238,
&end
#
# 17 LYS HA 18 LYS HN 3.08
&rst
ixpk= 0, nxpk= 0, iat= 232, 252, r1= 1.30, r2= 1.80, r3= 3.08, r4= 3.58, &end
#
# 17 LYS HA 18 LYS QB 4.54
&rst
ixpk= 0, nxpk= 0, iat= 232, -1, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
igr2= 256, 257,
&end
#
# 17 LYS HB2 17 LYS QD 3.62
&rst
ixpk= 0, nxpk= 0, iat= 234, -1, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,
igr2= 240, 241,
&end
#
# 17 LYS HB2 19 TYR QE 3.99
&rst
ixpk= 0, nxpk= 0, iat= 234, -1, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
igr2= 284, 289,
&end
#
# 17 LYS HB3 17 LYS HD2 4.22
&rst
ixpk= 0, nxpk= 0, iat= 235, 240, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 17 LYS HB3 17 LYS HD3 4.22
&rst
ixpk= 0, nxpk= 0, iat= 235, 241, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 17 LYS HB3 17 LYS QD 3.69
&rst
ixpk= 0, nxpk= 0, iat= 235, -1, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,
igr2= 240, 241,
&end
#
# 17 LYS HB3 18 LYS QB 4.57
&rst
ixpk= 0, nxpk= 0, iat= 235, -1, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
igr2= 256, 257,
&end
#
# 17 LYS HB3 19 TYR QE 4.02
&rst
ixpk= 0, nxpk= 0, iat= 235, -1, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,
igr2= 284, 289,
&end
#
# 17 LYS HD2 28 HIS HE1 4.46
&rst
ixpk= 0, nxpk= 0, iat= 240, 440, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, &end
#
# 17 LYS HD3 28 HIS HE1 4.46
&rst
ixpk= 0, nxpk= 0, iat= 241, 440, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, &end
#
# 17 LYS HN 17 LYS HB2 3.98
&rst
ixpk= 0, nxpk= 0, iat= 230, 234, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48, &end
#
# 17 LYS HN 17 LYS HB3 3.60
&rst
ixpk= 0, nxpk= 0, iat= 230, 235, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10, &end
#
# 17 LYS HN 17 LYS HG2 4.42
&rst
ixpk= 0, nxpk= 0, iat= 230, 237, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92, &end
#
# 17 LYS HN 17 LYS HG3 4.42
&rst
ixpk= 0, nxpk= 0, iat= 230, 238, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92, &end
#
# 17 LYS HN 17 LYS QD 4.96
&rst
ixpk= 0, nxpk= 0, iat= 230, -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
igr2= 240, 241,
&end
#
# 17 LYS QD 19 TYR QE 4.04
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
igr1= 240, 241,
igr2= 284, 289,
&end
#
# 17 LYS QD 28 HIS HE1 3.86
&rst
ixpk= 0, nxpk= 0, iat= -1, 440, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,
igr1= 240, 241,
&end
#
# 17 LYS QG 18 LYS HN 5.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 252, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
igr1= 237, 238,
&end
#
# 17 LYS QG 19 TYR QE 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1= 237, 238,
igr2= 284, 289,
&end
#
# 18 LYS HA 19 TYR HN 3.13
&rst
ixpk= 0, nxpk= 0, iat= 254, 274, r1= 1.30, r2= 1.80, r3= 3.13, r4= 3.63, &end
#
# 18 LYS HA 19 TYR QD 4.48
&rst
ixpk= 0, nxpk= 0, iat= 254, -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
igr2= 282, 291,
&end
#
# 18 LYS HG2 18 LYS QE 4.07
&rst
ixpk= 0, nxpk= 0, iat= 259, -1, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,
igr2= 265, 266,
&end
#
# 18 LYS HG3 18 LYS QE 4.07
&rst
ixpk= 0, nxpk= 0, iat= 260, -1, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,
igr2= 265, 266,
&end
#
# 18 LYS HN 18 LYS HG2 4.78
&rst
ixpk= 0, nxpk= 0, iat= 252, 259, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, &end
#
# 18 LYS HN 18 LYS HG3 4.78
&rst
ixpk= 0, nxpk= 0, iat= 252, 260, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, &end
#
# 18 LYS HN 18 LYS QB 3.41
&rst
ixpk= 0, nxpk= 0, iat= 252, -1, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,
igr2= 256, 257,
&end
#
# 18 LYS HN 18 LYS QG 4.15
&rst
ixpk= 0, nxpk= 0, iat= 252, -1, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
igr2= 259, 260,
&end
#
# 18 LYS QB 18 LYS QE 4.45
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr1= 256, 257,
igr2= 265, 266,
&end
#
# 18 LYS QB 19 TYR HA 4.87
&rst
ixpk= 0, nxpk= 0, iat= -1, 276, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,
igr1= 256, 257,
&end
#
# 18 LYS QB 19 TYR HN 3.95
&rst
ixpk= 0, nxpk= 0, iat= -1, 274, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
igr1= 256, 257,
&end
#
# 18 LYS QG 19 TYR HN 4.36
&rst
ixpk= 0, nxpk= 0, iat= -1, 274, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
igr1= 259, 260,
&end
#
# 19 TYR HA 19 TYR QD 3.89
&rst
ixpk= 0, nxpk= 0, iat= 276, -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
igr2= 282, 291,
&end
#
# 19 TYR HB2 25 LEU HB2 4.40
&rst
ixpk= 0, nxpk= 0, iat= 278, 374, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 19 TYR HB2 25 LEU HB3 4.88
&rst
ixpk= 0, nxpk= 0, iat= 278, 375, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38, &end
#
# 19 TYR HB3 25 LEU HB2 4.40
&rst
ixpk= 0, nxpk= 0, iat= 279, 374, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 19 TYR HB3 25 LEU HB3 4.88
&rst
ixpk= 0, nxpk= 0, iat= 279, 375, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38, &end
#
# 19 TYR HN 19 TYR HB2 4.19
&rst
ixpk= 0, nxpk= 0, iat= 274, 278, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69, &end
#
# 19 TYR HN 19 TYR HB3 4.19
&rst
ixpk= 0, nxpk= 0, iat= 274, 279, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69, &end
#
# 19 TYR HN 19 TYR QB 3.49
&rst
ixpk= 0, nxpk= 0, iat= 274, -1, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
igr2= 278, 279,
&end
#
# 19 TYR HN 19 TYR QD 3.97
&rst
ixpk= 0, nxpk= 0, iat= 274, -1, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
igr2= 282, 291,
&end
#
# 19 TYR QB 25 LEU HB2 3.78
&rst
ixpk= 0, nxpk= 0, iat= -1, 374, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
igr1= 278, 279,
&end
#
# 19 TYR QB 25 LEU HB3 4.25
&rst
ixpk= 0, nxpk= 0, iat= -1, 375, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
igr1= 278, 279,
&end
#
# 19 TYR QB 25 LEU QQD 3.95
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
igr1= 278, 279,
igr2= 379, 380, 381, 383, 384, 385,
&end
#
# 19 TYR QD 24 ASN HB2 4.22
&rst
ixpk= 0, nxpk= 0, iat= -1, 360, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr1= 282, 291,
&end
#
# 19 TYR QD 24 ASN HB3 4.22
&rst
ixpk= 0, nxpk= 0, iat= -1, 361, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr1= 282, 291,
&end
#
# 19 TYR QD 24 ASN QB 3.61
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,
igr1= 282, 291,
igr2= 360, 361,
&end
#
# 19 TYR QD 25 LEU HA 4.10
&rst
ixpk= 0, nxpk= 0, iat= -1, 372, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
igr1= 282, 291,
&end
#
# 19 TYR QD 25 LEU HB2 4.12
&rst
ixpk= 0, nxpk= 0, iat= -1, 374, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
igr1= 282, 291,
&end
#
# 19 TYR QD 25 LEU QQD 3.53
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr1= 282, 291,
igr2= 379, 380, 381, 383, 384, 385,
&end
#
# 19 TYR QE 24 ASN QB 4.16
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr1= 284, 289,
igr2= 360, 361,
&end
#
# 19 TYR QE 25 LEU HA 4.36
&rst
ixpk= 0, nxpk= 0, iat= -1, 372, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
igr1= 284, 289,
&end
#
# 19 TYR QE 25 LEU HB2 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 374, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 284, 289,
&end
#
# 19 TYR QE 25 LEU QQD 4.04
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
igr1= 284, 289,
igr2= 379, 380, 381, 383, 384, 385,
&end
#
# 19 TYR QE 28 HIS HB3 4.66
&rst
ixpk= 0, nxpk= 0, iat= -1, 435, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73,
igr1= 284, 289,
&end
#
# 19 TYR QE 28 HIS HD2 4.33
&rst
ixpk= 0, nxpk= 0, iat= -1, 443, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
igr1= 284, 289,
&end
#
# 21 ASP HA 22 VAL QG1 4.80
&rst
ixpk= 0, nxpk= 0, iat= 308, -1, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
igr2= 324, 325, 326,
&end
#
# 21 ASP QB 24 ASN HN 4.19
&rst
ixpk= 0, nxpk= 0, iat= -1, 356, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
igr1= 310, 311,
&end
#
# 22 VAL HA 22 VAL QG1 3.86
&rst
ixpk= 0, nxpk= 0, iat= 320, -1, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
igr2= 324, 325, 326,
&end
#
# 22 VAL HA 22 VAL QG2 3.53
&rst
ixpk= 0, nxpk= 0, iat= 320, -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
igr2= 328, 329, 330,
&end
#
# 22 VAL HA 25 LEU HB2 3.86
&rst
ixpk= 0, nxpk= 0, iat= 320, 374, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 22 VAL HA 25 LEU HB3 3.52
&rst
ixpk= 0, nxpk= 0, iat= 320, 375, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02, &end
#
# 22 VAL HA 25 LEU HG 5.28
&rst
ixpk= 0, nxpk= 0, iat= 320, 377, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 22 VAL HA 25 LEU HN 3.94
&rst
ixpk= 0, nxpk= 0, iat= 320, 370, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44, &end
#
# 22 VAL HA 25 LEU QQD 4.02
&rst
ixpk= 0, nxpk= 0, iat= 320, -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr2= 379, 380, 381, 383, 384, 385,
&end
#
# 22 VAL HA 26 ILE HN 4.33
&rst
ixpk= 0, nxpk= 0, iat= 320, 389, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83, &end
#
# 22 VAL HB 23 LYS HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= 322, 336, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 22 VAL HB 23 LYS HN 4.24
&rst
ixpk= 0, nxpk= 0, iat= 322, 334, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74, &end
#
# 22 VAL HB 26 ILE QD1 5.43
&rst
ixpk= 0, nxpk= 0, iat= 322, -1, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
igr2= 402, 403, 404,
&end
#
# 22 VAL HN 22 VAL QG1 4.74
&rst
ixpk= 0, nxpk= 0, iat= 318, -1, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
igr2= 324, 325, 326,
&end
#
# 22 VAL HN 23 LYS HN 4.41
&rst
ixpk= 0, nxpk= 0, iat= 318, 334, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, &end
#
# 22 VAL QG1 23 LYS HA 4.22
&rst
ixpk= 0, nxpk= 0, iat= -1, 336, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
igr1= 324, 325, 326,
&end
#
# 22 VAL QG1 23 LYS HG2 4.65
&rst
ixpk= 0, nxpk= 0, iat= -1, 341, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr1= 324, 325, 326,
&end
#
# 22 VAL QG1 23 LYS HG3 4.65
&rst
ixpk= 0, nxpk= 0, iat= -1, 342, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr1= 324, 325, 326,
&end
#
# 22 VAL QG1 23 LYS HN 3.94
&rst
ixpk= 0, nxpk= 0, iat= -1, 334, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
igr1= 324, 325, 326,
&end
#
# 22 VAL QG1 23 LYS QD 4.05
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
igr1= 324, 325, 326,
igr2= 344, 345,
&end
#
# 22 VAL QG1 26 ILE HB 5.18
&rst
ixpk= 0, nxpk= 0, iat= -1, 393, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
igr1= 324, 325, 326,
&end
#
# 22 VAL QG1 26 ILE QD1 3.61
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,
igr1= 324, 325, 326,
igr2= 402, 403, 404,
&end
#
# 22 VAL QG1 26 ILE QG1 4.47
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
igr1= 324, 325, 326,
igr2= 399, 400,
&end
#
# 22 VAL QG2 23 LYS HA 4.63
&rst
ixpk= 0, nxpk= 0, iat= -1, 336, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
igr1= 328, 329, 330,
&end
#
# 22 VAL QG2 23 LYS HN 4.92
&rst
ixpk= 0, nxpk= 0, iat= -1, 334, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41,
igr1= 328, 329, 330,
&end
#
# 22 VAL QG2 25 LEU HB3 4.84
&rst
ixpk= 0, nxpk= 0, iat= -1, 375, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
igr1= 328, 329, 330,
&end
#
# 22 VAL QG2 25 LEU QQD 3.93
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
igr1= 328, 329, 330,
igr2= 379, 380, 381, 383, 384, 385,
&end
#
# 22 VAL QG2 26 ILE HA 5.28
&rst
ixpk= 0, nxpk= 0, iat= -1, 391, r1= 1.30, r2= 1.80, r3= 6.34, r4= 6.84,
igr1= 328, 329, 330,
&end
#
# 22 VAL QG2 26 ILE HB 4.79
&rst
ixpk= 0, nxpk= 0, iat= -1, 393, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
igr1= 328, 329, 330,
&end
#
# 22 VAL QG2 26 ILE HG12 4.67
&rst
ixpk= 0, nxpk= 0, iat= -1, 399, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr1= 328, 329, 330,
&end
#
# 22 VAL QG2 26 ILE HG13 4.67
&rst
ixpk= 0, nxpk= 0, iat= -1, 400, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr1= 328, 329, 330,
&end
#
# 22 VAL QG2 26 ILE HN 5.12
&rst
ixpk= 0, nxpk= 0, iat= -1, 389, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
igr1= 328, 329, 330,
&end
#
# 22 VAL QG2 26 ILE QD1 3.72
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr1= 328, 329, 330,
igr2= 402, 403, 404,
&end
#
# 22 VAL QG2 26 ILE QG1 3.85
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
igr1= 328, 329, 330,
igr2= 399, 400,
&end
#
# 23 LYS HA 23 LYS HG2 4.20
&rst
ixpk= 0, nxpk= 0, iat= 336, 341, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 23 LYS HA 23 LYS HG3 4.20
&rst
ixpk= 0, nxpk= 0, iat= 336, 342, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 23 LYS HA 23 LYS QD 4.25
&rst
ixpk= 0, nxpk= 0, iat= 336, -1, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
igr2= 344, 345,
&end
#
# 23 LYS HA 23 LYS QG 3.67
&rst
ixpk= 0, nxpk= 0, iat= 336, -1, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
igr2= 341, 342,
&end
#
# 23 LYS HA 25 LEU HB3 5.50
&rst
ixpk= 0, nxpk= 0, iat= 336, 375, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 23 LYS HA 26 ILE HB 3.71
&rst
ixpk= 0, nxpk= 0, iat= 336, 393, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21, &end
#
# 23 LYS HA 26 ILE HN 4.07
&rst
ixpk= 0, nxpk= 0, iat= 336, 389, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57, &end
#
# 23 LYS HA 26 ILE QD1 3.70
&rst
ixpk= 0, nxpk= 0, iat= 336, -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
igr2= 402, 403, 404,
&end
#
# 23 LYS HA 26 ILE QG1 4.60
&rst
ixpk= 0, nxpk= 0, iat= 336, -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
igr2= 399, 400,
&end
#
# 23 LYS HA 26 ILE QG2 4.82
&rst
ixpk= 0, nxpk= 0, iat= 336, -1, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,
igr2= 395, 396, 397,
&end
#
# 23 LYS HB2 24 ASN HN 4.21
&rst
ixpk= 0, nxpk= 0, iat= 338, 356, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71, &end
#
# 23 LYS HB3 24 ASN HN 4.21
&rst
ixpk= 0, nxpk= 0, iat= 339, 356, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71, &end
#
# 23 LYS HG2 23 LYS QE 4.15
&rst
ixpk= 0, nxpk= 0, iat= 341, -1, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
igr2= 347, 348,
&end
#
# 23 LYS HG3 23 LYS QE 4.15
&rst
ixpk= 0, nxpk= 0, iat= 342, -1, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
igr2= 347, 348,
&end
#
# 23 LYS HN 23 LYS HB2 3.70
&rst
ixpk= 0, nxpk= 0, iat= 334, 338, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20, &end
#
# 23 LYS HN 23 LYS HB3 3.70
&rst
ixpk= 0, nxpk= 0, iat= 334, 339, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20, &end
#
# 23 LYS HN 23 LYS HG2 4.48
&rst
ixpk= 0, nxpk= 0, iat= 334, 341, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98, &end
#
# 23 LYS HN 23 LYS HG3 4.48
&rst
ixpk= 0, nxpk= 0, iat= 334, 342, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98, &end
#
# 23 LYS HN 23 LYS QB 3.16
&rst
ixpk= 0, nxpk= 0, iat= 334, -1, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05,
igr2= 338, 339,
&end
#
# 23 LYS HN 23 LYS QD 3.87
&rst
ixpk= 0, nxpk= 0, iat= 334, -1, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,
igr2= 344, 345,
&end
#
# 23 LYS HN 23 LYS QG 3.74
&rst
ixpk= 0, nxpk= 0, iat= 334, -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
igr2= 341, 342,
&end
#
# 23 LYS HN 24 ASN HN 3.48
&rst
ixpk= 0, nxpk= 0, iat= 334, 356, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98, &end
#
# 23 LYS QB 23 LYS QE 4.59
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr1= 338, 339,
igr2= 347, 348,
&end
#
# 23 LYS QB 24 ASN HN 3.62
&rst
ixpk= 0, nxpk= 0, iat= -1, 356, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,
igr1= 338, 339,
&end
#
# 24 ASN HA 27 LYS HN 4.02
&rst
ixpk= 0, nxpk= 0, iat= 358, 408, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52, &end
#
# 24 ASN HA 27 LYS QB 3.75
&rst
ixpk= 0, nxpk= 0, iat= 358, -1, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,
igr2= 412, 413,
&end
#
# 24 ASN HB2 25 LEU HN 4.61
&rst
ixpk= 0, nxpk= 0, iat= 360, 370, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 24 ASN HB3 25 LEU HN 4.61
&rst
ixpk= 0, nxpk= 0, iat= 361, 370, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 24 ASN HN 24 ASN HB2 3.87
&rst
ixpk= 0, nxpk= 0, iat= 356, 360, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37, &end
#
# 24 ASN HN 24 ASN HB3 3.87
&rst
ixpk= 0, nxpk= 0, iat= 356, 361, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37, &end
#
# 24 ASN HN 24 ASN QB 3.21
&rst
ixpk= 0, nxpk= 0, iat= 356, -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr2= 360, 361,
&end
#
# 24 ASN HN 25 LEU HN 3.49
&rst
ixpk= 0, nxpk= 0, iat= 356, 370, r1= 1.30, r2= 1.80, r3= 3.49, r4= 3.99, &end
#
# 24 ASN QB 25 LEU HN 3.75
&rst
ixpk= 0, nxpk= 0, iat= -1, 370, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,
igr1= 360, 361,
&end
#
# 25 LEU HA 25 LEU QD1 4.40
&rst
ixpk= 0, nxpk= 0, iat= 372, -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
igr2= 379, 380, 381,
&end
#
# 25 LEU HA 25 LEU QD2 4.40
&rst
ixpk= 0, nxpk= 0, iat= 372, -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
igr2= 383, 384, 385,
&end
#
# 25 LEU HA 25 LEU QQD 3.13
&rst
ixpk= 0, nxpk= 0, iat= 372, -1, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
igr2= 379, 380, 381, 383, 384, 385,
&end
#
# 25 LEU HA 28 HIS HB2 4.20
&rst
ixpk= 0, nxpk= 0, iat= 372, 434, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 25 LEU HA 28 HIS HN 4.54
&rst
ixpk= 0, nxpk= 0, iat= 372, 430, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 25 LEU HB2 26 ILE HN 4.11
&rst
ixpk= 0, nxpk= 0, iat= 374, 389, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 25 LEU HB3 25 LEU QD1 3.87
&rst
ixpk= 0, nxpk= 0, iat= 375, -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
igr2= 379, 380, 381,
&end
#
# 25 LEU HB3 25 LEU QD2 3.87
&rst
ixpk= 0, nxpk= 0, iat= 375, -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
igr2= 383, 384, 385,
&end
#
# 25 LEU HB3 26 ILE HN 3.55
&rst
ixpk= 0, nxpk= 0, iat= 375, 389, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05, &end
#
# 25 LEU HB3 26 ILE QD1 5.50
&rst
ixpk= 0, nxpk= 0, iat= 375, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2= 402, 403, 404,
&end
#
# 25 LEU HG 26 ILE HA 4.93
&rst
ixpk= 0, nxpk= 0, iat= 377, 391, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43, &end
#
# 25 LEU HG 26 ILE HN 4.45
&rst
ixpk= 0, nxpk= 0, iat= 377, 389, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95, &end
#
# 25 LEU HG 29 ILE QD1 3.35
&rst
ixpk= 0, nxpk= 0, iat= 377, -1, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,
igr2= 460, 461, 462,
&end
#
# 25 LEU HN 25 LEU HB2 3.64
&rst
ixpk= 0, nxpk= 0, iat= 370, 374, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14, &end
#
# 25 LEU HN 25 LEU HB3 3.46
&rst
ixpk= 0, nxpk= 0, iat= 370, 375, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96, &end
#
# 25 LEU HN 25 LEU QQD 4.35
&rst
ixpk= 0, nxpk= 0, iat= 370, -1, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
igr2= 379, 380, 381, 383, 384, 385,
&end
#
# 25 LEU HN 26 ILE HB 5.44
&rst
ixpk= 0, nxpk= 0, iat= 370, 393, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94, &end
#
# 25 LEU HN 26 ILE HN 3.56
&rst
ixpk= 0, nxpk= 0, iat= 370, 389, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06, &end
#
# 25 LEU HN 27 LYS QB 5.50
&rst
ixpk= 0, nxpk= 0, iat= 370, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 412, 413,
&end
#
# 25 LEU QD1 29 ILE QD1 3.51
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
igr1= 379, 380, 381,
igr2= 460, 461, 462,
&end
#
# 25 LEU QD2 29 ILE QD1 3.51
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
igr1= 383, 384, 385,
igr2= 460, 461, 462,
&end
#
# 25 LEU QQD 26 ILE HN 4.08
&rst
ixpk= 0, nxpk= 0, iat= -1, 389, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
igr1= 379, 380, 381, 383, 384, 385,
&end
#
# 25 LEU QQD 28 HIS HB2 4.43
&rst
ixpk= 0, nxpk= 0, iat= -1, 434, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr1= 379, 380, 381, 383, 384, 385,
&end
#
# 25 LEU QQD 28 HIS HB3 4.58
&rst
ixpk= 0, nxpk= 0, iat= -1, 435, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 379, 380, 381, 383, 384, 385,
&end
#
# 25 LEU QQD 28 HIS HD2 3.62
&rst
ixpk= 0, nxpk= 0, iat= -1, 443, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
igr1= 379, 380, 381, 383, 384, 385,
&end
#
# 25 LEU QQD 28 HIS HN 4.51
&rst
ixpk= 0, nxpk= 0, iat= -1, 430, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
igr1= 379, 380, 381, 383, 384, 385,
&end
#
# 25 LEU QQD 29 ILE HN 4.36
&rst
ixpk= 0, nxpk= 0, iat= -1, 447, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
igr1= 379, 380, 381, 383, 384, 385,
&end
#
# 25 LEU QQD 29 ILE QD1 2.98
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
igr1= 379, 380, 381, 383, 384, 385,
igr2= 460, 461, 462,
&end
#
# 25 LEU QQD 29 ILE QG1 3.63
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
igr1= 379, 380, 381, 383, 384, 385,
igr2= 457, 458,
&end
#
# 26 ILE HA 26 ILE HG12 3.67
&rst
ixpk= 0, nxpk= 0, iat= 391, 399, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17, &end
#
# 26 ILE HA 26 ILE HG13 3.67
&rst
ixpk= 0, nxpk= 0, iat= 391, 400, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17, &end
#
# 26 ILE HA 26 ILE QD1 3.88
&rst
ixpk= 0, nxpk= 0, iat= 391, -1, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
igr2= 402, 403, 404,
&end
#
# 26 ILE HA 26 ILE QG2 3.31
&rst
ixpk= 0, nxpk= 0, iat= 391, -1, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,
igr2= 395, 396, 397,
&end
#
# 26 ILE HA 29 ILE HB 3.70
&rst
ixpk= 0, nxpk= 0, iat= 391, 451, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20, &end
#
# 26 ILE HA 29 ILE HN 4.16
&rst
ixpk= 0, nxpk= 0, iat= 391, 447, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66, &end
#
# 26 ILE HA 29 ILE QD1 3.71
&rst
ixpk= 0, nxpk= 0, iat= 391, -1, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
igr2= 460, 461, 462,
&end
#
# 26 ILE HA 29 ILE QG1 4.71
&rst
ixpk= 0, nxpk= 0, iat= 391, -1, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,
igr2= 457, 458,
&end
#
# 26 ILE HA 29 ILE QG2 4.84
&rst
ixpk= 0, nxpk= 0, iat= 391, -1, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
igr2= 453, 454, 455,
&end
#
# 26 ILE HB 26 ILE QD1 3.66
&rst
ixpk= 0, nxpk= 0, iat= 393, -1, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,
igr2= 402, 403, 404,
&end
#
# 26 ILE HB 27 LYS HN 3.20
&rst
ixpk= 0, nxpk= 0, iat= 393, 408, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 26 ILE HN 26 ILE HB 3.15
&rst
ixpk= 0, nxpk= 0, iat= 389, 393, r1= 1.30, r2= 1.80, r3= 3.15, r4= 3.65, &end
#
# 26 ILE HN 26 ILE HG12 3.95
&rst
ixpk= 0, nxpk= 0, iat= 389, 399, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45, &end
#
# 26 ILE HN 26 ILE HG13 3.95
&rst
ixpk= 0, nxpk= 0, iat= 389, 400, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45, &end
#
# 26 ILE HN 26 ILE QD1 4.04
&rst
ixpk= 0, nxpk= 0, iat= 389, -1, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
igr2= 402, 403, 404,
&end
#
# 26 ILE HN 26 ILE QG1 3.36
&rst
ixpk= 0, nxpk= 0, iat= 389, -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
igr2= 399, 400,
&end
#
# 26 ILE HN 26 ILE QG2 3.97
&rst
ixpk= 0, nxpk= 0, iat= 389, -1, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
igr2= 395, 396, 397,
&end
#
# 26 ILE HN 27 LYS HN 3.57
&rst
ixpk= 0, nxpk= 0, iat= 389, 408, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07, &end
#
# 26 ILE QD1 29 ILE QD1 4.59
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.62, r4= 7.12,
igr1= 402, 403, 404,
igr2= 460, 461, 462,
&end
#
# 26 ILE QG1 27 LYS HN 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, 408, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1= 399, 400,
&end
#
# 26 ILE QG2 26 ILE HG12 3.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 399, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
igr1= 395, 396, 397,
&end
#
# 26 ILE QG2 26 ILE HG13 3.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 400, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
igr1= 395, 396, 397,
&end
#
# 26 ILE QG2 27 LYS HA 3.94
&rst
ixpk= 0, nxpk= 0, iat= -1, 410, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
igr1= 395, 396, 397,
&end
#
# 26 ILE QG2 27 LYS HN 3.98
&rst
ixpk= 0, nxpk= 0, iat= -1, 408, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
igr1= 395, 396, 397,
&end
#
# 26 ILE QG2 27 LYS QB 4.80
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.47, r4= 6.97,
igr1= 395, 396, 397,
igr2= 412, 413,
&end
#
# 26 ILE QG2 29 ILE HB 4.58
&rst
ixpk= 0, nxpk= 0, iat= -1, 451, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
igr1= 395, 396, 397,
&end
#
# 26 ILE QG2 29 ILE QD1 4.06
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
igr1= 395, 396, 397,
igr2= 460, 461, 462,
&end
#
# 26 ILE QG2 30 ARG QD 4.14
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr1= 395, 396, 397,
igr2= 476, 477,
&end
#
# 26 ILE QG2 30 ARG QG 4.74
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.39, r4= 6.89,
igr1= 395, 396, 397,
igr2= 473, 474,
&end
#
# 27 LYS HA 27 LYS HG2 4.22
&rst
ixpk= 0, nxpk= 0, iat= 410, 415, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 27 LYS HA 27 LYS HG3 4.22
&rst
ixpk= 0, nxpk= 0, iat= 410, 416, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 27 LYS HA 27 LYS QD 4.92
&rst
ixpk= 0, nxpk= 0, iat= 410, -1, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
igr2= 418, 419,
&end
#
# 27 LYS HA 27 LYS QG 3.60
&rst
ixpk= 0, nxpk= 0, iat= 410, -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
igr2= 415, 416,
&end
#
# 27 LYS HA 30 ARG HN 4.46
&rst
ixpk= 0, nxpk= 0, iat= 410, 466, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, &end
#
# 27 LYS HA 30 ARG QB 3.83
&rst
ixpk= 0, nxpk= 0, iat= 410, -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
igr2= 470, 471,
&end
#
# 27 LYS HA 30 ARG QD 4.56
&rst
ixpk= 0, nxpk= 0, iat= 410, -1, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
igr2= 476, 477,
&end
#
# 27 LYS HA 30 ARG QG 5.33
&rst
ixpk= 0, nxpk= 0, iat= 410, -1, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
igr2= 473, 474,
&end
#
# 27 LYS HN 27 LYS HG2 4.61
&rst
ixpk= 0, nxpk= 0, iat= 408, 415, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 27 LYS HN 27 LYS HG3 4.61
&rst
ixpk= 0, nxpk= 0, iat= 408, 416, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 27 LYS HN 27 LYS QB 3.35
&rst
ixpk= 0, nxpk= 0, iat= 408, -1, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,
igr2= 412, 413,
&end
#
# 27 LYS HN 27 LYS QD 5.34
&rst
ixpk= 0, nxpk= 0, iat= 408, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2= 418, 419,
&end
#
# 27 LYS HN 27 LYS QG 4.02
&rst
ixpk= 0, nxpk= 0, iat= 408, -1, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,
igr2= 415, 416,
&end
#
# 27 LYS HN 28 HIS HN 3.53
&rst
ixpk= 0, nxpk= 0, iat= 408, 430, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03, &end
#
# 27 LYS QB 27 LYS HD2 3.96
&rst
ixpk= 0, nxpk= 0, iat= -1, 418, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
igr1= 412, 413,
&end
#
# 27 LYS QB 27 LYS HD3 3.96
&rst
ixpk= 0, nxpk= 0, iat= -1, 419, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
igr1= 412, 413,
&end
#
# 27 LYS QB 27 LYS HE2 5.26
&rst
ixpk= 0, nxpk= 0, iat= -1, 421, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
igr1= 412, 413,
&end
#
# 27 LYS QB 27 LYS HE3 5.26
&rst
ixpk= 0, nxpk= 0, iat= -1, 422, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
igr1= 412, 413,
&end
#
# 27 LYS QB 27 LYS QE 4.51
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
igr1= 412, 413,
igr2= 421, 422,
&end
#
# 27 LYS QB 28 HIS HN 3.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 430, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
igr1= 412, 413,
&end
#
# 28 HIS HA 31 ASP HB2 4.28
&rst
ixpk= 0, nxpk= 0, iat= 432, 494, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78, &end
#
# 28 HIS HA 31 ASP HB3 4.28
&rst
ixpk= 0, nxpk= 0, iat= 432, 495, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78, &end
#
# 28 HIS HA 31 ASP HN 4.54
&rst
ixpk= 0, nxpk= 0, iat= 432, 490, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 28 HIS HA 31 ASP QB 3.59
&rst
ixpk= 0, nxpk= 0, iat= 432, -1, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,
igr2= 494, 495,
&end
#
# 28 HIS HA 32 MET HN 4.82
&rst
ixpk= 0, nxpk= 0, iat= 432, 502, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32, &end
#
# 28 HIS HA 32 MET QG 4.67
&rst
ixpk= 0, nxpk= 0, iat= 432, -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr2= 509, 510,
&end
#
# 28 HIS HB2 29 ILE HN 4.31
&rst
ixpk= 0, nxpk= 0, iat= 434, 447, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81, &end
#
# 28 HIS HB3 28 HIS HD2 3.72
&rst
ixpk= 0, nxpk= 0, iat= 435, 443, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22, &end
#
# 28 HIS HB3 29 ILE HN 3.35
&rst
ixpk= 0, nxpk= 0, iat= 435, 447, r1= 1.30, r2= 1.80, r3= 3.35, r4= 3.85, &end
#
# 28 HIS HD2 29 ILE HA 4.14
&rst
ixpk= 0, nxpk= 0, iat= 443, 449, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64, &end
#
# 28 HIS HD2 29 ILE HG12 4.25
&rst
ixpk= 0, nxpk= 0, iat= 443, 457, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75, &end
#
# 28 HIS HD2 29 ILE HG13 4.25
&rst
ixpk= 0, nxpk= 0, iat= 443, 458, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75, &end
#
# 28 HIS HD2 29 ILE HN 4.19
&rst
ixpk= 0, nxpk= 0, iat= 443, 447, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69, &end
#
# 28 HIS HD2 29 ILE QD1 4.46
&rst
ixpk= 0, nxpk= 0, iat= 443, -1, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
igr2= 460, 461, 462,
&end
#
# 28 HIS HD2 29 ILE QG1 3.54
&rst
ixpk= 0, nxpk= 0, iat= 443, -1, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47,
igr2= 457, 458,
&end
#
# 28 HIS HD2 29 ILE QG2 4.80
&rst
ixpk= 0, nxpk= 0, iat= 443, -1, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
igr2= 453, 454, 455,
&end
#
# 28 HIS HD2 33 HIS HD2 4.27
&rst
ixpk= 0, nxpk= 0, iat= 443, 532, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77, &end
#
# 28 HIS HE1 32 MET HB2 4.57
&rst
ixpk= 0, nxpk= 0, iat= 440, 506, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07, &end
#
# 28 HIS HE1 32 MET HB3 4.57
&rst
ixpk= 0, nxpk= 0, iat= 440, 507, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07, &end
#
# 28 HIS HE1 32 MET QE 4.34
&rst
ixpk= 0, nxpk= 0, iat= 440, -1, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,
igr2= 513, 514, 515,
&end
#
# 28 HIS HE1 32 MET QG 3.71
&rst
ixpk= 0, nxpk= 0, iat= 440, -1, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
igr2= 509, 510,
&end
#
# 28 HIS HN 28 HIS HB2 3.34
&rst
ixpk= 0, nxpk= 0, iat= 430, 434, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84, &end
#
# 28 HIS HN 28 HIS HB3 3.09
&rst
ixpk= 0, nxpk= 0, iat= 430, 435, r1= 1.30, r2= 1.80, r3= 3.09, r4= 3.59, &end
#
# 28 HIS HN 29 ILE HN 3.72
&rst
ixpk= 0, nxpk= 0, iat= 430, 447, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22, &end
#
# 29 ILE HA 29 ILE HG12 3.76
&rst
ixpk= 0, nxpk= 0, iat= 449, 457, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26, &end
#
# 29 ILE HA 29 ILE HG13 3.76
&rst
ixpk= 0, nxpk= 0, iat= 449, 458, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26, &end
#
# 29 ILE HA 29 ILE QD1 4.02
&rst
ixpk= 0, nxpk= 0, iat= 449, -1, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
igr2= 460, 461, 462,
&end
#
# 29 ILE HA 29 ILE QG1 3.26
&rst
ixpk= 0, nxpk= 0, iat= 449, -1, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,
igr2= 457, 458,
&end
#
# 29 ILE HA 29 ILE QG2 3.45
&rst
ixpk= 0, nxpk= 0, iat= 449, -1, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,
igr2= 453, 454, 455,
&end
#
# 29 ILE HA 32 MET HN 4.60
&rst
ixpk= 0, nxpk= 0, iat= 449, 502, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 29 ILE HA 33 HIS HB2 4.60
&rst
ixpk= 0, nxpk= 0, iat= 449, 523, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 29 ILE HA 33 HIS HB3 4.60
&rst
ixpk= 0, nxpk= 0, iat= 449, 524, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 29 ILE HA 33 HIS HD2 3.12
&rst
ixpk= 0, nxpk= 0, iat= 449, 532, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62, &end
#
# 29 ILE HA 33 HIS HN 4.00
&rst
ixpk= 0, nxpk= 0, iat= 449, 519, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 29 ILE HA 33 HIS QB 3.83
&rst
ixpk= 0, nxpk= 0, iat= 449, -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
igr2= 523, 524,
&end
#
# 29 ILE HB 29 ILE QD1 3.38
&rst
ixpk= 0, nxpk= 0, iat= 451, -1, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,
igr2= 460, 461, 462,
&end
#
# 29 ILE HB 30 ARG HN 3.58
&rst
ixpk= 0, nxpk= 0, iat= 451, 466, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08, &end
#
# 29 ILE HB 33 HIS HD2 4.73
&rst
ixpk= 0, nxpk= 0, iat= 451, 532, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, &end
#
# 29 ILE HG12 33 HIS HD2 4.29
&rst
ixpk= 0, nxpk= 0, iat= 457, 532, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79, &end
#
# 29 ILE HG13 33 HIS HD2 4.29
&rst
ixpk= 0, nxpk= 0, iat= 458, 532, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79, &end
#
# 29 ILE HN 29 ILE HB 3.30
&rst
ixpk= 0, nxpk= 0, iat= 447, 451, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80, &end
#
# 29 ILE HN 29 ILE HG12 3.85
&rst
ixpk= 0, nxpk= 0, iat= 447, 457, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35, &end
#
# 29 ILE HN 29 ILE HG13 3.85
&rst
ixpk= 0, nxpk= 0, iat= 447, 458, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35, &end
#
# 29 ILE HN 29 ILE QD1 4.03
&rst
ixpk= 0, nxpk= 0, iat= 447, -1, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
igr2= 460, 461, 462,
&end
#
# 29 ILE HN 29 ILE QG1 3.18
&rst
ixpk= 0, nxpk= 0, iat= 447, -1, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07,
igr2= 457, 458,
&end
#
# 29 ILE HN 29 ILE QG2 4.09
&rst
ixpk= 0, nxpk= 0, iat= 447, -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
igr2= 453, 454, 455,
&end
#
# 29 ILE HN 30 ARG HN 3.59
&rst
ixpk= 0, nxpk= 0, iat= 447, 466, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09, &end
#
# 29 ILE QD1 33 HIS HD2 4.57
&rst
ixpk= 0, nxpk= 0, iat= -1, 532, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
igr1= 460, 461, 462,
&end
#
# 29 ILE QG1 33 HIS HD2 3.58
&rst
ixpk= 0, nxpk= 0, iat= -1, 532, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,
igr1= 457, 458,
&end
#
# 29 ILE QG2 29 ILE HG12 3.81
&rst
ixpk= 0, nxpk= 0, iat= -1, 457, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
igr1= 453, 454, 455,
&end
#
# 29 ILE QG2 29 ILE HG13 3.81
&rst
ixpk= 0, nxpk= 0, iat= -1, 458, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
igr1= 453, 454, 455,
&end
#
# 29 ILE QG2 29 ILE QD1 2.95
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,
igr1= 453, 454, 455,
igr2= 460, 461, 462,
&end
#
# 29 ILE QG2 29 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= 453, 454, 455,
igr2= 457, 458,
&end
#
# 29 ILE QG2 30 ARG HA 4.29
&rst
ixpk= 0, nxpk= 0, iat= -1, 468, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
igr1= 453, 454, 455,
&end
#
# 29 ILE QG2 30 ARG HN 4.15
&rst
ixpk= 0, nxpk= 0, iat= -1, 466, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
igr1= 453, 454, 455,
&end
#
# 29 ILE QG2 33 HIS HB2 4.17
&rst
ixpk= 0, nxpk= 0, iat= -1, 523, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
igr1= 453, 454, 455,
&end
#
# 29 ILE QG2 33 HIS HB3 4.17
&rst
ixpk= 0, nxpk= 0, iat= -1, 524, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
igr1= 453, 454, 455,
&end
#
# 29 ILE QG2 33 HIS HD2 3.99
&rst
ixpk= 0, nxpk= 0, iat= -1, 532, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
igr1= 453, 454, 455,
&end
#
# 29 ILE QG2 33 HIS HN 4.08
&rst
ixpk= 0, nxpk= 0, iat= -1, 519, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,
igr1= 453, 454, 455,
&end
#
# 29 ILE QG2 33 HIS QB 3.49
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
igr1= 453, 454, 455,
igr2= 523, 524,
&end
#
# 29 ILE QG2 35 PRO HD2 4.80
&rst
ixpk= 0, nxpk= 0, iat= -1, 549, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
igr1= 453, 454, 455,
&end
#
# 29 ILE QG2 35 PRO HD3 4.80
&rst
ixpk= 0, nxpk= 0, iat= -1, 550, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
igr1= 453, 454, 455,
&end
#
# 30 ARG HA 30 ARG HG2 4.17
&rst
ixpk= 0, nxpk= 0, iat= 468, 473, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67, &end
#
# 30 ARG HA 30 ARG HG3 4.17
&rst
ixpk= 0, nxpk= 0, iat= 468, 474, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67, &end
#
# 30 ARG HA 30 ARG QD 4.18
&rst
ixpk= 0, nxpk= 0, iat= 468, -1, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,
igr2= 476, 477,
&end
#
# 30 ARG HA 30 ARG QG 3.56
&rst
ixpk= 0, nxpk= 0, iat= 468, -1, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,
igr2= 473, 474,
&end
#
# 30 ARG HA 34 ASP HB2 4.67
&rst
ixpk= 0, nxpk= 0, iat= 468, 540, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, &end
#
# 30 ARG HA 34 ASP HB3 4.67
&rst
ixpk= 0, nxpk= 0, iat= 468, 541, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, &end
#
# 30 ARG HA 34 ASP QB 3.93
&rst
ixpk= 0, nxpk= 0, iat= 468, -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
igr2= 540, 541,
&end
#
# 30 ARG HN 30 ARG HG2 4.11
&rst
ixpk= 0, nxpk= 0, iat= 466, 473, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 30 ARG HN 30 ARG HG3 4.11
&rst
ixpk= 0, nxpk= 0, iat= 466, 474, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 30 ARG HN 30 ARG QB 3.15
&rst
ixpk= 0, nxpk= 0, iat= 466, -1, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04,
igr2= 470, 471,
&end
#
# 30 ARG HN 30 ARG QG 3.59
&rst
ixpk= 0, nxpk= 0, iat= 466, -1, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,
igr2= 473, 474,
&end
#
# 30 ARG HN 31 ASP HN 3.55
&rst
ixpk= 0, nxpk= 0, iat= 466, 490, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05, &end
#
# 30 ARG QB 30 ARG QD 3.60
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
igr1= 470, 471,
igr2= 476, 477,
&end
#
# 30 ARG QB 31 ASP HA 4.75
&rst
ixpk= 0, nxpk= 0, iat= -1, 492, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
igr1= 470, 471,
&end
#
# 30 ARG QB 31 ASP HN 3.64
&rst
ixpk= 0, nxpk= 0, iat= -1, 490, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59,
igr1= 470, 471,
&end
#
# 31 ASP HB2 32 MET HN 4.11
&rst
ixpk= 0, nxpk= 0, iat= 494, 502, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 31 ASP HB3 32 MET HN 4.11
&rst
ixpk= 0, nxpk= 0, iat= 495, 502, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 31 ASP HN 31 ASP HB2 3.86
&rst
ixpk= 0, nxpk= 0, iat= 490, 494, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 31 ASP HN 31 ASP HB3 3.86
&rst
ixpk= 0, nxpk= 0, iat= 490, 495, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 31 ASP HN 31 ASP QB 3.23
&rst
ixpk= 0, nxpk= 0, iat= 490, -1, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13,
igr2= 494, 495,
&end
#
# 31 ASP HN 32 MET HN 3.54
&rst
ixpk= 0, nxpk= 0, iat= 490, 502, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04, &end
#
# 31 ASP QB 32 MET HN 3.49
&rst
ixpk= 0, nxpk= 0, iat= -1, 502, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
igr1= 494, 495,
&end
#
# 31 ASP QB 32 MET QG 3.86
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
igr1= 494, 495,
igr2= 509, 510,
&end
#
# 32 MET HA 32 MET QE 3.90
&rst
ixpk= 0, nxpk= 0, iat= 504, -1, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
igr2= 513, 514, 515,
&end
#
# 32 MET HB2 32 MET QE 4.11
&rst
ixpk= 0, nxpk= 0, iat= 506, -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
igr2= 513, 514, 515,
&end
#
# 32 MET HB3 32 MET QE 4.11
&rst
ixpk= 0, nxpk= 0, iat= 507, -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
igr2= 513, 514, 515,
&end
#
# 32 MET HN 32 MET HB2 3.99
&rst
ixpk= 0, nxpk= 0, iat= 502, 506, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49, &end
#
# 32 MET HN 32 MET HB3 3.99
&rst
ixpk= 0, nxpk= 0, iat= 502, 507, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49, &end
#
# 32 MET HN 32 MET HG2 4.27
&rst
ixpk= 0, nxpk= 0, iat= 502, 509, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77, &end
#
# 32 MET HN 32 MET HG3 4.27
&rst
ixpk= 0, nxpk= 0, iat= 502, 510, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77, &end
#
# 32 MET HN 32 MET QB 3.30
&rst
ixpk= 0, nxpk= 0, iat= 502, -1, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,
igr2= 506, 507,
&end
#
# 32 MET HN 32 MET QG 3.56
&rst
ixpk= 0, nxpk= 0, iat= 502, -1, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,
igr2= 509, 510,
&end
#
# 32 MET HN 33 HIS HN 3.26
&rst
ixpk= 0, nxpk= 0, iat= 502, 519, r1= 1.30, r2= 1.80, r3= 3.26, r4= 3.76, &end
#
# 32 MET QB 32 MET QE 3.38
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
igr1= 506, 507,
igr2= 513, 514, 515,
&end
#
# 32 MET QB 33 HIS HN 4.30
&rst
ixpk= 0, nxpk= 0, iat= -1, 519, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
igr1= 506, 507,
&end
#
# 33 HIS HB2 34 ASP HN 4.60
&rst
ixpk= 0, nxpk= 0, iat= 523, 536, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 33 HIS HB3 34 ASP HN 4.60
&rst
ixpk= 0, nxpk= 0, iat= 524, 536, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 33 HIS HN 33 HIS HB2 4.06
&rst
ixpk= 0, nxpk= 0, iat= 519, 523, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56, &end
#
# 33 HIS HN 33 HIS HB3 4.06
&rst
ixpk= 0, nxpk= 0, iat= 519, 524, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56, &end
#
# 33 HIS HN 33 HIS QB 3.40
&rst
ixpk= 0, nxpk= 0, iat= 519, -1, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,
igr2= 523, 524,
&end
#
# 33 HIS HN 34 ASP HN 3.45
&rst
ixpk= 0, nxpk= 0, iat= 519, 536, r1= 1.30, r2= 1.80, r3= 3.45, r4= 3.95, &end
#
# 33 HIS QB 34 ASP HN 4.01
&rst
ixpk= 0, nxpk= 0, iat= -1, 536, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
igr1= 523, 524,
&end
#
# 34 ASP HN 34 ASP HB2 4.15
&rst
ixpk= 0, nxpk= 0, iat= 536, 540, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65, &end
#
# 34 ASP HN 34 ASP HB3 4.15
&rst
ixpk= 0, nxpk= 0, iat= 536, 541, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65, &end
#
# 34 ASP HN 34 ASP QB 3.63
&rst
ixpk= 0, nxpk= 0, iat= 536, -1, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,
igr2= 540, 541,
&end
#
# 34 ASP QB 35 PRO QD 4.13
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
igr1= 540, 541,
igr2= 549, 550,
&end
#
# 35 PRO HA 36 GLN HN 3.42
&rst
ixpk= 0, nxpk= 0, iat= 558, 562, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92, &end
#
# 36 GLN HA 36 GLN QG 4.08
&rst
ixpk= 0, nxpk= 0, iat= 564, -1, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
igr2= 569, 570,
&end
#
# 36 GLN HN 36 GLN QB 3.62
&rst
ixpk= 0, nxpk= 0, iat= 562, -1, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,
igr2= 566, 567,
&end
#
# 36 GLN HN 36 GLN QG 4.22
&rst
ixpk= 0, nxpk= 0, iat= 562, -1, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr2= 569, 570,
&end
#
# 36 GLN HN 37 ASP HN 4.17
&rst
ixpk= 0, nxpk= 0, iat= 562, 579, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67, &end
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