NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
588686 |
2rut   |
11474 | cing | 1-original | 3 | AMBER | distance | NOE | simple |
#
# 7 GLY QA 8 LYS QB 4.45
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
rk2 = 32.0, rk3 = 32.0, ir6=1, ialtd=0,
igr1= 64, 65,
igr2= 73, 74,
&end
#
# 7 GLY QA 9 ILE HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 91, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 64, 65,
&end
#
# 7 GLY QA 9 ILE QG2 4.65
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
igr1= 64, 65,
igr2= 97, 98, 99,
&end
#
# 8 LYS HA 8 LYS QD 4.44
&rst
ixpk= 0, nxpk= 0, iat= 71, -1, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
igr2= 79, 80,
&end
#
# 8 LYS HA 8 LYS QG 3.68
&rst
ixpk= 0, nxpk= 0, iat= 71, -1, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
igr2= 76, 77,
&end
#
# 8 LYS HA 9 ILE HG12 5.13
&rst
ixpk= 0, nxpk= 0, iat= 71, 101, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63, &end
#
# 8 LYS HA 9 ILE HG13 5.13
&rst
ixpk= 0, nxpk= 0, iat= 71, 102, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63, &end
#
# 8 LYS HA 9 ILE HN 2.76
&rst
ixpk= 0, nxpk= 0, iat= 71, 91, r1= 1.30, r2= 1.80, r3= 2.76, r4= 3.26, &end
#
# 8 LYS HA 9 ILE QG1 4.27
&rst
ixpk= 0, nxpk= 0, iat= 71, -1, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
igr2= 101, 102,
&end
#
# 8 LYS HA 9 ILE QG2 4.51
&rst
ixpk= 0, nxpk= 0, iat= 71, -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr2= 97, 98, 99,
&end
#
# 8 LYS QB 10 PHE QE 4.63
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33,
igr1= 73, 74,
igr2= 120, 124,
&end
#
# 8 LYS QB 9 ILE HN 4.16
&rst
ixpk= 0, nxpk= 0, iat= -1, 91, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
igr1= 73, 74,
&end
#
# 8 LYS QD 10 PHE QE 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
igr1= 79, 80,
igr2= 120, 124,
&end
#
# 8 LYS QD 9 ILE HN 3.41
&rst
ixpk= 0, nxpk= 0, iat= -1, 91, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,
igr1= 79, 80,
&end
#
# 8 LYS QE 10 PHE QE 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
igr1= 82, 83,
igr2= 120, 124,
&end
#
# 8 LYS QE 9 ILE HN 5.23
&rst
ixpk= 0, nxpk= 0, iat= -1, 91, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,
igr1= 82, 83,
&end
#
# 8 LYS QG 10 PHE QE 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1= 76, 77,
igr2= 120, 124,
&end
#
# 8 LYS QG 8 LYS QE 3.65
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
igr1= 76, 77,
igr2= 82, 83,
&end
#
# 9 ILE HA 10 PHE HN 2.85
&rst
ixpk= 0, nxpk= 0, iat= 93, 110, r1= 1.30, r2= 1.80, r3= 2.85, r4= 3.35, &end
#
# 9 ILE HA 10 PHE QD 4.19
&rst
ixpk= 0, nxpk= 0, iat= 93, -1, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
igr2= 118, 126,
&end
#
# 9 ILE HA 18 VAL QG1 5.09
&rst
ixpk= 0, nxpk= 0, iat= 93, -1, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
igr2= 242, 243, 244,
&end
#
# 9 ILE HA 19 PHE HN 4.76
&rst
ixpk= 0, nxpk= 0, iat= 93, 252, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26, &end
#
# 9 ILE HA 9 ILE QD1 4.19
&rst
ixpk= 0, nxpk= 0, iat= 93, -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
igr2= 104, 105, 106,
&end
#
# 9 ILE HA 9 ILE QG2 3.36
&rst
ixpk= 0, nxpk= 0, iat= 93, -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
igr2= 97, 98, 99,
&end
#
# 9 ILE HB 10 PHE HN 3.44
&rst
ixpk= 0, nxpk= 0, iat= 95, 110, r1= 1.30, r2= 1.80, r3= 3.44, r4= 3.94, &end
#
# 9 ILE HB 18 VAL QG1 3.74
&rst
ixpk= 0, nxpk= 0, iat= 95, -1, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
igr2= 242, 243, 244,
&end
#
# 9 ILE HB 18 VAL QG2 4.35
&rst
ixpk= 0, nxpk= 0, iat= 95, -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
igr2= 246, 247, 248,
&end
#
# 9 ILE HB 9 ILE QD1 3.51
&rst
ixpk= 0, nxpk= 0, iat= 95, -1, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
igr2= 104, 105, 106,
&end
#
# 9 ILE HN 10 PHE HN 4.43
&rst
ixpk= 0, nxpk= 0, iat= 91, 110, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93, &end
#
# 9 ILE HN 9 ILE HB 3.95
&rst
ixpk= 0, nxpk= 0, iat= 91, 95, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45, &end
#
# 9 ILE HN 9 ILE HG12 3.74
&rst
ixpk= 0, nxpk= 0, iat= 91, 101, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24, &end
#
# 9 ILE HN 9 ILE HG13 3.74
&rst
ixpk= 0, nxpk= 0, iat= 91, 102, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24, &end
#
# 9 ILE HN 9 ILE QD1 4.29
&rst
ixpk= 0, nxpk= 0, iat= 91, -1, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
igr2= 104, 105, 106,
&end
#
# 9 ILE HN 9 ILE QG2 3.82
&rst
ixpk= 0, nxpk= 0, iat= 91, -1, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
igr2= 97, 98, 99,
&end
#
# 9 ILE QD1 10 PHE HN 4.55
&rst
ixpk= 0, nxpk= 0, iat= -1, 110, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
igr1= 104, 105, 106,
&end
#
# 9 ILE QD1 11 THR HB 5.16
&rst
ixpk= 0, nxpk= 0, iat= -1, 134, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
igr1= 104, 105, 106,
&end
#
# 9 ILE QD1 11 THR QG2 4.28
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 104, 105, 106,
igr2= 136, 137, 138,
&end
#
# 9 ILE QD1 18 VAL HB 4.65
&rst
ixpk= 0, nxpk= 0, iat= -1, 240, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr1= 104, 105, 106,
&end
#
# 9 ILE QG1 10 PHE HN 4.72
&rst
ixpk= 0, nxpk= 0, iat= -1, 110, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr1= 101, 102,
&end
#
# 9 ILE QG1 18 VAL QG1 4.30
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
igr1= 101, 102,
igr2= 242, 243, 244,
&end
#
# 9 ILE QG2 10 PHE HN 3.95
&rst
ixpk= 0, nxpk= 0, iat= -1, 110, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr1= 97, 98, 99,
&end
#
# 9 ILE QG2 18 VAL HB 4.48
&rst
ixpk= 0, nxpk= 0, iat= -1, 240, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
igr1= 97, 98, 99,
&end
#
# 9 ILE QG2 20 LYS HA 4.33
&rst
ixpk= 0, nxpk= 0, iat= -1, 274, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
igr1= 97, 98, 99,
&end
#
# 9 ILE QG2 20 LYS QD 4.85
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.54, r4= 7.04,
igr1= 97, 98, 99,
igr2= 282, 283,
&end
#
# 9 ILE QG2 20 LYS QE 4.95
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
igr1= 97, 98, 99,
igr2= 285, 286,
&end
#
# 9 ILE QG2 9 ILE HG12 3.72
&rst
ixpk= 0, nxpk= 0, iat= -1, 101, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
igr1= 97, 98, 99,
&end
#
# 9 ILE QG2 9 ILE HG13 3.72
&rst
ixpk= 0, nxpk= 0, iat= -1, 102, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
igr1= 97, 98, 99,
&end
#
# 9 ILE QG2 9 ILE QG1 3.17
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,
igr1= 97, 98, 99,
igr2= 101, 102,
&end
#
# 10 PHE HA 10 PHE QD 4.14
&rst
ixpk= 0, nxpk= 0, iat= 112, -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
igr2= 118, 126,
&end
#
# 10 PHE HA 11 THR HN 2.94
&rst
ixpk= 0, nxpk= 0, iat= 112, 130, r1= 1.30, r2= 1.80, r3= 2.94, r4= 3.44, &end
#
# 10 PHE HA 25 LEU QD2 4.09
&rst
ixpk= 0, nxpk= 0, iat= 112, -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
igr2= 377, 378, 379,
&end
#
# 10 PHE HB2 11 THR HN 4.54
&rst
ixpk= 0, nxpk= 0, iat= 114, 130, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 10 PHE HB2 19 PHE HB2 3.82
&rst
ixpk= 0, nxpk= 0, iat= 114, 256, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32, &end
#
# 10 PHE HB2 19 PHE HB3 4.38
&rst
ixpk= 0, nxpk= 0, iat= 114, 257, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88, &end
#
# 10 PHE HB2 19 PHE HN 4.19
&rst
ixpk= 0, nxpk= 0, iat= 114, 252, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69, &end
#
# 10 PHE HB2 19 PHE QD 4.48
&rst
ixpk= 0, nxpk= 0, iat= 114, -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
igr2= 260, 268,
&end
#
# 10 PHE HB2 21 PHE HN 5.32
&rst
ixpk= 0, nxpk= 0, iat= 114, 294, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82, &end
#
# 10 PHE HB2 25 LEU HB2 4.27
&rst
ixpk= 0, nxpk= 0, iat= 114, 368, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77, &end
#
# 10 PHE HB2 25 LEU HB3 4.67
&rst
ixpk= 0, nxpk= 0, iat= 114, 369, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, &end
#
# 10 PHE HB2 25 LEU QD2 3.75
&rst
ixpk= 0, nxpk= 0, iat= 114, -1, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
igr2= 377, 378, 379,
&end
#
# 10 PHE HB3 11 THR HN 3.83
&rst
ixpk= 0, nxpk= 0, iat= 115, 130, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33, &end
#
# 10 PHE HB3 19 PHE HB2 4.19
&rst
ixpk= 0, nxpk= 0, iat= 115, 256, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69, &end
#
# 10 PHE HB3 19 PHE HB3 5.50
&rst
ixpk= 0, nxpk= 0, iat= 115, 257, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 10 PHE HB3 19 PHE HN 4.62
&rst
ixpk= 0, nxpk= 0, iat= 115, 252, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12, &end
#
# 10 PHE HB3 19 PHE QD 4.57
&rst
ixpk= 0, nxpk= 0, iat= 115, -1, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
igr2= 260, 268,
&end
#
# 10 PHE HB3 22 LYS HA 4.40
&rst
ixpk= 0, nxpk= 0, iat= 115, 316, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 10 PHE HB3 25 LEU HB2 4.06
&rst
ixpk= 0, nxpk= 0, iat= 115, 368, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56, &end
#
# 10 PHE HB3 25 LEU HB3 4.13
&rst
ixpk= 0, nxpk= 0, iat= 115, 369, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63, &end
#
# 10 PHE HB3 25 LEU QD2 3.31
&rst
ixpk= 0, nxpk= 0, iat= 115, -1, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,
igr2= 377, 378, 379,
&end
#
# 10 PHE HN 10 PHE HB2 3.40
&rst
ixpk= 0, nxpk= 0, iat= 110, 114, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90, &end
#
# 10 PHE HN 10 PHE HB3 3.74
&rst
ixpk= 0, nxpk= 0, iat= 110, 115, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24, &end
#
# 10 PHE HN 10 PHE QD 3.58
&rst
ixpk= 0, nxpk= 0, iat= 110, -1, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,
igr2= 118, 126,
&end
#
# 10 PHE HN 10 PHE QE 5.21
&rst
ixpk= 0, nxpk= 0, iat= 110, -1, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
igr2= 120, 124,
&end
#
# 10 PHE HN 18 VAL QG1 4.66
&rst
ixpk= 0, nxpk= 0, iat= 110, -1, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
igr2= 242, 243, 244,
&end
#
# 10 PHE HN 19 PHE HB2 4.51
&rst
ixpk= 0, nxpk= 0, iat= 110, 256, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01, &end
#
# 10 PHE HN 19 PHE HN 3.82
&rst
ixpk= 0, nxpk= 0, iat= 110, 252, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32, &end
#
# 10 PHE HN 20 LYS HA 4.77
&rst
ixpk= 0, nxpk= 0, iat= 110, 274, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27, &end
#
# 10 PHE HN 25 LEU QD2 5.25
&rst
ixpk= 0, nxpk= 0, iat= 110, -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
igr2= 377, 378, 379,
&end
#
# 10 PHE HZ 22 LYS HG2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 122, 321, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 10 PHE HZ 22 LYS HG3 5.50
&rst
ixpk= 0, nxpk= 0, iat= 122, 322, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 10 PHE HZ 22 LYS QB 4.12
&rst
ixpk= 0, nxpk= 0, iat= 122, -1, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
igr2= 318, 319,
&end
#
# 10 PHE HZ 22 LYS QD 4.03
&rst
ixpk= 0, nxpk= 0, iat= 122, -1, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
igr2= 324, 325,
&end
#
# 10 PHE HZ 22 LYS QE 5.50
&rst
ixpk= 0, nxpk= 0, iat= 122, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 327, 328,
&end
#
# 10 PHE QD 11 THR HN 4.39
&rst
ixpk= 0, nxpk= 0, iat= -1, 130, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,
igr1= 118, 126,
&end
#
# 10 PHE QD 20 LYS HA 5.20
&rst
ixpk= 0, nxpk= 0, iat= -1, 274, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
igr1= 118, 126,
&end
#
# 10 PHE QD 25 LEU QD2 3.90
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr1= 118, 126,
igr2= 377, 378, 379,
&end
#
# 10 PHE QE 21 PHE HA 4.61
&rst
ixpk= 0, nxpk= 0, iat= -1, 296, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67,
igr1= 120, 124,
&end
#
# 10 PHE QE 22 LYS HA 4.60
&rst
ixpk= 0, nxpk= 0, iat= -1, 316, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
igr1= 120, 124,
&end
#
# 10 PHE QE 22 LYS HB2 4.97
&rst
ixpk= 0, nxpk= 0, iat= -1, 318, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr1= 120, 124,
&end
#
# 10 PHE QE 22 LYS HB3 4.97
&rst
ixpk= 0, nxpk= 0, iat= -1, 319, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr1= 120, 124,
&end
#
# 10 PHE QE 22 LYS HG2 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 321, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 120, 124,
&end
#
# 10 PHE QE 22 LYS HG3 4.90
&rst
ixpk= 0, nxpk= 0, iat= -1, 322, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
igr1= 120, 124,
&end
#
# 10 PHE QE 22 LYS QB 4.16
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr1= 120, 124,
igr2= 318, 319,
&end
#
# 10 PHE QE 22 LYS QD 4.55
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23,
igr1= 120, 124,
igr2= 324, 325,
&end
#
# 10 PHE QE 22 LYS QE 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
igr1= 120, 124,
igr2= 327, 328,
&end
#
# 11 THR HA 11 THR QG2 3.30
&rst
ixpk= 0, nxpk= 0, iat= 132, -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
igr2= 136, 137, 138,
&end
#
# 11 THR HA 12 CYM HB2 4.45
&rst
ixpk= 0, nxpk= 0, iat= 132, 149, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95, &end
#
# 11 THR HA 12 CYM HB3 4.85
&rst
ixpk= 0, nxpk= 0, iat= 132, 148, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35, &end
#
# 11 THR HA 12 CYM HN 2.89
&rst
ixpk= 0, nxpk= 0, iat= 132, 144, r1= 1.30, r2= 1.80, r3= 2.89, r4= 3.39, &end
#
# 11 THR HA 17 LYS HN 5.09
&rst
ixpk= 0, nxpk= 0, iat= 132, 214, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59, &end
#
# 11 THR HA 18 VAL HA 4.16
&rst
ixpk= 0, nxpk= 0, iat= 132, 238, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66, &end
#
# 11 THR HA 18 VAL HB 4.81
&rst
ixpk= 0, nxpk= 0, iat= 132, 240, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31, &end
#
# 11 THR HA 18 VAL QG1 3.97
&rst
ixpk= 0, nxpk= 0, iat= 132, -1, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
igr2= 242, 243, 244,
&end
#
# 11 THR HA 18 VAL QG2 4.62
&rst
ixpk= 0, nxpk= 0, iat= 132, -1, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,
igr2= 246, 247, 248,
&end
#
# 11 THR HA 19 PHE HN 3.85
&rst
ixpk= 0, nxpk= 0, iat= 132, 252, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35, &end
#
# 11 THR HA 19 PHE QD 4.53
&rst
ixpk= 0, nxpk= 0, iat= 132, -1, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
igr2= 260, 268,
&end
#
# 11 THR HA 25 LEU QD1 4.68
&rst
ixpk= 0, nxpk= 0, iat= 132, -1, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
igr2= 373, 374, 375,
&end
#
# 11 THR HB 12 CYM HN 4.11
&rst
ixpk= 0, nxpk= 0, iat= 134, 144, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 11 THR HB 18 VAL QG1 4.37
&rst
ixpk= 0, nxpk= 0, iat= 134, -1, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
igr2= 242, 243, 244,
&end
#
# 11 THR HN 11 THR HB 3.25
&rst
ixpk= 0, nxpk= 0, iat= 130, 134, r1= 1.30, r2= 1.80, r3= 3.25, r4= 3.75, &end
#
# 11 THR HN 11 THR QG2 3.88
&rst
ixpk= 0, nxpk= 0, iat= 130, -1, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
igr2= 136, 137, 138,
&end
#
# 11 THR HN 12 CYM HN 4.85
&rst
ixpk= 0, nxpk= 0, iat= 130, 144, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35, &end
#
# 11 THR HN 25 LEU QD2 4.57
&rst
ixpk= 0, nxpk= 0, iat= 130, -1, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
igr2= 377, 378, 379,
&end
#
# 11 THR QG2 12 CYM HB2 4.55
&rst
ixpk= 0, nxpk= 0, iat= -1, 149, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
igr1= 136, 137, 138,
&end
#
# 11 THR QG2 12 CYM HB3 4.61
&rst
ixpk= 0, nxpk= 0, iat= -1, 148, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
igr1= 136, 137, 138,
&end
#
# 11 THR QG2 12 CYM HN 3.32
&rst
ixpk= 0, nxpk= 0, iat= -1, 144, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,
igr1= 136, 137, 138,
&end
#
# 11 THR QG2 13 GLU HA 4.14
&rst
ixpk= 0, nxpk= 0, iat= -1, 156, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
igr1= 136, 137, 138,
&end
#
# 11 THR QG2 13 GLU HN 5.04
&rst
ixpk= 0, nxpk= 0, iat= -1, 154, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
igr1= 136, 137, 138,
&end
#
# 11 THR QG2 13 GLU QB 5.11
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.89, r4= 7.39,
igr1= 136, 137, 138,
igr2= 158, 159,
&end
#
# 11 THR QG2 14 TYR HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 169, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 136, 137, 138,
&end
#
# 11 THR QG2 16 ASN HA 3.31
&rst
ixpk= 0, nxpk= 0, iat= -1, 202, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,
igr1= 136, 137, 138,
&end
#
# 11 THR QG2 16 ASN HN 4.41
&rst
ixpk= 0, nxpk= 0, iat= -1, 200, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr1= 136, 137, 138,
&end
#
# 11 THR QG2 16 ASN QB 3.96
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr1= 136, 137, 138,
igr2= 204, 205,
&end
#
# 11 THR QG2 17 LYS HN 3.94
&rst
ixpk= 0, nxpk= 0, iat= -1, 214, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
igr1= 136, 137, 138,
&end
#
# 11 THR QG2 18 VAL HA 3.89
&rst
ixpk= 0, nxpk= 0, iat= -1, 238, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
igr1= 136, 137, 138,
&end
#
# 11 THR QG2 18 VAL HB 4.65
&rst
ixpk= 0, nxpk= 0, iat= -1, 240, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr1= 136, 137, 138,
&end
#
# 11 THR QG2 18 VAL QG1 3.24
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
igr1= 136, 137, 138,
igr2= 242, 243, 244,
&end
#
# 11 THR QG2 18 VAL QG2 3.83
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
igr1= 136, 137, 138,
igr2= 246, 247, 248,
&end
#
# 11 THR QG2 19 PHE HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 252, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 136, 137, 138,
&end
#
# 12 CYM HA 13 GLU HA 4.48
&rst
ixpk= 0, nxpk= 0, iat= 146, 156, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98, &end
#
# 12 CYM HA 13 GLU HN 3.02
&rst
ixpk= 0, nxpk= 0, iat= 146, 154, r1= 1.30, r2= 1.80, r3= 3.02, r4= 3.52, &end
#
# 12 CYM HA 13 GLU QB 4.53
&rst
ixpk= 0, nxpk= 0, iat= 146, -1, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
igr2= 158, 159,
&end
#
# 12 CYM HA 14 TYR HN 4.05
&rst
ixpk= 0, nxpk= 0, iat= 146, 169, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55, &end
#
# 12 CYM HA 25 LEU QD1 3.22
&rst
ixpk= 0, nxpk= 0, iat= 146, -1, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,
igr2= 373, 374, 375,
&end
#
# 12 CYM HA 25 LEU QD2 4.53
&rst
ixpk= 0, nxpk= 0, iat= 146, -1, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
igr2= 377, 378, 379,
&end
#
# 12 CYM HA 28 HIS HD2 5.18
&rst
ixpk= 0, nxpk= 0, iat= 146, 423, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68, &end
#
# 12 CYM HA 29 LEU QD2 3.97
&rst
ixpk= 0, nxpk= 0, iat= 146, -1, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
igr2= 440, 441, 442,
&end
#
# 12 CYM HB2 13 GLU HN 4.67
&rst
ixpk= 0, nxpk= 0, iat= 149, 154, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, &end
#
# 12 CYM HB2 14 TYR HN 4.63
&rst
ixpk= 0, nxpk= 0, iat= 149, 169, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, &end
#
# 12 CYM HB2 15 CYM HN 4.42
&rst
ixpk= 0, nxpk= 0, iat= 149, 190, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92, &end
#
# 12 CYM HB2 17 LYS HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= 149, 216, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 12 CYM HB2 17 LYS HN 3.61
&rst
ixpk= 0, nxpk= 0, iat= 149, 214, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11, &end
#
# 12 CYM HB2 17 LYS QB 4.43
&rst
ixpk= 0, nxpk= 0, iat= 149, -1, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
igr2= 218, 219,
&end
#
# 12 CYM HB2 19 PHE HZ 4.49
&rst
ixpk= 0, nxpk= 0, iat= 149, 264, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99, &end
#
# 12 CYM HB2 19 PHE QD 4.56
&rst
ixpk= 0, nxpk= 0, iat= 149, -1, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
igr2= 260, 268,
&end
#
# 12 CYM HB2 19 PHE QE 3.65
&rst
ixpk= 0, nxpk= 0, iat= 149, -1, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,
igr2= 262, 266,
&end
#
# 12 CYM HB2 25 LEU QD1 3.43
&rst
ixpk= 0, nxpk= 0, iat= 149, -1, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
igr2= 373, 374, 375,
&end
#
# 12 CYM HB2 28 HIS HD2 3.67
&rst
ixpk= 0, nxpk= 0, iat= 149, 423, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17, &end
#
# 12 CYM HB2 29 LEU QD2 4.42
&rst
ixpk= 0, nxpk= 0, iat= 149, -1, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
igr2= 440, 441, 442,
&end
#
# 12 CYM HB3 13 GLU HN 4.61
&rst
ixpk= 0, nxpk= 0, iat= 148, 154, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 12 CYM HB3 14 TYR HN 4.63
&rst
ixpk= 0, nxpk= 0, iat= 148, 169, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, &end
#
# 12 CYM HB3 15 CYM HN 3.81
&rst
ixpk= 0, nxpk= 0, iat= 148, 190, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31, &end
#
# 12 CYM HB3 16 ASN HA 4.79
&rst
ixpk= 0, nxpk= 0, iat= 148, 202, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29, &end
#
# 12 CYM HB3 16 ASN HN 3.80
&rst
ixpk= 0, nxpk= 0, iat= 148, 200, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30, &end
#
# 12 CYM HB3 17 LYS HB2 4.79
&rst
ixpk= 0, nxpk= 0, iat= 148, 218, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29, &end
#
# 12 CYM HB3 17 LYS HB3 4.79
&rst
ixpk= 0, nxpk= 0, iat= 148, 219, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29, &end
#
# 12 CYM HB3 17 LYS HN 3.41
&rst
ixpk= 0, nxpk= 0, iat= 148, 214, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91, &end
#
# 12 CYM HB3 17 LYS QB 3.93
&rst
ixpk= 0, nxpk= 0, iat= 148, -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
igr2= 218, 219,
&end
#
# 12 CYM HB3 19 PHE QE 4.01
&rst
ixpk= 0, nxpk= 0, iat= 148, -1, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
igr2= 262, 266,
&end
#
# 12 CYM HB3 25 LEU QD1 3.86
&rst
ixpk= 0, nxpk= 0, iat= 148, -1, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
igr2= 373, 374, 375,
&end
#
# 12 CYM HB3 25 LEU QD2 5.48
&rst
ixpk= 0, nxpk= 0, iat= 148, -1, r1= 1.30, r2= 1.80, r3= 6.58, r4= 7.08,
igr2= 377, 378, 379,
&end
#
# 12 CYM HB3 28 HIS HD2 4.58
&rst
ixpk= 0, nxpk= 0, iat= 148, 423, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08, &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 3.23
&rst
ixpk= 0, nxpk= 0, iat= 144, 148, r1= 1.30, r2= 1.80, r3= 3.23, r4= 3.73, &end
#
# 12 CYM HN 13 GLU HN 4.73
&rst
ixpk= 0, nxpk= 0, iat= 144, 154, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, &end
#
# 12 CYM HN 15 CYM HN 5.14
&rst
ixpk= 0, nxpk= 0, iat= 144, 190, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64, &end
#
# 12 CYM HN 16 ASN HN 4.54
&rst
ixpk= 0, nxpk= 0, iat= 144, 200, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 12 CYM HN 17 LYS HN 4.17
&rst
ixpk= 0, nxpk= 0, iat= 144, 214, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67, &end
#
# 12 CYM HN 17 LYS QB 5.13
&rst
ixpk= 0, nxpk= 0, iat= 144, -1, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
igr2= 218, 219,
&end
#
# 12 CYM HN 18 VAL HA 4.06
&rst
ixpk= 0, nxpk= 0, iat= 144, 238, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56, &end
#
# 12 CYM HN 18 VAL QG1 4.31
&rst
ixpk= 0, nxpk= 0, iat= 144, -1, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
igr2= 242, 243, 244,
&end
#
# 12 CYM HN 18 VAL QG2 5.39
&rst
ixpk= 0, nxpk= 0, iat= 144, -1, r1= 1.30, r2= 1.80, r3= 6.47, r4= 6.97,
igr2= 246, 247, 248,
&end
#
# 12 CYM HN 19 PHE QD 4.46
&rst
ixpk= 0, nxpk= 0, iat= 144, -1, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
igr2= 260, 268,
&end
#
# 12 CYM HN 19 PHE QE 4.30
&rst
ixpk= 0, nxpk= 0, iat= 144, -1, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
igr2= 262, 266,
&end
#
# 12 CYM HN 25 LEU QD1 4.13
&rst
ixpk= 0, nxpk= 0, iat= 144, -1, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
igr2= 373, 374, 375,
&end
#
# 13 GLU HA 13 GLU HG2 3.96
&rst
ixpk= 0, nxpk= 0, iat= 156, 161, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46, &end
#
# 13 GLU HA 13 GLU HG3 3.96
&rst
ixpk= 0, nxpk= 0, iat= 156, 162, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46, &end
#
# 13 GLU HA 13 GLU QB 2.89
&rst
ixpk= 0, nxpk= 0, iat= 156, -1, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,
igr2= 158, 159,
&end
#
# 13 GLU HA 15 CYM HN 5.02
&rst
ixpk= 0, nxpk= 0, iat= 156, 190, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52, &end
#
# 13 GLU HG2 14 TYR QE 4.30
&rst
ixpk= 0, nxpk= 0, iat= 161, -1, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
igr2= 179, 184,
&end
#
# 13 GLU HG3 14 TYR QE 4.30
&rst
ixpk= 0, nxpk= 0, iat= 162, -1, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
igr2= 179, 184,
&end
#
# 13 GLU HN 13 GLU HG2 4.24
&rst
ixpk= 0, nxpk= 0, iat= 154, 161, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74, &end
#
# 13 GLU HN 13 GLU HG3 4.24
&rst
ixpk= 0, nxpk= 0, iat= 154, 162, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74, &end
#
# 13 GLU HN 13 GLU QB 3.32
&rst
ixpk= 0, nxpk= 0, iat= 154, -1, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23,
igr2= 158, 159,
&end
#
# 13 GLU HN 13 GLU QG 3.53
&rst
ixpk= 0, nxpk= 0, iat= 154, -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
igr2= 161, 162,
&end
#
# 13 GLU HN 14 TYR HN 3.65
&rst
ixpk= 0, nxpk= 0, iat= 154, 169, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15, &end
#
# 13 GLU HN 14 TYR QD 4.72
&rst
ixpk= 0, nxpk= 0, iat= 154, -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr2= 177, 186,
&end
#
# 13 GLU HN 15 CYM HN 4.95
&rst
ixpk= 0, nxpk= 0, iat= 154, 190, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45, &end
#
# 13 GLU HN 25 LEU QD1 4.48
&rst
ixpk= 0, nxpk= 0, iat= 154, -1, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
igr2= 373, 374, 375,
&end
#
# 13 GLU HN 29 LEU QD2 4.60
&rst
ixpk= 0, nxpk= 0, iat= 154, -1, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
igr2= 440, 441, 442,
&end
#
# 13 GLU QB 14 TYR HN 4.04
&rst
ixpk= 0, nxpk= 0, iat= -1, 169, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
igr1= 158, 159,
&end
#
# 13 GLU QB 14 TYR QD 4.53
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21,
igr1= 158, 159,
igr2= 177, 186,
&end
#
# 13 GLU QB 14 TYR QE 4.74
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr1= 158, 159,
igr2= 179, 184,
&end
#
# 13 GLU QG 14 TYR HN 4.16
&rst
ixpk= 0, nxpk= 0, iat= -1, 169, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
igr1= 161, 162,
&end
#
# 13 GLU QG 14 TYR QD 4.16
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr1= 161, 162,
igr2= 177, 186,
&end
#
# 13 GLU QG 14 TYR QE 3.66
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
igr1= 161, 162,
igr2= 179, 184,
&end
#
# 14 TYR HA 14 TYR QD 3.61
&rst
ixpk= 0, nxpk= 0, iat= 171, -1, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,
igr2= 177, 186,
&end
#
# 14 TYR HA 14 TYR QE 4.76
&rst
ixpk= 0, nxpk= 0, iat= 171, -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr2= 179, 184,
&end
#
# 14 TYR HB2 15 CYM HN 3.36
&rst
ixpk= 0, nxpk= 0, iat= 173, 190, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86, &end
#
# 14 TYR HB2 16 ASN HN 4.71
&rst
ixpk= 0, nxpk= 0, iat= 173, 200, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21, &end
#
# 14 TYR HB2 32 HIS HD2 4.30
&rst
ixpk= 0, nxpk= 0, iat= 173, 502, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80, &end
#
# 14 TYR HB2 32 HIS HE1 4.72
&rst
ixpk= 0, nxpk= 0, iat= 173, 499, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22, &end
#
# 14 TYR HB3 15 CYM HN 3.76
&rst
ixpk= 0, nxpk= 0, iat= 174, 190, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26, &end
#
# 14 TYR HB3 32 HIS HD2 4.63
&rst
ixpk= 0, nxpk= 0, iat= 174, 502, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, &end
#
# 14 TYR HB3 32 HIS HE1 4.47
&rst
ixpk= 0, nxpk= 0, iat= 174, 499, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97, &end
#
# 14 TYR HN 14 TYR HB2 3.27
&rst
ixpk= 0, nxpk= 0, iat= 169, 173, r1= 1.30, r2= 1.80, r3= 3.27, r4= 3.77, &end
#
# 14 TYR HN 14 TYR HB3 3.77
&rst
ixpk= 0, nxpk= 0, iat= 169, 174, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27, &end
#
# 14 TYR HN 14 TYR QD 3.45
&rst
ixpk= 0, nxpk= 0, iat= 169, -1, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,
igr2= 177, 186,
&end
#
# 14 TYR HN 14 TYR QE 4.79
&rst
ixpk= 0, nxpk= 0, iat= 169, -1, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
igr2= 179, 184,
&end
#
# 14 TYR HN 15 CYM HN 3.11
&rst
ixpk= 0, nxpk= 0, iat= 169, 190, r1= 1.30, r2= 1.80, r3= 3.11, r4= 3.61, &end
#
# 14 TYR HN 16 ASN HN 4.18
&rst
ixpk= 0, nxpk= 0, iat= 169, 200, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68, &end
#
# 14 TYR HN 16 ASN QD2 5.34
&rst
ixpk= 0, nxpk= 0, iat= 169, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2= 209, 210,
&end
#
# 14 TYR HN 25 LEU QD1 4.96
&rst
ixpk= 0, nxpk= 0, iat= 169, -1, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
igr2= 373, 374, 375,
&end
#
# 14 TYR HN 29 LEU QD2 4.65
&rst
ixpk= 0, nxpk= 0, iat= 169, -1, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr2= 440, 441, 442,
&end
#
# 14 TYR QD 15 CYM HN 4.29
&rst
ixpk= 0, nxpk= 0, iat= -1, 190, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
igr1= 177, 186,
&end
#
# 14 TYR QD 25 LEU QD1 4.64
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75,
igr1= 177, 186,
igr2= 373, 374, 375,
&end
#
# 14 TYR QD 29 LEU HA 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 429, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr1= 177, 186,
&end
#
# 14 TYR QD 29 LEU QD1 4.41
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
igr1= 177, 186,
igr2= 436, 437, 438,
&end
#
# 14 TYR QD 29 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= 177, 186,
igr2= 440, 441, 442,
&end
#
# 14 TYR QD 32 HIS HB2 4.56
&rst
ixpk= 0, nxpk= 0, iat= -1, 493, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
igr1= 177, 186,
&end
#
# 14 TYR QD 32 HIS HB3 4.80
&rst
ixpk= 0, nxpk= 0, iat= -1, 494, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr1= 177, 186,
&end
#
# 14 TYR QD 32 HIS HD2 4.04
&rst
ixpk= 0, nxpk= 0, iat= -1, 502, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
igr1= 177, 186,
&end
#
# 14 TYR QE 29 LEU QD1 4.38
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
igr1= 179, 184,
igr2= 436, 437, 438,
&end
#
# 14 TYR QE 29 LEU QD2 3.29
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
igr1= 179, 184,
igr2= 440, 441, 442,
&end
#
# 14 TYR QE 32 HIS HB3 4.64
&rst
ixpk= 0, nxpk= 0, iat= -1, 494, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,
igr1= 179, 184,
&end
#
# 14 TYR QE 33 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= 179, 184,
igr2= 512, 513, 514,
&end
#
# 15 CYM HA 16 ASN QB 4.81
&rst
ixpk= 0, nxpk= 0, iat= 192, -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr2= 204, 205,
&end
#
# 15 CYM HA 32 HIS HE1 4.46
&rst
ixpk= 0, nxpk= 0, iat= 192, 499, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, &end
#
# 15 CYM HB2 16 ASN HN 4.42
&rst
ixpk= 0, nxpk= 0, iat= 195, 200, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92, &end
#
# 15 CYM HB2 32 HIS HE1 4.15
&rst
ixpk= 0, nxpk= 0, iat= 195, 499, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65, &end
#
# 15 CYM HB3 16 ASN HN 4.55
&rst
ixpk= 0, nxpk= 0, iat= 194, 200, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05, &end
#
# 15 CYM HB3 17 LYS QB 5.34
&rst
ixpk= 0, nxpk= 0, iat= 194, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2= 218, 219,
&end
#
# 15 CYM HB3 31 ILE QD1 5.33
&rst
ixpk= 0, nxpk= 0, iat= 194, -1, r1= 1.30, r2= 1.80, r3= 6.40, r4= 6.90,
igr2= 483, 484, 485,
&end
#
# 15 CYM HB3 32 HIS HE1 3.38
&rst
ixpk= 0, nxpk= 0, iat= 194, 499, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88, &end
#
# 15 CYM HN 15 CYM HB2 4.02
&rst
ixpk= 0, nxpk= 0, iat= 190, 195, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52, &end
#
# 15 CYM HN 15 CYM HB3 3.52
&rst
ixpk= 0, nxpk= 0, iat= 190, 194, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02, &end
#
# 15 CYM HN 16 ASN HA 4.33
&rst
ixpk= 0, nxpk= 0, iat= 190, 202, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83, &end
#
# 15 CYM HN 16 ASN QD2 4.62
&rst
ixpk= 0, nxpk= 0, iat= 190, -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
igr2= 209, 210,
&end
#
# 15 CYM HN 17 LYS HN 4.27
&rst
ixpk= 0, nxpk= 0, iat= 190, 214, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77, &end
#
# 16 ASN HN 16 ASN HA 2.86
&rst
ixpk= 0, nxpk= 0, iat= 200, 202, r1= 1.30, r2= 1.80, r3= 2.86, r4= 3.36, &end
#
# 16 ASN HN 16 ASN QB 3.60
&rst
ixpk= 0, nxpk= 0, iat= 200, -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
igr2= 204, 205,
&end
#
# 16 ASN HN 17 LYS HN 3.52
&rst
ixpk= 0, nxpk= 0, iat= 200, 214, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02, &end
#
# 16 ASN HN 17 LYS QB 4.73
&rst
ixpk= 0, nxpk= 0, iat= 200, -1, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
igr2= 218, 219,
&end
#
# 16 ASN QB 16 ASN HD21 3.83
&rst
ixpk= 0, nxpk= 0, iat= -1, 209, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
igr1= 204, 205,
&end
#
# 16 ASN QB 16 ASN HD22 3.83
&rst
ixpk= 0, nxpk= 0, iat= -1, 210, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
igr1= 204, 205,
&end
#
# 16 ASN QB 16 ASN QD2 3.25
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59,
igr1= 204, 205,
igr2= 209, 210,
&end
#
# 16 ASN QB 17 LYS HA 4.76
&rst
ixpk= 0, nxpk= 0, iat= -1, 216, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr1= 204, 205,
&end
#
# 16 ASN QB 17 LYS HN 4.07
&rst
ixpk= 0, nxpk= 0, iat= -1, 214, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,
igr1= 204, 205,
&end
#
# 16 ASN QB 18 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= 204, 205,
igr2= 242, 243, 244,
&end
#
# 17 LYS HA 17 LYS HG2 3.78
&rst
ixpk= 0, nxpk= 0, iat= 216, 221, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28, &end
#
# 17 LYS HA 17 LYS HG3 3.78
&rst
ixpk= 0, nxpk= 0, iat= 216, 222, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28, &end
#
# 17 LYS HA 17 LYS QD 4.56
&rst
ixpk= 0, nxpk= 0, iat= 216, -1, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
igr2= 224, 225,
&end
#
# 17 LYS HA 17 LYS QE 5.34
&rst
ixpk= 0, nxpk= 0, iat= 216, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2= 227, 228,
&end
#
# 17 LYS HA 18 VAL HN 2.72
&rst
ixpk= 0, nxpk= 0, iat= 216, 236, r1= 1.30, r2= 1.80, r3= 2.72, r4= 3.22, &end
#
# 17 LYS HA 18 VAL QG1 4.55
&rst
ixpk= 0, nxpk= 0, iat= 216, -1, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
igr2= 242, 243, 244,
&end
#
# 17 LYS HA 18 VAL QG2 3.83
&rst
ixpk= 0, nxpk= 0, iat= 216, -1, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
igr2= 246, 247, 248,
&end
#
# 17 LYS HB2 18 VAL HN 4.33
&rst
ixpk= 0, nxpk= 0, iat= 218, 236, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83, &end
#
# 17 LYS HB2 19 PHE HZ 4.79
&rst
ixpk= 0, nxpk= 0, iat= 218, 264, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29, &end
#
# 17 LYS HB2 19 PHE QE 4.35
&rst
ixpk= 0, nxpk= 0, iat= 218, -1, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
igr2= 262, 266,
&end
#
# 17 LYS HB3 18 VAL HN 4.33
&rst
ixpk= 0, nxpk= 0, iat= 219, 236, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83, &end
#
# 17 LYS HB3 19 PHE HZ 4.79
&rst
ixpk= 0, nxpk= 0, iat= 219, 264, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29, &end
#
# 17 LYS HB3 19 PHE QE 4.35
&rst
ixpk= 0, nxpk= 0, iat= 219, -1, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
igr2= 262, 266,
&end
#
# 17 LYS HD2 19 PHE HZ 4.37
&rst
ixpk= 0, nxpk= 0, iat= 224, 264, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87, &end
#
# 17 LYS HD2 28 HIS HE1 4.84
&rst
ixpk= 0, nxpk= 0, iat= 224, 420, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34, &end
#
# 17 LYS HD3 19 PHE HZ 4.37
&rst
ixpk= 0, nxpk= 0, iat= 225, 264, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87, &end
#
# 17 LYS HD3 28 HIS HE1 4.84
&rst
ixpk= 0, nxpk= 0, iat= 225, 420, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34, &end
#
# 17 LYS HG2 17 LYS HE2 4.02
&rst
ixpk= 0, nxpk= 0, iat= 221, 227, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52, &end
#
# 17 LYS HG2 17 LYS HE3 4.02
&rst
ixpk= 0, nxpk= 0, iat= 221, 228, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52, &end
#
# 17 LYS HG2 18 VAL HN 3.91
&rst
ixpk= 0, nxpk= 0, iat= 221, 236, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41, &end
#
# 17 LYS HG3 17 LYS HE2 4.02
&rst
ixpk= 0, nxpk= 0, iat= 222, 227, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52, &end
#
# 17 LYS HG3 17 LYS HE3 4.02
&rst
ixpk= 0, nxpk= 0, iat= 222, 228, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52, &end
#
# 17 LYS HG3 18 VAL HN 3.91
&rst
ixpk= 0, nxpk= 0, iat= 222, 236, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41, &end
#
# 17 LYS HN 17 LYS HB2 3.43
&rst
ixpk= 0, nxpk= 0, iat= 214, 218, r1= 1.30, r2= 1.80, r3= 3.43, r4= 3.93, &end
#
# 17 LYS HN 17 LYS HB3 3.43
&rst
ixpk= 0, nxpk= 0, iat= 214, 219, r1= 1.30, r2= 1.80, r3= 3.43, r4= 3.93, &end
#
# 17 LYS HN 17 LYS HG2 4.74
&rst
ixpk= 0, nxpk= 0, iat= 214, 221, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24, &end
#
# 17 LYS HN 17 LYS HG3 4.74
&rst
ixpk= 0, nxpk= 0, iat= 214, 222, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24, &end
#
# 17 LYS HN 17 LYS QB 2.83
&rst
ixpk= 0, nxpk= 0, iat= 214, -1, r1= 1.30, r2= 1.80, r3= 3.18, r4= 3.68,
igr2= 218, 219,
&end
#
# 17 LYS HN 17 LYS QD 5.11
&rst
ixpk= 0, nxpk= 0, iat= 214, -1, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
igr2= 224, 225,
&end
#
# 17 LYS HN 18 VAL HN 4.58
&rst
ixpk= 0, nxpk= 0, iat= 214, 236, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08, &end
#
# 17 LYS HN 18 VAL QG1 5.26
&rst
ixpk= 0, nxpk= 0, iat= 214, -1, r1= 1.30, r2= 1.80, r3= 6.32, r4= 6.82,
igr2= 242, 243, 244,
&end
#
# 17 LYS HN 19 PHE QE 4.66
&rst
ixpk= 0, nxpk= 0, iat= 214, -1, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73,
igr2= 262, 266,
&end
#
# 17 LYS QB 17 LYS QD 3.32
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
igr1= 218, 219,
igr2= 224, 225,
&end
#
# 17 LYS QB 17 LYS QE 5.18
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.53, r4= 7.03,
igr1= 218, 219,
igr2= 227, 228,
&end
#
# 17 LYS QB 18 VAL HN 3.72
&rst
ixpk= 0, nxpk= 0, iat= -1, 236, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
igr1= 218, 219,
&end
#
# 17 LYS QB 18 VAL QG2 5.11
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.89, r4= 7.39,
igr1= 218, 219,
igr2= 246, 247, 248,
&end
#
# 17 LYS QB 19 PHE HZ 4.01
&rst
ixpk= 0, nxpk= 0, iat= -1, 264, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
igr1= 218, 219,
&end
#
# 17 LYS QB 19 PHE QE 3.75
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
igr1= 218, 219,
igr2= 262, 266,
&end
#
# 17 LYS QD 19 PHE HZ 3.70
&rst
ixpk= 0, nxpk= 0, iat= -1, 264, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65,
igr1= 224, 225,
&end
#
# 17 LYS QD 19 PHE QE 4.99
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.29, r4= 6.79,
igr1= 224, 225,
igr2= 262, 266,
&end
#
# 17 LYS QD 28 HIS HE1 4.07
&rst
ixpk= 0, nxpk= 0, iat= -1, 420, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,
igr1= 224, 225,
&end
#
# 17 LYS QE 19 PHE QE 4.51
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
igr1= 227, 228,
igr2= 262, 266,
&end
#
# 17 LYS QG 17 LYS QE 3.05
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
igr1= 221, 222,
igr2= 227, 228,
&end
#
# 17 LYS QG 18 VAL HN 3.28
&rst
ixpk= 0, nxpk= 0, iat= -1, 236, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18,
igr1= 221, 222,
&end
#
# 17 LYS QG 18 VAL QG2 4.48
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54,
igr1= 221, 222,
igr2= 246, 247, 248,
&end
#
# 18 VAL HA 18 VAL QG1 3.37
&rst
ixpk= 0, nxpk= 0, iat= 238, -1, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,
igr2= 242, 243, 244,
&end
#
# 18 VAL HA 18 VAL QG2 3.46
&rst
ixpk= 0, nxpk= 0, iat= 238, -1, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
igr2= 246, 247, 248,
&end
#
# 18 VAL HA 19 PHE HN 2.93
&rst
ixpk= 0, nxpk= 0, iat= 238, 252, r1= 1.30, r2= 1.80, r3= 2.93, r4= 3.43, &end
#
# 18 VAL HB 19 PHE HN 3.69
&rst
ixpk= 0, nxpk= 0, iat= 240, 252, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19, &end
#
# 18 VAL HN 18 VAL HB 3.66
&rst
ixpk= 0, nxpk= 0, iat= 236, 240, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16, &end
#
# 18 VAL HN 18 VAL QG1 3.98
&rst
ixpk= 0, nxpk= 0, iat= 236, -1, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
igr2= 242, 243, 244,
&end
#
# 18 VAL HN 18 VAL QG2 3.13
&rst
ixpk= 0, nxpk= 0, iat= 236, -1, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,
igr2= 246, 247, 248,
&end
#
# 18 VAL HN 19 PHE HN 4.57
&rst
ixpk= 0, nxpk= 0, iat= 236, 252, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07, &end
#
# 18 VAL QG1 19 PHE HN 3.38
&rst
ixpk= 0, nxpk= 0, iat= -1, 252, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,
igr1= 242, 243, 244,
&end
#
# 18 VAL QG2 19 PHE HN 4.15
&rst
ixpk= 0, nxpk= 0, iat= -1, 252, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
igr1= 246, 247, 248,
&end
#
# 19 PHE HA 19 PHE QD 3.54
&rst
ixpk= 0, nxpk= 0, iat= 254, -1, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47,
igr2= 260, 268,
&end
#
# 19 PHE HA 21 PHE HN 4.76
&rst
ixpk= 0, nxpk= 0, iat= 254, 294, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26, &end
#
# 19 PHE HB2 20 LYS QG 5.34
&rst
ixpk= 0, nxpk= 0, iat= 256, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2= 279, 280,
&end
#
# 19 PHE HB2 21 PHE HN 4.17
&rst
ixpk= 0, nxpk= 0, iat= 256, 294, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67, &end
#
# 19 PHE HB2 24 SER HB2 4.55
&rst
ixpk= 0, nxpk= 0, iat= 256, 357, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05, &end
#
# 19 PHE HB2 24 SER HB3 4.52
&rst
ixpk= 0, nxpk= 0, iat= 256, 358, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02, &end
#
# 19 PHE HB2 25 LEU HA 4.94
&rst
ixpk= 0, nxpk= 0, iat= 256, 366, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44, &end
#
# 19 PHE HB2 25 LEU HB2 4.31
&rst
ixpk= 0, nxpk= 0, iat= 256, 368, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81, &end
#
# 19 PHE HB2 25 LEU HB3 4.64
&rst
ixpk= 0, nxpk= 0, iat= 256, 369, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14, &end
#
# 19 PHE HB2 25 LEU HN 4.40
&rst
ixpk= 0, nxpk= 0, iat= 256, 364, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 19 PHE HB2 25 LEU QD1 4.53
&rst
ixpk= 0, nxpk= 0, iat= 256, -1, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
igr2= 373, 374, 375,
&end
#
# 19 PHE HB3 20 LYS HB2 4.84
&rst
ixpk= 0, nxpk= 0, iat= 257, 276, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34, &end
#
# 19 PHE HB3 20 LYS QG 4.48
&rst
ixpk= 0, nxpk= 0, iat= 257, -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
igr2= 279, 280,
&end
#
# 19 PHE HB3 21 PHE HN 3.48
&rst
ixpk= 0, nxpk= 0, iat= 257, 294, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98, &end
#
# 19 PHE HB3 24 SER HB2 4.02
&rst
ixpk= 0, nxpk= 0, iat= 257, 357, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52, &end
#
# 19 PHE HB3 24 SER HB3 4.21
&rst
ixpk= 0, nxpk= 0, iat= 257, 358, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71, &end
#
# 19 PHE HB3 25 LEU HA 4.84
&rst
ixpk= 0, nxpk= 0, iat= 257, 366, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34, &end
#
# 19 PHE HB3 25 LEU HB2 4.68
&rst
ixpk= 0, nxpk= 0, iat= 257, 368, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18, &end
#
# 19 PHE HB3 25 LEU HN 4.28
&rst
ixpk= 0, nxpk= 0, iat= 257, 364, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78, &end
#
# 19 PHE HN 19 PHE HB2 3.58
&rst
ixpk= 0, nxpk= 0, iat= 252, 256, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08, &end
#
# 19 PHE HN 19 PHE HB3 4.09
&rst
ixpk= 0, nxpk= 0, iat= 252, 257, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59, &end
#
# 19 PHE HN 19 PHE QD 3.34
&rst
ixpk= 0, nxpk= 0, iat= 252, -1, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,
igr2= 260, 268,
&end
#
# 19 PHE HN 19 PHE QE 4.79
&rst
ixpk= 0, nxpk= 0, iat= 252, -1, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
igr2= 262, 266,
&end
#
# 19 PHE HZ 25 LEU QD1 4.46
&rst
ixpk= 0, nxpk= 0, iat= 264, -1, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
igr2= 373, 374, 375,
&end
#
# 19 PHE HZ 28 HIS HB2 4.35
&rst
ixpk= 0, nxpk= 0, iat= 264, 414, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85, &end
#
# 19 PHE HZ 28 HIS HB3 4.47
&rst
ixpk= 0, nxpk= 0, iat= 264, 415, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97, &end
#
# 19 PHE HZ 28 HIS HD2 4.73
&rst
ixpk= 0, nxpk= 0, iat= 264, 423, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, &end
#
# 19 PHE HZ 28 HIS HE1 4.75
&rst
ixpk= 0, nxpk= 0, iat= 264, 420, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, &end
#
# 19 PHE QD 19 PHE HZ 4.10
&rst
ixpk= 0, nxpk= 0, iat= -1, 264, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
igr1= 260, 268,
&end
#
# 19 PHE QD 24 SER HA 4.55
&rst
ixpk= 0, nxpk= 0, iat= -1, 355, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,
igr1= 260, 268,
&end
#
# 19 PHE QD 24 SER HB2 3.99
&rst
ixpk= 0, nxpk= 0, iat= -1, 357, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
igr1= 260, 268,
&end
#
# 19 PHE QD 24 SER HB3 3.66
&rst
ixpk= 0, nxpk= 0, iat= -1, 358, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
igr1= 260, 268,
&end
#
# 19 PHE QD 25 LEU HA 4.27
&rst
ixpk= 0, nxpk= 0, iat= -1, 366, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
igr1= 260, 268,
&end
#
# 19 PHE QD 25 LEU HB2 4.26
&rst
ixpk= 0, nxpk= 0, iat= -1, 368, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
igr1= 260, 268,
&end
#
# 19 PHE QD 25 LEU HB3 4.85
&rst
ixpk= 0, nxpk= 0, iat= -1, 369, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
igr1= 260, 268,
&end
#
# 19 PHE QD 25 LEU HN 4.12
&rst
ixpk= 0, nxpk= 0, iat= -1, 364, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
igr1= 260, 268,
&end
#
# 19 PHE QD 25 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= 260, 268,
igr2= 373, 374, 375,
&end
#
# 19 PHE QD 25 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= 260, 268,
igr2= 377, 378, 379,
&end
#
# 19 PHE QD 28 HIS HB2 5.12
&rst
ixpk= 0, nxpk= 0, iat= -1, 414, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
igr1= 260, 268,
&end
#
# 19 PHE QE 25 LEU HA 4.44
&rst
ixpk= 0, nxpk= 0, iat= -1, 366, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
igr1= 262, 266,
&end
#
# 19 PHE QE 25 LEU QD1 3.68
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
igr1= 262, 266,
igr2= 373, 374, 375,
&end
#
# 19 PHE QE 25 LEU QD2 4.58
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 262, 266,
igr2= 377, 378, 379,
&end
#
# 19 PHE QE 28 HIS HB2 4.06
&rst
ixpk= 0, nxpk= 0, iat= -1, 414, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
igr1= 262, 266,
&end
#
# 19 PHE QE 28 HIS HB3 4.54
&rst
ixpk= 0, nxpk= 0, iat= -1, 415, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
igr1= 262, 266,
&end
#
# 19 PHE QE 28 HIS HD2 4.20
&rst
ixpk= 0, nxpk= 0, iat= -1, 423, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
igr1= 262, 266,
&end
#
# 20 LYS HA 20 LYS HG2 4.04
&rst
ixpk= 0, nxpk= 0, iat= 274, 279, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, &end
#
# 20 LYS HA 20 LYS HG3 4.04
&rst
ixpk= 0, nxpk= 0, iat= 274, 280, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, &end
#
# 20 LYS HA 20 LYS QD 4.09
&rst
ixpk= 0, nxpk= 0, iat= 274, -1, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
igr2= 282, 283,
&end
#
# 20 LYS HA 20 LYS QG 3.51
&rst
ixpk= 0, nxpk= 0, iat= 274, -1, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,
igr2= 279, 280,
&end
#
# 20 LYS HB2 21 PHE HN 3.99
&rst
ixpk= 0, nxpk= 0, iat= 276, 294, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49, &end
#
# 20 LYS HB2 21 PHE QD 4.46
&rst
ixpk= 0, nxpk= 0, iat= 276, -1, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
igr2= 302, 310,
&end
#
# 20 LYS HB2 24 SER HB3 5.50
&rst
ixpk= 0, nxpk= 0, iat= 276, 358, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 20 LYS HB3 20 LYS QE 4.46
&rst
ixpk= 0, nxpk= 0, iat= 277, -1, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
igr2= 285, 286,
&end
#
# 20 LYS HB3 21 PHE HN 4.02
&rst
ixpk= 0, nxpk= 0, iat= 277, 294, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52, &end
#
# 20 LYS HB3 21 PHE QD 4.49
&rst
ixpk= 0, nxpk= 0, iat= 277, -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr2= 302, 310,
&end
#
# 20 LYS HB3 21 PHE QE 4.71
&rst
ixpk= 0, nxpk= 0, iat= 277, -1, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,
igr2= 304, 308,
&end
#
# 20 LYS HG2 20 LYS QE 4.02
&rst
ixpk= 0, nxpk= 0, iat= 279, -1, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,
igr2= 285, 286,
&end
#
# 20 LYS HG3 20 LYS QE 4.02
&rst
ixpk= 0, nxpk= 0, iat= 280, -1, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,
igr2= 285, 286,
&end
#
# 20 LYS HN 21 PHE HN 4.53
&rst
ixpk= 0, nxpk= 0, iat= 272, 294, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03, &end
#
# 20 LYS QD 21 PHE QD 4.81
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
igr1= 282, 283,
igr2= 302, 310,
&end
#
# 20 LYS QD 21 PHE QE 5.32
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.70, r4= 7.20,
igr1= 282, 283,
igr2= 304, 308,
&end
#
# 20 LYS QE 21 PHE QE 5.27
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.64, r4= 7.14,
igr1= 285, 286,
igr2= 304, 308,
&end
#
# 20 LYS QG 20 LYS QE 3.47
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
igr1= 279, 280,
igr2= 285, 286,
&end
#
# 20 LYS QG 21 PHE HN 4.76
&rst
ixpk= 0, nxpk= 0, iat= -1, 294, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr1= 279, 280,
&end
#
# 21 PHE HA 21 PHE QD 3.70
&rst
ixpk= 0, nxpk= 0, iat= 296, -1, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65,
igr2= 302, 310,
&end
#
# 21 PHE HB2 24 SER HB2 4.74
&rst
ixpk= 0, nxpk= 0, iat= 298, 357, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24, &end
#
# 21 PHE HB2 24 SER HN 3.83
&rst
ixpk= 0, nxpk= 0, iat= 298, 353, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33, &end
#
# 21 PHE HB3 24 SER HB2 4.74
&rst
ixpk= 0, nxpk= 0, iat= 299, 357, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24, &end
#
# 21 PHE HB3 24 SER HN 3.83
&rst
ixpk= 0, nxpk= 0, iat= 299, 353, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33, &end
#
# 21 PHE HN 21 PHE HB2 3.79
&rst
ixpk= 0, nxpk= 0, iat= 294, 298, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29, &end
#
# 21 PHE HN 21 PHE HB3 3.79
&rst
ixpk= 0, nxpk= 0, iat= 294, 299, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29, &end
#
# 21 PHE HN 21 PHE QB 3.21
&rst
ixpk= 0, nxpk= 0, iat= 294, -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr2= 298, 299,
&end
#
# 21 PHE HN 21 PHE QD 3.59
&rst
ixpk= 0, nxpk= 0, iat= 294, -1, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,
igr2= 302, 310,
&end
#
# 21 PHE HN 24 SER HB2 3.79
&rst
ixpk= 0, nxpk= 0, iat= 294, 357, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29, &end
#
# 21 PHE HN 24 SER HB3 4.36
&rst
ixpk= 0, nxpk= 0, iat= 294, 358, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86, &end
#
# 21 PHE HN 24 SER HN 4.35
&rst
ixpk= 0, nxpk= 0, iat= 294, 353, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85, &end
#
# 21 PHE QB 23 HIS HD2 4.71
&rst
ixpk= 0, nxpk= 0, iat= -1, 349, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,
igr1= 298, 299,
&end
#
# 21 PHE QB 23 HIS HE1 4.41
&rst
ixpk= 0, nxpk= 0, iat= -1, 346, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr1= 298, 299,
&end
#
# 21 PHE QB 24 SER HB2 4.11
&rst
ixpk= 0, nxpk= 0, iat= -1, 357, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
igr1= 298, 299,
&end
#
# 21 PHE QB 24 SER HB3 4.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 358, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
igr1= 298, 299,
&end
#
# 21 PHE QB 24 SER HN 3.31
&rst
ixpk= 0, nxpk= 0, iat= -1, 353, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,
igr1= 298, 299,
&end
#
# 21 PHE QB 25 LEU HN 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, 364, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1= 298, 299,
&end
#
# 21 PHE QD 24 SER HN 4.95
&rst
ixpk= 0, nxpk= 0, iat= -1, 353, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
igr1= 302, 310,
&end
#
# 22 LYS HA 22 LYS HG2 3.72
&rst
ixpk= 0, nxpk= 0, iat= 316, 321, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22, &end
#
# 22 LYS HA 22 LYS HG3 3.42
&rst
ixpk= 0, nxpk= 0, iat= 316, 322, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92, &end
#
# 22 LYS HA 25 LEU HB2 4.69
&rst
ixpk= 0, nxpk= 0, iat= 316, 368, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, &end
#
# 22 LYS HA 25 LEU HB3 3.79
&rst
ixpk= 0, nxpk= 0, iat= 316, 369, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29, &end
#
# 22 LYS HA 25 LEU HN 3.94
&rst
ixpk= 0, nxpk= 0, iat= 316, 364, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44, &end
#
# 22 LYS HA 26 GLN HN 4.48
&rst
ixpk= 0, nxpk= 0, iat= 316, 383, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98, &end
#
# 22 LYS HG2 23 HIS HA 4.68
&rst
ixpk= 0, nxpk= 0, iat= 321, 338, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18, &end
#
# 22 LYS HG2 24 SER HN 5.27
&rst
ixpk= 0, nxpk= 0, iat= 321, 353, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77, &end
#
# 22 LYS HG2 26 GLN HG2 4.53
&rst
ixpk= 0, nxpk= 0, iat= 321, 390, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03, &end
#
# 22 LYS HG2 26 GLN HG3 4.53
&rst
ixpk= 0, nxpk= 0, iat= 321, 391, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03, &end
#
# 22 LYS HG2 26 GLN HN 4.37
&rst
ixpk= 0, nxpk= 0, iat= 321, 383, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87, &end
#
# 22 LYS HG3 26 GLN HG2 4.79
&rst
ixpk= 0, nxpk= 0, iat= 322, 390, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29, &end
#
# 22 LYS HG3 26 GLN HG3 4.79
&rst
ixpk= 0, nxpk= 0, iat= 322, 391, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29, &end
#
# 22 LYS HG3 26 GLN QG 3.94
&rst
ixpk= 0, nxpk= 0, iat= 322, -1, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
igr2= 390, 391,
&end
#
# 22 LYS QB 22 LYS QD 3.31
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,
igr1= 318, 319,
igr2= 324, 325,
&end
#
# 23 HIS HA 23 HIS HD2 5.00
&rst
ixpk= 0, nxpk= 0, iat= 338, 349, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 23 HIS HA 25 LEU HN 4.50
&rst
ixpk= 0, nxpk= 0, iat= 338, 364, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 23 HIS HA 26 GLN HB2 3.55
&rst
ixpk= 0, nxpk= 0, iat= 338, 387, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05, &end
#
# 23 HIS HA 26 GLN HB3 4.12
&rst
ixpk= 0, nxpk= 0, iat= 338, 388, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62, &end
#
# 23 HIS HA 26 GLN HG2 4.43
&rst
ixpk= 0, nxpk= 0, iat= 338, 390, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93, &end
#
# 23 HIS HA 26 GLN HG3 4.43
&rst
ixpk= 0, nxpk= 0, iat= 338, 391, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93, &end
#
# 23 HIS HA 26 GLN HN 3.70
&rst
ixpk= 0, nxpk= 0, iat= 338, 383, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20, &end
#
# 23 HIS HA 27 ALA HN 4.26
&rst
ixpk= 0, nxpk= 0, iat= 338, 400, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76, &end
#
# 23 HIS HB2 24 SER HN 4.61
&rst
ixpk= 0, nxpk= 0, iat= 340, 353, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 23 HIS HB3 24 SER HN 4.61
&rst
ixpk= 0, nxpk= 0, iat= 341, 353, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 23 HIS HD2 24 SER HN 3.57
&rst
ixpk= 0, nxpk= 0, iat= 349, 353, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07, &end
#
# 23 HIS QB 24 SER HN 3.90
&rst
ixpk= 0, nxpk= 0, iat= -1, 353, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
igr1= 340, 341,
&end
#
# 23 HIS QB 27 ALA HN 5.07
&rst
ixpk= 0, nxpk= 0, iat= -1, 400, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
igr1= 340, 341,
&end
#
# 23 HIS QB 27 ALA QB 4.53
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
igr1= 340, 341,
igr2= 404, 405, 406,
&end
#
# 24 SER HA 27 ALA HN 4.18
&rst
ixpk= 0, nxpk= 0, iat= 355, 400, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68, &end
#
# 24 SER HA 27 ALA QB 3.48
&rst
ixpk= 0, nxpk= 0, iat= 355, -1, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
igr2= 404, 405, 406,
&end
#
# 24 SER HB2 25 LEU HN 3.60
&rst
ixpk= 0, nxpk= 0, iat= 357, 364, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10, &end
#
# 24 SER HB3 25 LEU HN 4.04
&rst
ixpk= 0, nxpk= 0, iat= 358, 364, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, &end
#
# 24 SER HB3 26 GLN HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 358, 383, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 24 SER HB3 27 ALA QB 5.50
&rst
ixpk= 0, nxpk= 0, iat= 358, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2= 404, 405, 406,
&end
#
# 24 SER HN 24 SER HB2 3.66
&rst
ixpk= 0, nxpk= 0, iat= 353, 357, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16, &end
#
# 24 SER HN 24 SER HB3 3.83
&rst
ixpk= 0, nxpk= 0, iat= 353, 358, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33, &end
#
# 24 SER HN 25 LEU HB3 5.22
&rst
ixpk= 0, nxpk= 0, iat= 353, 369, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72, &end
#
# 24 SER HN 25 LEU HN 3.25
&rst
ixpk= 0, nxpk= 0, iat= 353, 364, r1= 1.30, r2= 1.80, r3= 3.25, r4= 3.75, &end
#
# 24 SER HN 26 GLN HN 4.61
&rst
ixpk= 0, nxpk= 0, iat= 353, 383, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 25 LEU HA 25 LEU HG 4.04
&rst
ixpk= 0, nxpk= 0, iat= 366, 371, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, &end
#
# 25 LEU HA 25 LEU QD1 3.08
&rst
ixpk= 0, nxpk= 0, iat= 366, -1, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,
igr2= 373, 374, 375,
&end
#
# 25 LEU HA 27 ALA HN 4.71
&rst
ixpk= 0, nxpk= 0, iat= 366, 400, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21, &end
#
# 25 LEU HA 27 ALA QB 5.12
&rst
ixpk= 0, nxpk= 0, iat= 366, -1, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
igr2= 404, 405, 406,
&end
#
# 25 LEU HA 28 HIS HB2 3.84
&rst
ixpk= 0, nxpk= 0, iat= 366, 414, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34, &end
#
# 25 LEU HA 28 HIS HB3 3.56
&rst
ixpk= 0, nxpk= 0, iat= 366, 415, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06, &end
#
# 25 LEU HA 28 HIS HD2 4.41
&rst
ixpk= 0, nxpk= 0, iat= 366, 423, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, &end
#
# 25 LEU HA 28 HIS HN 3.76
&rst
ixpk= 0, nxpk= 0, iat= 366, 410, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26, &end
#
# 25 LEU HA 29 LEU HN 4.37
&rst
ixpk= 0, nxpk= 0, iat= 366, 427, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87, &end
#
# 25 LEU HB2 25 LEU QD1 3.49
&rst
ixpk= 0, nxpk= 0, iat= 368, -1, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,
igr2= 373, 374, 375,
&end
#
# 25 LEU HB2 25 LEU QD2 3.55
&rst
ixpk= 0, nxpk= 0, iat= 368, -1, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,
igr2= 377, 378, 379,
&end
#
# 25 LEU HB2 26 GLN HN 4.50
&rst
ixpk= 0, nxpk= 0, iat= 368, 383, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 25 LEU HB3 25 LEU QD1 3.68
&rst
ixpk= 0, nxpk= 0, iat= 369, -1, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
igr2= 373, 374, 375,
&end
#
# 25 LEU HB3 25 LEU QD2 3.40
&rst
ixpk= 0, nxpk= 0, iat= 369, -1, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,
igr2= 377, 378, 379,
&end
#
# 25 LEU HB3 26 GLN HN 3.44
&rst
ixpk= 0, nxpk= 0, iat= 369, 383, r1= 1.30, r2= 1.80, r3= 3.44, r4= 3.94, &end
#
# 25 LEU HB3 27 ALA HN 5.37
&rst
ixpk= 0, nxpk= 0, iat= 369, 400, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87, &end
#
# 25 LEU HG 26 GLN HA 4.70
&rst
ixpk= 0, nxpk= 0, iat= 371, 385, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 25 LEU HG 26 GLN HN 4.00
&rst
ixpk= 0, nxpk= 0, iat= 371, 383, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 25 LEU HG 29 LEU HG 4.13
&rst
ixpk= 0, nxpk= 0, iat= 371, 434, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63, &end
#
# 25 LEU HN 25 LEU HB2 3.26
&rst
ixpk= 0, nxpk= 0, iat= 364, 368, r1= 1.30, r2= 1.80, r3= 3.26, r4= 3.76, &end
#
# 25 LEU HN 25 LEU HB3 3.17
&rst
ixpk= 0, nxpk= 0, iat= 364, 369, r1= 1.30, r2= 1.80, r3= 3.17, r4= 3.67, &end
#
# 25 LEU HN 25 LEU HG 4.38
&rst
ixpk= 0, nxpk= 0, iat= 364, 371, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88, &end
#
# 25 LEU HN 25 LEU QD1 4.48
&rst
ixpk= 0, nxpk= 0, iat= 364, -1, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
igr2= 373, 374, 375,
&end
#
# 25 LEU HN 25 LEU QD2 4.23
&rst
ixpk= 0, nxpk= 0, iat= 364, -1, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
igr2= 377, 378, 379,
&end
#
# 25 LEU HN 26 GLN HN 3.34
&rst
ixpk= 0, nxpk= 0, iat= 364, 383, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84, &end
#
# 25 LEU HN 26 GLN QG 5.34
&rst
ixpk= 0, nxpk= 0, iat= 364, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2= 390, 391,
&end
#
# 25 LEU HN 27 ALA HN 4.43
&rst
ixpk= 0, nxpk= 0, iat= 364, 400, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93, &end
#
# 25 LEU HN 28 HIS HN 4.81
&rst
ixpk= 0, nxpk= 0, iat= 364, 410, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31, &end
#
# 25 LEU QD1 26 GLN HA 5.04
&rst
ixpk= 0, nxpk= 0, iat= -1, 385, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
igr1= 373, 374, 375,
&end
#
# 25 LEU QD1 26 GLN HN 4.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 383, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr1= 373, 374, 375,
&end
#
# 25 LEU QD1 28 HIS HA 5.45
&rst
ixpk= 0, nxpk= 0, iat= -1, 412, r1= 1.30, r2= 1.80, r3= 6.55, r4= 7.05,
igr1= 373, 374, 375,
&end
#
# 25 LEU QD1 28 HIS HB2 4.57
&rst
ixpk= 0, nxpk= 0, iat= -1, 414, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
igr1= 373, 374, 375,
&end
#
# 25 LEU QD1 28 HIS HB3 4.03
&rst
ixpk= 0, nxpk= 0, iat= -1, 415, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
igr1= 373, 374, 375,
&end
#
# 25 LEU QD1 28 HIS HD2 3.48
&rst
ixpk= 0, nxpk= 0, iat= -1, 423, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
igr1= 373, 374, 375,
&end
#
# 25 LEU QD1 28 HIS HN 4.28
&rst
ixpk= 0, nxpk= 0, iat= -1, 410, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
igr1= 373, 374, 375,
&end
#
# 25 LEU QD1 29 LEU HA 4.78
&rst
ixpk= 0, nxpk= 0, iat= -1, 429, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
igr1= 373, 374, 375,
&end
#
# 25 LEU QD1 29 LEU HG 3.56
&rst
ixpk= 0, nxpk= 0, iat= -1, 434, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,
igr1= 373, 374, 375,
&end
#
# 25 LEU QD1 29 LEU HN 4.09
&rst
ixpk= 0, nxpk= 0, iat= -1, 427, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
igr1= 373, 374, 375,
&end
#
# 25 LEU QD1 29 LEU QD2 3.29
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25,
igr1= 373, 374, 375,
igr2= 440, 441, 442,
&end
#
# 25 LEU QD2 26 GLN HA 4.62
&rst
ixpk= 0, nxpk= 0, iat= -1, 385, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,
igr1= 377, 378, 379,
&end
#
# 25 LEU QD2 26 GLN HN 4.21
&rst
ixpk= 0, nxpk= 0, iat= -1, 383, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
igr1= 377, 378, 379,
&end
#
# 26 GLN HA 26 GLN HG2 4.01
&rst
ixpk= 0, nxpk= 0, iat= 385, 390, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51, &end
#
# 26 GLN HA 26 GLN HG3 4.01
&rst
ixpk= 0, nxpk= 0, iat= 385, 391, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51, &end
#
# 26 GLN HA 26 GLN QG 3.49
&rst
ixpk= 0, nxpk= 0, iat= 385, -1, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
igr2= 390, 391,
&end
#
# 26 GLN HA 27 ALA QB 5.04
&rst
ixpk= 0, nxpk= 0, iat= 385, -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
igr2= 404, 405, 406,
&end
#
# 26 GLN HA 28 HIS HN 4.60
&rst
ixpk= 0, nxpk= 0, iat= 385, 410, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 26 GLN HA 29 LEU HB2 3.85
&rst
ixpk= 0, nxpk= 0, iat= 385, 431, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35, &end
#
# 26 GLN HA 29 LEU HB3 5.07
&rst
ixpk= 0, nxpk= 0, iat= 385, 432, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, &end
#
# 26 GLN HA 29 LEU HG 3.78
&rst
ixpk= 0, nxpk= 0, iat= 385, 434, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28, &end
#
# 26 GLN HA 29 LEU HN 4.23
&rst
ixpk= 0, nxpk= 0, iat= 385, 427, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73, &end
#
# 26 GLN HA 29 LEU QD1 3.19
&rst
ixpk= 0, nxpk= 0, iat= 385, -1, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,
igr2= 436, 437, 438,
&end
#
# 26 GLN HA 29 LEU QD2 4.19
&rst
ixpk= 0, nxpk= 0, iat= 385, -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
igr2= 440, 441, 442,
&end
#
# 26 GLN HA 30 ARG HN 5.38
&rst
ixpk= 0, nxpk= 0, iat= 385, 446, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88, &end
#
# 26 GLN HB2 27 ALA HN 3.65
&rst
ixpk= 0, nxpk= 0, iat= 387, 400, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15, &end
#
# 26 GLN HB2 27 ALA QB 4.63
&rst
ixpk= 0, nxpk= 0, iat= 387, -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
igr2= 404, 405, 406,
&end
#
# 26 GLN HB2 29 LEU QD1 4.85
&rst
ixpk= 0, nxpk= 0, iat= 387, -1, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32,
igr2= 436, 437, 438,
&end
#
# 26 GLN HB3 27 ALA HN 3.64
&rst
ixpk= 0, nxpk= 0, iat= 388, 400, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14, &end
#
# 26 GLN HB3 27 ALA QB 5.00
&rst
ixpk= 0, nxpk= 0, iat= 388, -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr2= 404, 405, 406,
&end
#
# 26 GLN HB3 29 LEU QD1 4.45
&rst
ixpk= 0, nxpk= 0, iat= 388, -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr2= 436, 437, 438,
&end
#
# 26 GLN HN 26 GLN HB2 3.18
&rst
ixpk= 0, nxpk= 0, iat= 383, 387, r1= 1.30, r2= 1.80, r3= 3.18, r4= 3.68, &end
#
# 26 GLN HN 26 GLN HB3 3.66
&rst
ixpk= 0, nxpk= 0, iat= 383, 388, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16, &end
#
# 26 GLN HN 26 GLN HG2 3.69
&rst
ixpk= 0, nxpk= 0, iat= 383, 390, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19, &end
#
# 26 GLN HN 26 GLN HG3 3.69
&rst
ixpk= 0, nxpk= 0, iat= 383, 391, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19, &end
#
# 26 GLN HN 27 ALA HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= 383, 402, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 26 GLN HN 27 ALA HN 3.43
&rst
ixpk= 0, nxpk= 0, iat= 383, 400, r1= 1.30, r2= 1.80, r3= 3.43, r4= 3.93, &end
#
# 26 GLN HN 27 ALA QB 4.71
&rst
ixpk= 0, nxpk= 0, iat= 383, -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr2= 404, 405, 406,
&end
#
# 26 GLN HN 28 HIS HB3 4.96
&rst
ixpk= 0, nxpk= 0, iat= 383, 415, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46, &end
#
# 26 GLN HN 29 LEU QD1 4.63
&rst
ixpk= 0, nxpk= 0, iat= 383, -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
igr2= 436, 437, 438,
&end
#
# 26 GLN HN 29 LEU QD2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 383, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2= 440, 441, 442,
&end
#
# 26 GLN QG 27 ALA HN 4.73
&rst
ixpk= 0, nxpk= 0, iat= -1, 400, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
igr1= 390, 391,
&end
#
# 26 GLN QG 29 LEU QD1 4.62
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.23, r4= 6.73,
igr1= 390, 391,
igr2= 436, 437, 438,
&end
#
# 27 ALA HA 29 LEU HN 4.65
&rst
ixpk= 0, nxpk= 0, iat= 402, 427, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15, &end
#
# 27 ALA HA 30 ARG HG2 4.14
&rst
ixpk= 0, nxpk= 0, iat= 402, 453, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64, &end
#
# 27 ALA HA 30 ARG HG3 4.14
&rst
ixpk= 0, nxpk= 0, iat= 402, 454, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64, &end
#
# 27 ALA HA 30 ARG HN 4.44
&rst
ixpk= 0, nxpk= 0, iat= 402, 446, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94, &end
#
# 27 ALA HA 30 ARG QD 3.96
&rst
ixpk= 0, nxpk= 0, iat= 402, -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
igr2= 456, 457,
&end
#
# 27 ALA HA 30 ARG QG 3.57
&rst
ixpk= 0, nxpk= 0, iat= 402, -1, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,
igr2= 453, 454,
&end
#
# 27 ALA HN 27 ALA QB 2.81
&rst
ixpk= 0, nxpk= 0, iat= 400, -1, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87,
igr2= 404, 405, 406,
&end
#
# 27 ALA HN 28 HIS HB2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 400, 414, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 27 ALA HN 28 HIS HB3 5.50
&rst
ixpk= 0, nxpk= 0, iat= 400, 415, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 27 ALA HN 29 LEU QD1 5.22
&rst
ixpk= 0, nxpk= 0, iat= 400, -1, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
igr2= 436, 437, 438,
&end
#
# 27 ALA QB 28 HIS HA 4.27
&rst
ixpk= 0, nxpk= 0, iat= -1, 412, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
igr1= 404, 405, 406,
&end
#
# 27 ALA QB 28 HIS HB2 4.52
&rst
ixpk= 0, nxpk= 0, iat= -1, 414, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
igr1= 404, 405, 406,
&end
#
# 27 ALA QB 28 HIS HB3 5.22
&rst
ixpk= 0, nxpk= 0, iat= -1, 415, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
igr1= 404, 405, 406,
&end
#
# 27 ALA QB 28 HIS HN 3.12
&rst
ixpk= 0, nxpk= 0, iat= -1, 410, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,
igr1= 404, 405, 406,
&end
#
# 27 ALA QB 29 LEU HG 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 434, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 404, 405, 406,
&end
#
# 27 ALA QB 30 ARG HB2 5.10
&rst
ixpk= 0, nxpk= 0, iat= -1, 450, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,
igr1= 404, 405, 406,
&end
#
# 27 ALA QB 30 ARG HN 4.97
&rst
ixpk= 0, nxpk= 0, iat= -1, 446, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr1= 404, 405, 406,
&end
#
# 27 ALA QB 30 ARG QD 4.44
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1= 404, 405, 406,
igr2= 456, 457,
&end
#
# 27 ALA QB 30 ARG QG 5.14
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
igr1= 404, 405, 406,
igr2= 453, 454,
&end
#
# 27 ALA QB 31 ILE QG2 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
igr1= 404, 405, 406,
igr2= 476, 477, 478,
&end
#
# 28 HIS HA 28 HIS HD2 4.70
&rst
ixpk= 0, nxpk= 0, iat= 412, 423, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 28 HIS HA 30 ARG HN 4.46
&rst
ixpk= 0, nxpk= 0, iat= 412, 446, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, &end
#
# 28 HIS HA 31 ILE HN 4.44
&rst
ixpk= 0, nxpk= 0, iat= 412, 470, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94, &end
#
# 28 HIS HA 31 ILE QD1 4.69
&rst
ixpk= 0, nxpk= 0, iat= 412, -1, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr2= 483, 484, 485,
&end
#
# 28 HIS HA 31 ILE QG2 4.10
&rst
ixpk= 0, nxpk= 0, iat= 412, -1, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
igr2= 476, 477, 478,
&end
#
# 28 HIS HB2 29 LEU HN 4.25
&rst
ixpk= 0, nxpk= 0, iat= 414, 427, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75, &end
#
# 28 HIS HB2 31 ILE QD1 5.50
&rst
ixpk= 0, nxpk= 0, iat= 414, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2= 483, 484, 485,
&end
#
# 28 HIS HB3 28 HIS HD2 3.94
&rst
ixpk= 0, nxpk= 0, iat= 415, 423, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44, &end
#
# 28 HIS HB3 29 LEU HN 3.59
&rst
ixpk= 0, nxpk= 0, iat= 415, 427, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09, &end
#
# 28 HIS HB3 29 LEU QD2 4.57
&rst
ixpk= 0, nxpk= 0, iat= 415, -1, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
igr2= 440, 441, 442,
&end
#
# 28 HIS HD2 29 LEU HA 4.01
&rst
ixpk= 0, nxpk= 0, iat= 423, 429, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51, &end
#
# 28 HIS HD2 29 LEU HG 4.40
&rst
ixpk= 0, nxpk= 0, iat= 423, 434, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 28 HIS HD2 29 LEU HN 4.54
&rst
ixpk= 0, nxpk= 0, iat= 423, 427, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 28 HIS HD2 29 LEU QD2 3.73
&rst
ixpk= 0, nxpk= 0, iat= 423, -1, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
igr2= 440, 441, 442,
&end
#
# 28 HIS HD2 32 HIS HD2 4.23
&rst
ixpk= 0, nxpk= 0, iat= 423, 502, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73, &end
#
# 28 HIS HE1 31 ILE QD1 3.45
&rst
ixpk= 0, nxpk= 0, iat= 420, -1, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,
igr2= 483, 484, 485,
&end
#
# 28 HIS HE1 31 ILE QG1 4.68
&rst
ixpk= 0, nxpk= 0, iat= 420, -1, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
igr2= 480, 481,
&end
#
# 28 HIS HE1 31 ILE QG2 5.20
&rst
ixpk= 0, nxpk= 0, iat= 420, -1, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
igr2= 476, 477, 478,
&end
#
# 28 HIS HN 28 HIS HB2 3.12
&rst
ixpk= 0, nxpk= 0, iat= 410, 414, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62, &end
#
# 28 HIS HN 28 HIS HB3 3.04
&rst
ixpk= 0, nxpk= 0, iat= 410, 415, r1= 1.30, r2= 1.80, r3= 3.04, r4= 3.54, &end
#
# 28 HIS HN 28 HIS HD2 4.70
&rst
ixpk= 0, nxpk= 0, iat= 410, 423, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 28 HIS HN 29 LEU HB2 5.13
&rst
ixpk= 0, nxpk= 0, iat= 410, 431, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63, &end
#
# 28 HIS HN 29 LEU HG 4.36
&rst
ixpk= 0, nxpk= 0, iat= 410, 434, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86, &end
#
# 28 HIS HN 29 LEU HN 3.30
&rst
ixpk= 0, nxpk= 0, iat= 410, 427, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80, &end
#
# 28 HIS HN 30 ARG HN 4.47
&rst
ixpk= 0, nxpk= 0, iat= 410, 446, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97, &end
#
# 29 LEU HA 29 LEU HG 3.84
&rst
ixpk= 0, nxpk= 0, iat= 429, 434, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34, &end
#
# 29 LEU HA 29 LEU QD1 4.04
&rst
ixpk= 0, nxpk= 0, iat= 429, -1, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
igr2= 436, 437, 438,
&end
#
# 29 LEU HA 29 LEU QD2 3.03
&rst
ixpk= 0, nxpk= 0, iat= 429, -1, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
igr2= 440, 441, 442,
&end
#
# 29 LEU HA 31 ILE HN 4.28
&rst
ixpk= 0, nxpk= 0, iat= 429, 470, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78, &end
#
# 29 LEU HA 32 HIS HB2 4.45
&rst
ixpk= 0, nxpk= 0, iat= 429, 493, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95, &end
#
# 29 LEU HA 32 HIS HB3 4.89
&rst
ixpk= 0, nxpk= 0, iat= 429, 494, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39, &end
#
# 29 LEU HA 32 HIS HD2 3.33
&rst
ixpk= 0, nxpk= 0, iat= 429, 502, r1= 1.30, r2= 1.80, r3= 3.33, r4= 3.83, &end
#
# 29 LEU HA 32 HIS HN 4.01
&rst
ixpk= 0, nxpk= 0, iat= 429, 489, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51, &end
#
# 29 LEU HB2 29 LEU QD1 3.27
&rst
ixpk= 0, nxpk= 0, iat= 431, -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
igr2= 436, 437, 438,
&end
#
# 29 LEU HB2 29 LEU QD2 3.52
&rst
ixpk= 0, nxpk= 0, iat= 431, -1, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,
igr2= 440, 441, 442,
&end
#
# 29 LEU HB2 30 ARG HN 4.31
&rst
ixpk= 0, nxpk= 0, iat= 431, 446, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81, &end
#
# 29 LEU HB3 29 LEU QD1 3.23
&rst
ixpk= 0, nxpk= 0, iat= 432, -1, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,
igr2= 436, 437, 438,
&end
#
# 29 LEU HB3 29 LEU QD2 3.59
&rst
ixpk= 0, nxpk= 0, iat= 432, -1, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,
igr2= 440, 441, 442,
&end
#
# 29 LEU HB3 30 ARG HN 4.29
&rst
ixpk= 0, nxpk= 0, iat= 432, 446, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79, &end
#
# 29 LEU HB3 33 THR QG2 4.59
&rst
ixpk= 0, nxpk= 0, iat= 432, -1, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
igr2= 512, 513, 514,
&end
#
# 29 LEU HG 30 ARG HN 4.41
&rst
ixpk= 0, nxpk= 0, iat= 434, 446, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, &end
#
# 29 LEU HN 29 LEU HB2 3.24
&rst
ixpk= 0, nxpk= 0, iat= 427, 431, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74, &end
#
# 29 LEU HN 29 LEU HB3 3.71
&rst
ixpk= 0, nxpk= 0, iat= 427, 432, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21, &end
#
# 29 LEU HN 29 LEU HG 3.23
&rst
ixpk= 0, nxpk= 0, iat= 427, 434, r1= 1.30, r2= 1.80, r3= 3.23, r4= 3.73, &end
#
# 29 LEU HN 29 LEU QD1 3.73
&rst
ixpk= 0, nxpk= 0, iat= 427, -1, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
igr2= 436, 437, 438,
&end
#
# 29 LEU HN 29 LEU QD2 3.56
&rst
ixpk= 0, nxpk= 0, iat= 427, -1, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,
igr2= 440, 441, 442,
&end
#
# 29 LEU HN 30 ARG HB2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 427, 450, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 29 LEU HN 30 ARG HN 3.46
&rst
ixpk= 0, nxpk= 0, iat= 427, 446, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96, &end
#
# 29 LEU HN 30 ARG QG 5.34
&rst
ixpk= 0, nxpk= 0, iat= 427, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2= 453, 454,
&end
#
# 29 LEU HN 31 ILE HN 4.92
&rst
ixpk= 0, nxpk= 0, iat= 427, 470, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42, &end
#
# 29 LEU HN 32 HIS HD2 4.69
&rst
ixpk= 0, nxpk= 0, iat= 427, 502, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, &end
#
# 29 LEU QD1 30 ARG HN 4.84
&rst
ixpk= 0, nxpk= 0, iat= -1, 446, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
igr1= 436, 437, 438,
&end
#
# 29 LEU QD2 30 ARG HN 5.31
&rst
ixpk= 0, nxpk= 0, iat= -1, 446, r1= 1.30, r2= 1.80, r3= 6.38, r4= 6.88,
igr1= 440, 441, 442,
&end
#
# 29 LEU QD2 32 HIS HB2 4.31
&rst
ixpk= 0, nxpk= 0, iat= -1, 493, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
igr1= 440, 441, 442,
&end
#
# 29 LEU QD2 32 HIS HB3 4.58
&rst
ixpk= 0, nxpk= 0, iat= -1, 494, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
igr1= 440, 441, 442,
&end
#
# 29 LEU QD2 32 HIS HD2 3.34
&rst
ixpk= 0, nxpk= 0, iat= -1, 502, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,
igr1= 440, 441, 442,
&end
#
# 29 LEU QD2 32 HIS HN 4.89
&rst
ixpk= 0, nxpk= 0, iat= -1, 489, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,
igr1= 440, 441, 442,
&end
#
# 30 ARG HA 30 ARG HG2 3.67
&rst
ixpk= 0, nxpk= 0, iat= 448, 453, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17, &end
#
# 30 ARG HA 30 ARG HG3 3.67
&rst
ixpk= 0, nxpk= 0, iat= 448, 454, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17, &end
#
# 30 ARG HA 30 ARG QD 4.09
&rst
ixpk= 0, nxpk= 0, iat= 448, -1, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
igr2= 456, 457,
&end
#
# 30 ARG HA 30 ARG QG 3.17
&rst
ixpk= 0, nxpk= 0, iat= 448, -1, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06,
igr2= 453, 454,
&end
#
# 30 ARG HA 32 HIS HN 4.44
&rst
ixpk= 0, nxpk= 0, iat= 448, 489, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94, &end
#
# 30 ARG HA 33 THR HN 4.30
&rst
ixpk= 0, nxpk= 0, iat= 448, 506, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80, &end
#
# 30 ARG HA 33 THR QG2 4.51
&rst
ixpk= 0, nxpk= 0, iat= 448, -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr2= 512, 513, 514,
&end
#
# 30 ARG HB2 30 ARG QD 3.44
&rst
ixpk= 0, nxpk= 0, iat= 450, -1, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,
igr2= 456, 457,
&end
#
# 30 ARG HB2 31 ILE HN 3.73
&rst
ixpk= 0, nxpk= 0, iat= 450, 470, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23, &end
#
# 30 ARG HB2 31 ILE QG2 4.44
&rst
ixpk= 0, nxpk= 0, iat= 450, -1, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
igr2= 476, 477, 478,
&end
#
# 30 ARG HB3 30 ARG QD 3.50
&rst
ixpk= 0, nxpk= 0, iat= 451, -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
igr2= 456, 457,
&end
#
# 30 ARG HB3 31 ILE HN 4.15
&rst
ixpk= 0, nxpk= 0, iat= 451, 470, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65, &end
#
# 30 ARG HB3 33 THR QG2 4.86
&rst
ixpk= 0, nxpk= 0, iat= 451, -1, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
igr2= 512, 513, 514,
&end
#
# 30 ARG HN 30 ARG HB2 3.00
&rst
ixpk= 0, nxpk= 0, iat= 446, 450, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 30 ARG HN 30 ARG HB3 3.80
&rst
ixpk= 0, nxpk= 0, iat= 446, 451, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30, &end
#
# 30 ARG HN 30 ARG HG2 3.50
&rst
ixpk= 0, nxpk= 0, iat= 446, 453, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 30 ARG HN 30 ARG HG3 3.50
&rst
ixpk= 0, nxpk= 0, iat= 446, 454, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 30 ARG HN 30 ARG QD 4.29
&rst
ixpk= 0, nxpk= 0, iat= 446, -1, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
igr2= 456, 457,
&end
#
# 30 ARG HN 30 ARG QG 3.05
&rst
ixpk= 0, nxpk= 0, iat= 446, -1, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92,
igr2= 453, 454,
&end
#
# 30 ARG HN 31 ILE HN 3.35
&rst
ixpk= 0, nxpk= 0, iat= 446, 470, r1= 1.30, r2= 1.80, r3= 3.35, r4= 3.85, &end
#
# 30 ARG HN 31 ILE QG2 4.56
&rst
ixpk= 0, nxpk= 0, iat= 446, -1, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
igr2= 476, 477, 478,
&end
#
# 30 ARG HN 32 HIS HN 4.36
&rst
ixpk= 0, nxpk= 0, iat= 446, 489, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86, &end
#
# 30 ARG HN 33 THR QG2 4.85
&rst
ixpk= 0, nxpk= 0, iat= 446, -1, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32,
igr2= 512, 513, 514,
&end
#
# 31 ILE HA 31 ILE QD1 4.30
&rst
ixpk= 0, nxpk= 0, iat= 472, -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
igr2= 483, 484, 485,
&end
#
# 31 ILE HA 31 ILE QG1 3.72
&rst
ixpk= 0, nxpk= 0, iat= 472, -1, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
igr2= 480, 481,
&end
#
# 31 ILE HA 31 ILE QG2 3.17
&rst
ixpk= 0, nxpk= 0, iat= 472, -1, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,
igr2= 476, 477, 478,
&end
#
# 31 ILE HB 31 ILE QD1 3.34
&rst
ixpk= 0, nxpk= 0, iat= 474, -1, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,
igr2= 483, 484, 485,
&end
#
# 31 ILE HB 32 HIS HN 4.15
&rst
ixpk= 0, nxpk= 0, iat= 474, 489, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65, &end
#
# 31 ILE HG12 32 HIS HN 4.18
&rst
ixpk= 0, nxpk= 0, iat= 480, 489, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68, &end
#
# 31 ILE HG13 32 HIS HN 4.18
&rst
ixpk= 0, nxpk= 0, iat= 481, 489, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68, &end
#
# 31 ILE HN 31 ILE HB 3.70
&rst
ixpk= 0, nxpk= 0, iat= 470, 474, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20, &end
#
# 31 ILE HN 31 ILE QD1 4.32
&rst
ixpk= 0, nxpk= 0, iat= 470, -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
igr2= 483, 484, 485,
&end
#
# 31 ILE HN 31 ILE QG1 3.39
&rst
ixpk= 0, nxpk= 0, iat= 470, -1, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,
igr2= 480, 481,
&end
#
# 31 ILE HN 31 ILE QG2 3.18
&rst
ixpk= 0, nxpk= 0, iat= 470, -1, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,
igr2= 476, 477, 478,
&end
#
# 31 ILE HN 32 HIS HA 5.16
&rst
ixpk= 0, nxpk= 0, iat= 470, 491, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66, &end
#
# 31 ILE HN 32 HIS HB2 4.50
&rst
ixpk= 0, nxpk= 0, iat= 470, 493, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 31 ILE HN 32 HIS HD2 5.42
&rst
ixpk= 0, nxpk= 0, iat= 470, 502, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92, &end
#
# 31 ILE HN 32 HIS HN 3.08
&rst
ixpk= 0, nxpk= 0, iat= 470, 489, r1= 1.30, r2= 1.80, r3= 3.08, r4= 3.58, &end
#
# 31 ILE QG1 32 HIS HN 3.45
&rst
ixpk= 0, nxpk= 0, iat= -1, 489, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,
igr1= 480, 481,
&end
#
# 31 ILE QG1 33 THR HN 4.67
&rst
ixpk= 0, nxpk= 0, iat= -1, 506, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr1= 480, 481,
&end
#
# 31 ILE QG2 31 ILE QG1 3.26
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,
igr1= 476, 477, 478,
igr2= 480, 481,
&end
#
# 31 ILE QG2 32 HIS HN 4.23
&rst
ixpk= 0, nxpk= 0, iat= -1, 489, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
igr1= 476, 477, 478,
&end
#
# 32 HIS HB2 32 HIS HD2 3.82
&rst
ixpk= 0, nxpk= 0, iat= 493, 502, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32, &end
#
# 32 HIS HB2 33 THR HN 4.35
&rst
ixpk= 0, nxpk= 0, iat= 493, 506, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85, &end
#
# 32 HIS HB2 33 THR QG2 4.75
&rst
ixpk= 0, nxpk= 0, iat= 493, -1, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr2= 512, 513, 514,
&end
#
# 32 HIS HB3 33 THR HN 4.29
&rst
ixpk= 0, nxpk= 0, iat= 494, 506, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79, &end
#
# 32 HIS HB3 33 THR QG2 4.64
&rst
ixpk= 0, nxpk= 0, iat= 494, -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
igr2= 512, 513, 514,
&end
#
# 32 HIS HD2 33 THR HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 502, 506, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 32 HIS HN 32 HIS HB2 3.27
&rst
ixpk= 0, nxpk= 0, iat= 489, 493, r1= 1.30, r2= 1.80, r3= 3.27, r4= 3.77, &end
#
# 32 HIS HN 32 HIS HB3 3.50
&rst
ixpk= 0, nxpk= 0, iat= 489, 494, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 32 HIS HN 32 HIS HD2 4.10
&rst
ixpk= 0, nxpk= 0, iat= 489, 502, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60, &end
#
# 32 HIS HN 33 THR HA 5.29
&rst
ixpk= 0, nxpk= 0, iat= 489, 508, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79, &end
#
# 32 HIS HN 33 THR HN 3.41
&rst
ixpk= 0, nxpk= 0, iat= 489, 506, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91, &end
#
# 32 HIS HN 33 THR QG2 4.52
&rst
ixpk= 0, nxpk= 0, iat= 489, -1, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
igr2= 512, 513, 514,
&end
#
# 33 THR HA 33 THR QG2 3.32
&rst
ixpk= 0, nxpk= 0, iat= 508, -1, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,
igr2= 512, 513, 514,
&end
#
# 33 THR HN 33 THR HB 3.98
&rst
ixpk= 0, nxpk= 0, iat= 506, 510, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48, &end
#
# 33 THR HN 33 THR QG2 3.77
&rst
ixpk= 0, nxpk= 0, iat= 506, -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
igr2= 512, 513, 514,
&end
#
# 35 GLU HA 35 GLU QG 3.93
&rst
ixpk= 0, nxpk= 0, iat= 536, -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
igr2= 541, 542,
&end
#
# 35 GLU HA 36 LYS HN 3.24
&rst
ixpk= 0, nxpk= 0, iat= 536, 549, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74, &end
#
# 35 GLU HB2 36 LYS HN 4.53
&rst
ixpk= 0, nxpk= 0, iat= 538, 549, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03, &end
#
# 35 GLU HB3 36 LYS HN 4.53
&rst
ixpk= 0, nxpk= 0, iat= 539, 549, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03, &end
#
# 35 GLU HN 35 GLU QG 4.60
&rst
ixpk= 0, nxpk= 0, iat= 534, -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
igr2= 541, 542,
&end
#
# 35 GLU QG 36 LYS HN 4.70
&rst
ixpk= 0, nxpk= 0, iat= -1, 549, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
igr1= 541, 542,
&end
#
# 36 LYS HN 36 LYS QB 3.66
&rst
ixpk= 0, nxpk= 0, iat= 549, -1, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
igr2= 553, 554,
&end
#
# 36 LYS HN 36 LYS QG 4.68
&rst
ixpk= 0, nxpk= 0, iat= 549, -1, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
igr2= 556, 557,
&end
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