NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
569168 |
4bs2   |
19290 | cing | 1-original | 1 | AMBER | distance | NOE | simple |
#
# 18 TRP HB2 18 TRP HE1 4.85
&rst
ixpk= 0, nxpk= 0, iat= 253, 259, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
rk2=50, rk3=50, ir6=1, ialtd=0,
&end
#
# 71 HID HB2 72 MET H 3.83
&rst
ixpk= 0, nxpk= 0, iat=1138,1152, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33, &end
#
# 72 MET H 73 ILE HG12 5.32
&rst
ixpk= 0, nxpk= 0, iat=1152,1179, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82, &end
#
# 28 TYR QE 72 MET H 4.88
&rst
ixpk= 0, nxpk= 0, iat= -1,1152, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
igr1= 433, 438,
&end
#
# 71 HID HA 72 MET H 3.13
&rst
ixpk= 0, nxpk= 0, iat=1136,1152, r1= 1.30, r2= 1.80, r3= 3.13, r4= 3.63, &end
#
# 72 MET H 73 ILE HG13 4.98
&rst
ixpk= 0, nxpk= 0, iat=1152,1180, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48, &end
#
# 72 MET H 73 ILE H 4.31
&rst
ixpk= 0, nxpk= 0, iat=1152,1169, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81, &end
#
# 72 MET H 77 TRP HZ3 3.79
&rst
ixpk= 0, nxpk= 0, iat=1152,1248, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29, &end
#
# 72 MET H 72 MET HB2 3.25
&rst
ixpk= 0, nxpk= 0, iat=1152,1156, r1= 1.30, r2= 1.80, r3= 3.25, r4= 3.75, &end
#
# 77 TRP H 77 TRP HE1 5.21
&rst
ixpk= 0, nxpk= 0, iat=1231,1241, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71, &end
#
# 72 MET HA 77 TRP HE1 6.50
&rst
ixpk= 0, nxpk= 0, iat=1154,1241, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00, &end
#
# 44 LEU H 45 LYS H 3.23
&rst
ixpk= 0, nxpk= 0, iat= 688, 707, r1= 1.30, r2= 1.80, r3= 3.23, r4= 3.73, &end
#
# 44 LEU H 47 GLY H 4.86
&rst
ixpk= 0, nxpk= 0, iat= 688, 743, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36, &end
#
# 43 ASP HA 44 LEU H 2.66
&rst
ixpk= 0, nxpk= 0, iat= 678, 688, r1= 1.30, r2= 1.80, r3= 2.66, r4= 3.16, &end
#
# 44 LEU H 45 LYS HA 5.07
&rst
ixpk= 0, nxpk= 0, iat= 688, 709, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, &end
#
# 44 LEU H 44 LEU HB2 2.99
&rst
ixpk= 0, nxpk= 0, iat= 688, 692, r1= 1.30, r2= 1.80, r3= 2.99, r4= 3.49, &end
#
# 44 LEU H 44 LEU QD2 4.44
&rst
ixpk= 0, nxpk= 0, iat= 688, -1, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
igr2= 701, 702, 703,
&end
#
# 127 ILE H 128 PRO HD3 4.42
&rst
ixpk= 0, nxpk= 0, iat=2032,2053, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92, &end
#
# 77 TRP HB2 77 TRP HE1 4.93
&rst
ixpk= 0, nxpk= 0, iat=1235,1241, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43, &end
#
# 77 TRP HB3 77 TRP HE1 5.18
&rst
ixpk= 0, nxpk= 0, iat=1236,1241, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68, &end
#
# 126 PHE QE 127 ILE H 4.80
&rst
ixpk= 0, nxpk= 0, iat= -1,2032, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr1=2022,2026,
&end
#
# 127 ILE H 136 PHE QD 5.46
&rst
ixpk= 0, nxpk= 0, iat=2032, -1, r1= 1.30, r2= 1.80, r3= 6.13, r4= 6.63,
igr2=2193,2201,
&end
#
# 126 PHE HA 127 ILE H 2.82
&rst
ixpk= 0, nxpk= 0, iat=2014,2032, r1= 1.30, r2= 1.80, r3= 2.82, r4= 3.32, &end
#
# 127 ILE H 135 ALA HA 6.37
&rst
ixpk= 0, nxpk= 0, iat=2032,2177, r1= 1.30, r2= 1.80, r3= 6.37, r4= 6.87, &end
#
# 109 GLU HA 127 ILE H 5.96
&rst
ixpk= 0, nxpk= 0, iat=1745,2032, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46, &end
#
# 126 PHE HB3 127 ILE H 4.40
&rst
ixpk= 0, nxpk= 0, iat=2017,2032, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 109 GLU HG2 127 ILE H 4.21
&rst
ixpk= 0, nxpk= 0, iat=1750,2032, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71, &end
#
# 127 ILE H 127 ILE HB 3.20
&rst
ixpk= 0, nxpk= 0, iat=2032,2036, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 126 PHE H 127 ILE H 4.41
&rst
ixpk= 0, nxpk= 0, iat=2012,2032, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, &end
#
# 126 PHE QD 127 ILE H 3.81
&rst
ixpk= 0, nxpk= 0, iat= -1,2032, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,
igr1=2020,2028,
&end
#
# 125 VAL HA 127 ILE H 6.42
&rst
ixpk= 0, nxpk= 0, iat=1998,2032, r1= 1.30, r2= 1.80, r3= 6.42, r4= 6.92, &end
#
# 126 PHE HB2 127 ILE H 4.40
&rst
ixpk= 0, nxpk= 0, iat=2016,2032, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 109 GLU HG3 127 ILE H 5.14
&rst
ixpk= 0, nxpk= 0, iat=1751,2032, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64, &end
#
# 127 ILE H 127 ILE HG13 3.79
&rst
ixpk= 0, nxpk= 0, iat=2032,2043, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29, &end
#
# 127 ILE H 127 ILE QD1 5.15
&rst
ixpk= 0, nxpk= 0, iat=2032, -1, r1= 1.30, r2= 1.80, r3= 6.18, r4= 6.68,
igr2=2045,2046,2047,
&end
#
# 139 PHE H 141 ASP H 5.85
&rst
ixpk= 0, nxpk= 0, iat=2235,2265, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35, &end
#
# 97 LYS H 139 PHE H 4.89
&rst
ixpk= 0, nxpk= 0, iat=1555,2235, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39, &end
#
# 139 PHE H 139 PHE QD 3.45
&rst
ixpk= 0, nxpk= 0, iat=2235, -1, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,
igr2=2243,2251,
&end
#
# 97 LYS HA 139 PHE H 3.83
&rst
ixpk= 0, nxpk= 0, iat=1557,2235, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33, &end
#
# 138 THR HA 139 PHE H 3.20
&rst
ixpk= 0, nxpk= 0, iat=2223,2235, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 96 ARG HA 139 PHE H 4.46
&rst
ixpk= 0, nxpk= 0, iat=1533,2235, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, &end
#
# 139 PHE H 139 PHE HB3 3.86
&rst
ixpk= 0, nxpk= 0, iat=2235,2240, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 139 PHE H 139 PHE HB2 3.69
&rst
ixpk= 0, nxpk= 0, iat=2235,2239, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19, &end
#
# 96 ARG HB3 139 PHE H 4.63
&rst
ixpk= 0, nxpk= 0, iat=1536,2235, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, &end
#
# 96 ARG HB2 139 PHE H 4.51
&rst
ixpk= 0, nxpk= 0, iat=1535,2235, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01, &end
#
# 123 MET H 139 PHE H 5.24
&rst
ixpk= 0, nxpk= 0, iat=1967,2235, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74, &end
#
# 122 VAL HA 139 PHE H 5.11
&rst
ixpk= 0, nxpk= 0, iat=1953,2235, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61, &end
#
# 73 ILE H 76 ARG HA 5.13
&rst
ixpk= 0, nxpk= 0, iat=1169,1209, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63, &end
#
# 71 HID HB2 73 ILE H 4.88
&rst
ixpk= 0, nxpk= 0, iat=1138,1169, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38, &end
#
# 162 ILE H 162 ILE HB 3.60
&rst
ixpk= 0, nxpk= 0, iat=2576,2580, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10, &end
#
# 98 VAL H 139 PHE H 4.93
&rst
ixpk= 0, nxpk= 0, iat=1577,2235, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43, &end
#
# 138 THR H 139 PHE H 4.86
&rst
ixpk= 0, nxpk= 0, iat=2221,2235, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36, &end
#
# 73 ILE H 77 TRP HA 3.83
&rst
ixpk= 0, nxpk= 0, iat=1169,1233, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33, &end
#
# 72 MET HA 73 ILE H 3.01
&rst
ixpk= 0, nxpk= 0, iat=1154,1169, r1= 1.30, r2= 1.80, r3= 3.01, r4= 3.51, &end
#
# 72 MET HG3 73 ILE H 3.57
&rst
ixpk= 0, nxpk= 0, iat=1160,1169, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07, &end
#
# 73 ILE H 73 ILE QD1 5.01
&rst
ixpk= 0, nxpk= 0, iat=1169, -1, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,
igr2=1182,1183,1184,
&end
#
# 73 ILE H 77 TRP HE3 4.98
&rst
ixpk= 0, nxpk= 0, iat=1169,1250, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48, &end
#
# 73 ILE H 73 ILE HB 3.34
&rst
ixpk= 0, nxpk= 0, iat=1169,1173, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84, &end
#
# 73 ILE H 73 ILE HG12 3.89
&rst
ixpk= 0, nxpk= 0, iat=1169,1179, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39, &end
#
# 73 ILE H 73 ILE HG13 3.78
&rst
ixpk= 0, nxpk= 0, iat=1169,1180, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28, &end
#
# 152 ASP HA 162 ILE H 3.87
&rst
ixpk= 0, nxpk= 0, iat=2417,2576, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37, &end
#
# 149 CYS HA 162 ILE H 5.50
&rst
ixpk= 0, nxpk= 0, iat=2384,2576, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 161 HIS HB3 162 ILE H 4.95
&rst
ixpk= 0, nxpk= 0, iat=2564,2576, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45, &end
#
# 162 ILE H 162 ILE QG1 4.97
&rst
ixpk= 0, nxpk= 0, iat=2576, -1, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr2=2586,2587,
&end
#
# 153 LEU QD2 162 ILE H 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2576, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr1=2440,2441,2442,
&end
#
# 162 ILE H 162 ILE QG2 4.89
&rst
ixpk= 0, nxpk= 0, iat=2576, -1, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,
igr2=2582,2583,2584,
&end
#
# 151 GLU H 162 ILE H 4.86
&rst
ixpk= 0, nxpk= 0, iat=2400,2576, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36, &end
#
# 161 HIS HA 162 ILE H 3.24
&rst
ixpk= 0, nxpk= 0, iat=2561,2576, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74, &end
#
# 161 HIS HB2 162 ILE H 4.95
&rst
ixpk= 0, nxpk= 0, iat=2563,2576, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45, &end
#
# 115 PHE QE 160 VAL H 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,2543, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1=1853,1857,
&end
#
# 158 ILE HA 160 VAL H 5.61
&rst
ixpk= 0, nxpk= 0, iat=2515,2543, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11, &end
#
# 154 ILE HA 160 VAL H 4.11
&rst
ixpk= 0, nxpk= 0, iat=2448,2543, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 159 SER HB3 160 VAL H 4.65
&rst
ixpk= 0, nxpk= 0, iat=2537,2543, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15, &end
#
# 154 ILE HB 160 VAL H 5.73
&rst
ixpk= 0, nxpk= 0, iat=2450,2543, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23, &end
#
# 154 ILE H 160 VAL H 4.99
&rst
ixpk= 0, nxpk= 0, iat=2446,2543, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49, &end
#
# 160 VAL H 161 HIS HA 5.49
&rst
ixpk= 0, nxpk= 0, iat=2543,2561, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99, &end
#
# 159 SER HB2 160 VAL H 4.65
&rst
ixpk= 0, nxpk= 0, iat=2536,2543, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15, &end
#
# 155 ILE H 160 VAL H 3.98
&rst
ixpk= 0, nxpk= 0, iat=2465,2543, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48, &end
#
# 159 SER H 160 VAL H 4.72
&rst
ixpk= 0, nxpk= 0, iat=2532,2543, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22, &end
#
# 160 VAL H 161 HIS H 5.18
&rst
ixpk= 0, nxpk= 0, iat=2543,2559, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68, &end
#
# 159 SER HA 160 VAL H 3.29
&rst
ixpk= 0, nxpk= 0, iat=2534,2543, r1= 1.30, r2= 1.80, r3= 3.29, r4= 3.79, &end
#
# 155 ILE HB 160 VAL H 5.11
&rst
ixpk= 0, nxpk= 0, iat=2469,2543, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61, &end
#
# 60 TYR H 60 TYR QD 4.18
&rst
ixpk= 0, nxpk= 0, iat= 944, -1, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,
igr2= 952, 961,
&end
#
# 59 GLU HA 60 TYR H 3.00
&rst
ixpk= 0, nxpk= 0, iat= 931, 944, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 60 TYR H 60 TYR HB2 3.40
&rst
ixpk= 0, nxpk= 0, iat= 944, 948, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90, &end
#
# 60 TYR H 60 TYR HB3 3.31
&rst
ixpk= 0, nxpk= 0, iat= 944, 949, r1= 1.30, r2= 1.80, r3= 3.31, r4= 3.81, &end
#
# 59 GLU HB2 60 TYR H 3.74
&rst
ixpk= 0, nxpk= 0, iat= 933, 944, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24, &end
#
# 59 GLU HB3 60 TYR H 3.77
&rst
ixpk= 0, nxpk= 0, iat= 934, 944, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27, &end
#
# 8 THR QG2 60 TYR H 3.43
&rst
ixpk= 0, nxpk= 0, iat= -1, 944, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
igr1= 105, 106, 107,
&end
#
# 115 PHE QE 155 ILE H 5.67
&rst
ixpk= 0, nxpk= 0, iat= -1,2465, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
igr1=1853,1857,
&end
#
# 155 ILE H 159 SER HA 3.88
&rst
ixpk= 0, nxpk= 0, iat=2465,2534, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38, &end
#
# 155 ILE H 158 ILE HA 5.10
&rst
ixpk= 0, nxpk= 0, iat=2465,2515, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, &end
#
# 155 ILE H 158 ILE HB 4.31
&rst
ixpk= 0, nxpk= 0, iat=2465,2517, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81, &end
#
# 154 ILE HB 155 ILE H 4.18
&rst
ixpk= 0, nxpk= 0, iat=2450,2465, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68, &end
#
# 154 ILE HG12 155 ILE H 4.40
&rst
ixpk= 0, nxpk= 0, iat=2456,2465, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 155 ILE H 155 ILE QG2 5.02
&rst
ixpk= 0, nxpk= 0, iat=2465, -1, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
igr2=2471,2472,2473,
&end
#
# 155 ILE H 155 ILE QD1 5.30
&rst
ixpk= 0, nxpk= 0, iat=2465, -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
igr2=2478,2479,2480,
&end
#
# 155 ILE H 156 LYS H 4.44
&rst
ixpk= 0, nxpk= 0, iat=2465,2484, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94, &end
#
# 154 ILE HA 155 ILE H 3.05
&rst
ixpk= 0, nxpk= 0, iat=2448,2465, r1= 1.30, r2= 1.80, r3= 3.05, r4= 3.55, &end
#
# 155 ILE H 157 GLY HA2 5.32
&rst
ixpk= 0, nxpk= 0, iat=2465,2508, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82, &end
#
# 107 MET QE 155 ILE H 3.98
&rst
ixpk= 0, nxpk= 0, iat= -1,2465, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
igr1=1723,1724,1725,
&end
#
# 155 ILE H 155 ILE HB 3.44
&rst
ixpk= 0, nxpk= 0, iat=2465,2469, r1= 1.30, r2= 1.80, r3= 3.44, r4= 3.94, &end
#
# 60 TYR H 63 GLN H 5.27
&rst
ixpk= 0, nxpk= 0, iat= 944, 994, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77, &end
#
# 57 PHE H 63 GLN HA 6.29
&rst
ixpk= 0, nxpk= 0, iat= 895, 996, r1= 1.30, r2= 1.80, r3= 6.29, r4= 6.79, &end
#
# 57 PHE H 63 GLN HB2 4.89
&rst
ixpk= 0, nxpk= 0, iat= 895, 998, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39, &end
#
# 57 PHE H 57 PHE QD 3.52
&rst
ixpk= 0, nxpk= 0, iat= 895, -1, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
igr2= 903, 911,
&end
#
# 57 PHE H 57 PHE QE 4.88
&rst
ixpk= 0, nxpk= 0, iat= 895, -1, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
igr2= 905, 909,
&end
#
# 56 ARG HA 57 PHE H 3.48
&rst
ixpk= 0, nxpk= 0, iat= 873, 895, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98, &end
#
# 57 PHE H 57 PHE HB2 3.95
&rst
ixpk= 0, nxpk= 0, iat= 895, 899, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45, &end
#
# 57 PHE H 57 PHE HB3 3.95
&rst
ixpk= 0, nxpk= 0, iat= 895, 900, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45, &end
#
# 56 ARG QG 57 PHE H 3.69
&rst
ixpk= 0, nxpk= 0, iat= -1, 895, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,
igr1= 878, 879,
&end
#
# 57 PHE H 62 THR QG2 5.51
&rst
ixpk= 0, nxpk= 0, iat= 895, -1, r1= 1.30, r2= 1.80, r3= 6.62, r4= 7.12,
igr2= 986, 987, 988,
&end
#
# 57 PHE H 59 GLU H 5.55
&rst
ixpk= 0, nxpk= 0, iat= 895, 929, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05, &end
#
# 56 ARG HD2 57 PHE H 4.71
&rst
ixpk= 0, nxpk= 0, iat= 881, 895, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21, &end
#
# 56 ARG HD3 57 PHE H 4.71
&rst
ixpk= 0, nxpk= 0, iat= 882, 895, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21, &end
#
# 56 ARG QB 57 PHE H 5.04
&rst
ixpk= 0, nxpk= 0, iat= -1, 895, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr1= 875, 876,
&end
#
# 55 VAL QG2 57 PHE H 6.28
&rst
ixpk= 0, nxpk= 0, iat= -1, 895, r1= 1.30, r2= 1.80, r3= 7.54, r4= 8.04,
igr1= 865, 866, 867,
&end
#
# 126 PHE H 136 PHE H 3.67
&rst
ixpk= 0, nxpk= 0, iat=2012,2185, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17, &end
#
# 126 PHE H 137 VAL H 5.09
&rst
ixpk= 0, nxpk= 0, iat=2012,2205, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59, &end
#
# 126 PHE H 126 PHE QD 4.53
&rst
ixpk= 0, nxpk= 0, iat=2012, -1, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
igr2=2020,2028,
&end
#
# 126 PHE H 136 PHE QD 5.04
&rst
ixpk= 0, nxpk= 0, iat=2012, -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr2=2193,2201,
&end
#
# 126 PHE H 137 VAL HA 3.78
&rst
ixpk= 0, nxpk= 0, iat=2012,2207, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28, &end
#
# 126 PHE H 126 PHE HB3 3.50
&rst
ixpk= 0, nxpk= 0, iat=2012,2017, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 125 VAL HB 126 PHE H 4.23
&rst
ixpk= 0, nxpk= 0, iat=2000,2012, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73, &end
#
# 126 PHE H 127 ILE HG13 5.01
&rst
ixpk= 0, nxpk= 0, iat=2012,2043, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51, &end
#
# 125 VAL QG1 126 PHE H 5.23
&rst
ixpk= 0, nxpk= 0, iat= -1,2012, r1= 1.30, r2= 1.80, r3= 6.28, r4= 6.78,
igr1=2002,2003,2004,
&end
#
# 126 PHE H 136 PHE HA 5.23
&rst
ixpk= 0, nxpk= 0, iat=2012,2187, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73, &end
#
# 125 VAL HA 126 PHE H 2.99
&rst
ixpk= 0, nxpk= 0, iat=1998,2012, r1= 1.30, r2= 1.80, r3= 2.99, r4= 3.49, &end
#
# 126 PHE H 126 PHE HB2 3.50
&rst
ixpk= 0, nxpk= 0, iat=2012,2016, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 126 PHE H 136 PHE QB 3.80
&rst
ixpk= 0, nxpk= 0, iat=2012, -1, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,
igr2=2189,2190,
&end
#
# 126 PHE H 127 ILE QD1 5.80
&rst
ixpk= 0, nxpk= 0, iat=2012, -1, r1= 1.30, r2= 1.80, r3= 6.97, r4= 7.47,
igr2=2045,2046,2047,
&end
#
# 126 PHE H 137 VAL QG2 6.41
&rst
ixpk= 0, nxpk= 0, iat=2012, -1, r1= 1.30, r2= 1.80, r3= 7.70, r4= 8.20,
igr2=2215,2216,2217,
&end
#
# 13 VAL H 52 PHE HB2 4.59
&rst
ixpk= 0, nxpk= 0, iat= 174, 812, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 12 ILE H 13 VAL H 4.78
&rst
ixpk= 0, nxpk= 0, iat= 155, 174, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, &end
#
# 126 PHE H 137 VAL QG1 6.41
&rst
ixpk= 0, nxpk= 0, iat=2012, -1, r1= 1.30, r2= 1.80, r3= 7.70, r4= 8.20,
igr2=2211,2212,2213,
&end
#
# 13 VAL H 52 PHE QD 4.00
&rst
ixpk= 0, nxpk= 0, iat= 174, -1, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
igr2= 816, 824,
&end
#
# 13 VAL H 54 PHE HA 4.17
&rst
ixpk= 0, nxpk= 0, iat= 174, 837, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67, &end
#
# 13 VAL H 80 CYS HA 5.20
&rst
ixpk= 0, nxpk= 0, iat= 174,1280, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70, &end
#
# 13 VAL H 52 PHE HA 4.71
&rst
ixpk= 0, nxpk= 0, iat= 174, 810, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21, &end
#
# 12 ILE HA 13 VAL H 3.39
&rst
ixpk= 0, nxpk= 0, iat= 157, 174, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89, &end
#
# 13 VAL H 13 VAL HB 3.62
&rst
ixpk= 0, nxpk= 0, iat= 174, 178, r1= 1.30, r2= 1.80, r3= 3.62, r4= 4.12, &end
#
# 12 ILE HB 13 VAL H 3.83
&rst
ixpk= 0, nxpk= 0, iat= 159, 174, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33, &end
#
# 13 VAL H 13 VAL QG2 5.00
&rst
ixpk= 0, nxpk= 0, iat= 174, -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr2= 184, 185, 186,
&end
#
# 13 VAL H 14 LEU QD2 5.66
&rst
ixpk= 0, nxpk= 0, iat= 174, -1, r1= 1.30, r2= 1.80, r3= 6.80, r4= 7.30,
igr2= 203, 204, 205,
&end
#
# 13 VAL H 16 LEU QQD 5.32
&rst
ixpk= 0, nxpk= 0, iat= 174, -1, r1= 1.30, r2= 1.80, r3= 7.17, r4= 7.67,
igr2= 225, 226, 227, 229, 230, 231,
&end
#
# 100 VAL H 101 GLY H 4.62
&rst
ixpk= 0, nxpk= 0, iat=1613,1629, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12, &end
#
# 100 VAL H 136 PHE H 4.76
&rst
ixpk= 0, nxpk= 0, iat=1613,2185, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26, &end
#
# 100 VAL H 165 ALA QB 5.21
&rst
ixpk= 0, nxpk= 0, iat=1613, -1, r1= 1.30, r2= 1.80, r3= 6.26, r4= 6.76,
igr2=2624,2625,2626,
&end
#
# 100 VAL H 100 VAL QG1 4.87
&rst
ixpk= 0, nxpk= 0, iat=1613, -1, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
igr2=1619,1620,1621,
&end
#
# 122 VAL H 139 PHE HA 5.18
&rst
ixpk= 0, nxpk= 0, iat=1951,2237, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68, &end
#
# 13 VAL H 54 PHE QE 5.91
&rst
ixpk= 0, nxpk= 0, iat= 174, -1, r1= 1.30, r2= 1.80, r3= 6.63, r4= 7.13,
igr2= 845, 849,
&end
#
# 99 PHE QD 100 VAL H 3.87
&rst
ixpk= 0, nxpk= 0, iat= -1,1613, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,
igr1=1601,1609,
&end
#
# 100 VAL H 162 ILE QG2 5.71
&rst
ixpk= 0, nxpk= 0, iat=1613, -1, r1= 1.30, r2= 1.80, r3= 6.86, r4= 7.36,
igr2=2582,2583,2584,
&end
#
# 99 PHE H 100 VAL H 4.61
&rst
ixpk= 0, nxpk= 0, iat=1593,1613, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 100 VAL H 137 VAL H 5.42
&rst
ixpk= 0, nxpk= 0, iat=1613,2205, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92, &end
#
# 100 VAL H 136 PHE QE 5.59
&rst
ixpk= 0, nxpk= 0, iat=1613, -1, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
igr2=2195,2199,
&end
#
# 100 VAL H 136 PHE QD 4.75
&rst
ixpk= 0, nxpk= 0, iat=1613, -1, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
igr2=2193,2201,
&end
#
# 100 VAL H 136 PHE HA 3.95
&rst
ixpk= 0, nxpk= 0, iat=1613,2187, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45, &end
#
# 99 PHE HA 100 VAL H 3.22
&rst
ixpk= 0, nxpk= 0, iat=1595,1613, r1= 1.30, r2= 1.80, r3= 3.22, r4= 3.72, &end
#
# 100 VAL H 100 VAL QG2 4.87
&rst
ixpk= 0, nxpk= 0, iat=1613, -1, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
igr2=1623,1624,1625,
&end
#
# 100 VAL H 135 ALA H 3.66
&rst
ixpk= 0, nxpk= 0, iat=1613,2175, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16, &end
#
# 122 VAL H 139 PHE QD 5.05
&rst
ixpk= 0, nxpk= 0, iat=1951, -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
igr2=2243,2251,
&end
#
# 122 VAL H 123 MET QE 4.91
&rst
ixpk= 0, nxpk= 0, iat=1951, -1, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
igr2=1978,1979,1980,
&end
#
# 122 VAL H 139 PHE QE 5.37
&rst
ixpk= 0, nxpk= 0, iat=1951, -1, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
igr2=2245,2249,
&end
#
# 117 SER HA 122 VAL H 3.98
&rst
ixpk= 0, nxpk= 0, iat=1885,1951, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48, &end
#
# 121 ASP HA 122 VAL H 2.66
&rst
ixpk= 0, nxpk= 0, iat=1941,1951, r1= 1.30, r2= 1.80, r3= 2.66, r4= 3.16, &end
#
# 113 ARG HA 122 VAL H 6.22
&rst
ixpk= 0, nxpk= 0, iat=1806,1951, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72, &end
#
# 122 VAL H 122 VAL HB 3.51
&rst
ixpk= 0, nxpk= 0, iat=1951,1955, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01, &end
#
# 122 VAL H 140 ALA QB 5.32
&rst
ixpk= 0, nxpk= 0, iat=1951, -1, r1= 1.30, r2= 1.80, r3= 6.39, r4= 6.89,
igr2=2259,2260,2261,
&end
#
# 122 VAL H 122 VAL QG1 4.96
&rst
ixpk= 0, nxpk= 0, iat=1951, -1, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
igr2=1957,1958,1959,
&end
#
# 30 SER HA 35 VAL H 4.45
&rst
ixpk= 0, nxpk= 0, iat= 466, 531, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95, &end
#
# 34 GLU HG2 35 VAL H 3.22
&rst
ixpk= 0, nxpk= 0, iat= 523, 531, r1= 1.30, r2= 1.80, r3= 3.22, r4= 3.72, &end
#
# 34 GLU HB3 35 VAL H 4.32
&rst
ixpk= 0, nxpk= 0, iat= 521, 531, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82, &end
#
# 122 VAL H 123 MET HG2 5.98
&rst
ixpk= 0, nxpk= 0, iat=1951,1974, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48, &end
#
# 33 GLY H 35 VAL H 4.84
&rst
ixpk= 0, nxpk= 0, iat= 509, 531, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34, &end
#
# 35 VAL H 35 VAL QG1 5.18
&rst
ixpk= 0, nxpk= 0, iat= 531, -1, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
igr2= 537, 538, 539,
&end
#
# 26 LYS QE 36 LEU H 6.02
&rst
ixpk= 0, nxpk= 0, iat= -1, 547, r1= 1.30, r2= 1.80, r3= 6.76, r4= 7.26,
igr1= 399, 400,
&end
#
# 36 LEU H 58 THR H 4.00
&rst
ixpk= 0, nxpk= 0, iat= 547, 915, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 35 VAL HA 36 LEU H 3.11
&rst
ixpk= 0, nxpk= 0, iat= 533, 547, r1= 1.30, r2= 1.80, r3= 3.11, r4= 3.61, &end
#
# 35 VAL HB 36 LEU H 4.63
&rst
ixpk= 0, nxpk= 0, iat= 535, 547, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, &end
#
# 36 LEU H 36 LEU HG 4.13
&rst
ixpk= 0, nxpk= 0, iat= 547, 554, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63, &end
#
# 36 LEU H 36 LEU HB2 3.49
&rst
ixpk= 0, nxpk= 0, iat= 547, 551, r1= 1.30, r2= 1.80, r3= 3.49, r4= 3.99, &end
#
# 36 LEU H 36 LEU HB3 3.74
&rst
ixpk= 0, nxpk= 0, iat= 547, 552, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24, &end
#
# 35 VAL QG2 36 LEU H 5.59
&rst
ixpk= 0, nxpk= 0, iat= -1, 547, r1= 1.30, r2= 1.80, r3= 6.71, r4= 7.21,
igr1= 541, 542, 543,
&end
#
# 36 LEU H 57 PHE HA 3.70
&rst
ixpk= 0, nxpk= 0, iat= 547, 897, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20, &end
#
# 165 ALA H 166 GLU H 4.36
&rst
ixpk= 0, nxpk= 0, iat=2620,2630, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86, &end
#
# 165 ALA QB 166 GLU H 3.62
&rst
ixpk= 0, nxpk= 0, iat= -1,2630, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,
igr1=2624,2625,2626,
&end
#
# 99 PHE QD 166 GLU H 5.06
&rst
ixpk= 0, nxpk= 0, iat= -1,2630, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
igr1=1601,1609,
&end
#
# 165 ALA HA 166 GLU H 3.17
&rst
ixpk= 0, nxpk= 0, iat=2622,2630, r1= 1.30, r2= 1.80, r3= 3.17, r4= 3.67, &end
#
# 166 GLU H 166 GLU QG 3.36
&rst
ixpk= 0, nxpk= 0, iat=2630, -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
igr2=2637,2638,
&end
#
# 173 ARG H 174 GLN H 3.07
&rst
ixpk= 0, nxpk= 0, iat=2737,2761, r1= 1.30, r2= 1.80, r3= 3.07, r4= 3.57, &end
#
# 173 ARG HA 174 GLN H 3.11
&rst
ixpk= 0, nxpk= 0, iat=2739,2761, r1= 1.30, r2= 1.80, r3= 3.11, r4= 3.61, &end
#
# 174 GLN H 174 GLN HB3 3.89
&rst
ixpk= 0, nxpk= 0, iat=2761,2766, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39, &end
#
# 36 LEU H 57 PHE QE 5.98
&rst
ixpk= 0, nxpk= 0, iat= 547, -1, r1= 1.30, r2= 1.80, r3= 6.71, r4= 7.21,
igr2= 905, 909,
&end
#
# 99 PHE QB 166 GLU H 5.09
&rst
ixpk= 0, nxpk= 0, iat= -1,2630, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21,
igr1=1597,1598,
&end
#
# 41 LYS H 52 PHE QE 5.14
&rst
ixpk= 0, nxpk= 0, iat= 632, -1, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,
igr2= 818, 822,
&end
#
# 41 LYS H 52 PHE QD 5.08
&rst
ixpk= 0, nxpk= 0, iat= 632, -1, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr2= 816, 824,
&end
#
# 13 VAL H 14 LEU H 4.59
&rst
ixpk= 0, nxpk= 0, iat= 174, 190, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 13 VAL HA 14 LEU H 3.22
&rst
ixpk= 0, nxpk= 0, iat= 176, 190, r1= 1.30, r2= 1.80, r3= 3.22, r4= 3.72, &end
#
# 14 LEU H 79 ASP HB2 4.06
&rst
ixpk= 0, nxpk= 0, iat= 190,1270, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56, &end
#
# 14 LEU H 79 ASP HB3 5.09
&rst
ixpk= 0, nxpk= 0, iat= 190,1271, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59, &end
#
# 13 VAL HB 14 LEU H 4.52
&rst
ixpk= 0, nxpk= 0, iat= 178, 190, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02, &end
#
# 14 LEU H 14 LEU QD1 4.58
&rst
ixpk= 0, nxpk= 0, iat= 190, -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
igr2= 199, 200, 201,
&end
#
# 14 LEU H 79 ASP HA 5.34
&rst
ixpk= 0, nxpk= 0, iat= 190,1268, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84, &end
#
# 14 LEU H 52 PHE HB2 5.20
&rst
ixpk= 0, nxpk= 0, iat= 190, 812, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70, &end
#
# 41 LYS H 52 PHE H 5.50
&rst
ixpk= 0, nxpk= 0, iat= 632, 808, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 40 VAL HA 41 LYS H 2.94
&rst
ixpk= 0, nxpk= 0, iat= 618, 632, r1= 1.30, r2= 1.80, r3= 2.94, r4= 3.44, &end
#
# 40 VAL HB 41 LYS H 4.69
&rst
ixpk= 0, nxpk= 0, iat= 620, 632, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, &end
#
# 40 VAL QG2 41 LYS H 5.39
&rst
ixpk= 0, nxpk= 0, iat= -1, 632, r1= 1.30, r2= 1.80, r3= 6.47, r4= 6.97,
igr1= 626, 627, 628,
&end
#
# 40 VAL QG1 41 LYS H 5.39
&rst
ixpk= 0, nxpk= 0, iat= -1, 632, r1= 1.30, r2= 1.80, r3= 6.47, r4= 6.97,
igr1= 622, 623, 624,
&end
#
# 41 LYS H 54 PHE H 4.11
&rst
ixpk= 0, nxpk= 0, iat= 632, 835, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 14 LEU H 80 CYS HA 3.93
&rst
ixpk= 0, nxpk= 0, iat= 190,1280, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43, &end
#
# 14 LEU H 14 LEU HB2 3.87
&rst
ixpk= 0, nxpk= 0, iat= 190, 194, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37, &end
#
# 14 LEU H 14 LEU HB3 3.87
&rst
ixpk= 0, nxpk= 0, iat= 190, 195, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37, &end
#
# 156 LYS H 156 LYS HG3 3.55
&rst
ixpk= 0, nxpk= 0, iat=2484,2492, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05, &end
#
# 155 ILE HB 156 LYS H 4.58
&rst
ixpk= 0, nxpk= 0, iat=2469,2484, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08, &end
#
# 115 PHE QD 156 LYS H 4.96
&rst
ixpk= 0, nxpk= 0, iat= -1,2484, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
igr1=1851,1859,
&end
#
# 123 MET H 140 ALA H 4.54
&rst
ixpk= 0, nxpk= 0, iat=1967,2255, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 123 MET H 139 PHE QD 5.07
&rst
ixpk= 0, nxpk= 0, iat=1967, -1, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
igr2=2243,2251,
&end
#
# 123 MET H 139 PHE HA 3.54
&rst
ixpk= 0, nxpk= 0, iat=1967,2237, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04, &end
#
# 122 VAL HA 123 MET H 3.20
&rst
ixpk= 0, nxpk= 0, iat=1953,1967, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 123 MET H 123 MET HB2 3.60
&rst
ixpk= 0, nxpk= 0, iat=1967,1971, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10, &end
#
# 121 ASP HA 123 MET H 6.32
&rst
ixpk= 0, nxpk= 0, iat=1941,1967, r1= 1.30, r2= 1.80, r3= 6.32, r4= 6.82, &end
#
# 155 ILE QD1 156 LYS H 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2484, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr1=2478,2479,2480,
&end
#
# 115 PHE HB2 156 LYS H 5.13
&rst
ixpk= 0, nxpk= 0, iat=1847,2484, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63, &end
#
# 156 LYS H 156 LYS HG2 3.44
&rst
ixpk= 0, nxpk= 0, iat=2484,2491, r1= 1.30, r2= 1.80, r3= 3.44, r4= 3.94, &end
#
# 39 GLN H 40 VAL H 4.28
&rst
ixpk= 0, nxpk= 0, iat= 599, 616, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78, &end
#
# 39 GLN HA 40 VAL H 3.23
&rst
ixpk= 0, nxpk= 0, iat= 601, 616, r1= 1.30, r2= 1.80, r3= 3.23, r4= 3.73, &end
#
# 22 GLU HA 40 VAL H 4.23
&rst
ixpk= 0, nxpk= 0, iat= 325, 616, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73, &end
#
# 22 GLU HG2 40 VAL H 3.36
&rst
ixpk= 0, nxpk= 0, iat= 330, 616, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86, &end
#
# 22 GLU HB2 40 VAL H 3.59
&rst
ixpk= 0, nxpk= 0, iat= 327, 616, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09, &end
#
# 40 VAL H 40 VAL HB 3.10
&rst
ixpk= 0, nxpk= 0, iat= 616, 620, r1= 1.30, r2= 1.80, r3= 3.10, r4= 3.60, &end
#
# 40 VAL H 40 VAL QG2 4.77
&rst
ixpk= 0, nxpk= 0, iat= 616, -1, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23,
igr2= 626, 627, 628,
&end
#
# 40 VAL H 41 LYS H 4.45
&rst
ixpk= 0, nxpk= 0, iat= 616, 632, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95, &end
#
# 39 GLN HE21 40 VAL H 5.57
&rst
ixpk= 0, nxpk= 0, iat= 612, 616, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07, &end
#
# 40 VAL H 41 LYS HA 5.33
&rst
ixpk= 0, nxpk= 0, iat= 616, 634, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83, &end
#
# 164 ASN HD22 165 ALA H 6.07
&rst
ixpk= 0, nxpk= 0, iat=2615,2620, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57, &end
#
# 97 LYS QB 165 ALA H 5.27
&rst
ixpk= 0, nxpk= 0, iat= -1,2620, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
igr1=1559,1560,
&end
#
# 136 PHE QE 165 ALA H 6.33
&rst
ixpk= 0, nxpk= 0, iat= -1,2620, r1= 1.30, r2= 1.80, r3= 7.11, r4= 7.61,
igr1=2195,2199,
&end
#
# 98 VAL HA 165 ALA H 3.94
&rst
ixpk= 0, nxpk= 0, iat=1579,2620, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44, &end
#
# 164 ASN HA 165 ALA H 3.05
&rst
ixpk= 0, nxpk= 0, iat=2608,2620, r1= 1.30, r2= 1.80, r3= 3.05, r4= 3.55, &end
#
# 164 ASN QB 165 ALA H 3.67
&rst
ixpk= 0, nxpk= 0, iat= -1,2620, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
igr1=2610,2611,
&end
#
# 98 VAL HB 165 ALA H 6.50
&rst
ixpk= 0, nxpk= 0, iat=1581,2620, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00, &end
#
# 165 ALA H 165 ALA QB 3.13
&rst
ixpk= 0, nxpk= 0, iat=2620, -1, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,
igr2=2624,2625,2626,
&end
#
# 162 ILE QG2 165 ALA H 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2620, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr1=2582,2583,2584,
&end
#
# 164 ASN HD21 165 ALA H 5.23
&rst
ixpk= 0, nxpk= 0, iat=2616,2620, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73, &end
#
# 136 PHE QE 137 VAL H 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2205, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
igr1=2195,2199,
&end
#
# 137 VAL H 139 PHE QD 6.50
&rst
ixpk= 0, nxpk= 0, iat=2205, -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
igr2=2243,2251,
&end
#
# 136 PHE QB 137 VAL H 3.54
&rst
ixpk= 0, nxpk= 0, iat= -1,2205, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47,
igr1=2189,2190,
&end
#
# 97 LYS QB 137 VAL H 4.87
&rst
ixpk= 0, nxpk= 0, iat= -1,2205, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,
igr1=1559,1560,
&end
#
# 97 LYS QG 137 VAL H 5.02
&rst
ixpk= 0, nxpk= 0, iat= -1,2205, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr1=1562,1563,
&end
#
# 137 VAL H 165 ALA QB 5.34
&rst
ixpk= 0, nxpk= 0, iat=2205, -1, r1= 1.30, r2= 1.80, r3= 6.41, r4= 6.91,
igr2=2624,2625,2626,
&end
#
# 137 VAL H 137 VAL HB 4.05
&rst
ixpk= 0, nxpk= 0, iat=2205,2209, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55, &end
#
# 137 VAL H 137 VAL QG2 5.02
&rst
ixpk= 0, nxpk= 0, iat=2205, -1, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
igr2=2215,2216,2217,
&end
#
# 136 PHE QD 137 VAL H 4.14
&rst
ixpk= 0, nxpk= 0, iat= -1,2205, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
igr1=2193,2201,
&end
#
# 99 PHE QD 137 VAL H 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2205, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
igr1=1601,1609,
&end
#
# 136 PHE HA 137 VAL H 3.07
&rst
ixpk= 0, nxpk= 0, iat=2187,2205, r1= 1.30, r2= 1.80, r3= 3.07, r4= 3.57, &end
#
# 97 LYS HA 137 VAL H 4.94
&rst
ixpk= 0, nxpk= 0, iat=1557,2205, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44, &end
#
# 98 VAL HA 137 VAL H 5.47
&rst
ixpk= 0, nxpk= 0, iat=1579,2205, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97, &end
#
# 132 ARG H 132 ARG HG3 5.09
&rst
ixpk= 0, nxpk= 0, iat=2121,2129, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59, &end
#
# 131 PHE QE 132 ARG H 4.67
&rst
ixpk= 0, nxpk= 0, iat= -1,2121, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr1=2111,2115,
&end
#
# 56 ARG H 57 PHE QE 5.81
&rst
ixpk= 0, nxpk= 0, iat= 871, -1, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
igr2= 905, 909,
&end
#
# 132 ARG H 132 ARG HG2 5.09
&rst
ixpk= 0, nxpk= 0, iat=2121,2128, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59, &end
#
# 131 PHE QD 132 ARG H 3.66
&rst
ixpk= 0, nxpk= 0, iat= -1,2121, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
igr1=2109,2117,
&end
#
# 131 PHE HA 132 ARG H 3.40
&rst
ixpk= 0, nxpk= 0, iat=2103,2121, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90, &end
#
# 131 PHE HB3 132 ARG H 3.89
&rst
ixpk= 0, nxpk= 0, iat=2106,2121, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39, &end
#
# 132 ARG H 133 ALA QB 5.64
&rst
ixpk= 0, nxpk= 0, iat=2121, -1, r1= 1.30, r2= 1.80, r3= 6.77, r4= 7.27,
igr2=2149,2150,2151,
&end
#
# 4 MET HA 5 ALA H 3.28
&rst
ixpk= 0, nxpk= 0, iat= 41, 56, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78, &end
#
# 4 MET HB2 5 ALA H 4.02
&rst
ixpk= 0, nxpk= 0, iat= 43, 56, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52, &end
#
# 5 ALA H 5 ALA QB 2.98
&rst
ixpk= 0, nxpk= 0, iat= 56, -1, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08,
igr2= 60, 61, 62,
&end
#
# 5 ALA H 6 SER HA 5.16
&rst
ixpk= 0, nxpk= 0, iat= 56, 68, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66, &end
#
# 4 MET HB3 5 ALA H 4.02
&rst
ixpk= 0, nxpk= 0, iat= 44, 56, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52, &end
#
# 39 GLN H 56 ARG H 5.64
&rst
ixpk= 0, nxpk= 0, iat= 599, 871, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14, &end
#
# 37 MET H 56 ARG H 3.48
&rst
ixpk= 0, nxpk= 0, iat= 566, 871, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98, &end
#
# 55 VAL HA 56 ARG H 2.95
&rst
ixpk= 0, nxpk= 0, iat= 857, 871, r1= 1.30, r2= 1.80, r3= 2.95, r4= 3.45, &end
#
# 35 VAL HA 56 ARG H 5.15
&rst
ixpk= 0, nxpk= 0, iat= 533, 871, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65, &end
#
# 37 MET HG3 56 ARG H 5.01
&rst
ixpk= 0, nxpk= 0, iat= 574, 871, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51, &end
#
# 56 ARG H 56 ARG QG 4.10
&rst
ixpk= 0, nxpk= 0, iat= 871, -1, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
igr2= 878, 879,
&end
#
# 55 VAL HB 56 ARG H 4.33
&rst
ixpk= 0, nxpk= 0, iat= 859, 871, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83, &end
#
# 55 VAL QG1 56 ARG H 5.22
&rst
ixpk= 0, nxpk= 0, iat= -1, 871, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
igr1= 861, 862, 863,
&end
#
# 56 ARG H 57 PHE H 4.62
&rst
ixpk= 0, nxpk= 0, iat= 871, 895, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12, &end
#
# 73 ILE H 74 ASP H 4.41
&rst
ixpk= 0, nxpk= 0, iat=1169,1188, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, &end
#
# 74 ASP H 74 ASP HA 2.65
&rst
ixpk= 0, nxpk= 0, iat=1188,1190, r1= 1.30, r2= 1.80, r3= 2.65, r4= 3.15, &end
#
# 73 ILE HA 74 ASP H 2.77
&rst
ixpk= 0, nxpk= 0, iat=1171,1188, r1= 1.30, r2= 1.80, r3= 2.77, r4= 3.27, &end
#
# 74 ASP H 74 ASP HB2 3.42
&rst
ixpk= 0, nxpk= 0, iat=1188,1192, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92, &end
#
# 74 ASP H 74 ASP HB3 4.04
&rst
ixpk= 0, nxpk= 0, iat=1188,1193, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, &end
#
# 72 MET HG3 74 ASP H 4.66
&rst
ixpk= 0, nxpk= 0, iat=1160,1188, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16, &end
#
# 20 THR QG2 74 ASP H 5.10
&rst
ixpk= 0, nxpk= 0, iat= -1,1188, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,
igr1= 301, 302, 303,
&end
#
# 73 ILE HG12 74 ASP H 4.74
&rst
ixpk= 0, nxpk= 0, iat=1179,1188, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24, &end
#
# 73 ILE QG2 74 ASP H 4.07
&rst
ixpk= 0, nxpk= 0, iat= -1,1188, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
igr1=1175,1176,1177,
&end
#
# 50 LYS H 52 PHE QE 5.15
&rst
ixpk= 0, nxpk= 0, iat= 779, -1, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr2= 818, 822,
&end
#
# 50 LYS H 52 PHE QD 5.22
&rst
ixpk= 0, nxpk= 0, iat= 779, -1, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
igr2= 816, 824,
&end
#
# 42 LYS HA 50 LYS H 3.39
&rst
ixpk= 0, nxpk= 0, iat= 656, 779, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89, &end
#
# 50 LYS H 50 LYS HG2 4.13
&rst
ixpk= 0, nxpk= 0, iat= 779, 786, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63, &end
#
# 50 LYS H 50 LYS HG3 4.13
&rst
ixpk= 0, nxpk= 0, iat= 779, 787, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63, &end
#
# 141 ASP HA 142 ASP H 2.64
&rst
ixpk= 0, nxpk= 0, iat=2267,2277, r1= 1.30, r2= 1.80, r3= 2.64, r4= 3.14, &end
#
# 141 ASP HB2 142 ASP H 4.36
&rst
ixpk= 0, nxpk= 0, iat=2269,2277, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86, &end
#
# 141 ASP HB3 142 ASP H 3.35
&rst
ixpk= 0, nxpk= 0, iat=2270,2277, r1= 1.30, r2= 1.80, r3= 3.35, r4= 3.85, &end
#
# 99 PHE H 100 VAL HA 5.00
&rst
ixpk= 0, nxpk= 0, iat=1593,1615, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 142 ASP H 142 ASP HB3 3.16
&rst
ixpk= 0, nxpk= 0, iat=2277,2282, r1= 1.30, r2= 1.80, r3= 3.16, r4= 3.66, &end
#
# 153 LEU H 153 LEU HB3 3.98
&rst
ixpk= 0, nxpk= 0, iat=2427,2432, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48, &end
#
# 99 PHE H 136 PHE QD 5.23
&rst
ixpk= 0, nxpk= 0, iat=1593, -1, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,
igr2=2193,2201,
&end
#
# 153 LEU H 153 LEU HB2 3.98
&rst
ixpk= 0, nxpk= 0, iat=2427,2431, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48, &end
#
# 153 LEU H 162 ILE H 4.41
&rst
ixpk= 0, nxpk= 0, iat=2427,2576, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, &end
#
# 99 PHE H 99 PHE QD 4.18
&rst
ixpk= 0, nxpk= 0, iat=1593, -1, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,
igr2=1601,1609,
&end
#
# 152 ASP HA 153 LEU H 3.24
&rst
ixpk= 0, nxpk= 0, iat=2417,2427, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74, &end
#
# 153 LEU H 161 HIS HA 3.97
&rst
ixpk= 0, nxpk= 0, iat=2427,2561, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47, &end
#
# 99 PHE H 162 ILE HA 4.84
&rst
ixpk= 0, nxpk= 0, iat=1593,2578, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34, &end
#
# 98 VAL HB 99 PHE H 3.35
&rst
ixpk= 0, nxpk= 0, iat=1581,1593, r1= 1.30, r2= 1.80, r3= 3.35, r4= 3.85, &end
#
# 153 LEU H 162 ILE QG1 5.54
&rst
ixpk= 0, nxpk= 0, iat=2427, -1, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
igr2=2586,2587,
&end
#
# 99 PHE H 165 ALA QB 4.74
&rst
ixpk= 0, nxpk= 0, iat=1593, -1, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
igr2=2624,2625,2626,
&end
#
# 99 PHE H 162 ILE QG2 4.34
&rst
ixpk= 0, nxpk= 0, iat=1593, -1, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,
igr2=2582,2583,2584,
&end
#
# 92 PRO HD3 93 LEU H 5.45
&rst
ixpk= 0, nxpk= 0, iat=1465,1477, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95, &end
#
# 93 LEU H 164 ASN HD22 4.27
&rst
ixpk= 0, nxpk= 0, iat=1477,2615, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77, &end
#
# 92 PRO HD2 93 LEU H 5.43
&rst
ixpk= 0, nxpk= 0, iat=1464,1477, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93, &end
#
# 96 ARG QD 142 ASP H 4.13
&rst
ixpk= 0, nxpk= 0, iat= -1,2277, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
igr1=1541,1542,
&end
#
# 93 LEU H 164 ASN HD21 3.89
&rst
ixpk= 0, nxpk= 0, iat=1477,2616, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39, &end
#
# 92 PRO HA 93 LEU H 2.83
&rst
ixpk= 0, nxpk= 0, iat=1473,1477, r1= 1.30, r2= 1.80, r3= 2.83, r4= 3.33, &end
#
# 93 LEU H 164 ASN QB 5.04
&rst
ixpk= 0, nxpk= 0, iat=1477, -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr2=2610,2611,
&end
#
# 93 LEU H 146 GLN QG 4.91
&rst
ixpk= 0, nxpk= 0, iat=1477, -1, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
igr2=2342,2343,
&end
#
# 92 PRO HB2 93 LEU H 3.42
&rst
ixpk= 0, nxpk= 0, iat=1470,1477, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92, &end
#
# 92 PRO HB3 93 LEU H 3.55
&rst
ixpk= 0, nxpk= 0, iat=1471,1477, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05, &end
#
# 93 LEU H 93 LEU HG 2.79
&rst
ixpk= 0, nxpk= 0, iat=1477,1484, r1= 1.30, r2= 1.80, r3= 2.79, r4= 3.29, &end
#
# 10 ASP H 11 LEU H 4.63
&rst
ixpk= 0, nxpk= 0, iat= 124, 136, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, &end
#
# 9 SER H 10 ASP H 4.40
&rst
ixpk= 0, nxpk= 0, iat= 113, 124, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 151 GLU QB 153 LEU H 5.54
&rst
ixpk= 0, nxpk= 0, iat= -1,2427, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
igr1=2404,2405,
&end
#
# 10 ASP H 10 ASP HB2 3.66
&rst
ixpk= 0, nxpk= 0, iat= 124, 128, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16, &end
#
# 9 SER HA 10 ASP H 2.96
&rst
ixpk= 0, nxpk= 0, iat= 115, 124, r1= 1.30, r2= 1.80, r3= 2.96, r4= 3.46, &end
#
# 9 SER HB2 10 ASP H 3.72
&rst
ixpk= 0, nxpk= 0, iat= 117, 124, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22, &end
#
# 9 SER HB3 10 ASP H 3.72
&rst
ixpk= 0, nxpk= 0, iat= 118, 124, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22, &end
#
# 10 ASP H 10 ASP HB3 3.82
&rst
ixpk= 0, nxpk= 0, iat= 124, 129, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32, &end
#
# 105 GLU H 105 GLU HG2 4.74
&rst
ixpk= 0, nxpk= 0, iat=1685,1692, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24, &end
#
# 104 THR QG2 105 GLU H 3.74
&rst
ixpk= 0, nxpk= 0, iat= -1,1685, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
igr1=1677,1678,1679,
&end
#
# 104 THR HA 105 GLU H 3.24
&rst
ixpk= 0, nxpk= 0, iat=1673,1685, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74, &end
#
# 104 THR HB 105 GLU H 3.19
&rst
ixpk= 0, nxpk= 0, iat=1675,1685, r1= 1.30, r2= 1.80, r3= 3.19, r4= 3.69, &end
#
# 105 GLU H 105 GLU HB2 3.25
&rst
ixpk= 0, nxpk= 0, iat=1685,1689, r1= 1.30, r2= 1.80, r3= 3.25, r4= 3.75, &end
#
# 105 GLU H 105 GLU HB3 3.28
&rst
ixpk= 0, nxpk= 0, iat=1685,1690, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78, &end
#
# 85 SER HB2 86 LYS H 4.73
&rst
ixpk= 0, nxpk= 0, iat=1362,1369, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, &end
#
# 86 LYS H 86 LYS HB3 3.92
&rst
ixpk= 0, nxpk= 0, iat=1369,1374, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42, &end
#
# 85 SER HB3 86 LYS H 4.73
&rst
ixpk= 0, nxpk= 0, iat=1363,1369, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, &end
#
# 104 THR H 105 GLU H 4.89
&rst
ixpk= 0, nxpk= 0, iat=1671,1685, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39, &end
#
# 94 ARG H 146 GLN HA 6.50
&rst
ixpk= 0, nxpk= 0, iat=1496,2337, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00, &end
#
# 92 PRO HB2 94 ARG H 5.90
&rst
ixpk= 0, nxpk= 0, iat=1470,1496, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40, &end
#
# 94 ARG H 94 ARG HB2 3.75
&rst
ixpk= 0, nxpk= 0, iat=1496,1500, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25, &end
#
# 94 ARG H 94 ARG HG2 3.66
&rst
ixpk= 0, nxpk= 0, iat=1496,1503, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16, &end
#
# 93 LEU HA 94 ARG H 2.87
&rst
ixpk= 0, nxpk= 0, iat=1479,1496, r1= 1.30, r2= 1.80, r3= 2.87, r4= 3.37, &end
#
# 94 ARG H 146 GLN QG 4.92
&rst
ixpk= 0, nxpk= 0, iat=1496, -1, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
igr2=2342,2343,
&end
#
# 94 ARG H 94 ARG HB3 3.25
&rst
ixpk= 0, nxpk= 0, iat=1496,1501, r1= 1.30, r2= 1.80, r3= 3.25, r4= 3.75, &end
#
# 86 LYS H 87 GLN HB2 5.13
&rst
ixpk= 0, nxpk= 0, iat=1369,1395, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63, &end
#
# 85 SER H 86 LYS H 3.88
&rst
ixpk= 0, nxpk= 0, iat=1358,1369, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38, &end
#
# 84 ASN HA 86 LYS H 3.95
&rst
ixpk= 0, nxpk= 0, iat=1346,1369, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45, &end
#
# 85 SER HA 86 LYS H 3.39
&rst
ixpk= 0, nxpk= 0, iat=1360,1369, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89, &end
#
# 86 LYS H 86 LYS HB2 3.25
&rst
ixpk= 0, nxpk= 0, iat=1369,1373, r1= 1.30, r2= 1.80, r3= 3.25, r4= 3.75, &end
#
# 18 TRP H 19 LYS HA 5.44
&rst
ixpk= 0, nxpk= 0, iat= 249, 275, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94, &end
#
# 17 PRO QG 18 TRP H 3.86
&rst
ixpk= 0, nxpk= 0, iat= -1, 249, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,
igr1= 239, 240,
&end
#
# 18 TRP H 19 LYS HB3 5.49
&rst
ixpk= 0, nxpk= 0, iat= 249, 278, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99, &end
#
# 18 TRP H 19 LYS HG2 4.71
&rst
ixpk= 0, nxpk= 0, iat= 249, 280, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21, &end
#
# 93 LEU H 94 ARG H 4.54
&rst
ixpk= 0, nxpk= 0, iat=1477,1496, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 18 TRP H 18 TRP HE1 5.29
&rst
ixpk= 0, nxpk= 0, iat= 249, 259, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79, &end
#
# 18 TRP H 18 TRP HB3 4.06
&rst
ixpk= 0, nxpk= 0, iat= 249, 254, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56, &end
#
# 17 PRO QB 18 TRP H 3.86
&rst
ixpk= 0, nxpk= 0, iat= -1, 249, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,
igr1= 242, 243,
&end
#
# 18 TRP H 19 LYS HG3 6.25
&rst
ixpk= 0, nxpk= 0, iat= 249, 281, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 81 LYS HB3 82 LEU H 3.33
&rst
ixpk= 0, nxpk= 0, iat=1294,1311, r1= 1.30, r2= 1.80, r3= 3.33, r4= 3.83, &end
#
# 12 ILE H 82 LEU H 5.32
&rst
ixpk= 0, nxpk= 0, iat= 155,1311, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82, &end
#
# 81 LYS H 82 LEU H 4.45
&rst
ixpk= 0, nxpk= 0, iat=1289,1311, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95, &end
#
# 81 LYS HA 82 LEU H 3.02
&rst
ixpk= 0, nxpk= 0, iat=1291,1311, r1= 1.30, r2= 1.80, r3= 3.02, r4= 3.52, &end
#
# 82 LEU H 83 PRO HD3 4.91
&rst
ixpk= 0, nxpk= 0, iat=1311,1332, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41, &end
#
# 82 LEU H 83 PRO HD2 4.89
&rst
ixpk= 0, nxpk= 0, iat=1311,1331, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39, &end
#
# 81 LYS HB2 82 LEU H 3.17
&rst
ixpk= 0, nxpk= 0, iat=1293,1311, r1= 1.30, r2= 1.80, r3= 3.17, r4= 3.67, &end
#
# 82 LEU H 82 LEU HB2 2.79
&rst
ixpk= 0, nxpk= 0, iat=1311,1315, r1= 1.30, r2= 1.80, r3= 2.79, r4= 3.29, &end
#
# 82 LEU H 82 LEU HB3 3.43
&rst
ixpk= 0, nxpk= 0, iat=1311,1316, r1= 1.30, r2= 1.80, r3= 3.43, r4= 3.93, &end
#
# 81 LYS HG2 82 LEU H 4.83
&rst
ixpk= 0, nxpk= 0, iat=1296,1311, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33, &end
#
# 12 ILE QD1 82 LEU H 5.22
&rst
ixpk= 0, nxpk= 0, iat= -1,1311, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
igr1= 168, 169, 170,
&end
#
# 7 LYS H 8 THR H 4.67
&rst
ixpk= 0, nxpk= 0, iat= 77, 99, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, &end
#
# 6 SER HA 7 LYS H 2.81
&rst
ixpk= 0, nxpk= 0, iat= 68, 77, r1= 1.30, r2= 1.80, r3= 2.81, r4= 3.31, &end
#
# 7 LYS H 7 LYS HB2 3.83
&rst
ixpk= 0, nxpk= 0, iat= 77, 81, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33, &end
#
# 7 LYS H 7 LYS HB3 3.34
&rst
ixpk= 0, nxpk= 0, iat= 77, 82, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84, &end
#
# 7 LYS H 7 LYS QD 4.15
&rst
ixpk= 0, nxpk= 0, iat= 77, -1, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
igr2= 87, 88,
&end
#
# 7 LYS H 7 LYS QG 3.41
&rst
ixpk= 0, nxpk= 0, iat= 77, -1, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,
igr2= 84, 85,
&end
#
# 7 LYS H 8 THR QG2 5.98
&rst
ixpk= 0, nxpk= 0, iat= 77, -1, r1= 1.30, r2= 1.80, r3= 7.18, r4= 7.68,
igr2= 105, 106, 107,
&end
#
# 7 LYS H 60 TYR QD 5.26
&rst
ixpk= 0, nxpk= 0, iat= 77, -1, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
igr2= 952, 961,
&end
#
# 156 LYS H 158 ILE H 4.56
&rst
ixpk= 0, nxpk= 0, iat=2484,2513, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06, &end
#
# 157 GLY H 158 ILE H 3.49
&rst
ixpk= 0, nxpk= 0, iat=2506,2513, r1= 1.30, r2= 1.80, r3= 3.49, r4= 3.99, &end
#
# 158 ILE H 159 SER HA 5.00
&rst
ixpk= 0, nxpk= 0, iat=2513,2534, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 158 ILE H 158 ILE HB 3.09
&rst
ixpk= 0, nxpk= 0, iat=2513,2517, r1= 1.30, r2= 1.80, r3= 3.09, r4= 3.59, &end
#
# 107 MET QE 158 ILE H 4.17
&rst
ixpk= 0, nxpk= 0, iat= -1,2513, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
igr1=1723,1724,1725,
&end
#
# 155 ILE HB 158 ILE H 5.00
&rst
ixpk= 0, nxpk= 0, iat=2469,2513, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 154 ILE HG12 158 ILE H 5.50
&rst
ixpk= 0, nxpk= 0, iat=2456,2513, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 158 ILE H 158 ILE QD1 4.61
&rst
ixpk= 0, nxpk= 0, iat=2513, -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
igr2=2526,2527,2528,
&end
#
# 155 ILE QG2 158 ILE H 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1,2513, r1= 1.30, r2= 1.80, r3= 6.41, r4= 6.91,
igr1=2471,2472,2473,
&end
#
# 155 ILE QD1 158 ILE H 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2513, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr1=2478,2479,2480,
&end
#
# 39 GLN QG 158 ILE H 5.43
&rst
ixpk= 0, nxpk= 0, iat= -1,2513, r1= 1.30, r2= 1.80, r3= 6.09, r4= 6.59,
igr1= 606, 607,
&end
#
# 155 ILE H 158 ILE H 3.67
&rst
ixpk= 0, nxpk= 0, iat=2465,2513, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17, &end
#
# 154 ILE HA 158 ILE H 4.38
&rst
ixpk= 0, nxpk= 0, iat=2448,2513, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88, &end
#
# 156 LYS HB2 158 ILE H 4.50
&rst
ixpk= 0, nxpk= 0, iat=2488,2513, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 156 LYS HA 158 ILE H 4.71
&rst
ixpk= 0, nxpk= 0, iat=2486,2513, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21, &end
#
# 88 SER H 89 GLN H 3.85
&rst
ixpk= 0, nxpk= 0, iat=1408,1419, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35, &end
#
# 88 SER HA 89 GLN H 2.61
&rst
ixpk= 0, nxpk= 0, iat=1410,1419, r1= 1.30, r2= 1.80, r3= 2.61, r4= 3.11, &end
#
# 88 SER QB 89 GLN H 4.16
&rst
ixpk= 0, nxpk= 0, iat= -1,1419, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
igr1=1412,1413,
&end
#
# 89 GLN H 89 GLN QG 3.39
&rst
ixpk= 0, nxpk= 0, iat=1419, -1, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,
igr2=1426,1427,
&end
#
# 91 GLU H 92 PRO HD2 4.88
&rst
ixpk= 0, nxpk= 0, iat=1448,1464, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38, &end
#
# 90 ASP HB2 91 GLU H 3.43
&rst
ixpk= 0, nxpk= 0, iat=1440,1448, r1= 1.30, r2= 1.80, r3= 3.43, r4= 3.93, &end
#
# 90 ASP HB3 91 GLU H 3.43
&rst
ixpk= 0, nxpk= 0, iat=1441,1448, r1= 1.30, r2= 1.80, r3= 3.43, r4= 3.93, &end
#
# 113 ARG QB 138 THR H 6.19
&rst
ixpk= 0, nxpk= 0, iat= -1,2221, r1= 1.30, r2= 1.80, r3= 6.95, r4= 7.45,
igr1=1808,1809,
&end
#
# 123 MET HB3 138 THR H 6.50
&rst
ixpk= 0, nxpk= 0, iat=1972,2221, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00, &end
#
# 97 LYS HA 138 THR H 5.16
&rst
ixpk= 0, nxpk= 0, iat=1557,2221, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66, &end
#
# 90 ASP H 91 GLU H 2.94
&rst
ixpk= 0, nxpk= 0, iat=1436,1448, r1= 1.30, r2= 1.80, r3= 2.94, r4= 3.44, &end
#
# 90 ASP H 91 GLU HA 4.69
&rst
ixpk= 0, nxpk= 0, iat=1436,1450, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, &end
#
# 89 GLN HA 90 ASP H 2.63
&rst
ixpk= 0, nxpk= 0, iat=1421,1436, r1= 1.30, r2= 1.80, r3= 2.63, r4= 3.13, &end
#
# 90 ASP H 90 ASP HB2 3.38
&rst
ixpk= 0, nxpk= 0, iat=1436,1440, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88, &end
#
# 90 ASP H 90 ASP HB3 3.38
&rst
ixpk= 0, nxpk= 0, iat=1436,1441, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88, &end
#
# 89 GLN QG 90 ASP H 3.69
&rst
ixpk= 0, nxpk= 0, iat= -1,1436, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,
igr1=1426,1427,
&end
#
# 90 ASP H 91 GLU QG 4.81
&rst
ixpk= 0, nxpk= 0, iat=1436, -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr2=1455,1456,
&end
#
# 89 GLN HB2 90 ASP H 3.78
&rst
ixpk= 0, nxpk= 0, iat=1423,1436, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28, &end
#
# 89 GLN HB3 90 ASP H 3.78
&rst
ixpk= 0, nxpk= 0, iat=1424,1436, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28, &end
#
# 126 PHE H 138 THR H 5.07
&rst
ixpk= 0, nxpk= 0, iat=2012,2221, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, &end
#
# 137 VAL HA 138 THR H 3.02
&rst
ixpk= 0, nxpk= 0, iat=2207,2221, r1= 1.30, r2= 1.80, r3= 3.02, r4= 3.52, &end
#
# 138 THR H 138 THR HB 3.41
&rst
ixpk= 0, nxpk= 0, iat=2221,2225, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91, &end
#
# 124 ASP HB2 138 THR H 5.17
&rst
ixpk= 0, nxpk= 0, iat=1988,2221, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67, &end
#
# 122 VAL HB 138 THR H 6.50
&rst
ixpk= 0, nxpk= 0, iat=1955,2221, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00, &end
#
# 125 VAL HB 138 THR H 6.50
&rst
ixpk= 0, nxpk= 0, iat=2000,2221, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00, &end
#
# 137 VAL QG1 138 THR H 5.52
&rst
ixpk= 0, nxpk= 0, iat= -1,2221, r1= 1.30, r2= 1.80, r3= 6.63, r4= 7.13,
igr1=2211,2212,2213,
&end
#
# 77 TRP H 78 CYS H 4.62
&rst
ixpk= 0, nxpk= 0, iat=1231,1255, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12, &end
#
# 77 TRP H 77 TRP HD1 3.41
&rst
ixpk= 0, nxpk= 0, iat=1231,1239, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91, &end
#
# 76 ARG HE 77 TRP H 5.14
&rst
ixpk= 0, nxpk= 0, iat=1220,1231, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64, &end
#
# 76 ARG HA 77 TRP H 2.74
&rst
ixpk= 0, nxpk= 0, iat=1209,1231, r1= 1.30, r2= 1.80, r3= 2.74, r4= 3.24, &end
#
# 72 MET HA 77 TRP H 5.11
&rst
ixpk= 0, nxpk= 0, iat=1154,1231, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61, &end
#
# 75 GLY HA2 77 TRP H 6.11
&rst
ixpk= 0, nxpk= 0, iat=1202,1231, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61, &end
#
# 77 TRP H 77 TRP HB2 3.17
&rst
ixpk= 0, nxpk= 0, iat=1231,1235, r1= 1.30, r2= 1.80, r3= 3.17, r4= 3.67, &end
#
# 76 ARG HB3 77 TRP H 4.29
&rst
ixpk= 0, nxpk= 0, iat=1212,1231, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79, &end
#
# 12 ILE H 54 PHE QD 4.60
&rst
ixpk= 0, nxpk= 0, iat= 155, -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
igr2= 843, 851,
&end
#
# 125 VAL HA 138 THR H 3.84
&rst
ixpk= 0, nxpk= 0, iat=1998,2221, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34, &end
#
# 43 ASP H 46 THR H 5.98
&rst
ixpk= 0, nxpk= 0, iat= 676, 729, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48, &end
#
# 77 TRP H 78 CYS HA 5.60
&rst
ixpk= 0, nxpk= 0, iat=1231,1257, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10, &end
#
# 12 ILE H 80 CYS HB3 5.21
&rst
ixpk= 0, nxpk= 0, iat= 155,1283, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71, &end
#
# 11 LEU HG 12 ILE H 5.29
&rst
ixpk= 0, nxpk= 0, iat= 143, 155, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79, &end
#
# 12 ILE H 12 ILE HB 3.81
&rst
ixpk= 0, nxpk= 0, iat= 155, 159, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31, &end
#
# 12 ILE H 80 CYS HA 4.86
&rst
ixpk= 0, nxpk= 0, iat= 155,1280, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36, &end
#
# 11 LEU HA 12 ILE H 3.12
&rst
ixpk= 0, nxpk= 0, iat= 138, 155, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62, &end
#
# 12 ILE H 83 PRO HD3 3.69
&rst
ixpk= 0, nxpk= 0, iat= 155,1332, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19, &end
#
# 12 ILE H 83 PRO HD2 4.60
&rst
ixpk= 0, nxpk= 0, iat= 155,1331, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 12 ILE H 83 PRO HG3 4.90
&rst
ixpk= 0, nxpk= 0, iat= 155,1335, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40, &end
#
# 12 ILE H 67 MET QE 5.82
&rst
ixpk= 0, nxpk= 0, iat= 155, -1, r1= 1.30, r2= 1.80, r3= 6.99, r4= 7.49,
igr2=1076,1077,1078,
&end
#
# 12 ILE H 83 PRO HG2 6.37
&rst
ixpk= 0, nxpk= 0, iat= 155,1334, r1= 1.30, r2= 1.80, r3= 6.37, r4= 6.87, &end
#
# 12 ILE H 12 ILE HG12 3.94
&rst
ixpk= 0, nxpk= 0, iat= 155, 165, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44, &end
#
# 12 ILE H 12 ILE QD1 4.10
&rst
ixpk= 0, nxpk= 0, iat= 155, -1, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
igr2= 168, 169, 170,
&end
#
# 12 ILE H 12 ILE HG13 3.94
&rst
ixpk= 0, nxpk= 0, iat= 155, 166, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44, &end
#
# 12 ILE H 54 PHE HA 5.05
&rst
ixpk= 0, nxpk= 0, iat= 155, 837, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55, &end
#
# 43 ASP H 50 LYS H 3.96
&rst
ixpk= 0, nxpk= 0, iat= 676, 779, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46, &end
#
# 43 ASP H 44 LEU H 4.76
&rst
ixpk= 0, nxpk= 0, iat= 676, 688, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26, &end
#
# 43 ASP H 47 GLY H 4.83
&rst
ixpk= 0, nxpk= 0, iat= 676, 743, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33, &end
#
# 43 ASP H 48 HID H 4.15
&rst
ixpk= 0, nxpk= 0, iat= 676, 750, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65, &end
#
# 42 LYS HA 43 ASP H 2.98
&rst
ixpk= 0, nxpk= 0, iat= 656, 676, r1= 1.30, r2= 1.80, r3= 2.98, r4= 3.48, &end
#
# 43 ASP H 43 ASP HB2 3.54
&rst
ixpk= 0, nxpk= 0, iat= 676, 680, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04, &end
#
# 42 LYS HB3 43 ASP H 3.64
&rst
ixpk= 0, nxpk= 0, iat= 659, 676, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14, &end
#
# 42 LYS HB2 43 ASP H 3.26
&rst
ixpk= 0, nxpk= 0, iat= 658, 676, r1= 1.30, r2= 1.80, r3= 3.26, r4= 3.76, &end
#
# 43 ASP H 47 GLY HA3 5.72
&rst
ixpk= 0, nxpk= 0, iat= 676, 746, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 74 ASP H 76 ARG H 4.30
&rst
ixpk= 0, nxpk= 0, iat=1188,1207, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80, &end
#
# 76 ARG H 77 TRP H 4.46
&rst
ixpk= 0, nxpk= 0, iat=1207,1231, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, &end
#
# 73 ILE H 76 ARG H 3.58
&rst
ixpk= 0, nxpk= 0, iat=1169,1207, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08, &end
#
# 76 ARG H 77 TRP HA 4.77
&rst
ixpk= 0, nxpk= 0, iat=1207,1233, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27, &end
#
# 75 GLY HA3 76 ARG H 3.52
&rst
ixpk= 0, nxpk= 0, iat=1203,1207, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02, &end
#
# 73 ILE HA 76 ARG H 4.23
&rst
ixpk= 0, nxpk= 0, iat=1171,1207, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73, &end
#
# 75 GLY HA2 76 ARG H 3.37
&rst
ixpk= 0, nxpk= 0, iat=1202,1207, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87, &end
#
# 76 ARG H 76 ARG HB2 3.65
&rst
ixpk= 0, nxpk= 0, iat=1207,1211, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15, &end
#
# 72 MET HG3 76 ARG H 3.26
&rst
ixpk= 0, nxpk= 0, iat=1160,1207, r1= 1.30, r2= 1.80, r3= 3.26, r4= 3.76, &end
#
# 76 ARG H 76 ARG HB3 3.65
&rst
ixpk= 0, nxpk= 0, iat=1207,1212, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15, &end
#
# 73 ILE QG2 76 ARG H 5.92
&rst
ixpk= 0, nxpk= 0, iat= -1,1207, r1= 1.30, r2= 1.80, r3= 7.11, r4= 7.61,
igr1=1175,1176,1177,
&end
#
# 72 MET HB2 76 ARG H 5.17
&rst
ixpk= 0, nxpk= 0, iat=1156,1207, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67, &end
#
# 144 ILE HB 145 ALA H 3.77
&rst
ixpk= 0, nxpk= 0, iat=2310,2325, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27, &end
#
# 99 PHE H 163 SER H 3.95
&rst
ixpk= 0, nxpk= 0, iat=1593,2595, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45, &end
#
# 162 ILE HA 163 SER H 3.15
&rst
ixpk= 0, nxpk= 0, iat=2578,2595, r1= 1.30, r2= 1.80, r3= 3.15, r4= 3.65, &end
#
# 100 VAL HA 163 SER H 4.18
&rst
ixpk= 0, nxpk= 0, iat=1615,2595, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68, &end
#
# 163 SER H 163 SER HB2 4.10
&rst
ixpk= 0, nxpk= 0, iat=2595,2599, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60, &end
#
# 162 ILE QG1 163 SER H 5.63
&rst
ixpk= 0, nxpk= 0, iat= -1,2595, r1= 1.30, r2= 1.80, r3= 6.32, r4= 6.82,
igr1=2586,2587,
&end
#
# 149 CYS HA 163 SER H 4.75
&rst
ixpk= 0, nxpk= 0, iat=2384,2595, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, &end
#
# 99 PHE QB 163 SER H 4.28
&rst
ixpk= 0, nxpk= 0, iat= -1,2595, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1=1597,1598,
&end
#
# 12 ILE QG2 81 LYS H 6.43
&rst
ixpk= 0, nxpk= 0, iat= -1,1289, r1= 1.30, r2= 1.80, r3= 7.72, r4= 8.22,
igr1= 161, 162, 163,
&end
#
# 125 VAL H 126 PHE H 4.70
&rst
ixpk= 0, nxpk= 0, iat=1996,2012, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 124 ASP H 125 VAL H 4.45
&rst
ixpk= 0, nxpk= 0, iat=1984,1996, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95, &end
#
# 124 ASP HA 125 VAL H 2.73
&rst
ixpk= 0, nxpk= 0, iat=1986,1996, r1= 1.30, r2= 1.80, r3= 2.73, r4= 3.23, &end
#
# 125 VAL H 137 VAL HA 5.11
&rst
ixpk= 0, nxpk= 0, iat=1996,2207, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61, &end
#
# 125 VAL H 125 VAL HB 3.00
&rst
ixpk= 0, nxpk= 0, iat=1996,2000, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 113 ARG HG3 125 VAL H 5.20
&rst
ixpk= 0, nxpk= 0, iat=1812,1996, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70, &end
#
# 125 VAL H 138 THR H 5.03
&rst
ixpk= 0, nxpk= 0, iat=1996,2221, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53, &end
#
# 141 ASP H 145 ALA H 5.06
&rst
ixpk= 0, nxpk= 0, iat=2265,2325, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56, &end
#
# 142 ASP HA 145 ALA H 4.53
&rst
ixpk= 0, nxpk= 0, iat=2279,2325, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03, &end
#
# 139 PHE HB3 145 ALA H 4.29
&rst
ixpk= 0, nxpk= 0, iat=2240,2325, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79, &end
#
# 145 ALA H 145 ALA QB 3.17
&rst
ixpk= 0, nxpk= 0, iat=2325, -1, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,
igr2=2329,2330,2331,
&end
#
# 144 ILE HG13 145 ALA H 4.53
&rst
ixpk= 0, nxpk= 0, iat=2317,2325, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03, &end
#
# 144 ILE QD1 145 ALA H 6.02
&rst
ixpk= 0, nxpk= 0, iat= -1,2325, r1= 1.30, r2= 1.80, r3= 7.23, r4= 7.73,
igr1=2319,2320,2321,
&end
#
# 144 ILE QG2 145 ALA H 4.85
&rst
ixpk= 0, nxpk= 0, iat= -1,2325, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32,
igr1=2312,2313,2314,
&end
#
# 63 GLN H 64 VAL QG2 6.01
&rst
ixpk= 0, nxpk= 0, iat= 994, -1, r1= 1.30, r2= 1.80, r3= 7.22, r4= 7.72,
igr2=1021,1022,1023,
&end
#
# 162 ILE H 163 SER H 4.73
&rst
ixpk= 0, nxpk= 0, iat=2576,2595, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, &end
#
# 99 PHE QD 163 SER H 4.06
&rst
ixpk= 0, nxpk= 0, iat= -1,2595, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
igr1=1601,1609,
&end
#
# 163 SER H 164 ASN HA 5.19
&rst
ixpk= 0, nxpk= 0, iat=2595,2608, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69, &end
#
# 163 SER H 163 SER HB3 4.10
&rst
ixpk= 0, nxpk= 0, iat=2595,2600, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60, &end
#
# 162 ILE HB 163 SER H 3.86
&rst
ixpk= 0, nxpk= 0, iat=2580,2595, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 162 ILE QG2 163 SER H 4.15
&rst
ixpk= 0, nxpk= 0, iat= -1,2595, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
igr1=2582,2583,2584,
&end
#
# 12 ILE H 81 LYS H 3.71
&rst
ixpk= 0, nxpk= 0, iat= 155,1289, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21, &end
#
# 80 CYS HA 81 LYS H 2.83
&rst
ixpk= 0, nxpk= 0, iat=1280,1289, r1= 1.30, r2= 1.80, r3= 2.83, r4= 3.33, &end
#
# 11 LEU HA 81 LYS H 4.33
&rst
ixpk= 0, nxpk= 0, iat= 138,1289, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83, &end
#
# 13 VAL HA 81 LYS H 4.59
&rst
ixpk= 0, nxpk= 0, iat= 176,1289, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 12 ILE HA 81 LYS H 5.14
&rst
ixpk= 0, nxpk= 0, iat= 157,1289, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64, &end
#
# 80 CYS HB3 81 LYS H 3.66
&rst
ixpk= 0, nxpk= 0, iat=1283,1289, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16, &end
#
# 67 MET QE 81 LYS H 5.17
&rst
ixpk= 0, nxpk= 0, iat= -1,1289, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,
igr1=1076,1077,1078,
&end
#
# 81 LYS H 81 LYS HB2 3.87
&rst
ixpk= 0, nxpk= 0, iat=1289,1293, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37, &end
#
# 81 LYS H 81 LYS HB3 3.92
&rst
ixpk= 0, nxpk= 0, iat=1289,1294, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42, &end
#
# 81 LYS H 81 LYS HG3 3.77
&rst
ixpk= 0, nxpk= 0, iat=1289,1297, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27, &end
#
# 81 LYS H 81 LYS HG2 3.63
&rst
ixpk= 0, nxpk= 0, iat=1289,1296, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13, &end
#
# 12 ILE QD1 81 LYS H 4.59
&rst
ixpk= 0, nxpk= 0, iat= -1,1289, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
igr1= 168, 169, 170,
&end
#
# 167 PRO HA 168 LYS H 2.62
&rst
ixpk= 0, nxpk= 0, iat=2655,2659, r1= 1.30, r2= 1.80, r3= 2.62, r4= 3.12, &end
#
# 167 PRO HB2 168 LYS H 3.82
&rst
ixpk= 0, nxpk= 0, iat=2652,2659, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32, &end
#
# 168 LYS H 168 LYS HB2 3.72
&rst
ixpk= 0, nxpk= 0, iat=2659,2663, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22, &end
#
# 168 LYS H 168 LYS HB3 3.72
&rst
ixpk= 0, nxpk= 0, iat=2659,2664, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22, &end
#
# 168 LYS H 168 LYS HG2 3.41
&rst
ixpk= 0, nxpk= 0, iat=2659,2666, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91, &end
#
# 168 LYS H 168 LYS HG3 3.41
&rst
ixpk= 0, nxpk= 0, iat=2659,2667, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91, &end
#
# 109 GLU HA 125 VAL H 5.73
&rst
ixpk= 0, nxpk= 0, iat=1745,1996, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23, &end
#
# 63 GLN H 66 VAL H 5.21
&rst
ixpk= 0, nxpk= 0, iat= 994,1049, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71, &end
#
# 61 GLU H 63 GLN H 4.29
&rst
ixpk= 0, nxpk= 0, iat= 965, 994, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79, &end
#
# 62 THR H 63 GLN H 3.18
&rst
ixpk= 0, nxpk= 0, iat= 980, 994, r1= 1.30, r2= 1.80, r3= 3.18, r4= 3.68, &end
#
# 62 THR HB 63 GLN H 3.59
&rst
ixpk= 0, nxpk= 0, iat= 984, 994, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09, &end
#
# 60 TYR HA 63 GLN H 3.76
&rst
ixpk= 0, nxpk= 0, iat= 946, 994, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26, &end
#
# 60 TYR HB2 63 GLN H 5.84
&rst
ixpk= 0, nxpk= 0, iat= 948, 994, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34, &end
#
# 60 TYR HB3 63 GLN H 5.79
&rst
ixpk= 0, nxpk= 0, iat= 949, 994, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29, &end
#
# 63 GLN H 63 GLN HB3 3.17
&rst
ixpk= 0, nxpk= 0, iat= 994, 999, r1= 1.30, r2= 1.80, r3= 3.17, r4= 3.67, &end
#
# 63 GLN H 63 GLN HG2 3.01
&rst
ixpk= 0, nxpk= 0, iat= 994,1001, r1= 1.30, r2= 1.80, r3= 3.01, r4= 3.51, &end
#
# 61 GLU HB3 63 GLN H 4.72
&rst
ixpk= 0, nxpk= 0, iat= 970, 994, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22, &end
#
# 63 GLN H 64 VAL QG1 4.96
&rst
ixpk= 0, nxpk= 0, iat= 994, -1, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
igr2=1017,1018,1019,
&end
#
# 62 THR QG2 63 GLN H 4.15
&rst
ixpk= 0, nxpk= 0, iat= -1, 994, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
igr1= 986, 987, 988,
&end
#
# 112 LEU H 113 ARG H 3.23
&rst
ixpk= 0, nxpk= 0, iat=1785,1804, r1= 1.30, r2= 1.80, r3= 3.23, r4= 3.73, &end
#
# 110 ASP HA 113 ARG H 4.02
&rst
ixpk= 0, nxpk= 0, iat=1760,1804, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52, &end
#
# 109 GLU HA 113 ARG H 4.63
&rst
ixpk= 0, nxpk= 0, iat=1745,1804, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, &end
#
# 113 ARG H 113 ARG QB 2.85
&rst
ixpk= 0, nxpk= 0, iat=1804, -1, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,
igr2=1808,1809,
&end
#
# 112 LEU HB2 113 ARG H 3.30
&rst
ixpk= 0, nxpk= 0, iat=1789,1804, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80, &end
#
# 111 GLU H 113 ARG H 5.01
&rst
ixpk= 0, nxpk= 0, iat=1770,1804, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51, &end
#
# 113 ARG H 124 ASP HA 6.43
&rst
ixpk= 0, nxpk= 0, iat=1804,1986, r1= 1.30, r2= 1.80, r3= 6.43, r4= 6.93, &end
#
# 113 ARG H 113 ARG HD2 4.12
&rst
ixpk= 0, nxpk= 0, iat=1804,1814, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62, &end
#
# 113 ARG H 125 VAL HB 4.21
&rst
ixpk= 0, nxpk= 0, iat=1804,2000, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71, &end
#
# 172 ASN HB2 173 ARG H 5.07
&rst
ixpk= 0, nxpk= 0, iat=2727,2737, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, &end
#
# 173 ARG H 173 ARG QG 4.26
&rst
ixpk= 0, nxpk= 0, iat=2737, -1, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
igr2=2744,2745,
&end
#
# 173 ARG H 173 ARG QD 4.98
&rst
ixpk= 0, nxpk= 0, iat=2737, -1, r1= 1.30, r2= 1.80, r3= 5.59, r4= 6.09,
igr2=2747,2748,
&end
#
# 172 ASN HB3 173 ARG H 5.07
&rst
ixpk= 0, nxpk= 0, iat=2728,2737, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, &end
#
# 173 ARG H 173 ARG HB2 3.89
&rst
ixpk= 0, nxpk= 0, iat=2737,2741, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39, &end
#
# 173 ARG H 173 ARG HB3 3.89
&rst
ixpk= 0, nxpk= 0, iat=2737,2742, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39, &end
#
# 63 GLN H 65 LYS H 4.33
&rst
ixpk= 0, nxpk= 0, iat= 994,1027, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83, &end
#
# 61 GLU HA 65 LYS H 4.71
&rst
ixpk= 0, nxpk= 0, iat= 967,1027, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21, &end
#
# 62 THR HA 65 LYS H 3.96
&rst
ixpk= 0, nxpk= 0, iat= 982,1027, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46, &end
#
# 108 THR HB 109 GLU H 3.88
&rst
ixpk= 0, nxpk= 0, iat=1733,1743, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38, &end
#
# 108 THR HA 109 GLU H 2.93
&rst
ixpk= 0, nxpk= 0, iat=1731,1743, r1= 1.30, r2= 1.80, r3= 2.93, r4= 3.43, &end
#
# 109 GLU H 109 GLU HB2 3.25
&rst
ixpk= 0, nxpk= 0, iat=1743,1747, r1= 1.30, r2= 1.80, r3= 3.25, r4= 3.75, &end
#
# 109 GLU H 109 GLU HB3 3.77
&rst
ixpk= 0, nxpk= 0, iat=1743,1748, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27, &end
#
# 109 GLU H 127 ILE QG2 5.57
&rst
ixpk= 0, nxpk= 0, iat=1743, -1, r1= 1.30, r2= 1.80, r3= 6.69, r4= 7.19,
igr2=2038,2039,2040,
&end
#
# 109 GLU H 127 ILE QD1 4.35
&rst
ixpk= 0, nxpk= 0, iat=1743, -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
igr2=2045,2046,2047,
&end
#
# 108 THR H 109 GLU H 4.62
&rst
ixpk= 0, nxpk= 0, iat=1729,1743, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12, &end
#
# 109 GLU H 127 ILE HB 4.89
&rst
ixpk= 0, nxpk= 0, iat=1743,2036, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39, &end
#
# 109 GLU H 127 ILE HG13 5.27
&rst
ixpk= 0, nxpk= 0, iat=1743,2043, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77, &end
#
# 22 GLU HA 39 GLN H 5.79
&rst
ixpk= 0, nxpk= 0, iat= 325, 599, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29, &end
#
# 38 VAL H 39 GLN H 4.53
&rst
ixpk= 0, nxpk= 0, iat= 583, 599, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03, &end
#
# 38 VAL HA 39 GLN H 2.84
&rst
ixpk= 0, nxpk= 0, iat= 585, 599, r1= 1.30, r2= 1.80, r3= 2.84, r4= 3.34, &end
#
# 39 GLN H 40 VAL HA 4.54
&rst
ixpk= 0, nxpk= 0, iat= 599, 618, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 39 GLN H 39 GLN QG 4.30
&rst
ixpk= 0, nxpk= 0, iat= 599, -1, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
igr2= 606, 607,
&end
#
# 39 GLN H 39 GLN QB 3.07
&rst
ixpk= 0, nxpk= 0, iat= 599, -1, r1= 1.30, r2= 1.80, r3= 3.45, r4= 3.95,
igr2= 603, 604,
&end
#
# 39 GLN H 55 VAL HB 4.80
&rst
ixpk= 0, nxpk= 0, iat= 599, 859, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30, &end
#
# 81 LYS QD 84 ASN H 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1344, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
igr1=1299,1300,
&end
#
# 82 LEU HB3 84 ASN H 6.50
&rst
ixpk= 0, nxpk= 0, iat=1316,1344, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00, &end
#
# 84 ASN H 85 SER H 3.40
&rst
ixpk= 0, nxpk= 0, iat=1344,1358, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90, &end
#
# 84 ASN H 84 ASN HD21 4.15
&rst
ixpk= 0, nxpk= 0, iat=1344,1354, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65, &end
#
# 84 ASN H 84 ASN HD22 4.47
&rst
ixpk= 0, nxpk= 0, iat=1344,1353, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97, &end
#
# 83 PRO HA 84 ASN H 2.64
&rst
ixpk= 0, nxpk= 0, iat=1340,1344, r1= 1.30, r2= 1.80, r3= 2.64, r4= 3.14, &end
#
# 83 PRO HD3 84 ASN H 5.59
&rst
ixpk= 0, nxpk= 0, iat=1332,1344, r1= 1.30, r2= 1.80, r3= 5.59, r4= 6.09, &end
#
# 84 ASN H 84 ASN HB2 3.84
&rst
ixpk= 0, nxpk= 0, iat=1344,1348, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34, &end
#
# 84 ASN H 84 ASN HB3 3.84
&rst
ixpk= 0, nxpk= 0, iat=1344,1349, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34, &end
#
# 83 PRO HG2 84 ASN H 4.46
&rst
ixpk= 0, nxpk= 0, iat=1334,1344, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, &end
#
# 12 ILE QD1 84 ASN H 5.15
&rst
ixpk= 0, nxpk= 0, iat= -1,1344, r1= 1.30, r2= 1.80, r3= 6.18, r4= 6.68,
igr1= 168, 169, 170,
&end
#
# 65 LYS H 66 VAL HA 5.23
&rst
ixpk= 0, nxpk= 0, iat=1027,1051, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73, &end
#
# 70 ARG HB3 78 CYS H 5.77
&rst
ixpk= 0, nxpk= 0, iat=1115,1255, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27, &end
#
# 73 ILE HB 78 CYS H 6.12
&rst
ixpk= 0, nxpk= 0, iat=1173,1255, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62, &end
#
# 86 LYS HA 87 GLN H 2.91
&rst
ixpk= 0, nxpk= 0, iat=1371,1391, r1= 1.30, r2= 1.80, r3= 2.91, r4= 3.41, &end
#
# 87 GLN H 88 SER QB 4.94
&rst
ixpk= 0, nxpk= 0, iat=1391, -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
igr2=1412,1413,
&end
#
# 87 GLN H 87 GLN HB2 3.17
&rst
ixpk= 0, nxpk= 0, iat=1391,1395, r1= 1.30, r2= 1.80, r3= 3.17, r4= 3.67, &end
#
# 86 LYS HB3 87 GLN H 3.68
&rst
ixpk= 0, nxpk= 0, iat=1374,1391, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18, &end
#
# 7 LYS QG 87 GLN H 3.98
&rst
ixpk= 0, nxpk= 0, iat= -1,1391, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
igr1= 84, 85,
&end
#
# 142 ASP H 144 ILE H 4.48
&rst
ixpk= 0, nxpk= 0, iat=2277,2306, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98, &end
#
# 144 ILE H 145 ALA H 3.40
&rst
ixpk= 0, nxpk= 0, iat=2306,2325, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90, &end
#
# 139 PHE QD 144 ILE H 5.35
&rst
ixpk= 0, nxpk= 0, iat= -1,2306, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51,
igr1=2243,2251,
&end
#
# 141 ASP HA 144 ILE H 5.01
&rst
ixpk= 0, nxpk= 0, iat=2267,2306, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51, &end
#
# 142 ASP HA 144 ILE H 4.63
&rst
ixpk= 0, nxpk= 0, iat=2279,2306, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, &end
#
# 144 ILE H 145 ALA HA 5.70
&rst
ixpk= 0, nxpk= 0, iat=2306,2327, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20, &end
#
# 141 ASP HB2 144 ILE H 3.88
&rst
ixpk= 0, nxpk= 0, iat=2269,2306, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38, &end
#
# 141 ASP HB3 144 ILE H 4.19
&rst
ixpk= 0, nxpk= 0, iat=2270,2306, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69, &end
#
# 143 GLN QB 144 ILE H 3.60
&rst
ixpk= 0, nxpk= 0, iat= -1,2306, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
igr1=2293,2294,
&end
#
# 144 ILE H 144 ILE HB 3.21
&rst
ixpk= 0, nxpk= 0, iat=2306,2310, r1= 1.30, r2= 1.80, r3= 3.21, r4= 3.71, &end
#
# 144 ILE H 145 ALA QB 4.45
&rst
ixpk= 0, nxpk= 0, iat=2306, -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr2=2329,2330,2331,
&end
#
# 144 ILE H 144 ILE HG13 3.43
&rst
ixpk= 0, nxpk= 0, iat=2306,2317, r1= 1.30, r2= 1.80, r3= 3.43, r4= 3.93, &end
#
# 144 ILE H 144 ILE QD1 4.46
&rst
ixpk= 0, nxpk= 0, iat=2306, -1, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
igr2=2319,2320,2321,
&end
#
# 73 ILE H 78 CYS H 4.00
&rst
ixpk= 0, nxpk= 0, iat=1169,1255, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 77 TRP HE3 78 CYS H 3.78
&rst
ixpk= 0, nxpk= 0, iat=1250,1255, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28, &end
#
# 76 ARG HA 78 CYS H 5.88
&rst
ixpk= 0, nxpk= 0, iat=1209,1255, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38, &end
#
# 72 MET HA 78 CYS H 4.10
&rst
ixpk= 0, nxpk= 0, iat=1154,1255, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60, &end
#
# 77 TRP HB2 78 CYS H 4.52
&rst
ixpk= 0, nxpk= 0, iat=1235,1255, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02, &end
#
# 77 TRP HB3 78 CYS H 4.54
&rst
ixpk= 0, nxpk= 0, iat=1236,1255, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 73 ILE QD1 78 CYS H 5.61
&rst
ixpk= 0, nxpk= 0, iat= -1,1255, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
igr1=1182,1183,1184,
&end
#
# 72 MET H 78 CYS H 5.55
&rst
ixpk= 0, nxpk= 0, iat=1152,1255, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05, &end
#
# 71 HID HD2 78 CYS H 5.13
&rst
ixpk= 0, nxpk= 0, iat=1148,1255, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63, &end
#
# 97 LYS H 98 VAL H 4.86
&rst
ixpk= 0, nxpk= 0, iat=1555,1577, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36, &end
#
# 97 LYS H 139 PHE QD 6.09
&rst
ixpk= 0, nxpk= 0, iat=1555, -1, r1= 1.30, r2= 1.80, r3= 6.84, r4= 7.34,
igr2=2243,2251,
&end
#
# 19 LYS QE 20 THR H 4.91
&rst
ixpk= 0, nxpk= 0, iat= -1, 295, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
igr1= 286, 287,
&end
#
# 95 SER HB3 96 ARG H 4.44
&rst
ixpk= 0, nxpk= 0, iat=1525,1531, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94, &end
#
# 96 ARG H 97 LYS H 3.51
&rst
ixpk= 0, nxpk= 0, iat=1531,1555, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01, &end
#
# 97 LYS H 97 LYS QE 5.71
&rst
ixpk= 0, nxpk= 0, iat=1555, -1, r1= 1.30, r2= 1.80, r3= 6.41, r4= 6.91,
igr2=1568,1569,
&end
#
# 96 ARG HB3 97 LYS H 4.24
&rst
ixpk= 0, nxpk= 0, iat=1536,1555, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74, &end
#
# 96 ARG HB2 97 LYS H 3.78
&rst
ixpk= 0, nxpk= 0, iat=1535,1555, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28, &end
#
# 97 LYS H 97 LYS QB 3.03
&rst
ixpk= 0, nxpk= 0, iat=1555, -1, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90,
igr2=1559,1560,
&end
#
# 97 LYS H 97 LYS QG 3.83
&rst
ixpk= 0, nxpk= 0, iat=1555, -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
igr2=1562,1563,
&end
#
# 96 ARG QD 97 LYS H 5.66
&rst
ixpk= 0, nxpk= 0, iat= -1,1555, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
igr1=1541,1542,
&end
#
# 109 GLU H 111 GLU H 4.68
&rst
ixpk= 0, nxpk= 0, iat=1743,1770, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18, &end
#
# 20 THR H 21 THR H 4.67
&rst
ixpk= 0, nxpk= 0, iat= 295, 309, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, &end
#
# 19 LYS H 20 THR H 3.26
&rst
ixpk= 0, nxpk= 0, iat= 273, 295, r1= 1.30, r2= 1.80, r3= 3.26, r4= 3.76, &end
#
# 18 TRP H 20 THR H 4.06
&rst
ixpk= 0, nxpk= 0, iat= 249, 295, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56, &end
#
# 18 TRP HA 20 THR H 4.58
&rst
ixpk= 0, nxpk= 0, iat= 251, 295, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08, &end
#
# 20 THR H 20 THR HB 2.97
&rst
ixpk= 0, nxpk= 0, iat= 295, 299, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 17 PRO QB 20 THR H 3.78
&rst
ixpk= 0, nxpk= 0, iat= -1, 295, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
igr1= 242, 243,
&end
#
# 17 PRO QG 20 THR H 3.51
&rst
ixpk= 0, nxpk= 0, iat= -1, 295, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,
igr1= 239, 240,
&end
#
# 19 LYS HB2 20 THR H 4.46
&rst
ixpk= 0, nxpk= 0, iat= 277, 295, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, &end
#
# 19 LYS HB3 20 THR H 4.15
&rst
ixpk= 0, nxpk= 0, iat= 278, 295, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65, &end
#
# 19 LYS QD 20 THR H 4.91
&rst
ixpk= 0, nxpk= 0, iat= -1, 295, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
igr1= 283, 284,
&end
#
# 19 LYS HG2 20 THR H 3.42
&rst
ixpk= 0, nxpk= 0, iat= 280, 295, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92, &end
#
# 19 LYS HG3 20 THR H 3.68
&rst
ixpk= 0, nxpk= 0, iat= 281, 295, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18, &end
#
# 16 LEU QQD 20 THR H 5.60
&rst
ixpk= 0, nxpk= 0, iat= -1, 295, r1= 1.30, r2= 1.80, r3= 7.55, r4= 8.05,
igr1= 225, 226, 227, 229, 230, 231,
&end
#
# 29 PHE QE 80 CYS H 6.03
&rst
ixpk= 0, nxpk= 0, iat= -1,1278, r1= 1.30, r2= 1.80, r3= 6.77, r4= 7.27,
igr1= 454, 458,
&end
#
# 26 LYS H 27 GLU H 3.11
&rst
ixpk= 0, nxpk= 0, iat= 386, 408, r1= 1.30, r2= 1.80, r3= 3.11, r4= 3.61, &end
#
# 25 LEU H 26 LYS H 3.29
&rst
ixpk= 0, nxpk= 0, iat= 367, 386, r1= 1.30, r2= 1.80, r3= 3.29, r4= 3.79, &end
#
# 24 ASP H 26 LYS H 4.79
&rst
ixpk= 0, nxpk= 0, iat= 355, 386, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29, &end
#
# 26 LYS H 29 PHE QD 4.43
&rst
ixpk= 0, nxpk= 0, iat= 386, -1, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
igr2= 452, 460,
&end
#
# 24 ASP HA 26 LYS H 4.90
&rst
ixpk= 0, nxpk= 0, iat= 357, 386, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40, &end
#
# 23 GLN HA 26 LYS H 3.40
&rst
ixpk= 0, nxpk= 0, iat= 340, 386, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90, &end
#
# 26 LYS H 26 LYS QE 4.79
&rst
ixpk= 0, nxpk= 0, iat= 386, -1, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
igr2= 399, 400,
&end
#
# 26 LYS H 26 LYS HB3 2.83
&rst
ixpk= 0, nxpk= 0, iat= 386, 391, r1= 1.30, r2= 1.80, r3= 2.83, r4= 3.33, &end
#
# 26 LYS H 26 LYS HB2 3.59
&rst
ixpk= 0, nxpk= 0, iat= 386, 390, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09, &end
#
# 25 LEU HB3 26 LYS H 3.27
&rst
ixpk= 0, nxpk= 0, iat= 372, 386, r1= 1.30, r2= 1.80, r3= 3.27, r4= 3.77, &end
#
# 25 LEU HB2 26 LYS H 3.10
&rst
ixpk= 0, nxpk= 0, iat= 371, 386, r1= 1.30, r2= 1.80, r3= 3.10, r4= 3.60, &end
#
# 26 LYS H 26 LYS HG2 3.68
&rst
ixpk= 0, nxpk= 0, iat= 386, 393, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18, &end
#
# 20 THR QG2 26 LYS H 5.88
&rst
ixpk= 0, nxpk= 0, iat= -1, 386, r1= 1.30, r2= 1.80, r3= 7.06, r4= 7.56,
igr1= 301, 302, 303,
&end
#
# 95 SER HB2 96 ARG H 4.44
&rst
ixpk= 0, nxpk= 0, iat=1524,1531, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94, &end
#
# 96 ARG H 96 ARG HB3 3.91
&rst
ixpk= 0, nxpk= 0, iat=1531,1536, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41, &end
#
# 96 ARG H 96 ARG HB2 3.86
&rst
ixpk= 0, nxpk= 0, iat=1531,1535, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 96 ARG H 96 ARG QD 4.74
&rst
ixpk= 0, nxpk= 0, iat=1531, -1, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
igr2=1541,1542,
&end
#
# 167 PRO QG 172 ASN H 4.13
&rst
ixpk= 0, nxpk= 0, iat= -1,2723, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
igr1=2649,2650,
&end
#
# 108 THR HB 111 GLU H 4.92
&rst
ixpk= 0, nxpk= 0, iat=1733,1770, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42, &end
#
# 111 GLU H 112 LEU HA 5.69
&rst
ixpk= 0, nxpk= 0, iat=1770,1787, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19, &end
#
# 110 ASP HB2 111 GLU H 3.62
&rst
ixpk= 0, nxpk= 0, iat=1762,1770, r1= 1.30, r2= 1.80, r3= 3.62, r4= 4.12, &end
#
# 108 THR QG2 111 GLU H 3.92
&rst
ixpk= 0, nxpk= 0, iat= -1,1770, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
igr1=1735,1736,1737,
&end
#
# 109 GLU HA 111 GLU H 4.92
&rst
ixpk= 0, nxpk= 0, iat=1745,1770, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42, &end
#
# 110 ASP HB3 111 GLU H 3.62
&rst
ixpk= 0, nxpk= 0, iat=1763,1770, r1= 1.30, r2= 1.80, r3= 3.62, r4= 4.12, &end
#
# 111 GLU H 111 GLU HB3 3.59
&rst
ixpk= 0, nxpk= 0, iat=1770,1775, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09, &end
#
# 111 GLU H 111 GLU HB2 3.16
&rst
ixpk= 0, nxpk= 0, iat=1770,1774, r1= 1.30, r2= 1.80, r3= 3.16, r4= 3.66, &end
#
# 111 GLU H 112 LEU HB2 5.31
&rst
ixpk= 0, nxpk= 0, iat=1770,1789, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81, &end
#
# 80 CYS H 81 LYS H 4.54
&rst
ixpk= 0, nxpk= 0, iat=1278,1289, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 79 ASP H 80 CYS H 4.59
&rst
ixpk= 0, nxpk= 0, iat=1266,1278, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 71 HID HD2 80 CYS H 3.94
&rst
ixpk= 0, nxpk= 0, iat=1148,1278, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44, &end
#
# 79 ASP HA 80 CYS H 2.79
&rst
ixpk= 0, nxpk= 0, iat=1268,1278, r1= 1.30, r2= 1.80, r3= 2.79, r4= 3.29, &end
#
# 70 ARG HA 80 CYS H 4.11
&rst
ixpk= 0, nxpk= 0, iat=1112,1278, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 67 MET HA 80 CYS H 4.33
&rst
ixpk= 0, nxpk= 0, iat=1067,1278, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83, &end
#
# 80 CYS H 80 CYS HB2 3.45
&rst
ixpk= 0, nxpk= 0, iat=1278,1282, r1= 1.30, r2= 1.80, r3= 3.45, r4= 3.95, &end
#
# 79 ASP HB3 80 CYS H 3.85
&rst
ixpk= 0, nxpk= 0, iat=1271,1278, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35, &end
#
# 80 CYS H 81 LYS HG2 4.86
&rst
ixpk= 0, nxpk= 0, iat=1278,1296, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36, &end
#
# 4 MET H 5 ALA H 4.61
&rst
ixpk= 0, nxpk= 0, iat= 39, 56, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 3 HIS HA 4 MET H 3.45
&rst
ixpk= 0, nxpk= 0, iat= 24, 39, r1= 1.30, r2= 1.80, r3= 3.45, r4= 3.95, &end
#
# 4 MET H 4 MET HB3 3.85
&rst
ixpk= 0, nxpk= 0, iat= 39, 44, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35, &end
#
# 24 ASP H 27 GLU H 5.06
&rst
ixpk= 0, nxpk= 0, iat= 355, 408, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56, &end
#
# 27 GLU H 28 TYR H 3.25
&rst
ixpk= 0, nxpk= 0, iat= 408, 423, r1= 1.30, r2= 1.80, r3= 3.25, r4= 3.75, &end
#
# 24 ASP HA 27 GLU H 3.67
&rst
ixpk= 0, nxpk= 0, iat= 357, 408, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17, &end
#
# 27 GLU H 27 GLU HB2 2.67
&rst
ixpk= 0, nxpk= 0, iat= 408, 412, r1= 1.30, r2= 1.80, r3= 2.67, r4= 3.17, &end
#
# 26 LYS HB2 27 GLU H 4.23
&rst
ixpk= 0, nxpk= 0, iat= 390, 408, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73, &end
#
# 27 GLU H 38 VAL QG1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 408, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 589, 590, 591,
&end
#
# 27 GLU H 38 VAL QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 408, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 593, 594, 595,
&end
#
# 26 LYS HA 27 GLU H 3.55
&rst
ixpk= 0, nxpk= 0, iat= 388, 408, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05, &end
#
# 27 GLU H 28 TYR HB3 4.78
&rst
ixpk= 0, nxpk= 0, iat= 408, 428, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, &end
#
# 26 LYS QE 27 GLU H 4.74
&rst
ixpk= 0, nxpk= 0, iat= -1, 408, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
igr1= 399, 400,
&end
#
# 27 GLU H 27 GLU HG2 3.23
&rst
ixpk= 0, nxpk= 0, iat= 408, 415, r1= 1.30, r2= 1.80, r3= 3.23, r4= 3.73, &end
#
# 21 THR H 22 GLU H 4.65
&rst
ixpk= 0, nxpk= 0, iat= 309, 323, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15, &end
#
# 22 GLU H 40 VAL H 5.61
&rst
ixpk= 0, nxpk= 0, iat= 323, 616, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11, &end
#
# 21 THR HA 22 GLU H 2.96
&rst
ixpk= 0, nxpk= 0, iat= 311, 323, r1= 1.30, r2= 1.80, r3= 2.96, r4= 3.46, &end
#
# 22 GLU H 23 GLN HA 5.52
&rst
ixpk= 0, nxpk= 0, iat= 323, 340, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02, &end
#
# 22 GLU H 22 GLU HG2 4.70
&rst
ixpk= 0, nxpk= 0, iat= 323, 330, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 22 GLU H 22 GLU HB2 3.17
&rst
ixpk= 0, nxpk= 0, iat= 323, 327, r1= 1.30, r2= 1.80, r3= 3.17, r4= 3.67, &end
#
# 22 GLU H 22 GLU HB3 3.29
&rst
ixpk= 0, nxpk= 0, iat= 323, 328, r1= 1.30, r2= 1.80, r3= 3.29, r4= 3.79, &end
#
# 118 GLN HE22 154 ILE H 5.78
&rst
ixpk= 0, nxpk= 0, iat=1906,2446, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28, &end
#
# 139 PHE HA 140 ALA H 3.08
&rst
ixpk= 0, nxpk= 0, iat=2237,2255, r1= 1.30, r2= 1.80, r3= 3.08, r4= 3.58, &end
#
# 139 PHE H 140 ALA H 4.74
&rst
ixpk= 0, nxpk= 0, iat=2235,2255, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24, &end
#
# 122 VAL HA 140 ALA H 4.05
&rst
ixpk= 0, nxpk= 0, iat=1953,2255, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55, &end
#
# 139 PHE HB3 140 ALA H 3.59
&rst
ixpk= 0, nxpk= 0, iat=2240,2255, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09, &end
#
# 147 SER QB 148 LEU H 3.57
&rst
ixpk= 0, nxpk= 0, iat= -1,2363, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,
igr1=2356,2357,
&end
#
# 144 ILE HA 148 LEU H 4.90
&rst
ixpk= 0, nxpk= 0, iat=2308,2363, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40, &end
#
# 145 ALA HA 148 LEU H 4.12
&rst
ixpk= 0, nxpk= 0, iat=2327,2363, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62, &end
#
# 146 GLN QG 148 LEU H 5.49
&rst
ixpk= 0, nxpk= 0, iat= -1,2363, r1= 1.30, r2= 1.80, r3= 6.16, r4= 6.66,
igr1=2342,2343,
&end
#
# 144 ILE QG2 148 LEU H 5.66
&rst
ixpk= 0, nxpk= 0, iat= -1,2363, r1= 1.30, r2= 1.80, r3= 6.80, r4= 7.30,
igr1=2312,2313,2314,
&end
#
# 148 LEU H 148 LEU HB2 3.86
&rst
ixpk= 0, nxpk= 0, iat=2363,2367, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 148 LEU H 148 LEU QD1 4.74
&rst
ixpk= 0, nxpk= 0, iat=2363, -1, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
igr2=2372,2373,2374,
&end
#
# 22 GLU H 25 LEU H 5.13
&rst
ixpk= 0, nxpk= 0, iat= 323, 367, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63, &end
#
# 10 ASP HB3 11 LEU H 4.01
&rst
ixpk= 0, nxpk= 0, iat= 129, 136, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51, &end
#
# 11 LEU H 11 LEU QD1 5.35
&rst
ixpk= 0, nxpk= 0, iat= 136, -1, r1= 1.30, r2= 1.80, r3= 6.43, r4= 6.93,
igr2= 145, 146, 147,
&end
#
# 11 LEU H 55 VAL H 3.78
&rst
ixpk= 0, nxpk= 0, iat= 136, 855, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28, &end
#
# 11 LEU H 54 PHE QD 4.56
&rst
ixpk= 0, nxpk= 0, iat= 136, -1, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
igr2= 843, 851,
&end
#
# 11 LEU H 54 PHE HA 4.91
&rst
ixpk= 0, nxpk= 0, iat= 136, 837, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41, &end
#
# 10 ASP HA 11 LEU H 3.14
&rst
ixpk= 0, nxpk= 0, iat= 126, 136, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64, &end
#
# 10 ASP HB2 11 LEU H 4.45
&rst
ixpk= 0, nxpk= 0, iat= 128, 136, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95, &end
#
# 11 LEU H 11 LEU HG 4.56
&rst
ixpk= 0, nxpk= 0, iat= 136, 143, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06, &end
#
# 11 LEU H 11 LEU HB2 4.12
&rst
ixpk= 0, nxpk= 0, iat= 136, 140, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62, &end
#
# 11 LEU H 11 LEU HB3 4.12
&rst
ixpk= 0, nxpk= 0, iat= 136, 141, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62, &end
#
# 11 LEU H 11 LEU QD2 5.35
&rst
ixpk= 0, nxpk= 0, iat= 136, -1, r1= 1.30, r2= 1.80, r3= 6.43, r4= 6.93,
igr2= 149, 150, 151,
&end
#
# 143 GLN H 144 ILE HG13 4.31
&rst
ixpk= 0, nxpk= 0, iat=2289,2317, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81, &end
#
# 113 ARG HE 114 GLU H 5.81
&rst
ixpk= 0, nxpk= 0, iat=1817,1828, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31, &end
#
# 114 GLU H 116 PHE QD 6.06
&rst
ixpk= 0, nxpk= 0, iat=1828, -1, r1= 1.30, r2= 1.80, r3= 6.80, r4= 7.30,
igr2=1871,1879,
&end
#
# 111 GLU H 112 LEU H 3.34
&rst
ixpk= 0, nxpk= 0, iat=1770,1785, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84, &end
#
# 110 ASP HA 112 LEU H 4.43
&rst
ixpk= 0, nxpk= 0, iat=1760,1785, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93, &end
#
# 109 GLU HA 112 LEU H 4.04
&rst
ixpk= 0, nxpk= 0, iat=1745,1785, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, &end
#
# 112 LEU H 112 LEU HB3 3.64
&rst
ixpk= 0, nxpk= 0, iat=1785,1790, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14, &end
#
# 111 GLU HB2 112 LEU H 3.05
&rst
ixpk= 0, nxpk= 0, iat=1774,1785, r1= 1.30, r2= 1.80, r3= 3.05, r4= 3.55, &end
#
# 112 LEU H 112 LEU HG 3.38
&rst
ixpk= 0, nxpk= 0, iat=1785,1792, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88, &end
#
# 112 LEU H 112 LEU HB2 3.29
&rst
ixpk= 0, nxpk= 0, iat=1785,1789, r1= 1.30, r2= 1.80, r3= 3.29, r4= 3.79, &end
#
# 112 LEU H 155 ILE QG2 5.85
&rst
ixpk= 0, nxpk= 0, iat=1785, -1, r1= 1.30, r2= 1.80, r3= 7.03, r4= 7.53,
igr2=2471,2472,2473,
&end
#
# 112 LEU H 155 ILE QD1 5.94
&rst
ixpk= 0, nxpk= 0, iat=1785, -1, r1= 1.30, r2= 1.80, r3= 7.13, r4= 7.63,
igr2=2478,2479,2480,
&end
#
# 112 LEU H 125 VAL QG1 5.41
&rst
ixpk= 0, nxpk= 0, iat=1785, -1, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
igr2=2002,2003,2004,
&end
#
# 154 ILE H 155 ILE H 4.44
&rst
ixpk= 0, nxpk= 0, iat=2446,2465, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94, &end
#
# 154 ILE H 159 SER HA 4.82
&rst
ixpk= 0, nxpk= 0, iat=2446,2534, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32, &end
#
# 154 ILE H 154 ILE HG13 3.52
&rst
ixpk= 0, nxpk= 0, iat=2446,2457, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02, &end
#
# 115 PHE HZ 154 ILE H 3.78
&rst
ixpk= 0, nxpk= 0, iat=1855,2446, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28, &end
#
# 115 PHE QE 154 ILE H 3.92
&rst
ixpk= 0, nxpk= 0, iat= -1,2446, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,
igr1=1853,1857,
&end
#
# 153 LEU HA 154 ILE H 2.96
&rst
ixpk= 0, nxpk= 0, iat=2429,2446, r1= 1.30, r2= 1.80, r3= 2.96, r4= 3.46, &end
#
# 154 ILE H 154 ILE HB 3.06
&rst
ixpk= 0, nxpk= 0, iat=2446,2450, r1= 1.30, r2= 1.80, r3= 3.06, r4= 3.56, &end
#
# 122 VAL H 140 ALA H 5.16
&rst
ixpk= 0, nxpk= 0, iat=1951,2255, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66, &end
#
# 139 PHE QD 140 ALA H 3.57
&rst
ixpk= 0, nxpk= 0, iat= -1,2255, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,
igr1=2243,2251,
&end
#
# 139 PHE HB2 140 ALA H 4.04
&rst
ixpk= 0, nxpk= 0, iat=2239,2255, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, &end
#
# 25 LEU H 29 PHE QD 5.39
&rst
ixpk= 0, nxpk= 0, iat= 367, -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
igr2= 452, 460,
&end
#
# 22 GLU HA 25 LEU H 3.87
&rst
ixpk= 0, nxpk= 0, iat= 325, 367, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37, &end
#
# 24 ASP HB2 25 LEU H 3.99
&rst
ixpk= 0, nxpk= 0, iat= 359, 367, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49, &end
#
# 25 LEU H 25 LEU HB2 3.33
&rst
ixpk= 0, nxpk= 0, iat= 367, 371, r1= 1.30, r2= 1.80, r3= 3.33, r4= 3.83, &end
#
# 25 LEU H 73 ILE QD1 6.50
&rst
ixpk= 0, nxpk= 0, iat= 367, -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr2=1182,1183,1184,
&end
#
# 73 ILE QD1 79 ASP H 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1266, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr1=1182,1183,1184,
&end
#
# 148 LEU H 153 LEU QD1 6.50
&rst
ixpk= 0, nxpk= 0, iat=2363, -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr2=2436,2437,2438,
&end
#
# 148 LEU H 153 LEU QD2 6.50
&rst
ixpk= 0, nxpk= 0, iat=2363, -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr2=2440,2441,2442,
&end
#
# 21 THR H 23 GLN H 6.00
&rst
ixpk= 0, nxpk= 0, iat= 309, 338, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 21 THR H 24 ASP H 4.49
&rst
ixpk= 0, nxpk= 0, iat= 309, 355, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99, &end
#
# 20 THR HA 21 THR H 2.92
&rst
ixpk= 0, nxpk= 0, iat= 297, 309, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42, &end
#
# 20 THR HB 21 THR H 4.28
&rst
ixpk= 0, nxpk= 0, iat= 299, 309, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78, &end
#
# 21 THR H 24 ASP HB2 4.22
&rst
ixpk= 0, nxpk= 0, iat= 309, 359, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 17 PRO QG 21 THR H 5.78
&rst
ixpk= 0, nxpk= 0, iat= -1, 309, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
igr1= 239, 240,
&end
#
# 21 THR H 25 LEU H 5.55
&rst
ixpk= 0, nxpk= 0, iat= 309, 367, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05, &end
#
# 21 THR H 73 ILE QG2 6.50
&rst
ixpk= 0, nxpk= 0, iat= 309, -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr2=1175,1176,1177,
&end
#
# 11 LEU H 63 GLN HB2 5.18
&rst
ixpk= 0, nxpk= 0, iat= 136, 998, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68, &end
#
# 143 GLN H 145 ALA H 4.26
&rst
ixpk= 0, nxpk= 0, iat=2289,2325, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76, &end
#
# 143 GLN H 144 ILE HA 4.85
&rst
ixpk= 0, nxpk= 0, iat=2289,2308, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35, &end
#
# 141 ASP HB2 143 GLN H 4.30
&rst
ixpk= 0, nxpk= 0, iat=2269,2289, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80, &end
#
# 143 GLN H 144 ILE HB 4.64
&rst
ixpk= 0, nxpk= 0, iat=2289,2310, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14, &end
#
# 143 GLN H 144 ILE QD1 5.42
&rst
ixpk= 0, nxpk= 0, iat=2289, -1, r1= 1.30, r2= 1.80, r3= 6.51, r4= 7.01,
igr2=2319,2320,2321,
&end
#
# 142 ASP H 143 GLN H 3.21
&rst
ixpk= 0, nxpk= 0, iat=2277,2289, r1= 1.30, r2= 1.80, r3= 3.21, r4= 3.71, &end
#
# 141 ASP H 143 GLN H 5.19
&rst
ixpk= 0, nxpk= 0, iat=2265,2289, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69, &end
#
# 143 GLN H 144 ILE H 3.14
&rst
ixpk= 0, nxpk= 0, iat=2289,2306, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64, &end
#
# 141 ASP HA 143 GLN H 4.01
&rst
ixpk= 0, nxpk= 0, iat=2267,2289, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51, &end
#
# 141 ASP HB3 143 GLN H 3.71
&rst
ixpk= 0, nxpk= 0, iat=2270,2289, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21, &end
#
# 143 GLN H 143 GLN QB 3.05
&rst
ixpk= 0, nxpk= 0, iat=2289, -1, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92,
igr2=2293,2294,
&end
#
# 143 GLN H 144 ILE QG2 6.50
&rst
ixpk= 0, nxpk= 0, iat=2289, -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr2=2312,2313,2314,
&end
#
# 113 ARG H 114 GLU H 3.32
&rst
ixpk= 0, nxpk= 0, iat=1804,1828, r1= 1.30, r2= 1.80, r3= 3.32, r4= 3.82, &end
#
# 114 GLU H 115 PHE H 3.41
&rst
ixpk= 0, nxpk= 0, iat=1828,1843, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91, &end
#
# 111 GLU H 114 GLU H 4.88
&rst
ixpk= 0, nxpk= 0, iat=1770,1828, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38, &end
#
# 110 ASP HA 114 GLU H 4.36
&rst
ixpk= 0, nxpk= 0, iat=1760,1828, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86, &end
#
# 111 GLU HA 114 GLU H 3.85
&rst
ixpk= 0, nxpk= 0, iat=1772,1828, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35, &end
#
# 113 ARG HD3 114 GLU H 4.24
&rst
ixpk= 0, nxpk= 0, iat=1815,1828, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74, &end
#
# 114 GLU H 115 PHE HB3 4.63
&rst
ixpk= 0, nxpk= 0, iat=1828,1848, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, &end
#
# 114 GLU H 115 PHE QD 5.56
&rst
ixpk= 0, nxpk= 0, iat=1828, -1, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
igr2=1851,1859,
&end
#
# 112 LEU HB2 114 GLU H 4.66
&rst
ixpk= 0, nxpk= 0, iat=1789,1828, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16, &end
#
# 115 PHE H 155 ILE QD1 6.13
&rst
ixpk= 0, nxpk= 0, iat=1843, -1, r1= 1.30, r2= 1.80, r3= 7.36, r4= 7.86,
igr2=2478,2479,2480,
&end
#
# 140 ALA H 144 ILE QD1 5.07
&rst
ixpk= 0, nxpk= 0, iat=2255, -1, r1= 1.30, r2= 1.80, r3= 6.09, r4= 6.59,
igr2=2319,2320,2321,
&end
#
# 78 CYS H 79 ASP H 4.61
&rst
ixpk= 0, nxpk= 0, iat=1255,1266, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 14 LEU H 79 ASP H 3.76
&rst
ixpk= 0, nxpk= 0, iat= 190,1266, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26, &end
#
# 79 ASP H 80 CYS HA 5.18
&rst
ixpk= 0, nxpk= 0, iat=1266,1280, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68, &end
#
# 78 CYS HA 79 ASP H 2.83
&rst
ixpk= 0, nxpk= 0, iat=1257,1266, r1= 1.30, r2= 1.80, r3= 2.83, r4= 3.33, &end
#
# 79 ASP H 79 ASP HB3 4.06
&rst
ixpk= 0, nxpk= 0, iat=1266,1271, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56, &end
#
# 14 LEU QD1 79 ASP H 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1266, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr1= 199, 200, 201,
&end
#
# 14 LEU QD2 79 ASP H 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1266, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr1= 203, 204, 205,
&end
#
# 129 LYS H 130 PRO HA 4.96
&rst
ixpk= 0, nxpk= 0, iat=2065,2097, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46, &end
#
# 128 PRO HA 129 LYS H 2.68
&rst
ixpk= 0, nxpk= 0, iat=2061,2065, r1= 1.30, r2= 1.80, r3= 2.68, r4= 3.18, &end
#
# 128 PRO HB2 129 LYS H 4.06
&rst
ixpk= 0, nxpk= 0, iat=2058,2065, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56, &end
#
# 129 LYS H 129 LYS QD 3.96
&rst
ixpk= 0, nxpk= 0, iat=2065, -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
igr2=2075,2076,
&end
#
# 129 LYS H 129 LYS HB3 4.00
&rst
ixpk= 0, nxpk= 0, iat=2065,2070, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 115 PHE H 116 PHE H 3.31
&rst
ixpk= 0, nxpk= 0, iat=1843,1863, r1= 1.30, r2= 1.80, r3= 3.31, r4= 3.81, &end
#
# 115 PHE H 115 PHE QD 3.70
&rst
ixpk= 0, nxpk= 0, iat=1843, -1, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65,
igr2=1851,1859,
&end
#
# 112 LEU HA 115 PHE H 3.76
&rst
ixpk= 0, nxpk= 0, iat=1787,1843, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26, &end
#
# 113 ARG HA 115 PHE H 4.75
&rst
ixpk= 0, nxpk= 0, iat=1806,1843, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, &end
#
# 115 PHE H 115 PHE HB3 3.09
&rst
ixpk= 0, nxpk= 0, iat=1843,1848, r1= 1.30, r2= 1.80, r3= 3.09, r4= 3.59, &end
#
# 115 PHE H 115 PHE HB2 3.55
&rst
ixpk= 0, nxpk= 0, iat=1843,1847, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05, &end
#
# 114 GLU HB2 115 PHE H 3.22
&rst
ixpk= 0, nxpk= 0, iat=1832,1843, r1= 1.30, r2= 1.80, r3= 3.22, r4= 3.72, &end
#
# 115 PHE H 155 ILE QG2 6.01
&rst
ixpk= 0, nxpk= 0, iat=1843, -1, r1= 1.30, r2= 1.80, r3= 7.22, r4= 7.72,
igr2=2471,2472,2473,
&end
#
# 23 GLN H 23 GLN HE21 6.50
&rst
ixpk= 0, nxpk= 0, iat= 338, 351, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00, &end
#
# 22 GLU H 23 GLN H 3.37
&rst
ixpk= 0, nxpk= 0, iat= 323, 338, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87, &end
#
# 23 GLN H 23 GLN HB2 2.77
&rst
ixpk= 0, nxpk= 0, iat= 338, 342, r1= 1.30, r2= 1.80, r3= 2.77, r4= 3.27, &end
#
# 23 GLN H 23 GLN HB3 3.01
&rst
ixpk= 0, nxpk= 0, iat= 338, 343, r1= 1.30, r2= 1.80, r3= 3.01, r4= 3.51, &end
#
# 22 GLU H 24 ASP H 4.03
&rst
ixpk= 0, nxpk= 0, iat= 323, 355, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53, &end
#
# 23 GLN H 24 ASP H 3.09
&rst
ixpk= 0, nxpk= 0, iat= 338, 355, r1= 1.30, r2= 1.80, r3= 3.09, r4= 3.59, &end
#
# 24 ASP H 25 LEU H 3.13
&rst
ixpk= 0, nxpk= 0, iat= 355, 367, r1= 1.30, r2= 1.80, r3= 3.13, r4= 3.63, &end
#
# 22 GLU HA 24 ASP H 4.85
&rst
ixpk= 0, nxpk= 0, iat= 325, 355, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35, &end
#
# 24 ASP H 24 ASP HB2 3.73
&rst
ixpk= 0, nxpk= 0, iat= 355, 359, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23, &end
#
# 24 ASP H 24 ASP HB3 3.73
&rst
ixpk= 0, nxpk= 0, iat= 355, 360, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23, &end
#
# 23 GLN HB2 24 ASP H 3.89
&rst
ixpk= 0, nxpk= 0, iat= 342, 355, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39, &end
#
# 23 GLN HB3 24 ASP H 3.12
&rst
ixpk= 0, nxpk= 0, iat= 343, 355, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62, &end
#
# 20 THR QG2 24 ASP H 4.31
&rst
ixpk= 0, nxpk= 0, iat= -1, 355, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
igr1= 301, 302, 303,
&end
#
# 151 GLU HA 152 ASP H 3.50
&rst
ixpk= 0, nxpk= 0, iat=2402,2415, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 152 ASP H 162 ILE QG1 6.32
&rst
ixpk= 0, nxpk= 0, iat=2415, -1, r1= 1.30, r2= 1.80, r3= 7.09, r4= 7.59,
igr2=2586,2587,
&end
#
# 152 ASP H 161 HIS HA 4.67
&rst
ixpk= 0, nxpk= 0, iat=2415,2561, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, &end
#
# 131 PHE H 131 PHE QD 3.78
&rst
ixpk= 0, nxpk= 0, iat=2101, -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
igr2=2109,2117,
&end
#
# 131 PHE H 131 PHE QE 5.82
&rst
ixpk= 0, nxpk= 0, iat=2101, -1, r1= 1.30, r2= 1.80, r3= 6.53, r4= 7.03,
igr2=2111,2115,
&end
#
# 129 LYS HA 131 PHE H 3.77
&rst
ixpk= 0, nxpk= 0, iat=2067,2101, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27, &end
#
# 131 PHE H 131 PHE HB2 3.26
&rst
ixpk= 0, nxpk= 0, iat=2101,2105, r1= 1.30, r2= 1.80, r3= 3.26, r4= 3.76, &end
#
# 131 PHE H 131 PHE HB3 3.52
&rst
ixpk= 0, nxpk= 0, iat=2101,2106, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02, &end
#
# 130 PRO HB3 131 PHE H 3.47
&rst
ixpk= 0, nxpk= 0, iat=2095,2101, r1= 1.30, r2= 1.80, r3= 3.47, r4= 3.97, &end
#
# 23 GLN H 25 LEU H 4.51
&rst
ixpk= 0, nxpk= 0, iat= 338, 367, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01, &end
#
# 65 LYS H 66 VAL H 3.19
&rst
ixpk= 0, nxpk= 0, iat=1027,1049, r1= 1.30, r2= 1.80, r3= 3.19, r4= 3.69, &end
#
# 62 THR HA 66 VAL H 4.95
&rst
ixpk= 0, nxpk= 0, iat= 982,1049, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45, &end
#
# 63 GLN HA 66 VAL H 3.89
&rst
ixpk= 0, nxpk= 0, iat= 996,1049, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39, &end
#
# 66 VAL H 67 MET HG2 4.90
&rst
ixpk= 0, nxpk= 0, iat=1049,1072, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40, &end
#
# 66 VAL H 67 MET HG3 4.90
&rst
ixpk= 0, nxpk= 0, iat=1049,1073, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40, &end
#
# 66 VAL H 66 VAL HB 3.76
&rst
ixpk= 0, nxpk= 0, iat=1049,1053, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26, &end
#
# 66 VAL H 66 VAL QG2 4.86
&rst
ixpk= 0, nxpk= 0, iat=1049, -1, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
igr2=1059,1060,1061,
&end
#
# 62 THR QG2 66 VAL H 5.21
&rst
ixpk= 0, nxpk= 0, iat= -1,1049, r1= 1.30, r2= 1.80, r3= 6.26, r4= 6.76,
igr1= 986, 987, 988,
&end
#
# 46 THR QG2 48 HID H 4.06
&rst
ixpk= 0, nxpk= 0, iat= -1, 750, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
igr1= 735, 736, 737,
&end
#
# 151 GLU H 161 HIS HA 5.66
&rst
ixpk= 0, nxpk= 0, iat=2400,2561, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16, &end
#
# 150 GLY H 151 GLU H 3.37
&rst
ixpk= 0, nxpk= 0, iat=2393,2400, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87, &end
#
# 151 GLU H 152 ASP H 3.76
&rst
ixpk= 0, nxpk= 0, iat=2400,2415, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26, &end
#
# 151 GLU H 163 SER HA 5.81
&rst
ixpk= 0, nxpk= 0, iat=2400,2597, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31, &end
#
# 148 LEU HA 151 GLU H 4.68
&rst
ixpk= 0, nxpk= 0, iat=2365,2400, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18, &end
#
# 149 CYS HA 151 GLU H 3.90
&rst
ixpk= 0, nxpk= 0, iat=2384,2400, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40, &end
#
# 151 GLU H 162 ILE HB 3.51
&rst
ixpk= 0, nxpk= 0, iat=2400,2580, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01, &end
#
# 151 GLU H 151 GLU HG2 3.70
&rst
ixpk= 0, nxpk= 0, iat=2400,2407, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20, &end
#
# 151 GLU H 162 ILE QG1 5.49
&rst
ixpk= 0, nxpk= 0, iat=2400, -1, r1= 1.30, r2= 1.80, r3= 6.16, r4= 6.66,
igr2=2586,2587,
&end
#
# 151 GLU H 162 ILE HA 6.14
&rst
ixpk= 0, nxpk= 0, iat=2400,2578, r1= 1.30, r2= 1.80, r3= 6.14, r4= 6.64, &end
#
# 24 ASP H 26 LYS HG3 5.37
&rst
ixpk= 0, nxpk= 0, iat= 355, 394, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87, &end
#
# 24 ASP H 73 ILE QG2 6.50
&rst
ixpk= 0, nxpk= 0, iat= 355, -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr2=1175,1176,1177,
&end
#
# 105 GLU H 107 MET H 4.82
&rst
ixpk= 0, nxpk= 0, iat=1685,1712, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32, &end
#
# 104 THR H 107 MET H 4.38
&rst
ixpk= 0, nxpk= 0, iat=1671,1712, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88, &end
#
# 103 CYM HA 107 MET H 6.39
&rst
ixpk= 0, nxpk= 0, iat=1662,1712, r1= 1.30, r2= 1.80, r3= 6.39, r4= 6.89, &end
#
# 105 GLU HA 107 MET H 4.78
&rst
ixpk= 0, nxpk= 0, iat=1687,1712, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, &end
#
# 106 ASP HB3 107 MET H 4.50
&rst
ixpk= 0, nxpk= 0, iat=1705,1712, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 107 MET H 107 MET HB3 3.00
&rst
ixpk= 0, nxpk= 0, iat=1712,1717, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 107 MET H 107 MET HB2 3.81
&rst
ixpk= 0, nxpk= 0, iat=1712,1716, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31, &end
#
# 107 MET H 158 ILE HG13 4.14
&rst
ixpk= 0, nxpk= 0, iat=1712,2524, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64, &end
#
# 107 MET H 158 ILE QG2 6.50
&rst
ixpk= 0, nxpk= 0, iat=1712, -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr2=2519,2520,2521,
&end
#
# 69 GLN H 70 ARG H 4.36
&rst
ixpk= 0, nxpk= 0, iat=1093,1110, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86, &end
#
# 69 GLN HA 70 ARG H 2.79
&rst
ixpk= 0, nxpk= 0, iat=1095,1110, r1= 1.30, r2= 1.80, r3= 2.79, r4= 3.29, &end
#
# 70 ARG H 70 ARG HG3 3.52
&rst
ixpk= 0, nxpk= 0, iat=1110,1118, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02, &end
#
# 70 ARG H 70 ARG HG2 3.52
&rst
ixpk= 0, nxpk= 0, iat=1110,1117, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02, &end
#
# 37 MET HB3 38 VAL H 4.22
&rst
ixpk= 0, nxpk= 0, iat= 571, 583, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 37 MET HA 38 VAL H 2.62
&rst
ixpk= 0, nxpk= 0, iat= 568, 583, r1= 1.30, r2= 1.80, r3= 2.62, r4= 3.12, &end
#
# 22 GLU HG2 23 GLN H 3.99
&rst
ixpk= 0, nxpk= 0, iat= 330, 338, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49, &end
#
# 66 VAL H 67 MET HA 5.50
&rst
ixpk= 0, nxpk= 0, iat=1049,1067, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 46 THR H 48 HID H 4.19
&rst
ixpk= 0, nxpk= 0, iat= 729, 750, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69, &end
#
# 47 GLY HA3 48 HID H 3.44
&rst
ixpk= 0, nxpk= 0, iat= 746, 750, r1= 1.30, r2= 1.80, r3= 3.44, r4= 3.94, &end
#
# 46 THR HB 48 HID H 3.51
&rst
ixpk= 0, nxpk= 0, iat= 733, 750, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01, &end
#
# 47 GLY HA2 48 HID H 3.44
&rst
ixpk= 0, nxpk= 0, iat= 745, 750, r1= 1.30, r2= 1.80, r3= 3.44, r4= 3.94, &end
#
# 48 HID H 48 HID HB2 3.50
&rst
ixpk= 0, nxpk= 0, iat= 750, 754, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 48 HID H 48 HID HB3 3.50
&rst
ixpk= 0, nxpk= 0, iat= 750, 755, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 42 LYS HB2 48 HID H 4.88
&rst
ixpk= 0, nxpk= 0, iat= 658, 750, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38, &end
#
# 44 LEU H 48 HID H 5.65
&rst
ixpk= 0, nxpk= 0, iat= 688, 750, r1= 1.30, r2= 1.80, r3= 5.65, r4= 6.15, &end
#
# 107 MET H 108 THR HA 5.58
&rst
ixpk= 0, nxpk= 0, iat=1712,1731, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08, &end
#
# 57 PHE HA 59 GLU H 4.41
&rst
ixpk= 0, nxpk= 0, iat= 897, 929, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, &end
#
# 95 SER H 142 ASP HA 4.58
&rst
ixpk= 0, nxpk= 0, iat=1520,2279, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08, &end
#
# 30 SER H 32 PHE H 4.61
&rst
ixpk= 0, nxpk= 0, iat= 464, 489, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 32 PHE H 57 PHE HZ 6.24
&rst
ixpk= 0, nxpk= 0, iat= 489, 907, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74, &end
#
# 58 THR H 59 GLU H 3.43
&rst
ixpk= 0, nxpk= 0, iat= 915, 929, r1= 1.30, r2= 1.80, r3= 3.43, r4= 3.93, &end
#
# 58 THR HB 59 GLU H 3.98
&rst
ixpk= 0, nxpk= 0, iat= 919, 929, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48, &end
#
# 59 GLU H 60 TYR HA 5.45
&rst
ixpk= 0, nxpk= 0, iat= 929, 946, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95, &end
#
# 59 GLU H 59 GLU HG3 3.40
&rst
ixpk= 0, nxpk= 0, iat= 929, 937, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90, &end
#
# 59 GLU H 59 GLU HB2 3.68
&rst
ixpk= 0, nxpk= 0, iat= 929, 933, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18, &end
#
# 59 GLU H 59 GLU HB3 3.30
&rst
ixpk= 0, nxpk= 0, iat= 929, 934, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80, &end
#
# 59 GLU H 61 GLU H 6.18
&rst
ixpk= 0, nxpk= 0, iat= 929, 965, r1= 1.30, r2= 1.80, r3= 6.18, r4= 6.68, &end
#
# 59 GLU H 60 TYR H 4.54
&rst
ixpk= 0, nxpk= 0, iat= 929, 944, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 59 GLU H 62 THR H 4.88
&rst
ixpk= 0, nxpk= 0, iat= 929, 980, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38, &end
#
# 59 GLU H 59 GLU HG2 3.40
&rst
ixpk= 0, nxpk= 0, iat= 929, 936, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90, &end
#
# 102 ARG H 135 ALA H 6.46
&rst
ixpk= 0, nxpk= 0, iat=1636,2175, r1= 1.30, r2= 1.80, r3= 6.46, r4= 6.96, &end
#
# 134 PHE QE 135 ALA H 5.16
&rst
ixpk= 0, nxpk= 0, iat= -1,2175, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,
igr1=2165,2169,
&end
#
# 99 PHE QE 135 ALA H 4.79
&rst
ixpk= 0, nxpk= 0, iat= -1,2175, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
igr1=1603,1607,
&end
#
# 134 PHE QD 135 ALA H 3.31
&rst
ixpk= 0, nxpk= 0, iat= -1,2175, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,
igr1=2163,2171,
&end
#
# 134 PHE HA 135 ALA H 3.31
&rst
ixpk= 0, nxpk= 0, iat=2157,2175, r1= 1.30, r2= 1.80, r3= 3.31, r4= 3.81, &end
#
# 134 PHE HB2 135 ALA H 3.90
&rst
ixpk= 0, nxpk= 0, iat=2159,2175, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40, &end
#
# 134 PHE HB3 135 ALA H 3.90
&rst
ixpk= 0, nxpk= 0, iat=2160,2175, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40, &end
#
# 135 ALA H 135 ALA QB 3.43
&rst
ixpk= 0, nxpk= 0, iat=2175, -1, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
igr2=2179,2180,2181,
&end
#
# 100 VAL QG1 135 ALA H 5.21
&rst
ixpk= 0, nxpk= 0, iat= -1,2175, r1= 1.30, r2= 1.80, r3= 6.26, r4= 6.76,
igr1=1619,1620,1621,
&end
#
# 100 VAL QG2 135 ALA H 5.21
&rst
ixpk= 0, nxpk= 0, iat= -1,2175, r1= 1.30, r2= 1.80, r3= 6.26, r4= 6.76,
igr1=1623,1624,1625,
&end
#
# 135 ALA H 136 PHE H 4.58
&rst
ixpk= 0, nxpk= 0, iat=2175,2185, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08, &end
#
# 94 ARG HG2 95 SER H 3.80
&rst
ixpk= 0, nxpk= 0, iat=1503,1520, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30, &end
#
# 95 SER H 145 ALA QB 4.23
&rst
ixpk= 0, nxpk= 0, iat=1520, -1, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
igr2=2329,2330,2331,
&end
#
# 94 ARG H 95 SER H 4.66
&rst
ixpk= 0, nxpk= 0, iat=1496,1520, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16, &end
#
# 94 ARG HA 95 SER H 2.62
&rst
ixpk= 0, nxpk= 0, iat=1498,1520, r1= 1.30, r2= 1.80, r3= 2.62, r4= 3.12, &end
#
# 94 ARG QD 95 SER H 4.60
&rst
ixpk= 0, nxpk= 0, iat= -1,1520, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
igr1=1506,1507,
&end
#
# 95 SER H 142 ASP HB2 4.13
&rst
ixpk= 0, nxpk= 0, iat=1520,2281, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63, &end
#
# 95 SER H 146 GLN QG 4.44
&rst
ixpk= 0, nxpk= 0, iat=1520, -1, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
igr2=2342,2343,
&end
#
# 95 SER H 146 GLN QB 4.48
&rst
ixpk= 0, nxpk= 0, iat=1520, -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
igr2=2339,2340,
&end
#
# 94 ARG HB2 95 SER H 3.56
&rst
ixpk= 0, nxpk= 0, iat=1500,1520, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06, &end
#
# 93 LEU QD1 95 SER H 5.64
&rst
ixpk= 0, nxpk= 0, iat= -1,1520, r1= 1.30, r2= 1.80, r3= 6.77, r4= 7.27,
igr1=1486,1487,1488,
&end
#
# 31 THR HA 32 PHE H 3.45
&rst
ixpk= 0, nxpk= 0, iat= 477, 489, r1= 1.30, r2= 1.80, r3= 3.45, r4= 3.95, &end
#
# 32 PHE H 33 GLY H 2.87
&rst
ixpk= 0, nxpk= 0, iat= 489, 509, r1= 1.30, r2= 1.80, r3= 2.87, r4= 3.37, &end
#
# 32 PHE H 32 PHE QD 2.95
&rst
ixpk= 0, nxpk= 0, iat= 489, -1, r1= 1.30, r2= 1.80, r3= 3.31, r4= 3.81,
igr2= 497, 505,
&end
#
# 32 PHE H 57 PHE QE 4.53
&rst
ixpk= 0, nxpk= 0, iat= 489, -1, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
igr2= 905, 909,
&end
#
# 30 SER HA 32 PHE H 3.64
&rst
ixpk= 0, nxpk= 0, iat= 466, 489, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14, &end
#
# 29 PHE HA 32 PHE H 4.18
&rst
ixpk= 0, nxpk= 0, iat= 446, 489, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68, &end
#
# 31 THR HB 32 PHE H 4.46
&rst
ixpk= 0, nxpk= 0, iat= 479, 489, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, &end
#
# 32 PHE H 32 PHE HB3 3.86
&rst
ixpk= 0, nxpk= 0, iat= 489, 494, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 29 PHE HB2 32 PHE H 6.02
&rst
ixpk= 0, nxpk= 0, iat= 448, 489, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52, &end
#
# 32 PHE H 32 PHE HB2 3.19
&rst
ixpk= 0, nxpk= 0, iat= 489, 493, r1= 1.30, r2= 1.80, r3= 3.19, r4= 3.69, &end
#
# 71 HID H 78 CYS H 3.91
&rst
ixpk= 0, nxpk= 0, iat=1134,1255, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41, &end
#
# 71 HID H 72 MET H 4.53
&rst
ixpk= 0, nxpk= 0, iat=1134,1152, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03, &end
#
# 70 ARG H 71 HID H 4.57
&rst
ixpk= 0, nxpk= 0, iat=1110,1134, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07, &end
#
# 71 HID H 71 HID HB2 3.62
&rst
ixpk= 0, nxpk= 0, iat=1134,1138, r1= 1.30, r2= 1.80, r3= 3.62, r4= 4.12, &end
#
# 71 HID H 73 ILE QD1 6.32
&rst
ixpk= 0, nxpk= 0, iat=1134, -1, r1= 1.30, r2= 1.80, r3= 7.59, r4= 8.09,
igr2=1182,1183,1184,
&end
#
# 71 HID H 73 ILE H 6.15
&rst
ixpk= 0, nxpk= 0, iat=1134,1169, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 71 HID H 79 ASP H 6.50
&rst
ixpk= 0, nxpk= 0, iat=1134,1266, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00, &end
#
# 71 HID H 77 TRP HE3 3.60
&rst
ixpk= 0, nxpk= 0, iat=1134,1250, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10, &end
#
# 71 HID H 71 HID HD2 3.46
&rst
ixpk= 0, nxpk= 0, iat=1134,1148, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96, &end
#
# 71 HID H 77 TRP HZ3 4.34
&rst
ixpk= 0, nxpk= 0, iat=1134,1248, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84, &end
#
# 70 ARG HA 71 HID H 3.37
&rst
ixpk= 0, nxpk= 0, iat=1112,1134, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87, &end
#
# 71 HID H 71 HID HB3 4.05
&rst
ixpk= 0, nxpk= 0, iat=1134,1139, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55, &end
#
# 70 ARG HB3 71 HID H 3.52
&rst
ixpk= 0, nxpk= 0, iat=1115,1134, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02, &end
#
# 71 HID H 80 CYS H 5.68
&rst
ixpk= 0, nxpk= 0, iat=1134,1278, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18, &end
#
# 71 HID H 79 ASP HA 4.74
&rst
ixpk= 0, nxpk= 0, iat=1134,1268, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24, &end
#
# 71 HID H 78 CYS HA 5.48
&rst
ixpk= 0, nxpk= 0, iat=1134,1257, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98, &end
#
# 70 ARG HB2 71 HID H 3.46
&rst
ixpk= 0, nxpk= 0, iat=1114,1134, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96, &end
#
# 71 HID H 73 ILE HG13 5.34
&rst
ixpk= 0, nxpk= 0, iat=1134,1180, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84, &end
#
# 99 PHE QD 164 ASN H 5.03
&rst
ixpk= 0, nxpk= 0, iat= -1,2606, r1= 1.30, r2= 1.80, r3= 5.65, r4= 6.15,
igr1=1601,1609,
&end
#
# 26 LYS QE 28 TYR H 5.82
&rst
ixpk= 0, nxpk= 0, iat= -1, 423, r1= 1.30, r2= 1.80, r3= 6.53, r4= 7.03,
igr1= 399, 400,
&end
#
# 28 TYR H 29 PHE HB3 6.29
&rst
ixpk= 0, nxpk= 0, iat= 423, 449, r1= 1.30, r2= 1.80, r3= 6.29, r4= 6.79, &end
#
# 28 TYR H 35 VAL QG2 6.50
&rst
ixpk= 0, nxpk= 0, iat= 423, -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr2= 541, 542, 543,
&end
#
# 28 TYR H 35 VAL QG1 6.50
&rst
ixpk= 0, nxpk= 0, iat= 423, -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr2= 537, 538, 539,
&end
#
# 28 TYR H 29 PHE HB2 4.45
&rst
ixpk= 0, nxpk= 0, iat= 423, 448, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95, &end
#
# 163 SER H 164 ASN H 4.43
&rst
ixpk= 0, nxpk= 0, iat=2595,2606, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93, &end
#
# 164 ASN H 165 ALA H 4.55
&rst
ixpk= 0, nxpk= 0, iat=2606,2620, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05, &end
#
# 164 ASN H 164 ASN HD22 3.97
&rst
ixpk= 0, nxpk= 0, iat=2606,2615, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47, &end
#
# 164 ASN H 164 ASN HD21 4.04
&rst
ixpk= 0, nxpk= 0, iat=2606,2616, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, &end
#
# 163 SER HA 164 ASN H 2.99
&rst
ixpk= 0, nxpk= 0, iat=2597,2606, r1= 1.30, r2= 1.80, r3= 2.99, r4= 3.49, &end
#
# 163 SER HB2 164 ASN H 3.88
&rst
ixpk= 0, nxpk= 0, iat=2599,2606, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38, &end
#
# 163 SER HB3 164 ASN H 3.88
&rst
ixpk= 0, nxpk= 0, iat=2600,2606, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38, &end
#
# 164 ASN H 164 ASN QB 2.95
&rst
ixpk= 0, nxpk= 0, iat=2606, -1, r1= 1.30, r2= 1.80, r3= 3.31, r4= 3.81,
igr2=2610,2611,
&end
#
# 164 ASN H 165 ALA QB 5.87
&rst
ixpk= 0, nxpk= 0, iat=2606, -1, r1= 1.30, r2= 1.80, r3= 7.05, r4= 7.55,
igr2=2624,2625,2626,
&end
#
# 67 MET H 71 HID HE1 5.24
&rst
ixpk= 0, nxpk= 0, iat=1065,1144, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74, &end
#
# 67 MET H 68 SER HA 5.06
&rst
ixpk= 0, nxpk= 0, iat=1065,1084, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56, &end
#
# 67 MET H 80 CYS HB3 6.12
&rst
ixpk= 0, nxpk= 0, iat=1065,1283, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62, &end
#
# 28 TYR H 29 PHE H 3.29
&rst
ixpk= 0, nxpk= 0, iat= 423, 444, r1= 1.30, r2= 1.80, r3= 3.29, r4= 3.79, &end
#
# 26 LYS H 28 TYR H 4.16
&rst
ixpk= 0, nxpk= 0, iat= 386, 423, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66, &end
#
# 28 TYR H 28 TYR QE 5.24
&rst
ixpk= 0, nxpk= 0, iat= 423, -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
igr2= 433, 438,
&end
#
# 28 TYR H 29 PHE HA 4.86
&rst
ixpk= 0, nxpk= 0, iat= 423, 446, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36, &end
#
# 26 LYS HA 28 TYR H 4.53
&rst
ixpk= 0, nxpk= 0, iat= 388, 423, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03, &end
#
# 28 TYR H 28 TYR HB3 3.09
&rst
ixpk= 0, nxpk= 0, iat= 423, 428, r1= 1.30, r2= 1.80, r3= 3.09, r4= 3.59, &end
#
# 28 TYR H 28 TYR HB2 3.84
&rst
ixpk= 0, nxpk= 0, iat= 423, 427, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34, &end
#
# 27 GLU HB2 28 TYR H 3.33
&rst
ixpk= 0, nxpk= 0, iat= 412, 423, r1= 1.30, r2= 1.80, r3= 3.33, r4= 3.83, &end
#
# 26 LYS QD 28 TYR H 4.62
&rst
ixpk= 0, nxpk= 0, iat= -1, 423, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
igr1= 396, 397,
&end
#
# 28 TYR H 31 THR QG2 5.85
&rst
ixpk= 0, nxpk= 0, iat= 423, -1, r1= 1.30, r2= 1.80, r3= 7.03, r4= 7.53,
igr2= 481, 482, 483,
&end
#
# 28 TYR H 73 ILE QG2 6.34
&rst
ixpk= 0, nxpk= 0, iat= 423, -1, r1= 1.30, r2= 1.80, r3= 7.61, r4= 8.11,
igr2=1175,1176,1177,
&end
#
# 28 TYR H 29 PHE QD 4.58
&rst
ixpk= 0, nxpk= 0, iat= 423, -1, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
igr2= 452, 460,
&end
#
# 28 TYR H 28 TYR QD 3.75
&rst
ixpk= 0, nxpk= 0, iat= 423, -1, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,
igr2= 431, 440,
&end
#
# 24 ASP HA 28 TYR H 4.89
&rst
ixpk= 0, nxpk= 0, iat= 357, 423, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39, &end
#
# 27 GLU HG3 28 TYR H 4.53
&rst
ixpk= 0, nxpk= 0, iat= 416, 423, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03, &end
#
# 67 MET H 68 SER QB 4.66
&rst
ixpk= 0, nxpk= 0, iat=1065, -1, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73,
igr2=1086,1087,
&end
#
# 66 VAL QG2 67 MET H 4.93
&rst
ixpk= 0, nxpk= 0, iat= -1,1065, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
igr1=1059,1060,1061,
&end
#
# 64 VAL H 67 MET H 5.18
&rst
ixpk= 0, nxpk= 0, iat=1011,1065, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68, &end
#
# 67 MET H 69 GLN HE21 5.90
&rst
ixpk= 0, nxpk= 0, iat=1065,1106, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40, &end
#
# 67 MET H 81 LYS HA 5.15
&rst
ixpk= 0, nxpk= 0, iat=1065,1291, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65, &end
#
# 65 LYS HA 67 MET H 4.59
&rst
ixpk= 0, nxpk= 0, iat=1029,1065, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 64 VAL HA 67 MET H 4.06
&rst
ixpk= 0, nxpk= 0, iat=1013,1065, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56, &end
#
# 67 MET H 67 MET HG2 3.38
&rst
ixpk= 0, nxpk= 0, iat=1065,1072, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88, &end
#
# 67 MET H 67 MET HB3 3.02
&rst
ixpk= 0, nxpk= 0, iat=1065,1070, r1= 1.30, r2= 1.80, r3= 3.02, r4= 3.52, &end
#
# 67 MET H 67 MET QE 4.26
&rst
ixpk= 0, nxpk= 0, iat=1065, -1, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
igr2=1076,1077,1078,
&end
#
# 66 VAL HB 67 MET H 4.25
&rst
ixpk= 0, nxpk= 0, iat=1053,1065, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75, &end
#
# 11 LEU QD1 67 MET H 5.77
&rst
ixpk= 0, nxpk= 0, iat= -1,1065, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
igr1= 145, 146, 147,
&end
#
# 66 VAL QG1 67 MET H 4.93
&rst
ixpk= 0, nxpk= 0, iat= -1,1065, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
igr1=1055,1056,1057,
&end
#
# 36 LEU H 37 MET H 3.12
&rst
ixpk= 0, nxpk= 0, iat= 547, 566, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62, &end
#
# 37 MET H 38 VAL H 4.47
&rst
ixpk= 0, nxpk= 0, iat= 566, 583, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97, &end
#
# 37 MET H 57 PHE HA 4.60
&rst
ixpk= 0, nxpk= 0, iat= 566, 897, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 35 VAL HA 37 MET H 4.06
&rst
ixpk= 0, nxpk= 0, iat= 533, 566, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56, &end
#
# 37 MET H 37 MET HG3 4.17
&rst
ixpk= 0, nxpk= 0, iat= 566, 574, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67, &end
#
# 37 MET H 37 MET HG2 4.25
&rst
ixpk= 0, nxpk= 0, iat= 566, 573, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75, &end
#
# 37 MET H 56 ARG QB 3.71
&rst
ixpk= 0, nxpk= 0, iat= 566, -1, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
igr2= 875, 876,
&end
#
# 36 LEU HB2 37 MET H 3.56
&rst
ixpk= 0, nxpk= 0, iat= 551, 566, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06, &end
#
# 36 LEU HB3 37 MET H 3.73
&rst
ixpk= 0, nxpk= 0, iat= 552, 566, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23, &end
#
# 118 GLN H 120 GLY H 4.40
&rst
ixpk= 0, nxpk= 0, iat=1894,1932, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 118 GLN H 119 TYR QD 4.07
&rst
ixpk= 0, nxpk= 0, iat=1894, -1, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,
igr2=1919,1928,
&end
#
# 116 PHE HA 118 GLN H 4.11
&rst
ixpk= 0, nxpk= 0, iat=1865,1894, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 118 GLN H 118 GLN HA 2.88
&rst
ixpk= 0, nxpk= 0, iat=1894,1896, r1= 1.30, r2= 1.80, r3= 2.88, r4= 3.38, &end
#
# 116 PHE HB2 118 GLN H 5.31
&rst
ixpk= 0, nxpk= 0, iat=1867,1894, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81, &end
#
# 118 GLN H 118 GLN QG 3.39
&rst
ixpk= 0, nxpk= 0, iat=1894, -1, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,
igr2=1901,1902,
&end
#
# 118 GLN H 118 GLN QB 2.86
&rst
ixpk= 0, nxpk= 0, iat=1894, -1, r1= 1.30, r2= 1.80, r3= 3.21, r4= 3.71,
igr2=1898,1899,
&end
#
# 118 GLN H 118 GLN HE21 4.34
&rst
ixpk= 0, nxpk= 0, iat=1894,1907, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84, &end
#
# 118 GLN H 118 GLN HE22 5.81
&rst
ixpk= 0, nxpk= 0, iat=1894,1906, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31, &end
#
# 161 HIS H 161 HIS HB2 3.88
&rst
ixpk= 0, nxpk= 0, iat=2559,2563, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38, &end
#
# 119 TYR H 119 TYR QD 3.17
&rst
ixpk= 0, nxpk= 0, iat=1911, -1, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06,
igr2=1919,1928,
&end
#
# 119 TYR H 119 TYR HB2 3.27
&rst
ixpk= 0, nxpk= 0, iat=1911,1915, r1= 1.30, r2= 1.80, r3= 3.27, r4= 3.77, &end
#
# 118 GLN QG 119 TYR H 3.87
&rst
ixpk= 0, nxpk= 0, iat= -1,1911, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,
igr1=1901,1902,
&end
#
# 118 GLN QB 119 TYR H 3.61
&rst
ixpk= 0, nxpk= 0, iat= -1,1911, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,
igr1=1898,1899,
&end
#
# 119 TYR H 120 GLY H 2.97
&rst
ixpk= 0, nxpk= 0, iat=1911,1932, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 118 GLN H 119 TYR H 3.19
&rst
ixpk= 0, nxpk= 0, iat=1894,1911, r1= 1.30, r2= 1.80, r3= 3.19, r4= 3.69, &end
#
# 119 TYR H 119 TYR QE 4.54
&rst
ixpk= 0, nxpk= 0, iat=1911, -1, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
igr2=1921,1926,
&end
#
# 117 SER HA 119 TYR H 3.95
&rst
ixpk= 0, nxpk= 0, iat=1885,1911, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45, &end
#
# 116 PHE HA 119 TYR H 4.11
&rst
ixpk= 0, nxpk= 0, iat=1865,1911, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 119 TYR H 119 TYR HB3 3.77
&rst
ixpk= 0, nxpk= 0, iat=1911,1916, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27, &end
#
# 116 PHE H 119 TYR H 5.94
&rst
ixpk= 0, nxpk= 0, iat=1863,1911, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44, &end
#
# 34 GLU H 35 VAL H 3.54
&rst
ixpk= 0, nxpk= 0, iat= 516, 531, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04, &end
#
# 34 GLU H 58 THR H 4.69
&rst
ixpk= 0, nxpk= 0, iat= 516, 915, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, &end
#
# 33 GLY H 34 GLU H 3.77
&rst
ixpk= 0, nxpk= 0, iat= 509, 516, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27, &end
#
# 34 GLU H 57 PHE QD 4.17
&rst
ixpk= 0, nxpk= 0, iat= 516, -1, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
igr2= 903, 911,
&end
#
# 34 GLU H 57 PHE QE 5.21
&rst
ixpk= 0, nxpk= 0, iat= 516, -1, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
igr2= 905, 909,
&end
#
# 30 SER HA 34 GLU H 4.77
&rst
ixpk= 0, nxpk= 0, iat= 466, 516, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27, &end
#
# 33 GLY HA3 34 GLU H 2.74
&rst
ixpk= 0, nxpk= 0, iat= 512, 516, r1= 1.30, r2= 1.80, r3= 2.74, r4= 3.24, &end
#
# 33 GLY HA2 34 GLU H 3.42
&rst
ixpk= 0, nxpk= 0, iat= 511, 516, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92, &end
#
# 32 PHE HB2 34 GLU H 5.79
&rst
ixpk= 0, nxpk= 0, iat= 493, 516, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29, &end
#
# 34 GLU H 34 GLU HG3 3.43
&rst
ixpk= 0, nxpk= 0, iat= 516, 524, r1= 1.30, r2= 1.80, r3= 3.43, r4= 3.93, &end
#
# 34 GLU H 34 GLU HG2 2.63
&rst
ixpk= 0, nxpk= 0, iat= 516, 523, r1= 1.30, r2= 1.80, r3= 2.63, r4= 3.13, &end
#
# 34 GLU H 34 GLU HB3 3.06
&rst
ixpk= 0, nxpk= 0, iat= 516, 521, r1= 1.30, r2= 1.80, r3= 3.06, r4= 3.56, &end
#
# 34 GLU H 35 VAL HB 5.44
&rst
ixpk= 0, nxpk= 0, iat= 516, 535, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94, &end
#
# 34 GLU H 58 THR QG2 3.81
&rst
ixpk= 0, nxpk= 0, iat= 516, -1, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
igr2= 921, 922, 923,
&end
#
# 34 GLU H 35 VAL QG2 6.50
&rst
ixpk= 0, nxpk= 0, iat= 516, -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr2= 541, 542, 543,
&end
#
# 34 GLU H 62 THR QG2 3.49
&rst
ixpk= 0, nxpk= 0, iat= 516, -1, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,
igr2= 986, 987, 988,
&end
#
# 34 GLU H 35 VAL QG1 6.50
&rst
ixpk= 0, nxpk= 0, iat= 516, -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr2= 537, 538, 539,
&end
#
# 152 ASP HA 161 HIS H 5.50
&rst
ixpk= 0, nxpk= 0, iat=2417,2559, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 101 GLY H 161 HIS H 3.88
&rst
ixpk= 0, nxpk= 0, iat=1629,2559, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38, &end
#
# 160 VAL HA 161 HIS H 3.31
&rst
ixpk= 0, nxpk= 0, iat=2545,2559, r1= 1.30, r2= 1.80, r3= 3.31, r4= 3.81, &end
#
# 100 VAL HA 161 HIS H 5.12
&rst
ixpk= 0, nxpk= 0, iat=1615,2559, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, &end
#
# 161 HIS H 161 HIS HB3 3.88
&rst
ixpk= 0, nxpk= 0, iat=2559,2564, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38, &end
#
# 160 VAL HB 161 HIS H 3.29
&rst
ixpk= 0, nxpk= 0, iat=2547,2559, r1= 1.30, r2= 1.80, r3= 3.29, r4= 3.79, &end
#
# 155 ILE QD1 161 HIS H 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2559, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr1=2478,2479,2480,
&end
#
# 118 GLN HE22 119 TYR H 5.91
&rst
ixpk= 0, nxpk= 0, iat=1906,1911, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41, &end
#
# 45 LYS H 46 THR H 2.76
&rst
ixpk= 0, nxpk= 0, iat= 707, 729, r1= 1.30, r2= 1.80, r3= 2.76, r4= 3.26, &end
#
# 44 LEU HB2 45 LYS H 3.06
&rst
ixpk= 0, nxpk= 0, iat= 692, 707, r1= 1.30, r2= 1.80, r3= 3.06, r4= 3.56, &end
#
# 45 LYS H 45 LYS HG3 3.01
&rst
ixpk= 0, nxpk= 0, iat= 707, 715, r1= 1.30, r2= 1.80, r3= 3.01, r4= 3.51, &end
#
# 45 LYS H 47 GLY H 4.22
&rst
ixpk= 0, nxpk= 0, iat= 707, 743, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 45 LYS H 47 GLY HA2 5.54
&rst
ixpk= 0, nxpk= 0, iat= 707, 745, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04, &end
#
# 45 LYS H 45 LYS QE 3.57
&rst
ixpk= 0, nxpk= 0, iat= 707, -1, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,
igr2= 720, 721,
&end
#
# 154 ILE HG12 159 SER H 4.80
&rst
ixpk= 0, nxpk= 0, iat=2456,2532, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30, &end
#
# 158 ILE H 159 SER H 4.18
&rst
ixpk= 0, nxpk= 0, iat=2513,2532, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68, &end
#
# 158 ILE HA 159 SER H 3.05
&rst
ixpk= 0, nxpk= 0, iat=2515,2532, r1= 1.30, r2= 1.80, r3= 3.05, r4= 3.55, &end
#
# 158 ILE HG12 159 SER H 5.49
&rst
ixpk= 0, nxpk= 0, iat=2523,2532, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99, &end
#
# 154 ILE HA 159 SER H 5.30
&rst
ixpk= 0, nxpk= 0, iat=2448,2532, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80, &end
#
# 84 ASN HD21 85 SER H 5.48
&rst
ixpk= 0, nxpk= 0, iat=1354,1358, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98, &end
#
# 84 ASN HA 85 SER H 3.09
&rst
ixpk= 0, nxpk= 0, iat=1346,1358, r1= 1.30, r2= 1.80, r3= 3.09, r4= 3.59, &end
#
# 85 SER H 85 SER HB2 4.11
&rst
ixpk= 0, nxpk= 0, iat=1358,1362, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 85 SER H 85 SER HB3 4.11
&rst
ixpk= 0, nxpk= 0, iat=1358,1363, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 84 ASN HB2 85 SER H 4.75
&rst
ixpk= 0, nxpk= 0, iat=1348,1358, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, &end
#
# 84 ASN HB3 85 SER H 4.75
&rst
ixpk= 0, nxpk= 0, iat=1349,1358, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, &end
#
# 83 PRO HB2 85 SER H 4.43
&rst
ixpk= 0, nxpk= 0, iat=1337,1358, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93, &end
#
# 62 THR QG2 64 VAL H 4.80
&rst
ixpk= 0, nxpk= 0, iat= -1,1011, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
igr1= 986, 987, 988,
&end
#
# 60 TYR QE 64 VAL H 5.91
&rst
ixpk= 0, nxpk= 0, iat= -1,1011, r1= 1.30, r2= 1.80, r3= 6.63, r4= 7.13,
igr1= 954, 959,
&end
#
# 155 ILE H 159 SER H 5.17
&rst
ixpk= 0, nxpk= 0, iat=2465,2532, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67, &end
#
# 83 PRO HB3 85 SER H 5.00
&rst
ixpk= 0, nxpk= 0, iat=1338,1358, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 109 GLU H 110 ASP H 3.42
&rst
ixpk= 0, nxpk= 0, iat=1743,1758, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92, &end
#
# 110 ASP H 113 ARG H 5.44
&rst
ixpk= 0, nxpk= 0, iat=1758,1804, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94, &end
#
# 110 ASP H 111 GLU H 3.13
&rst
ixpk= 0, nxpk= 0, iat=1758,1770, r1= 1.30, r2= 1.80, r3= 3.13, r4= 3.63, &end
#
# 170 ASN HA 171 SER H 3.15
&rst
ixpk= 0, nxpk= 0, iat=2700,2712, r1= 1.30, r2= 1.80, r3= 3.15, r4= 3.65, &end
#
# 109 GLU HA 110 ASP H 3.56
&rst
ixpk= 0, nxpk= 0, iat=1745,1758, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06, &end
#
# 109 GLU HG3 110 ASP H 4.08
&rst
ixpk= 0, nxpk= 0, iat=1751,1758, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58, &end
#
# 109 GLU HB2 110 ASP H 2.97
&rst
ixpk= 0, nxpk= 0, iat=1747,1758, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 109 GLU HB3 110 ASP H 3.27
&rst
ixpk= 0, nxpk= 0, iat=1748,1758, r1= 1.30, r2= 1.80, r3= 3.27, r4= 3.77, &end
#
# 110 ASP H 127 ILE QD1 5.84
&rst
ixpk= 0, nxpk= 0, iat=1758, -1, r1= 1.30, r2= 1.80, r3= 7.01, r4= 7.51,
igr2=2045,2046,2047,
&end
#
# 110 ASP H 110 ASP HA 2.85
&rst
ixpk= 0, nxpk= 0, iat=1758,1760, r1= 1.30, r2= 1.80, r3= 2.85, r4= 3.35, &end
#
# 110 ASP H 113 ARG HD2 6.26
&rst
ixpk= 0, nxpk= 0, iat=1758,1814, r1= 1.30, r2= 1.80, r3= 6.26, r4= 6.76, &end
#
# 110 ASP H 111 GLU HB2 5.04
&rst
ixpk= 0, nxpk= 0, iat=1758,1774, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54, &end
#
# 87 GLN HB3 88 SER H 4.41
&rst
ixpk= 0, nxpk= 0, iat=1396,1408, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, &end
#
# 87 GLN HA 88 SER H 2.94
&rst
ixpk= 0, nxpk= 0, iat=1393,1408, r1= 1.30, r2= 1.80, r3= 2.94, r4= 3.44, &end
#
# 88 SER H 88 SER QB 3.23
&rst
ixpk= 0, nxpk= 0, iat=1408, -1, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13,
igr2=1412,1413,
&end
#
# 171 SER H 171 SER QB 3.38
&rst
ixpk= 0, nxpk= 0, iat=2712, -1, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,
igr2=2716,2717,
&end
#
# 96 ARG QD 141 ASP H 4.63
&rst
ixpk= 0, nxpk= 0, iat= -1,2265, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
igr1=1541,1542,
&end
#
# 64 VAL H 66 VAL H 3.84
&rst
ixpk= 0, nxpk= 0, iat=1011,1049, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34, &end
#
# 64 VAL H 65 LYS H 3.20
&rst
ixpk= 0, nxpk= 0, iat=1011,1027, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 62 THR H 64 VAL H 4.33
&rst
ixpk= 0, nxpk= 0, iat= 980,1011, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83, &end
#
# 64 VAL H 65 LYS HA 4.91
&rst
ixpk= 0, nxpk= 0, iat=1011,1029, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41, &end
#
# 63 GLN HG2 64 VAL H 3.61
&rst
ixpk= 0, nxpk= 0, iat=1001,1011, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11, &end
#
# 63 GLN H 64 VAL H 3.38
&rst
ixpk= 0, nxpk= 0, iat= 994,1011, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88, &end
#
# 61 GLU HA 64 VAL H 3.50
&rst
ixpk= 0, nxpk= 0, iat= 967,1011, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 64 VAL H 65 LYS QE 5.11
&rst
ixpk= 0, nxpk= 0, iat=1011, -1, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
igr2=1040,1041,
&end
#
# 141 ASP H 141 ASP HB3 3.35
&rst
ixpk= 0, nxpk= 0, iat=2265,2270, r1= 1.30, r2= 1.80, r3= 3.35, r4= 3.85, &end
#
# 141 ASP H 144 ILE QD1 4.79
&rst
ixpk= 0, nxpk= 0, iat=2265, -1, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
igr2=2319,2320,2321,
&end
#
# 141 ASP H 142 ASP H 4.56
&rst
ixpk= 0, nxpk= 0, iat=2265,2277, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06, &end
#
# 140 ALA H 141 ASP H 3.24
&rst
ixpk= 0, nxpk= 0, iat=2255,2265, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74, &end
#
# 141 ASP H 144 ILE H 4.75
&rst
ixpk= 0, nxpk= 0, iat=2265,2306, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, &end
#
# 139 PHE QD 141 ASP H 3.87
&rst
ixpk= 0, nxpk= 0, iat= -1,2265, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,
igr1=2243,2251,
&end
#
# 96 ARG HA 141 ASP H 5.93
&rst
ixpk= 0, nxpk= 0, iat=1533,2265, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43, &end
#
# 141 ASP H 142 ASP HA 6.29
&rst
ixpk= 0, nxpk= 0, iat=2265,2279, r1= 1.30, r2= 1.80, r3= 6.29, r4= 6.79, &end
#
# 139 PHE HB3 141 ASP H 3.32
&rst
ixpk= 0, nxpk= 0, iat=2240,2265, r1= 1.30, r2= 1.80, r3= 3.32, r4= 3.82, &end
#
# 60 TYR HB2 61 GLU H 4.21
&rst
ixpk= 0, nxpk= 0, iat= 948, 965, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71, &end
#
# 60 TYR H 61 GLU H 3.49
&rst
ixpk= 0, nxpk= 0, iat= 944, 965, r1= 1.30, r2= 1.80, r3= 3.49, r4= 3.99, &end
#
# 61 GLU H 64 VAL H 5.64
&rst
ixpk= 0, nxpk= 0, iat= 965,1011, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14, &end
#
# 60 TYR QE 61 GLU H 5.31
&rst
ixpk= 0, nxpk= 0, iat= -1, 965, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
igr1= 954, 959,
&end
#
# 60 TYR HB3 61 GLU H 3.41
&rst
ixpk= 0, nxpk= 0, iat= 949, 965, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91, &end
#
# 59 GLU HB2 61 GLU H 3.55
&rst
ixpk= 0, nxpk= 0, iat= 933, 965, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05, &end
#
# 61 GLU H 61 GLU HB2 2.79
&rst
ixpk= 0, nxpk= 0, iat= 965, 969, r1= 1.30, r2= 1.80, r3= 2.79, r4= 3.29, &end
#
# 61 GLU H 62 THR QG2 6.13
&rst
ixpk= 0, nxpk= 0, iat= 965, -1, r1= 1.30, r2= 1.80, r3= 7.36, r4= 7.86,
igr2= 986, 987, 988,
&end
#
# 61 GLU H 62 THR HB 5.23
&rst
ixpk= 0, nxpk= 0, iat= 965, 984, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73, &end
#
# 61 GLU H 64 VAL QG2 6.01
&rst
ixpk= 0, nxpk= 0, iat= 965, -1, r1= 1.30, r2= 1.80, r3= 7.22, r4= 7.72,
igr2=1021,1022,1023,
&end
#
# 28 TYR QE 29 PHE H 4.42
&rst
ixpk= 0, nxpk= 0, iat= -1, 444, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
igr1= 433, 438,
&end
#
# 29 PHE H 30 SER HA 5.46
&rst
ixpk= 0, nxpk= 0, iat= 444, 466, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96, &end
#
# 29 PHE H 29 PHE QD 3.41
&rst
ixpk= 0, nxpk= 0, iat= 444, -1, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,
igr2= 452, 460,
&end
#
# 28 TYR QD 29 PHE H 4.43
&rst
ixpk= 0, nxpk= 0, iat= -1, 444, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
igr1= 431, 440,
&end
#
# 25 LEU HA 29 PHE H 4.54
&rst
ixpk= 0, nxpk= 0, iat= 369, 444, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 29 PHE H 29 PHE HB2 3.45
&rst
ixpk= 0, nxpk= 0, iat= 444, 448, r1= 1.30, r2= 1.80, r3= 3.45, r4= 3.95, &end
#
# 28 TYR HB3 29 PHE H 3.52
&rst
ixpk= 0, nxpk= 0, iat= 428, 444, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02, &end
#
# 29 PHE H 29 PHE HB3 3.55
&rst
ixpk= 0, nxpk= 0, iat= 444, 449, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05, &end
#
# 28 TYR HB2 29 PHE H 4.38
&rst
ixpk= 0, nxpk= 0, iat= 427, 444, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88, &end
#
# 26 LYS QD 29 PHE H 5.24
&rst
ixpk= 0, nxpk= 0, iat= -1, 444, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
igr1= 396, 397,
&end
#
# 29 PHE H 35 VAL QG2 5.71
&rst
ixpk= 0, nxpk= 0, iat= 444, -1, r1= 1.30, r2= 1.80, r3= 6.86, r4= 7.36,
igr2= 541, 542, 543,
&end
#
# 29 PHE H 35 VAL QG1 5.71
&rst
ixpk= 0, nxpk= 0, iat= 444, -1, r1= 1.30, r2= 1.80, r3= 6.86, r4= 7.36,
igr2= 537, 538, 539,
&end
#
# 117 SER H 119 TYR H 4.93
&rst
ixpk= 0, nxpk= 0, iat=1883,1911, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43, &end
#
# 145 ALA HA 149 CYS H 4.75
&rst
ixpk= 0, nxpk= 0, iat=2327,2382, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, &end
#
# 149 CYS H 151 GLU H 5.03
&rst
ixpk= 0, nxpk= 0, iat=2382,2400, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53, &end
#
# 92 PRO HG2 149 CYS H 5.96
&rst
ixpk= 0, nxpk= 0, iat=1467,2382, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46, &end
#
# 146 GLN QB 149 CYS H 6.45
&rst
ixpk= 0, nxpk= 0, iat= -1,2382, r1= 1.30, r2= 1.80, r3= 7.24, r4= 7.74,
igr1=2339,2340,
&end
#
# 26 LYS H 29 PHE H 5.10
&rst
ixpk= 0, nxpk= 0, iat= 386, 444, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, &end
#
# 29 PHE H 29 PHE QE 5.23
&rst
ixpk= 0, nxpk= 0, iat= 444, -1, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,
igr2= 454, 458,
&end
#
# 26 LYS HA 29 PHE H 4.04
&rst
ixpk= 0, nxpk= 0, iat= 388, 444, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, &end
#
# 25 LEU HB3 29 PHE H 5.25
&rst
ixpk= 0, nxpk= 0, iat= 372, 444, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75, &end
#
# 29 PHE H 73 ILE QG2 6.50
&rst
ixpk= 0, nxpk= 0, iat= 444, -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr2=1175,1176,1177,
&end
#
# 115 PHE QD 117 SER H 5.43
&rst
ixpk= 0, nxpk= 0, iat= -1,1883, r1= 1.30, r2= 1.80, r3= 6.09, r4= 6.59,
igr1=1851,1859,
&end
#
# 117 SER H 118 GLN QB 4.56
&rst
ixpk= 0, nxpk= 0, iat=1883, -1, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
igr2=1898,1899,
&end
#
# 116 PHE H 117 SER H 3.30
&rst
ixpk= 0, nxpk= 0, iat=1863,1883, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80, &end
#
# 116 PHE QD 117 SER H 4.78
&rst
ixpk= 0, nxpk= 0, iat= -1,1883, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr1=1871,1879,
&end
#
# 117 SER H 118 GLN H 3.32
&rst
ixpk= 0, nxpk= 0, iat=1883,1894, r1= 1.30, r2= 1.80, r3= 3.32, r4= 3.82, &end
#
# 113 ARG HA 117 SER H 4.31
&rst
ixpk= 0, nxpk= 0, iat=1806,1883, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81, &end
#
# 116 PHE HB2 117 SER H 4.36
&rst
ixpk= 0, nxpk= 0, iat=1867,1883, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86, &end
#
# 115 PHE HB3 117 SER H 5.74
&rst
ixpk= 0, nxpk= 0, iat=1848,1883, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24, &end
#
# 116 PHE HB3 117 SER H 3.86
&rst
ixpk= 0, nxpk= 0, iat=1868,1883, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 113 ARG HG3 117 SER H 6.24
&rst
ixpk= 0, nxpk= 0, iat=1812,1883, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74, &end
#
# 121 ASP H 122 VAL H 4.41
&rst
ixpk= 0, nxpk= 0, iat=1939,1951, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, &end
#
# 121 ASP H 141 ASP H 4.89
&rst
ixpk= 0, nxpk= 0, iat=1939,2265, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39, &end
#
# 120 GLY H 121 ASP H 3.63
&rst
ixpk= 0, nxpk= 0, iat=1932,1939, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13, &end
#
# 121 ASP H 139 PHE QD 4.15
&rst
ixpk= 0, nxpk= 0, iat=1939, -1, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
igr2=2243,2251,
&end
#
# 121 ASP H 139 PHE HA 5.45
&rst
ixpk= 0, nxpk= 0, iat=1939,2237, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95, &end
#
# 120 GLY QA 121 ASP H 2.68
&rst
ixpk= 0, nxpk= 0, iat= -1,1939, r1= 1.30, r2= 1.80, r3= 3.01, r4= 3.51,
igr1=1934,1935,
&end
#
# 121 ASP H 122 VAL HA 4.89
&rst
ixpk= 0, nxpk= 0, iat=1939,1953, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39, &end
#
# 121 ASP H 123 MET QE 5.71
&rst
ixpk= 0, nxpk= 0, iat=1939, -1, r1= 1.30, r2= 1.80, r3= 6.86, r4= 7.36,
igr2=1978,1979,1980,
&end
#
# 121 ASP H 144 ILE QD1 4.40
&rst
ixpk= 0, nxpk= 0, iat=1939, -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
igr2=2319,2320,2321,
&end
#
# 121 ASP H 144 ILE QG2 4.97
&rst
ixpk= 0, nxpk= 0, iat=1939, -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr2=2312,2313,2314,
&end
#
# 121 ASP H 140 ALA QB 4.05
&rst
ixpk= 0, nxpk= 0, iat=1939, -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
igr2=2259,2260,2261,
&end
#
# 121 ASP H 144 ILE HG12 4.63
&rst
ixpk= 0, nxpk= 0, iat=1939,2316, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, &end
#
# 124 ASP H 139 PHE H 5.61
&rst
ixpk= 0, nxpk= 0, iat=1984,2235, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11, &end
#
# 147 SER H 149 CYS H 4.24
&rst
ixpk= 0, nxpk= 0, iat=2352,2382, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74, &end
#
# 146 GLN HA 149 CYS H 3.93
&rst
ixpk= 0, nxpk= 0, iat=2337,2382, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43, &end
#
# 149 CYS H 149 CYS HB2 3.64
&rst
ixpk= 0, nxpk= 0, iat=2382,2386, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14, &end
#
# 149 CYS H 149 CYS HB3 3.64
&rst
ixpk= 0, nxpk= 0, iat=2382,2387, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14, &end
#
# 146 GLN QG 149 CYS H 5.70
&rst
ixpk= 0, nxpk= 0, iat= -1,2382, r1= 1.30, r2= 1.80, r3= 6.40, r4= 6.90,
igr1=2342,2343,
&end
#
# 149 CYS H 162 ILE HB 6.03
&rst
ixpk= 0, nxpk= 0, iat=2382,2580, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53, &end
#
# 149 CYS H 151 GLU HG2 4.67
&rst
ixpk= 0, nxpk= 0, iat=2382,2407, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, &end
#
# 149 CYS H 151 GLU HG3 4.67
&rst
ixpk= 0, nxpk= 0, iat=2382,2408, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, &end
#
# 148 LEU HB3 149 CYS H 4.33
&rst
ixpk= 0, nxpk= 0, iat=2368,2382, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83, &end
#
# 149 CYS H 162 ILE QG2 6.19
&rst
ixpk= 0, nxpk= 0, iat=2382, -1, r1= 1.30, r2= 1.80, r3= 7.43, r4= 7.93,
igr2=2582,2583,2584,
&end
#
# 92 PRO HG3 149 CYS H 5.03
&rst
ixpk= 0, nxpk= 0, iat=1468,2382, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53, &end
#
# 123 MET H 124 ASP H 3.08
&rst
ixpk= 0, nxpk= 0, iat=1967,1984, r1= 1.30, r2= 1.80, r3= 3.08, r4= 3.58, &end
#
# 124 ASP H 138 THR H 3.56
&rst
ixpk= 0, nxpk= 0, iat=1984,2221, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06, &end
#
# 124 ASP H 139 PHE HA 4.69
&rst
ixpk= 0, nxpk= 0, iat=1984,2237, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, &end
#
# 124 ASP H 137 VAL HA 4.92
&rst
ixpk= 0, nxpk= 0, iat=1984,2207, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42, &end
#
# 124 ASP H 138 THR HB 3.13
&rst
ixpk= 0, nxpk= 0, iat=1984,2225, r1= 1.30, r2= 1.80, r3= 3.13, r4= 3.63, &end
#
# 124 ASP H 124 ASP HB2 3.84
&rst
ixpk= 0, nxpk= 0, iat=1984,1988, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34, &end
#
# 123 MET HG2 124 ASP H 4.50
&rst
ixpk= 0, nxpk= 0, iat=1974,1984, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 124 ASP H 124 ASP HB3 3.84
&rst
ixpk= 0, nxpk= 0, iat=1984,1989, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34, &end
#
# 123 MET HB3 124 ASP H 3.71
&rst
ixpk= 0, nxpk= 0, iat=1972,1984, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21, &end
#
# 122 VAL HB 124 ASP H 4.90
&rst
ixpk= 0, nxpk= 0, iat=1955,1984, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40, &end
#
# 123 MET HB2 124 ASP H 3.31
&rst
ixpk= 0, nxpk= 0, iat=1971,1984, r1= 1.30, r2= 1.80, r3= 3.31, r4= 3.81, &end
#
# 124 ASP H 138 THR QG2 4.13
&rst
ixpk= 0, nxpk= 0, iat=1984, -1, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
igr2=2227,2228,2229,
&end
#
# 15 GLY H 16 LEU H 3.63
&rst
ixpk= 0, nxpk= 0, iat= 209, 216, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13, &end
#
# 16 LEU H 76 ARG HE 5.51
&rst
ixpk= 0, nxpk= 0, iat= 216,1220, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01, &end
#
# 16 LEU H 52 PHE HA 4.07
&rst
ixpk= 0, nxpk= 0, iat= 216, 810, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57, &end
#
# 14 LEU HA 16 LEU H 4.16
&rst
ixpk= 0, nxpk= 0, iat= 192, 216, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66, &end
#
# 16 LEU H 16 LEU HB2 3.65
&rst
ixpk= 0, nxpk= 0, iat= 216, 220, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15, &end
#
# 16 LEU H 16 LEU HB3 3.65
&rst
ixpk= 0, nxpk= 0, iat= 216, 221, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15, &end
#
# 16 LEU H 16 LEU QQD 4.51
&rst
ixpk= 0, nxpk= 0, iat= 216, -1, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
igr2= 225, 226, 227, 229, 230, 231,
&end
#
# 13 VAL H 55 VAL H 5.24
&rst
ixpk= 0, nxpk= 0, iat= 174, 855, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74, &end
#
# 55 VAL H 56 ARG H 4.70
&rst
ixpk= 0, nxpk= 0, iat= 855, 871, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 55 VAL H 57 PHE QE 5.71
&rst
ixpk= 0, nxpk= 0, iat= 855, -1, r1= 1.30, r2= 1.80, r3= 6.41, r4= 6.91,
igr2= 905, 909,
&end
#
# 10 ASP HB3 55 VAL H 4.46
&rst
ixpk= 0, nxpk= 0, iat= 129, 855, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, &end
#
# 54 PHE QD 55 VAL H 3.89
&rst
ixpk= 0, nxpk= 0, iat= -1, 855, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
igr1= 843, 851,
&end
#
# 54 PHE HA 55 VAL H 3.06
&rst
ixpk= 0, nxpk= 0, iat= 837, 855, r1= 1.30, r2= 1.80, r3= 3.06, r4= 3.56, &end
#
# 11 LEU HA 55 VAL H 5.12
&rst
ixpk= 0, nxpk= 0, iat= 138, 855, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, &end
#
# 54 PHE HB2 55 VAL H 4.67
&rst
ixpk= 0, nxpk= 0, iat= 839, 855, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, &end
#
# 54 PHE HB3 55 VAL H 4.67
&rst
ixpk= 0, nxpk= 0, iat= 840, 855, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, &end
#
# 10 ASP HB2 55 VAL H 5.49
&rst
ixpk= 0, nxpk= 0, iat= 128, 855, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99, &end
#
# 37 MET QE 55 VAL H 5.08
&rst
ixpk= 0, nxpk= 0, iat= -1, 855, r1= 1.30, r2= 1.80, r3= 6.10, r4= 6.60,
igr1= 577, 578, 579,
&end
#
# 11 LEU HB3 55 VAL H 5.04
&rst
ixpk= 0, nxpk= 0, iat= 141, 855, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54, &end
#
# 55 VAL H 55 VAL QG2 4.93
&rst
ixpk= 0, nxpk= 0, iat= 855, -1, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
igr2= 865, 866, 867,
&end
#
# 124 ASP H 139 PHE QD 6.50
&rst
ixpk= 0, nxpk= 0, iat=1984, -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
igr2=2243,2251,
&end
#
# 69 GLN H 69 GLN HE22 5.00
&rst
ixpk= 0, nxpk= 0, iat=1093,1105, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 66 VAL HA 69 GLN H 4.48
&rst
ixpk= 0, nxpk= 0, iat=1051,1093, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98, &end
#
# 66 VAL HB 69 GLN H 6.05
&rst
ixpk= 0, nxpk= 0, iat=1053,1093, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 16 LEU H 52 PHE HB2 5.82
&rst
ixpk= 0, nxpk= 0, iat= 216, 812, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32, &end
#
# 39 GLN QB 55 VAL H 6.03
&rst
ixpk= 0, nxpk= 0, iat= -1, 855, r1= 1.30, r2= 1.80, r3= 6.77, r4= 7.27,
igr1= 603, 604,
&end
#
# 53 GLY QA 55 VAL H 5.15
&rst
ixpk= 0, nxpk= 0, iat= -1, 855, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr1= 830, 831,
&end
#
# 67 MET H 69 GLN H 4.49
&rst
ixpk= 0, nxpk= 0, iat=1065,1093, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99, &end
#
# 69 GLN H 69 GLN HE21 3.80
&rst
ixpk= 0, nxpk= 0, iat=1093,1106, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30, &end
#
# 67 MET HA 69 GLN H 3.62
&rst
ixpk= 0, nxpk= 0, iat=1067,1093, r1= 1.30, r2= 1.80, r3= 3.62, r4= 4.12, &end
#
# 68 SER QB 69 GLN H 3.34
&rst
ixpk= 0, nxpk= 0, iat= -1,1093, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,
igr1=1086,1087,
&end
#
# 69 GLN H 69 GLN QB 3.48
&rst
ixpk= 0, nxpk= 0, iat=1093, -1, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41,
igr2=1097,1098,
&end
#
# 69 GLN H 71 HID HE1 4.58
&rst
ixpk= 0, nxpk= 0, iat=1093,1144, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08, &end
#
# 39 GLN H 54 PHE H 3.42
&rst
ixpk= 0, nxpk= 0, iat= 599, 835, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92, &end
#
# 13 VAL H 54 PHE H 4.81
&rst
ixpk= 0, nxpk= 0, iat= 174, 835, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31, &end
#
# 53 GLY H 54 PHE H 4.47
&rst
ixpk= 0, nxpk= 0, iat= 828, 835, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97, &end
#
# 54 PHE H 54 PHE QD 4.20
&rst
ixpk= 0, nxpk= 0, iat= 835, -1, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
igr2= 843, 851,
&end
#
# 40 VAL HA 54 PHE H 3.32
&rst
ixpk= 0, nxpk= 0, iat= 618, 835, r1= 1.30, r2= 1.80, r3= 3.32, r4= 3.82, &end
#
# 54 PHE H 54 PHE HB2 4.01
&rst
ixpk= 0, nxpk= 0, iat= 835, 839, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51, &end
#
# 54 PHE H 54 PHE HB3 4.01
&rst
ixpk= 0, nxpk= 0, iat= 835, 840, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51, &end
#
# 38 VAL HB 54 PHE H 4.65
&rst
ixpk= 0, nxpk= 0, iat= 587, 835, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15, &end
#
# 40 VAL HB 54 PHE H 5.86
&rst
ixpk= 0, nxpk= 0, iat= 620, 835, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36, &end
#
# 13 VAL HB 54 PHE H 6.13
&rst
ixpk= 0, nxpk= 0, iat= 178, 835, r1= 1.30, r2= 1.80, r3= 6.13, r4= 6.63, &end
#
# 37 MET QE 54 PHE H 5.23
&rst
ixpk= 0, nxpk= 0, iat= -1, 835, r1= 1.30, r2= 1.80, r3= 6.28, r4= 6.78,
igr1= 577, 578, 579,
&end
#
# 40 VAL H 54 PHE H 4.42
&rst
ixpk= 0, nxpk= 0, iat= 616, 835, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92, &end
#
# 38 VAL HA 54 PHE H 4.76
&rst
ixpk= 0, nxpk= 0, iat= 585, 835, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26, &end
#
# 39 GLN HA 54 PHE H 4.78
&rst
ixpk= 0, nxpk= 0, iat= 601, 835, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, &end
#
# 16 LEU QQD 54 PHE H 6.07
&rst
ixpk= 0, nxpk= 0, iat= -1, 835, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
igr1= 225, 226, 227, 229, 230, 231,
&end
#
# 12 ILE HA 54 PHE H 5.16
&rst
ixpk= 0, nxpk= 0, iat= 157, 835, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66, &end
#
# 114 GLU HB2 116 PHE H 5.26
&rst
ixpk= 0, nxpk= 0, iat=1832,1863, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76, &end
#
# 112 LEU HB2 116 PHE H 5.99
&rst
ixpk= 0, nxpk= 0, iat=1789,1863, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49, &end
#
# 116 PHE H 155 ILE QD1 6.45
&rst
ixpk= 0, nxpk= 0, iat=1863, -1, r1= 1.30, r2= 1.80, r3= 7.75, r4= 8.25,
igr2=2478,2479,2480,
&end
#
# 116 PHE H 117 SER HA 5.44
&rst
ixpk= 0, nxpk= 0, iat=1863,1885, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94, &end
#
# 116 PHE H 137 VAL QG2 6.50
&rst
ixpk= 0, nxpk= 0, iat=1863, -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr2=2215,2216,2217,
&end
#
# 113 ARG HA 116 PHE H 4.22
&rst
ixpk= 0, nxpk= 0, iat=1806,1863, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 116 PHE H 122 VAL QG1 6.29
&rst
ixpk= 0, nxpk= 0, iat=1863, -1, r1= 1.30, r2= 1.80, r3= 7.55, r4= 8.05,
igr2=1957,1958,1959,
&end
#
# 114 GLU H 116 PHE H 4.50
&rst
ixpk= 0, nxpk= 0, iat=1828,1863, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 116 PHE H 116 PHE QD 3.52
&rst
ixpk= 0, nxpk= 0, iat=1863, -1, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
igr2=1871,1879,
&end
#
# 115 PHE QD 116 PHE H 3.46
&rst
ixpk= 0, nxpk= 0, iat= -1,1863, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,
igr1=1851,1859,
&end
#
# 112 LEU HA 116 PHE H 4.34
&rst
ixpk= 0, nxpk= 0, iat=1787,1863, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84, &end
#
# 116 PHE H 116 PHE HB2 3.54
&rst
ixpk= 0, nxpk= 0, iat=1863,1867, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04, &end
#
# 115 PHE HB3 116 PHE H 3.57
&rst
ixpk= 0, nxpk= 0, iat=1848,1863, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07, &end
#
# 116 PHE H 116 PHE HB3 3.78
&rst
ixpk= 0, nxpk= 0, iat=1863,1868, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28, &end
#
# 115 PHE HB2 116 PHE H 4.40
&rst
ixpk= 0, nxpk= 0, iat=1847,1863, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 116 PHE H 122 VAL QG2 6.29
&rst
ixpk= 0, nxpk= 0, iat=1863, -1, r1= 1.30, r2= 1.80, r3= 7.55, r4= 8.05,
igr2=1961,1962,1963,
&end
#
# 116 PHE H 137 VAL QG1 6.50
&rst
ixpk= 0, nxpk= 0, iat=1863, -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr2=2211,2212,2213,
&end
#
# 116 PHE H 155 ILE QG2 6.50
&rst
ixpk= 0, nxpk= 0, iat=1863, -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr2=2471,2472,2473,
&end
#
# 60 TYR H 62 THR H 4.15
&rst
ixpk= 0, nxpk= 0, iat= 944, 980, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65, &end
#
# 60 TYR HB3 62 THR H 5.11
&rst
ixpk= 0, nxpk= 0, iat= 949, 980, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61, &end
#
# 62 THR H 64 VAL QG1 5.43
&rst
ixpk= 0, nxpk= 0, iat= 980, -1, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
igr2=1017,1018,1019,
&end
#
# 62 THR H 65 LYS H 5.57
&rst
ixpk= 0, nxpk= 0, iat= 980,1027, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07, &end
#
# 62 THR H 65 LYS QE 4.51
&rst
ixpk= 0, nxpk= 0, iat= 980, -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
igr2=1040,1041,
&end
#
# 61 GLU H 62 THR H 3.24
&rst
ixpk= 0, nxpk= 0, iat= 965, 980, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74, &end
#
# 33 GLY HA3 62 THR H 6.05
&rst
ixpk= 0, nxpk= 0, iat= 512, 980, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 62 THR H 62 THR HB 3.01
&rst
ixpk= 0, nxpk= 0, iat= 980, 984, r1= 1.30, r2= 1.80, r3= 3.01, r4= 3.51, &end
#
# 59 GLU HG3 62 THR H 4.13
&rst
ixpk= 0, nxpk= 0, iat= 937, 980, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63, &end
#
# 59 GLU HB2 62 THR H 3.54
&rst
ixpk= 0, nxpk= 0, iat= 933, 980, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04, &end
#
# 61 GLU HB3 62 THR H 3.29
&rst
ixpk= 0, nxpk= 0, iat= 970, 980, r1= 1.30, r2= 1.80, r3= 3.29, r4= 3.79, &end
#
# 62 THR H 64 VAL QG2 6.03
&rst
ixpk= 0, nxpk= 0, iat= 980, -1, r1= 1.30, r2= 1.80, r3= 7.24, r4= 7.74,
igr2=1021,1022,1023,
&end
#
# 62 THR H 62 THR QG2 3.80
&rst
ixpk= 0, nxpk= 0, iat= 980, -1, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
igr2= 986, 987, 988,
&end
#
# 98 VAL H 139 PHE QD 4.60
&rst
ixpk= 0, nxpk= 0, iat=1577, -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
igr2=2243,2251,
&end
#
# 98 VAL H 136 PHE HA 4.85
&rst
ixpk= 0, nxpk= 0, iat=1577,2187, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35, &end
#
# 29 PHE H 30 SER H 3.21
&rst
ixpk= 0, nxpk= 0, iat= 444, 464, r1= 1.30, r2= 1.80, r3= 3.21, r4= 3.71, &end
#
# 30 SER H 31 THR H 3.08
&rst
ixpk= 0, nxpk= 0, iat= 464, 475, r1= 1.30, r2= 1.80, r3= 3.08, r4= 3.58, &end
#
# 30 SER H 57 PHE QE 5.36
&rst
ixpk= 0, nxpk= 0, iat= 464, -1, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,
igr2= 905, 909,
&end
#
# 26 LYS HA 30 SER H 4.20
&rst
ixpk= 0, nxpk= 0, iat= 388, 464, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 29 PHE HB2 30 SER H 3.97
&rst
ixpk= 0, nxpk= 0, iat= 448, 464, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47, &end
#
# 28 TYR HB3 30 SER H 5.30
&rst
ixpk= 0, nxpk= 0, iat= 428, 464, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80, &end
#
# 29 PHE HB3 30 SER H 3.83
&rst
ixpk= 0, nxpk= 0, iat= 449, 464, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33, &end
#
# 26 LYS HG3 30 SER H 6.13
&rst
ixpk= 0, nxpk= 0, iat= 394, 464, r1= 1.30, r2= 1.80, r3= 6.13, r4= 6.63, &end
#
# 30 SER H 31 THR QG2 4.38
&rst
ixpk= 0, nxpk= 0, iat= 464, -1, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr2= 481, 482, 483,
&end
#
# 5 ALA QB 6 SER H 3.35
&rst
ixpk= 0, nxpk= 0, iat= -1, 66, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,
igr1= 60, 61, 62,
&end
#
# 5 ALA HA 6 SER H 2.85
&rst
ixpk= 0, nxpk= 0, iat= 58, 66, r1= 1.30, r2= 1.80, r3= 2.85, r4= 3.35, &end
#
# 98 VAL H 137 VAL H 3.90
&rst
ixpk= 0, nxpk= 0, iat=1577,2205, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40, &end
#
# 98 VAL H 136 PHE QD 5.29
&rst
ixpk= 0, nxpk= 0, iat=1577, -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
igr2=2193,2201,
&end
#
# 98 VAL H 99 PHE H 4.88
&rst
ixpk= 0, nxpk= 0, iat=1577,1593, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38, &end
#
# 97 LYS HA 98 VAL H 3.20
&rst
ixpk= 0, nxpk= 0, iat=1557,1577, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 98 VAL H 138 THR HA 3.62
&rst
ixpk= 0, nxpk= 0, iat=1577,2223, r1= 1.30, r2= 1.80, r3= 3.62, r4= 4.12, &end
#
# 97 LYS QB 98 VAL H 3.61
&rst
ixpk= 0, nxpk= 0, iat= -1,1577, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,
igr1=1559,1560,
&end
#
# 97 LYS QG 98 VAL H 4.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1577, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
igr1=1562,1563,
&end
#
# 98 VAL H 98 VAL QG1 4.34
&rst
ixpk= 0, nxpk= 0, iat=1577, -1, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,
igr2=1583,1584,1585,
&end
#
# 98 VAL H 137 VAL QG2 5.88
&rst
ixpk= 0, nxpk= 0, iat=1577, -1, r1= 1.30, r2= 1.80, r3= 7.06, r4= 7.56,
igr2=2215,2216,2217,
&end
#
# 98 VAL H 139 PHE QE 5.79
&rst
ixpk= 0, nxpk= 0, iat=1577, -1, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
igr2=2245,2249,
&end
#
# 150 GLY H 164 ASN H 5.35
&rst
ixpk= 0, nxpk= 0, iat=2393,2606, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85, &end
#
# 150 GLY H 162 ILE HA 5.37
&rst
ixpk= 0, nxpk= 0, iat=2393,2578, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87, &end
#
# 150 GLY H 163 SER HA 3.80
&rst
ixpk= 0, nxpk= 0, iat=2393,2597, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30, &end
#
# 149 CYS HA 150 GLY H 3.25
&rst
ixpk= 0, nxpk= 0, iat=2384,2393, r1= 1.30, r2= 1.80, r3= 3.25, r4= 3.75, &end
#
# 149 CYS HB3 150 GLY H 4.46
&rst
ixpk= 0, nxpk= 0, iat=2387,2393, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, &end
#
# 92 PRO HG3 150 GLY H 5.71
&rst
ixpk= 0, nxpk= 0, iat=1468,2393, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21, &end
#
# 150 GLY H 152 ASP H 4.53
&rst
ixpk= 0, nxpk= 0, iat=2393,2415, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03, &end
#
# 28 TYR H 30 SER H 4.75
&rst
ixpk= 0, nxpk= 0, iat= 423, 464, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, &end
#
# 28 TYR QD 30 SER H 5.25
&rst
ixpk= 0, nxpk= 0, iat= -1, 464, r1= 1.30, r2= 1.80, r3= 5.89, r4= 6.39,
igr1= 431, 440,
&end
#
# 28 TYR HB2 30 SER H 5.45
&rst
ixpk= 0, nxpk= 0, iat= 427, 464, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95, &end
#
# 26 LYS QD 30 SER H 4.87
&rst
ixpk= 0, nxpk= 0, iat= -1, 464, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,
igr1= 396, 397,
&end
#
# 150 GLY H 162 ILE HB 3.96
&rst
ixpk= 0, nxpk= 0, iat=2393,2580, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46, &end
#
# 149 CYS HB2 150 GLY H 4.46
&rst
ixpk= 0, nxpk= 0, iat=2386,2393, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, &end
#
# 150 GLY H 162 ILE QG2 4.59
&rst
ixpk= 0, nxpk= 0, iat=2393, -1, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
igr2=2582,2583,2584,
&end
#
# 149 CYS H 150 GLY H 4.62
&rst
ixpk= 0, nxpk= 0, iat=2382,2393, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12, &end
#
# 150 GLY H 161 HIS HA 5.86
&rst
ixpk= 0, nxpk= 0, iat=2393,2561, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36, &end
#
# 150 GLY H 151 GLU HA 5.44
&rst
ixpk= 0, nxpk= 0, iat=2393,2402, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94, &end
#
# 92 PRO HG3 164 ASN HD22 5.09
&rst
ixpk= 0, nxpk= 0, iat=1468,2615, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59, &end
#
# 93 LEU HG 164 ASN HD22 3.96
&rst
ixpk= 0, nxpk= 0, iat=1484,2615, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46, &end
#
# 146 GLN HA 164 ASN HD21 6.26
&rst
ixpk= 0, nxpk= 0, iat=2337,2616, r1= 1.30, r2= 1.80, r3= 6.26, r4= 6.76, &end
#
# 92 PRO HB3 164 ASN HD21 4.76
&rst
ixpk= 0, nxpk= 0, iat=1471,2616, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26, &end
#
# 93 LEU QD2 164 ASN HD21 5.14
&rst
ixpk= 0, nxpk= 0, iat= -1,2616, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1=1490,1491,1492,
&end
#
# 9 SER H 11 LEU H 5.98
&rst
ixpk= 0, nxpk= 0, iat= 113, 136, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48, &end
#
# 108 THR H 108 THR HB 3.98
&rst
ixpk= 0, nxpk= 0, iat=1729,1733, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48, &end
#
# 108 THR H 112 LEU QD2 5.92
&rst
ixpk= 0, nxpk= 0, iat=1729, -1, r1= 1.30, r2= 1.80, r3= 7.11, r4= 7.61,
igr2=1798,1799,1800,
&end
#
# 108 THR H 110 ASP H 5.98
&rst
ixpk= 0, nxpk= 0, iat=1729,1758, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48, &end
#
# 108 THR H 111 GLU H 4.11
&rst
ixpk= 0, nxpk= 0, iat=1729,1770, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 107 MET H 108 THR H 4.72
&rst
ixpk= 0, nxpk= 0, iat=1712,1729, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22, &end
#
# 107 MET HA 108 THR H 2.88
&rst
ixpk= 0, nxpk= 0, iat=1714,1729, r1= 1.30, r2= 1.80, r3= 2.88, r4= 3.38, &end
#
# 108 THR H 111 GLU HA 5.05
&rst
ixpk= 0, nxpk= 0, iat=1729,1772, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55, &end
#
# 107 MET HG2 108 THR H 4.44
&rst
ixpk= 0, nxpk= 0, iat=1719,1729, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94, &end
#
# 108 THR H 111 GLU HB3 3.52
&rst
ixpk= 0, nxpk= 0, iat=1729,1775, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02, &end
#
# 107 MET HG3 108 THR H 4.44
&rst
ixpk= 0, nxpk= 0, iat=1720,1729, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94, &end
#
# 107 MET HB3 108 THR H 3.65
&rst
ixpk= 0, nxpk= 0, iat=1717,1729, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15, &end
#
# 108 THR H 111 GLU HB2 3.47
&rst
ixpk= 0, nxpk= 0, iat=1729,1774, r1= 1.30, r2= 1.80, r3= 3.47, r4= 3.97, &end
#
# 107 MET HB2 108 THR H 3.69
&rst
ixpk= 0, nxpk= 0, iat=1716,1729, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19, &end
#
# 108 THR H 127 ILE QD1 5.50
&rst
ixpk= 0, nxpk= 0, iat=1729, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2=2045,2046,2047,
&end
#
# 164 ASN HA 164 ASN HD22 4.16
&rst
ixpk= 0, nxpk= 0, iat=2608,2615, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66, &end
#
# 92 PRO HB2 164 ASN HD22 4.98
&rst
ixpk= 0, nxpk= 0, iat=1470,2615, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48, &end
#
# 92 PRO HA 164 ASN HD22 4.19
&rst
ixpk= 0, nxpk= 0, iat=1473,2615, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69, &end
#
# 164 ASN QB 164 ASN HD22 3.64
&rst
ixpk= 0, nxpk= 0, iat= -1,2615, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59,
igr1=2610,2611,
&end
#
# 164 ASN HA 164 ASN HD21 4.27
&rst
ixpk= 0, nxpk= 0, iat=2608,2616, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77, &end
#
# 164 ASN QB 164 ASN HD21 3.40
&rst
ixpk= 0, nxpk= 0, iat= -1,2616, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,
igr1=2610,2611,
&end
#
# 92 PRO HB2 164 ASN HD21 4.55
&rst
ixpk= 0, nxpk= 0, iat=1470,2616, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05, &end
#
# 93 LEU HG 164 ASN HD21 3.82
&rst
ixpk= 0, nxpk= 0, iat=1484,2616, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32, &end
#
# 92 PRO HA 164 ASN HD21 3.98
&rst
ixpk= 0, nxpk= 0, iat=1473,2616, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48, &end
#
# 9 SER H 63 GLN HB2 5.68
&rst
ixpk= 0, nxpk= 0, iat= 113, 998, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18, &end
#
# 9 SER H 63 GLN HG2 6.15
&rst
ixpk= 0, nxpk= 0, iat= 113,1001, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65, &end
#
# 9 SER H 60 TYR QD 4.31
&rst
ixpk= 0, nxpk= 0, iat= 113, -1, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
igr2= 952, 961,
&end
#
# 8 THR HA 9 SER H 2.94
&rst
ixpk= 0, nxpk= 0, iat= 101, 113, r1= 1.30, r2= 1.80, r3= 2.94, r4= 3.44, &end
#
# 8 THR HB 9 SER H 3.22
&rst
ixpk= 0, nxpk= 0, iat= 103, 113, r1= 1.30, r2= 1.80, r3= 3.22, r4= 3.72, &end
#
# 9 SER H 9 SER HB2 4.17
&rst
ixpk= 0, nxpk= 0, iat= 113, 117, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67, &end
#
# 9 SER H 9 SER HB3 4.17
&rst
ixpk= 0, nxpk= 0, iat= 113, 118, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67, &end
#
# 9 SER H 60 TYR HA 4.92
&rst
ixpk= 0, nxpk= 0, iat= 113, 946, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42, &end
#
# 108 THR H 109 GLU HA 5.27
&rst
ixpk= 0, nxpk= 0, iat=1729,1745, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77, &end
#
# 108 THR H 155 ILE QG2 5.92
&rst
ixpk= 0, nxpk= 0, iat=1729, -1, r1= 1.30, r2= 1.80, r3= 7.11, r4= 7.61,
igr2=2471,2472,2473,
&end
#
# 134 PHE QD 136 PHE H 5.05
&rst
ixpk= 0, nxpk= 0, iat= -1,2185, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
igr1=2163,2171,
&end
#
# 125 VAL HA 136 PHE H 5.29
&rst
ixpk= 0, nxpk= 0, iat=1998,2185, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79, &end
#
# 136 PHE H 137 VAL H 4.64
&rst
ixpk= 0, nxpk= 0, iat=2185,2205, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14, &end
#
# 127 ILE H 136 PHE H 5.32
&rst
ixpk= 0, nxpk= 0, iat=2032,2185, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82, &end
#
# 126 PHE QD 136 PHE H 4.78
&rst
ixpk= 0, nxpk= 0, iat= -1,2185, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr1=2020,2028,
&end
#
# 136 PHE H 136 PHE QD 3.69
&rst
ixpk= 0, nxpk= 0, iat=2185, -1, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,
igr2=2193,2201,
&end
#
# 126 PHE HA 136 PHE H 5.40
&rst
ixpk= 0, nxpk= 0, iat=2014,2185, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90, &end
#
# 135 ALA HA 136 PHE H 3.08
&rst
ixpk= 0, nxpk= 0, iat=2177,2185, r1= 1.30, r2= 1.80, r3= 3.08, r4= 3.58, &end
#
# 127 ILE HA 136 PHE H 4.24
&rst
ixpk= 0, nxpk= 0, iat=2034,2185, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74, &end
#
# 128 PRO HD2 136 PHE H 5.30
&rst
ixpk= 0, nxpk= 0, iat=2052,2185, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80, &end
#
# 136 PHE H 136 PHE QB 3.33
&rst
ixpk= 0, nxpk= 0, iat=2185, -1, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24,
igr2=2189,2190,
&end
#
# 127 ILE HG13 136 PHE H 4.22
&rst
ixpk= 0, nxpk= 0, iat=2043,2185, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 135 ALA QB 136 PHE H 2.95
&rst
ixpk= 0, nxpk= 0, iat= -1,2185, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04,
igr1=2179,2180,2181,
&end
#
# 127 ILE HG12 136 PHE H 3.88
&rst
ixpk= 0, nxpk= 0, iat=2042,2185, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38, &end
#
# 143 GLN HA 147 SER H 4.92
&rst
ixpk= 0, nxpk= 0, iat=2291,2352, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42, &end
#
# 144 ILE HA 147 SER H 3.74
&rst
ixpk= 0, nxpk= 0, iat=2308,2352, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24, &end
#
# 146 GLN QB 147 SER H 3.43
&rst
ixpk= 0, nxpk= 0, iat= -1,2352, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35,
igr1=2339,2340,
&end
#
# 144 ILE QG2 147 SER H 5.67
&rst
ixpk= 0, nxpk= 0, iat= -1,2352, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
igr1=2312,2313,2314,
&end
#
# 147 SER H 148 LEU H 3.27
&rst
ixpk= 0, nxpk= 0, iat=2352,2363, r1= 1.30, r2= 1.80, r3= 3.27, r4= 3.77, &end
#
# 147 SER H 147 SER QB 2.79
&rst
ixpk= 0, nxpk= 0, iat=2352, -1, r1= 1.30, r2= 1.80, r3= 3.13, r4= 3.63,
igr2=2356,2357,
&end
#
# 147 SER H 148 LEU HB3 4.75
&rst
ixpk= 0, nxpk= 0, iat=2352,2368, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, &end
#
# 145 ALA HA 147 SER H 4.25
&rst
ixpk= 0, nxpk= 0, iat=2327,2352, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75, &end
#
# 146 GLN H 147 SER H 3.24
&rst
ixpk= 0, nxpk= 0, iat=2335,2352, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74, &end
#
# 144 ILE H 146 GLN H 4.74
&rst
ixpk= 0, nxpk= 0, iat=2306,2335, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24, &end
#
# 145 ALA H 146 GLN H 3.61
&rst
ixpk= 0, nxpk= 0, iat=2325,2335, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11, &end
#
# 146 GLN H 148 LEU H 4.25
&rst
ixpk= 0, nxpk= 0, iat=2335,2363, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75, &end
#
# 143 GLN HA 146 GLN H 3.65
&rst
ixpk= 0, nxpk= 0, iat=2291,2335, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15, &end
#
# 144 ILE HA 146 GLN H 4.60
&rst
ixpk= 0, nxpk= 0, iat=2308,2335, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 141 ASP HB3 146 GLN H 6.50
&rst
ixpk= 0, nxpk= 0, iat=2270,2335, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00, &end
#
# 142 ASP HB2 146 GLN H 6.50
&rst
ixpk= 0, nxpk= 0, iat=2281,2335, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00, &end
#
# 146 GLN H 146 GLN QB 2.79
&rst
ixpk= 0, nxpk= 0, iat=2335, -1, r1= 1.30, r2= 1.80, r3= 3.13, r4= 3.63,
igr2=2339,2340,
&end
#
# 144 ILE QG2 146 GLN H 5.62
&rst
ixpk= 0, nxpk= 0, iat= -1,2335, r1= 1.30, r2= 1.80, r3= 6.75, r4= 7.25,
igr1=2312,2313,2314,
&end
#
# 57 PHE H 58 THR H 4.64
&rst
ixpk= 0, nxpk= 0, iat= 895, 915, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14, &end
#
# 105 GLU H 106 ASP H 3.25
&rst
ixpk= 0, nxpk= 0, iat=1685,1700, r1= 1.30, r2= 1.80, r3= 3.25, r4= 3.75, &end
#
# 57 PHE QD 58 THR H 4.24
&rst
ixpk= 0, nxpk= 0, iat= -1, 915, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
igr1= 903, 911,
&end
#
# 106 ASP H 107 MET H 3.00
&rst
ixpk= 0, nxpk= 0, iat=1700,1712, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 57 PHE HA 58 THR H 3.12
&rst
ixpk= 0, nxpk= 0, iat= 897, 915, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62, &end
#
# 58 THR H 58 THR HB 3.32
&rst
ixpk= 0, nxpk= 0, iat= 915, 919, r1= 1.30, r2= 1.80, r3= 3.32, r4= 3.82, &end
#
# 105 GLU HA 106 ASP H 3.55
&rst
ixpk= 0, nxpk= 0, iat=1687,1700, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05, &end
#
# 106 ASP H 106 ASP HB3 3.04
&rst
ixpk= 0, nxpk= 0, iat=1700,1705, r1= 1.30, r2= 1.80, r3= 3.04, r4= 3.54, &end
#
# 105 GLU HG2 106 ASP H 5.40
&rst
ixpk= 0, nxpk= 0, iat=1692,1700, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90, &end
#
# 56 ARG QG 58 THR H 5.36
&rst
ixpk= 0, nxpk= 0, iat= -1, 915, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,
igr1= 878, 879,
&end
#
# 105 GLU HB3 106 ASP H 4.02
&rst
ixpk= 0, nxpk= 0, iat=1690,1700, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52, &end
#
# 58 THR H 62 THR QG2 4.85
&rst
ixpk= 0, nxpk= 0, iat= 915, -1, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32,
igr2= 986, 987, 988,
&end
#
# 104 THR H 106 ASP H 5.07
&rst
ixpk= 0, nxpk= 0, iat=1671,1700, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, &end
#
# 142 ASP H 143 GLN HE22 6.21
&rst
ixpk= 0, nxpk= 0, iat=2277,2301, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71, &end
#
# 143 GLN QB 143 GLN HE22 3.95
&rst
ixpk= 0, nxpk= 0, iat= -1,2301, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
igr1=2293,2294,
&end
#
# 143 GLN H 143 GLN HE21 4.09
&rst
ixpk= 0, nxpk= 0, iat=2289,2302, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59, &end
#
# 143 GLN HA 143 GLN HE21 4.98
&rst
ixpk= 0, nxpk= 0, iat=2291,2302, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48, &end
#
# 23 GLN HE21 27 GLU H 4.99
&rst
ixpk= 0, nxpk= 0, iat= 351, 408, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49, &end
#
# 23 GLN HA 23 GLN HE21 4.91
&rst
ixpk= 0, nxpk= 0, iat= 340, 351, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41, &end
#
# 23 GLN HE21 27 GLU HA 5.23
&rst
ixpk= 0, nxpk= 0, iat= 351, 410, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73, &end
#
# 23 GLN HG2 23 GLN HE21 3.17
&rst
ixpk= 0, nxpk= 0, iat= 345, 351, r1= 1.30, r2= 1.80, r3= 3.17, r4= 3.67, &end
#
# 23 GLN HE21 27 GLU HG2 3.44
&rst
ixpk= 0, nxpk= 0, iat= 351, 415, r1= 1.30, r2= 1.80, r3= 3.44, r4= 3.94, &end
#
# 23 GLN HG3 23 GLN HE21 3.17
&rst
ixpk= 0, nxpk= 0, iat= 346, 351, r1= 1.30, r2= 1.80, r3= 3.17, r4= 3.67, &end
#
# 23 GLN HB3 23 GLN HE21 4.80
&rst
ixpk= 0, nxpk= 0, iat= 343, 351, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30, &end
#
# 89 GLN QG 89 GLN HE22 3.42
&rst
ixpk= 0, nxpk= 0, iat= -1,1431, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
igr1=1426,1427,
&end
#
# 89 GLN HE22 152 ASP H 6.17
&rst
ixpk= 0, nxpk= 0, iat=1431,2415, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67, &end
#
# 89 GLN HE22 151 GLU HA 4.35
&rst
ixpk= 0, nxpk= 0, iat=1431,2402, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85, &end
#
# 89 GLN HE21 151 GLU HA 5.06
&rst
ixpk= 0, nxpk= 0, iat=1432,2402, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56, &end
#
# 23 GLN HA 23 GLN HE22 6.11
&rst
ixpk= 0, nxpk= 0, iat= 340, 350, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61, &end
#
# 23 GLN HE22 27 GLU HA 6.50
&rst
ixpk= 0, nxpk= 0, iat= 350, 410, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00, &end
#
# 23 GLN HE22 27 GLU HG2 4.28
&rst
ixpk= 0, nxpk= 0, iat= 350, 415, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78, &end
#
# 23 GLN HG3 23 GLN HE22 3.97
&rst
ixpk= 0, nxpk= 0, iat= 346, 350, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47, &end
#
# 23 GLN HE22 26 LYS QD 4.21
&rst
ixpk= 0, nxpk= 0, iat= 350, -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
igr2= 396, 397,
&end
#
# 132 ARG H 134 PHE H 4.27
&rst
ixpk= 0, nxpk= 0, iat=2121,2155, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77, &end
#
# 134 PHE H 135 ALA H 4.38
&rst
ixpk= 0, nxpk= 0, iat=2155,2175, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88, &end
#
# 131 PHE QD 134 PHE H 5.11
&rst
ixpk= 0, nxpk= 0, iat= -1,2155, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
igr1=2109,2117,
&end
#
# 133 ALA HA 134 PHE H 3.40
&rst
ixpk= 0, nxpk= 0, iat=2147,2155, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90, &end
#
# 132 ARG HA 134 PHE H 4.65
&rst
ixpk= 0, nxpk= 0, iat=2123,2155, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15, &end
#
# 103 CYM HB2 134 PHE H 4.00
&rst
ixpk= 0, nxpk= 0, iat=1664,2155, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 103 CYM HB3 134 PHE H 4.30
&rst
ixpk= 0, nxpk= 0, iat=1665,2155, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80, &end
#
# 8 THR H 9 SER H 4.69
&rst
ixpk= 0, nxpk= 0, iat= 99, 113, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, &end
#
# 8 THR H 87 GLN H 6.50
&rst
ixpk= 0, nxpk= 0, iat= 99,1391, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00, &end
#
# 8 THR H 60 TYR QD 4.63
&rst
ixpk= 0, nxpk= 0, iat= 99, -1, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
igr2= 952, 961,
&end
#
# 7 LYS HA 8 THR H 2.92
&rst
ixpk= 0, nxpk= 0, iat= 79, 99, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42, &end
#
# 7 LYS QD 8 THR H 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 99, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 87, 88,
&end
#
# 29 PHE HB3 31 THR H 5.16
&rst
ixpk= 0, nxpk= 0, iat= 449, 475, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66, &end
#
# 31 THR H 62 THR QG2 6.30
&rst
ixpk= 0, nxpk= 0, iat= 475, -1, r1= 1.30, r2= 1.80, r3= 7.57, r4= 8.07,
igr2= 986, 987, 988,
&end
#
# 63 GLN HE22 87 GLN HB3 6.50
&rst
ixpk= 0, nxpk= 0, iat=1006,1396, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00, &end
#
# 8 THR H 60 TYR HB2 5.08
&rst
ixpk= 0, nxpk= 0, iat= 99, 948, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58, &end
#
# 8 THR H 8 THR HB 3.80
&rst
ixpk= 0, nxpk= 0, iat= 99, 103, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30, &end
#
# 7 LYS HB2 8 THR H 3.68
&rst
ixpk= 0, nxpk= 0, iat= 81, 99, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18, &end
#
# 7 LYS QG 8 THR H 4.26
&rst
ixpk= 0, nxpk= 0, iat= -1, 99, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
igr1= 84, 85,
&end
#
# 8 THR H 8 THR QG2 3.37
&rst
ixpk= 0, nxpk= 0, iat= 99, -1, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,
igr2= 105, 106, 107,
&end
#
# 63 GLN HG3 63 GLN HE21 3.14
&rst
ixpk= 0, nxpk= 0, iat=1002,1007, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64, &end
#
# 29 PHE H 31 THR H 4.42
&rst
ixpk= 0, nxpk= 0, iat= 444, 475, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92, &end
#
# 31 THR H 32 PHE H 3.12
&rst
ixpk= 0, nxpk= 0, iat= 475, 489, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62, &end
#
# 30 SER HA 31 THR H 3.46
&rst
ixpk= 0, nxpk= 0, iat= 466, 475, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96, &end
#
# 29 PHE HA 31 THR H 3.92
&rst
ixpk= 0, nxpk= 0, iat= 446, 475, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42, &end
#
# 31 THR H 31 THR HA 2.88
&rst
ixpk= 0, nxpk= 0, iat= 475, 477, r1= 1.30, r2= 1.80, r3= 2.88, r4= 3.38, &end
#
# 31 THR H 31 THR HB 3.13
&rst
ixpk= 0, nxpk= 0, iat= 475, 479, r1= 1.30, r2= 1.80, r3= 3.13, r4= 3.63, &end
#
# 31 THR H 32 PHE HB2 5.07
&rst
ixpk= 0, nxpk= 0, iat= 475, 493, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, &end
#
# 94 ARG HA 146 GLN HE21 4.39
&rst
ixpk= 0, nxpk= 0, iat=1498,2348, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89, &end
#
# 94 ARG QD 146 GLN HE21 5.07
&rst
ixpk= 0, nxpk= 0, iat= -1,2348, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
igr1=1506,1507,
&end
#
# 94 ARG HA 146 GLN HE22 4.39
&rst
ixpk= 0, nxpk= 0, iat=1498,2347, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89, &end
#
# 146 GLN QG 146 GLN HE22 3.28
&rst
ixpk= 0, nxpk= 0, iat= -1,2347, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18,
igr1=2342,2343,
&end
#
# 63 GLN HE22 87 GLN HA 6.04
&rst
ixpk= 0, nxpk= 0, iat=1006,1393, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54, &end
#
# 63 GLN HE22 87 GLN H 5.94
&rst
ixpk= 0, nxpk= 0, iat=1006,1391, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44, &end
#
# 63 GLN HG3 63 GLN HE22 3.71
&rst
ixpk= 0, nxpk= 0, iat=1002,1006, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21, &end
#
# 101 GLY H 102 ARG HE 6.50
&rst
ixpk= 0, nxpk= 0, iat=1629,1649, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00, &end
#
# 101 GLY H 161 HIS HA 5.06
&rst
ixpk= 0, nxpk= 0, iat=1629,2561, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56, &end
#
# 101 GLY H 162 ILE HA 4.08
&rst
ixpk= 0, nxpk= 0, iat=1629,2578, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58, &end
#
# 101 GLY H 160 VAL HA 4.99
&rst
ixpk= 0, nxpk= 0, iat=1629,2545, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49, &end
#
# 100 VAL HA 101 GLY H 3.13
&rst
ixpk= 0, nxpk= 0, iat=1615,1629, r1= 1.30, r2= 1.80, r3= 3.13, r4= 3.63, &end
#
# 100 VAL QG1 101 GLY H 5.41
&rst
ixpk= 0, nxpk= 0, iat= -1,1629, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
igr1=1619,1620,1621,
&end
#
# 101 GLY H 163 SER H 5.29
&rst
ixpk= 0, nxpk= 0, iat=1629,2595, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79, &end
#
# 101 GLY H 102 ARG H 4.76
&rst
ixpk= 0, nxpk= 0, iat=1629,1636, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26, &end
#
# 99 PHE QD 101 GLY H 5.09
&rst
ixpk= 0, nxpk= 0, iat= -1,1629, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21,
igr1=1601,1609,
&end
#
# 101 GLY H 161 HIS HB3 5.55
&rst
ixpk= 0, nxpk= 0, iat=1629,2564, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05, &end
#
# 101 GLY H 160 VAL HB 5.03
&rst
ixpk= 0, nxpk= 0, iat=1629,2547, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53, &end
#
# 64 VAL QG1 87 GLN HE21 6.34
&rst
ixpk= 0, nxpk= 0, iat= -1,1404, r1= 1.30, r2= 1.80, r3= 7.61, r4= 8.11,
igr1=1017,1018,1019,
&end
#
# 87 GLN HB2 87 GLN HE21 3.95
&rst
ixpk= 0, nxpk= 0, iat=1395,1404, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45, &end
#
# 68 SER H 69 GLN HE21 4.67
&rst
ixpk= 0, nxpk= 0, iat=1082,1106, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, &end
#
# 82 LEU HG 87 GLN HE22 5.27
&rst
ixpk= 0, nxpk= 0, iat=1318,1403, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77, &end
#
# 64 VAL QG1 87 GLN HE22 6.34
&rst
ixpk= 0, nxpk= 0, iat= -1,1403, r1= 1.30, r2= 1.80, r3= 7.61, r4= 8.11,
igr1=1017,1018,1019,
&end
#
# 99 PHE QE 101 GLY H 6.24
&rst
ixpk= 0, nxpk= 0, iat= -1,1629, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,
igr1=1603,1607,
&end
#
# 100 VAL QG2 101 GLY H 4.41
&rst
ixpk= 0, nxpk= 0, iat= -1,1629, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr1=1623,1624,1625,
&end
#
# 101 GLY H 161 HIS HB2 5.55
&rst
ixpk= 0, nxpk= 0, iat=1629,2563, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05, &end
#
# 82 LEU HG 87 GLN HE21 5.27
&rst
ixpk= 0, nxpk= 0, iat=1318,1404, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77, &end
#
# 67 MET H 68 SER H 2.93
&rst
ixpk= 0, nxpk= 0, iat=1065,1082, r1= 1.30, r2= 1.80, r3= 2.93, r4= 3.43, &end
#
# 68 SER H 68 SER HA 2.89
&rst
ixpk= 0, nxpk= 0, iat=1082,1084, r1= 1.30, r2= 1.80, r3= 2.89, r4= 3.39, &end
#
# 67 MET HA 68 SER H 3.36
&rst
ixpk= 0, nxpk= 0, iat=1067,1082, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86, &end
#
# 68 SER H 68 SER QB 2.66
&rst
ixpk= 0, nxpk= 0, iat=1082, -1, r1= 1.30, r2= 1.80, r3= 2.99, r4= 3.49,
igr2=1086,1087,
&end
#
# 66 VAL HA 68 SER H 3.97
&rst
ixpk= 0, nxpk= 0, iat=1051,1082, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47, &end
#
# 65 LYS QB 68 SER H 4.88
&rst
ixpk= 0, nxpk= 0, iat= -1,1082, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
igr1=1031,1032,
&end
#
# 66 VAL HB 68 SER H 5.45
&rst
ixpk= 0, nxpk= 0, iat=1053,1082, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95, &end
#
# 66 VAL QG1 68 SER H 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1082, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr1=1055,1056,1057,
&end
#
# 87 GLN HB2 87 GLN HE22 3.95
&rst
ixpk= 0, nxpk= 0, iat=1395,1403, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45, &end
#
# 83 PRO HA 84 ASN HD21 4.60
&rst
ixpk= 0, nxpk= 0, iat=1340,1354, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 84 ASN HA 84 ASN HD21 5.00
&rst
ixpk= 0, nxpk= 0, iat=1346,1354, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 84 ASN HD22 85 SER H 6.16
&rst
ixpk= 0, nxpk= 0, iat=1353,1358, r1= 1.30, r2= 1.80, r3= 6.16, r4= 6.66, &end
#
# 83 PRO HA 84 ASN HD22 5.65
&rst
ixpk= 0, nxpk= 0, iat=1340,1353, r1= 1.30, r2= 1.80, r3= 5.65, r4= 6.15, &end
#
# 51 GLY H 52 PHE H 3.21
&rst
ixpk= 0, nxpk= 0, iat= 801, 808, r1= 1.30, r2= 1.80, r3= 3.21, r4= 3.71, &end
#
# 50 LYS H 52 PHE H 4.93
&rst
ixpk= 0, nxpk= 0, iat= 779, 808, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43, &end
#
# 52 PHE H 52 PHE QE 4.48
&rst
ixpk= 0, nxpk= 0, iat= 808, -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
igr2= 818, 822,
&end
#
# 16 LEU H 52 PHE H 6.04
&rst
ixpk= 0, nxpk= 0, iat= 216, 808, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54, &end
#
# 52 PHE H 52 PHE QD 3.34
&rst
ixpk= 0, nxpk= 0, iat= 808, -1, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,
igr2= 816, 824,
&end
#
# 50 LYS HA 52 PHE H 5.18
&rst
ixpk= 0, nxpk= 0, iat= 781, 808, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68, &end
#
# 51 GLY HA2 52 PHE H 3.55
&rst
ixpk= 0, nxpk= 0, iat= 803, 808, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05, &end
#
# 51 GLY HA3 52 PHE H 3.55
&rst
ixpk= 0, nxpk= 0, iat= 804, 808, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05, &end
#
# 13 VAL HB 52 PHE H 6.50
&rst
ixpk= 0, nxpk= 0, iat= 178, 808, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00, &end
#
# 16 LEU QQD 52 PHE H 4.64
&rst
ixpk= 0, nxpk= 0, iat= -1, 808, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75,
igr1= 225, 226, 227, 229, 230, 231,
&end
#
# 69 GLN HE22 70 ARG H 5.95
&rst
ixpk= 0, nxpk= 0, iat=1105,1110, r1= 1.30, r2= 1.80, r3= 5.95, r4= 6.45, &end
#
# 19 LYS H 20 THR HA 4.73
&rst
ixpk= 0, nxpk= 0, iat= 273, 297, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, &end
#
# 18 TRP HB3 19 LYS H 4.59
&rst
ixpk= 0, nxpk= 0, iat= 254, 273, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 19 LYS H 19 LYS QD 4.60
&rst
ixpk= 0, nxpk= 0, iat= 273, -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
igr2= 283, 284,
&end
#
# 18 TRP H 19 LYS H 3.31
&rst
ixpk= 0, nxpk= 0, iat= 249, 273, r1= 1.30, r2= 1.80, r3= 3.31, r4= 3.81, &end
#
# 19 LYS H 20 THR HB 4.18
&rst
ixpk= 0, nxpk= 0, iat= 273, 299, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68, &end
#
# 18 TRP HB2 19 LYS H 3.90
&rst
ixpk= 0, nxpk= 0, iat= 253, 273, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40, &end
#
# 17 PRO QB 19 LYS H 3.63
&rst
ixpk= 0, nxpk= 0, iat= -1, 273, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,
igr1= 242, 243,
&end
#
# 17 PRO QG 19 LYS H 3.68
&rst
ixpk= 0, nxpk= 0, iat= -1, 273, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
igr1= 239, 240,
&end
#
# 19 LYS H 19 LYS HB2 3.87
&rst
ixpk= 0, nxpk= 0, iat= 273, 277, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37, &end
#
# 19 LYS H 19 LYS HB3 3.04
&rst
ixpk= 0, nxpk= 0, iat= 273, 278, r1= 1.30, r2= 1.80, r3= 3.04, r4= 3.54, &end
#
# 19 LYS H 19 LYS HG2 3.01
&rst
ixpk= 0, nxpk= 0, iat= 273, 280, r1= 1.30, r2= 1.80, r3= 3.01, r4= 3.51, &end
#
# 19 LYS H 20 THR QG2 5.30
&rst
ixpk= 0, nxpk= 0, iat= 273, -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
igr2= 301, 302, 303,
&end
#
# 32 PHE HZ 69 GLN HE21 4.18
&rst
ixpk= 0, nxpk= 0, iat= 501,1106, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68, &end
#
# 32 PHE QE 69 GLN HE21 4.52
&rst
ixpk= 0, nxpk= 0, iat= -1,1106, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
igr1= 499, 503,
&end
#
# 69 GLN HA 69 GLN HE21 4.91
&rst
ixpk= 0, nxpk= 0, iat=1095,1106, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41, &end
#
# 69 GLN HE21 71 HID HE1 3.82
&rst
ixpk= 0, nxpk= 0, iat=1106,1144, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32, &end
#
# 69 GLN HE21 70 ARG HA 4.82
&rst
ixpk= 0, nxpk= 0, iat=1106,1112, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32, &end
#
# 66 VAL HA 69 GLN HE21 4.87
&rst
ixpk= 0, nxpk= 0, iat=1051,1106, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37, &end
#
# 69 GLN QG 69 GLN HE21 3.34
&rst
ixpk= 0, nxpk= 0, iat= -1,1106, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,
igr1=1100,1101,
&end
#
# 69 GLN QB 69 GLN HE21 3.59
&rst
ixpk= 0, nxpk= 0, iat= -1,1106, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,
igr1=1097,1098,
&end
#
# 69 GLN HA 69 GLN HE22 6.00
&rst
ixpk= 0, nxpk= 0, iat=1095,1105, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 32 PHE HZ 69 GLN HE22 4.06
&rst
ixpk= 0, nxpk= 0, iat= 501,1105, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56, &end
#
# 66 VAL HA 69 GLN HE22 4.88
&rst
ixpk= 0, nxpk= 0, iat=1051,1105, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38, &end
#
# 115 PHE HZ 118 GLN HE21 4.78
&rst
ixpk= 0, nxpk= 0, iat=1855,1907, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, &end
#
# 115 PHE QE 118 GLN HE22 4.40
&rst
ixpk= 0, nxpk= 0, iat= -1,1906, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
igr1=1853,1857,
&end
#
# 115 PHE HA 118 GLN HE22 5.28
&rst
ixpk= 0, nxpk= 0, iat=1845,1906, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 69 GLN HE21 70 ARG H 4.67
&rst
ixpk= 0, nxpk= 0, iat=1106,1110, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, &end
#
# 115 PHE QE 118 GLN HE21 4.08
&rst
ixpk= 0, nxpk= 0, iat= -1,1907, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
igr1=1853,1857,
&end
#
# 115 PHE HA 118 GLN HE21 4.86
&rst
ixpk= 0, nxpk= 0, iat=1845,1907, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36, &end
#
# 115 PHE HZ 118 GLN HE22 5.28
&rst
ixpk= 0, nxpk= 0, iat=1855,1906, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 102 ARG H 161 HIS H 5.08
&rst
ixpk= 0, nxpk= 0, iat=1636,2559, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58, &end
#
# 102 ARG H 134 PHE H 6.06
&rst
ixpk= 0, nxpk= 0, iat=1636,2155, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56, &end
#
# 102 ARG H 134 PHE QD 6.50
&rst
ixpk= 0, nxpk= 0, iat=1636, -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
igr2=2163,2171,
&end
#
# 102 ARG H 103 CYM HB2 5.15
&rst
ixpk= 0, nxpk= 0, iat=1636,1664, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65, &end
#
# 102 ARG H 133 ALA QB 4.15
&rst
ixpk= 0, nxpk= 0, iat=1636, -1, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
igr2=2149,2150,2151,
&end
#
# 99 PHE QE 102 ARG H 5.47
&rst
ixpk= 0, nxpk= 0, iat= -1,1636, r1= 1.30, r2= 1.80, r3= 6.14, r4= 6.64,
igr1=1603,1607,
&end
#
# 46 THR H 47 GLY H 2.97
&rst
ixpk= 0, nxpk= 0, iat= 729, 743, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 47 GLY H 48 HID H 3.02
&rst
ixpk= 0, nxpk= 0, iat= 743, 750, r1= 1.30, r2= 1.80, r3= 3.02, r4= 3.52, &end
#
# 47 GLY H 48 HID HA 5.29
&rst
ixpk= 0, nxpk= 0, iat= 743, 752, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79, &end
#
# 44 LEU HA 47 GLY H 4.17
&rst
ixpk= 0, nxpk= 0, iat= 690, 743, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67, &end
#
# 46 THR HB 47 GLY H 4.58
&rst
ixpk= 0, nxpk= 0, iat= 733, 743, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08, &end
#
# 47 GLY H 47 GLY HA2 2.78
&rst
ixpk= 0, nxpk= 0, iat= 743, 745, r1= 1.30, r2= 1.80, r3= 2.78, r4= 3.28, &end
#
# 43 ASP HB2 47 GLY H 3.68
&rst
ixpk= 0, nxpk= 0, iat= 680, 743, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18, &end
#
# 43 ASP HB3 47 GLY H 3.68
&rst
ixpk= 0, nxpk= 0, iat= 681, 743, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18, &end
#
# 104 THR H 134 PHE H 6.50
&rst
ixpk= 0, nxpk= 0, iat=1671,2155, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00, &end
#
# 104 THR H 104 THR HB 3.97
&rst
ixpk= 0, nxpk= 0, iat=1671,1675, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47, &end
#
# 103 CYM HA 104 THR H 2.87
&rst
ixpk= 0, nxpk= 0, iat=1662,1671, r1= 1.30, r2= 1.80, r3= 2.87, r4= 3.37, &end
#
# 104 THR H 105 GLU HA 5.58
&rst
ixpk= 0, nxpk= 0, iat=1671,1687, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08, &end
#
# 104 THR H 107 MET QE 2.84
&rst
ixpk= 0, nxpk= 0, iat=1671, -1, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91,
igr2=1723,1724,1725,
&end
#
# 104 THR H 158 ILE HG13 5.14
&rst
ixpk= 0, nxpk= 0, iat=1671,2524, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64, &end
#
# 104 THR H 158 ILE QG2 4.65
&rst
ixpk= 0, nxpk= 0, iat=1671, -1, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr2=2519,2520,2521,
&end
#
# 104 THR H 104 THR QG2 3.08
&rst
ixpk= 0, nxpk= 0, iat=1671, -1, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,
igr2=1677,1678,1679,
&end
#
# 39 GLN HE21 54 PHE QD 4.48
&rst
ixpk= 0, nxpk= 0, iat= 612, -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
igr2= 843, 851,
&end
#
# 39 GLN HE21 158 ILE HA 5.17
&rst
ixpk= 0, nxpk= 0, iat= 612,2515, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67, &end
#
# 39 GLN HE21 41 LYS H 5.08
&rst
ixpk= 0, nxpk= 0, iat= 612, 632, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58, &end
#
# 39 GLN QG 39 GLN HE21 3.28
&rst
ixpk= 0, nxpk= 0, iat= -1, 612, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18,
igr1= 606, 607,
&end
#
# 39 GLN HE21 158 ILE QD1 5.29
&rst
ixpk= 0, nxpk= 0, iat= 612, -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
igr2=2526,2527,2528,
&end
#
# 39 GLN HE21 104 THR QG2 5.09
&rst
ixpk= 0, nxpk= 0, iat= 612, -1, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
igr2=1677,1678,1679,
&end
#
# 39 GLN HE22 54 PHE QD 5.42
&rst
ixpk= 0, nxpk= 0, iat= 611, -1, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
igr2= 843, 851,
&end
#
# 39 GLN HE22 40 VAL HA 6.50
&rst
ixpk= 0, nxpk= 0, iat= 611, 618, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00, &end
#
# 39 GLN QG 39 GLN HE22 3.48
&rst
ixpk= 0, nxpk= 0, iat= -1, 611, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41,
igr1= 606, 607,
&end
#
# 39 GLN QB 39 GLN HE22 3.51
&rst
ixpk= 0, nxpk= 0, iat= -1, 611, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,
igr1= 603, 604,
&end
#
# 37 MET QE 39 GLN HE21 5.36
&rst
ixpk= 0, nxpk= 0, iat= -1, 612, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,
igr1= 577, 578, 579,
&end
#
# 39 GLN QB 39 GLN HE21 3.22
&rst
ixpk= 0, nxpk= 0, iat= -1, 612, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11,
igr1= 603, 604,
&end
#
# 39 GLN HE21 158 ILE QG2 5.40
&rst
ixpk= 0, nxpk= 0, iat= 612, -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
igr2=2519,2520,2521,
&end
#
# 39 GLN HE22 40 VAL H 5.60
&rst
ixpk= 0, nxpk= 0, iat= 611, 616, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10, &end
#
# 50 LYS H 51 GLY H 3.71
&rst
ixpk= 0, nxpk= 0, iat= 779, 801, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21, &end
#
# 18 TRP HZ3 51 GLY H 4.11
&rst
ixpk= 0, nxpk= 0, iat= 266, 801, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 16 LEU QQD 51 GLY H 5.74
&rst
ixpk= 0, nxpk= 0, iat= -1, 801, r1= 1.30, r2= 1.80, r3= 7.74, r4= 8.24,
igr1= 225, 226, 227, 229, 230, 231,
&end
#
# 14 LEU H 53 GLY H 5.01
&rst
ixpk= 0, nxpk= 0, iat= 190, 828, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51, &end
#
# 41 LYS H 53 GLY H 4.64
&rst
ixpk= 0, nxpk= 0, iat= 632, 828, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14, &end
#
# 13 VAL H 53 GLY H 3.77
&rst
ixpk= 0, nxpk= 0, iat= 174, 828, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27, &end
#
# 52 PHE QE 53 GLY H 5.73
&rst
ixpk= 0, nxpk= 0, iat= -1, 828, r1= 1.30, r2= 1.80, r3= 6.43, r4= 6.93,
igr1= 818, 822,
&end
#
# 52 PHE H 53 GLY H 4.62
&rst
ixpk= 0, nxpk= 0, iat= 808, 828, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12, &end
#
# 16 LEU H 53 GLY H 5.70
&rst
ixpk= 0, nxpk= 0, iat= 216, 828, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20, &end
#
# 53 GLY H 54 PHE HA 5.34
&rst
ixpk= 0, nxpk= 0, iat= 828, 837, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84, &end
#
# 52 PHE HA 53 GLY H 3.22
&rst
ixpk= 0, nxpk= 0, iat= 810, 828, r1= 1.30, r2= 1.80, r3= 3.22, r4= 3.72, &end
#
# 12 ILE HA 53 GLY H 4.51
&rst
ixpk= 0, nxpk= 0, iat= 157, 828, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01, &end
#
# 14 LEU HA 53 GLY H 4.36
&rst
ixpk= 0, nxpk= 0, iat= 192, 828, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86, &end
#
# 52 PHE HB2 53 GLY H 3.25
&rst
ixpk= 0, nxpk= 0, iat= 812, 828, r1= 1.30, r2= 1.80, r3= 3.25, r4= 3.75, &end
#
# 13 VAL HB 53 GLY H 4.50
&rst
ixpk= 0, nxpk= 0, iat= 178, 828, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 12 ILE HB 53 GLY H 4.73
&rst
ixpk= 0, nxpk= 0, iat= 159, 828, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, &end
#
# 13 VAL QG1 53 GLY H 4.86
&rst
ixpk= 0, nxpk= 0, iat= -1, 828, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
igr1= 180, 181, 182,
&end
#
# 16 LEU QQD 53 GLY H 4.58
&rst
ixpk= 0, nxpk= 0, iat= -1, 828, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 225, 226, 227, 229, 230, 231,
&end
#
# 15 GLY H 16 LEU QQD 5.90
&rst
ixpk= 0, nxpk= 0, iat= 209, -1, r1= 1.30, r2= 1.80, r3= 7.95, r4= 8.45,
igr2= 225, 226, 227, 229, 230, 231,
&end
#
# 14 LEU HG 15 GLY H 5.46
&rst
ixpk= 0, nxpk= 0, iat= 197, 209, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96, &end
#
# 15 GLY H 52 PHE HA 4.69
&rst
ixpk= 0, nxpk= 0, iat= 209, 810, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, &end
#
# 14 LEU HA 15 GLY H 3.53
&rst
ixpk= 0, nxpk= 0, iat= 192, 209, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03, &end
#
# 52 PHE HB3 53 GLY H 5.16
&rst
ixpk= 0, nxpk= 0, iat= 813, 828, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66, &end
#
# 44 LEU H 46 THR H 4.18
&rst
ixpk= 0, nxpk= 0, iat= 688, 729, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68, &end
#
# 43 ASP HA 46 THR H 4.90
&rst
ixpk= 0, nxpk= 0, iat= 678, 729, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40, &end
#
# 44 LEU HA 46 THR H 4.60
&rst
ixpk= 0, nxpk= 0, iat= 690, 729, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 46 THR H 46 THR HB 3.81
&rst
ixpk= 0, nxpk= 0, iat= 729, 733, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31, &end
#
# 46 THR H 47 GLY HA2 4.40
&rst
ixpk= 0, nxpk= 0, iat= 729, 745, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 43 ASP HB2 46 THR H 4.38
&rst
ixpk= 0, nxpk= 0, iat= 680, 729, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88, &end
#
# 43 ASP HB3 46 THR H 4.38
&rst
ixpk= 0, nxpk= 0, iat= 681, 729, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88, &end
#
# 33 GLY H 57 PHE QE 3.77
&rst
ixpk= 0, nxpk= 0, iat= 509, -1, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,
igr2= 905, 909,
&end
#
# 33 GLY H 57 PHE HZ 5.99
&rst
ixpk= 0, nxpk= 0, iat= 509, 907, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49, &end
#
# 30 SER HA 33 GLY H 3.59
&rst
ixpk= 0, nxpk= 0, iat= 466, 509, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09, &end
#
# 33 GLY H 33 GLY HA3 2.91
&rst
ixpk= 0, nxpk= 0, iat= 509, 512, r1= 1.30, r2= 1.80, r3= 2.91, r4= 3.41, &end
#
# 32 PHE HB2 33 GLY H 3.26
&rst
ixpk= 0, nxpk= 0, iat= 493, 509, r1= 1.30, r2= 1.80, r3= 3.26, r4= 3.76, &end
#
# 32 PHE HB3 33 GLY H 3.74
&rst
ixpk= 0, nxpk= 0, iat= 494, 509, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24, &end
#
# 31 THR QG2 33 GLY H 4.55
&rst
ixpk= 0, nxpk= 0, iat= -1, 509, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
igr1= 481, 482, 483,
&end
#
# 33 GLY H 62 THR QG2 3.23
&rst
ixpk= 0, nxpk= 0, iat= 509, -1, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,
igr2= 986, 987, 988,
&end
#
# 117 SER HA 120 GLY H 3.22
&rst
ixpk= 0, nxpk= 0, iat=1885,1932, r1= 1.30, r2= 1.80, r3= 3.22, r4= 3.72, &end
#
# 120 GLY H 121 ASP HA 4.68
&rst
ixpk= 0, nxpk= 0, iat=1932,1941, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18, &end
#
# 118 GLN QG 120 GLY H 4.83
&rst
ixpk= 0, nxpk= 0, iat= -1,1932, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr1=1901,1902,
&end
#
# 120 GLY H 144 ILE QD1 4.94
&rst
ixpk= 0, nxpk= 0, iat=1932, -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr2=2319,2320,2321,
&end
#
# 120 GLY H 144 ILE QG2 4.77
&rst
ixpk= 0, nxpk= 0, iat=1932, -1, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23,
igr2=2312,2313,2314,
&end
#
# 120 GLY H 122 VAL H 5.78
&rst
ixpk= 0, nxpk= 0, iat=1932,1951, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28, &end
#
# 118 GLN QB 120 GLY H 5.21
&rst
ixpk= 0, nxpk= 0, iat= -1,1932, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
igr1=1898,1899,
&end
#
# 119 TYR QD 120 GLY H 4.39
&rst
ixpk= 0, nxpk= 0, iat= -1,1932, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,
igr1=1919,1928,
&end
#
# 120 GLY H 139 PHE QE 3.57
&rst
ixpk= 0, nxpk= 0, iat=1932, -1, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,
igr2=2245,2249,
&end
#
# 120 GLY H 120 GLY QA 2.90
&rst
ixpk= 0, nxpk= 0, iat=1932, -1, r1= 1.30, r2= 1.80, r3= 3.26, r4= 3.76,
igr2=1934,1935,
&end
#
# 119 TYR HB2 120 GLY H 3.40
&rst
ixpk= 0, nxpk= 0, iat=1915,1932, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90, &end
#
# 156 LYS H 157 GLY H 3.23
&rst
ixpk= 0, nxpk= 0, iat=2484,2506, r1= 1.30, r2= 1.80, r3= 3.23, r4= 3.73, &end
#
# 155 ILE H 157 GLY H 4.26
&rst
ixpk= 0, nxpk= 0, iat=2465,2506, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76, &end
#
# 154 ILE HA 157 GLY H 4.81
&rst
ixpk= 0, nxpk= 0, iat=2448,2506, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31, &end
#
# 156 LYS HA 157 GLY H 3.11
&rst
ixpk= 0, nxpk= 0, iat=2486,2506, r1= 1.30, r2= 1.80, r3= 3.11, r4= 3.61, &end
#
# 157 GLY H 157 GLY HA2 2.77
&rst
ixpk= 0, nxpk= 0, iat=2506,2508, r1= 1.30, r2= 1.80, r3= 2.77, r4= 3.27, &end
#
# 157 GLY H 158 ILE HB 4.94
&rst
ixpk= 0, nxpk= 0, iat=2506,2517, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44, &end
#
# 156 LYS HB3 157 GLY H 4.68
&rst
ixpk= 0, nxpk= 0, iat=2489,2506, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18, &end
#
# 154 ILE HB 157 GLY H 4.86
&rst
ixpk= 0, nxpk= 0, iat=2450,2506, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36, &end
#
# 157 GLY H 158 ILE HG12 4.47
&rst
ixpk= 0, nxpk= 0, iat=2506,2523, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97, &end
#
# 156 LYS HG3 157 GLY H 4.64
&rst
ixpk= 0, nxpk= 0, iat=2492,2506, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14, &end
#
# 154 ILE QG2 157 GLY H 3.81
&rst
ixpk= 0, nxpk= 0, iat= -1,2506, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
igr1=2452,2453,2454,
&end
#
# 155 ILE QG2 157 GLY H 5.89
&rst
ixpk= 0, nxpk= 0, iat= -1,2506, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,
igr1=2471,2472,2473,
&end
#
# 74 ASP H 75 GLY H 3.23
&rst
ixpk= 0, nxpk= 0, iat=1188,1200, r1= 1.30, r2= 1.80, r3= 3.23, r4= 3.73, &end
#
# 73 ILE H 75 GLY H 4.47
&rst
ixpk= 0, nxpk= 0, iat=1169,1200, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97, &end
#
# 75 GLY H 76 ARG HA 5.11
&rst
ixpk= 0, nxpk= 0, iat=1200,1209, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61, &end
#
# 74 ASP HA 75 GLY H 3.29
&rst
ixpk= 0, nxpk= 0, iat=1190,1200, r1= 1.30, r2= 1.80, r3= 3.29, r4= 3.79, &end
#
# 73 ILE HA 75 GLY H 3.81
&rst
ixpk= 0, nxpk= 0, iat=1171,1200, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31, &end
#
# 75 GLY H 75 GLY HA2 2.77
&rst
ixpk= 0, nxpk= 0, iat=1200,1202, r1= 1.30, r2= 1.80, r3= 2.77, r4= 3.27, &end
#
# 72 MET HG2 75 GLY H 3.86
&rst
ixpk= 0, nxpk= 0, iat=1159,1200, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 72 MET HG3 75 GLY H 3.65
&rst
ixpk= 0, nxpk= 0, iat=1160,1200, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15, &end
#
# 73 ILE HB 75 GLY H 5.03
&rst
ixpk= 0, nxpk= 0, iat=1173,1200, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53, &end
#
# 73 ILE QG2 75 GLY H 5.64
&rst
ixpk= 0, nxpk= 0, iat= -1,1200, r1= 1.30, r2= 1.80, r3= 6.77, r4= 7.27,
igr1=1175,1176,1177,
&end
#
# 18 TRP HZ3 51 GLY HA2 4.79
&rst
ixpk= 0, nxpk= 0, iat= 266, 803, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29, &end
#
# 79 ASP HB2 81 LYS QD 5.19
&rst
ixpk= 0, nxpk= 0, iat=1270, -1, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33,
igr2=1299,1300,
&end
#
# 79 ASP HB3 81 LYS HG3 5.25
&rst
ixpk= 0, nxpk= 0, iat=1271,1297, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75, &end
#
# 46 THR H 47 GLY HA3 4.77
&rst
ixpk= 0, nxpk= 0, iat= 729, 746, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27, &end
#
# 42 LYS HB2 47 GLY HA3 5.94
&rst
ixpk= 0, nxpk= 0, iat= 658, 746, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44, &end
#
# 72 MET HG2 75 GLY HA3 4.91
&rst
ixpk= 0, nxpk= 0, iat=1159,1203, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41, &end
#
# 72 MET HG3 75 GLY HA3 5.05
&rst
ixpk= 0, nxpk= 0, iat=1160,1203, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55, &end
#
# 75 GLY HA2 76 ARG HB3 5.56
&rst
ixpk= 0, nxpk= 0, iat=1202,1212, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06, &end
#
# 79 ASP HB2 80 CYS H 4.65
&rst
ixpk= 0, nxpk= 0, iat=1270,1278, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15, &end
#
# 14 LEU HB3 79 ASP HB2 5.25
&rst
ixpk= 0, nxpk= 0, iat= 195,1270, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75, &end
#
# 14 LEU QD1 79 ASP HB2 6.16
&rst
ixpk= 0, nxpk= 0, iat= -1,1270, r1= 1.30, r2= 1.80, r3= 7.40, r4= 7.90,
igr1= 199, 200, 201,
&end
#
# 153 LEU HB2 153 LEU QD2 4.65
&rst
ixpk= 0, nxpk= 0, iat=2431, -1, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr2=2440,2441,2442,
&end
#
# 115 PHE HZ 153 LEU HB3 4.63
&rst
ixpk= 0, nxpk= 0, iat=1855,2432, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, &end
#
# 42 LYS QE 47 GLY HA3 4.39
&rst
ixpk= 0, nxpk= 0, iat= -1, 746, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,
igr1= 667, 668,
&end
#
# 156 LYS H 157 GLY HA3 5.41
&rst
ixpk= 0, nxpk= 0, iat=2484,2509, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91, &end
#
# 154 ILE QG2 157 GLY HA3 5.07
&rst
ixpk= 0, nxpk= 0, iat= -1,2509, r1= 1.30, r2= 1.80, r3= 6.09, r4= 6.59,
igr1=2452,2453,2454,
&end
#
# 72 MET QE 75 GLY HA3 4.33
&rst
ixpk= 0, nxpk= 0, iat= -1,1203, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
igr1=1163,1164,1165,
&end
#
# 74 ASP H 75 GLY HA3 5.58
&rst
ixpk= 0, nxpk= 0, iat=1188,1203, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08, &end
#
# 72 MET HG2 75 GLY HA2 4.72
&rst
ixpk= 0, nxpk= 0, iat=1159,1202, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22, &end
#
# 74 ASP H 75 GLY HA2 5.03
&rst
ixpk= 0, nxpk= 0, iat=1188,1202, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53, &end
#
# 156 LYS HA 157 GLY HA3 4.71
&rst
ixpk= 0, nxpk= 0, iat=2486,2509, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21, &end
#
# 156 LYS H 157 GLY HA2 5.23
&rst
ixpk= 0, nxpk= 0, iat=2484,2508, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73, &end
#
# 156 LYS HA 157 GLY HA2 4.82
&rst
ixpk= 0, nxpk= 0, iat=2486,2508, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32, &end
#
# 52 PHE QD 53 GLY QA 5.40
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.80, r4= 7.30,
igr1= 816, 824,
igr2= 830, 831,
&end
#
# 53 GLY QA 54 PHE QD 5.72
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr1= 830, 831,
igr2= 843, 851,
&end
#
# 16 LEU QQD 53 GLY QA 5.51
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.34, r4= 8.84,
igr1= 225, 226, 227, 229, 230, 231,
igr2= 830, 831,
&end
#
# 33 GLY HA3 34 GLU HG3 5.62
&rst
ixpk= 0, nxpk= 0, iat= 512, 524, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12, &end
#
# 33 GLY HA3 34 GLU HG2 4.69
&rst
ixpk= 0, nxpk= 0, iat= 512, 523, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, &end
#
# 119 TYR HB2 120 GLY QA 5.07
&rst
ixpk= 0, nxpk= 0, iat=1915, -1, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
igr2=1934,1935,
&end
#
# 120 GLY QA 139 PHE QE 5.04
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
igr1=1934,1935,
igr2=2245,2249,
&end
#
# 33 GLY HA2 34 GLU HB3 4.70
&rst
ixpk= 0, nxpk= 0, iat= 511, 521, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 33 GLY HA2 62 THR QG2 3.78
&rst
ixpk= 0, nxpk= 0, iat= 511, -1, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
igr2= 986, 987, 988,
&end
#
# 124 ASP HB2 138 THR HB 4.60
&rst
ixpk= 0, nxpk= 0, iat=1988,2225, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 124 ASP HB3 138 THR H 5.17
&rst
ixpk= 0, nxpk= 0, iat=1989,2221, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67, &end
#
# 124 ASP HB3 138 THR HB 4.60
&rst
ixpk= 0, nxpk= 0, iat=1989,2225, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 14 LEU HB2 79 ASP HB2 5.25
&rst
ixpk= 0, nxpk= 0, iat= 194,1270, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75, &end
#
# 35 VAL HA 36 LEU HB2 4.78
&rst
ixpk= 0, nxpk= 0, iat= 533, 551, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, &end
#
# 36 LEU HB2 154 ILE QD1 4.74
&rst
ixpk= 0, nxpk= 0, iat= 551, -1, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
igr2=2459,2460,2461,
&end
#
# 36 LEU HB2 56 ARG QG 4.31
&rst
ixpk= 0, nxpk= 0, iat= 551, -1, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
igr2= 878, 879,
&end
#
# 33 GLY HA3 62 THR QG2 3.80
&rst
ixpk= 0, nxpk= 0, iat= 512, -1, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
igr2= 986, 987, 988,
&end
#
# 119 TYR H 120 GLY QA 5.15
&rst
ixpk= 0, nxpk= 0, iat=1911, -1, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr2=1934,1935,
&end
#
# 33 GLY HA2 57 PHE QD 5.56
&rst
ixpk= 0, nxpk= 0, iat= 511, -1, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
igr2= 903, 911,
&end
#
# 148 LEU HB3 148 LEU QD1 5.22
&rst
ixpk= 0, nxpk= 0, iat=2368, -1, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
igr2=2372,2373,2374,
&end
#
# 36 LEU HB2 36 LEU QD2 5.31
&rst
ixpk= 0, nxpk= 0, iat= 551, -1, r1= 1.30, r2= 1.80, r3= 6.38, r4= 6.88,
igr2= 560, 561, 562,
&end
#
# 36 LEU HB3 57 PHE HA 5.64
&rst
ixpk= 0, nxpk= 0, iat= 552, 897, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14, &end
#
# 36 LEU HB3 154 ILE QD1 4.80
&rst
ixpk= 0, nxpk= 0, iat= 552, -1, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
igr2=2459,2460,2461,
&end
#
# 148 LEU HB3 148 LEU QD2 6.22
&rst
ixpk= 0, nxpk= 0, iat=2368, -1, r1= 1.30, r2= 1.80, r3= 7.47, r4= 7.97,
igr2=2376,2377,2378,
&end
#
# 100 VAL HA 101 GLY HA2 4.90
&rst
ixpk= 0, nxpk= 0, iat=1615,1631, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40, &end
#
# 99 PHE QE 101 GLY HA2 5.06
&rst
ixpk= 0, nxpk= 0, iat= -1,1631, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
igr1=1603,1607,
&end
#
# 100 VAL HA 101 GLY HA3 4.90
&rst
ixpk= 0, nxpk= 0, iat=1615,1632, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40, &end
#
# 96 ARG HA 96 ARG QD 3.50
&rst
ixpk= 0, nxpk= 0, iat=1533, -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
igr2=1541,1542,
&end
#
# 96 ARG QD 140 ALA H 4.24
&rst
ixpk= 0, nxpk= 0, iat= -1,2255, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
igr1=1541,1542,
&end
#
# 96 ARG HG3 96 ARG QD 2.99
&rst
ixpk= 0, nxpk= 0, iat=1539, -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
igr2=1541,1542,
&end
#
# 96 ARG QD 144 ILE QD1 6.18
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.33, r4= 8.83,
igr1=1541,1542,
igr2=2319,2320,2321,
&end
#
# 141 ASP HB2 144 ILE HB 4.15
&rst
ixpk= 0, nxpk= 0, iat=2269,2310, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65, &end
#
# 141 ASP H 141 ASP HB2 3.76
&rst
ixpk= 0, nxpk= 0, iat=2265,2269, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26, &end
#
# 140 ALA QB 141 ASP HB2 3.99
&rst
ixpk= 0, nxpk= 0, iat= -1,2269, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
igr1=2259,2260,2261,
&end
#
# 141 ASP HB2 144 ILE HG12 4.48
&rst
ixpk= 0, nxpk= 0, iat=2269,2316, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98, &end
#
# 139 PHE HB3 141 ASP HB2 4.58
&rst
ixpk= 0, nxpk= 0, iat=2240,2269, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08, &end
#
# 141 ASP HB2 144 ILE QG2 6.02
&rst
ixpk= 0, nxpk= 0, iat=2269, -1, r1= 1.30, r2= 1.80, r3= 7.23, r4= 7.73,
igr2=2312,2313,2314,
&end
#
# 70 ARG HD3 71 HID H 5.20
&rst
ixpk= 0, nxpk= 0, iat=1121,1134, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70, &end
#
# 141 ASP HB3 144 ILE QG2 6.00
&rst
ixpk= 0, nxpk= 0, iat=2270, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr2=2312,2313,2314,
&end
#
# 139 PHE HB3 141 ASP HB3 5.35
&rst
ixpk= 0, nxpk= 0, iat=2240,2270, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85, &end
#
# 141 ASP HB3 144 ILE HA 5.80
&rst
ixpk= 0, nxpk= 0, iat=2270,2308, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30, &end
#
# 140 ALA QB 141 ASP HB3 5.18
&rst
ixpk= 0, nxpk= 0, iat= -1,2270, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
igr1=2259,2260,2261,
&end
#
# 141 ASP HB3 144 ILE HG12 4.24
&rst
ixpk= 0, nxpk= 0, iat=2270,2316, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74, &end
#
# 141 ASP HB3 144 ILE HG13 4.29
&rst
ixpk= 0, nxpk= 0, iat=2270,2317, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79, &end
#
# 140 ALA H 141 ASP HB3 5.53
&rst
ixpk= 0, nxpk= 0, iat=2255,2270, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03, &end
#
# 96 ARG QD 139 PHE H 4.66
&rst
ixpk= 0, nxpk= 0, iat= -1,2235, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73,
igr1=1541,1542,
&end
#
# 96 ARG QD 141 ASP HA 3.97
&rst
ixpk= 0, nxpk= 0, iat= -1,2267, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
igr1=1541,1542,
&end
#
# 96 ARG QD 140 ALA HA 3.59
&rst
ixpk= 0, nxpk= 0, iat= -1,2257, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,
igr1=1541,1542,
&end
#
# 96 ARG HB3 96 ARG QD 3.14
&rst
ixpk= 0, nxpk= 0, iat=1536, -1, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02,
igr2=1541,1542,
&end
#
# 96 ARG HG2 96 ARG QD 2.99
&rst
ixpk= 0, nxpk= 0, iat=1538, -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
igr2=1541,1542,
&end
#
# 96 ARG QD 141 ASP HB3 5.35
&rst
ixpk= 0, nxpk= 0, iat= -1,2270, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51,
igr1=1541,1542,
&end
#
# 94 ARG H 94 ARG QD 4.06
&rst
ixpk= 0, nxpk= 0, iat=1496, -1, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
igr2=1506,1507,
&end
#
# 94 ARG QD 173 ARG H 5.80
&rst
ixpk= 0, nxpk= 0, iat= -1,2737, r1= 1.30, r2= 1.80, r3= 6.51, r4= 7.01,
igr1=1506,1507,
&end
#
# 94 ARG QD 146 GLN HE22 5.07
&rst
ixpk= 0, nxpk= 0, iat= -1,2347, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
igr1=1506,1507,
&end
#
# 93 LEU HA 94 ARG QD 4.32
&rst
ixpk= 0, nxpk= 0, iat=1479, -1, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
igr2=1506,1507,
&end
#
# 94 ARG QD 174 GLN QG 4.04
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
igr1=1506,1507,
igr2=2768,2769,
&end
#
# 94 ARG HG3 94 ARG QD 2.62
&rst
ixpk= 0, nxpk= 0, iat=1504, -1, r1= 1.30, r2= 1.80, r3= 2.94, r4= 3.44,
igr2=1506,1507,
&end
#
# 93 LEU QD2 94 ARG QD 5.55
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.48, r4= 7.98,
igr1=1490,1491,1492,
igr2=1506,1507,
&end
#
# 70 ARG H 70 ARG HD2 4.67
&rst
ixpk= 0, nxpk= 0, iat=1110,1120, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, &end
#
# 70 ARG HD2 77 TRP HE3 4.66
&rst
ixpk= 0, nxpk= 0, iat=1120,1250, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16, &end
#
# 70 ARG HB2 70 ARG HD2 3.95
&rst
ixpk= 0, nxpk= 0, iat=1114,1120, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45, &end
#
# 70 ARG HD2 71 HID H 5.20
&rst
ixpk= 0, nxpk= 0, iat=1120,1134, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70, &end
#
# 70 ARG H 70 ARG HD3 4.67
&rst
ixpk= 0, nxpk= 0, iat=1110,1121, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, &end
#
# 70 ARG HB2 70 ARG HD3 3.95
&rst
ixpk= 0, nxpk= 0, iat=1114,1121, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45, &end
#
# 94 ARG QD 172 ASN HA 6.16
&rst
ixpk= 0, nxpk= 0, iat= -1,2725, r1= 1.30, r2= 1.80, r3= 6.91, r4= 7.41,
igr1=1506,1507,
&end
#
# 94 ARG HB3 94 ARG QD 2.91
&rst
ixpk= 0, nxpk= 0, iat=1501, -1, r1= 1.30, r2= 1.80, r3= 3.27, r4= 3.77,
igr2=1506,1507,
&end
#
# 94 ARG HG2 94 ARG QD 2.40
&rst
ixpk= 0, nxpk= 0, iat=1503, -1, r1= 1.30, r2= 1.80, r3= 2.69, r4= 3.19,
igr2=1506,1507,
&end
#
# 173 ARG HA 173 ARG QD 3.40
&rst
ixpk= 0, nxpk= 0, iat=2739, -1, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,
igr2=2747,2748,
&end
#
# 93 LEU QD1 94 ARG QD 5.23
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.05, r4= 7.55,
igr1=1486,1487,1488,
igr2=1506,1507,
&end
#
# 56 ARG HA 56 ARG HD2 4.96
&rst
ixpk= 0, nxpk= 0, iat= 873, 881, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46, &end
#
# 94 ARG QD 174 GLN H 5.21
&rst
ixpk= 0, nxpk= 0, iat= -1,2761, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
igr1=1506,1507,
&end
#
# 97 LYS QG 136 PHE QB 5.16
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
igr1=1562,1563,
igr2=2189,2190,
&end
#
# 127 ILE HG13 136 PHE QB 5.55
&rst
ixpk= 0, nxpk= 0, iat=2043, -1, r1= 1.30, r2= 1.80, r3= 6.23, r4= 6.73,
igr2=2189,2190,
&end
#
# 11 LEU HB2 55 VAL H 5.04
&rst
ixpk= 0, nxpk= 0, iat= 140, 855, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54, &end
#
# 113 ARG HD3 117 SER H 5.13
&rst
ixpk= 0, nxpk= 0, iat=1815,1883, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63, &end
#
# 113 ARG HA 113 ARG HD3 4.58
&rst
ixpk= 0, nxpk= 0, iat=1806,1815, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08, &end
#
# 113 ARG QB 113 ARG HD3 3.49
&rst
ixpk= 0, nxpk= 0, iat= -1,1815, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
igr1=1808,1809,
&end
#
# 113 ARG HD3 122 VAL HB 4.48
&rst
ixpk= 0, nxpk= 0, iat=1815,1955, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98, &end
#
# 113 ARG HG2 113 ARG HD3 2.86
&rst
ixpk= 0, nxpk= 0, iat=1811,1815, r1= 1.30, r2= 1.80, r3= 2.86, r4= 3.36, &end
#
# 110 ASP HA 113 ARG HD2 3.74
&rst
ixpk= 0, nxpk= 0, iat=1760,1814, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24, &end
#
# 113 ARG HA 113 ARG HD2 4.32
&rst
ixpk= 0, nxpk= 0, iat=1806,1814, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82, &end
#
# 113 ARG HD2 114 GLU H 3.91
&rst
ixpk= 0, nxpk= 0, iat=1814,1828, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41, &end
#
# 113 ARG HD2 117 SER H 6.19
&rst
ixpk= 0, nxpk= 0, iat=1814,1883, r1= 1.30, r2= 1.80, r3= 6.19, r4= 6.69, &end
#
# 113 ARG QB 113 ARG HD2 3.12
&rst
ixpk= 0, nxpk= 0, iat= -1,1814, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,
igr1=1808,1809,
&end
#
# 113 ARG HG3 113 ARG HD2 2.92
&rst
ixpk= 0, nxpk= 0, iat=1812,1814, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42, &end
#
# 56 ARG HA 56 ARG HD3 4.96
&rst
ixpk= 0, nxpk= 0, iat= 873, 882, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46, &end
#
# 93 LEU H 93 LEU HB3 3.46
&rst
ixpk= 0, nxpk= 0, iat=1477,1482, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96, &end
#
# 92 PRO HA 93 LEU HB3 4.71
&rst
ixpk= 0, nxpk= 0, iat=1473,1482, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21, &end
#
# 93 LEU HB2 94 ARG H 4.19
&rst
ixpk= 0, nxpk= 0, iat=1481,1496, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69, &end
#
# 93 LEU H 93 LEU HB2 3.75
&rst
ixpk= 0, nxpk= 0, iat=1477,1481, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25, &end
#
# 11 LEU HB3 80 CYS HB3 5.18
&rst
ixpk= 0, nxpk= 0, iat= 141,1283, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68, &end
#
# 43 ASP H 43 ASP HB3 3.54
&rst
ixpk= 0, nxpk= 0, iat= 676, 681, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04, &end
#
# 93 LEU HB3 94 ARG H 4.15
&rst
ixpk= 0, nxpk= 0, iat=1482,1496, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65, &end
#
# 93 LEU HB2 164 ASN QB 5.19
&rst
ixpk= 0, nxpk= 0, iat=1481, -1, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33,
igr2=2610,2611,
&end
#
# 92 PRO HA 93 LEU HB2 5.82
&rst
ixpk= 0, nxpk= 0, iat=1473,1481, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32, &end
#
# 93 LEU HB2 94 ARG HA 4.62
&rst
ixpk= 0, nxpk= 0, iat=1481,1498, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12, &end
#
# 25 LEU H 25 LEU HB3 3.71
&rst
ixpk= 0, nxpk= 0, iat= 367, 372, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21, &end
#
# 25 LEU HB3 29 PHE QE 4.89
&rst
ixpk= 0, nxpk= 0, iat= 372, -1, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
igr2= 454, 458,
&end
#
# 25 LEU HB3 26 LYS HB3 4.72
&rst
ixpk= 0, nxpk= 0, iat= 372, 391, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22, &end
#
# 25 LEU HB3 29 PHE QD 4.37
&rst
ixpk= 0, nxpk= 0, iat= 372, -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
igr2= 452, 460,
&end
#
# 25 LEU HB3 26 LYS HA 4.84
&rst
ixpk= 0, nxpk= 0, iat= 372, 388, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34, &end
#
# 25 LEU HB2 27 GLU H 4.99
&rst
ixpk= 0, nxpk= 0, iat= 371, 408, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49, &end
#
# 25 LEU HB2 29 PHE QD 4.02
&rst
ixpk= 0, nxpk= 0, iat= 371, -1, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,
igr2= 452, 460,
&end
#
# 22 GLU HA 25 LEU HB2 3.96
&rst
ixpk= 0, nxpk= 0, iat= 325, 371, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46, &end
#
# 25 LEU HB2 26 LYS HB3 4.90
&rst
ixpk= 0, nxpk= 0, iat= 371, 391, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40, &end
#
# 25 LEU HB2 73 ILE QG2 6.14
&rst
ixpk= 0, nxpk= 0, iat= 371, -1, r1= 1.30, r2= 1.80, r3= 7.37, r4= 7.87,
igr2=1175,1176,1177,
&end
#
# 25 LEU HB2 29 PHE QE 4.53
&rst
ixpk= 0, nxpk= 0, iat= 371, -1, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
igr2= 454, 458,
&end
#
# 24 ASP H 25 LEU HB2 4.96
&rst
ixpk= 0, nxpk= 0, iat= 355, 371, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46, &end
#
# 25 LEU HB3 27 GLU H 5.43
&rst
ixpk= 0, nxpk= 0, iat= 372, 408, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93, &end
#
# 102 ARG HB2 102 ARG HD2 4.03
&rst
ixpk= 0, nxpk= 0, iat=1640,1646, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53, &end
#
# 102 ARG HB3 102 ARG HD2 4.03
&rst
ixpk= 0, nxpk= 0, iat=1641,1646, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53, &end
#
# 102 ARG HB3 102 ARG HD3 4.03
&rst
ixpk= 0, nxpk= 0, iat=1641,1647, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53, &end
#
# 102 ARG HB2 102 ARG HD3 4.03
&rst
ixpk= 0, nxpk= 0, iat=1640,1647, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53, &end
#
# 13 VAL H 52 PHE HB3 5.20
&rst
ixpk= 0, nxpk= 0, iat= 174, 813, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70, &end
#
# 61 GLU QG 65 LYS QE 3.71
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
igr1= 972, 973,
igr2=1040,1041,
&end
#
# 65 LYS QE 66 VAL H 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1049, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr1=1040,1041,
&end
#
# 32 PHE H 65 LYS QE 5.48
&rst
ixpk= 0, nxpk= 0, iat= 489, -1, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
igr2=1040,1041,
&end
#
# 32 PHE QD 65 LYS QE 3.37
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,
igr1= 497, 505,
igr2=1040,1041,
&end
#
# 62 THR HB 65 LYS QE 4.50
&rst
ixpk= 0, nxpk= 0, iat= 984, -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
igr2=1040,1041,
&end
#
# 62 THR HA 65 LYS QE 3.74
&rst
ixpk= 0, nxpk= 0, iat= 982, -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
igr2=1040,1041,
&end
#
# 65 LYS H 65 LYS QE 4.49
&rst
ixpk= 0, nxpk= 0, iat=1027, -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr2=1040,1041,
&end
#
# 52 PHE H 52 PHE HB2 4.18
&rst
ixpk= 0, nxpk= 0, iat= 808, 812, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68, &end
#
# 62 THR QG2 65 LYS QE 3.68
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
igr1= 986, 987, 988,
igr2=1040,1041,
&end
#
# 7 LYS QE 89 GLN HE21 4.80
&rst
ixpk= 0, nxpk= 0, iat= -1,1432, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr1= 90, 91,
&end
#
# 7 LYS QG 7 LYS QE 2.40
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.02, r4= 3.52,
igr1= 84, 85,
igr2= 90, 91,
&end
#
# 81 LYS HG2 81 LYS HE2 3.53
&rst
ixpk= 0, nxpk= 0, iat=1296,1302, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03, &end
#
# 42 LYS QE 43 ASP H 4.77
&rst
ixpk= 0, nxpk= 0, iat= -1, 676, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,
igr1= 667, 668,
&end
#
# 45 LYS QE 46 THR H 5.39
&rst
ixpk= 0, nxpk= 0, iat= -1, 729, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
igr1= 720, 721,
&end
#
# 42 LYS QE 47 GLY HA2 3.98
&rst
ixpk= 0, nxpk= 0, iat= -1, 745, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
igr1= 667, 668,
&end
#
# 45 LYS HB3 45 LYS QE 3.33
&rst
ixpk= 0, nxpk= 0, iat= 712, -1, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24,
igr2= 720, 721,
&end
#
# 23 GLN HE21 26 LYS QE 5.02
&rst
ixpk= 0, nxpk= 0, iat= 351, -1, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr2= 399, 400,
&end
#
# 26 LYS QE 37 MET H 5.85
&rst
ixpk= 0, nxpk= 0, iat= -1, 566, r1= 1.30, r2= 1.80, r3= 6.57, r4= 7.07,
igr1= 399, 400,
&end
#
# 26 LYS QE 27 GLU HA 5.24
&rst
ixpk= 0, nxpk= 0, iat= -1, 410, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
igr1= 399, 400,
&end
#
# 26 LYS HA 26 LYS QE 3.79
&rst
ixpk= 0, nxpk= 0, iat= 388, -1, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,
igr2= 399, 400,
&end
#
# 26 LYS HB3 26 LYS QE 3.11
&rst
ixpk= 0, nxpk= 0, iat= 391, -1, r1= 1.30, r2= 1.80, r3= 3.49, r4= 3.99,
igr2= 399, 400,
&end
#
# 26 LYS QE 35 VAL HB 2.83
&rst
ixpk= 0, nxpk= 0, iat= -1, 535, r1= 1.30, r2= 1.80, r3= 3.18, r4= 3.68,
igr1= 399, 400,
&end
#
# 26 LYS HG2 26 LYS QE 2.77
&rst
ixpk= 0, nxpk= 0, iat= 393, -1, r1= 1.30, r2= 1.80, r3= 3.11, r4= 3.61,
igr2= 399, 400,
&end
#
# 26 LYS QE 35 VAL QG2 3.83
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
igr1= 399, 400,
igr2= 541, 542, 543,
&end
#
# 26 LYS QE 35 VAL QG1 3.83
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
igr1= 399, 400,
igr2= 537, 538, 539,
&end
#
# 50 LYS HE2 52 PHE QE 4.83
&rst
ixpk= 0, nxpk= 0, iat= 792, -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr2= 818, 822,
&end
#
# 44 LEU H 45 LYS QE 4.49
&rst
ixpk= 0, nxpk= 0, iat= 688, -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr2= 720, 721,
&end
#
# 7 LYS QD 7 LYS QE 2.58
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.25, r4= 3.75,
igr1= 87, 88,
igr2= 90, 91,
&end
#
# 45 LYS HG2 45 LYS QE 2.44
&rst
ixpk= 0, nxpk= 0, iat= 714, -1, r1= 1.30, r2= 1.80, r3= 2.74, r4= 3.24,
igr2= 720, 721,
&end
#
# 50 LYS HE3 52 PHE QE 4.83
&rst
ixpk= 0, nxpk= 0, iat= 793, -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr2= 818, 822,
&end
#
# 26 LYS QE 37 MET HA 4.14
&rst
ixpk= 0, nxpk= 0, iat= -1, 568, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
igr1= 399, 400,
&end
#
# 112 LEU HB3 113 ARG H 4.28
&rst
ixpk= 0, nxpk= 0, iat=1790,1804, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78, &end
#
# 112 LEU HB3 137 VAL HA 6.00
&rst
ixpk= 0, nxpk= 0, iat=1790,2207, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 111 GLU HB3 112 LEU HB3 6.44
&rst
ixpk= 0, nxpk= 0, iat=1775,1790, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94, &end
#
# 112 LEU HB3 112 LEU QD2 4.89
&rst
ixpk= 0, nxpk= 0, iat=1790, -1, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,
igr2=1798,1799,1800,
&end
#
# 44 LEU HB2 45 LYS HA 4.45
&rst
ixpk= 0, nxpk= 0, iat= 692, 709, r1= 1.30, r2= 1.80, r3= 4.45, r4= 4.95, &end
#
# 44 LEU HB3 45 LYS HA 5.31
&rst
ixpk= 0, nxpk= 0, iat= 693, 709, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81, &end
#
# 112 LEU HB2 125 VAL QG1 4.59
&rst
ixpk= 0, nxpk= 0, iat=1789, -1, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
igr2=2002,2003,2004,
&end
#
# 19 LYS H 19 LYS QE 5.06
&rst
ixpk= 0, nxpk= 0, iat= 273, -1, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
igr2= 286, 287,
&end
#
# 19 LYS HA 19 LYS QE 4.50
&rst
ixpk= 0, nxpk= 0, iat= 275, -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
igr2= 286, 287,
&end
#
# 19 LYS HB2 19 LYS QE 3.51
&rst
ixpk= 0, nxpk= 0, iat= 277, -1, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,
igr2= 286, 287,
&end
#
# 19 LYS HG2 19 LYS QE 3.46
&rst
ixpk= 0, nxpk= 0, iat= 280, -1, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,
igr2= 286, 287,
&end
#
# 112 LEU HB3 116 PHE QD 4.73
&rst
ixpk= 0, nxpk= 0, iat=1790, -1, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
igr2=1871,1879,
&end
#
# 109 GLU HA 112 LEU HB3 4.79
&rst
ixpk= 0, nxpk= 0, iat=1745,1790, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29, &end
#
# 44 LEU HB2 46 THR H 5.36
&rst
ixpk= 0, nxpk= 0, iat= 692, 729, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86, &end
#
# 44 LEU HB2 45 LYS HB3 4.54
&rst
ixpk= 0, nxpk= 0, iat= 692, 712, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 44 LEU HB2 45 LYS HG2 4.50
&rst
ixpk= 0, nxpk= 0, iat= 692, 714, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 44 LEU H 44 LEU HB3 3.84
&rst
ixpk= 0, nxpk= 0, iat= 688, 693, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34, &end
#
# 44 LEU HB3 45 LYS H 4.38
&rst
ixpk= 0, nxpk= 0, iat= 693, 707, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88, &end
#
# 44 LEU HA 44 LEU HB3 2.79
&rst
ixpk= 0, nxpk= 0, iat= 690, 693, r1= 1.30, r2= 1.80, r3= 2.79, r4= 3.29, &end
#
# 156 LYS H 156 LYS QE 4.78
&rst
ixpk= 0, nxpk= 0, iat=2484, -1, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr2=2497,2498,
&end
#
# 107 MET QE 156 LYS QE 3.71
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,
igr1=1723,1724,1725,
igr2=2497,2498,
&end
#
# 111 GLU HB2 156 LYS QE 4.31
&rst
ixpk= 0, nxpk= 0, iat=1774, -1, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
igr2=2497,2498,
&end
#
# 156 LYS HG3 156 LYS QE 2.94
&rst
ixpk= 0, nxpk= 0, iat=2492, -1, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80,
igr2=2497,2498,
&end
#
# 155 ILE QG2 156 LYS QE 4.75
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.40, r4= 6.90,
igr1=2471,2472,2473,
igr2=2497,2498,
&end
#
# 108 THR H 156 LYS QE 4.51
&rst
ixpk= 0, nxpk= 0, iat=1729, -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
igr2=2497,2498,
&end
#
# 107 MET H 156 LYS QE 5.11
&rst
ixpk= 0, nxpk= 0, iat=1712, -1, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
igr2=2497,2498,
&end
#
# 107 MET HA 156 LYS QE 4.27
&rst
ixpk= 0, nxpk= 0, iat=1714, -1, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
igr2=2497,2498,
&end
#
# 168 LYS HG2 168 LYS QE 3.61
&rst
ixpk= 0, nxpk= 0, iat=2666, -1, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,
igr2=2672,2673,
&end
#
# 168 LYS HG3 168 LYS QE 3.61
&rst
ixpk= 0, nxpk= 0, iat=2667, -1, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,
igr2=2672,2673,
&end
#
# 57 PHE HB2 62 THR QG2 4.98
&rst
ixpk= 0, nxpk= 0, iat= 899, -1, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
igr2= 986, 987, 988,
&end
#
# 139 PHE HB3 144 ILE QG2 6.02
&rst
ixpk= 0, nxpk= 0, iat=2240, -1, r1= 1.30, r2= 1.80, r3= 7.23, r4= 7.73,
igr2=2312,2313,2314,
&end
#
# 97 LYS QE 136 PHE QD 5.96
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.51, r4= 8.01,
igr1=1568,1569,
igr2=2193,2201,
&end
#
# 97 LYS QE 138 THR QG2 4.22
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
igr1=1568,1569,
igr2=2227,2228,2229,
&end
#
# 21 THR H 24 ASP HB3 4.22
&rst
ixpk= 0, nxpk= 0, iat= 309, 360, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 24 ASP HB3 25 LEU H 3.99
&rst
ixpk= 0, nxpk= 0, iat= 360, 367, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49, &end
#
# 98 VAL HA 99 PHE QB 4.75
&rst
ixpk= 0, nxpk= 0, iat=1579, -1, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
igr2=1597,1598,
&end
#
# 57 PHE HB3 62 THR QG2 4.98
&rst
ixpk= 0, nxpk= 0, iat= 900, -1, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
igr2= 986, 987, 988,
&end
#
# 12 ILE HB 83 PRO HA 5.51
&rst
ixpk= 0, nxpk= 0, iat= 159,1340, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01, &end
#
# 12 ILE HB 54 PHE HZ 5.23
&rst
ixpk= 0, nxpk= 0, iat= 159, 847, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73, &end
#
# 139 PHE HB3 145 ALA QB 3.90
&rst
ixpk= 0, nxpk= 0, iat=2240, -1, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
igr2=2329,2330,2331,
&end
#
# 122 VAL HA 139 PHE HB2 5.19
&rst
ixpk= 0, nxpk= 0, iat=1953,2239, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69, &end
#
# 139 PHE HB2 144 ILE QG2 6.21
&rst
ixpk= 0, nxpk= 0, iat=2239, -1, r1= 1.30, r2= 1.80, r3= 7.46, r4= 7.96,
igr2=2312,2313,2314,
&end
#
# 99 PHE QB 136 PHE QE 4.85
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
igr1=1597,1598,
igr2=2195,2199,
&end
#
# 139 PHE HB2 141 ASP H 4.81
&rst
ixpk= 0, nxpk= 0, iat=2239,2265, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31, &end
#
# 121 ASP HB2 140 ALA QB 3.03
&rst
ixpk= 0, nxpk= 0, iat=1943, -1, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
igr2=2259,2260,2261,
&end
#
# 106 ASP HB2 107 MET H 4.50
&rst
ixpk= 0, nxpk= 0, iat=1704,1712, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 81 LYS HA 82 LEU HB2 4.49
&rst
ixpk= 0, nxpk= 0, iat=1291,1315, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99, &end
#
# 82 LEU HB2 83 PRO HD2 4.61
&rst
ixpk= 0, nxpk= 0, iat=1315,1331, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 82 LEU HB3 83 PRO HD3 5.18
&rst
ixpk= 0, nxpk= 0, iat=1316,1332, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68, &end
#
# 67 MET QE 82 LEU HB3 4.64
&rst
ixpk= 0, nxpk= 0, iat= -1,1316, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
igr1=1076,1077,1078,
&end
#
# 82 LEU HB3 87 GLN HB2 4.97
&rst
ixpk= 0, nxpk= 0, iat=1316,1395, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 82 LEU HB3 87 GLN QG 5.54
&rst
ixpk= 0, nxpk= 0, iat=1316, -1, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
igr2=1398,1399,
&end
#
# 106 ASP H 106 ASP HB2 3.04
&rst
ixpk= 0, nxpk= 0, iat=1700,1704, r1= 1.30, r2= 1.80, r3= 3.04, r4= 3.54, &end
#
# 121 ASP HB3 140 ALA QB 3.03
&rst
ixpk= 0, nxpk= 0, iat=1944, -1, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
igr2=2259,2260,2261,
&end
#
# 20 THR QG2 74 ASP HB3 4.27
&rst
ixpk= 0, nxpk= 0, iat= -1,1193, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
igr1= 301, 302, 303,
&end
#
# 73 ILE HB 74 ASP HB3 5.08
&rst
ixpk= 0, nxpk= 0, iat=1173,1193, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58, &end
#
# 19 LYS H 74 ASP HB3 6.50
&rst
ixpk= 0, nxpk= 0, iat= 273,1193, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00, &end
#
# 73 ILE H 74 ASP HB3 6.50
&rst
ixpk= 0, nxpk= 0, iat=1169,1193, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00, &end
#
# 20 THR H 74 ASP HB2 5.66
&rst
ixpk= 0, nxpk= 0, iat= 295,1192, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16, &end
#
# 74 ASP HB2 76 ARG H 5.99
&rst
ixpk= 0, nxpk= 0, iat=1192,1207, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49, &end
#
# 73 ILE HA 74 ASP HB2 4.23
&rst
ixpk= 0, nxpk= 0, iat=1171,1192, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73, &end
#
# 73 ILE QG2 74 ASP HB2 4.52
&rst
ixpk= 0, nxpk= 0, iat= -1,1192, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
igr1=1175,1176,1177,
&end
#
# 73 ILE QD1 74 ASP HB2 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1192, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr1=1182,1183,1184,
&end
#
# 73 ILE H 74 ASP HB2 5.95
&rst
ixpk= 0, nxpk= 0, iat=1169,1192, r1= 1.30, r2= 1.80, r3= 5.95, r4= 6.45, &end
#
# 74 ASP HB2 75 GLY H 4.37
&rst
ixpk= 0, nxpk= 0, iat=1192,1200, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87, &end
#
# 20 THR QG2 74 ASP HB2 4.58
&rst
ixpk= 0, nxpk= 0, iat= -1,1192, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
igr1= 301, 302, 303,
&end
#
# 74 ASP HB3 76 ARG H 4.60
&rst
ixpk= 0, nxpk= 0, iat=1193,1207, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 74 ASP HB3 75 GLY H 4.11
&rst
ixpk= 0, nxpk= 0, iat=1193,1200, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 74 ASP HB3 75 GLY HA2 5.83
&rst
ixpk= 0, nxpk= 0, iat=1193,1202, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33, &end
#
# 19 LYS HG2 74 ASP HB3 4.97
&rst
ixpk= 0, nxpk= 0, iat= 280,1193, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 73 ILE QG2 74 ASP HB3 5.06
&rst
ixpk= 0, nxpk= 0, iat= -1,1193, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
igr1=1175,1176,1177,
&end
#
# 96 ARG HG2 142 ASP HB2 4.70
&rst
ixpk= 0, nxpk= 0, iat=1538,2281, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 96 ARG HG3 142 ASP HB2 4.70
&rst
ixpk= 0, nxpk= 0, iat=1539,2281, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 109 GLU HG2 127 ILE HB 4.05
&rst
ixpk= 0, nxpk= 0, iat=1750,2036, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55, &end
#
# 126 PHE HA 127 ILE HB 4.65
&rst
ixpk= 0, nxpk= 0, iat=2014,2036, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15, &end
#
# 142 ASP HB2 143 GLN H 4.96
&rst
ixpk= 0, nxpk= 0, iat=2281,2289, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46, &end
#
# 96 ARG QD 142 ASP HB2 4.78
&rst
ixpk= 0, nxpk= 0, iat= -1,2281, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr1=1541,1542,
&end
#
# 96 ARG HG3 142 ASP HB3 4.43
&rst
ixpk= 0, nxpk= 0, iat=1539,2282, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93, &end
#
# 142 ASP HB3 143 GLN H 4.67
&rst
ixpk= 0, nxpk= 0, iat=2282,2289, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, &end
#
# 96 ARG QD 142 ASP HB3 4.81
&rst
ixpk= 0, nxpk= 0, iat= -1,2282, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr1=1541,1542,
&end
#
# 96 ARG HG2 142 ASP HB3 4.43
&rst
ixpk= 0, nxpk= 0, iat=1538,2282, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93, &end
#
# 130 PRO HA 131 PHE HB2 4.70
&rst
ixpk= 0, nxpk= 0, iat=2097,2105, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 32 PHE HB2 33 GLY HA2 5.00
&rst
ixpk= 0, nxpk= 0, iat= 493, 511, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 32 PHE HB2 57 PHE QE 5.05
&rst
ixpk= 0, nxpk= 0, iat= 493, -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
igr2= 905, 909,
&end
#
# 112 LEU HA 115 PHE HB3 4.36
&rst
ixpk= 0, nxpk= 0, iat=1787,1848, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86, &end
#
# 115 PHE HB3 116 PHE QD 5.75
&rst
ixpk= 0, nxpk= 0, iat=1848, -1, r1= 1.30, r2= 1.80, r3= 6.45, r4= 6.95,
igr2=1871,1879,
&end
#
# 112 LEU HA 115 PHE HB2 5.62
&rst
ixpk= 0, nxpk= 0, iat=1787,1847, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12, &end
#
# 115 PHE HB2 155 ILE QD1 6.13
&rst
ixpk= 0, nxpk= 0, iat=1847, -1, r1= 1.30, r2= 1.80, r3= 7.36, r4= 7.86,
igr2=2478,2479,2480,
&end
#
# 130 PRO HA 131 PHE HB3 5.97
&rst
ixpk= 0, nxpk= 0, iat=2097,2106, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47, &end
#
# 164 ASN QB 165 ALA QB 5.08
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.85, r4= 7.35,
igr1=2610,2611,
igr2=2624,2625,2626,
&end
#
# 154 ILE HA 155 ILE HB 4.82
&rst
ixpk= 0, nxpk= 0, iat=2448,2469, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32, &end
#
# 155 ILE HB 158 ILE HG12 4.81
&rst
ixpk= 0, nxpk= 0, iat=2469,2523, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31, &end
#
# 93 LEU HG 164 ASN QB 5.13
&rst
ixpk= 0, nxpk= 0, iat=1484, -1, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
igr2=2610,2611,
&end
#
# 115 PHE QE 155 ILE HB 5.69
&rst
ixpk= 0, nxpk= 0, iat= -1,2469, r1= 1.30, r2= 1.80, r3= 6.39, r4= 6.89,
igr1=1853,1857,
&end
#
# 119 TYR HB3 139 PHE QE 4.24
&rst
ixpk= 0, nxpk= 0, iat=1916, -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
igr2=2245,2249,
&end
#
# 116 PHE HA 119 TYR HB3 6.48
&rst
ixpk= 0, nxpk= 0, iat=1865,1916, r1= 1.30, r2= 1.80, r3= 6.48, r4= 6.98, &end
#
# 119 TYR HB3 120 GLY H 5.03
&rst
ixpk= 0, nxpk= 0, iat=1916,1932, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53, &end
#
# 116 PHE QD 119 TYR HB2 5.16
&rst
ixpk= 0, nxpk= 0, iat= -1,1915, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,
igr1=1871,1879,
&end
#
# 119 TYR HB2 139 PHE QE 4.45
&rst
ixpk= 0, nxpk= 0, iat=1915, -1, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,
igr2=2245,2249,
&end
#
# 119 TYR HB2 144 ILE QG2 5.15
&rst
ixpk= 0, nxpk= 0, iat=1915, -1, r1= 1.30, r2= 1.80, r3= 6.18, r4= 6.68,
igr2=2312,2313,2314,
&end
#
# 170 ASN HB2 170 ASN HD21 4.02
&rst
ixpk= 0, nxpk= 0, iat=2702,2708, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52, &end
#
# 170 ASN HB2 170 ASN HD22 4.02
&rst
ixpk= 0, nxpk= 0, iat=2702,2707, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52, &end
#
# 94 ARG HG2 172 ASN HB3 5.96
&rst
ixpk= 0, nxpk= 0, iat=1503,2728, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46, &end
#
# 170 ASN HB3 170 ASN HD22 4.02
&rst
ixpk= 0, nxpk= 0, iat=2703,2707, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52, &end
#
# 170 ASN HB3 170 ASN HD21 4.02
&rst
ixpk= 0, nxpk= 0, iat=2703,2708, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52, &end
#
# 59 GLU HA 60 TYR HB3 4.95
&rst
ixpk= 0, nxpk= 0, iat= 931, 949, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45, &end
#
# 59 GLU HB2 60 TYR HB3 5.09
&rst
ixpk= 0, nxpk= 0, iat= 933, 949, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59, &end
#
# 171 SER QB 172 ASN HB2 5.30
&rst
ixpk= 0, nxpk= 0, iat= -1,2727, r1= 1.30, r2= 1.80, r3= 5.95, r4= 6.45,
igr1=2716,2717,
&end
#
# 94 ARG QD 172 ASN HB2 4.46
&rst
ixpk= 0, nxpk= 0, iat= -1,2727, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
igr1=1506,1507,
&end
#
# 94 ARG HG2 172 ASN HB2 5.96
&rst
ixpk= 0, nxpk= 0, iat=1503,2727, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46, &end
#
# 94 ARG QD 172 ASN HB3 4.46
&rst
ixpk= 0, nxpk= 0, iat= -1,2728, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
igr1=1506,1507,
&end
#
# 72 MET HA 73 ILE HB 4.91
&rst
ixpk= 0, nxpk= 0, iat=1154,1173, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41, &end
#
# 59 GLU HA 60 TYR HB2 4.77
&rst
ixpk= 0, nxpk= 0, iat= 931, 948, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27, &end
#
# 59 GLU HB3 60 TYR HB2 6.50
&rst
ixpk= 0, nxpk= 0, iat= 934, 948, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00, &end
#
# 60 TYR HB2 61 GLU HB2 6.50
&rst
ixpk= 0, nxpk= 0, iat= 948, 969, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00, &end
#
# 8 THR QG2 60 TYR HB2 4.11
&rst
ixpk= 0, nxpk= 0, iat= -1, 948, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
igr1= 105, 106, 107,
&end
#
# 171 SER QB 172 ASN HB3 5.30
&rst
ixpk= 0, nxpk= 0, iat= -1,2728, r1= 1.30, r2= 1.80, r3= 5.95, r4= 6.45,
igr1=2716,2717,
&end
#
# 73 ILE HB 74 ASP H 4.43
&rst
ixpk= 0, nxpk= 0, iat=1173,1188, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93, &end
#
# 20 THR QG2 73 ILE HB 4.75
&rst
ixpk= 0, nxpk= 0, iat= -1,1173, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr1= 301, 302, 303,
&end
#
# 29 PHE HB2 35 VAL QG1 5.30
&rst
ixpk= 0, nxpk= 0, iat= 448, -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
igr2= 537, 538, 539,
&end
#
# 116 PHE HB2 139 PHE QE 4.45
&rst
ixpk= 0, nxpk= 0, iat=1867, -1, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,
igr2=2245,2249,
&end
#
# 28 TYR HB3 73 ILE HG13 6.05
&rst
ixpk= 0, nxpk= 0, iat= 428,1180, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 60 TYR HB2 64 VAL QG1 6.14
&rst
ixpk= 0, nxpk= 0, iat= 948, -1, r1= 1.30, r2= 1.80, r3= 7.37, r4= 7.87,
igr2=1017,1018,1019,
&end
#
# 28 TYR HB2 73 ILE QG2 6.08
&rst
ixpk= 0, nxpk= 0, iat= 427, -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
igr2=1175,1176,1177,
&end
#
# 22 GLU HG2 39 GLN H 4.37
&rst
ixpk= 0, nxpk= 0, iat= 330, 599, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87, &end
#
# 22 GLU HG2 39 GLN HA 3.48
&rst
ixpk= 0, nxpk= 0, iat= 330, 601, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98, &end
#
# 22 GLU HG2 23 GLN HA 4.40
&rst
ixpk= 0, nxpk= 0, iat= 330, 340, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 22 GLU HA 22 GLU HG2 3.23
&rst
ixpk= 0, nxpk= 0, iat= 325, 330, r1= 1.30, r2= 1.80, r3= 3.23, r4= 3.73, &end
#
# 22 GLU HG2 38 VAL HB 3.40
&rst
ixpk= 0, nxpk= 0, iat= 330, 587, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90, &end
#
# 22 GLU HG2 25 LEU HB2 4.71
&rst
ixpk= 0, nxpk= 0, iat= 330, 371, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21, &end
#
# 21 THR QG2 22 GLU HG2 5.42
&rst
ixpk= 0, nxpk= 0, iat= -1, 330, r1= 1.30, r2= 1.80, r3= 6.51, r4= 7.01,
igr1= 315, 316, 317,
&end
#
# 22 GLU HG2 25 LEU H 5.42
&rst
ixpk= 0, nxpk= 0, iat= 330, 367, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92, &end
#
# 22 GLU HG3 40 VAL H 3.29
&rst
ixpk= 0, nxpk= 0, iat= 331, 616, r1= 1.30, r2= 1.80, r3= 3.29, r4= 3.79, &end
#
# 22 GLU HG3 23 GLN H 4.95
&rst
ixpk= 0, nxpk= 0, iat= 331, 338, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45, &end
#
# 22 GLU HG3 39 GLN HA 3.25
&rst
ixpk= 0, nxpk= 0, iat= 331, 601, r1= 1.30, r2= 1.80, r3= 3.25, r4= 3.75, &end
#
# 22 GLU HA 22 GLU HG3 3.18
&rst
ixpk= 0, nxpk= 0, iat= 325, 331, r1= 1.30, r2= 1.80, r3= 3.18, r4= 3.68, &end
#
# 22 GLU HG3 39 GLN H 4.38
&rst
ixpk= 0, nxpk= 0, iat= 331, 599, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88, &end
#
# 26 LYS QD 29 PHE HB2 5.32
&rst
ixpk= 0, nxpk= 0, iat= -1, 448, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr1= 396, 397,
&end
#
# 115 PHE H 116 PHE HB2 5.28
&rst
ixpk= 0, nxpk= 0, iat=1843,1867, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 25 LEU HA 28 TYR HB3 4.41
&rst
ixpk= 0, nxpk= 0, iat= 369, 428, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, &end
#
# 115 PHE H 116 PHE HB3 5.97
&rst
ixpk= 0, nxpk= 0, iat=1843,1868, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47, &end
#
# 116 PHE HB3 139 PHE QE 4.40
&rst
ixpk= 0, nxpk= 0, iat=1868, -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
igr2=2245,2249,
&end
#
# 29 PHE HB3 32 PHE QD 4.71
&rst
ixpk= 0, nxpk= 0, iat= 449, -1, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,
igr2= 497, 505,
&end
#
# 29 PHE HB3 57 PHE QD 5.09
&rst
ixpk= 0, nxpk= 0, iat= 449, -1, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21,
igr2= 903, 911,
&end
#
# 22 GLU HG2 40 VAL HA 5.80
&rst
ixpk= 0, nxpk= 0, iat= 330, 618, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30, &end
#
# 22 GLU HG3 40 VAL HA 4.84
&rst
ixpk= 0, nxpk= 0, iat= 331, 618, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34, &end
#
# 22 GLU HG3 54 PHE H 5.72
&rst
ixpk= 0, nxpk= 0, iat= 331, 835, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 27 GLU HB2 28 TYR HB3 5.23
&rst
ixpk= 0, nxpk= 0, iat= 412, 428, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73, &end
#
# 107 MET QE 158 ILE HB 3.29
&rst
ixpk= 0, nxpk= 0, iat= -1,2517, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
igr1=1723,1724,1725,
&end
#
# 155 ILE QG2 158 ILE HB 5.88
&rst
ixpk= 0, nxpk= 0, iat= -1,2517, r1= 1.30, r2= 1.80, r3= 7.06, r4= 7.56,
igr1=2471,2472,2473,
&end
#
# 108 THR HB 109 GLU HG3 5.66
&rst
ixpk= 0, nxpk= 0, iat=1733,1751, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16, &end
#
# 108 THR HA 109 GLU HG3 4.32
&rst
ixpk= 0, nxpk= 0, iat=1731,1751, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82, &end
#
# 109 GLU H 109 GLU HG2 3.79
&rst
ixpk= 0, nxpk= 0, iat=1743,1750, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29, &end
#
# 109 GLU HG2 110 ASP H 4.71
&rst
ixpk= 0, nxpk= 0, iat=1750,1758, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21, &end
#
# 108 THR HA 109 GLU HG2 5.04
&rst
ixpk= 0, nxpk= 0, iat=1731,1750, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54, &end
#
# 109 GLU HA 109 GLU HG2 3.46
&rst
ixpk= 0, nxpk= 0, iat=1745,1750, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96, &end
#
# 109 GLU H 109 GLU HG3 3.84
&rst
ixpk= 0, nxpk= 0, iat=1743,1751, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34, &end
#
# 109 GLU HA 109 GLU HG3 3.46
&rst
ixpk= 0, nxpk= 0, iat=1745,1751, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96, &end
#
# 109 GLU HG3 127 ILE HB 4.49
&rst
ixpk= 0, nxpk= 0, iat=1751,2036, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99, &end
#
# 109 GLU HG3 127 ILE QG2 5.41
&rst
ixpk= 0, nxpk= 0, iat=1751, -1, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
igr2=2038,2039,2040,
&end
#
# 109 GLU HG3 127 ILE QD1 4.21
&rst
ixpk= 0, nxpk= 0, iat=1751, -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
igr2=2045,2046,2047,
&end
#
# 109 GLU HG2 126 PHE HA 4.48
&rst
ixpk= 0, nxpk= 0, iat=1750,2014, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98, &end
#
# 109 GLU HG2 127 ILE HG13 4.04
&rst
ixpk= 0, nxpk= 0, iat=1750,2043, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, &end
#
# 109 GLU HG2 127 ILE QG2 5.43
&rst
ixpk= 0, nxpk= 0, iat=1750, -1, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
igr2=2038,2039,2040,
&end
#
# 154 ILE HB 159 SER HA 4.94
&rst
ixpk= 0, nxpk= 0, iat=2450,2534, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44, &end
#
# 61 GLU QG 65 LYS H 4.52
&rst
ixpk= 0, nxpk= 0, iat= -1,1027, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
igr1= 972, 973,
&end
#
# 61 GLU QG 62 THR HA 3.91
&rst
ixpk= 0, nxpk= 0, iat= -1, 982, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,
igr1= 972, 973,
&end
#
# 61 GLU QG 64 VAL QG2 4.68
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.31, r4= 6.81,
igr1= 972, 973,
igr2=1021,1022,1023,
&end
#
# 61 GLU QG 64 VAL QG1 4.62
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.23, r4= 6.73,
igr1= 972, 973,
igr2=1017,1018,1019,
&end
#
# 61 GLU QG 62 THR H 3.96
&rst
ixpk= 0, nxpk= 0, iat= -1, 980, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
igr1= 972, 973,
&end
#
# 61 GLU HB2 61 GLU QG 2.57
&rst
ixpk= 0, nxpk= 0, iat= 969, -1, r1= 1.30, r2= 1.80, r3= 2.88, r4= 3.38,
igr2= 972, 973,
&end
#
# 61 GLU HB3 61 GLU QG 2.40
&rst
ixpk= 0, nxpk= 0, iat= 970, -1, r1= 1.30, r2= 1.80, r3= 2.69, r4= 3.19,
igr2= 972, 973,
&end
#
# 33 GLY HA2 34 GLU HG2 5.19
&rst
ixpk= 0, nxpk= 0, iat= 511, 523, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69, &end
#
# 61 GLU HA 61 GLU QG 2.73
&rst
ixpk= 0, nxpk= 0, iat= 967, -1, r1= 1.30, r2= 1.80, r3= 3.06, r4= 3.56,
igr2= 972, 973,
&end
#
# 61 GLU QG 63 GLN H 4.87
&rst
ixpk= 0, nxpk= 0, iat= -1, 994, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,
igr1= 972, 973,
&end
#
# 34 GLU HG3 35 VAL H 3.33
&rst
ixpk= 0, nxpk= 0, iat= 524, 531, r1= 1.30, r2= 1.80, r3= 3.33, r4= 3.83, &end
#
# 34 GLU HA 34 GLU HG3 3.80
&rst
ixpk= 0, nxpk= 0, iat= 518, 524, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30, &end
#
# 34 GLU HG3 36 LEU HG 4.95
&rst
ixpk= 0, nxpk= 0, iat= 524, 554, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45, &end
#
# 34 GLU HG3 58 THR QG2 3.41
&rst
ixpk= 0, nxpk= 0, iat= 524, -1, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,
igr2= 921, 922, 923,
&end
#
# 34 GLU HG3 58 THR H 4.90
&rst
ixpk= 0, nxpk= 0, iat= 524, 915, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40, &end
#
# 34 GLU HG3 62 THR QG2 5.99
&rst
ixpk= 0, nxpk= 0, iat= 524, -1, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
igr2= 986, 987, 988,
&end
#
# 34 GLU HA 34 GLU HG2 3.89
&rst
ixpk= 0, nxpk= 0, iat= 518, 523, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39, &end
#
# 34 GLU HG2 58 THR HA 5.04
&rst
ixpk= 0, nxpk= 0, iat= 523, 917, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54, &end
#
# 34 GLU HB3 34 GLU HG2 2.80
&rst
ixpk= 0, nxpk= 0, iat= 521, 523, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30, &end
#
# 148 LEU HA 151 GLU HG2 4.06
&rst
ixpk= 0, nxpk= 0, iat=2365,2407, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56, &end
#
# 81 LYS HB2 82 LEU HB2 4.33
&rst
ixpk= 0, nxpk= 0, iat=1293,1315, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83, &end
#
# 81 LYS HB2 81 LYS QD 3.20
&rst
ixpk= 0, nxpk= 0, iat=1293, -1, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09,
igr2=1299,1300,
&end
#
# 80 CYS HA 81 LYS HB3 5.06
&rst
ixpk= 0, nxpk= 0, iat=1280,1294, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56, &end
#
# 79 ASP HB3 81 LYS HB3 5.43
&rst
ixpk= 0, nxpk= 0, iat=1271,1294, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93, &end
#
# 81 LYS HB3 81 LYS QD 3.33
&rst
ixpk= 0, nxpk= 0, iat=1294, -1, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24,
igr2=1299,1300,
&end
#
# 12 ILE QD1 81 LYS HB3 5.57
&rst
ixpk= 0, nxpk= 0, iat= -1,1294, r1= 1.30, r2= 1.80, r3= 6.69, r4= 7.19,
igr1= 168, 169, 170,
&end
#
# 27 GLU HG3 29 PHE H 6.19
&rst
ixpk= 0, nxpk= 0, iat= 416, 444, r1= 1.30, r2= 1.80, r3= 6.19, r4= 6.69, &end
#
# 27 GLU HG3 28 TYR HB3 6.24
&rst
ixpk= 0, nxpk= 0, iat= 416, 428, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74, &end
#
# 27 GLU H 27 GLU HG3 2.94
&rst
ixpk= 0, nxpk= 0, iat= 408, 416, r1= 1.30, r2= 1.80, r3= 2.94, r4= 3.44, &end
#
# 24 ASP HA 27 GLU HG3 3.63
&rst
ixpk= 0, nxpk= 0, iat= 357, 416, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13, &end
#
# 114 GLU HB2 114 GLU HG3 2.45
&rst
ixpk= 0, nxpk= 0, iat=1832,1836, r1= 1.30, r2= 1.80, r3= 2.45, r4= 2.95, &end
#
# 26 LYS QD 27 GLU HG3 4.15
&rst
ixpk= 0, nxpk= 0, iat= -1, 416, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
igr1= 396, 397,
&end
#
# 26 LYS HG2 27 GLU HG3 4.36
&rst
ixpk= 0, nxpk= 0, iat= 393, 416, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86, &end
#
# 34 GLU HG3 36 LEU QD1 6.24
&rst
ixpk= 0, nxpk= 0, iat= 524, -1, r1= 1.30, r2= 1.80, r3= 7.49, r4= 7.99,
igr2= 556, 557, 558,
&end
#
# 151 GLU H 151 GLU HG3 3.70
&rst
ixpk= 0, nxpk= 0, iat=2400,2408, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20, &end
#
# 151 GLU HA 151 GLU HG3 4.04
&rst
ixpk= 0, nxpk= 0, iat=2402,2408, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, &end
#
# 148 LEU HA 151 GLU HG3 4.06
&rst
ixpk= 0, nxpk= 0, iat=2365,2408, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56, &end
#
# 80 CYS HA 81 LYS HB2 5.89
&rst
ixpk= 0, nxpk= 0, iat=1280,1293, r1= 1.30, r2= 1.80, r3= 5.89, r4= 6.39, &end
#
# 12 ILE QG2 81 LYS HB2 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1293, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr1= 161, 162, 163,
&end
#
# 144 ILE HB 146 GLN H 5.02
&rst
ixpk= 0, nxpk= 0, iat=2310,2335, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52, &end
#
# 139 PHE QD 144 ILE HB 5.03
&rst
ixpk= 0, nxpk= 0, iat= -1,2310, r1= 1.30, r2= 1.80, r3= 5.65, r4= 6.15,
igr1=2243,2251,
&end
#
# 141 ASP HB3 144 ILE HB 4.46
&rst
ixpk= 0, nxpk= 0, iat=2270,2310, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, &end
#
# 139 PHE HB3 144 ILE HB 4.24
&rst
ixpk= 0, nxpk= 0, iat=2240,2310, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74, &end
#
# 143 GLN QB 144 ILE HB 5.82
&rst
ixpk= 0, nxpk= 0, iat= -1,2310, r1= 1.30, r2= 1.80, r3= 6.53, r4= 7.03,
igr1=2293,2294,
&end
#
# 24 ASP H 27 GLU HG2 5.28
&rst
ixpk= 0, nxpk= 0, iat= 355, 415, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 24 ASP HA 27 GLU HG2 4.07
&rst
ixpk= 0, nxpk= 0, iat= 357, 415, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57, &end
#
# 27 GLU HA 27 GLU HG2 2.88
&rst
ixpk= 0, nxpk= 0, iat= 410, 415, r1= 1.30, r2= 1.80, r3= 2.88, r4= 3.38, &end
#
# 26 LYS HG2 27 GLU HG2 4.88
&rst
ixpk= 0, nxpk= 0, iat= 393, 415, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38, &end
#
# 26 LYS QD 27 GLU HG2 4.13
&rst
ixpk= 0, nxpk= 0, iat= -1, 415, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
igr1= 396, 397,
&end
#
# 26 LYS H 27 GLU HG3 4.22
&rst
ixpk= 0, nxpk= 0, iat= 386, 416, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 23 GLN HE21 27 GLU HG3 3.69
&rst
ixpk= 0, nxpk= 0, iat= 351, 416, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19, &end
#
# 27 GLU HA 27 GLU HG3 3.31
&rst
ixpk= 0, nxpk= 0, iat= 410, 416, r1= 1.30, r2= 1.80, r3= 3.31, r4= 3.81, &end
#
# 26 LYS QE 27 GLU HG3 5.75
&rst
ixpk= 0, nxpk= 0, iat= -1, 416, r1= 1.30, r2= 1.80, r3= 6.45, r4= 6.95,
igr1= 399, 400,
&end
#
# 23 GLN HE22 27 GLU HG3 5.07
&rst
ixpk= 0, nxpk= 0, iat= 350, 416, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, &end
#
# 151 GLU HA 151 GLU HG2 4.04
&rst
ixpk= 0, nxpk= 0, iat=2402,2407, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, &end
#
# 120 GLY QA 144 ILE HB 5.23
&rst
ixpk= 0, nxpk= 0, iat= -1,2310, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,
igr1=1934,1935,
&end
#
# 113 ARG HD2 114 GLU HG3 5.08
&rst
ixpk= 0, nxpk= 0, iat=1814,1836, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58, &end
#
# 114 GLU HB3 114 GLU HG3 2.85
&rst
ixpk= 0, nxpk= 0, iat=1833,1836, r1= 1.30, r2= 1.80, r3= 2.85, r4= 3.35, &end
#
# 113 ARG HE 114 GLU HG2 4.64
&rst
ixpk= 0, nxpk= 0, iat=1817,1835, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14, &end
#
# 97 LYS QB 136 PHE QD 4.84
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.10, r4= 6.60,
igr1=1559,1560,
igr2=2193,2201,
&end
#
# 59 GLU HG2 62 THR H 4.13
&rst
ixpk= 0, nxpk= 0, iat= 936, 980, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63, &end
#
# 59 GLU HA 59 GLU HG2 3.97
&rst
ixpk= 0, nxpk= 0, iat= 931, 936, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47, &end
#
# 114 GLU H 114 GLU HG3 3.60
&rst
ixpk= 0, nxpk= 0, iat=1828,1836, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10, &end
#
# 59 GLU HA 59 GLU HG3 3.97
&rst
ixpk= 0, nxpk= 0, iat= 931, 937, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47, &end
#
# 58 THR QG2 59 GLU HG3 3.80
&rst
ixpk= 0, nxpk= 0, iat= -1, 937, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
igr1= 921, 922, 923,
&end
#
# 91 GLU H 91 GLU QG 3.12
&rst
ixpk= 0, nxpk= 0, iat=1448, -1, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,
igr2=1455,1456,
&end
#
# 90 ASP HB2 91 GLU QG 3.91
&rst
ixpk= 0, nxpk= 0, iat=1440, -1, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,
igr2=1455,1456,
&end
#
# 90 ASP HB3 91 GLU QG 3.91
&rst
ixpk= 0, nxpk= 0, iat=1441, -1, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,
igr2=1455,1456,
&end
#
# 91 GLU HB3 91 GLU QG 2.54
&rst
ixpk= 0, nxpk= 0, iat=1453, -1, r1= 1.30, r2= 1.80, r3= 2.85, r4= 3.35,
igr2=1455,1456,
&end
#
# 114 GLU H 114 GLU HG2 3.25
&rst
ixpk= 0, nxpk= 0, iat=1828,1835, r1= 1.30, r2= 1.80, r3= 3.25, r4= 3.75, &end
#
# 114 GLU HA 114 GLU HG2 3.00
&rst
ixpk= 0, nxpk= 0, iat=1830,1835, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 113 ARG HD2 114 GLU HG2 4.33
&rst
ixpk= 0, nxpk= 0, iat=1814,1835, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83, &end
#
# 38 VAL HB 39 GLN H 3.17
&rst
ixpk= 0, nxpk= 0, iat= 587, 599, r1= 1.30, r2= 1.80, r3= 3.17, r4= 3.67, &end
#
# 38 VAL H 38 VAL HB 3.91
&rst
ixpk= 0, nxpk= 0, iat= 583, 587, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41, &end
#
# 29 PHE QD 38 VAL HB 5.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 587, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
igr1= 452, 460,
&end
#
# 38 VAL HB 39 GLN HA 5.11
&rst
ixpk= 0, nxpk= 0, iat= 587, 601, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61, &end
#
# 22 GLU HA 38 VAL HB 4.41
&rst
ixpk= 0, nxpk= 0, iat= 325, 587, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, &end
#
# 38 VAL HB 40 VAL H 4.97
&rst
ixpk= 0, nxpk= 0, iat= 587, 616, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 25 LEU H 38 VAL HB 5.07
&rst
ixpk= 0, nxpk= 0, iat= 367, 587, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, &end
#
# 23 GLN HA 38 VAL HB 5.06
&rst
ixpk= 0, nxpk= 0, iat= 340, 587, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56, &end
#
# 97 LYS QB 138 THR HA 4.89
&rst
ixpk= 0, nxpk= 0, iat= -1,2223, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
igr1=1559,1560,
&end
#
# 97 LYS QB 98 VAL QG2 6.12
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.25, r4= 8.75,
igr1=1559,1560,
igr2=1587,1588,1589,
&end
#
# 97 LYS QB 138 THR QG2 4.69
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.32, r4= 6.82,
igr1=1559,1560,
igr2=2227,2228,2229,
&end
#
# 97 LYS QB 98 VAL QG1 6.12
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.25, r4= 8.75,
igr1=1559,1560,
igr2=1583,1584,1585,
&end
#
# 91 GLU HA 91 GLU QG 3.47
&rst
ixpk= 0, nxpk= 0, iat=1450, -1, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,
igr2=1455,1456,
&end
#
# 91 GLU HB2 91 GLU QG 2.54
&rst
ixpk= 0, nxpk= 0, iat=1452, -1, r1= 1.30, r2= 1.80, r3= 2.85, r4= 3.35,
igr2=1455,1456,
&end
#
# 105 GLU HG2 131 PHE QD 4.10
&rst
ixpk= 0, nxpk= 0, iat=1692, -1, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
igr2=2109,2117,
&end
#
# 105 GLU HA 105 GLU HG2 3.75
&rst
ixpk= 0, nxpk= 0, iat=1687,1692, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25, &end
#
# 96 ARG HB3 97 LYS QB 5.74
&rst
ixpk= 0, nxpk= 0, iat=1536, -1, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,
igr2=1559,1560,
&end
#
# 105 GLU H 105 GLU HG3 4.74
&rst
ixpk= 0, nxpk= 0, iat=1685,1693, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24, &end
#
# 105 GLU HG3 106 ASP H 5.40
&rst
ixpk= 0, nxpk= 0, iat=1693,1700, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90, &end
#
# 105 GLU HG3 131 PHE QD 4.10
&rst
ixpk= 0, nxpk= 0, iat=1693, -1, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
igr2=2109,2117,
&end
#
# 105 GLU HA 105 GLU HG3 3.75
&rst
ixpk= 0, nxpk= 0, iat=1687,1693, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25, &end
#
# 42 LYS HB2 50 LYS H 4.98
&rst
ixpk= 0, nxpk= 0, iat= 658, 779, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48, &end
#
# 42 LYS HB2 47 GLY HA2 4.57
&rst
ixpk= 0, nxpk= 0, iat= 658, 745, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07, &end
#
# 165 ALA HA 166 GLU QG 4.43
&rst
ixpk= 0, nxpk= 0, iat=2622, -1, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
igr2=2637,2638,
&end
#
# 166 GLU HA 166 GLU QG 3.48
&rst
ixpk= 0, nxpk= 0, iat=2632, -1, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41,
igr2=2637,2638,
&end
#
# 42 LYS HB3 47 GLY HA2 5.25
&rst
ixpk= 0, nxpk= 0, iat= 659, 745, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75, &end
#
# 165 ALA QB 166 GLU QG 4.90
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1=2624,2625,2626,
igr2=2637,2638,
&end
#
# 110 ASP H 125 VAL HB 6.50
&rst
ixpk= 0, nxpk= 0, iat=1758,2000, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00, &end
#
# 113 ARG HA 125 VAL HB 5.47
&rst
ixpk= 0, nxpk= 0, iat=1806,2000, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97, &end
#
# 125 VAL HB 127 ILE QD1 5.18
&rst
ixpk= 0, nxpk= 0, iat=2000, -1, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
igr2=2045,2046,2047,
&end
#
# 125 VAL HB 137 VAL QG1 6.50
&rst
ixpk= 0, nxpk= 0, iat=2000, -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr2=2211,2212,2213,
&end
#
# 125 VAL HB 137 VAL QG2 6.50
&rst
ixpk= 0, nxpk= 0, iat=2000, -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr2=2215,2216,2217,
&end
#
# 112 LEU H 125 VAL HB 5.88
&rst
ixpk= 0, nxpk= 0, iat=1785,2000, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38, &end
#
# 125 VAL HB 137 VAL HA 5.05
&rst
ixpk= 0, nxpk= 0, iat=2000,2207, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55, &end
#
# 109 GLU HA 125 VAL HB 4.11
&rst
ixpk= 0, nxpk= 0, iat=1745,2000, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 116 PHE QD 125 VAL HB 6.27
&rst
ixpk= 0, nxpk= 0, iat= -1,2000, r1= 1.30, r2= 1.80, r3= 7.04, r4= 7.54,
igr1=1871,1879,
&end
#
# 112 LEU HB2 125 VAL HB 4.50
&rst
ixpk= 0, nxpk= 0, iat=1789,2000, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 125 VAL HB 126 PHE HA 5.23
&rst
ixpk= 0, nxpk= 0, iat=2000,2014, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73, &end
#
# 149 CYS HA 162 ILE HB 4.52
&rst
ixpk= 0, nxpk= 0, iat=2384,2580, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02, &end
#
# 151 GLU QB 162 ILE HB 5.09
&rst
ixpk= 0, nxpk= 0, iat= -1,2580, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21,
igr1=2404,2405,
&end
#
# 29 PHE QD 55 VAL HB 4.15
&rst
ixpk= 0, nxpk= 0, iat= -1, 859, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
igr1= 452, 460,
&end
#
# 54 PHE HA 55 VAL HB 5.10
&rst
ixpk= 0, nxpk= 0, iat= 837, 859, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, &end
#
# 55 VAL H 55 VAL HB 3.87
&rst
ixpk= 0, nxpk= 0, iat= 855, 859, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37, &end
#
# 29 PHE QE 55 VAL HB 4.11
&rst
ixpk= 0, nxpk= 0, iat= -1, 859, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
igr1= 454, 458,
&end
#
# 38 VAL HB 55 VAL HB 4.81
&rst
ixpk= 0, nxpk= 0, iat= 587, 859, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31, &end
#
# 130 PRO HB3 131 PHE HB2 5.29
&rst
ixpk= 0, nxpk= 0, iat=2095,2105, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79, &end
#
# 129 LYS HA 130 PRO HB3 4.60
&rst
ixpk= 0, nxpk= 0, iat=2067,2095, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 143 GLN HG2 144 ILE HG13 4.54
&rst
ixpk= 0, nxpk= 0, iat=2296,2317, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 129 LYS HA 130 PRO HB2 4.54
&rst
ixpk= 0, nxpk= 0, iat=2067,2094, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 130 PRO HB2 131 PHE HB3 5.11
&rst
ixpk= 0, nxpk= 0, iat=2094,2106, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61, &end
#
# 130 PRO HB2 131 PHE H 3.59
&rst
ixpk= 0, nxpk= 0, iat=2094,2101, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09, &end
#
# 130 PRO HB2 131 PHE HB2 4.72
&rst
ixpk= 0, nxpk= 0, iat=2094,2105, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22, &end
#
# 129 LYS H 129 LYS HB2 4.00
&rst
ixpk= 0, nxpk= 0, iat=2065,2069, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 129 LYS HB2 130 PRO HA 4.48
&rst
ixpk= 0, nxpk= 0, iat=2069,2097, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98, &end
#
# 71 HID HB2 73 ILE HG12 4.78
&rst
ixpk= 0, nxpk= 0, iat=1138,1179, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, &end
#
# 71 HID HB3 73 ILE HG12 4.68
&rst
ixpk= 0, nxpk= 0, iat=1139,1179, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18, &end
#
# 39 GLN QG 54 PHE H 5.89
&rst
ixpk= 0, nxpk= 0, iat= -1, 835, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 606, 607,
&end
#
# 143 GLN HG2 144 ILE H 4.20
&rst
ixpk= 0, nxpk= 0, iat=2296,2306, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 39 GLN QB 39 GLN QG 2.48
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,
igr1= 603, 604,
igr2= 606, 607,
&end
#
# 142 ASP H 143 GLN HG2 4.76
&rst
ixpk= 0, nxpk= 0, iat=2277,2296, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26, &end
#
# 143 GLN HG3 144 ILE H 3.88
&rst
ixpk= 0, nxpk= 0, iat=2297,2306, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38, &end
#
# 141 ASP HB3 143 GLN HG3 4.13
&rst
ixpk= 0, nxpk= 0, iat=2270,2297, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63, &end
#
# 129 LYS HB3 130 PRO HA 4.48
&rst
ixpk= 0, nxpk= 0, iat=2070,2097, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98, &end
#
# 39 GLN QG 40 VAL H 4.37
&rst
ixpk= 0, nxpk= 0, iat= -1, 616, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
igr1= 606, 607,
&end
#
# 141 ASP HA 143 GLN HG2 5.03
&rst
ixpk= 0, nxpk= 0, iat=2267,2296, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53, &end
#
# 143 GLN H 143 GLN HG2 3.03
&rst
ixpk= 0, nxpk= 0, iat=2289,2296, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53, &end
#
# 143 GLN HG2 143 GLN HE22 3.53
&rst
ixpk= 0, nxpk= 0, iat=2296,2301, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03, &end
#
# 143 GLN HA 143 GLN HG2 3.85
&rst
ixpk= 0, nxpk= 0, iat=2291,2296, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35, &end
#
# 141 ASP HB3 143 GLN HG2 3.73
&rst
ixpk= 0, nxpk= 0, iat=2270,2296, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23, &end
#
# 143 GLN HG2 144 ILE QD1 5.38
&rst
ixpk= 0, nxpk= 0, iat=2296, -1, r1= 1.30, r2= 1.80, r3= 6.46, r4= 6.96,
igr2=2319,2320,2321,
&end
#
# 67 MET HB3 81 LYS H 4.68
&rst
ixpk= 0, nxpk= 0, iat=1070,1289, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18, &end
#
# 143 GLN H 143 GLN HG3 3.15
&rst
ixpk= 0, nxpk= 0, iat=2289,2297, r1= 1.30, r2= 1.80, r3= 3.15, r4= 3.65, &end
#
# 143 GLN HA 143 GLN HG3 3.98
&rst
ixpk= 0, nxpk= 0, iat=2291,2297, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48, &end
#
# 143 GLN HG3 144 ILE QG2 5.85
&rst
ixpk= 0, nxpk= 0, iat=2297, -1, r1= 1.30, r2= 1.80, r3= 7.03, r4= 7.53,
igr2=2312,2313,2314,
&end
#
# 67 MET HB2 68 SER H 4.36
&rst
ixpk= 0, nxpk= 0, iat=1069,1082, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86, &end
#
# 39 GLN QB 158 ILE HA 4.33
&rst
ixpk= 0, nxpk= 0, iat= -1,2515, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
igr1= 603, 604,
&end
#
# 39 GLN QB 40 VAL H 3.98
&rst
ixpk= 0, nxpk= 0, iat= -1, 616, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
igr1= 603, 604,
&end
#
# 39 GLN QB 54 PHE H 3.87
&rst
ixpk= 0, nxpk= 0, iat= -1, 835, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,
igr1= 603, 604,
&end
#
# 39 GLN QB 54 PHE HA 5.33
&rst
ixpk= 0, nxpk= 0, iat= -1, 837, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
igr1= 603, 604,
&end
#
# 146 GLN QG 147 SER H 4.24
&rst
ixpk= 0, nxpk= 0, iat= -1,2352, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
igr1=2342,2343,
&end
#
# 146 GLN H 146 GLN QG 4.17
&rst
ixpk= 0, nxpk= 0, iat=2335, -1, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
igr2=2342,2343,
&end
#
# 146 GLN QG 146 GLN HE21 3.28
&rst
ixpk= 0, nxpk= 0, iat= -1,2348, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18,
igr1=2342,2343,
&end
#
# 146 GLN HA 146 GLN QG 3.15
&rst
ixpk= 0, nxpk= 0, iat=2337, -1, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04,
igr2=2342,2343,
&end
#
# 94 ARG QD 146 GLN QG 5.69
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.17, r4= 7.67,
igr1=1506,1507,
igr2=2342,2343,
&end
#
# 146 GLN QB 146 GLN QG 2.54
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,
igr1=2339,2340,
igr2=2342,2343,
&end
#
# 94 ARG HA 146 GLN QG 4.43
&rst
ixpk= 0, nxpk= 0, iat=1498, -1, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
igr2=2342,2343,
&end
#
# 174 GLN H 174 GLN QG 3.47
&rst
ixpk= 0, nxpk= 0, iat=2761, -1, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39,
igr2=2768,2769,
&end
#
# 94 ARG HG2 174 GLN QG 4.40
&rst
ixpk= 0, nxpk= 0, iat=1503, -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
igr2=2768,2769,
&end
#
# 67 MET H 67 MET HB2 3.76
&rst
ixpk= 0, nxpk= 0, iat=1065,1069, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26, &end
#
# 63 GLN HA 63 GLN HG2 3.76
&rst
ixpk= 0, nxpk= 0, iat= 996,1001, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26, &end
#
# 75 GLY HA2 76 ARG HB2 5.56
&rst
ixpk= 0, nxpk= 0, iat=1202,1211, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06, &end
#
# 98 VAL H 137 VAL HB 6.17
&rst
ixpk= 0, nxpk= 0, iat=1577,2209, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67, &end
#
# 113 ARG H 137 VAL HB 6.50
&rst
ixpk= 0, nxpk= 0, iat=1804,2209, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00, &end
#
# 137 VAL HB 138 THR H 4.57
&rst
ixpk= 0, nxpk= 0, iat=2209,2221, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07, &end
#
# 116 PHE HZ 137 VAL HB 6.31
&rst
ixpk= 0, nxpk= 0, iat=1875,2209, r1= 1.30, r2= 1.80, r3= 6.31, r4= 6.81, &end
#
# 137 VAL HB 139 PHE QE 6.50
&rst
ixpk= 0, nxpk= 0, iat=2209, -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
igr2=2245,2249,
&end
#
# 11 LEU QD2 63 GLN HG2 6.12
&rst
ixpk= 0, nxpk= 0, iat= -1,1001, r1= 1.30, r2= 1.80, r3= 7.35, r4= 7.85,
igr1= 149, 150, 151,
&end
#
# 35 VAL H 35 VAL HB 3.72
&rst
ixpk= 0, nxpk= 0, iat= 531, 535, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22, &end
#
# 30 SER H 35 VAL HB 5.14
&rst
ixpk= 0, nxpk= 0, iat= 464, 535, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64, &end
#
# 35 VAL HB 37 MET H 5.80
&rst
ixpk= 0, nxpk= 0, iat= 535, 566, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30, &end
#
# 35 VAL HB 57 PHE QD 5.28
&rst
ixpk= 0, nxpk= 0, iat= 535, -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr2= 903, 911,
&end
#
# 30 SER HA 35 VAL HB 4.93
&rst
ixpk= 0, nxpk= 0, iat= 466, 535, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43, &end
#
# 22 GLU HB2 40 VAL HB 4.54
&rst
ixpk= 0, nxpk= 0, iat= 327, 620, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 39 GLN H 40 VAL HB 6.01
&rst
ixpk= 0, nxpk= 0, iat= 599, 620, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51, &end
#
# 76 ARG HB2 77 TRP H 4.29
&rst
ixpk= 0, nxpk= 0, iat=1211,1231, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79, &end
#
# 37 MET QE 56 ARG QB 5.10
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.87, r4= 7.37,
igr1= 577, 578, 579,
igr2= 875, 876,
&end
#
# 137 VAL HB 138 THR HA 5.80
&rst
ixpk= 0, nxpk= 0, iat=2209,2223, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30, &end
#
# 11 LEU QD1 63 GLN HG2 6.12
&rst
ixpk= 0, nxpk= 0, iat= -1,1001, r1= 1.30, r2= 1.80, r3= 7.35, r4= 7.85,
igr1= 145, 146, 147,
&end
#
# 63 GLN HG2 64 VAL QG2 6.50
&rst
ixpk= 0, nxpk= 0, iat=1001, -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr2=1021,1022,1023,
&end
#
# 63 GLN HG2 64 VAL HA 4.58
&rst
ixpk= 0, nxpk= 0, iat=1001,1013, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08, &end
#
# 123 MET HB3 140 ALA HA 5.24
&rst
ixpk= 0, nxpk= 0, iat=1972,2257, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74, &end
#
# 22 GLU HA 40 VAL HB 4.78
&rst
ixpk= 0, nxpk= 0, iat= 325, 620, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, &end
#
# 22 GLU HG3 40 VAL HB 4.44
&rst
ixpk= 0, nxpk= 0, iat= 331, 620, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94, &end
#
# 22 GLU HG2 40 VAL HB 5.09
&rst
ixpk= 0, nxpk= 0, iat= 330, 620, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59, &end
#
# 39 GLN HA 40 VAL HB 5.26
&rst
ixpk= 0, nxpk= 0, iat= 601, 620, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76, &end
#
# 55 VAL QG1 56 ARG QB 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
igr1= 861, 862, 863,
igr2= 875, 876,
&end
#
# 55 VAL QG2 56 ARG QB 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
igr1= 865, 866, 867,
igr2= 875, 876,
&end
#
# 63 GLN HG3 64 VAL HA 5.57
&rst
ixpk= 0, nxpk= 0, iat=1002,1013, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07, &end
#
# 7 LYS QG 89 GLN QG 4.63
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33,
igr1= 84, 85,
igr2=1426,1427,
&end
#
# 89 GLN HB3 89 GLN QG 2.78
&rst
ixpk= 0, nxpk= 0, iat=1424, -1, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,
igr2=1426,1427,
&end
#
# 89 GLN QG 91 GLU H 5.09
&rst
ixpk= 0, nxpk= 0, iat= -1,1448, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21,
igr1=1426,1427,
&end
#
# 88 SER H 89 GLN QG 3.96
&rst
ixpk= 0, nxpk= 0, iat=1408, -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
igr2=1426,1427,
&end
#
# 89 GLN QG 89 GLN HE21 3.44
&rst
ixpk= 0, nxpk= 0, iat= -1,1432, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,
igr1=1426,1427,
&end
#
# 82 LEU HG 87 GLN QG 4.50
&rst
ixpk= 0, nxpk= 0, iat=1318, -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
igr2=1398,1399,
&end
#
# 123 MET HB3 138 THR HB 4.14
&rst
ixpk= 0, nxpk= 0, iat=1972,2225, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64, &end
#
# 7 LYS HB2 89 GLN HE21 4.92
&rst
ixpk= 0, nxpk= 0, iat= 81,1432, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42, &end
#
# 7 LYS HB2 7 LYS QE 3.85
&rst
ixpk= 0, nxpk= 0, iat= 81, -1, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,
igr2= 90, 91,
&end
#
# 7 LYS HB3 8 THR H 4.18
&rst
ixpk= 0, nxpk= 0, iat= 82, 99, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68, &end
#
# 7 LYS HB3 87 GLN HA 4.95
&rst
ixpk= 0, nxpk= 0, iat= 82,1393, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45, &end
#
# 7 LYS HB3 7 LYS QE 3.80
&rst
ixpk= 0, nxpk= 0, iat= 82, -1, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,
igr2= 90, 91,
&end
#
# 7 LYS HB3 7 LYS QG 2.91
&rst
ixpk= 0, nxpk= 0, iat= 82, -1, r1= 1.30, r2= 1.80, r3= 3.27, r4= 3.77,
igr2= 84, 85,
&end
#
# 7 LYS HB3 89 GLN HE21 4.99
&rst
ixpk= 0, nxpk= 0, iat= 82,1432, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49, &end
#
# 123 MET HB2 140 ALA HA 5.31
&rst
ixpk= 0, nxpk= 0, iat=1971,2257, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81, &end
#
# 123 MET H 123 MET HB3 3.79
&rst
ixpk= 0, nxpk= 0, iat=1967,1972, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29, &end
#
# 7 LYS HB2 8 THR HA 5.08
&rst
ixpk= 0, nxpk= 0, iat= 81, 101, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58, &end
#
# 117 SER HA 122 VAL HB 4.62
&rst
ixpk= 0, nxpk= 0, iat=1885,1955, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12, &end
#
# 123 MET HB2 138 THR QG2 3.75
&rst
ixpk= 0, nxpk= 0, iat=1971, -1, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
igr2=2227,2228,2229,
&end
#
# 37 MET HG3 56 ARG QB 3.89
&rst
ixpk= 0, nxpk= 0, iat= 574, -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
igr2= 875, 876,
&end
#
# 123 MET HB2 138 THR HB 4.25
&rst
ixpk= 0, nxpk= 0, iat=1971,2225, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75, &end
#
# 50 LYS HB3 52 PHE QD 4.82
&rst
ixpk= 0, nxpk= 0, iat= 784, -1, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,
igr2= 816, 824,
&end
#
# 37 MET HB2 38 VAL H 4.22
&rst
ixpk= 0, nxpk= 0, iat= 570, 583, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 113 ARG HD2 122 VAL HB 4.72
&rst
ixpk= 0, nxpk= 0, iat=1814,1955, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22, &end
#
# 113 ARG HA 122 VAL HB 4.46
&rst
ixpk= 0, nxpk= 0, iat=1806,1955, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, &end
#
# 122 VAL HB 123 MET H 4.17
&rst
ixpk= 0, nxpk= 0, iat=1955,1967, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67, &end
#
# 23 GLN HG2 23 GLN HE22 3.97
&rst
ixpk= 0, nxpk= 0, iat= 345, 350, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47, &end
#
# 23 GLN HB3 23 GLN HG3 3.00
&rst
ixpk= 0, nxpk= 0, iat= 343, 346, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 107 MET HG3 155 ILE QG2 5.83
&rst
ixpk= 0, nxpk= 0, iat=1720, -1, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,
igr2=2471,2472,2473,
&end
#
# 117 SER H 122 VAL HB 4.82
&rst
ixpk= 0, nxpk= 0, iat=1883,1955, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32, &end
#
# 118 GLN QG 118 GLN HE22 4.04
&rst
ixpk= 0, nxpk= 0, iat= -1,1906, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
igr1=1901,1902,
&end
#
# 69 GLN QG 70 ARG H 4.17
&rst
ixpk= 0, nxpk= 0, iat= -1,1110, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
igr1=1100,1101,
&end
#
# 69 GLN H 69 GLN QG 3.83
&rst
ixpk= 0, nxpk= 0, iat=1093, -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
igr2=1100,1101,
&end
#
# 69 GLN QG 71 HID HE1 4.97
&rst
ixpk= 0, nxpk= 0, iat= -1,1144, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr1=1100,1101,
&end
#
# 69 GLN QG 69 GLN HE22 4.09
&rst
ixpk= 0, nxpk= 0, iat= -1,1105, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
igr1=1100,1101,
&end
#
# 68 SER QB 69 GLN QG 5.21
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.56, r4= 7.06,
igr1=1086,1087,
igr2=1100,1101,
&end
#
# 66 VAL HA 69 GLN QG 5.03
&rst
ixpk= 0, nxpk= 0, iat=1051, -1, r1= 1.30, r2= 1.80, r3= 5.65, r4= 6.15,
igr2=1100,1101,
&end
#
# 69 GLN QB 69 GLN HE22 4.14
&rst
ixpk= 0, nxpk= 0, iat= -1,1105, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
igr1=1097,1098,
&end
#
# 69 GLN QB 70 ARG H 4.57
&rst
ixpk= 0, nxpk= 0, iat= -1,1110, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
igr1=1097,1098,
&end
#
# 64 VAL HA 67 MET HG2 3.92
&rst
ixpk= 0, nxpk= 0, iat=1013,1072, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42, &end
#
# 67 MET HG2 68 SER H 4.33
&rst
ixpk= 0, nxpk= 0, iat=1072,1082, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83, &end
#
# 67 MET HA 67 MET HG2 3.79
&rst
ixpk= 0, nxpk= 0, iat=1067,1072, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29, &end
#
# 67 MET HG3 68 SER H 4.33
&rst
ixpk= 0, nxpk= 0, iat=1073,1082, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83, &end
#
# 67 MET H 67 MET HG3 3.38
&rst
ixpk= 0, nxpk= 0, iat=1065,1073, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88, &end
#
# 67 MET HA 67 MET HG3 3.79
&rst
ixpk= 0, nxpk= 0, iat=1067,1073, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29, &end
#
# 64 VAL HA 67 MET HG3 3.92
&rst
ixpk= 0, nxpk= 0, iat=1013,1073, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42, &end
#
# 44 LEU H 45 LYS HB3 4.88
&rst
ixpk= 0, nxpk= 0, iat= 688, 712, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38, &end
#
# 45 LYS H 45 LYS HB3 2.96
&rst
ixpk= 0, nxpk= 0, iat= 707, 712, r1= 1.30, r2= 1.80, r3= 2.96, r4= 3.46, &end
#
# 44 LEU H 45 LYS HB2 5.72
&rst
ixpk= 0, nxpk= 0, iat= 688, 711, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 12 ILE QG2 83 PRO HB2 5.68
&rst
ixpk= 0, nxpk= 0, iat= -1,1337, r1= 1.30, r2= 1.80, r3= 6.82, r4= 7.32,
igr1= 161, 162, 163,
&end
#
# 12 ILE QG2 83 PRO HB3 5.04
&rst
ixpk= 0, nxpk= 0, iat= -1,1338, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
igr1= 161, 162, 163,
&end
#
# 12 ILE H 83 PRO HB3 4.95
&rst
ixpk= 0, nxpk= 0, iat= 155,1338, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45, &end
#
# 83 PRO HB3 84 ASN H 4.60
&rst
ixpk= 0, nxpk= 0, iat=1338,1344, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 12 ILE HB 83 PRO HB3 5.06
&rst
ixpk= 0, nxpk= 0, iat= 159,1338, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56, &end
#
# 4 MET H 4 MET HB2 3.85
&rst
ixpk= 0, nxpk= 0, iat= 39, 43, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35, &end
#
# 45 LYS HB3 46 THR H 4.28
&rst
ixpk= 0, nxpk= 0, iat= 712, 729, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78, &end
#
# 45 LYS HA 45 LYS HB3 2.78
&rst
ixpk= 0, nxpk= 0, iat= 709, 712, r1= 1.30, r2= 1.80, r3= 2.78, r4= 3.28, &end
#
# 45 LYS HB3 45 LYS QD 2.82
&rst
ixpk= 0, nxpk= 0, iat= 712, -1, r1= 1.30, r2= 1.80, r3= 3.17, r4= 3.67,
igr2= 717, 718,
&end
#
# 45 LYS H 45 LYS HB2 3.68
&rst
ixpk= 0, nxpk= 0, iat= 707, 711, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18, &end
#
# 45 LYS HB2 47 GLY H 5.97
&rst
ixpk= 0, nxpk= 0, iat= 711, 743, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47, &end
#
# 45 LYS HB2 46 THR H 3.86
&rst
ixpk= 0, nxpk= 0, iat= 711, 729, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 45 LYS HA 45 LYS HB2 2.74
&rst
ixpk= 0, nxpk= 0, iat= 709, 711, r1= 1.30, r2= 1.80, r3= 2.74, r4= 3.24, &end
#
# 45 LYS HB2 45 LYS QE 4.16
&rst
ixpk= 0, nxpk= 0, iat= 711, -1, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
igr2= 720, 721,
&end
#
# 45 LYS HB2 45 LYS HG3 2.76
&rst
ixpk= 0, nxpk= 0, iat= 711, 715, r1= 1.30, r2= 1.80, r3= 2.76, r4= 3.26, &end
#
# 86 LYS HB3 86 LYS QE 4.67
&rst
ixpk= 0, nxpk= 0, iat=1374, -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr2=1382,1383,
&end
#
# 83 PRO HG3 86 LYS HB3 5.88
&rst
ixpk= 0, nxpk= 0, iat=1335,1374, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38, &end
#
# 86 LYS HB3 87 GLN QG 6.31
&rst
ixpk= 0, nxpk= 0, iat=1374, -1, r1= 1.30, r2= 1.80, r3= 7.08, r4= 7.58,
igr2=1398,1399,
&end
#
# 13 VAL HB 80 CYS HA 6.02
&rst
ixpk= 0, nxpk= 0, iat= 178,1280, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52, &end
#
# 13 VAL HB 29 PHE HZ 4.89
&rst
ixpk= 0, nxpk= 0, iat= 178, 456, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39, &end
#
# 13 VAL HB 52 PHE HA 6.16
&rst
ixpk= 0, nxpk= 0, iat= 178, 810, r1= 1.30, r2= 1.80, r3= 6.16, r4= 6.66, &end
#
# 13 VAL HB 53 GLY QA 5.18
&rst
ixpk= 0, nxpk= 0, iat= 178, -1, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
igr2= 830, 831,
&end
#
# 13 VAL HB 55 VAL H 5.81
&rst
ixpk= 0, nxpk= 0, iat= 178, 855, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31, &end
#
# 13 VAL HB 52 PHE HB2 6.22
&rst
ixpk= 0, nxpk= 0, iat= 178, 812, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72, &end
#
# 92 PRO HB2 149 CYS HB3 4.26
&rst
ixpk= 0, nxpk= 0, iat=1470,2387, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76, &end
#
# 92 PRO HB2 146 GLN HA 4.68
&rst
ixpk= 0, nxpk= 0, iat=1470,2337, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18, &end
#
# 65 LYS QB 66 VAL H 3.64
&rst
ixpk= 0, nxpk= 0, iat= -1,1049, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59,
igr1=1031,1032,
&end
#
# 65 LYS H 65 LYS QB 2.93
&rst
ixpk= 0, nxpk= 0, iat=1027, -1, r1= 1.30, r2= 1.80, r3= 3.29, r4= 3.79,
igr2=1031,1032,
&end
#
# 65 LYS HA 65 LYS QB 2.80
&rst
ixpk= 0, nxpk= 0, iat=1029, -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
igr2=1031,1032,
&end
#
# 65 LYS QB 66 VAL HA 4.65
&rst
ixpk= 0, nxpk= 0, iat= -1,1051, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
igr1=1031,1032,
&end
#
# 65 LYS QB 65 LYS QE 3.63
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,
igr1=1031,1032,
igr2=1040,1041,
&end
#
# 65 LYS QB 65 LYS HG3 2.73
&rst
ixpk= 0, nxpk= 0, iat= -1,1035, r1= 1.30, r2= 1.80, r3= 3.06, r4= 3.56,
igr1=1031,1032,
&end
#
# 92 PRO HB2 164 ASN HA 5.31
&rst
ixpk= 0, nxpk= 0, iat=1470,2608, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81, &end
#
# 23 GLN HA 26 LYS HB3 3.99
&rst
ixpk= 0, nxpk= 0, iat= 340, 391, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49, &end
#
# 26 LYS HB3 27 GLU H 3.94
&rst
ixpk= 0, nxpk= 0, iat= 391, 408, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44, &end
#
# 26 LYS HB3 26 LYS QD 3.71
&rst
ixpk= 0, nxpk= 0, iat= 391, -1, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
igr2= 396, 397,
&end
#
# 32 PHE QD 65 LYS QB 4.02
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
igr1= 497, 505,
igr2=1031,1032,
&end
#
# 19 LYS HB3 19 LYS QE 4.08
&rst
ixpk= 0, nxpk= 0, iat= 278, -1, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
igr2= 286, 287,
&end
#
# 19 LYS HB3 19 LYS QD 3.36
&rst
ixpk= 0, nxpk= 0, iat= 278, -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
igr2= 283, 284,
&end
#
# 26 LYS HB3 29 PHE HB3 5.96
&rst
ixpk= 0, nxpk= 0, iat= 391, 449, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46, &end
#
# 18 TRP HB2 19 LYS HB3 5.12
&rst
ixpk= 0, nxpk= 0, iat= 253, 278, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, &end
#
# 128 PRO HB3 129 LYS H 4.06
&rst
ixpk= 0, nxpk= 0, iat=2059,2065, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56, &end
#
# 100 VAL HB 116 PHE HZ 5.46
&rst
ixpk= 0, nxpk= 0, iat=1617,1875, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96, &end
#
# 100 VAL HB 103 CYM HB2 5.41
&rst
ixpk= 0, nxpk= 0, iat=1617,1664, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91, &end
#
# 100 VAL HB 135 ALA QB 3.80
&rst
ixpk= 0, nxpk= 0, iat=1617, -1, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
igr2=2179,2180,2181,
&end
#
# 167 PRO HB2 168 LYS HA 5.13
&rst
ixpk= 0, nxpk= 0, iat=2652,2661, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63, &end
#
# 70 ARG HB2 77 TRP HE3 4.29
&rst
ixpk= 0, nxpk= 0, iat=1114,1250, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79, &end
#
# 167 PRO HB3 168 LYS H 4.31
&rst
ixpk= 0, nxpk= 0, iat=2653,2659, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81, &end
#
# 70 ARG H 70 ARG HB3 4.13
&rst
ixpk= 0, nxpk= 0, iat=1110,1115, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63, &end
#
# 3 HIS HB2 4 MET H 4.33
&rst
ixpk= 0, nxpk= 0, iat= 26, 39, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83, &end
#
# 3 HIS HB3 4 MET H 4.33
&rst
ixpk= 0, nxpk= 0, iat= 27, 39, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83, &end
#
# 59 GLU HB2 62 THR QG2 5.89
&rst
ixpk= 0, nxpk= 0, iat= 933, -1, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,
igr2= 986, 987, 988,
&end
#
# 58 THR QG2 59 GLU HB2 5.03
&rst
ixpk= 0, nxpk= 0, iat= -1, 933, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54,
igr1= 921, 922, 923,
&end
#
# 64 VAL H 64 VAL HB 3.97
&rst
ixpk= 0, nxpk= 0, iat=1011,1015, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47, &end
#
# 64 VAL HB 65 LYS HA 5.14
&rst
ixpk= 0, nxpk= 0, iat=1015,1029, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64, &end
#
# 4 MET H 4 MET HG2 3.88
&rst
ixpk= 0, nxpk= 0, iat= 39, 46, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38, &end
#
# 4 MET HA 4 MET HG2 4.24
&rst
ixpk= 0, nxpk= 0, iat= 41, 46, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74, &end
#
# 59 GLU HB2 62 THR HB 5.10
&rst
ixpk= 0, nxpk= 0, iat= 933, 984, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, &end
#
# 16 LEU HA 17 PRO QB 4.88
&rst
ixpk= 0, nxpk= 0, iat= 218, -1, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
igr2= 242, 243,
&end
#
# 59 GLU HB3 61 GLU H 4.97
&rst
ixpk= 0, nxpk= 0, iat= 934, 965, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 4 MET H 4 MET HG3 3.88
&rst
ixpk= 0, nxpk= 0, iat= 39, 47, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38, &end
#
# 4 MET HA 4 MET HG3 4.24
&rst
ixpk= 0, nxpk= 0, iat= 41, 47, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74, &end
#
# 59 GLU HB3 62 THR H 4.92
&rst
ixpk= 0, nxpk= 0, iat= 934, 980, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42, &end
#
# 37 MET HG3 159 SER H 6.00
&rst
ixpk= 0, nxpk= 0, iat= 574,2532, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 37 MET HG3 154 ILE QD1 4.25
&rst
ixpk= 0, nxpk= 0, iat= 574, -1, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
igr2=2459,2460,2461,
&end
#
# 123 MET H 123 MET HG2 3.21
&rst
ixpk= 0, nxpk= 0, iat=1967,1974, r1= 1.30, r2= 1.80, r3= 3.21, r4= 3.71, &end
#
# 123 MET HG2 140 ALA H 3.54
&rst
ixpk= 0, nxpk= 0, iat=1974,2255, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04, &end
#
# 123 MET HG2 139 PHE HA 4.48
&rst
ixpk= 0, nxpk= 0, iat=1974,2237, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98, &end
#
# 123 MET HA 123 MET HG2 3.13
&rst
ixpk= 0, nxpk= 0, iat=1969,1974, r1= 1.30, r2= 1.80, r3= 3.13, r4= 3.63, &end
#
# 123 MET HG2 140 ALA HA 3.03
&rst
ixpk= 0, nxpk= 0, iat=1974,2257, r1= 1.30, r2= 1.80, r3= 3.03, r4= 3.53, &end
#
# 122 VAL HA 123 MET HG2 3.90
&rst
ixpk= 0, nxpk= 0, iat=1953,1974, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40, &end
#
# 123 MET HG2 138 THR QG2 3.41
&rst
ixpk= 0, nxpk= 0, iat=1974, -1, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,
igr2=2227,2228,2229,
&end
#
# 96 ARG QD 123 MET HG2 4.87
&rst
ixpk= 0, nxpk= 0, iat= -1,1974, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,
igr1=1541,1542,
&end
#
# 37 MET HG2 154 ILE HG12 4.18
&rst
ixpk= 0, nxpk= 0, iat= 573,2456, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68, &end
#
# 37 MET HG2 154 ILE QD1 4.57
&rst
ixpk= 0, nxpk= 0, iat= 573, -1, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
igr2=2459,2460,2461,
&end
#
# 123 MET H 123 MET HG3 3.96
&rst
ixpk= 0, nxpk= 0, iat=1967,1975, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46, &end
#
# 123 MET HG3 140 ALA H 4.86
&rst
ixpk= 0, nxpk= 0, iat=1975,2255, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36, &end
#
# 123 MET HG3 140 ALA HA 3.35
&rst
ixpk= 0, nxpk= 0, iat=1975,2257, r1= 1.30, r2= 1.80, r3= 3.35, r4= 3.85, &end
#
# 123 MET HG3 138 THR QG2 3.42
&rst
ixpk= 0, nxpk= 0, iat=1975, -1, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
igr2=2227,2228,2229,
&end
#
# 59 GLU HB2 60 TYR HA 4.47
&rst
ixpk= 0, nxpk= 0, iat= 933, 946, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97, &end
#
# 36 LEU H 37 MET HG3 5.27
&rst
ixpk= 0, nxpk= 0, iat= 547, 574, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77, &end
#
# 37 MET HG2 158 ILE HA 6.26
&rst
ixpk= 0, nxpk= 0, iat= 573,2515, r1= 1.30, r2= 1.80, r3= 6.26, r4= 6.76, &end
#
# 66 VAL HB 80 CYS HB2 5.26
&rst
ixpk= 0, nxpk= 0, iat=1053,1282, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76, &end
#
# 62 THR QG2 66 VAL HB 5.73
&rst
ixpk= 0, nxpk= 0, iat= -1,1053, r1= 1.30, r2= 1.80, r3= 6.88, r4= 7.38,
igr1= 986, 987, 988,
&end
#
# 73 ILE HB 78 CYS QB 4.86
&rst
ixpk= 0, nxpk= 0, iat=1173, -1, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
igr2=1259,1260,
&end
#
# 73 ILE QD1 78 CYS QB 4.87
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.56, r4= 7.06,
igr1=1182,1183,1184,
igr2=1259,1260,
&end
#
# 78 CYS QB 79 ASP H 4.04
&rst
ixpk= 0, nxpk= 0, iat= -1,1266, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
igr1=1259,1260,
&end
#
# 73 ILE QG2 78 CYS QB 5.70
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.68, r4= 8.18,
igr1=1175,1176,1177,
igr2=1259,1260,
&end
#
# 57 PHE HZ 66 VAL HB 5.24
&rst
ixpk= 0, nxpk= 0, iat= 907,1053, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74, &end
#
# 65 LYS H 66 VAL HB 5.93
&rst
ixpk= 0, nxpk= 0, iat=1027,1053, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43, &end
#
# 72 MET HG3 77 TRP HH2 5.99
&rst
ixpk= 0, nxpk= 0, iat=1160,1246, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49, &end
#
# 156 LYS HB3 156 LYS QE 3.41
&rst
ixpk= 0, nxpk= 0, iat=2489, -1, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,
igr2=2497,2498,
&end
#
# 156 LYS HB3 158 ILE H 5.67
&rst
ixpk= 0, nxpk= 0, iat=2489,2513, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17, &end
#
# 156 LYS HB3 157 GLY HA3 5.31
&rst
ixpk= 0, nxpk= 0, iat=2489,2509, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81, &end
#
# 155 ILE QG2 156 LYS HB3 5.76
&rst
ixpk= 0, nxpk= 0, iat= -1,2489, r1= 1.30, r2= 1.80, r3= 6.92, r4= 7.42,
igr1=2471,2472,2473,
&end
#
# 72 MET HG2 74 ASP H 5.17
&rst
ixpk= 0, nxpk= 0, iat=1159,1188, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67, &end
#
# 32 PHE HZ 66 VAL HB 4.70
&rst
ixpk= 0, nxpk= 0, iat= 501,1053, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 72 MET HG2 76 ARG H 4.97
&rst
ixpk= 0, nxpk= 0, iat=1159,1207, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 72 MET HA 72 MET HG2 3.89
&rst
ixpk= 0, nxpk= 0, iat=1154,1159, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39, &end
#
# 72 MET HG2 72 MET QE 3.42
&rst
ixpk= 0, nxpk= 0, iat=1159, -1, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
igr2=1163,1164,1165,
&end
#
# 156 LYS HB2 157 GLY H 4.20
&rst
ixpk= 0, nxpk= 0, iat=2488,2506, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 156 LYS HB2 156 LYS QE 3.30
&rst
ixpk= 0, nxpk= 0, iat=2488, -1, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,
igr2=2497,2498,
&end
#
# 156 LYS HB2 158 ILE QD1 6.06
&rst
ixpk= 0, nxpk= 0, iat=2488, -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
igr2=2526,2527,2528,
&end
#
# 155 ILE QD1 156 LYS HB2 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2488, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr1=2478,2479,2480,
&end
#
# 156 LYS H 156 LYS HB2 3.77
&rst
ixpk= 0, nxpk= 0, iat=2484,2488, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27, &end
#
# 156 LYS HB2 156 LYS HG3 3.01
&rst
ixpk= 0, nxpk= 0, iat=2488,2492, r1= 1.30, r2= 1.80, r3= 3.01, r4= 3.51, &end
#
# 155 ILE QG2 156 LYS HB2 4.55
&rst
ixpk= 0, nxpk= 0, iat= -1,2488, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
igr1=2471,2472,2473,
&end
#
# 72 MET HG3 77 TRP HE3 5.67
&rst
ixpk= 0, nxpk= 0, iat=1160,1250, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17, &end
#
# 72 MET HG3 77 TRP HZ3 5.67
&rst
ixpk= 0, nxpk= 0, iat=1160,1248, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17, &end
#
# 72 MET HA 72 MET HG3 3.47
&rst
ixpk= 0, nxpk= 0, iat=1154,1160, r1= 1.30, r2= 1.80, r3= 3.47, r4= 3.97, &end
#
# 72 MET HG3 78 CYS H 6.25
&rst
ixpk= 0, nxpk= 0, iat=1160,1255, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75, &end
#
# 72 MET HG3 77 TRP HA 5.15
&rst
ixpk= 0, nxpk= 0, iat=1160,1233, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65, &end
#
# 72 MET HG3 73 ILE HA 4.49
&rst
ixpk= 0, nxpk= 0, iat=1160,1171, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99, &end
#
# 72 MET HG3 75 GLY HA2 4.33
&rst
ixpk= 0, nxpk= 0, iat=1160,1202, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83, &end
#
# 156 LYS H 156 LYS HB3 4.07
&rst
ixpk= 0, nxpk= 0, iat=2484,2489, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57, &end
#
# 46 THR QG2 48 HID HB2 4.79
&rst
ixpk= 0, nxpk= 0, iat= -1, 754, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
igr1= 735, 736, 737,
&end
#
# 46 THR QG2 48 HID HB3 4.79
&rst
ixpk= 0, nxpk= 0, iat= -1, 755, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
igr1= 735, 736, 737,
&end
#
# 173 ARG HB2 174 GLN H 4.73
&rst
ixpk= 0, nxpk= 0, iat=2741,2761, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, &end
#
# 173 ARG HB2 173 ARG QD 3.34
&rst
ixpk= 0, nxpk= 0, iat=2741, -1, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,
igr2=2747,2748,
&end
#
# 173 ARG HB2 173 ARG QG 2.55
&rst
ixpk= 0, nxpk= 0, iat=2741, -1, r1= 1.30, r2= 1.80, r3= 2.86, r4= 3.36,
igr2=2744,2745,
&end
#
# 173 ARG HB3 174 GLN H 4.73
&rst
ixpk= 0, nxpk= 0, iat=2742,2761, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, &end
#
# 173 ARG HB3 173 ARG QD 3.34
&rst
ixpk= 0, nxpk= 0, iat=2742, -1, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,
igr2=2747,2748,
&end
#
# 148 LEU HA 151 GLU QB 4.93
&rst
ixpk= 0, nxpk= 0, iat=2365, -1, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03,
igr2=2404,2405,
&end
#
# 96 ARG HB3 138 THR QG2 3.97
&rst
ixpk= 0, nxpk= 0, iat=1536, -1, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
igr2=2227,2228,2229,
&end
#
# 174 GLN H 174 GLN HB2 3.89
&rst
ixpk= 0, nxpk= 0, iat=2761,2765, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39, &end
#
# 174 GLN HB2 174 GLN QG 2.55
&rst
ixpk= 0, nxpk= 0, iat=2765, -1, r1= 1.30, r2= 1.80, r3= 2.86, r4= 3.36,
igr2=2768,2769,
&end
#
# 174 GLN HB3 174 GLN QG 2.55
&rst
ixpk= 0, nxpk= 0, iat=2766, -1, r1= 1.30, r2= 1.80, r3= 2.86, r4= 3.36,
igr2=2768,2769,
&end
#
# 96 ARG HB2 96 ARG QD 3.74
&rst
ixpk= 0, nxpk= 0, iat=1535, -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
igr2=1541,1542,
&end
#
# 76 ARG HA 77 TRP HB3 5.88
&rst
ixpk= 0, nxpk= 0, iat=1209,1236, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38, &end
#
# 96 ARG HB3 139 PHE HA 5.40
&rst
ixpk= 0, nxpk= 0, iat=1536,2237, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90, &end
#
# 34 GLU HB2 35 VAL H 4.37
&rst
ixpk= 0, nxpk= 0, iat= 520, 531, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87, &end
#
# 34 GLU H 34 GLU HB2 3.93
&rst
ixpk= 0, nxpk= 0, iat= 516, 520, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43, &end
#
# 34 GLU HB2 34 GLU HG3 2.94
&rst
ixpk= 0, nxpk= 0, iat= 520, 524, r1= 1.30, r2= 1.80, r3= 2.94, r4= 3.44, &end
#
# 33 GLY H 34 GLU HB3 6.35
&rst
ixpk= 0, nxpk= 0, iat= 509, 521, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85, &end
#
# 110 ASP HA 113 ARG QB 3.69
&rst
ixpk= 0, nxpk= 0, iat=1760, -1, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,
igr2=1808,1809,
&end
#
# 113 ARG QB 114 GLU HA 5.32
&rst
ixpk= 0, nxpk= 0, iat= -1,1830, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr1=1808,1809,
&end
#
# 18 TRP H 18 TRP HB2 3.83
&rst
ixpk= 0, nxpk= 0, iat= 249, 253, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33, &end
#
# 91 GLU HA 91 GLU HB2 3.00
&rst
ixpk= 0, nxpk= 0, iat=1450,1452, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 91 GLU HB2 92 PRO HD2 3.51
&rst
ixpk= 0, nxpk= 0, iat=1452,1464, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01, &end
#
# 50 LYS HD2 52 PHE QE 4.12
&rst
ixpk= 0, nxpk= 0, iat= 789, -1, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
igr2= 818, 822,
&end
#
# 50 LYS HD2 52 PHE QD 4.56
&rst
ixpk= 0, nxpk= 0, iat= 789, -1, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
igr2= 816, 824,
&end
#
# 50 LYS HD3 52 PHE QE 4.12
&rst
ixpk= 0, nxpk= 0, iat= 790, -1, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
igr2= 818, 822,
&end
#
# 50 LYS HD3 52 PHE QD 4.56
&rst
ixpk= 0, nxpk= 0, iat= 790, -1, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
igr2= 816, 824,
&end
#
# 169 HIS QB 170 ASN HA 4.95
&rst
ixpk= 0, nxpk= 0, iat= -1,2700, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
igr1=2685,2686,
&end
#
# 89 GLN HB2 89 GLN HE22 4.64
&rst
ixpk= 0, nxpk= 0, iat=1423,1431, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14, &end
#
# 91 GLU HB2 92 PRO HD3 4.43
&rst
ixpk= 0, nxpk= 0, iat=1452,1465, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93, &end
#
# 89 GLN HB3 89 GLN HE22 4.64
&rst
ixpk= 0, nxpk= 0, iat=1424,1431, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14, &end
#
# 91 GLU HA 91 GLU HB3 3.00
&rst
ixpk= 0, nxpk= 0, iat=1450,1453, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 91 GLU HB3 92 PRO HD2 3.51
&rst
ixpk= 0, nxpk= 0, iat=1453,1464, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01, &end
#
# 91 GLU HB3 92 PRO HD3 4.43
&rst
ixpk= 0, nxpk= 0, iat=1453,1465, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93, &end
#
# 156 LYS H 156 LYS QD 4.87
&rst
ixpk= 0, nxpk= 0, iat=2484, -1, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,
igr2=2494,2495,
&end
#
# 156 LYS HA 156 LYS QD 4.29
&rst
ixpk= 0, nxpk= 0, iat=2486, -1, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
igr2=2494,2495,
&end
#
# 156 LYS HB3 156 LYS QD 3.26
&rst
ixpk= 0, nxpk= 0, iat=2489, -1, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,
igr2=2494,2495,
&end
#
# 155 ILE QG2 156 LYS QD 4.88
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.58, r4= 7.08,
igr1=2471,2472,2473,
igr2=2494,2495,
&end
#
# 168 LYS QD 169 HIS QB 5.39
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1=2669,2670,
igr2=2685,2686,
&end
#
# 67 MET H 80 CYS HB2 4.77
&rst
ixpk= 0, nxpk= 0, iat=1065,1282, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27, &end
#
# 66 VAL QG1 80 CYS HB2 5.77
&rst
ixpk= 0, nxpk= 0, iat= -1,1282, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
igr1=1055,1056,1057,
&end
#
# 80 CYS HB2 81 LYS H 4.31
&rst
ixpk= 0, nxpk= 0, iat=1282,1289, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81, &end
#
# 71 HID HD2 80 CYS HB2 4.36
&rst
ixpk= 0, nxpk= 0, iat=1148,1282, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86, &end
#
# 29 PHE QE 80 CYS HB2 4.52
&rst
ixpk= 0, nxpk= 0, iat= -1,1282, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
igr1= 454, 458,
&end
#
# 79 ASP HA 80 CYS HB2 5.00
&rst
ixpk= 0, nxpk= 0, iat=1268,1282, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 80 CYS HB2 81 LYS HA 4.73
&rst
ixpk= 0, nxpk= 0, iat=1282,1291, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, &end
#
# 67 MET HA 80 CYS HB2 3.85
&rst
ixpk= 0, nxpk= 0, iat=1067,1282, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35, &end
#
# 67 MET HB2 80 CYS HB2 6.08
&rst
ixpk= 0, nxpk= 0, iat=1069,1282, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58, &end
#
# 67 MET QE 80 CYS HB2 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1282, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr1=1076,1077,1078,
&end
#
# 71 HID HD2 80 CYS HB3 5.21
&rst
ixpk= 0, nxpk= 0, iat=1148,1283, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71, &end
#
# 80 CYS HB3 81 LYS HA 4.78
&rst
ixpk= 0, nxpk= 0, iat=1283,1291, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, &end
#
# 80 CYS H 80 CYS HB3 3.87
&rst
ixpk= 0, nxpk= 0, iat=1278,1283, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37, &end
#
# 29 PHE QE 80 CYS HB3 5.01
&rst
ixpk= 0, nxpk= 0, iat= -1,1283, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
igr1= 454, 458,
&end
#
# 29 PHE HZ 80 CYS HB3 5.37
&rst
ixpk= 0, nxpk= 0, iat= 456,1283, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87, &end
#
# 13 VAL HA 80 CYS HB3 4.97
&rst
ixpk= 0, nxpk= 0, iat= 176,1283, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 67 MET HB2 80 CYS HB3 6.50
&rst
ixpk= 0, nxpk= 0, iat=1069,1283, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00, &end
#
# 67 MET QE 80 CYS HB3 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1283, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr1=1076,1077,1078,
&end
#
# 11 LEU HB2 80 CYS HB3 5.18
&rst
ixpk= 0, nxpk= 0, iat= 140,1283, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68, &end
#
# 13 VAL HB 80 CYS HB3 6.50
&rst
ixpk= 0, nxpk= 0, iat= 178,1283, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00, &end
#
# 11 LEU QD1 80 CYS HB3 5.51
&rst
ixpk= 0, nxpk= 0, iat= -1,1283, r1= 1.30, r2= 1.80, r3= 6.62, r4= 7.12,
igr1= 145, 146, 147,
&end
#
# 11 LEU QD2 80 CYS HB3 5.51
&rst
ixpk= 0, nxpk= 0, iat= -1,1283, r1= 1.30, r2= 1.80, r3= 6.62, r4= 7.12,
igr1= 149, 150, 151,
&end
#
# 108 THR QG2 111 GLU HB3 4.88
&rst
ixpk= 0, nxpk= 0, iat= -1,1775, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
igr1=1735,1736,1737,
&end
#
# 114 GLU H 114 GLU HB3 3.61
&rst
ixpk= 0, nxpk= 0, iat=1828,1833, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11, &end
#
# 114 GLU HB3 115 PHE H 3.74
&rst
ixpk= 0, nxpk= 0, iat=1833,1843, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24, &end
#
# 7 LYS QG 87 GLN HB2 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1395, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr1= 84, 85,
&end
#
# 87 GLN HB2 87 GLN QG 2.64
&rst
ixpk= 0, nxpk= 0, iat=1395, -1, r1= 1.30, r2= 1.80, r3= 2.96, r4= 3.46,
igr2=1398,1399,
&end
#
# 89 GLN HB2 89 GLN QG 2.78
&rst
ixpk= 0, nxpk= 0, iat=1423, -1, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,
igr2=1426,1427,
&end
#
# 113 ARG H 114 GLU HB2 4.97
&rst
ixpk= 0, nxpk= 0, iat=1804,1832, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 114 GLU HB2 115 PHE HB3 4.77
&rst
ixpk= 0, nxpk= 0, iat=1832,1848, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27, &end
#
# 107 MET HA 111 GLU HB2 4.29
&rst
ixpk= 0, nxpk= 0, iat=1714,1774, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79, &end
#
# 13 VAL HA 80 CYS HB2 5.36
&rst
ixpk= 0, nxpk= 0, iat= 176,1282, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86, &end
#
# 111 GLU HB3 112 LEU H 4.13
&rst
ixpk= 0, nxpk= 0, iat=1775,1785, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63, &end
#
# 27 GLU HA 27 GLU HB3 2.90
&rst
ixpk= 0, nxpk= 0, iat= 410, 413, r1= 1.30, r2= 1.80, r3= 2.90, r4= 3.40, &end
#
# 27 GLU HB3 28 TYR H 4.10
&rst
ixpk= 0, nxpk= 0, iat= 413, 423, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60, &end
#
# 63 GLN HE21 87 GLN HB2 5.12
&rst
ixpk= 0, nxpk= 0, iat=1007,1395, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, &end
#
# 27 GLU HB2 27 GLU HG3 2.63
&rst
ixpk= 0, nxpk= 0, iat= 412, 416, r1= 1.30, r2= 1.80, r3= 2.63, r4= 3.13, &end
#
# 32 PHE QD 65 LYS HD2 4.74
&rst
ixpk= 0, nxpk= 0, iat= -1,1037, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
igr1= 497, 505,
&end
#
# 62 THR HA 65 LYS HD2 3.80
&rst
ixpk= 0, nxpk= 0, iat= 982,1037, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30, &end
#
# 65 LYS HD2 65 LYS QE 2.57
&rst
ixpk= 0, nxpk= 0, iat=1037, -1, r1= 1.30, r2= 1.80, r3= 2.88, r4= 3.38,
igr2=1040,1041,
&end
#
# 65 LYS QB 65 LYS HD2 2.92
&rst
ixpk= 0, nxpk= 0, iat= -1,1037, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78,
igr1=1031,1032,
&end
#
# 64 VAL QG2 65 LYS HD2 5.66
&rst
ixpk= 0, nxpk= 0, iat= -1,1037, r1= 1.30, r2= 1.80, r3= 6.80, r4= 7.30,
igr1=1021,1022,1023,
&end
#
# 94 ARG HB2 94 ARG QD 3.67
&rst
ixpk= 0, nxpk= 0, iat=1500, -1, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
igr2=1506,1507,
&end
#
# 111 GLU HB2 113 ARG H 5.97
&rst
ixpk= 0, nxpk= 0, iat=1774,1804, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47, &end
#
# 62 THR HA 65 LYS HD3 3.80
&rst
ixpk= 0, nxpk= 0, iat= 982,1038, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30, &end
#
# 65 LYS HD3 65 LYS QE 2.57
&rst
ixpk= 0, nxpk= 0, iat=1038, -1, r1= 1.30, r2= 1.80, r3= 2.88, r4= 3.38,
igr2=1040,1041,
&end
#
# 65 LYS QB 65 LYS HD3 2.92
&rst
ixpk= 0, nxpk= 0, iat= -1,1038, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78,
igr1=1031,1032,
&end
#
# 64 VAL QG2 65 LYS HD3 5.66
&rst
ixpk= 0, nxpk= 0, iat= -1,1038, r1= 1.30, r2= 1.80, r3= 6.80, r4= 7.30,
igr1=1021,1022,1023,
&end
#
# 94 ARG HB3 95 SER H 4.37
&rst
ixpk= 0, nxpk= 0, iat=1501,1520, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87, &end
#
# 93 LEU HA 94 ARG HB3 4.42
&rst
ixpk= 0, nxpk= 0, iat=1479,1501, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92, &end
#
# 12 ILE H 81 LYS QD 5.22
&rst
ixpk= 0, nxpk= 0, iat= 155, -1, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
igr2=1299,1300,
&end
#
# 81 LYS H 81 LYS QD 4.35
&rst
ixpk= 0, nxpk= 0, iat=1289, -1, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
igr2=1299,1300,
&end
#
# 81 LYS QD 82 LEU H 3.87
&rst
ixpk= 0, nxpk= 0, iat= -1,1311, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,
igr1=1299,1300,
&end
#
# 81 LYS HG2 81 LYS QD 2.87
&rst
ixpk= 0, nxpk= 0, iat=1296, -1, r1= 1.30, r2= 1.80, r3= 3.22, r4= 3.72,
igr2=1299,1300,
&end
#
# 12 ILE QD1 81 LYS QD 4.27
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
igr1= 168, 169, 170,
igr2=1299,1300,
&end
#
# 14 LEU QD1 81 LYS QD 5.21
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.02, r4= 7.52,
igr1= 199, 200, 201,
igr2=1299,1300,
&end
#
# 14 LEU QD2 81 LYS QD 5.21
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.02, r4= 7.52,
igr1= 203, 204, 205,
igr2=1299,1300,
&end
#
# 26 LYS H 27 GLU HB2 5.09
&rst
ixpk= 0, nxpk= 0, iat= 386, 412, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59, &end
#
# 109 GLU HB3 112 LEU H 5.66
&rst
ixpk= 0, nxpk= 0, iat=1748,1785, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16, &end
#
# 26 LYS QD 26 LYS QE 2.40
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.02, r4= 3.52,
igr1= 396, 397,
igr2= 399, 400,
&end
#
# 26 LYS HG2 26 LYS QD 2.40
&rst
ixpk= 0, nxpk= 0, iat= 393, -1, r1= 1.30, r2= 1.80, r3= 2.69, r4= 3.19,
igr2= 396, 397,
&end
#
# 26 LYS QD 27 GLU H 3.24
&rst
ixpk= 0, nxpk= 0, iat= -1, 408, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
igr1= 396, 397,
&end
#
# 26 LYS HA 26 LYS QD 3.83
&rst
ixpk= 0, nxpk= 0, iat= 388, -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
igr2= 396, 397,
&end
#
# 26 LYS HB2 26 LYS QD 2.94
&rst
ixpk= 0, nxpk= 0, iat= 390, -1, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80,
igr2= 396, 397,
&end
#
# 26 LYS HG3 26 LYS QD 2.40
&rst
ixpk= 0, nxpk= 0, iat= 394, -1, r1= 1.30, r2= 1.80, r3= 2.69, r4= 3.19,
igr2= 396, 397,
&end
#
# 23 GLN HE21 26 LYS QD 3.93
&rst
ixpk= 0, nxpk= 0, iat= 351, -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
igr2= 396, 397,
&end
#
# 118 GLN QB 119 TYR QD 4.39
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03,
igr1=1898,1899,
igr2=1919,1928,
&end
#
# 118 GLN QB 118 GLN HE21 3.94
&rst
ixpk= 0, nxpk= 0, iat= -1,1907, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
igr1=1898,1899,
&end
#
# 118 GLN HA 118 GLN QB 2.90
&rst
ixpk= 0, nxpk= 0, iat=1896, -1, r1= 1.30, r2= 1.80, r3= 3.26, r4= 3.76,
igr2=1898,1899,
&end
#
# 118 GLN QB 118 GLN HE22 4.08
&rst
ixpk= 0, nxpk= 0, iat= -1,1906, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
igr1=1898,1899,
&end
#
# 63 GLN HB3 64 VAL H 5.14
&rst
ixpk= 0, nxpk= 0, iat= 999,1011, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64, &end
#
# 63 GLN H 63 GLN HB2 4.17
&rst
ixpk= 0, nxpk= 0, iat= 994, 998, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67, &end
#
# 17 PRO QG 18 TRP HA 4.94
&rst
ixpk= 0, nxpk= 0, iat= -1, 251, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
igr1= 239, 240,
&end
#
# 61 GLU HB2 64 VAL QG1 5.32
&rst
ixpk= 0, nxpk= 0, iat= 969, -1, r1= 1.30, r2= 1.80, r3= 6.39, r4= 6.89,
igr2=1017,1018,1019,
&end
#
# 61 GLU HB3 62 THR HB 5.23
&rst
ixpk= 0, nxpk= 0, iat= 970, 984, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73, &end
#
# 61 GLU HB3 65 LYS QE 4.85
&rst
ixpk= 0, nxpk= 0, iat= 970, -1, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
igr2=1040,1041,
&end
#
# 109 GLU HB3 113 ARG H 5.23
&rst
ixpk= 0, nxpk= 0, iat=1748,1804, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73, &end
#
# 72 MET HB3 77 TRP HE3 5.30
&rst
ixpk= 0, nxpk= 0, iat=1157,1250, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80, &end
#
# 105 GLU HB2 106 ASP H 4.66
&rst
ixpk= 0, nxpk= 0, iat=1689,1700, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16, &end
#
# 104 THR HA 105 GLU HB2 4.87
&rst
ixpk= 0, nxpk= 0, iat=1673,1689, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37, &end
#
# 168 LYS H 168 LYS QD 4.52
&rst
ixpk= 0, nxpk= 0, iat=2659, -1, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
igr2=2669,2670,
&end
#
# 168 LYS HA 168 LYS QD 4.44
&rst
ixpk= 0, nxpk= 0, iat=2661, -1, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
igr2=2669,2670,
&end
#
# 108 THR HB 109 GLU HB2 5.96
&rst
ixpk= 0, nxpk= 0, iat=1733,1747, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46, &end
#
# 60 TYR HB3 61 GLU HB2 4.59
&rst
ixpk= 0, nxpk= 0, iat= 949, 969, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 61 GLU HB2 62 THR H 4.11
&rst
ixpk= 0, nxpk= 0, iat= 969, 980, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 61 GLU HA 61 GLU HB2 2.90
&rst
ixpk= 0, nxpk= 0, iat= 967, 969, r1= 1.30, r2= 1.80, r3= 2.90, r4= 3.40, &end
#
# 17 PRO QG 18 TRP HB2 5.56
&rst
ixpk= 0, nxpk= 0, iat= -1, 253, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
igr1= 239, 240,
&end
#
# 17 PRO QG 20 THR QG2 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
igr1= 239, 240,
igr2= 301, 302, 303,
&end
#
# 60 TYR H 61 GLU HB2 4.70
&rst
ixpk= 0, nxpk= 0, iat= 944, 969, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 61 GLU H 61 GLU HB3 2.93
&rst
ixpk= 0, nxpk= 0, iat= 965, 970, r1= 1.30, r2= 1.80, r3= 2.93, r4= 3.43, &end
#
# 60 TYR H 61 GLU HB3 4.65
&rst
ixpk= 0, nxpk= 0, iat= 944, 970, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15, &end
#
# 61 GLU HB3 64 VAL QG1 5.87
&rst
ixpk= 0, nxpk= 0, iat= 970, -1, r1= 1.30, r2= 1.80, r3= 7.05, r4= 7.55,
igr2=1017,1018,1019,
&end
#
# 22 GLU HB3 23 GLN HA 4.22
&rst
ixpk= 0, nxpk= 0, iat= 328, 340, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 10 ASP H 86 LYS QD 5.17
&rst
ixpk= 0, nxpk= 0, iat= 124, -1, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
igr2=1379,1380,
&end
#
# 85 SER H 86 LYS QD 5.42
&rst
ixpk= 0, nxpk= 0, iat=1358, -1, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
igr2=1379,1380,
&end
#
# 72 MET H 72 MET HB3 3.59
&rst
ixpk= 0, nxpk= 0, iat=1152,1157, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09, &end
#
# 72 MET HB3 73 ILE H 4.98
&rst
ixpk= 0, nxpk= 0, iat=1157,1169, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48, &end
#
# 72 MET HB3 72 MET QE 3.87
&rst
ixpk= 0, nxpk= 0, iat=1157, -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
igr2=1163,1164,1165,
&end
#
# 71 HID HA 72 MET HB3 4.95
&rst
ixpk= 0, nxpk= 0, iat=1136,1157, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45, &end
#
# 105 GLU HB2 131 PHE QD 4.38
&rst
ixpk= 0, nxpk= 0, iat=1689, -1, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
igr2=2109,2117,
&end
#
# 104 THR HB 105 GLU HB2 4.96
&rst
ixpk= 0, nxpk= 0, iat=1675,1689, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46, &end
#
# 104 THR HB 105 GLU HB3 4.70
&rst
ixpk= 0, nxpk= 0, iat=1675,1690, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 104 THR HA 105 GLU HB3 5.30
&rst
ixpk= 0, nxpk= 0, iat=1673,1690, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80, &end
#
# 72 MET HB2 73 ILE H 4.88
&rst
ixpk= 0, nxpk= 0, iat=1156,1169, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38, &end
#
# 72 MET HB2 77 TRP HZ3 4.68
&rst
ixpk= 0, nxpk= 0, iat=1156,1248, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18, &end
#
# 71 HID HA 72 MET HB2 5.08
&rst
ixpk= 0, nxpk= 0, iat=1136,1156, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58, &end
#
# 72 MET HB2 77 TRP HA 5.43
&rst
ixpk= 0, nxpk= 0, iat=1156,1233, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93, &end
#
# 21 THR HA 22 GLU HB2 4.85
&rst
ixpk= 0, nxpk= 0, iat= 311, 327, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35, &end
#
# 141 ASP HB2 143 GLN QB 5.59
&rst
ixpk= 0, nxpk= 0, iat=2269, -1, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
igr2=2293,2294,
&end
#
# 94 ARG QD 146 GLN QB 5.84
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.36, r4= 7.86,
igr1=1506,1507,
igr2=2339,2340,
&end
#
# 61 GLU HB3 65 LYS H 6.37
&rst
ixpk= 0, nxpk= 0, iat= 970,1027, r1= 1.30, r2= 1.80, r3= 6.37, r4= 6.87, &end
#
# 61 GLU HB3 64 VAL QG2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 970, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2=1021,1022,1023,
&end
#
# 22 GLU HB3 24 ASP H 4.97
&rst
ixpk= 0, nxpk= 0, iat= 328, 355, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 96 ARG HG2 142 ASP HA 4.88
&rst
ixpk= 0, nxpk= 0, iat=1538,2279, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38, &end
#
# 86 LYS H 86 LYS QD 4.75
&rst
ixpk= 0, nxpk= 0, iat=1369, -1, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
igr2=1379,1380,
&end
#
# 86 LYS HA 86 LYS QD 3.43
&rst
ixpk= 0, nxpk= 0, iat=1371, -1, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35,
igr2=1379,1380,
&end
#
# 86 LYS QD 86 LYS QE 2.67
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
igr1=1379,1380,
igr2=1382,1383,
&end
#
# 45 LYS H 45 LYS QD 4.14
&rst
ixpk= 0, nxpk= 0, iat= 707, -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
igr2= 717, 718,
&end
#
# 45 LYS QD 46 THR H 4.60
&rst
ixpk= 0, nxpk= 0, iat= -1, 729, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
igr1= 717, 718,
&end
#
# 45 LYS QD 45 LYS QE 2.40
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.02, r4= 3.52,
igr1= 717, 718,
igr2= 720, 721,
&end
#
# 45 LYS HB2 45 LYS QD 2.45
&rst
ixpk= 0, nxpk= 0, iat= 711, -1, r1= 1.30, r2= 1.80, r3= 2.75, r4= 3.25,
igr2= 717, 718,
&end
#
# 45 LYS HG3 45 LYS QD 2.40
&rst
ixpk= 0, nxpk= 0, iat= 715, -1, r1= 1.30, r2= 1.80, r3= 2.69, r4= 3.19,
igr2= 717, 718,
&end
#
# 72 MET HB3 77 TRP HZ3 5.08
&rst
ixpk= 0, nxpk= 0, iat=1157,1248, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58, &end
#
# 96 ARG HG3 142 ASP HA 4.88
&rst
ixpk= 0, nxpk= 0, iat=1539,2279, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38, &end
#
# 103 CYM HB2 133 ALA HA 4.96
&rst
ixpk= 0, nxpk= 0, iat=1664,2147, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46, &end
#
# 22 GLU HB2 23 GLN H 3.82
&rst
ixpk= 0, nxpk= 0, iat= 327, 338, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32, &end
#
# 142 ASP H 143 GLN QB 4.52
&rst
ixpk= 0, nxpk= 0, iat=2277, -1, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
igr2=2293,2294,
&end
#
# 95 SER HA 146 GLN QB 5.18
&rst
ixpk= 0, nxpk= 0, iat=1522, -1, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
igr2=2339,2340,
&end
#
# 143 GLN HA 146 GLN QB 3.48
&rst
ixpk= 0, nxpk= 0, iat=2291, -1, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41,
igr2=2339,2340,
&end
#
# 143 GLN QB 143 GLN HG2 2.68
&rst
ixpk= 0, nxpk= 0, iat= -1,2296, r1= 1.30, r2= 1.80, r3= 3.01, r4= 3.51,
igr1=2293,2294,
&end
#
# 22 GLU HB2 22 GLU HG3 2.81
&rst
ixpk= 0, nxpk= 0, iat= 327, 331, r1= 1.30, r2= 1.80, r3= 2.81, r4= 3.31, &end
#
# 143 GLN QB 144 ILE HG13 4.60
&rst
ixpk= 0, nxpk= 0, iat= -1,2317, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
igr1=2293,2294,
&end
#
# 146 GLN QB 147 SER HA 4.70
&rst
ixpk= 0, nxpk= 0, iat= -1,2354, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
igr1=2339,2340,
&end
#
# 146 GLN HA 146 GLN QB 2.97
&rst
ixpk= 0, nxpk= 0, iat=2337, -1, r1= 1.30, r2= 1.80, r3= 3.33, r4= 3.83,
igr2=2339,2340,
&end
#
# 145 ALA H 146 GLN QB 4.92
&rst
ixpk= 0, nxpk= 0, iat=2325, -1, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
igr2=2339,2340,
&end
#
# 102 ARG H 103 CYM HB3 5.43
&rst
ixpk= 0, nxpk= 0, iat=1636,1665, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93, &end
#
# 103 CYM HB3 134 PHE HA 4.90
&rst
ixpk= 0, nxpk= 0, iat=1665,2157, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40, &end
#
# 22 GLU HB3 40 VAL H 4.58
&rst
ixpk= 0, nxpk= 0, iat= 328, 616, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08, &end
#
# 22 GLU HB3 25 LEU H 5.62
&rst
ixpk= 0, nxpk= 0, iat= 328, 367, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12, &end
#
# 22 GLU HB3 23 GLN H 3.93
&rst
ixpk= 0, nxpk= 0, iat= 328, 338, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43, &end
#
# 12 ILE QG2 12 ILE HG13 5.20
&rst
ixpk= 0, nxpk= 0, iat= -1, 166, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
igr1= 161, 162, 163,
&end
#
# 103 CYM HB2 134 PHE HA 4.94
&rst
ixpk= 0, nxpk= 0, iat=1664,2157, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44, &end
#
# 103 CYM HB2 104 THR H 4.20
&rst
ixpk= 0, nxpk= 0, iat=1664,1671, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 103 CYM HB2 133 ALA QB 5.31
&rst
ixpk= 0, nxpk= 0, iat=1664, -1, r1= 1.30, r2= 1.80, r3= 6.38, r4= 6.88,
igr2=2149,2150,2151,
&end
#
# 103 CYM HB2 158 ILE QG2 6.50
&rst
ixpk= 0, nxpk= 0, iat=1664, -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr2=2519,2520,2521,
&end
#
# 103 CYM HB3 104 THR H 4.48
&rst
ixpk= 0, nxpk= 0, iat=1665,1671, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98, &end
#
# 109 GLU HA 112 LEU HG 5.33
&rst
ixpk= 0, nxpk= 0, iat=1745,1792, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83, &end
#
# 112 LEU HG 116 PHE QD 5.15
&rst
ixpk= 0, nxpk= 0, iat=1792, -1, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr2=1871,1879,
&end
#
# 112 LEU HG 116 PHE HZ 4.87
&rst
ixpk= 0, nxpk= 0, iat=1792,1875, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37, &end
#
# 12 ILE QG2 12 ILE HG12 5.20
&rst
ixpk= 0, nxpk= 0, iat= -1, 165, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
igr1= 161, 162, 163,
&end
#
# 12 ILE HG12 13 VAL H 5.17
&rst
ixpk= 0, nxpk= 0, iat= 165, 174, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67, &end
#
# 12 ILE HG13 13 VAL H 5.17
&rst
ixpk= 0, nxpk= 0, iat= 166, 174, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67, &end
#
# 103 CYM HB3 133 ALA HA 5.10
&rst
ixpk= 0, nxpk= 0, iat=1665,2147, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, &end
#
# 112 LEU HG 116 PHE QE 4.21
&rst
ixpk= 0, nxpk= 0, iat=1792, -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
igr2=1873,1877,
&end
#
# 108 THR HA 112 LEU HG 6.31
&rst
ixpk= 0, nxpk= 0, iat=1731,1792, r1= 1.30, r2= 1.80, r3= 6.31, r4= 6.81, &end
#
# 112 LEU HG 155 ILE QG2 6.50
&rst
ixpk= 0, nxpk= 0, iat=1792, -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr2=2471,2472,2473,
&end
#
# 112 LEU HA 112 LEU HG 3.75
&rst
ixpk= 0, nxpk= 0, iat=1787,1792, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25, &end
#
# 112 LEU HG 113 ARG H 4.84
&rst
ixpk= 0, nxpk= 0, iat=1792,1804, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34, &end
#
# 76 ARG HA 76 ARG HG2 4.12
&rst
ixpk= 0, nxpk= 0, iat=1209,1214, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62, &end
#
# 17 PRO QG 76 ARG HG2 4.79
&rst
ixpk= 0, nxpk= 0, iat= -1,1214, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
igr1= 239, 240,
&end
#
# 120 GLY H 144 ILE HG12 5.49
&rst
ixpk= 0, nxpk= 0, iat=1932,2316, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99, &end
#
# 76 ARG HA 76 ARG HG3 4.12
&rst
ixpk= 0, nxpk= 0, iat=1209,1215, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62, &end
#
# 143 GLN H 144 ILE HG12 5.60
&rst
ixpk= 0, nxpk= 0, iat=2289,2316, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10, &end
#
# 144 ILE H 144 ILE HG12 3.63
&rst
ixpk= 0, nxpk= 0, iat=2306,2316, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13, &end
#
# 144 ILE HA 144 ILE HG12 3.74
&rst
ixpk= 0, nxpk= 0, iat=2308,2316, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24, &end
#
# 143 GLN HG3 144 ILE HG12 5.07
&rst
ixpk= 0, nxpk= 0, iat=2297,2316, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, &end
#
# 17 PRO QG 76 ARG HG3 4.79
&rst
ixpk= 0, nxpk= 0, iat= -1,1215, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
igr1= 239, 240,
&end
#
# 144 ILE HA 144 ILE HG13 3.84
&rst
ixpk= 0, nxpk= 0, iat=2308,2317, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34, &end
#
# 144 ILE QG2 144 ILE HG13 4.35
&rst
ixpk= 0, nxpk= 0, iat= -1,2317, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
igr1=2312,2313,2314,
&end
#
# 126 PHE QD 127 ILE HG13 5.38
&rst
ixpk= 0, nxpk= 0, iat= -1,2043, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54,
igr1=2020,2028,
&end
#
# 83 PRO HG3 86 LYS QE 5.26
&rst
ixpk= 0, nxpk= 0, iat=1335, -1, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
igr2=1382,1383,
&end
#
# 12 ILE QG2 83 PRO HG3 5.24
&rst
ixpk= 0, nxpk= 0, iat= -1,1335, r1= 1.30, r2= 1.80, r3= 6.29, r4= 6.79,
igr1= 161, 162, 163,
&end
#
# 82 LEU HA 83 PRO HG3 4.61
&rst
ixpk= 0, nxpk= 0, iat=1313,1335, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 83 PRO HG3 86 LYS QD 4.60
&rst
ixpk= 0, nxpk= 0, iat=1335, -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
igr2=1379,1380,
&end
#
# 12 ILE QD1 83 PRO HG3 4.96
&rst
ixpk= 0, nxpk= 0, iat= -1,1335, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
igr1= 168, 169, 170,
&end
#
# 54 PHE QD 83 PRO HG3 4.71
&rst
ixpk= 0, nxpk= 0, iat= -1,1335, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79,
igr1= 843, 851,
&end
#
# 82 LEU HA 83 PRO HG2 4.67
&rst
ixpk= 0, nxpk= 0, iat=1313,1334, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, &end
#
# 12 ILE QG2 83 PRO HG2 5.31
&rst
ixpk= 0, nxpk= 0, iat= -1,1334, r1= 1.30, r2= 1.80, r3= 6.38, r4= 6.88,
igr1= 161, 162, 163,
&end
#
# 109 GLU HA 127 ILE HG13 4.67
&rst
ixpk= 0, nxpk= 0, iat=1745,2043, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, &end
#
# 141 ASP HB2 144 ILE HG13 3.98
&rst
ixpk= 0, nxpk= 0, iat=2269,2317, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48, &end
#
# 109 GLU HG2 127 ILE HG12 4.55
&rst
ixpk= 0, nxpk= 0, iat=1750,2042, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05, &end
#
# 127 ILE HG12 135 ALA HA 4.86
&rst
ixpk= 0, nxpk= 0, iat=2042,2177, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36, &end
#
# 83 PRO HG3 85 SER H 4.96
&rst
ixpk= 0, nxpk= 0, iat=1335,1358, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46, &end
#
# 23 GLN HB2 23 GLN HE22 5.20
&rst
ixpk= 0, nxpk= 0, iat= 342, 350, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70, &end
#
# 23 GLN HB2 26 LYS QD 5.92
&rst
ixpk= 0, nxpk= 0, iat= 342, -1, r1= 1.30, r2= 1.80, r3= 6.64, r4= 7.14,
igr2= 396, 397,
&end
#
# 23 GLN HB2 25 LEU H 5.77
&rst
ixpk= 0, nxpk= 0, iat= 342, 367, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27, &end
#
# 23 GLN HA 23 GLN HB2 2.92
&rst
ixpk= 0, nxpk= 0, iat= 340, 342, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42, &end
#
# 23 GLN HB3 25 LEU H 5.26
&rst
ixpk= 0, nxpk= 0, iat= 343, 367, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76, &end
#
# 23 GLN HB3 23 GLN HG2 3.00
&rst
ixpk= 0, nxpk= 0, iat= 343, 345, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 21 THR HB 23 GLN HB3 5.93
&rst
ixpk= 0, nxpk= 0, iat= 313, 343, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43, &end
#
# 23 GLN HB3 24 ASP HA 4.52
&rst
ixpk= 0, nxpk= 0, iat= 343, 357, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02, &end
#
# 160 VAL HA 162 ILE QG1 6.50
&rst
ixpk= 0, nxpk= 0, iat=2545, -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
igr2=2586,2587,
&end
#
# 22 GLU HA 23 GLN HB2 6.10
&rst
ixpk= 0, nxpk= 0, iat= 325, 342, r1= 1.30, r2= 1.80, r3= 6.10, r4= 6.60, &end
#
# 92 PRO HG2 146 GLN HA 4.74
&rst
ixpk= 0, nxpk= 0, iat=1467,2337, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24, &end
#
# 92 PRO HG2 93 LEU H 4.36
&rst
ixpk= 0, nxpk= 0, iat=1467,1477, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86, &end
#
# 92 PRO HG2 146 GLN QG 3.87
&rst
ixpk= 0, nxpk= 0, iat=1467, -1, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,
igr2=2342,2343,
&end
#
# 92 PRO HG2 93 LEU QD1 6.09
&rst
ixpk= 0, nxpk= 0, iat=1467, -1, r1= 1.30, r2= 1.80, r3= 7.31, r4= 7.81,
igr2=1486,1487,1488,
&end
#
# 113 ARG HG2 122 VAL HA 5.14
&rst
ixpk= 0, nxpk= 0, iat=1811,1953, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64, &end
#
# 113 ARG HG2 122 VAL QG1 4.45
&rst
ixpk= 0, nxpk= 0, iat=1811, -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr2=1957,1958,1959,
&end
#
# 113 ARG HG2 122 VAL H 4.42
&rst
ixpk= 0, nxpk= 0, iat=1811,1951, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92, &end
#
# 113 ARG H 113 ARG HG2 4.67
&rst
ixpk= 0, nxpk= 0, iat=1804,1811, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, &end
#
# 113 ARG HG2 114 GLU H 4.55
&rst
ixpk= 0, nxpk= 0, iat=1811,1828, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05, &end
#
# 113 ARG HA 113 ARG HG2 3.56
&rst
ixpk= 0, nxpk= 0, iat=1806,1811, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06, &end
#
# 113 ARG HG2 122 VAL QG2 4.45
&rst
ixpk= 0, nxpk= 0, iat=1811, -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr2=1961,1962,1963,
&end
#
# 113 ARG HG2 115 PHE H 5.94
&rst
ixpk= 0, nxpk= 0, iat=1811,1843, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44, &end
#
# 113 ARG HG3 122 VAL H 5.85
&rst
ixpk= 0, nxpk= 0, iat=1812,1951, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35, &end
#
# 113 ARG HG3 123 MET H 6.35
&rst
ixpk= 0, nxpk= 0, iat=1812,1967, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85, &end
#
# 113 ARG H 113 ARG HG3 4.81
&rst
ixpk= 0, nxpk= 0, iat=1804,1812, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31, &end
#
# 113 ARG HA 113 ARG HG3 3.83
&rst
ixpk= 0, nxpk= 0, iat=1806,1812, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33, &end
#
# 113 ARG HG3 122 VAL HB 4.75
&rst
ixpk= 0, nxpk= 0, iat=1812,1955, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, &end
#
# 113 ARG HG3 114 GLU H 5.28
&rst
ixpk= 0, nxpk= 0, iat=1812,1828, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 154 ILE HG13 155 ILE H 5.01
&rst
ixpk= 0, nxpk= 0, iat=2457,2465, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51, &end
#
# 148 LEU HA 162 ILE QG1 6.50
&rst
ixpk= 0, nxpk= 0, iat=2365, -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
igr2=2586,2587,
&end
#
# 154 ILE HG13 159 SER HA 5.11
&rst
ixpk= 0, nxpk= 0, iat=2457,2534, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61, &end
#
# 116 PHE QE 162 ILE QG1 6.24
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
igr1=1873,1877,
igr2=2586,2587,
&end
#
# 154 ILE H 154 ILE HG12 4.40
&rst
ixpk= 0, nxpk= 0, iat=2446,2456, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 92 PRO HG2 93 LEU HA 5.01
&rst
ixpk= 0, nxpk= 0, iat=1467,1479, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51, &end
#
# 92 PRO HG3 93 LEU H 4.77
&rst
ixpk= 0, nxpk= 0, iat=1468,1477, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27, &end
#
# 92 PRO HG3 149 CYS HB2 5.02
&rst
ixpk= 0, nxpk= 0, iat=1468,2386, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52, &end
#
# 56 ARG QG 154 ILE QD1 5.03
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.78, r4= 7.28,
igr1= 878, 879,
igr2=2459,2460,2461,
&end
#
# 82 LEU HA 82 LEU HG 3.74
&rst
ixpk= 0, nxpk= 0, iat=1313,1318, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24, &end
#
# 82 LEU HG 83 PRO HD2 4.75
&rst
ixpk= 0, nxpk= 0, iat=1318,1331, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, &end
#
# 67 MET QE 82 LEU HG 3.55
&rst
ixpk= 0, nxpk= 0, iat= -1,1318, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,
igr1=1076,1077,1078,
&end
#
# 82 LEU HG 87 GLN HB2 3.67
&rst
ixpk= 0, nxpk= 0, iat=1318,1395, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17, &end
#
# 94 ARG HG2 146 GLN QG 5.95
&rst
ixpk= 0, nxpk= 0, iat=1503, -1, r1= 1.30, r2= 1.80, r3= 6.68, r4= 7.18,
igr2=2342,2343,
&end
#
# 94 ARG H 94 ARG HG3 4.21
&rst
ixpk= 0, nxpk= 0, iat=1496,1504, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71, &end
#
# 94 ARG HG3 95 SER H 5.20
&rst
ixpk= 0, nxpk= 0, iat=1504,1520, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70, &end
#
# 36 LEU H 56 ARG QG 5.14
&rst
ixpk= 0, nxpk= 0, iat= 547, -1, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,
igr2= 878, 879,
&end
#
# 93 LEU HG 94 ARG H 4.89
&rst
ixpk= 0, nxpk= 0, iat=1484,1496, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39, &end
#
# 153 LEU H 153 LEU HG 4.63
&rst
ixpk= 0, nxpk= 0, iat=2427,2434, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, &end
#
# 153 LEU HG 154 ILE H 4.70
&rst
ixpk= 0, nxpk= 0, iat=2434,2446, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 153 LEU HG 162 ILE H 5.24
&rst
ixpk= 0, nxpk= 0, iat=2434,2576, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74, &end
#
# 153 LEU QD1 162 ILE H 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2576, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr1=2436,2437,2438,
&end
#
# 153 LEU HA 153 LEU HG 3.81
&rst
ixpk= 0, nxpk= 0, iat=2429,2434, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31, &end
#
# 153 LEU HA 153 LEU QD1 5.40
&rst
ixpk= 0, nxpk= 0, iat=2429, -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
igr2=2436,2437,2438,
&end
#
# 148 LEU HA 153 LEU QD1 6.16
&rst
ixpk= 0, nxpk= 0, iat=2365, -1, r1= 1.30, r2= 1.80, r3= 7.40, r4= 7.90,
igr2=2436,2437,2438,
&end
#
# 153 LEU HB2 153 LEU QD1 4.65
&rst
ixpk= 0, nxpk= 0, iat=2431, -1, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr2=2436,2437,2438,
&end
#
# 153 LEU HB3 153 LEU QD1 4.65
&rst
ixpk= 0, nxpk= 0, iat=2432, -1, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr2=2436,2437,2438,
&end
#
# 152 ASP HA 153 LEU HG 5.92
&rst
ixpk= 0, nxpk= 0, iat=2417,2434, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42, &end
#
# 92 PRO HA 93 LEU HG 4.11
&rst
ixpk= 0, nxpk= 0, iat=1473,1484, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 93 LEU HA 93 LEU HG 3.88
&rst
ixpk= 0, nxpk= 0, iat=1479,1484, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38, &end
#
# 92 PRO HB2 93 LEU HG 4.31
&rst
ixpk= 0, nxpk= 0, iat=1470,1484, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81, &end
#
# 173 ARG HA 173 ARG QG 3.02
&rst
ixpk= 0, nxpk= 0, iat=2739, -1, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89,
igr2=2744,2745,
&end
#
# 173 ARG HB3 173 ARG QG 2.55
&rst
ixpk= 0, nxpk= 0, iat=2742, -1, r1= 1.30, r2= 1.80, r3= 2.86, r4= 3.36,
igr2=2744,2745,
&end
#
# 173 ARG QG 174 GLN H 4.98
&rst
ixpk= 0, nxpk= 0, iat= -1,2761, r1= 1.30, r2= 1.80, r3= 5.59, r4= 6.09,
igr1=2744,2745,
&end
#
# 148 LEU QD2 153 LEU QD1 5.08
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.33, r4= 7.83,
igr1=2376,2377,2378,
igr2=2436,2437,2438,
&end
#
# 92 PRO HB3 149 CYS HB2 4.91
&rst
ixpk= 0, nxpk= 0, iat=1471,2386, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41, &end
#
# 92 PRO HB2 149 CYS HB2 4.26
&rst
ixpk= 0, nxpk= 0, iat=1470,2386, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76, &end
#
# 146 GLN HA 149 CYS HB2 4.73
&rst
ixpk= 0, nxpk= 0, iat=2337,2386, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, &end
#
# 92 PRO HB3 149 CYS HB3 4.91
&rst
ixpk= 0, nxpk= 0, iat=1471,2387, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41, &end
#
# 146 GLN HA 149 CYS HB3 4.73
&rst
ixpk= 0, nxpk= 0, iat=2337,2387, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, &end
#
# 92 PRO HG3 149 CYS HB3 5.02
&rst
ixpk= 0, nxpk= 0, iat=1468,2387, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52, &end
#
# 149 CYS HB3 162 ILE QG2 5.85
&rst
ixpk= 0, nxpk= 0, iat=2387, -1, r1= 1.30, r2= 1.80, r3= 7.03, r4= 7.53,
igr2=2582,2583,2584,
&end
#
# 43 ASP H 50 LYS HG2 4.94
&rst
ixpk= 0, nxpk= 0, iat= 676, 786, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44, &end
#
# 50 LYS HG2 52 PHE QE 5.05
&rst
ixpk= 0, nxpk= 0, iat= 786, -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
igr2= 818, 822,
&end
#
# 42 LYS HA 50 LYS HG2 4.83
&rst
ixpk= 0, nxpk= 0, iat= 656, 786, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33, &end
#
# 50 LYS HA 50 LYS HG2 3.94
&rst
ixpk= 0, nxpk= 0, iat= 781, 786, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44, &end
#
# 11 LEU QD1 80 CYS HA 6.30
&rst
ixpk= 0, nxpk= 0, iat= -1,1280, r1= 1.30, r2= 1.80, r3= 7.57, r4= 8.07,
igr1= 145, 146, 147,
&end
#
# 11 LEU QD1 67 MET HA 6.10
&rst
ixpk= 0, nxpk= 0, iat= -1,1067, r1= 1.30, r2= 1.80, r3= 7.33, r4= 7.83,
igr1= 145, 146, 147,
&end
#
# 11 LEU QD1 63 GLN HA 5.44
&rst
ixpk= 0, nxpk= 0, iat= -1, 996, r1= 1.30, r2= 1.80, r3= 6.53, r4= 7.03,
igr1= 145, 146, 147,
&end
#
# 11 LEU QD1 57 PHE QE 5.87
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.91, r4= 8.41,
igr1= 145, 146, 147,
igr2= 905, 909,
&end
#
# 11 LEU HA 11 LEU QD1 5.12
&rst
ixpk= 0, nxpk= 0, iat= 138, -1, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
igr2= 145, 146, 147,
&end
#
# 11 LEU QD1 67 MET HG2 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1072, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr1= 145, 146, 147,
&end
#
# 11 LEU QD1 63 GLN HG3 4.68
&rst
ixpk= 0, nxpk= 0, iat= -1,1002, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
igr1= 145, 146, 147,
&end
#
# 11 LEU HG 63 GLN HA 5.82
&rst
ixpk= 0, nxpk= 0, iat= 143, 996, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32, &end
#
# 11 LEU HG 57 PHE QE 5.03
&rst
ixpk= 0, nxpk= 0, iat= 143, -1, r1= 1.30, r2= 1.80, r3= 5.65, r4= 6.15,
igr2= 905, 909,
&end
#
# 25 LEU HG 26 LYS H 5.24
&rst
ixpk= 0, nxpk= 0, iat= 374, 386, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74, &end
#
# 36 LEU HG 57 PHE HA 5.15
&rst
ixpk= 0, nxpk= 0, iat= 554, 897, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65, &end
#
# 36 LEU HA 36 LEU HG 3.65
&rst
ixpk= 0, nxpk= 0, iat= 549, 554, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15, &end
#
# 36 LEU HG 58 THR HA 3.87
&rst
ixpk= 0, nxpk= 0, iat= 554, 917, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37, &end
#
# 34 GLU HG2 36 LEU HG 5.82
&rst
ixpk= 0, nxpk= 0, iat= 523, 554, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32, &end
#
# 36 LEU HB2 36 LEU HG 2.98
&rst
ixpk= 0, nxpk= 0, iat= 551, 554, r1= 1.30, r2= 1.80, r3= 2.98, r4= 3.48, &end
#
# 36 LEU HG 58 THR H 4.42
&rst
ixpk= 0, nxpk= 0, iat= 554, 915, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92, &end
#
# 36 LEU HG 37 MET H 5.17
&rst
ixpk= 0, nxpk= 0, iat= 554, 566, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67, &end
#
# 42 LYS HA 50 LYS HG3 4.83
&rst
ixpk= 0, nxpk= 0, iat= 656, 787, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33, &end
#
# 43 ASP H 50 LYS HG3 4.94
&rst
ixpk= 0, nxpk= 0, iat= 676, 787, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44, &end
#
# 50 LYS HA 50 LYS HG3 3.94
&rst
ixpk= 0, nxpk= 0, iat= 781, 787, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44, &end
#
# 25 LEU HB2 25 LEU QD1 4.30
&rst
ixpk= 0, nxpk= 0, iat= 371, -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
igr2= 376, 377, 378,
&end
#
# 16 LEU QQD 40 VAL H 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 616, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
igr1= 225, 226, 227, 229, 230, 231,
&end
#
# 16 LEU QQD 52 PHE QD 5.58
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.44, r4= 8.94,
igr1= 225, 226, 227, 229, 230, 231,
igr2= 816, 824,
&end
#
# 16 LEU QQD 17 PRO QG 5.69
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.61, r4= 9.11,
igr1= 225, 226, 227, 229, 230, 231,
igr2= 239, 240,
&end
#
# 16 LEU QQD 41 LYS H 6.27
&rst
ixpk= 0, nxpk= 0, iat= -1, 632, r1= 1.30, r2= 1.80, r3= 8.45, r4= 8.95,
igr1= 225, 226, 227, 229, 230, 231,
&end
#
# 16 LEU QQD 52 PHE HA 4.66
&rst
ixpk= 0, nxpk= 0, iat= -1, 810, r1= 1.30, r2= 1.80, r3= 6.28, r4= 6.78,
igr1= 225, 226, 227, 229, 230, 231,
&end
#
# 13 VAL HA 16 LEU QQD 6.19
&rst
ixpk= 0, nxpk= 0, iat= 176, -1, r1= 1.30, r2= 1.80, r3= 8.34, r4= 8.84,
igr2= 225, 226, 227, 229, 230, 231,
&end
#
# 16 LEU QQD 21 THR HA 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 311, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
igr1= 225, 226, 227, 229, 230, 231,
&end
#
# 16 LEU QQD 40 VAL HA 4.65
&rst
ixpk= 0, nxpk= 0, iat= -1, 618, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
igr1= 225, 226, 227, 229, 230, 231,
&end
#
# 16 LEU HA 16 LEU QQD 4.67
&rst
ixpk= 0, nxpk= 0, iat= 218, -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
igr2= 225, 226, 227, 229, 230, 231,
&end
#
# 13 VAL HB 16 LEU QQD 5.34
&rst
ixpk= 0, nxpk= 0, iat= 178, -1, r1= 1.30, r2= 1.80, r3= 7.20, r4= 7.70,
igr2= 225, 226, 227, 229, 230, 231,
&end
#
# 16 LEU HB2 16 LEU QQD 4.36
&rst
ixpk= 0, nxpk= 0, iat= 220, -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
igr2= 225, 226, 227, 229, 230, 231,
&end
#
# 16 LEU HB3 16 LEU QQD 4.36
&rst
ixpk= 0, nxpk= 0, iat= 221, -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
igr2= 225, 226, 227, 229, 230, 231,
&end
#
# 13 VAL QG1 16 LEU QQD 4.74
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.67, r4= 8.17,
igr1= 180, 181, 182,
igr2= 225, 226, 227, 229, 230, 231,
&end
#
# 16 LEU QQD 73 ILE QG2 6.34
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3=10.26, r4=10.76,
igr1= 225, 226, 227, 229, 230, 231,
igr2=1175,1176,1177,
&end
#
# 16 LEU QQD 73 ILE QD1 5.97
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.66, r4=10.16,
igr1= 225, 226, 227, 229, 230, 231,
igr2=1182,1183,1184,
&end
#
# 16 LEU QQD 20 THR HB 5.96
&rst
ixpk= 0, nxpk= 0, iat= -1, 299, r1= 1.30, r2= 1.80, r3= 8.03, r4= 8.53,
igr1= 225, 226, 227, 229, 230, 231,
&end
#
# 10 ASP H 11 LEU HG 6.43
&rst
ixpk= 0, nxpk= 0, iat= 124, 143, r1= 1.30, r2= 1.80, r3= 6.43, r4= 6.93, &end
#
# 11 LEU HG 55 VAL H 6.50
&rst
ixpk= 0, nxpk= 0, iat= 143, 855, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00, &end
#
# 25 LEU HG 29 PHE QD 4.93
&rst
ixpk= 0, nxpk= 0, iat= 374, -1, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03,
igr2= 452, 460,
&end
#
# 25 LEU HG 73 ILE QD1 5.07
&rst
ixpk= 0, nxpk= 0, iat= 374, -1, r1= 1.30, r2= 1.80, r3= 6.09, r4= 6.59,
igr2=1182,1183,1184,
&end
#
# 25 LEU H 25 LEU HG 4.24
&rst
ixpk= 0, nxpk= 0, iat= 367, 374, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74, &end
#
# 25 LEU HG 29 PHE QE 4.04
&rst
ixpk= 0, nxpk= 0, iat= 374, -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
igr2= 454, 458,
&end
#
# 25 LEU HA 25 LEU HG 3.91
&rst
ixpk= 0, nxpk= 0, iat= 369, 374, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41, &end
#
# 22 GLU HA 25 LEU HG 5.51
&rst
ixpk= 0, nxpk= 0, iat= 325, 374, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01, &end
#
# 20 THR QG2 25 LEU HG 4.06
&rst
ixpk= 0, nxpk= 0, iat= -1, 374, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
igr1= 301, 302, 303,
&end
#
# 25 LEU HG 73 ILE QG2 5.69
&rst
ixpk= 0, nxpk= 0, iat= 374, -1, r1= 1.30, r2= 1.80, r3= 6.83, r4= 7.33,
igr2=1175,1176,1177,
&end
#
# 127 ILE HA 128 PRO HG2 5.12
&rst
ixpk= 0, nxpk= 0, iat=2034,2055, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, &end
#
# 25 LEU H 25 LEU QD1 5.04
&rst
ixpk= 0, nxpk= 0, iat= 367, -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
igr2= 376, 377, 378,
&end
#
# 22 GLU HA 25 LEU QD1 5.39
&rst
ixpk= 0, nxpk= 0, iat= 325, -1, r1= 1.30, r2= 1.80, r3= 6.47, r4= 6.97,
igr2= 376, 377, 378,
&end
#
# 13 VAL HA 14 LEU QD1 5.52
&rst
ixpk= 0, nxpk= 0, iat= 176, -1, r1= 1.30, r2= 1.80, r3= 6.63, r4= 7.13,
igr2= 199, 200, 201,
&end
#
# 14 LEU HG 52 PHE QD 5.93
&rst
ixpk= 0, nxpk= 0, iat= 197, -1, r1= 1.30, r2= 1.80, r3= 6.66, r4= 7.16,
igr2= 816, 824,
&end
#
# 116 PHE QD 148 LEU QD1 5.20
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.01, r4= 7.51,
igr1=1871,1879,
igr2=2372,2373,2374,
&end
#
# 139 PHE QE 148 LEU QD1 4.36
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
igr1=2245,2249,
igr2=2372,2373,2374,
&end
#
# 116 PHE QD 148 LEU HG 5.72
&rst
ixpk= 0, nxpk= 0, iat= -1,2370, r1= 1.30, r2= 1.80, r3= 6.42, r4= 6.92,
igr1=1871,1879,
&end
#
# 148 LEU H 148 LEU HG 4.59
&rst
ixpk= 0, nxpk= 0, iat=2363,2370, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 127 ILE HA 128 PRO HG3 5.12
&rst
ixpk= 0, nxpk= 0, iat=2034,2056, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, &end
#
# 12 ILE H 14 LEU QD1 6.08
&rst
ixpk= 0, nxpk= 0, iat= 155, -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
igr2= 199, 200, 201,
&end
#
# 13 VAL H 14 LEU QD1 5.66
&rst
ixpk= 0, nxpk= 0, iat= 174, -1, r1= 1.30, r2= 1.80, r3= 6.80, r4= 7.30,
igr2= 199, 200, 201,
&end
#
# 145 ALA HA 148 LEU QD1 5.20
&rst
ixpk= 0, nxpk= 0, iat=2327, -1, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
igr2=2372,2373,2374,
&end
#
# 148 LEU HB2 148 LEU QD1 4.22
&rst
ixpk= 0, nxpk= 0, iat=2367, -1, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
igr2=2372,2373,2374,
&end
#
# 148 LEU QD1 153 LEU QD1 5.08
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.33, r4= 7.83,
igr1=2372,2373,2374,
igr2=2436,2437,2438,
&end
#
# 144 ILE QG2 148 LEU HG 6.28
&rst
ixpk= 0, nxpk= 0, iat= -1,2370, r1= 1.30, r2= 1.80, r3= 7.54, r4= 8.04,
igr1=2312,2313,2314,
&end
#
# 158 ILE QG2 158 ILE HG12 4.31
&rst
ixpk= 0, nxpk= 0, iat= -1,2523, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
igr1=2519,2520,2521,
&end
#
# 158 ILE H 158 ILE HG12 3.88
&rst
ixpk= 0, nxpk= 0, iat=2513,2523, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38, &end
#
# 154 ILE QG2 158 ILE HG12 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,2523, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=2452,2453,2454,
&end
#
# 158 ILE H 158 ILE HG13 4.11
&rst
ixpk= 0, nxpk= 0, iat=2513,2524, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 107 MET QE 158 ILE HG12 3.62
&rst
ixpk= 0, nxpk= 0, iat= -1,2523, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,
igr1=1723,1724,1725,
&end
#
# 73 ILE HG13 74 ASP H 5.49
&rst
ixpk= 0, nxpk= 0, iat=1180,1188, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99, &end
#
# 23 GLN HE22 26 LYS HG2 5.52
&rst
ixpk= 0, nxpk= 0, iat= 350, 393, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02, &end
#
# 23 GLN HA 26 LYS HG2 3.82
&rst
ixpk= 0, nxpk= 0, iat= 340, 393, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32, &end
#
# 25 LEU H 26 LYS HG3 5.13
&rst
ixpk= 0, nxpk= 0, iat= 367, 394, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63, &end
#
# 26 LYS H 26 LYS HG3 3.57
&rst
ixpk= 0, nxpk= 0, iat= 386, 394, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07, &end
#
# 26 LYS HG3 27 GLU H 3.73
&rst
ixpk= 0, nxpk= 0, iat= 394, 408, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23, &end
#
# 26 LYS HG3 28 TYR H 5.17
&rst
ixpk= 0, nxpk= 0, iat= 394, 423, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67, &end
#
# 26 LYS HA 26 LYS HG3 3.80
&rst
ixpk= 0, nxpk= 0, iat= 388, 394, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30, &end
#
# 26 LYS HG3 26 LYS QE 3.44
&rst
ixpk= 0, nxpk= 0, iat= 394, -1, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,
igr2= 399, 400,
&end
#
# 82 LEU QD1 87 GLN HE21 5.16
&rst
ixpk= 0, nxpk= 0, iat= -1,1404, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
igr1=1320,1321,1322,
&end
#
# 82 LEU QD1 87 GLN HE22 5.16
&rst
ixpk= 0, nxpk= 0, iat= -1,1403, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
igr1=1320,1321,1322,
&end
#
# 82 LEU HA 82 LEU QD1 4.08
&rst
ixpk= 0, nxpk= 0, iat=1313, -1, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,
igr2=1320,1321,1322,
&end
#
# 82 LEU QD1 83 PRO HD3 4.75
&rst
ixpk= 0, nxpk= 0, iat= -1,1332, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr1=1320,1321,1322,
&end
#
# 9 SER HB2 82 LEU QD1 5.68
&rst
ixpk= 0, nxpk= 0, iat= 117, -1, r1= 1.30, r2= 1.80, r3= 6.82, r4= 7.32,
igr2=1320,1321,1322,
&end
#
# 82 LEU QD1 83 PRO HD2 4.64
&rst
ixpk= 0, nxpk= 0, iat= -1,1331, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
igr1=1320,1321,1322,
&end
#
# 9 SER HB3 82 LEU QD1 5.68
&rst
ixpk= 0, nxpk= 0, iat= 118, -1, r1= 1.30, r2= 1.80, r3= 6.82, r4= 7.32,
igr2=1320,1321,1322,
&end
#
# 82 LEU HB3 82 LEU QD1 4.21
&rst
ixpk= 0, nxpk= 0, iat=1316, -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
igr2=1320,1321,1322,
&end
#
# 73 ILE HA 73 ILE HG12 3.67
&rst
ixpk= 0, nxpk= 0, iat=1171,1179, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17, &end
#
# 112 LEU QD1 113 ARG H 5.78
&rst
ixpk= 0, nxpk= 0, iat= -1,1804, r1= 1.30, r2= 1.80, r3= 6.94, r4= 7.44,
igr1=1794,1795,1796,
&end
#
# 108 THR H 112 LEU QD1 5.92
&rst
ixpk= 0, nxpk= 0, iat=1729, -1, r1= 1.30, r2= 1.80, r3= 7.11, r4= 7.61,
igr2=1794,1795,1796,
&end
#
# 112 LEU QD1 116 PHE QE 4.45
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr1=1794,1795,1796,
igr2=1873,1877,
&end
#
# 112 LEU QD1 116 PHE HZ 5.18
&rst
ixpk= 0, nxpk= 0, iat= -1,1875, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
igr1=1794,1795,1796,
&end
#
# 112 LEU HA 112 LEU QD1 4.96
&rst
ixpk= 0, nxpk= 0, iat=1787, -1, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
igr2=1794,1795,1796,
&end
#
# 112 LEU HB3 112 LEU QD1 4.89
&rst
ixpk= 0, nxpk= 0, iat=1790, -1, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,
igr2=1794,1795,1796,
&end
#
# 112 LEU HB2 112 LEU QD1 4.24
&rst
ixpk= 0, nxpk= 0, iat=1789, -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
igr2=1794,1795,1796,
&end
#
# 130 PRO HG2 131 PHE H 4.60
&rst
ixpk= 0, nxpk= 0, iat=2091,2101, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 129 LYS HA 130 PRO HG2 4.83
&rst
ixpk= 0, nxpk= 0, iat=2067,2091, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33, &end
#
# 129 LYS HA 130 PRO HG3 5.74
&rst
ixpk= 0, nxpk= 0, iat=2067,2092, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24, &end
#
# 26 LYS HG2 27 GLU H 4.04
&rst
ixpk= 0, nxpk= 0, iat= 393, 408, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, &end
#
# 156 LYS HG2 156 LYS QE 3.44
&rst
ixpk= 0, nxpk= 0, iat=2491, -1, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,
igr2=2497,2498,
&end
#
# 156 LYS HA 156 LYS HG2 3.26
&rst
ixpk= 0, nxpk= 0, iat=2486,2491, r1= 1.30, r2= 1.80, r3= 3.26, r4= 3.76, &end
#
# 26 LYS HG3 27 GLU HG3 4.48
&rst
ixpk= 0, nxpk= 0, iat= 394, 416, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98, &end
#
# 23 GLN HA 26 LYS HG3 3.99
&rst
ixpk= 0, nxpk= 0, iat= 340, 394, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49, &end
#
# 26 LYS HG3 27 GLU HA 4.59
&rst
ixpk= 0, nxpk= 0, iat= 394, 410, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 16 LEU H 16 LEU HG 3.86
&rst
ixpk= 0, nxpk= 0, iat= 216, 223, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 16 LEU HG 52 PHE HA 4.90
&rst
ixpk= 0, nxpk= 0, iat= 223, 810, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40, &end
#
# 130 PRO HG3 131 PHE H 5.07
&rst
ixpk= 0, nxpk= 0, iat=2092,2101, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, &end
#
# 44 LEU H 45 LYS HG3 4.98
&rst
ixpk= 0, nxpk= 0, iat= 688, 715, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48, &end
#
# 45 LYS HG3 46 THR H 3.98
&rst
ixpk= 0, nxpk= 0, iat= 715, 729, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48, &end
#
# 156 LYS HG2 157 GLY H 5.23
&rst
ixpk= 0, nxpk= 0, iat=2491,2506, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73, &end
#
# 44 LEU H 45 LYS HG2 4.73
&rst
ixpk= 0, nxpk= 0, iat= 688, 714, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, &end
#
# 45 LYS H 45 LYS HG2 3.12
&rst
ixpk= 0, nxpk= 0, iat= 707, 714, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62, &end
#
# 45 LYS HG2 46 THR H 3.88
&rst
ixpk= 0, nxpk= 0, iat= 714, 729, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38, &end
#
# 45 LYS HG2 46 THR HB 5.89
&rst
ixpk= 0, nxpk= 0, iat= 714, 733, r1= 1.30, r2= 1.80, r3= 5.89, r4= 6.39, &end
#
# 45 LYS HB3 45 LYS HG2 2.61
&rst
ixpk= 0, nxpk= 0, iat= 712, 714, r1= 1.30, r2= 1.80, r3= 2.61, r4= 3.11, &end
#
# 45 LYS HG2 45 LYS QD 2.55
&rst
ixpk= 0, nxpk= 0, iat= 714, -1, r1= 1.30, r2= 1.80, r3= 2.86, r4= 3.36,
igr2= 717, 718,
&end
#
# 45 LYS HG2 46 THR QG2 3.23
&rst
ixpk= 0, nxpk= 0, iat= 714, -1, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,
igr2= 735, 736, 737,
&end
#
# 23 GLN HE21 26 LYS HG3 4.53
&rst
ixpk= 0, nxpk= 0, iat= 351, 394, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03, &end
#
# 156 LYS HA 156 LYS HG3 3.56
&rst
ixpk= 0, nxpk= 0, iat=2486,2492, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06, &end
#
# 156 LYS HG3 158 ILE H 5.11
&rst
ixpk= 0, nxpk= 0, iat=2492,2513, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61, &end
#
# 16 LEU HA 16 LEU HG 3.51
&rst
ixpk= 0, nxpk= 0, iat= 218, 223, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01, &end
#
# 65 LYS HG2 66 VAL H 3.58
&rst
ixpk= 0, nxpk= 0, iat=1034,1049, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08, &end
#
# 64 VAL H 65 LYS HG2 5.27
&rst
ixpk= 0, nxpk= 0, iat=1011,1034, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77, &end
#
# 65 LYS H 65 LYS HG2 3.44
&rst
ixpk= 0, nxpk= 0, iat=1027,1034, r1= 1.30, r2= 1.80, r3= 3.44, r4= 3.94, &end
#
# 32 PHE QD 65 LYS HG2 3.97
&rst
ixpk= 0, nxpk= 0, iat= -1,1034, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
igr1= 497, 505,
&end
#
# 62 THR HA 65 LYS HG2 3.99
&rst
ixpk= 0, nxpk= 0, iat= 982,1034, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49, &end
#
# 61 GLU QG 65 LYS HG2 5.39
&rst
ixpk= 0, nxpk= 0, iat= -1,1034, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
igr1= 972, 973,
&end
#
# 65 LYS QB 65 LYS HG2 2.73
&rst
ixpk= 0, nxpk= 0, iat= -1,1034, r1= 1.30, r2= 1.80, r3= 3.06, r4= 3.56,
igr1=1031,1032,
&end
#
# 62 THR QG2 65 LYS HG2 4.44
&rst
ixpk= 0, nxpk= 0, iat= -1,1034, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
igr1= 986, 987, 988,
&end
#
# 65 LYS H 65 LYS HG3 3.44
&rst
ixpk= 0, nxpk= 0, iat=1027,1035, r1= 1.30, r2= 1.80, r3= 3.44, r4= 3.94, &end
#
# 32 PHE QD 65 LYS HG3 3.97
&rst
ixpk= 0, nxpk= 0, iat= -1,1035, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
igr1= 497, 505,
&end
#
# 65 LYS HG3 66 VAL H 3.58
&rst
ixpk= 0, nxpk= 0, iat=1035,1049, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08, &end
#
# 64 VAL H 65 LYS HG3 5.27
&rst
ixpk= 0, nxpk= 0, iat=1011,1035, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77, &end
#
# 62 THR HA 65 LYS HG3 3.99
&rst
ixpk= 0, nxpk= 0, iat= 982,1035, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49, &end
#
# 86 LYS QG 86 LYS QE 2.74
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.45, r4= 3.95,
igr1=1376,1377,
igr2=1382,1383,
&end
#
# 61 GLU QG 65 LYS HG3 5.39
&rst
ixpk= 0, nxpk= 0, iat= -1,1035, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
igr1= 972, 973,
&end
#
# 83 PRO HG3 86 LYS QG 5.32
&rst
ixpk= 0, nxpk= 0, iat=1335, -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr2=1376,1377,
&end
#
# 86 LYS HA 86 LYS QG 3.39
&rst
ixpk= 0, nxpk= 0, iat=1371, -1, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,
igr2=1376,1377,
&end
#
# 86 LYS HB2 86 LYS QG 2.97
&rst
ixpk= 0, nxpk= 0, iat=1373, -1, r1= 1.30, r2= 1.80, r3= 3.33, r4= 3.83,
igr2=1376,1377,
&end
#
# 45 LYS HG3 45 LYS QE 3.29
&rst
ixpk= 0, nxpk= 0, iat= 715, -1, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19,
igr2= 720, 721,
&end
#
# 93 LEU QD2 165 ALA H 6.10
&rst
ixpk= 0, nxpk= 0, iat= -1,2620, r1= 1.30, r2= 1.80, r3= 7.33, r4= 7.83,
igr1=1490,1491,1492,
&end
#
# 93 LEU QD2 94 ARG H 5.08
&rst
ixpk= 0, nxpk= 0, iat= -1,1496, r1= 1.30, r2= 1.80, r3= 6.10, r4= 6.60,
igr1=1490,1491,1492,
&end
#
# 93 LEU H 93 LEU QD2 5.04
&rst
ixpk= 0, nxpk= 0, iat=1477, -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
igr2=1490,1491,1492,
&end
#
# 93 LEU QD2 164 ASN HD22 5.68
&rst
ixpk= 0, nxpk= 0, iat= -1,2615, r1= 1.30, r2= 1.80, r3= 6.82, r4= 7.32,
igr1=1490,1491,1492,
&end
#
# 93 LEU QD2 164 ASN HA 5.41
&rst
ixpk= 0, nxpk= 0, iat= -1,2608, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
igr1=1490,1491,1492,
&end
#
# 93 LEU QD2 164 ASN QB 4.40
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr1=1490,1491,1492,
igr2=2610,2611,
&end
#
# 92 PRO HB2 93 LEU QD2 6.50
&rst
ixpk= 0, nxpk= 0, iat=1470, -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr2=1490,1491,1492,
&end
#
# 93 LEU HB3 93 LEU QD2 3.75
&rst
ixpk= 0, nxpk= 0, iat=1482, -1, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
igr2=1490,1491,1492,
&end
#
# 97 LYS QG 138 THR H 5.44
&rst
ixpk= 0, nxpk= 0, iat= -1,2221, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
igr1=1562,1563,
&end
#
# 36 LEU H 36 LEU QD1 4.77
&rst
ixpk= 0, nxpk= 0, iat= 547, -1, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23,
igr2= 556, 557, 558,
&end
#
# 36 LEU QD1 58 THR H 5.07
&rst
ixpk= 0, nxpk= 0, iat= -1, 915, r1= 1.30, r2= 1.80, r3= 6.09, r4= 6.59,
igr1= 556, 557, 558,
&end
#
# 36 LEU QD1 58 THR HA 4.29
&rst
ixpk= 0, nxpk= 0, iat= -1, 917, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
igr1= 556, 557, 558,
&end
#
# 36 LEU HB2 36 LEU QD1 4.31
&rst
ixpk= 0, nxpk= 0, iat= 551, -1, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
igr2= 556, 557, 558,
&end
#
# 7 LYS HB2 7 LYS QG 2.78
&rst
ixpk= 0, nxpk= 0, iat= 81, -1, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62,
igr2= 84, 85,
&end
#
# 7 LYS QG 60 TYR QD 5.19
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.54, r4= 7.04,
igr1= 84, 85,
igr2= 952, 961,
&end
#
# 7 LYS QG 89 GLN HE21 5.39
&rst
ixpk= 0, nxpk= 0, iat= -1,1432, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
igr1= 84, 85,
&end
#
# 7 LYS HA 7 LYS QG 3.60
&rst
ixpk= 0, nxpk= 0, iat= 79, -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
igr2= 84, 85,
&end
#
# 7 LYS QG 7 LYS QD 2.40
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.02, r4= 3.52,
igr1= 84, 85,
igr2= 87, 88,
&end
#
# 42 LYS HG2 50 LYS H 5.47
&rst
ixpk= 0, nxpk= 0, iat= 661, 779, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97, &end
#
# 42 LYS HG3 50 LYS H 5.34
&rst
ixpk= 0, nxpk= 0, iat= 662, 779, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84, &end
#
# 42 LYS HG3 43 ASP H 4.59
&rst
ixpk= 0, nxpk= 0, iat= 662, 676, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 41 LYS HA 42 LYS HG3 3.93
&rst
ixpk= 0, nxpk= 0, iat= 634, 662, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43, &end
#
# 42 LYS HA 42 LYS HG3 3.76
&rst
ixpk= 0, nxpk= 0, iat= 656, 662, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26, &end
#
# 44 LEU H 44 LEU QD1 4.44
&rst
ixpk= 0, nxpk= 0, iat= 688, -1, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
igr2= 697, 698, 699,
&end
#
# 44 LEU QD1 45 LYS H 5.36
&rst
ixpk= 0, nxpk= 0, iat= -1, 707, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,
igr1= 697, 698, 699,
&end
#
# 44 LEU HA 44 LEU QD1 4.61
&rst
ixpk= 0, nxpk= 0, iat= 690, -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
igr2= 697, 698, 699,
&end
#
# 6 SER HA 7 LYS QG 4.94
&rst
ixpk= 0, nxpk= 0, iat= 68, -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
igr2= 84, 85,
&end
#
# 129 LYS HG2 130 PRO HA 3.84
&rst
ixpk= 0, nxpk= 0, iat=2072,2097, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34, &end
#
# 129 LYS H 129 LYS HG2 4.67
&rst
ixpk= 0, nxpk= 0, iat=2065,2072, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, &end
#
# 129 LYS HA 129 LYS HG2 4.65
&rst
ixpk= 0, nxpk= 0, iat=2067,2072, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15, &end
#
# 129 LYS HG2 130 PRO HB3 5.39
&rst
ixpk= 0, nxpk= 0, iat=2072,2095, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89, &end
#
# 42 LYS HG2 43 ASP H 4.79
&rst
ixpk= 0, nxpk= 0, iat= 661, 676, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29, &end
#
# 42 LYS HG2 47 GLY HA2 5.51
&rst
ixpk= 0, nxpk= 0, iat= 661, 745, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01, &end
#
# 129 LYS HG3 130 PRO HB3 5.39
&rst
ixpk= 0, nxpk= 0, iat=2073,2095, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89, &end
#
# 129 LYS H 129 LYS HG3 4.67
&rst
ixpk= 0, nxpk= 0, iat=2065,2073, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, &end
#
# 129 LYS HG3 130 PRO HA 3.84
&rst
ixpk= 0, nxpk= 0, iat=2073,2097, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34, &end
#
# 129 LYS HA 129 LYS HG3 4.65
&rst
ixpk= 0, nxpk= 0, iat=2067,2073, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15, &end
#
# 115 PHE QE 155 ILE HG13 4.64
&rst
ixpk= 0, nxpk= 0, iat= -1,2476, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,
igr1=1853,1857,
&end
#
# 62 THR QG2 65 LYS HG3 4.44
&rst
ixpk= 0, nxpk= 0, iat= -1,1035, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
igr1= 986, 987, 988,
&end
#
# 80 CYS H 81 LYS HG3 5.35
&rst
ixpk= 0, nxpk= 0, iat=1278,1297, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85, &end
#
# 79 ASP HB2 81 LYS HG3 4.91
&rst
ixpk= 0, nxpk= 0, iat=1270,1297, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41, &end
#
# 67 MET QE 81 LYS HG3 5.88
&rst
ixpk= 0, nxpk= 0, iat= -1,1297, r1= 1.30, r2= 1.80, r3= 7.06, r4= 7.56,
igr1=1076,1077,1078,
&end
#
# 81 LYS HA 81 LYS HG3 3.72
&rst
ixpk= 0, nxpk= 0, iat=1291,1297, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22, &end
#
# 79 ASP HA 81 LYS HG2 5.74
&rst
ixpk= 0, nxpk= 0, iat=1268,1296, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24, &end
#
# 81 LYS HG2 81 LYS HE3 3.53
&rst
ixpk= 0, nxpk= 0, iat=1296,1303, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03, &end
#
# 80 CYS HA 81 LYS HG2 4.49
&rst
ixpk= 0, nxpk= 0, iat=1280,1296, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99, &end
#
# 81 LYS HA 81 LYS HG2 4.09
&rst
ixpk= 0, nxpk= 0, iat=1291,1296, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59, &end
#
# 79 ASP HB2 81 LYS HG2 4.69
&rst
ixpk= 0, nxpk= 0, iat=1270,1296, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, &end
#
# 79 ASP HB3 81 LYS HG2 4.67
&rst
ixpk= 0, nxpk= 0, iat=1271,1296, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, &end
#
# 12 ILE QD1 81 LYS HG2 5.24
&rst
ixpk= 0, nxpk= 0, iat= -1,1296, r1= 1.30, r2= 1.80, r3= 6.29, r4= 6.79,
igr1= 168, 169, 170,
&end
#
# 25 LEU H 25 LEU QD2 5.04
&rst
ixpk= 0, nxpk= 0, iat= 367, -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
igr2= 380, 381, 382,
&end
#
# 22 GLU HA 25 LEU QD2 5.39
&rst
ixpk= 0, nxpk= 0, iat= 325, -1, r1= 1.30, r2= 1.80, r3= 6.47, r4= 6.97,
igr2= 380, 381, 382,
&end
#
# 25 LEU HB2 25 LEU QD2 4.30
&rst
ixpk= 0, nxpk= 0, iat= 371, -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
igr2= 380, 381, 382,
&end
#
# 57 PHE HA 62 THR QG2 4.53
&rst
ixpk= 0, nxpk= 0, iat= 897, -1, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
igr2= 986, 987, 988,
&end
#
# 59 GLU H 62 THR QG2 4.53
&rst
ixpk= 0, nxpk= 0, iat= 929, -1, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
igr2= 986, 987, 988,
&end
#
# 32 PHE H 62 THR QG2 4.15
&rst
ixpk= 0, nxpk= 0, iat= 489, -1, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
igr2= 986, 987, 988,
&end
#
# 62 THR QG2 65 LYS H 5.07
&rst
ixpk= 0, nxpk= 0, iat= -1,1027, r1= 1.30, r2= 1.80, r3= 6.09, r4= 6.59,
igr1= 986, 987, 988,
&end
#
# 57 PHE QD 62 THR QG2 2.94
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
igr1= 903, 911,
igr2= 986, 987, 988,
&end
#
# 57 PHE QE 62 THR QG2 3.13
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
igr1= 905, 909,
igr2= 986, 987, 988,
&end
#
# 62 THR HA 62 THR QG2 2.90
&rst
ixpk= 0, nxpk= 0, iat= 982, -1, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98,
igr2= 986, 987, 988,
&end
#
# 62 THR QG2 63 GLN HA 4.41
&rst
ixpk= 0, nxpk= 0, iat= -1, 996, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr1= 986, 987, 988,
&end
#
# 32 PHE HB2 62 THR QG2 3.47
&rst
ixpk= 0, nxpk= 0, iat= 493, -1, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,
igr2= 986, 987, 988,
&end
#
# 32 PHE HB3 62 THR QG2 3.27
&rst
ixpk= 0, nxpk= 0, iat= 494, -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
igr2= 986, 987, 988,
&end
#
# 81 LYS HG3 82 LEU H 4.26
&rst
ixpk= 0, nxpk= 0, iat=1297,1311, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76, &end
#
# 80 CYS HA 81 LYS HG3 4.50
&rst
ixpk= 0, nxpk= 0, iat=1280,1297, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 116 PHE QE 135 ALA QB 4.69
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.32, r4= 6.82,
igr1=1873,1877,
igr2=2179,2180,2181,
&end
#
# 116 PHE HZ 135 ALA QB 5.24
&rst
ixpk= 0, nxpk= 0, iat=1875, -1, r1= 1.30, r2= 1.80, r3= 6.29, r4= 6.79,
igr2=2179,2180,2181,
&end
#
# 127 ILE HG13 135 ALA QB 3.69
&rst
ixpk= 0, nxpk= 0, iat=2043, -1, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
igr2=2179,2180,2181,
&end
#
# 127 ILE HG12 135 ALA QB 2.74
&rst
ixpk= 0, nxpk= 0, iat=2042, -1, r1= 1.30, r2= 1.80, r3= 3.29, r4= 3.79,
igr2=2179,2180,2181,
&end
#
# 100 VAL QG1 135 ALA QB 4.21
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
igr1=1619,1620,1621,
igr2=2179,2180,2181,
&end
#
# 134 PHE H 135 ALA QB 4.61
&rst
ixpk= 0, nxpk= 0, iat=2155, -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
igr2=2179,2180,2181,
&end
#
# 134 PHE QD 135 ALA QB 4.85
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.54, r4= 7.04,
igr1=2163,2171,
igr2=2179,2180,2181,
&end
#
# 134 PHE HA 135 ALA QB 4.70
&rst
ixpk= 0, nxpk= 0, iat=2157, -1, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14,
igr2=2179,2180,2181,
&end
#
# 127 ILE HA 135 ALA QB 4.25
&rst
ixpk= 0, nxpk= 0, iat=2034, -1, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
igr2=2179,2180,2181,
&end
#
# 128 PRO HD2 135 ALA QB 4.97
&rst
ixpk= 0, nxpk= 0, iat=2052, -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr2=2179,2180,2181,
&end
#
# 100 VAL QG2 135 ALA QB 4.21
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
igr1=1623,1624,1625,
igr2=2179,2180,2181,
&end
#
# 135 ALA QB 136 PHE HA 4.84
&rst
ixpk= 0, nxpk= 0, iat= -1,2187, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
igr1=2179,2180,2181,
&end
#
# 104 THR QG2 159 SER H 5.60
&rst
ixpk= 0, nxpk= 0, iat= -1,2532, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1=1677,1678,1679,
&end
#
# 39 GLN HE22 104 THR QG2 3.75
&rst
ixpk= 0, nxpk= 0, iat= 611, -1, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
igr2=1677,1678,1679,
&end
#
# 104 THR HA 104 THR QG2 3.05
&rst
ixpk= 0, nxpk= 0, iat=1673, -1, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,
igr2=1677,1678,1679,
&end
#
# 103 CYM HA 104 THR QG2 4.17
&rst
ixpk= 0, nxpk= 0, iat=1662, -1, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
igr2=1677,1678,1679,
&end
#
# 82 LEU QD2 87 GLN HE22 5.16
&rst
ixpk= 0, nxpk= 0, iat= -1,1403, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
igr1=1324,1325,1326,
&end
#
# 82 LEU HA 82 LEU QD2 4.08
&rst
ixpk= 0, nxpk= 0, iat=1313, -1, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,
igr2=1324,1325,1326,
&end
#
# 82 LEU QD2 83 PRO HD3 4.75
&rst
ixpk= 0, nxpk= 0, iat= -1,1332, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr1=1324,1325,1326,
&end
#
# 9 SER HB2 82 LEU QD2 5.68
&rst
ixpk= 0, nxpk= 0, iat= 117, -1, r1= 1.30, r2= 1.80, r3= 6.82, r4= 7.32,
igr2=1324,1325,1326,
&end
#
# 82 LEU QD2 83 PRO HD2 4.64
&rst
ixpk= 0, nxpk= 0, iat= -1,1331, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
igr1=1324,1325,1326,
&end
#
# 9 SER HB3 82 LEU QD2 5.68
&rst
ixpk= 0, nxpk= 0, iat= 118, -1, r1= 1.30, r2= 1.80, r3= 6.82, r4= 7.32,
igr2=1324,1325,1326,
&end
#
# 82 LEU HB3 82 LEU QD2 4.21
&rst
ixpk= 0, nxpk= 0, iat=1316, -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
igr2=1324,1325,1326,
&end
#
# 82 LEU QD2 87 GLN HE21 5.16
&rst
ixpk= 0, nxpk= 0, iat= -1,1404, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
igr1=1324,1325,1326,
&end
#
# 93 LEU QD1 94 ARG H 4.52
&rst
ixpk= 0, nxpk= 0, iat= -1,1496, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
igr1=1486,1487,1488,
&end
#
# 92 PRO HA 93 LEU QD1 5.44
&rst
ixpk= 0, nxpk= 0, iat=1473, -1, r1= 1.30, r2= 1.80, r3= 6.53, r4= 7.03,
igr2=1486,1487,1488,
&end
#
# 93 LEU QD1 146 GLN QG 5.76
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.76, r4= 8.26,
igr1=1486,1487,1488,
igr2=2342,2343,
&end
#
# 93 LEU H 93 LEU QD1 4.41
&rst
ixpk= 0, nxpk= 0, iat=1477, -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr2=1486,1487,1488,
&end
#
# 93 LEU QD1 164 ASN HD22 5.90
&rst
ixpk= 0, nxpk= 0, iat= -1,2615, r1= 1.30, r2= 1.80, r3= 7.09, r4= 7.59,
igr1=1486,1487,1488,
&end
#
# 93 LEU QD1 164 ASN HD21 5.23
&rst
ixpk= 0, nxpk= 0, iat= -1,2616, r1= 1.30, r2= 1.80, r3= 6.28, r4= 6.78,
igr1=1486,1487,1488,
&end
#
# 92 PRO HB2 93 LEU QD1 4.78
&rst
ixpk= 0, nxpk= 0, iat=1470, -1, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
igr2=1486,1487,1488,
&end
#
# 19 LYS HA 19 LYS HG2 4.19
&rst
ixpk= 0, nxpk= 0, iat= 275, 280, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69, &end
#
# 19 LYS HG2 19 LYS QD 2.97
&rst
ixpk= 0, nxpk= 0, iat= 280, -1, r1= 1.30, r2= 1.80, r3= 3.33, r4= 3.83,
igr2= 283, 284,
&end
#
# 18 TRP HB2 19 LYS HG2 5.35
&rst
ixpk= 0, nxpk= 0, iat= 253, 280, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85, &end
#
# 19 LYS H 19 LYS HG3 3.82
&rst
ixpk= 0, nxpk= 0, iat= 273, 281, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32, &end
#
# 17 PRO QG 19 LYS HG3 4.69
&rst
ixpk= 0, nxpk= 0, iat= -1, 281, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr1= 239, 240,
&end
#
# 19 LYS HA 19 LYS HG3 3.77
&rst
ixpk= 0, nxpk= 0, iat= 275, 281, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27, &end
#
# 19 LYS HG3 19 LYS QE 3.35
&rst
ixpk= 0, nxpk= 0, iat= 281, -1, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,
igr2= 286, 287,
&end
#
# 19 LYS HG3 74 ASP HB2 5.44
&rst
ixpk= 0, nxpk= 0, iat= 281,1192, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94, &end
#
# 19 LYS HG3 19 LYS QD 2.94
&rst
ixpk= 0, nxpk= 0, iat= 281, -1, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80,
igr2= 283, 284,
&end
#
# 104 THR QG2 105 GLU HA 5.74
&rst
ixpk= 0, nxpk= 0, iat= -1,1687, r1= 1.30, r2= 1.80, r3= 6.89, r4= 7.39,
igr1=1677,1678,1679,
&end
#
# 36 LEU H 36 LEU QD2 4.77
&rst
ixpk= 0, nxpk= 0, iat= 547, -1, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23,
igr2= 560, 561, 562,
&end
#
# 36 LEU QD2 58 THR H 5.07
&rst
ixpk= 0, nxpk= 0, iat= -1, 915, r1= 1.30, r2= 1.80, r3= 6.09, r4= 6.59,
igr1= 560, 561, 562,
&end
#
# 36 LEU QD2 58 THR HA 4.29
&rst
ixpk= 0, nxpk= 0, iat= -1, 917, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
igr1= 560, 561, 562,
&end
#
# 34 GLU HG3 36 LEU QD2 6.24
&rst
ixpk= 0, nxpk= 0, iat= 524, -1, r1= 1.30, r2= 1.80, r3= 7.49, r4= 7.99,
igr2= 560, 561, 562,
&end
#
# 44 LEU QD2 45 LYS H 5.36
&rst
ixpk= 0, nxpk= 0, iat= -1, 707, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,
igr1= 701, 702, 703,
&end
#
# 58 THR QG2 59 GLU H 3.48
&rst
ixpk= 0, nxpk= 0, iat= -1, 929, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
igr1= 921, 922, 923,
&end
#
# 58 THR H 58 THR QG2 3.02
&rst
ixpk= 0, nxpk= 0, iat= 915, -1, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13,
igr2= 921, 922, 923,
&end
#
# 57 PHE HA 58 THR QG2 4.25
&rst
ixpk= 0, nxpk= 0, iat= 897, -1, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
igr2= 921, 922, 923,
&end
#
# 58 THR HA 58 THR QG2 3.28
&rst
ixpk= 0, nxpk= 0, iat= 917, -1, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,
igr2= 921, 922, 923,
&end
#
# 58 THR QG2 59 GLU HG2 3.80
&rst
ixpk= 0, nxpk= 0, iat= -1, 936, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
igr1= 921, 922, 923,
&end
#
# 34 GLU HG2 58 THR QG2 2.69
&rst
ixpk= 0, nxpk= 0, iat= 523, -1, r1= 1.30, r2= 1.80, r3= 3.23, r4= 3.73,
igr2= 921, 922, 923,
&end
#
# 34 GLU HB3 58 THR QG2 3.54
&rst
ixpk= 0, nxpk= 0, iat= 521, -1, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,
igr2= 921, 922, 923,
&end
#
# 58 THR QG2 62 THR QG2 4.48
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.46, r4= 6.96,
igr1= 921, 922, 923,
igr2= 986, 987, 988,
&end
#
# 44 LEU HA 44 LEU QD2 4.61
&rst
ixpk= 0, nxpk= 0, iat= 690, -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
igr2= 701, 702, 703,
&end
#
# 112 LEU QD2 113 ARG H 5.78
&rst
ixpk= 0, nxpk= 0, iat= -1,1804, r1= 1.30, r2= 1.80, r3= 6.94, r4= 7.44,
igr1=1798,1799,1800,
&end
#
# 112 LEU QD2 116 PHE QE 4.45
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr1=1798,1799,1800,
igr2=1873,1877,
&end
#
# 112 LEU QD2 116 PHE HZ 5.18
&rst
ixpk= 0, nxpk= 0, iat= -1,1875, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
igr1=1798,1799,1800,
&end
#
# 112 LEU HA 112 LEU QD2 4.96
&rst
ixpk= 0, nxpk= 0, iat=1787, -1, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
igr2=1798,1799,1800,
&end
#
# 112 LEU HB2 112 LEU QD2 4.24
&rst
ixpk= 0, nxpk= 0, iat=1789, -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
igr2=1798,1799,1800,
&end
#
# 66 VAL H 66 VAL QG1 4.86
&rst
ixpk= 0, nxpk= 0, iat=1049, -1, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
igr2=1055,1056,1057,
&end
#
# 57 PHE QE 66 VAL QG1 4.65
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
igr1= 905, 909,
igr2=1055,1056,1057,
&end
#
# 57 PHE HZ 66 VAL QG1 4.86
&rst
ixpk= 0, nxpk= 0, iat= 907, -1, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
igr2=1055,1056,1057,
&end
#
# 29 PHE QE 66 VAL QG1 4.94
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.66, r4= 7.16,
igr1= 454, 458,
igr2=1055,1056,1057,
&end
#
# 29 PHE HA 66 VAL QG1 6.50
&rst
ixpk= 0, nxpk= 0, iat= 446, -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr2=1055,1056,1057,
&end
#
# 63 GLN HA 66 VAL QG1 5.53
&rst
ixpk= 0, nxpk= 0, iat= 996, -1, r1= 1.30, r2= 1.80, r3= 6.64, r4= 7.14,
igr2=1055,1056,1057,
&end
#
# 66 VAL HA 66 VAL QG1 4.22
&rst
ixpk= 0, nxpk= 0, iat=1051, -1, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
igr2=1055,1056,1057,
&end
#
# 20 THR QG2 21 THR H 3.10
&rst
ixpk= 0, nxpk= 0, iat= -1, 309, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,
igr1= 301, 302, 303,
&end
#
# 20 THR QG2 25 LEU H 3.63
&rst
ixpk= 0, nxpk= 0, iat= -1, 367, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,
igr1= 301, 302, 303,
&end
#
# 20 THR H 20 THR QG2 3.80
&rst
ixpk= 0, nxpk= 0, iat= 295, -1, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
igr2= 301, 302, 303,
&end
#
# 20 THR QG2 24 ASP HA 4.58
&rst
ixpk= 0, nxpk= 0, iat= -1, 357, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
igr1= 301, 302, 303,
&end
#
# 20 THR QG2 24 ASP HB2 3.15
&rst
ixpk= 0, nxpk= 0, iat= -1, 359, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,
igr1= 301, 302, 303,
&end
#
# 20 THR QG2 24 ASP HB3 3.15
&rst
ixpk= 0, nxpk= 0, iat= -1, 360, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,
igr1= 301, 302, 303,
&end
#
# 20 THR QG2 21 THR QG2 3.22
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
igr1= 301, 302, 303,
igr2= 315, 316, 317,
&end
#
# 16 LEU QQD 20 THR QG2 4.24
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.86, r4= 7.36,
igr1= 225, 226, 227, 229, 230, 231,
igr2= 301, 302, 303,
&end
#
# 20 THR QG2 73 ILE QG2 3.88
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
igr1= 301, 302, 303,
igr2=1175,1176,1177,
&end
#
# 20 THR QG2 22 GLU H 5.06
&rst
ixpk= 0, nxpk= 0, iat= -1, 323, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
igr1= 301, 302, 303,
&end
#
# 20 THR QG2 21 THR HA 4.47
&rst
ixpk= 0, nxpk= 0, iat= -1, 311, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr1= 301, 302, 303,
&end
#
# 20 THR QG2 21 THR HB 5.01
&rst
ixpk= 0, nxpk= 0, iat= -1, 313, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,
igr1= 301, 302, 303,
&end
#
# 11 LEU QD2 67 MET HA 6.10
&rst
ixpk= 0, nxpk= 0, iat= -1,1067, r1= 1.30, r2= 1.80, r3= 7.33, r4= 7.83,
igr1= 149, 150, 151,
&end
#
# 153 LEU HA 153 LEU QD2 5.40
&rst
ixpk= 0, nxpk= 0, iat=2429, -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
igr2=2440,2441,2442,
&end
#
# 148 LEU HA 153 LEU QD2 6.16
&rst
ixpk= 0, nxpk= 0, iat=2365, -1, r1= 1.30, r2= 1.80, r3= 7.40, r4= 7.90,
igr2=2440,2441,2442,
&end
#
# 153 LEU HB3 153 LEU QD2 4.65
&rst
ixpk= 0, nxpk= 0, iat=2432, -1, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr2=2440,2441,2442,
&end
#
# 148 LEU QD1 153 LEU QD2 3.08
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
igr1=2372,2373,2374,
igr2=2440,2441,2442,
&end
#
# 148 LEU QD2 153 LEU QD2 3.08
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
igr1=2376,2377,2378,
igr2=2440,2441,2442,
&end
#
# 11 LEU QD2 67 MET H 3.77
&rst
ixpk= 0, nxpk= 0, iat= -1,1065, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
igr1= 149, 150, 151,
&end
#
# 11 LEU QD2 57 PHE QE 3.87
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
igr1= 149, 150, 151,
igr2= 905, 909,
&end
#
# 11 LEU HA 11 LEU QD2 3.12
&rst
ixpk= 0, nxpk= 0, iat= 138, -1, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,
igr2= 149, 150, 151,
&end
#
# 11 LEU QD2 63 GLN HA 3.44
&rst
ixpk= 0, nxpk= 0, iat= -1, 996, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
igr1= 149, 150, 151,
&end
#
# 11 LEU QD2 67 MET HG2 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1072, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr1= 149, 150, 151,
&end
#
# 11 LEU QD2 63 GLN HG3 4.68
&rst
ixpk= 0, nxpk= 0, iat= -1,1002, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
igr1= 149, 150, 151,
&end
#
# 11 LEU QD2 80 CYS HA 6.30
&rst
ixpk= 0, nxpk= 0, iat= -1,1280, r1= 1.30, r2= 1.80, r3= 7.57, r4= 8.07,
igr1= 149, 150, 151,
&end
#
# 35 VAL QG1 36 LEU H 5.59
&rst
ixpk= 0, nxpk= 0, iat= -1, 547, r1= 1.30, r2= 1.80, r3= 6.71, r4= 7.21,
igr1= 537, 538, 539,
&end
#
# 35 VAL QG1 57 PHE QE 4.89
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
igr1= 537, 538, 539,
igr2= 905, 909,
&end
#
# 35 VAL QG1 57 PHE HA 5.67
&rst
ixpk= 0, nxpk= 0, iat= -1, 897, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
igr1= 537, 538, 539,
&end
#
# 35 VAL HA 35 VAL QG1 4.71
&rst
ixpk= 0, nxpk= 0, iat= 533, -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr2= 537, 538, 539,
&end
#
# 29 PHE HB3 35 VAL QG1 4.75
&rst
ixpk= 0, nxpk= 0, iat= 449, -1, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr2= 537, 538, 539,
&end
#
# 12 ILE H 14 LEU QD2 6.08
&rst
ixpk= 0, nxpk= 0, iat= 155, -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
igr2= 203, 204, 205,
&end
#
# 14 LEU H 14 LEU QD2 4.58
&rst
ixpk= 0, nxpk= 0, iat= 190, -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
igr2= 203, 204, 205,
&end
#
# 13 VAL HA 14 LEU QD2 5.52
&rst
ixpk= 0, nxpk= 0, iat= 176, -1, r1= 1.30, r2= 1.80, r3= 6.63, r4= 7.13,
igr2= 203, 204, 205,
&end
#
# 14 LEU QD2 79 ASP HB2 6.16
&rst
ixpk= 0, nxpk= 0, iat= -1,1270, r1= 1.30, r2= 1.80, r3= 7.40, r4= 7.90,
igr1= 203, 204, 205,
&end
#
# 26 LYS H 38 VAL QG1 3.84
&rst
ixpk= 0, nxpk= 0, iat= 386, -1, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
igr2= 589, 590, 591,
&end
#
# 38 VAL H 38 VAL QG1 4.35
&rst
ixpk= 0, nxpk= 0, iat= 583, -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
igr2= 589, 590, 591,
&end
#
# 29 PHE QD 38 VAL QG1 5.51
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.43, r4= 7.93,
igr1= 452, 460,
igr2= 589, 590, 591,
&end
#
# 38 VAL HA 38 VAL QG1 4.32
&rst
ixpk= 0, nxpk= 0, iat= 585, -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
igr2= 589, 590, 591,
&end
#
# 37 MET HA 38 VAL QG1 5.06
&rst
ixpk= 0, nxpk= 0, iat= 568, -1, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
igr2= 589, 590, 591,
&end
#
# 23 GLN HA 38 VAL QG1 5.79
&rst
ixpk= 0, nxpk= 0, iat= 340, -1, r1= 1.30, r2= 1.80, r3= 6.95, r4= 7.45,
igr2= 589, 590, 591,
&end
#
# 26 LYS HB3 38 VAL QG1 3.83
&rst
ixpk= 0, nxpk= 0, iat= 391, -1, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
igr2= 589, 590, 591,
&end
#
# 98 VAL QG1 163 SER H 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2595, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr1=1583,1584,1585,
&end
#
# 98 VAL QG1 99 PHE H 5.03
&rst
ixpk= 0, nxpk= 0, iat= -1,1593, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54,
igr1=1583,1584,1585,
&end
#
# 97 LYS HA 98 VAL QG1 5.74
&rst
ixpk= 0, nxpk= 0, iat=1557, -1, r1= 1.30, r2= 1.80, r3= 6.89, r4= 7.39,
igr2=1583,1584,1585,
&end
#
# 98 VAL HA 98 VAL QG1 4.47
&rst
ixpk= 0, nxpk= 0, iat=1579, -1, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr2=1583,1584,1585,
&end
#
# 116 PHE QD 122 VAL QG1 6.44
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.68, r4= 9.18,
igr1=1871,1879,
igr2=1957,1958,1959,
&end
#
# 122 VAL QG1 139 PHE HA 4.86
&rst
ixpk= 0, nxpk= 0, iat= -1,2237, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
igr1=1957,1958,1959,
&end
#
# 122 VAL HA 122 VAL QG1 4.53
&rst
ixpk= 0, nxpk= 0, iat=1953, -1, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
igr2=1957,1958,1959,
&end
#
# 113 ARG HG3 122 VAL QG1 4.93
&rst
ixpk= 0, nxpk= 0, iat=1812, -1, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
igr2=1957,1958,1959,
&end
#
# 28 TYR H 38 VAL QG1 6.50
&rst
ixpk= 0, nxpk= 0, iat= 423, -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr2= 589, 590, 591,
&end
#
# 61 GLU H 64 VAL QG1 5.00
&rst
ixpk= 0, nxpk= 0, iat= 965, -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr2=1017,1018,1019,
&end
#
# 64 VAL H 64 VAL QG1 3.67
&rst
ixpk= 0, nxpk= 0, iat=1011, -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
igr2=1017,1018,1019,
&end
#
# 64 VAL QG1 65 LYS H 4.91
&rst
ixpk= 0, nxpk= 0, iat= -1,1027, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
igr1=1017,1018,1019,
&end
#
# 60 TYR QD 64 VAL QG1 4.24
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
igr1= 952, 961,
igr2=1017,1018,1019,
&end
#
# 61 GLU HA 64 VAL QG1 3.91
&rst
ixpk= 0, nxpk= 0, iat= 967, -1, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
igr2=1017,1018,1019,
&end
#
# 64 VAL HA 64 VAL QG1 3.72
&rst
ixpk= 0, nxpk= 0, iat=1013, -1, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
igr2=1017,1018,1019,
&end
#
# 63 GLN HG3 64 VAL QG1 5.10
&rst
ixpk= 0, nxpk= 0, iat=1002, -1, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,
igr2=1017,1018,1019,
&end
#
# 63 GLN HG2 64 VAL QG1 3.98
&rst
ixpk= 0, nxpk= 0, iat=1001, -1, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
igr2=1017,1018,1019,
&end
#
# 8 THR QG2 62 THR HB 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 984, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr1= 105, 106, 107,
&end
#
# 35 VAL QG2 57 PHE HA 5.67
&rst
ixpk= 0, nxpk= 0, iat= -1, 897, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
igr1= 541, 542, 543,
&end
#
# 32 PHE QE 66 VAL QG2 5.77
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
igr1= 499, 503,
igr2=1059,1060,1061,
&end
#
# 29 PHE QE 66 VAL QG2 4.94
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.66, r4= 7.16,
igr1= 454, 458,
igr2=1059,1060,1061,
&end
#
# 57 PHE HZ 66 VAL QG2 4.86
&rst
ixpk= 0, nxpk= 0, iat= 907, -1, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
igr2=1059,1060,1061,
&end
#
# 63 GLN HA 66 VAL QG2 5.53
&rst
ixpk= 0, nxpk= 0, iat= 996, -1, r1= 1.30, r2= 1.80, r3= 6.64, r4= 7.14,
igr2=1059,1060,1061,
&end
#
# 7 LYS HA 8 THR QG2 4.48
&rst
ixpk= 0, nxpk= 0, iat= 79, -1, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
igr2= 105, 106, 107,
&end
#
# 7 LYS HB2 8 THR QG2 5.78
&rst
ixpk= 0, nxpk= 0, iat= 81, -1, r1= 1.30, r2= 1.80, r3= 6.94, r4= 7.44,
igr2= 105, 106, 107,
&end
#
# 8 THR QG2 61 GLU H 4.61
&rst
ixpk= 0, nxpk= 0, iat= -1, 965, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
igr1= 105, 106, 107,
&end
#
# 8 THR QG2 9 SER H 3.51
&rst
ixpk= 0, nxpk= 0, iat= -1, 113, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
igr1= 105, 106, 107,
&end
#
# 8 THR QG2 60 TYR QD 3.18
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,
igr1= 105, 106, 107,
igr2= 952, 961,
&end
#
# 8 THR HA 8 THR QG2 3.14
&rst
ixpk= 0, nxpk= 0, iat= 101, -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
igr2= 105, 106, 107,
&end
#
# 8 THR QG2 60 TYR HA 3.20
&rst
ixpk= 0, nxpk= 0, iat= -1, 946, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
igr1= 105, 106, 107,
&end
#
# 8 THR QG2 60 TYR HB3 3.57
&rst
ixpk= 0, nxpk= 0, iat= -1, 949, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,
igr1= 105, 106, 107,
&end
#
# 8 THR QG2 64 VAL QG1 6.14
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.86, r4= 9.36,
igr1= 105, 106, 107,
igr2=1017,1018,1019,
&end
#
# 35 VAL H 35 VAL QG2 5.18
&rst
ixpk= 0, nxpk= 0, iat= 531, -1, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
igr2= 541, 542, 543,
&end
#
# 35 VAL QG2 57 PHE QE 4.89
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
igr1= 541, 542, 543,
igr2= 905, 909,
&end
#
# 35 VAL HA 35 VAL QG2 5.71
&rst
ixpk= 0, nxpk= 0, iat= 533, -1, r1= 1.30, r2= 1.80, r3= 6.86, r4= 7.36,
igr2= 541, 542, 543,
&end
#
# 29 PHE HB2 35 VAL QG2 5.30
&rst
ixpk= 0, nxpk= 0, iat= 448, -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
igr2= 541, 542, 543,
&end
#
# 29 PHE HB3 35 VAL QG2 4.75
&rst
ixpk= 0, nxpk= 0, iat= 449, -1, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr2= 541, 542, 543,
&end
#
# 125 VAL HA 125 VAL QG1 4.24
&rst
ixpk= 0, nxpk= 0, iat=1998, -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
igr2=2002,2003,2004,
&end
#
# 125 VAL H 125 VAL QG1 5.02
&rst
ixpk= 0, nxpk= 0, iat=1996, -1, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
igr2=2002,2003,2004,
&end
#
# 122 VAL H 122 VAL QG2 4.96
&rst
ixpk= 0, nxpk= 0, iat=1951, -1, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
igr2=1961,1962,1963,
&end
#
# 122 VAL HA 122 VAL QG2 4.53
&rst
ixpk= 0, nxpk= 0, iat=1953, -1, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
igr2=1961,1962,1963,
&end
#
# 113 ARG HG3 122 VAL QG2 4.93
&rst
ixpk= 0, nxpk= 0, iat=1812, -1, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
igr2=1961,1962,1963,
&end
#
# 116 PHE QD 122 VAL QG2 6.44
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.68, r4= 9.18,
igr1=1871,1879,
igr2=1961,1962,1963,
&end
#
# 122 VAL QG2 139 PHE HA 5.86
&rst
ixpk= 0, nxpk= 0, iat= -1,2237, r1= 1.30, r2= 1.80, r3= 7.04, r4= 7.54,
igr1=1961,1962,1963,
&end
#
# 40 VAL H 40 VAL QG1 4.77
&rst
ixpk= 0, nxpk= 0, iat= 616, -1, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23,
igr2= 622, 623, 624,
&end
#
# 21 THR HA 40 VAL QG1 5.87
&rst
ixpk= 0, nxpk= 0, iat= 311, -1, r1= 1.30, r2= 1.80, r3= 7.05, r4= 7.55,
igr2= 622, 623, 624,
&end
#
# 40 VAL HA 40 VAL QG1 4.18
&rst
ixpk= 0, nxpk= 0, iat= 618, -1, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
igr2= 622, 623, 624,
&end
#
# 57 PHE QE 66 VAL QG2 4.65
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
igr1= 905, 909,
igr2=1059,1060,1061,
&end
#
# 29 PHE HA 66 VAL QG2 6.50
&rst
ixpk= 0, nxpk= 0, iat= 446, -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr2=1059,1060,1061,
&end
#
# 66 VAL HA 66 VAL QG2 4.22
&rst
ixpk= 0, nxpk= 0, iat=1051, -1, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
igr2=1059,1060,1061,
&end
#
# 66 VAL QG2 80 CYS HB2 5.77
&rst
ixpk= 0, nxpk= 0, iat= -1,1282, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
igr1=1059,1060,1061,
&end
#
# 66 VAL QG2 68 SER H 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1082, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr1=1059,1060,1061,
&end
#
# 116 PHE QD 148 LEU QD2 5.20
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.01, r4= 7.51,
igr1=1871,1879,
igr2=2376,2377,2378,
&end
#
# 148 LEU H 148 LEU QD2 4.74
&rst
ixpk= 0, nxpk= 0, iat=2363, -1, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
igr2=2376,2377,2378,
&end
#
# 139 PHE QE 148 LEU QD2 4.36
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
igr1=2245,2249,
igr2=2376,2377,2378,
&end
#
# 145 ALA HA 148 LEU QD2 5.20
&rst
ixpk= 0, nxpk= 0, iat=2327, -1, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
igr2=2376,2377,2378,
&end
#
# 148 LEU HB2 148 LEU QD2 4.22
&rst
ixpk= 0, nxpk= 0, iat=2367, -1, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
igr2=2376,2377,2378,
&end
#
# 148 LEU QD2 162 ILE QG2 6.04
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.71, r4= 9.21,
igr1=2376,2377,2378,
igr2=2582,2583,2584,
&end
#
# 21 THR QG2 24 ASP HB2 4.54
&rst
ixpk= 0, nxpk= 0, iat= -1, 359, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,
igr1= 315, 316, 317,
&end
#
# 21 THR QG2 73 ILE QG2 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.37, r4= 9.87,
igr1= 315, 316, 317,
igr2=1175,1176,1177,
&end
#
# 21 THR H 21 THR QG2 2.96
&rst
ixpk= 0, nxpk= 0, iat= 309, -1, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05,
igr2= 315, 316, 317,
&end
#
# 21 THR QG2 24 ASP H 3.56
&rst
ixpk= 0, nxpk= 0, iat= -1, 355, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,
igr1= 315, 316, 317,
&end
#
# 21 THR QG2 24 ASP HB3 4.54
&rst
ixpk= 0, nxpk= 0, iat= -1, 360, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,
igr1= 315, 316, 317,
&end
#
# 21 THR QG2 22 GLU H 3.02
&rst
ixpk= 0, nxpk= 0, iat= -1, 323, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13,
igr1= 315, 316, 317,
&end
#
# 21 THR QG2 26 LYS H 5.78
&rst
ixpk= 0, nxpk= 0, iat= -1, 386, r1= 1.30, r2= 1.80, r3= 6.94, r4= 7.44,
igr1= 315, 316, 317,
&end
#
# 21 THR QG2 23 GLN H 3.45
&rst
ixpk= 0, nxpk= 0, iat= -1, 338, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,
igr1= 315, 316, 317,
&end
#
# 21 THR QG2 25 LEU H 4.11
&rst
ixpk= 0, nxpk= 0, iat= -1, 367, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
igr1= 315, 316, 317,
&end
#
# 21 THR QG2 24 ASP HA 4.02
&rst
ixpk= 0, nxpk= 0, iat= -1, 357, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
igr1= 315, 316, 317,
&end
#
# 20 THR HA 21 THR QG2 4.36
&rst
ixpk= 0, nxpk= 0, iat= 297, -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr2= 315, 316, 317,
&end
#
# 21 THR QG2 22 GLU HA 4.19
&rst
ixpk= 0, nxpk= 0, iat= -1, 325, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
igr1= 315, 316, 317,
&end
#
# 21 THR QG2 23 GLN HB3 3.40
&rst
ixpk= 0, nxpk= 0, iat= -1, 343, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,
igr1= 315, 316, 317,
&end
#
# 108 THR QG2 109 GLU H 3.07
&rst
ixpk= 0, nxpk= 0, iat= -1,1743, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19,
igr1=1735,1736,1737,
&end
#
# 108 THR QG2 113 ARG H 5.70
&rst
ixpk= 0, nxpk= 0, iat= -1,1804, r1= 1.30, r2= 1.80, r3= 6.85, r4= 7.35,
igr1=1735,1736,1737,
&end
#
# 108 THR QG2 110 ASP H 3.25
&rst
ixpk= 0, nxpk= 0, iat= -1,1758, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40,
igr1=1735,1736,1737,
&end
#
# 108 THR H 108 THR QG2 2.87
&rst
ixpk= 0, nxpk= 0, iat=1729, -1, r1= 1.30, r2= 1.80, r3= 3.45, r4= 3.95,
igr2=1735,1736,1737,
&end
#
# 108 THR HA 108 THR QG2 3.22
&rst
ixpk= 0, nxpk= 0, iat=1731, -1, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,
igr2=1735,1736,1737,
&end
#
# 108 THR QG2 109 GLU HA 4.41
&rst
ixpk= 0, nxpk= 0, iat= -1,1745, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr1=1735,1736,1737,
&end
#
# 108 THR QG2 110 ASP HB2 4.37
&rst
ixpk= 0, nxpk= 0, iat= -1,1762, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
igr1=1735,1736,1737,
&end
#
# 108 THR QG2 110 ASP HB3 4.37
&rst
ixpk= 0, nxpk= 0, iat= -1,1763, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
igr1=1735,1736,1737,
&end
#
# 108 THR QG2 109 GLU HG3 4.17
&rst
ixpk= 0, nxpk= 0, iat= -1,1751, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
igr1=1735,1736,1737,
&end
#
# 108 THR QG2 109 GLU HB2 3.53
&rst
ixpk= 0, nxpk= 0, iat= -1,1747, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
igr1=1735,1736,1737,
&end
#
# 108 THR QG2 111 GLU HB2 3.53
&rst
ixpk= 0, nxpk= 0, iat= -1,1774, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
igr1=1735,1736,1737,
&end
#
# 107 MET HB2 108 THR QG2 4.66
&rst
ixpk= 0, nxpk= 0, iat=1716, -1, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
igr2=1735,1736,1737,
&end
#
# 138 THR QG2 139 PHE H 3.32
&rst
ixpk= 0, nxpk= 0, iat= -1,2235, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,
igr1=2227,2228,2229,
&end
#
# 123 MET H 138 THR QG2 3.75
&rst
ixpk= 0, nxpk= 0, iat=1967, -1, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
igr2=2227,2228,2229,
&end
#
# 97 LYS H 138 THR QG2 4.41
&rst
ixpk= 0, nxpk= 0, iat=1555, -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr2=2227,2228,2229,
&end
#
# 138 THR QG2 139 PHE QD 5.01
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.75, r4= 7.25,
igr1=2227,2228,2229,
igr2=2243,2251,
&end
#
# 97 LYS HA 138 THR QG2 3.81
&rst
ixpk= 0, nxpk= 0, iat=1557, -1, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
igr2=2227,2228,2229,
&end
#
# 96 ARG QD 138 THR QG2 4.09
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
igr1=1541,1542,
igr2=2227,2228,2229,
&end
#
# 96 ARG HB2 138 THR QG2 3.63
&rst
ixpk= 0, nxpk= 0, iat=1535, -1, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,
igr2=2227,2228,2229,
&end
#
# 138 THR H 138 THR QG2 3.82
&rst
ixpk= 0, nxpk= 0, iat=2221, -1, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
igr2=2227,2228,2229,
&end
#
# 138 THR HA 138 THR QG2 3.17
&rst
ixpk= 0, nxpk= 0, iat=2223, -1, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,
igr2=2227,2228,2229,
&end
#
# 138 THR QG2 140 ALA HA 4.36
&rst
ixpk= 0, nxpk= 0, iat= -1,2257, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr1=2227,2228,2229,
&end
#
# 96 ARG HA 138 THR QG2 5.14
&rst
ixpk= 0, nxpk= 0, iat=1533, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2=2227,2228,2229,
&end
#
# 138 THR QG2 139 PHE HB3 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2240, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr1=2227,2228,2229,
&end
#
# 123 MET HB3 138 THR QG2 3.32
&rst
ixpk= 0, nxpk= 0, iat=1972, -1, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,
igr2=2227,2228,2229,
&end
#
# 125 VAL QG2 126 PHE H 5.23
&rst
ixpk= 0, nxpk= 0, iat= -1,2012, r1= 1.30, r2= 1.80, r3= 6.28, r4= 6.78,
igr1=2006,2007,2008,
&end
#
# 112 LEU H 125 VAL QG2 5.41
&rst
ixpk= 0, nxpk= 0, iat=1785, -1, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
igr2=2006,2007,2008,
&end
#
# 125 VAL H 125 VAL QG2 5.02
&rst
ixpk= 0, nxpk= 0, iat=1996, -1, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
igr2=2006,2007,2008,
&end
#
# 125 VAL HA 125 VAL QG2 4.24
&rst
ixpk= 0, nxpk= 0, iat=1998, -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
igr2=2006,2007,2008,
&end
#
# 112 LEU HB2 125 VAL QG2 4.59
&rst
ixpk= 0, nxpk= 0, iat=1789, -1, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
igr2=2006,2007,2008,
&end
#
# 13 VAL H 13 VAL QG1 5.00
&rst
ixpk= 0, nxpk= 0, iat= 174, -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr2= 180, 181, 182,
&end
#
# 13 VAL QG1 29 PHE QE 4.72
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
igr1= 180, 181, 182,
igr2= 454, 458,
&end
#
# 13 VAL QG1 80 CYS HA 5.61
&rst
ixpk= 0, nxpk= 0, iat= -1,1280, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
igr1= 180, 181, 182,
&end
#
# 13 VAL HA 13 VAL QG1 4.31
&rst
ixpk= 0, nxpk= 0, iat= 176, -1, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
igr2= 180, 181, 182,
&end
#
# 100 VAL QG1 116 PHE HZ 5.04
&rst
ixpk= 0, nxpk= 0, iat= -1,1875, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
igr1=1619,1620,1621,
&end
#
# 100 VAL QG1 162 ILE HA 5.57
&rst
ixpk= 0, nxpk= 0, iat= -1,2578, r1= 1.30, r2= 1.80, r3= 6.69, r4= 7.19,
igr1=1619,1620,1621,
&end
#
# 100 VAL QG1 162 ILE QD1 5.22
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.53, r4= 8.03,
igr1=1619,1620,1621,
igr2=2589,2590,2591,
&end
#
# 100 VAL QG1 116 PHE QE 5.48
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=1619,1620,1621,
igr2=1873,1877,
&end
#
# 100 VAL HA 100 VAL QG1 4.47
&rst
ixpk= 0, nxpk= 0, iat=1615, -1, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr2=1619,1620,1621,
&end
#
# 100 VAL QG1 155 ILE QD1 6.14
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.86, r4= 9.36,
igr1=1619,1620,1621,
igr2=2478,2479,2480,
&end
#
# 98 VAL H 137 VAL QG1 5.88
&rst
ixpk= 0, nxpk= 0, iat=1577, -1, r1= 1.30, r2= 1.80, r3= 7.06, r4= 7.56,
igr2=2211,2212,2213,
&end
#
# 137 VAL HA 137 VAL QG1 4.19
&rst
ixpk= 0, nxpk= 0, iat=2207, -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
igr2=2211,2212,2213,
&end
#
# 137 VAL H 137 VAL QG1 5.02
&rst
ixpk= 0, nxpk= 0, iat=2205, -1, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
igr2=2211,2212,2213,
&end
#
# 116 PHE QD 137 VAL QG1 4.46
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51,
igr1=1871,1879,
igr2=2211,2212,2213,
&end
#
# 116 PHE QE 137 VAL QG1 5.78
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.79, r4= 8.29,
igr1=1873,1877,
igr2=2211,2212,2213,
&end
#
# 113 ARG HA 137 VAL QG1 5.91
&rst
ixpk= 0, nxpk= 0, iat=1806, -1, r1= 1.30, r2= 1.80, r3= 7.10, r4= 7.60,
igr2=2211,2212,2213,
&end
#
# 116 PHE HB2 137 VAL QG1 5.78
&rst
ixpk= 0, nxpk= 0, iat=1867, -1, r1= 1.30, r2= 1.80, r3= 6.94, r4= 7.44,
igr2=2211,2212,2213,
&end
#
# 116 PHE HB3 137 VAL QG1 5.84
&rst
ixpk= 0, nxpk= 0, iat=1868, -1, r1= 1.30, r2= 1.80, r3= 7.01, r4= 7.51,
igr2=2211,2212,2213,
&end
#
# 112 LEU HB3 137 VAL QG1 5.44
&rst
ixpk= 0, nxpk= 0, iat=1790, -1, r1= 1.30, r2= 1.80, r3= 6.53, r4= 7.03,
igr2=2211,2212,2213,
&end
#
# 55 VAL QG1 57 PHE H 6.28
&rst
ixpk= 0, nxpk= 0, iat= -1, 895, r1= 1.30, r2= 1.80, r3= 7.54, r4= 8.04,
igr1= 861, 862, 863,
&end
#
# 44 LEU H 46 THR QG2 4.29
&rst
ixpk= 0, nxpk= 0, iat= 688, -1, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
igr2= 735, 736, 737,
&end
#
# 43 ASP H 46 THR QG2 5.54
&rst
ixpk= 0, nxpk= 0, iat= 676, -1, r1= 1.30, r2= 1.80, r3= 6.65, r4= 7.15,
igr2= 735, 736, 737,
&end
#
# 45 LYS H 46 THR QG2 3.74
&rst
ixpk= 0, nxpk= 0, iat= 707, -1, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
igr2= 735, 736, 737,
&end
#
# 46 THR QG2 47 GLY H 3.43
&rst
ixpk= 0, nxpk= 0, iat= -1, 743, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
igr1= 735, 736, 737,
&end
#
# 46 THR H 46 THR QG2 2.78
&rst
ixpk= 0, nxpk= 0, iat= 729, -1, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84,
igr2= 735, 736, 737,
&end
#
# 31 THR QG2 32 PHE H 3.11
&rst
ixpk= 0, nxpk= 0, iat= -1, 489, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23,
igr1= 481, 482, 483,
&end
#
# 31 THR H 31 THR QG2 2.59
&rst
ixpk= 0, nxpk= 0, iat= 475, -1, r1= 1.30, r2= 1.80, r3= 3.11, r4= 3.61,
igr2= 481, 482, 483,
&end
#
# 30 SER HA 31 THR QG2 4.85
&rst
ixpk= 0, nxpk= 0, iat= 466, -1, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32,
igr2= 481, 482, 483,
&end
#
# 43 ASP HA 46 THR QG2 4.72
&rst
ixpk= 0, nxpk= 0, iat= 678, -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
igr2= 735, 736, 737,
&end
#
# 43 ASP HB2 46 THR QG2 3.93
&rst
ixpk= 0, nxpk= 0, iat= 680, -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
igr2= 735, 736, 737,
&end
#
# 45 LYS QE 46 THR QG2 4.49
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
igr1= 720, 721,
igr2= 735, 736, 737,
&end
#
# 45 LYS HB2 46 THR QG2 3.62
&rst
ixpk= 0, nxpk= 0, iat= 711, -1, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,
igr2= 735, 736, 737,
&end
#
# 45 LYS QD 46 THR QG2 3.19
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
igr1= 717, 718,
igr2= 735, 736, 737,
&end
#
# 45 LYS HG3 46 THR QG2 3.06
&rst
ixpk= 0, nxpk= 0, iat= 715, -1, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,
igr2= 735, 736, 737,
&end
#
# 55 VAL H 55 VAL QG1 4.93
&rst
ixpk= 0, nxpk= 0, iat= 855, -1, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
igr2= 861, 862, 863,
&end
#
# 29 PHE QD 55 VAL QG1 4.61
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,
igr1= 452, 460,
igr2= 861, 862, 863,
&end
#
# 55 VAL QG1 57 PHE QE 4.49
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
igr1= 861, 862, 863,
igr2= 905, 909,
&end
#
# 55 VAL QG1 57 PHE HZ 4.84
&rst
ixpk= 0, nxpk= 0, iat= -1, 907, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
igr1= 861, 862, 863,
&end
#
# 29 PHE QE 55 VAL QG1 4.96
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.69, r4= 7.19,
igr1= 454, 458,
igr2= 861, 862, 863,
&end
#
# 55 VAL HA 55 VAL QG1 4.87
&rst
ixpk= 0, nxpk= 0, iat= 857, -1, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
igr2= 861, 862, 863,
&end
#
# 43 ASP HB3 46 THR QG2 3.93
&rst
ixpk= 0, nxpk= 0, iat= 681, -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
igr2= 735, 736, 737,
&end
#
# 31 THR QG2 62 THR QG2 5.29
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.63, r4= 8.13,
igr1= 481, 482, 483,
igr2= 986, 987, 988,
&end
#
# 21 THR HA 40 VAL QG2 5.87
&rst
ixpk= 0, nxpk= 0, iat= 311, -1, r1= 1.30, r2= 1.80, r3= 7.05, r4= 7.55,
igr2= 626, 627, 628,
&end
#
# 40 VAL HA 40 VAL QG2 4.18
&rst
ixpk= 0, nxpk= 0, iat= 618, -1, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
igr2= 626, 627, 628,
&end
#
# 64 VAL QG2 66 VAL H 5.40
&rst
ixpk= 0, nxpk= 0, iat= -1,1049, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
igr1=1021,1022,1023,
&end
#
# 64 VAL H 64 VAL QG2 3.95
&rst
ixpk= 0, nxpk= 0, iat=1011, -1, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr2=1021,1022,1023,
&end
#
# 64 VAL QG2 65 LYS H 3.93
&rst
ixpk= 0, nxpk= 0, iat= -1,1027, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
igr1=1021,1022,1023,
&end
#
# 64 VAL QG2 65 LYS HA 4.34
&rst
ixpk= 0, nxpk= 0, iat= -1,1029, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,
igr1=1021,1022,1023,
&end
#
# 61 GLU HA 64 VAL QG2 4.22
&rst
ixpk= 0, nxpk= 0, iat= 967, -1, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
igr2=1021,1022,1023,
&end
#
# 64 VAL HA 64 VAL QG2 4.24
&rst
ixpk= 0, nxpk= 0, iat=1013, -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
igr2=1021,1022,1023,
&end
#
# 64 VAL QG2 65 LYS QE 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.16, r4= 8.66,
igr1=1021,1022,1023,
igr2=1040,1041,
&end
#
# 64 VAL QG2 65 LYS QB 4.02
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr1=1021,1022,1023,
igr2=1031,1032,
&end
#
# 13 VAL QG2 53 GLY H 4.86
&rst
ixpk= 0, nxpk= 0, iat= -1, 828, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
igr1= 184, 185, 186,
&end
#
# 13 VAL QG2 29 PHE QE 4.72
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
igr1= 184, 185, 186,
igr2= 454, 458,
&end
#
# 13 VAL QG2 29 PHE HZ 4.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 456, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr1= 184, 185, 186,
&end
#
# 13 VAL QG2 80 CYS HA 5.61
&rst
ixpk= 0, nxpk= 0, iat= -1,1280, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
igr1= 184, 185, 186,
&end
#
# 13 VAL HA 13 VAL QG2 4.31
&rst
ixpk= 0, nxpk= 0, iat= 176, -1, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
igr2= 184, 185, 186,
&end
#
# 13 VAL QG2 16 LEU QQD 4.74
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.67, r4= 8.17,
igr1= 184, 185, 186,
igr2= 225, 226, 227, 229, 230, 231,
&end
#
# 160 VAL H 160 VAL QG1 4.54
&rst
ixpk= 0, nxpk= 0, iat=2543, -1, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,
igr2=2549,2550,2551,
&end
#
# 160 VAL QG1 161 HIS H 5.28
&rst
ixpk= 0, nxpk= 0, iat= -1,2559, r1= 1.30, r2= 1.80, r3= 6.34, r4= 6.84,
igr1=2549,2550,2551,
&end
#
# 115 PHE QE 160 VAL QG1 6.13
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.26, r4= 8.76,
igr1=1853,1857,
igr2=2549,2550,2551,
&end
#
# 116 PHE HZ 160 VAL QG1 6.34
&rst
ixpk= 0, nxpk= 0, iat=1875, -1, r1= 1.30, r2= 1.80, r3= 7.61, r4= 8.11,
igr2=2549,2550,2551,
&end
#
# 160 VAL HA 160 VAL QG1 4.58
&rst
ixpk= 0, nxpk= 0, iat=2545, -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
igr2=2549,2550,2551,
&end
#
# 155 ILE HA 160 VAL QG1 6.40
&rst
ixpk= 0, nxpk= 0, iat=2467, -1, r1= 1.30, r2= 1.80, r3= 7.69, r4= 8.19,
igr2=2549,2550,2551,
&end
#
# 116 PHE QE 160 VAL QG1 5.93
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.99, r4= 8.49,
igr1=1873,1877,
igr2=2549,2550,2551,
&end
#
# 100 VAL QG2 116 PHE QE 5.48
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.39, r4= 7.89,
igr1=1623,1624,1625,
igr2=1873,1877,
&end
#
# 100 VAL HA 100 VAL QG2 4.47
&rst
ixpk= 0, nxpk= 0, iat=1615, -1, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr2=1623,1624,1625,
&end
#
# 100 VAL QG2 155 ILE QD1 6.14
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.86, r4= 9.36,
igr1=1623,1624,1625,
igr2=2478,2479,2480,
&end
#
# 100 VAL QG2 116 PHE HZ 5.04
&rst
ixpk= 0, nxpk= 0, iat= -1,1875, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
igr1=1623,1624,1625,
&end
#
# 100 VAL QG2 162 ILE HA 5.57
&rst
ixpk= 0, nxpk= 0, iat= -1,2578, r1= 1.30, r2= 1.80, r3= 6.69, r4= 7.19,
igr1=1623,1624,1625,
&end
#
# 26 LYS H 38 VAL QG2 3.84
&rst
ixpk= 0, nxpk= 0, iat= 386, -1, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
igr2= 593, 594, 595,
&end
#
# 38 VAL H 38 VAL QG2 4.35
&rst
ixpk= 0, nxpk= 0, iat= 583, -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
igr2= 593, 594, 595,
&end
#
# 28 TYR H 38 VAL QG2 6.50
&rst
ixpk= 0, nxpk= 0, iat= 423, -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr2= 593, 594, 595,
&end
#
# 29 PHE QD 38 VAL QG2 5.51
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.43, r4= 7.93,
igr1= 452, 460,
igr2= 593, 594, 595,
&end
#
# 38 VAL HA 38 VAL QG2 4.32
&rst
ixpk= 0, nxpk= 0, iat= 585, -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
igr2= 593, 594, 595,
&end
#
# 37 MET HA 38 VAL QG2 5.06
&rst
ixpk= 0, nxpk= 0, iat= 568, -1, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
igr2= 593, 594, 595,
&end
#
# 23 GLN HA 38 VAL QG2 5.79
&rst
ixpk= 0, nxpk= 0, iat= 340, -1, r1= 1.30, r2= 1.80, r3= 6.95, r4= 7.45,
igr2= 593, 594, 595,
&end
#
# 26 LYS HB3 38 VAL QG2 3.83
&rst
ixpk= 0, nxpk= 0, iat= 391, -1, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
igr2= 593, 594, 595,
&end
#
# 137 VAL QG2 138 THR H 5.52
&rst
ixpk= 0, nxpk= 0, iat= -1,2221, r1= 1.30, r2= 1.80, r3= 6.63, r4= 7.13,
igr1=2215,2216,2217,
&end
#
# 116 PHE QD 137 VAL QG2 4.46
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51,
igr1=1871,1879,
igr2=2215,2216,2217,
&end
#
# 137 VAL HA 137 VAL QG2 4.19
&rst
ixpk= 0, nxpk= 0, iat=2207, -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
igr2=2215,2216,2217,
&end
#
# 113 ARG HA 137 VAL QG2 5.91
&rst
ixpk= 0, nxpk= 0, iat=1806, -1, r1= 1.30, r2= 1.80, r3= 7.10, r4= 7.60,
igr2=2215,2216,2217,
&end
#
# 116 PHE HB2 137 VAL QG2 5.78
&rst
ixpk= 0, nxpk= 0, iat=1867, -1, r1= 1.30, r2= 1.80, r3= 6.94, r4= 7.44,
igr2=2215,2216,2217,
&end
#
# 116 PHE HB3 137 VAL QG2 5.84
&rst
ixpk= 0, nxpk= 0, iat=1868, -1, r1= 1.30, r2= 1.80, r3= 7.01, r4= 7.51,
igr2=2215,2216,2217,
&end
#
# 112 LEU HB3 137 VAL QG2 5.44
&rst
ixpk= 0, nxpk= 0, iat=1790, -1, r1= 1.30, r2= 1.80, r3= 6.53, r4= 7.03,
igr2=2215,2216,2217,
&end
#
# 140 ALA QB 142 ASP H 6.04
&rst
ixpk= 0, nxpk= 0, iat= -1,2277, r1= 1.30, r2= 1.80, r3= 7.25, r4= 7.75,
igr1=2259,2260,2261,
&end
#
# 139 PHE QD 140 ALA QB 4.31
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
igr1=2243,2251,
igr2=2259,2260,2261,
&end
#
# 96 ARG QD 140 ALA QB 4.43
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr1=1541,1542,
igr2=2259,2260,2261,
&end
#
# 139 PHE H 140 ALA QB 5.70
&rst
ixpk= 0, nxpk= 0, iat=2235, -1, r1= 1.30, r2= 1.80, r3= 6.85, r4= 7.35,
igr2=2259,2260,2261,
&end
#
# 140 ALA QB 141 ASP H 3.03
&rst
ixpk= 0, nxpk= 0, iat= -1,2265, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
igr1=2259,2260,2261,
&end
#
# 140 ALA H 140 ALA QB 2.68
&rst
ixpk= 0, nxpk= 0, iat=2255, -1, r1= 1.30, r2= 1.80, r3= 3.22, r4= 3.72,
igr2=2259,2260,2261,
&end
#
# 139 PHE HA 140 ALA QB 4.40
&rst
ixpk= 0, nxpk= 0, iat=2237, -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
igr2=2259,2260,2261,
&end
#
# 140 ALA QB 141 ASP HA 4.71
&rst
ixpk= 0, nxpk= 0, iat= -1,2267, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr1=2259,2260,2261,
&end
#
# 121 ASP HA 140 ALA QB 4.32
&rst
ixpk= 0, nxpk= 0, iat=1941, -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
igr2=2259,2260,2261,
&end
#
# 122 VAL HA 140 ALA QB 4.21
&rst
ixpk= 0, nxpk= 0, iat=1953, -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
igr2=2259,2260,2261,
&end
#
# 139 PHE HB3 140 ALA QB 4.36
&rst
ixpk= 0, nxpk= 0, iat=2240, -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr2=2259,2260,2261,
&end
#
# 123 MET HG2 140 ALA QB 3.30
&rst
ixpk= 0, nxpk= 0, iat=1974, -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
igr2=2259,2260,2261,
&end
#
# 138 THR QG2 140 ALA QB 5.17
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.46, r4= 7.96,
igr1=2227,2228,2229,
igr2=2259,2260,2261,
&end
#
# 140 ALA QB 144 ILE QD1 4.74
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.84, r4= 7.34,
igr1=2259,2260,2261,
igr2=2319,2320,2321,
&end
#
# 139 PHE H 145 ALA QB 4.51
&rst
ixpk= 0, nxpk= 0, iat=2235, -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr2=2329,2330,2331,
&end
#
# 143 GLN H 145 ALA QB 5.04
&rst
ixpk= 0, nxpk= 0, iat=2289, -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
igr2=2329,2330,2331,
&end
#
# 145 ALA QB 146 GLN H 3.40
&rst
ixpk= 0, nxpk= 0, iat= -1,2335, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,
igr1=2329,2330,2331,
&end
#
# 145 ALA QB 147 SER H 4.70
&rst
ixpk= 0, nxpk= 0, iat= -1,2352, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14,
igr1=2329,2330,2331,
&end
#
# 139 PHE QD 145 ALA QB 3.27
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
igr1=2243,2251,
igr2=2329,2330,2331,
&end
#
# 139 PHE HA 145 ALA QB 5.10
&rst
ixpk= 0, nxpk= 0, iat=2237, -1, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,
igr2=2329,2330,2331,
&end
#
# 145 ALA QB 146 GLN HA 4.80
&rst
ixpk= 0, nxpk= 0, iat= -1,2337, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
igr1=2329,2330,2331,
&end
#
# 139 PHE HB2 145 ALA QB 4.52
&rst
ixpk= 0, nxpk= 0, iat=2239, -1, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
igr2=2329,2330,2331,
&end
#
# 98 VAL HB 145 ALA QB 4.28
&rst
ixpk= 0, nxpk= 0, iat=1581, -1, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
igr2=2329,2330,2331,
&end
#
# 144 ILE HB 145 ALA QB 4.02
&rst
ixpk= 0, nxpk= 0, iat=2310, -1, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
igr2=2329,2330,2331,
&end
#
# 145 ALA QB 165 ALA QB 5.41
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.80, r4= 8.30,
igr1=2329,2330,2331,
igr2=2624,2625,2626,
&end
#
# 98 VAL QG2 145 ALA QB 5.18
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.47, r4= 7.97,
igr1=1587,1588,1589,
igr2=2329,2330,2331,
&end
#
# 144 ILE QG2 145 ALA QB 5.08
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.33, r4= 7.83,
igr1=2312,2313,2314,
igr2=2329,2330,2331,
&end
#
# 96 ARG HA 145 ALA QB 3.27
&rst
ixpk= 0, nxpk= 0, iat=1533, -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
igr2=2329,2330,2331,
&end
#
# 96 ARG HB3 145 ALA QB 4.29
&rst
ixpk= 0, nxpk= 0, iat=1536, -1, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
igr2=2329,2330,2331,
&end
#
# 145 ALA QB 146 GLN QB 4.02
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr1=2329,2330,2331,
igr2=2339,2340,
&end
#
# 98 VAL QG1 145 ALA QB 5.18
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.47, r4= 7.97,
igr1=1583,1584,1585,
igr2=2329,2330,2331,
&end
#
# 141 ASP HB3 145 ALA QB 6.01
&rst
ixpk= 0, nxpk= 0, iat=2270, -1, r1= 1.30, r2= 1.80, r3= 7.22, r4= 7.72,
igr2=2329,2330,2331,
&end
#
# 142 ASP HB2 145 ALA QB 6.37
&rst
ixpk= 0, nxpk= 0, iat=2281, -1, r1= 1.30, r2= 1.80, r3= 7.65, r4= 8.15,
igr2=2329,2330,2331,
&end
#
# 4 MET H 5 ALA QB 4.79
&rst
ixpk= 0, nxpk= 0, iat= 39, -1, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
igr2= 60, 61, 62,
&end
#
# 5 ALA QB 60 TYR QD 4.25
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23,
igr1= 60, 61, 62,
igr2= 952, 961,
&end
#
# 4 MET HA 5 ALA QB 3.93
&rst
ixpk= 0, nxpk= 0, iat= 41, -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
igr2= 60, 61, 62,
&end
#
# 5 ALA QB 64 VAL QG1 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.37, r4= 9.87,
igr1= 60, 61, 62,
igr2=1017,1018,1019,
&end
#
# 5 ALA QB 60 TYR QE 4.72
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
igr1= 60, 61, 62,
igr2= 954, 959,
&end
#
# 4 MET QE 5 ALA QB 4.07
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,
igr1= 50, 51, 52,
igr2= 60, 61, 62,
&end
#
# 163 SER H 165 ALA QB 5.35
&rst
ixpk= 0, nxpk= 0, iat=2595, -1, r1= 1.30, r2= 1.80, r3= 6.43, r4= 6.93,
igr2=2624,2625,2626,
&end
#
# 98 VAL H 165 ALA QB 4.24
&rst
ixpk= 0, nxpk= 0, iat=1577, -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
igr2=2624,2625,2626,
&end
#
# 136 PHE QE 165 ALA QB 3.45
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
igr1=2195,2199,
igr2=2624,2625,2626,
&end
#
# 136 PHE QD 165 ALA QB 3.47
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
igr1=2193,2201,
igr2=2624,2625,2626,
&end
#
# 98 VAL HA 165 ALA QB 3.65
&rst
ixpk= 0, nxpk= 0, iat=1579, -1, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
igr2=2624,2625,2626,
&end
#
# 136 PHE QB 165 ALA QB 4.82
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
igr1=2189,2190,
igr2=2624,2625,2626,
&end
#
# 97 LYS QB 165 ALA QB 3.21
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,
igr1=1559,1560,
igr2=2624,2625,2626,
&end
#
# 93 LEU QD2 165 ALA QB 5.81
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.38, r4= 8.88,
igr1=1490,1491,1492,
igr2=2624,2625,2626,
&end
#
# 162 ILE QG2 165 ALA QB 6.10
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.80, r4= 9.30,
igr1=2582,2583,2584,
igr2=2624,2625,2626,
&end
#
# 55 VAL QG2 56 ARG H 5.22
&rst
ixpk= 0, nxpk= 0, iat= -1, 871, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
igr1= 865, 866, 867,
&end
#
# 55 VAL QG2 57 PHE QE 4.49
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
igr1= 865, 866, 867,
igr2= 905, 909,
&end
#
# 55 VAL QG2 57 PHE HZ 4.84
&rst
ixpk= 0, nxpk= 0, iat= -1, 907, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
igr1= 865, 866, 867,
&end
#
# 55 VAL HA 55 VAL QG2 4.87
&rst
ixpk= 0, nxpk= 0, iat= 857, -1, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
igr2= 865, 866, 867,
&end
#
# 29 PHE QD 55 VAL QG2 4.61
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,
igr1= 452, 460,
igr2= 865, 866, 867,
&end
#
# 29 PHE QE 55 VAL QG2 4.96
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.69, r4= 7.19,
igr1= 454, 458,
igr2= 865, 866, 867,
&end
#
# 98 VAL QG2 163 SER H 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2595, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr1=1587,1588,1589,
&end
#
# 97 LYS HA 98 VAL QG2 5.74
&rst
ixpk= 0, nxpk= 0, iat=1557, -1, r1= 1.30, r2= 1.80, r3= 6.89, r4= 7.39,
igr2=1587,1588,1589,
&end
#
# 98 VAL H 98 VAL QG2 4.34
&rst
ixpk= 0, nxpk= 0, iat=1577, -1, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,
igr2=1587,1588,1589,
&end
#
# 98 VAL QG2 99 PHE H 5.03
&rst
ixpk= 0, nxpk= 0, iat= -1,1593, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54,
igr1=1587,1588,1589,
&end
#
# 98 VAL QG2 139 PHE QE 4.19
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.65, r4= 6.15,
igr1=1587,1588,1589,
igr2=2245,2249,
&end
#
# 98 VAL HA 98 VAL QG2 4.47
&rst
ixpk= 0, nxpk= 0, iat=1579, -1, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr2=1587,1588,1589,
&end
#
# 151 GLU H 162 ILE QG2 5.90
&rst
ixpk= 0, nxpk= 0, iat=2400, -1, r1= 1.30, r2= 1.80, r3= 7.09, r4= 7.59,
igr2=2582,2583,2584,
&end
#
# 116 PHE QE 162 ILE QG2 4.92
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.63, r4= 7.13,
igr1=1873,1877,
igr2=2582,2583,2584,
&end
#
# 116 PHE HZ 162 ILE QG2 5.79
&rst
ixpk= 0, nxpk= 0, iat=1875, -1, r1= 1.30, r2= 1.80, r3= 6.95, r4= 7.45,
igr2=2582,2583,2584,
&end
#
# 139 PHE QE 162 ILE QG2 6.27
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.45, r4= 8.95,
igr1=2245,2249,
igr2=2582,2583,2584,
&end
#
# 162 ILE HA 162 ILE QG2 4.41
&rst
ixpk= 0, nxpk= 0, iat=2578, -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr2=2582,2583,2584,
&end
#
# 98 VAL HA 162 ILE QG2 4.80
&rst
ixpk= 0, nxpk= 0, iat=1579, -1, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
igr2=2582,2583,2584,
&end
#
# 100 VAL HA 162 ILE QG2 5.49
&rst
ixpk= 0, nxpk= 0, iat=1615, -1, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
igr2=2582,2583,2584,
&end
#
# 148 LEU HA 162 ILE QG2 6.50
&rst
ixpk= 0, nxpk= 0, iat=2365, -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr2=2582,2583,2584,
&end
#
# 149 CYS HA 162 ILE QG2 4.74
&rst
ixpk= 0, nxpk= 0, iat=2384, -1, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
igr2=2582,2583,2584,
&end
#
# 149 CYS HB2 162 ILE QG2 5.85
&rst
ixpk= 0, nxpk= 0, iat=2386, -1, r1= 1.30, r2= 1.80, r3= 7.03, r4= 7.53,
igr2=2582,2583,2584,
&end
#
# 98 VAL HB 162 ILE QG2 4.23
&rst
ixpk= 0, nxpk= 0, iat=1581, -1, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
igr2=2582,2583,2584,
&end
#
# 162 ILE QG2 162 ILE QG1 4.21
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
igr1=2582,2583,2584,
igr2=2586,2587,
&end
#
# 148 LEU QD1 162 ILE QG2 6.04
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.71, r4= 9.21,
igr1=2372,2373,2374,
igr2=2582,2583,2584,
&end
#
# 101 GLY H 162 ILE QG2 5.81
&rst
ixpk= 0, nxpk= 0, iat=1629, -1, r1= 1.30, r2= 1.80, r3= 6.98, r4= 7.48,
igr2=2582,2583,2584,
&end
#
# 107 MET QE 158 ILE HA 4.35
&rst
ixpk= 0, nxpk= 0, iat= -1,2515, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
igr1=1723,1724,1725,
&end
#
# 107 MET QE 108 THR H 4.91
&rst
ixpk= 0, nxpk= 0, iat= -1,1729, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
igr1=1723,1724,1725,
&end
#
# 107 MET H 107 MET QE 3.61
&rst
ixpk= 0, nxpk= 0, iat=1712, -1, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,
igr2=1723,1724,1725,
&end
#
# 104 THR HB 107 MET QE 4.64
&rst
ixpk= 0, nxpk= 0, iat=1675, -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
igr2=1723,1724,1725,
&end
#
# 107 MET HA 107 MET QE 4.90
&rst
ixpk= 0, nxpk= 0, iat=1714, -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
igr2=1723,1724,1725,
&end
#
# 103 CYM HA 107 MET QE 3.69
&rst
ixpk= 0, nxpk= 0, iat=1662, -1, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
igr2=1723,1724,1725,
&end
#
# 107 MET HB2 107 MET QE 3.34
&rst
ixpk= 0, nxpk= 0, iat=1716, -1, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51,
igr2=1723,1724,1725,
&end
#
# 107 MET QE 158 ILE HG13 2.65
&rst
ixpk= 0, nxpk= 0, iat= -1,2524, r1= 1.30, r2= 1.80, r3= 3.18, r4= 3.68,
igr1=1723,1724,1725,
&end
#
# 104 THR QG2 107 MET QE 3.33
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1=1677,1678,1679,
igr2=1723,1724,1725,
&end
#
# 107 MET QE 155 ILE HB 2.90
&rst
ixpk= 0, nxpk= 0, iat= -1,2469, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98,
igr1=1723,1724,1725,
&end
#
# 107 MET QE 158 ILE QG2 3.40
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,
igr1=1723,1724,1725,
igr2=2519,2520,2521,
&end
#
# 107 MET QE 155 ILE QG2 3.60
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
igr1=1723,1724,1725,
igr2=2471,2472,2473,
&end
#
# 107 MET QE 155 ILE QD1 4.01
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr1=1723,1724,1725,
igr2=2478,2479,2480,
&end
#
# 107 MET QE 160 VAL H 4.83
&rst
ixpk= 0, nxpk= 0, iat= -1,2543, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
igr1=1723,1724,1725,
&end
#
# 155 ILE HA 160 VAL QG2 6.40
&rst
ixpk= 0, nxpk= 0, iat=2467, -1, r1= 1.30, r2= 1.80, r3= 7.69, r4= 8.19,
igr2=2553,2554,2555,
&end
#
# 160 VAL H 160 VAL QG2 4.54
&rst
ixpk= 0, nxpk= 0, iat=2543, -1, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,
igr2=2553,2554,2555,
&end
#
# 160 VAL QG2 161 HIS H 5.28
&rst
ixpk= 0, nxpk= 0, iat= -1,2559, r1= 1.30, r2= 1.80, r3= 6.34, r4= 6.84,
igr1=2553,2554,2555,
&end
#
# 116 PHE QE 160 VAL QG2 5.93
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.99, r4= 8.49,
igr1=1873,1877,
igr2=2553,2554,2555,
&end
#
# 115 PHE QE 160 VAL QG2 6.13
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.26, r4= 8.76,
igr1=1853,1857,
igr2=2553,2554,2555,
&end
#
# 116 PHE HZ 160 VAL QG2 6.34
&rst
ixpk= 0, nxpk= 0, iat=1875, -1, r1= 1.30, r2= 1.80, r3= 7.61, r4= 8.11,
igr2=2553,2554,2555,
&end
#
# 160 VAL HA 160 VAL QG2 4.58
&rst
ixpk= 0, nxpk= 0, iat=2545, -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
igr2=2553,2554,2555,
&end
#
# 155 ILE QD1 160 VAL QG2 5.02
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.24, r4= 7.74,
igr1=2478,2479,2480,
igr2=2553,2554,2555,
&end
#
# 158 ILE QG2 160 VAL HA 5.86
&rst
ixpk= 0, nxpk= 0, iat= -1,2545, r1= 1.30, r2= 1.80, r3= 7.04, r4= 7.54,
igr1=2519,2520,2521,
&end
#
# 155 ILE HB 158 ILE QG2 4.85
&rst
ixpk= 0, nxpk= 0, iat=2469, -1, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32,
igr2=2519,2520,2521,
&end
#
# 158 ILE QG2 160 VAL H 5.31
&rst
ixpk= 0, nxpk= 0, iat= -1,2543, r1= 1.30, r2= 1.80, r3= 6.38, r4= 6.88,
igr1=2519,2520,2521,
&end
#
# 155 ILE H 158 ILE QG2 5.17
&rst
ixpk= 0, nxpk= 0, iat=2465, -1, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,
igr2=2519,2520,2521,
&end
#
# 158 ILE H 158 ILE QG2 4.94
&rst
ixpk= 0, nxpk= 0, iat=2513, -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr2=2519,2520,2521,
&end
#
# 158 ILE QG2 159 SER H 4.55
&rst
ixpk= 0, nxpk= 0, iat= -1,2532, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
igr1=2519,2520,2521,
&end
#
# 39 GLN HE22 158 ILE QG2 5.54
&rst
ixpk= 0, nxpk= 0, iat= 611, -1, r1= 1.30, r2= 1.80, r3= 6.65, r4= 7.15,
igr2=2519,2520,2521,
&end
#
# 158 ILE QG2 159 SER HA 5.56
&rst
ixpk= 0, nxpk= 0, iat= -1,2534, r1= 1.30, r2= 1.80, r3= 6.68, r4= 7.18,
igr1=2519,2520,2521,
&end
#
# 104 THR HB 158 ILE QG2 5.57
&rst
ixpk= 0, nxpk= 0, iat=1675, -1, r1= 1.30, r2= 1.80, r3= 6.69, r4= 7.19,
igr2=2519,2520,2521,
&end
#
# 158 ILE HA 158 ILE QG2 3.92
&rst
ixpk= 0, nxpk= 0, iat=2515, -1, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
igr2=2519,2520,2521,
&end
#
# 103 CYM HA 158 ILE QG2 4.87
&rst
ixpk= 0, nxpk= 0, iat=1662, -1, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
igr2=2519,2520,2521,
&end
#
# 158 ILE QG2 158 ILE HG13 3.81
&rst
ixpk= 0, nxpk= 0, iat= -1,2524, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
igr1=2519,2520,2521,
&end
#
# 104 THR QG2 158 ILE QG2 3.56
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
igr1=1677,1678,1679,
igr2=2519,2520,2521,
&end
#
# 155 ILE QG2 158 ILE QG2 5.80
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.37, r4= 8.87,
igr1=2471,2472,2473,
igr2=2519,2520,2521,
&end
#
# 155 ILE QD1 158 ILE QG2 5.61
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
igr1=2478,2479,2480,
igr2=2519,2520,2521,
&end
#
# 37 MET HG2 154 ILE QG2 5.53
&rst
ixpk= 0, nxpk= 0, iat= 573, -1, r1= 1.30, r2= 1.80, r3= 6.64, r4= 7.14,
igr2=2452,2453,2454,
&end
#
# 154 ILE QG2 160 VAL H 5.82
&rst
ixpk= 0, nxpk= 0, iat= -1,2543, r1= 1.30, r2= 1.80, r3= 6.99, r4= 7.49,
igr1=2452,2453,2454,
&end
#
# 154 ILE QG2 156 LYS H 4.57
&rst
ixpk= 0, nxpk= 0, iat= -1,2484, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
igr1=2452,2453,2454,
&end
#
# 154 ILE QG2 155 ILE H 4.03
&rst
ixpk= 0, nxpk= 0, iat= -1,2465, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
igr1=2452,2453,2454,
&end
#
# 154 ILE H 154 ILE QG2 4.93
&rst
ixpk= 0, nxpk= 0, iat=2446, -1, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
igr2=2452,2453,2454,
&end
#
# 154 ILE QG2 158 ILE H 4.25
&rst
ixpk= 0, nxpk= 0, iat= -1,2513, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
igr1=2452,2453,2454,
&end
#
# 115 PHE QE 154 ILE QG2 6.18
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.33, r4= 8.83,
igr1=1853,1857,
igr2=2452,2453,2454,
&end
#
# 154 ILE QG2 159 SER HA 5.08
&rst
ixpk= 0, nxpk= 0, iat= -1,2534, r1= 1.30, r2= 1.80, r3= 6.10, r4= 6.60,
igr1=2452,2453,2454,
&end
#
# 154 ILE HA 154 ILE QG2 4.04
&rst
ixpk= 0, nxpk= 0, iat=2448, -1, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
igr2=2452,2453,2454,
&end
#
# 154 ILE QG2 155 ILE HA 4.75
&rst
ixpk= 0, nxpk= 0, iat= -1,2467, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr1=2452,2453,2454,
&end
#
# 154 ILE QG2 157 GLY HA2 3.97
&rst
ixpk= 0, nxpk= 0, iat= -1,2508, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
igr1=2452,2453,2454,
&end
#
# 37 MET HG3 154 ILE QG2 5.56
&rst
ixpk= 0, nxpk= 0, iat= 574, -1, r1= 1.30, r2= 1.80, r3= 6.68, r4= 7.18,
igr2=2452,2453,2454,
&end
#
# 154 ILE QG2 154 ILE HG13 4.24
&rst
ixpk= 0, nxpk= 0, iat= -1,2457, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
igr1=2452,2453,2454,
&end
#
# 154 ILE QG2 154 ILE HG12 4.21
&rst
ixpk= 0, nxpk= 0, iat= -1,2456, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
igr1=2452,2453,2454,
&end
#
# 154 ILE QG2 155 ILE QD1 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.37, r4= 9.87,
igr1=2452,2453,2454,
igr2=2478,2479,2480,
&end
#
# 119 TYR QD 144 ILE QG2 4.33
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
igr1=1919,1928,
igr2=2312,2313,2314,
&end
#
# 139 PHE HA 144 ILE QG2 6.32
&rst
ixpk= 0, nxpk= 0, iat=2237, -1, r1= 1.30, r2= 1.80, r3= 7.59, r4= 8.09,
igr2=2312,2313,2314,
&end
#
# 120 GLY QA 144 ILE QG2 4.36
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
igr1=1934,1935,
igr2=2312,2313,2314,
&end
#
# 119 TYR HB3 144 ILE QG2 4.31
&rst
ixpk= 0, nxpk= 0, iat=1916, -1, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
igr2=2312,2313,2314,
&end
#
# 141 ASP H 144 ILE QG2 5.97
&rst
ixpk= 0, nxpk= 0, iat=2265, -1, r1= 1.30, r2= 1.80, r3= 7.17, r4= 7.67,
igr2=2312,2313,2314,
&end
#
# 119 TYR H 144 ILE QG2 5.38
&rst
ixpk= 0, nxpk= 0, iat=1911, -1, r1= 1.30, r2= 1.80, r3= 6.46, r4= 6.96,
igr2=2312,2313,2314,
&end
#
# 144 ILE H 144 ILE QG2 4.82
&rst
ixpk= 0, nxpk= 0, iat=2306, -1, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,
igr2=2312,2313,2314,
&end
#
# 139 PHE QD 144 ILE QG2 4.27
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
igr1=2243,2251,
igr2=2312,2313,2314,
&end
#
# 119 TYR HA 144 ILE QG2 5.28
&rst
ixpk= 0, nxpk= 0, iat=1913, -1, r1= 1.30, r2= 1.80, r3= 6.34, r4= 6.84,
igr2=2312,2313,2314,
&end
#
# 144 ILE HA 144 ILE QG2 3.93
&rst
ixpk= 0, nxpk= 0, iat=2308, -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
igr2=2312,2313,2314,
&end
#
# 144 ILE QG2 145 ALA HA 4.93
&rst
ixpk= 0, nxpk= 0, iat= -1,2327, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
igr1=2312,2313,2314,
&end
#
# 144 ILE QG2 144 ILE HG12 3.94
&rst
ixpk= 0, nxpk= 0, iat= -1,2316, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
igr1=2312,2313,2314,
&end
#
# 144 ILE QG2 148 LEU HB3 4.77
&rst
ixpk= 0, nxpk= 0, iat= -1,2368, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23,
igr1=2312,2313,2314,
&end
#
# 144 ILE QG2 144 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=2312,2313,2314,
igr2=2319,2320,2321,
&end
#
# 67 MET QE 82 LEU H 2.63
&rst
ixpk= 0, nxpk= 0, iat= -1,1311, r1= 1.30, r2= 1.80, r3= 3.16, r4= 3.66,
igr1=1076,1077,1078,
&end
#
# 67 MET QE 81 LYS HA 2.85
&rst
ixpk= 0, nxpk= 0, iat= -1,1291, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92,
igr1=1076,1077,1078,
&end
#
# 64 VAL HA 67 MET QE 3.02
&rst
ixpk= 0, nxpk= 0, iat=1013, -1, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13,
igr2=1076,1077,1078,
&end
#
# 67 MET HB3 67 MET QE 2.70
&rst
ixpk= 0, nxpk= 0, iat=1070, -1, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,
igr2=1076,1077,1078,
&end
#
# 67 MET QE 82 LEU HB2 2.70
&rst
ixpk= 0, nxpk= 0, iat= -1,1315, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,
igr1=1076,1077,1078,
&end
#
# 60 TYR QE 67 MET QE 5.05
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
igr1= 954, 959,
igr2=1076,1077,1078,
&end
#
# 4 MET H 4 MET QE 4.12
&rst
ixpk= 0, nxpk= 0, iat= 39, -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr2= 50, 51, 52,
&end
#
# 123 MET QE 141 ASP H 5.01
&rst
ixpk= 0, nxpk= 0, iat= -1,2265, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,
igr1=1978,1979,1980,
&end
#
# 123 MET H 123 MET QE 3.40
&rst
ixpk= 0, nxpk= 0, iat=1967, -1, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,
igr2=1978,1979,1980,
&end
#
# 123 MET QE 140 ALA H 3.72
&rst
ixpk= 0, nxpk= 0, iat= -1,2255, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
igr1=1978,1979,1980,
&end
#
# 123 MET QE 139 PHE QD 5.25
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.08, r4= 7.58,
igr1=1978,1979,1980,
igr2=2243,2251,
&end
#
# 123 MET QE 139 PHE HA 4.35
&rst
ixpk= 0, nxpk= 0, iat= -1,2237, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
igr1=1978,1979,1980,
&end
#
# 123 MET HA 123 MET QE 2.85
&rst
ixpk= 0, nxpk= 0, iat=1969, -1, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92,
igr2=1978,1979,1980,
&end
#
# 123 MET QE 140 ALA HA 3.15
&rst
ixpk= 0, nxpk= 0, iat= -1,2257, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,
igr1=1978,1979,1980,
&end
#
# 123 MET HG2 123 MET QE 2.58
&rst
ixpk= 0, nxpk= 0, iat=1974, -1, r1= 1.30, r2= 1.80, r3= 3.10, r4= 3.60,
igr2=1978,1979,1980,
&end
#
# 123 MET QE 140 ALA QB 2.49
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09,
igr1=1978,1979,1980,
igr2=2259,2260,2261,
&end
#
# 127 ILE QG2 131 PHE QE 5.22
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.04, r4= 7.54,
igr1=2038,2039,2040,
igr2=2111,2115,
&end
#
# 127 ILE QG2 134 PHE H 6.31
&rst
ixpk= 0, nxpk= 0, iat= -1,2155, r1= 1.30, r2= 1.80, r3= 7.58, r4= 8.08,
igr1=2038,2039,2040,
&end
#
# 127 ILE QG2 135 ALA HA 5.06
&rst
ixpk= 0, nxpk= 0, iat= -1,2177, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
igr1=2038,2039,2040,
&end
#
# 37 MET QE 159 SER H 3.73
&rst
ixpk= 0, nxpk= 0, iat= -1,2532, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
igr1= 577, 578, 579,
&end
#
# 37 MET H 37 MET QE 3.99
&rst
ixpk= 0, nxpk= 0, iat= 566, -1, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
igr2= 577, 578, 579,
&end
#
# 37 MET QE 55 VAL HA 3.35
&rst
ixpk= 0, nxpk= 0, iat= -1, 857, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,
igr1= 577, 578, 579,
&end
#
# 37 MET QE 56 ARG HA 4.59
&rst
ixpk= 0, nxpk= 0, iat= -1, 873, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
igr1= 577, 578, 579,
&end
#
# 37 MET QE 158 ILE HA 4.80
&rst
ixpk= 0, nxpk= 0, iat= -1,2515, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
igr1= 577, 578, 579,
&end
#
# 37 MET QE 159 SER HB3 3.99
&rst
ixpk= 0, nxpk= 0, iat= -1,2537, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
igr1= 577, 578, 579,
&end
#
# 10 ASP HB3 37 MET QE 4.41
&rst
ixpk= 0, nxpk= 0, iat= 129, -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr2= 577, 578, 579,
&end
#
# 37 MET HG2 37 MET QE 3.37
&rst
ixpk= 0, nxpk= 0, iat= 573, -1, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,
igr2= 577, 578, 579,
&end
#
# 37 MET QE 154 ILE HG12 4.51
&rst
ixpk= 0, nxpk= 0, iat= -1,2456, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr1= 577, 578, 579,
&end
#
# 37 MET QE 39 GLN H 3.70
&rst
ixpk= 0, nxpk= 0, iat= -1, 599, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
igr1= 577, 578, 579,
&end
#
# 37 MET QE 38 VAL H 3.63
&rst
ixpk= 0, nxpk= 0, iat= -1, 583, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,
igr1= 577, 578, 579,
&end
#
# 37 MET QE 56 ARG H 3.30
&rst
ixpk= 0, nxpk= 0, iat= -1, 871, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
igr1= 577, 578, 579,
&end
#
# 37 MET QE 159 SER HB2 3.99
&rst
ixpk= 0, nxpk= 0, iat= -1,2536, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
igr1= 577, 578, 579,
&end
#
# 37 MET HG3 37 MET QE 2.98
&rst
ixpk= 0, nxpk= 0, iat= 574, -1, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08,
igr2= 577, 578, 579,
&end
#
# 37 MET QE 154 ILE QD1 4.42
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.37, r4= 6.87,
igr1= 577, 578, 579,
igr2=2459,2460,2461,
&end
#
# 133 ALA QB 134 PHE H 3.74
&rst
ixpk= 0, nxpk= 0, iat= -1,2155, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
igr1=2149,2150,2151,
&end
#
# 133 ALA QB 134 PHE HA 5.02
&rst
ixpk= 0, nxpk= 0, iat= -1,2157, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
igr1=2149,2150,2151,
&end
#
# 102 ARG HA 133 ALA QB 4.10
&rst
ixpk= 0, nxpk= 0, iat=1638, -1, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
igr2=2149,2150,2151,
&end
#
# 103 CYM HB3 133 ALA QB 4.44
&rst
ixpk= 0, nxpk= 0, iat=1665, -1, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
igr2=2149,2150,2151,
&end
#
# 127 ILE QG2 136 PHE H 5.82
&rst
ixpk= 0, nxpk= 0, iat= -1,2185, r1= 1.30, r2= 1.80, r3= 6.99, r4= 7.49,
igr1=2038,2039,2040,
&end
#
# 127 ILE H 127 ILE QG2 4.92
&rst
ixpk= 0, nxpk= 0, iat=2032, -1, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41,
igr2=2038,2039,2040,
&end
#
# 127 ILE QG2 131 PHE QD 4.76
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.42, r4= 6.92,
igr1=2038,2039,2040,
igr2=2109,2117,
&end
#
# 127 ILE HA 127 ILE QG2 4.25
&rst
ixpk= 0, nxpk= 0, iat=2034, -1, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
igr2=2038,2039,2040,
&end
#
# 127 ILE QG2 128 PRO HD2 4.67
&rst
ixpk= 0, nxpk= 0, iat= -1,2052, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr1=2038,2039,2040,
&end
#
# 127 ILE QG2 128 PRO HD3 5.31
&rst
ixpk= 0, nxpk= 0, iat= -1,2053, r1= 1.30, r2= 1.80, r3= 6.38, r4= 6.88,
igr1=2038,2039,2040,
&end
#
# 127 ILE QG2 127 ILE HG13 4.24
&rst
ixpk= 0, nxpk= 0, iat= -1,2043, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
igr1=2038,2039,2040,
&end
#
# 127 ILE QG2 127 ILE QD1 3.60
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
igr1=2038,2039,2040,
igr2=2045,2046,2047,
&end
#
# 28 TYR HB3 73 ILE QG2 6.04
&rst
ixpk= 0, nxpk= 0, iat= 428, -1, r1= 1.30, r2= 1.80, r3= 7.25, r4= 7.75,
igr2=1175,1176,1177,
&end
#
# 73 ILE H 73 ILE QG2 4.89
&rst
ixpk= 0, nxpk= 0, iat=1169, -1, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,
igr2=1175,1176,1177,
&end
#
# 25 LEU HA 73 ILE QG2 4.36
&rst
ixpk= 0, nxpk= 0, iat= 369, -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr2=1175,1176,1177,
&end
#
# 73 ILE HA 73 ILE QG2 3.85
&rst
ixpk= 0, nxpk= 0, iat=1171, -1, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
igr2=1175,1176,1177,
&end
#
# 73 ILE QG2 73 ILE HG12 4.47
&rst
ixpk= 0, nxpk= 0, iat= -1,1179, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr1=1175,1176,1177,
&end
#
# 73 ILE QG2 73 ILE HG13 4.36
&rst
ixpk= 0, nxpk= 0, iat= -1,1180, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr1=1175,1176,1177,
&end
#
# 115 PHE HB3 155 ILE QD1 5.16
&rst
ixpk= 0, nxpk= 0, iat=1848, -1, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
igr2=2478,2479,2480,
&end
#
# 155 ILE QD1 160 VAL H 5.92
&rst
ixpk= 0, nxpk= 0, iat= -1,2543, r1= 1.30, r2= 1.80, r3= 7.11, r4= 7.61,
igr1=2478,2479,2480,
&end
#
# 116 PHE QD 155 ILE QD1 5.42
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.31, r4= 7.81,
igr1=1871,1879,
igr2=2478,2479,2480,
&end
#
# 116 PHE QE 155 ILE QD1 4.64
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75,
igr1=1873,1877,
igr2=2478,2479,2480,
&end
#
# 115 PHE QE 155 ILE QD1 4.36
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
igr1=1853,1857,
igr2=2478,2479,2480,
&end
#
# 116 PHE HZ 155 ILE QD1 4.74
&rst
ixpk= 0, nxpk= 0, iat=1875, -1, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
igr2=2478,2479,2480,
&end
#
# 115 PHE QD 155 ILE QD1 4.41
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
igr1=1851,1859,
igr2=2478,2479,2480,
&end
#
# 112 LEU HA 155 ILE QD1 4.88
&rst
ixpk= 0, nxpk= 0, iat=1787, -1, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
igr2=2478,2479,2480,
&end
#
# 155 ILE HA 155 ILE QD1 5.02
&rst
ixpk= 0, nxpk= 0, iat=2467, -1, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
igr2=2478,2479,2480,
&end
#
# 155 ILE QD1 160 VAL HB 5.29
&rst
ixpk= 0, nxpk= 0, iat= -1,2547, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
igr1=2478,2479,2480,
&end
#
# 112 LEU HG 155 ILE QD1 5.56
&rst
ixpk= 0, nxpk= 0, iat=1792, -1, r1= 1.30, r2= 1.80, r3= 6.68, r4= 7.18,
igr2=2478,2479,2480,
&end
#
# 155 ILE HB 155 ILE QD1 4.16
&rst
ixpk= 0, nxpk= 0, iat=2469, -1, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,
igr2=2478,2479,2480,
&end
#
# 155 ILE QD1 160 VAL QG1 5.02
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.24, r4= 7.74,
igr1=2478,2479,2480,
igr2=2549,2550,2551,
&end
#
# 155 ILE QG2 156 LYS H 4.46
&rst
ixpk= 0, nxpk= 0, iat= -1,2484, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
igr1=2471,2472,2473,
&end
#
# 115 PHE HB3 155 ILE QG2 4.80
&rst
ixpk= 0, nxpk= 0, iat=1848, -1, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
igr2=2471,2472,2473,
&end
#
# 107 MET HB2 155 ILE QG2 4.60
&rst
ixpk= 0, nxpk= 0, iat=1716, -1, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
igr2=2471,2472,2473,
&end
#
# 155 ILE QG2 156 LYS HG2 4.59
&rst
ixpk= 0, nxpk= 0, iat= -1,2491, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
igr1=2471,2472,2473,
&end
#
# 155 ILE QG2 156 LYS HG3 4.10
&rst
ixpk= 0, nxpk= 0, iat= -1,2492, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
igr1=2471,2472,2473,
&end
#
# 12 ILE QG2 12 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= 161, 162, 163,
igr2= 168, 169, 170,
&end
#
# 115 PHE QE 155 ILE QG2 5.53
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.45, r4= 7.95,
igr1=1853,1857,
igr2=2471,2472,2473,
&end
#
# 115 PHE QD 155 ILE QG2 4.64
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75,
igr1=1851,1859,
igr2=2471,2472,2473,
&end
#
# 112 LEU HA 155 ILE QG2 5.29
&rst
ixpk= 0, nxpk= 0, iat=1787, -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
igr2=2471,2472,2473,
&end
#
# 155 ILE HA 155 ILE QG2 3.79
&rst
ixpk= 0, nxpk= 0, iat=2467, -1, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,
igr2=2471,2472,2473,
&end
#
# 107 MET HG2 155 ILE QG2 5.83
&rst
ixpk= 0, nxpk= 0, iat=1719, -1, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,
igr2=2471,2472,2473,
&end
#
# 115 PHE HB2 155 ILE QG2 6.00
&rst
ixpk= 0, nxpk= 0, iat=1847, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr2=2471,2472,2473,
&end
#
# 155 ILE QG2 155 ILE QD1 3.54
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,
igr1=2471,2472,2473,
igr2=2478,2479,2480,
&end
#
# 12 ILE H 12 ILE QG2 4.84
&rst
ixpk= 0, nxpk= 0, iat= 155, -1, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
igr2= 161, 162, 163,
&end
#
# 12 ILE QG2 13 VAL H 5.07
&rst
ixpk= 0, nxpk= 0, iat= -1, 174, r1= 1.30, r2= 1.80, r3= 6.09, r4= 6.59,
igr1= 161, 162, 163,
&end
#
# 12 ILE QG2 53 GLY H 6.33
&rst
ixpk= 0, nxpk= 0, iat= -1, 828, r1= 1.30, r2= 1.80, r3= 7.60, r4= 8.10,
igr1= 161, 162, 163,
&end
#
# 12 ILE QG2 52 PHE QE 4.81
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.48, r4= 6.98,
igr1= 161, 162, 163,
igr2= 818, 822,
&end
#
# 12 ILE QG2 52 PHE QD 4.30
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
igr1= 161, 162, 163,
igr2= 816, 824,
&end
#
# 12 ILE QG2 54 PHE HZ 4.59
&rst
ixpk= 0, nxpk= 0, iat= -1, 847, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
igr1= 161, 162, 163,
&end
#
# 12 ILE HA 12 ILE QG2 4.93
&rst
ixpk= 0, nxpk= 0, iat= 157, -1, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
igr2= 161, 162, 163,
&end
#
# 72 MET QE 77 TRP HB3 4.98
&rst
ixpk= 0, nxpk= 0, iat= -1,1236, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
igr1=1163,1164,1165,
&end
#
# 72 MET QE 73 ILE HG13 5.68
&rst
ixpk= 0, nxpk= 0, iat= -1,1180, r1= 1.30, r2= 1.80, r3= 6.82, r4= 7.32,
igr1=1163,1164,1165,
&end
#
# 72 MET QE 78 CYS H 4.80
&rst
ixpk= 0, nxpk= 0, iat= -1,1255, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
igr1=1163,1164,1165,
&end
#
# 72 MET QE 77 TRP HE1 2.86
&rst
ixpk= 0, nxpk= 0, iat= -1,1241, r1= 1.30, r2= 1.80, r3= 3.43, r4= 3.93,
igr1=1163,1164,1165,
&end
#
# 72 MET QE 77 TRP H 3.13
&rst
ixpk= 0, nxpk= 0, iat= -1,1231, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,
igr1=1163,1164,1165,
&end
#
# 72 MET QE 73 ILE H 3.86
&rst
ixpk= 0, nxpk= 0, iat= -1,1169, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
igr1=1163,1164,1165,
&end
#
# 72 MET QE 75 GLY H 4.01
&rst
ixpk= 0, nxpk= 0, iat= -1,1200, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
igr1=1163,1164,1165,
&end
#
# 72 MET QE 76 ARG H 3.27
&rst
ixpk= 0, nxpk= 0, iat= -1,1207, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
igr1=1163,1164,1165,
&end
#
# 72 MET QE 77 TRP HE3 3.82
&rst
ixpk= 0, nxpk= 0, iat= -1,1250, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
igr1=1163,1164,1165,
&end
#
# 72 MET QE 77 TRP HZ3 4.18
&rst
ixpk= 0, nxpk= 0, iat= -1,1248, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
igr1=1163,1164,1165,
&end
#
# 72 MET QE 77 TRP HA 3.22
&rst
ixpk= 0, nxpk= 0, iat= -1,1233, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,
igr1=1163,1164,1165,
&end
#
# 72 MET QE 76 ARG HA 3.23
&rst
ixpk= 0, nxpk= 0, iat= -1,1209, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,
igr1=1163,1164,1165,
&end
#
# 72 MET HA 72 MET QE 2.86
&rst
ixpk= 0, nxpk= 0, iat=1154, -1, r1= 1.30, r2= 1.80, r3= 3.43, r4= 3.93,
igr2=1163,1164,1165,
&end
#
# 72 MET QE 75 GLY HA2 3.36
&rst
ixpk= 0, nxpk= 0, iat= -1,1202, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
igr1=1163,1164,1165,
&end
#
# 72 MET QE 77 TRP HB2 4.15
&rst
ixpk= 0, nxpk= 0, iat= -1,1235, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
igr1=1163,1164,1165,
&end
#
# 72 MET HG3 72 MET QE 2.50
&rst
ixpk= 0, nxpk= 0, iat=1160, -1, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,
igr2=1163,1164,1165,
&end
#
# 72 MET HB2 72 MET QE 2.77
&rst
ixpk= 0, nxpk= 0, iat=1156, -1, r1= 1.30, r2= 1.80, r3= 3.33, r4= 3.83,
igr2=1163,1164,1165,
&end
#
# 12 ILE HA 12 ILE QD1 5.12
&rst
ixpk= 0, nxpk= 0, iat= 157, -1, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
igr2= 168, 169, 170,
&end
#
# 12 ILE QD1 80 CYS HA 6.06
&rst
ixpk= 0, nxpk= 0, iat= -1,1280, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
igr1= 168, 169, 170,
&end
#
# 12 ILE QD1 52 PHE QE 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
igr1= 168, 169, 170,
igr2= 818, 822,
&end
#
# 12 ILE QD1 84 ASN HD21 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1354, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr1= 168, 169, 170,
&end
#
# 11 LEU HA 12 ILE QD1 4.75
&rst
ixpk= 0, nxpk= 0, iat= 138, -1, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr2= 168, 169, 170,
&end
#
# 12 ILE QD1 83 PRO HD2 4.98
&rst
ixpk= 0, nxpk= 0, iat= -1,1331, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
igr1= 168, 169, 170,
&end
#
# 12 ILE QD1 52 PHE HB3 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 813, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr1= 168, 169, 170,
&end
#
# 12 ILE QD1 81 LYS HE2 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1302, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr1= 168, 169, 170,
&end
#
# 12 ILE QD1 81 LYS HE3 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1303, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr1= 168, 169, 170,
&end
#
# 12 ILE QD1 83 PRO HB3 4.44
&rst
ixpk= 0, nxpk= 0, iat= -1,1338, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
igr1= 168, 169, 170,
&end
#
# 12 ILE QD1 83 PRO HG2 5.30
&rst
ixpk= 0, nxpk= 0, iat= -1,1334, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
igr1= 168, 169, 170,
&end
#
# 12 ILE QD1 81 LYS HB2 4.64
&rst
ixpk= 0, nxpk= 0, iat= -1,1293, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
igr1= 168, 169, 170,
&end
#
# 12 ILE HB 12 ILE QD1 4.25
&rst
ixpk= 0, nxpk= 0, iat= 159, -1, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
igr2= 168, 169, 170,
&end
#
# 12 ILE QD1 81 LYS HG3 4.40
&rst
ixpk= 0, nxpk= 0, iat= -1,1297, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
igr1= 168, 169, 170,
&end
#
# 12 ILE QD1 54 PHE HZ 6.19
&rst
ixpk= 0, nxpk= 0, iat= -1, 847, r1= 1.30, r2= 1.80, r3= 7.43, r4= 7.93,
igr1= 168, 169, 170,
&end
#
# 126 PHE HA 127 ILE QD1 6.03
&rst
ixpk= 0, nxpk= 0, iat=2014, -1, r1= 1.30, r2= 1.80, r3= 7.24, r4= 7.74,
igr2=2045,2046,2047,
&end
#
# 127 ILE QD1 128 PRO HD3 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2053, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr1=2045,2046,2047,
&end
#
# 127 ILE QD1 136 PHE H 5.43
&rst
ixpk= 0, nxpk= 0, iat= -1,2185, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
igr1=2045,2046,2047,
&end
#
# 127 ILE QD1 131 PHE QD 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
igr1=2045,2046,2047,
igr2=2109,2117,
&end
#
# 127 ILE HA 127 ILE QD1 4.87
&rst
ixpk= 0, nxpk= 0, iat=2034, -1, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
igr2=2045,2046,2047,
&end
#
# 109 GLU HA 127 ILE QD1 4.15
&rst
ixpk= 0, nxpk= 0, iat=1745, -1, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
igr2=2045,2046,2047,
&end
#
# 127 ILE QD1 128 PRO HD2 6.37
&rst
ixpk= 0, nxpk= 0, iat= -1,2052, r1= 1.30, r2= 1.80, r3= 7.65, r4= 8.15,
igr1=2045,2046,2047,
&end
#
# 109 GLU HG2 127 ILE QD1 4.01
&rst
ixpk= 0, nxpk= 0, iat=1750, -1, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
igr2=2045,2046,2047,
&end
#
# 109 GLU HB3 127 ILE QD1 4.94
&rst
ixpk= 0, nxpk= 0, iat=1748, -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr2=2045,2046,2047,
&end
#
# 127 ILE HB 127 ILE QD1 3.94
&rst
ixpk= 0, nxpk= 0, iat=2036, -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
igr2=2045,2046,2047,
&end
#
# 108 THR HA 127 ILE QD1 4.41
&rst
ixpk= 0, nxpk= 0, iat=1731, -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr2=2045,2046,2047,
&end
#
# 56 ARG H 154 ILE QD1 6.50
&rst
ixpk= 0, nxpk= 0, iat= 871, -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr2=2459,2460,2461,
&end
#
# 154 ILE QD1 158 ILE H 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2513, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr1=2459,2460,2461,
&end
#
# 29 PHE QD 73 ILE QD1 5.66
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.63, r4= 8.13,
igr1= 452, 460,
igr2=1182,1183,1184,
&end
#
# 71 HID HD2 73 ILE QD1 5.57
&rst
ixpk= 0, nxpk= 0, iat=1148, -1, r1= 1.30, r2= 1.80, r3= 6.69, r4= 7.19,
igr2=1182,1183,1184,
&end
#
# 29 PHE QE 73 ILE QD1 5.08
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.85, r4= 7.35,
igr1= 454, 458,
igr2=1182,1183,1184,
&end
#
# 29 PHE HZ 73 ILE QD1 5.42
&rst
ixpk= 0, nxpk= 0, iat= 456, -1, r1= 1.30, r2= 1.80, r3= 6.51, r4= 7.01,
igr2=1182,1183,1184,
&end
#
# 28 TYR QE 73 ILE QD1 4.58
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 433, 438,
igr2=1182,1183,1184,
&end
#
# 28 TYR QD 73 ILE QD1 5.27
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.10, r4= 7.60,
igr1= 431, 440,
igr2=1182,1183,1184,
&end
#
# 73 ILE QD1 78 CYS HA 6.34
&rst
ixpk= 0, nxpk= 0, iat= -1,1257, r1= 1.30, r2= 1.80, r3= 7.61, r4= 8.11,
igr1=1182,1183,1184,
&end
#
# 25 LEU HA 73 ILE QD1 4.91
&rst
ixpk= 0, nxpk= 0, iat= 369, -1, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
igr2=1182,1183,1184,
&end
#
# 73 ILE HA 73 ILE QD1 4.92
&rst
ixpk= 0, nxpk= 0, iat=1171, -1, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41,
igr2=1182,1183,1184,
&end
#
# 71 HID HB2 73 ILE QD1 4.61
&rst
ixpk= 0, nxpk= 0, iat=1138, -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
igr2=1182,1183,1184,
&end
#
# 73 ILE HB 73 ILE QD1 4.04
&rst
ixpk= 0, nxpk= 0, iat=1173, -1, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
igr2=1182,1183,1184,
&end
#
# 20 THR QG2 73 ILE QD1 5.02
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.24, r4= 7.74,
igr1= 301, 302, 303,
igr2=1182,1183,1184,
&end
#
# 73 ILE QG2 73 ILE QD1 3.57
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
igr1=1175,1176,1177,
igr2=1182,1183,1184,
&end
#
# 28 TYR H 73 ILE QD1 6.50
&rst
ixpk= 0, nxpk= 0, iat= 423, -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr2=1182,1183,1184,
&end
#
# 72 MET HA 73 ILE QD1 6.50
&rst
ixpk= 0, nxpk= 0, iat=1154, -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr2=1182,1183,1184,
&end
#
# 154 ILE QD1 157 GLY HA2 5.42
&rst
ixpk= 0, nxpk= 0, iat= -1,2508, r1= 1.30, r2= 1.80, r3= 6.51, r4= 7.01,
igr1=2459,2460,2461,
&end
#
# 36 LEU H 154 ILE QD1 6.37
&rst
ixpk= 0, nxpk= 0, iat= 547, -1, r1= 1.30, r2= 1.80, r3= 7.65, r4= 8.15,
igr2=2459,2460,2461,
&end
#
# 154 ILE H 154 ILE QD1 5.41
&rst
ixpk= 0, nxpk= 0, iat=2446, -1, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
igr2=2459,2460,2461,
&end
#
# 154 ILE QD1 157 GLY H 5.82
&rst
ixpk= 0, nxpk= 0, iat= -1,2506, r1= 1.30, r2= 1.80, r3= 6.99, r4= 7.49,
igr1=2459,2460,2461,
&end
#
# 37 MET H 154 ILE QD1 5.43
&rst
ixpk= 0, nxpk= 0, iat= 566, -1, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
igr2=2459,2460,2461,
&end
#
# 154 ILE QD1 159 SER HA 5.36
&rst
ixpk= 0, nxpk= 0, iat= -1,2534, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,
igr1=2459,2460,2461,
&end
#
# 154 ILE HA 154 ILE QD1 5.01
&rst
ixpk= 0, nxpk= 0, iat=2448, -1, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,
igr2=2459,2460,2461,
&end
#
# 36 LEU HA 154 ILE QD1 6.13
&rst
ixpk= 0, nxpk= 0, iat= 549, -1, r1= 1.30, r2= 1.80, r3= 7.36, r4= 7.86,
igr2=2459,2460,2461,
&end
#
# 56 ARG HD2 154 ILE QD1 6.34
&rst
ixpk= 0, nxpk= 0, iat= 881, -1, r1= 1.30, r2= 1.80, r3= 7.61, r4= 8.11,
igr2=2459,2460,2461,
&end
#
# 154 ILE HB 154 ILE QD1 4.06
&rst
ixpk= 0, nxpk= 0, iat=2450, -1, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
igr2=2459,2460,2461,
&end
#
# 56 ARG HD3 154 ILE QD1 6.34
&rst
ixpk= 0, nxpk= 0, iat= 882, -1, r1= 1.30, r2= 1.80, r3= 7.61, r4= 8.11,
igr2=2459,2460,2461,
&end
#
# 162 ILE QD1 163 SER H 5.09
&rst
ixpk= 0, nxpk= 0, iat= -1,2595, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
igr1=2589,2590,2591,
&end
#
# 101 GLY H 162 ILE QD1 5.19
&rst
ixpk= 0, nxpk= 0, iat=1629, -1, r1= 1.30, r2= 1.80, r3= 6.23, r4= 6.73,
igr2=2589,2590,2591,
&end
#
# 150 GLY H 162 ILE QD1 6.41
&rst
ixpk= 0, nxpk= 0, iat=2393, -1, r1= 1.30, r2= 1.80, r3= 7.70, r4= 8.20,
igr2=2589,2590,2591,
&end
#
# 99 PHE H 162 ILE QD1 6.10
&rst
ixpk= 0, nxpk= 0, iat=1593, -1, r1= 1.30, r2= 1.80, r3= 7.33, r4= 7.83,
igr2=2589,2590,2591,
&end
#
# 153 LEU H 162 ILE QD1 6.28
&rst
ixpk= 0, nxpk= 0, iat=2427, -1, r1= 1.30, r2= 1.80, r3= 7.54, r4= 8.04,
igr2=2589,2590,2591,
&end
#
# 162 ILE H 162 ILE QD1 4.84
&rst
ixpk= 0, nxpk= 0, iat=2576, -1, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
igr2=2589,2590,2591,
&end
#
# 116 PHE QD 162 ILE QD1 5.58
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.52, r4= 8.02,
igr1=1871,1879,
igr2=2589,2590,2591,
&end
#
# 116 PHE QE 162 ILE QD1 3.97
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,
igr1=1873,1877,
igr2=2589,2590,2591,
&end
#
# 116 PHE HZ 162 ILE QD1 4.04
&rst
ixpk= 0, nxpk= 0, iat=1875, -1, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
igr2=2589,2590,2591,
&end
#
# 161 HIS HA 162 ILE QD1 5.48
&rst
ixpk= 0, nxpk= 0, iat=2561, -1, r1= 1.30, r2= 1.80, r3= 6.58, r4= 7.08,
igr2=2589,2590,2591,
&end
#
# 162 ILE HA 162 ILE QD1 4.21
&rst
ixpk= 0, nxpk= 0, iat=2578, -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
igr2=2589,2590,2591,
&end
#
# 160 VAL HA 162 ILE QD1 5.83
&rst
ixpk= 0, nxpk= 0, iat=2545, -1, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,
igr2=2589,2590,2591,
&end
#
# 116 PHE HA 162 ILE QD1 6.50
&rst
ixpk= 0, nxpk= 0, iat=1865, -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr2=2589,2590,2591,
&end
#
# 100 VAL HA 162 ILE QD1 4.60
&rst
ixpk= 0, nxpk= 0, iat=1615, -1, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
igr2=2589,2590,2591,
&end
#
# 149 CYS HA 162 ILE QD1 5.96
&rst
ixpk= 0, nxpk= 0, iat=2384, -1, r1= 1.30, r2= 1.80, r3= 7.16, r4= 7.66,
igr2=2589,2590,2591,
&end
#
# 160 VAL HB 162 ILE QD1 4.35
&rst
ixpk= 0, nxpk= 0, iat=2547, -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
igr2=2589,2590,2591,
&end
#
# 162 ILE HB 162 ILE QD1 4.81
&rst
ixpk= 0, nxpk= 0, iat=2580, -1, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr2=2589,2590,2591,
&end
#
# 100 VAL QG2 162 ILE QD1 5.22
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.53, r4= 8.03,
igr1=1623,1624,1625,
igr2=2589,2590,2591,
&end
#
# 155 ILE QD1 162 ILE QD1 5.01
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.23, r4= 7.73,
igr1=2478,2479,2480,
igr2=2589,2590,2591,
&end
#
# 141 ASP HA 144 ILE QD1 5.27
&rst
ixpk= 0, nxpk= 0, iat=2267, -1, r1= 1.30, r2= 1.80, r3= 6.33, r4= 6.83,
igr2=2319,2320,2321,
&end
#
# 139 PHE HB3 144 ILE QD1 4.41
&rst
ixpk= 0, nxpk= 0, iat=2240, -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr2=2319,2320,2321,
&end
#
# 141 ASP HB2 144 ILE QD1 4.34
&rst
ixpk= 0, nxpk= 0, iat=2269, -1, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,
igr2=2319,2320,2321,
&end
#
# 141 ASP HB3 144 ILE QD1 4.50
&rst
ixpk= 0, nxpk= 0, iat=2270, -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr2=2319,2320,2321,
&end
#
# 144 ILE HB 144 ILE QD1 4.29
&rst
ixpk= 0, nxpk= 0, iat=2310, -1, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
igr2=2319,2320,2321,
&end
#
# 157 GLY HA2 158 ILE QD1 5.70
&rst
ixpk= 0, nxpk= 0, iat=2508, -1, r1= 1.30, r2= 1.80, r3= 6.85, r4= 7.35,
igr2=2526,2527,2528,
&end
#
# 155 ILE H 158 ILE QD1 6.32
&rst
ixpk= 0, nxpk= 0, iat=2465, -1, r1= 1.30, r2= 1.80, r3= 7.59, r4= 8.09,
igr2=2526,2527,2528,
&end
#
# 158 ILE QD1 159 SER H 5.12
&rst
ixpk= 0, nxpk= 0, iat= -1,2532, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
igr1=2526,2527,2528,
&end
#
# 104 THR H 158 ILE QD1 6.37
&rst
ixpk= 0, nxpk= 0, iat=1671, -1, r1= 1.30, r2= 1.80, r3= 7.65, r4= 8.15,
igr2=2526,2527,2528,
&end
#
# 104 THR HB 158 ILE QD1 5.06
&rst
ixpk= 0, nxpk= 0, iat=1675, -1, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
igr2=2526,2527,2528,
&end
#
# 158 ILE HA 158 ILE QD1 3.69
&rst
ixpk= 0, nxpk= 0, iat=2515, -1, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
igr2=2526,2527,2528,
&end
#
# 39 GLN QG 158 ILE QD1 5.59
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.54, r4= 8.04,
igr1= 606, 607,
igr2=2526,2527,2528,
&end
#
# 158 ILE HB 158 ILE QD1 4.32
&rst
ixpk= 0, nxpk= 0, iat=2517, -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
igr2=2526,2527,2528,
&end
#
# 104 THR QG2 158 ILE QD1 3.55
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
igr1=1677,1678,1679,
igr2=2526,2527,2528,
&end
#
# 39 GLN HE22 158 ILE QD1 5.25
&rst
ixpk= 0, nxpk= 0, iat= 611, -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
igr2=2526,2527,2528,
&end
#
# 100 VAL HB 134 PHE QD 5.15
&rst
ixpk= 0, nxpk= 0, iat=1617, -1, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr2=2163,2171,
&end
#
# 134 PHE QD 136 PHE QE 4.78
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,
igr1=2163,2171,
igr2=2195,2199,
&end
#
# 134 PHE HA 134 PHE QD 4.51
&rst
ixpk= 0, nxpk= 0, iat=2157, -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
igr2=2163,2171,
&end
#
# 116 PHE QD 119 TYR QD 3.86
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
igr1=1871,1879,
igr2=1919,1928,
&end
#
# 116 PHE HA 119 TYR QD 3.43
&rst
ixpk= 0, nxpk= 0, iat=1865, -1, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35,
igr2=1919,1928,
&end
#
# 118 GLN HE21 119 TYR QD 4.19
&rst
ixpk= 0, nxpk= 0, iat=1907, -1, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
igr2=1919,1928,
&end
#
# 119 TYR HA 119 TYR QD 3.16
&rst
ixpk= 0, nxpk= 0, iat=1913, -1, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05,
igr2=1919,1928,
&end
#
# 118 GLN QG 119 TYR QD 4.57
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
igr1=1901,1902,
igr2=1919,1928,
&end
#
# 115 PHE QD 119 TYR QD 5.31
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.69, r4= 7.19,
igr1=1851,1859,
igr2=1919,1928,
&end
#
# 60 TYR QD 61 GLU H 4.19
&rst
ixpk= 0, nxpk= 0, iat= -1, 965, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
igr1= 952, 961,
&end
#
# 8 THR HA 60 TYR QD 3.97
&rst
ixpk= 0, nxpk= 0, iat= 101, -1, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
igr2= 952, 961,
&end
#
# 60 TYR HA 60 TYR QD 3.34
&rst
ixpk= 0, nxpk= 0, iat= 946, -1, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,
igr2= 952, 961,
&end
#
# 60 TYR QD 61 GLU HB2 3.99
&rst
ixpk= 0, nxpk= 0, iat= -1, 969, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
igr1= 952, 961,
&end
#
# 60 TYR QD 64 VAL HB 5.57
&rst
ixpk= 0, nxpk= 0, iat= -1,1015, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75,
igr1= 952, 961,
&end
#
# 60 TYR QD 64 VAL QG2 5.56
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.49, r4= 7.99,
igr1= 952, 961,
igr2=1021,1022,1023,
&end
#
# 52 PHE QD 53 GLY H 3.86
&rst
ixpk= 0, nxpk= 0, iat= -1, 828, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,
igr1= 816, 824,
&end
#
# 52 PHE HA 52 PHE QD 4.07
&rst
ixpk= 0, nxpk= 0, iat= 810, -1, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,
igr2= 816, 824,
&end
#
# 50 LYS HB2 52 PHE QD 4.82
&rst
ixpk= 0, nxpk= 0, iat= 783, -1, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,
igr2= 816, 824,
&end
#
# 12 ILE HB 52 PHE QD 4.18
&rst
ixpk= 0, nxpk= 0, iat= 159, -1, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,
igr2= 816, 824,
&end
#
# 12 ILE QD1 52 PHE QD 5.95
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.02, r4= 8.52,
igr1= 168, 169, 170,
igr2= 816, 824,
&end
#
# 115 PHE H 116 PHE QD 4.60
&rst
ixpk= 0, nxpk= 0, iat=1843, -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
igr2=1871,1879,
&end
#
# 116 PHE QD 139 PHE QE 3.58
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,
igr1=1871,1879,
igr2=2245,2249,
&end
#
# 115 PHE QD 116 PHE QD 4.01
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
igr1=1851,1859,
igr2=1871,1879,
&end
#
# 116 PHE HA 116 PHE QD 3.71
&rst
ixpk= 0, nxpk= 0, iat=1865, -1, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
igr2=1871,1879,
&end
#
# 112 LEU HA 116 PHE QD 4.51
&rst
ixpk= 0, nxpk= 0, iat=1787, -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
igr2=1871,1879,
&end
#
# 112 LEU HB2 116 PHE QD 4.20
&rst
ixpk= 0, nxpk= 0, iat=1789, -1, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
igr2=1871,1879,
&end
#
# 29 PHE HA 32 PHE QD 3.49
&rst
ixpk= 0, nxpk= 0, iat= 446, -1, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
igr2= 497, 505,
&end
#
# 57 PHE QD 59 GLU H 5.14
&rst
ixpk= 0, nxpk= 0, iat= -1, 929, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,
igr1= 903, 911,
&end
#
# 57 PHE QD 63 GLN HB2 3.98
&rst
ixpk= 0, nxpk= 0, iat= -1, 998, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
igr1= 903, 911,
&end
#
# 32 PHE QD 65 LYS HD3 4.74
&rst
ixpk= 0, nxpk= 0, iat= -1,1038, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
igr1= 497, 505,
&end
#
# 32 PHE QD 66 VAL H 4.83
&rst
ixpk= 0, nxpk= 0, iat= -1,1049, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr1= 497, 505,
&end
#
# 99 PHE HZ 136 PHE QE 6.31
&rst
ixpk= 0, nxpk= 0, iat=1605, -1, r1= 1.30, r2= 1.80, r3= 7.08, r4= 7.58,
igr2=2195,2199,
&end
#
# 30 SER HA 32 PHE QD 5.34
&rst
ixpk= 0, nxpk= 0, iat= 466, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2= 497, 505,
&end
#
# 139 PHE QD 145 ALA HA 4.48
&rst
ixpk= 0, nxpk= 0, iat= -1,2327, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
igr1=2243,2251,
&end
#
# 139 PHE QD 144 ILE QD1 4.88
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.58, r4= 7.08,
igr1=2243,2251,
igr2=2319,2320,2321,
&end
#
# 115 PHE QE 116 PHE H 5.16
&rst
ixpk= 0, nxpk= 0, iat= -1,1863, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,
igr1=1853,1857,
&end
#
# 115 PHE QE 156 LYS H 5.88
&rst
ixpk= 0, nxpk= 0, iat= -1,2484, r1= 1.30, r2= 1.80, r3= 6.60, r4= 7.10,
igr1=1853,1857,
&end
#
# 115 PHE QE 116 PHE QD 4.41
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
igr1=1853,1857,
igr2=1871,1879,
&end
#
# 115 PHE QE 116 PHE QE 3.57
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
igr1=1853,1857,
igr2=1873,1877,
&end
#
# 115 PHE HA 115 PHE QE 5.43
&rst
ixpk= 0, nxpk= 0, iat=1845, -1, r1= 1.30, r2= 1.80, r3= 6.09, r4= 6.59,
igr2=1853,1857,
&end
#
# 115 PHE QE 155 ILE HG12 4.64
&rst
ixpk= 0, nxpk= 0, iat= -1,2475, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,
igr1=1853,1857,
&end
#
# 126 PHE HA 126 PHE QD 3.95
&rst
ixpk= 0, nxpk= 0, iat=2014, -1, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
igr2=2020,2028,
&end
#
# 32 PHE H 32 PHE QE 4.82
&rst
ixpk= 0, nxpk= 0, iat= 489, -1, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,
igr2= 499, 503,
&end
#
# 136 PHE QE 165 ALA HA 3.72
&rst
ixpk= 0, nxpk= 0, iat= -1,2622, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
igr1=2195,2199,
&end
#
# 32 PHE QE 66 VAL QG1 5.77
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
igr1= 499, 503,
igr2=1055,1056,1057,
&end
#
# 28 TYR QE 32 PHE QE 3.98
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
igr1= 433, 438,
igr2= 499, 503,
&end
#
# 99 PHE QD 136 PHE QE 4.18
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77,
igr1=1601,1609,
igr2=2195,2199,
&end
#
# 28 TYR QD 32 PHE QE 4.43
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr1= 431, 440,
igr2= 499, 503,
&end
#
# 136 PHE QE 166 GLU H 4.83
&rst
ixpk= 0, nxpk= 0, iat= -1,2630, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr1=2195,2199,
&end
#
# 13 VAL H 52 PHE QE 6.15
&rst
ixpk= 0, nxpk= 0, iat= 174, -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
igr2= 818, 822,
&end
#
# 12 ILE HB 52 PHE QE 4.64
&rst
ixpk= 0, nxpk= 0, iat= 159, -1, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,
igr2= 818, 822,
&end
#
# 50 LYS HG3 52 PHE QE 5.05
&rst
ixpk= 0, nxpk= 0, iat= 787, -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
igr2= 818, 822,
&end
#
# 29 PHE QE 73 ILE QG2 6.40
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.63, r4= 9.13,
igr1= 454, 458,
igr2=1175,1176,1177,
&end
#
# 29 PHE QE 32 PHE QE 4.74
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr1= 454, 458,
igr2= 499, 503,
&end
#
# 115 PHE QD 116 PHE HA 4.87
&rst
ixpk= 0, nxpk= 0, iat= -1,1865, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,
igr1=1851,1859,
&end
#
# 112 LEU HA 115 PHE QD 4.63
&rst
ixpk= 0, nxpk= 0, iat=1787, -1, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
igr2=1851,1859,
&end
#
# 115 PHE HA 115 PHE QD 3.67
&rst
ixpk= 0, nxpk= 0, iat=1845, -1, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
igr2=1851,1859,
&end
#
# 116 PHE QE 137 VAL QG2 5.78
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.79, r4= 8.29,
igr1=1873,1877,
igr2=2215,2216,2217,
&end
#
# 57 PHE QE 63 GLN HB2 4.61
&rst
ixpk= 0, nxpk= 0, iat= -1, 998, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67,
igr1= 905, 909,
&end
#
# 25 LEU HA 29 PHE QE 4.88
&rst
ixpk= 0, nxpk= 0, iat= 369, -1, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
igr2= 454, 458,
&end
#
# 115 PHE HZ 153 LEU HB2 4.63
&rst
ixpk= 0, nxpk= 0, iat=1855,2431, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, &end
#
# 119 TYR H 139 PHE QE 4.94
&rst
ixpk= 0, nxpk= 0, iat=1911, -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
igr2=2245,2249,
&end
#
# 139 PHE QE 145 ALA QB 4.12
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,
igr1=2245,2249,
igr2=2329,2330,2331,
&end
#
# 98 VAL QG1 139 PHE QE 4.19
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.65, r4= 6.15,
igr1=1583,1584,1585,
igr2=2245,2249,
&end
#
# 139 PHE QE 144 ILE QG2 4.85
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.54, r4= 7.04,
igr1=2245,2249,
igr2=2312,2313,2314,
&end
#
# 32 PHE QD 32 PHE HZ 4.22
&rst
ixpk= 0, nxpk= 0, iat= -1, 501, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr1= 497, 505,
&end
#
# 28 TYR QE 32 PHE HZ 4.78
&rst
ixpk= 0, nxpk= 0, iat= -1, 501, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr1= 433, 438,
&end
#
# 115 PHE QD 115 PHE HZ 4.25
&rst
ixpk= 0, nxpk= 0, iat= -1,1855, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
igr1=1851,1859,
&end
#
# 115 PHE QD 116 PHE QE 4.52
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
igr1=1851,1859,
igr2=1873,1877,
&end
#
# 29 PHE HZ 71 HID HD2 5.09
&rst
ixpk= 0, nxpk= 0, iat= 456,1148, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59, &end
#
# 29 PHE QD 29 PHE HZ 3.90
&rst
ixpk= 0, nxpk= 0, iat= -1, 456, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
igr1= 452, 460,
&end
#
# 13 VAL QG1 29 PHE HZ 4.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 456, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr1= 180, 181, 182,
&end
#
# 29 PHE HZ 66 VAL QG2 6.50
&rst
ixpk= 0, nxpk= 0, iat= 456, -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr2=1059,1060,1061,
&end
#
# 29 PHE HZ 66 VAL QG1 6.50
&rst
ixpk= 0, nxpk= 0, iat= 456, -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr2=1055,1056,1057,
&end
#
# 29 PHE QD 57 PHE HZ 3.86
&rst
ixpk= 0, nxpk= 0, iat= -1, 907, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,
igr1= 452, 460,
&end
#
# 29 PHE HB3 57 PHE HZ 4.81
&rst
ixpk= 0, nxpk= 0, iat= 449, 907, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31, &end
#
# 116 PHE H 139 PHE HZ 5.50
&rst
ixpk= 0, nxpk= 0, iat=1863,2247, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 98 VAL QG1 139 PHE HZ 6.48
&rst
ixpk= 0, nxpk= 0, iat= -1,2247, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
igr1=1583,1584,1585,
&end
#
# 116 PHE QD 139 PHE HZ 3.84
&rst
ixpk= 0, nxpk= 0, iat= -1,2247, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,
igr1=1871,1879,
&end
#
# 116 PHE HB2 139 PHE HZ 4.44
&rst
ixpk= 0, nxpk= 0, iat=1867,2247, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94, &end
#
# 116 PHE HB3 139 PHE HZ 4.66
&rst
ixpk= 0, nxpk= 0, iat=1868,2247, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16, &end
#
# 98 VAL QG2 139 PHE HZ 6.48
&rst
ixpk= 0, nxpk= 0, iat= -1,2247, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
igr1=1587,1588,1589,
&end
#
# 99 PHE QE 101 GLY HA3 5.06
&rst
ixpk= 0, nxpk= 0, iat= -1,1632, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
igr1=1603,1607,
&end
#
# 18 TRP HD1 19 LYS H 4.96
&rst
ixpk= 0, nxpk= 0, iat= 257, 273, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46, &end
#
# 18 TRP HA 18 TRP HD1 4.84
&rst
ixpk= 0, nxpk= 0, iat= 251, 257, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34, &end
#
# 18 TRP HB2 18 TRP HD1 3.47
&rst
ixpk= 0, nxpk= 0, iat= 253, 257, r1= 1.30, r2= 1.80, r3= 3.47, r4= 3.97, &end
#
# 99 PHE QE 134 PHE QD 3.43
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,
igr1=1603,1607,
igr2=2163,2171,
&end
#
# 99 PHE QE 134 PHE HA 4.46
&rst
ixpk= 0, nxpk= 0, iat= -1,2157, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
igr1=1603,1607,
&end
#
# 52 PHE QD 52 PHE HZ 4.21
&rst
ixpk= 0, nxpk= 0, iat= -1, 820, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
igr1= 816, 824,
&end
#
# 12 ILE QG2 52 PHE HZ 6.32
&rst
ixpk= 0, nxpk= 0, iat= -1, 820, r1= 1.30, r2= 1.80, r3= 7.59, r4= 8.09,
igr1= 161, 162, 163,
&end
#
# 136 PHE HZ 165 ALA QB 5.60
&rst
ixpk= 0, nxpk= 0, iat=2197, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=2624,2625,2626,
&end
#
# 52 PHE QE 54 PHE HZ 4.47
&rst
ixpk= 0, nxpk= 0, iat= -1, 847, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
igr1= 818, 822,
&end
#
# 52 PHE QD 54 PHE HZ 4.82
&rst
ixpk= 0, nxpk= 0, iat= -1, 847, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,
igr1= 816, 824,
&end
#
# 77 TRP HA 77 TRP HD1 4.73
&rst
ixpk= 0, nxpk= 0, iat=1233,1239, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, &end
#
# 76 ARG HA 77 TRP HD1 4.95
&rst
ixpk= 0, nxpk= 0, iat=1209,1239, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45, &end
#
# 77 TRP HB2 77 TRP HD1 3.37
&rst
ixpk= 0, nxpk= 0, iat=1235,1239, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87, &end
#
# 77 TRP HB3 77 TRP HD1 3.72
&rst
ixpk= 0, nxpk= 0, iat=1236,1239, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22, &end
#
# 72 MET QE 77 TRP HD1 3.36
&rst
ixpk= 0, nxpk= 0, iat= -1,1239, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
igr1=1163,1164,1165,
&end
#
# 18 TRP HH2 51 GLY HA3 4.68
&rst
ixpk= 0, nxpk= 0, iat= 264, 804, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18, &end
#
# 18 TRP HH2 51 GLY HA2 4.68
&rst
ixpk= 0, nxpk= 0, iat= 264, 803, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18, &end
#
# 72 MET H 77 TRP HH2 4.70
&rst
ixpk= 0, nxpk= 0, iat=1152,1246, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 71 HID HA 77 TRP HH2 4.99
&rst
ixpk= 0, nxpk= 0, iat=1136,1246, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49, &end
#
# 72 MET HG2 77 TRP HH2 5.49
&rst
ixpk= 0, nxpk= 0, iat=1159,1246, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99, &end
#
# 72 MET HB3 77 TRP HH2 4.25
&rst
ixpk= 0, nxpk= 0, iat=1157,1246, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75, &end
#
# 72 MET QE 77 TRP HH2 4.25
&rst
ixpk= 0, nxpk= 0, iat= -1,1246, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
igr1=1163,1164,1165,
&end
#
# 72 MET HB2 77 TRP HH2 4.47
&rst
ixpk= 0, nxpk= 0, iat=1156,1246, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97, &end
#
# 73 ILE H 77 TRP HZ3 6.00
&rst
ixpk= 0, nxpk= 0, iat=1169,1248, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 71 HID HA 77 TRP HZ3 3.70
&rst
ixpk= 0, nxpk= 0, iat=1136,1248, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20, &end
#
# 70 ARG HB2 77 TRP HZ3 4.85
&rst
ixpk= 0, nxpk= 0, iat=1114,1248, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35, &end
#
# 77 TRP HZ3 78 CYS H 5.68
&rst
ixpk= 0, nxpk= 0, iat=1248,1255, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18, &end
#
# 72 MET HA 77 TRP HZ3 4.98
&rst
ixpk= 0, nxpk= 0, iat=1154,1248, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48, &end
#
# 18 TRP HZ3 51 GLY HA3 4.79
&rst
ixpk= 0, nxpk= 0, iat= 266, 804, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29, &end
#
# 70 ARG HD3 77 TRP HE3 4.66
&rst
ixpk= 0, nxpk= 0, iat=1121,1250, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16, &end
#
# 72 MET H 77 TRP HE3 4.59
&rst
ixpk= 0, nxpk= 0, iat=1152,1250, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 77 TRP H 77 TRP HE3 4.91
&rst
ixpk= 0, nxpk= 0, iat=1231,1250, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41, &end
#
# 77 TRP HA 77 TRP HE3 3.28
&rst
ixpk= 0, nxpk= 0, iat=1233,1250, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78, &end
#
# 18 TRP HB3 18 TRP HE3 3.87
&rst
ixpk= 0, nxpk= 0, iat= 254, 268, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37, &end
#
# 70 ARG HB3 77 TRP HE3 4.59
&rst
ixpk= 0, nxpk= 0, iat=1115,1250, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 72 MET HB2 77 TRP HE3 5.08
&rst
ixpk= 0, nxpk= 0, iat=1156,1250, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58, &end
#
# 18 TRP HA 18 TRP HE3 3.82
&rst
ixpk= 0, nxpk= 0, iat= 251, 268, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32, &end
#
# 169 HIS QB 169 HIS HD2 3.72
&rst
ixpk= 0, nxpk= 0, iat= -1,2694, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
igr1=2685,2686,
&end
#
# 169 HIS HD2 170 ASN HA 5.14
&rst
ixpk= 0, nxpk= 0, iat=2694,2700, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64, &end
#
# 70 ARG H 71 HID HD2 6.06
&rst
ixpk= 0, nxpk= 0, iat=1110,1148, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56, &end
#
# 29 PHE QE 71 HID HD2 4.67
&rst
ixpk= 0, nxpk= 0, iat= -1,1148, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr1= 454, 458,
&end
#
# 28 TYR QE 71 HID HD2 4.94
&rst
ixpk= 0, nxpk= 0, iat= -1,1148, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
igr1= 433, 438,
&end
#
# 71 HID HD2 79 ASP HA 4.23
&rst
ixpk= 0, nxpk= 0, iat=1148,1268, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73, &end
#
# 70 ARG HA 71 HID HD2 3.34
&rst
ixpk= 0, nxpk= 0, iat=1112,1148, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84, &end
#
# 66 VAL HA 71 HID HD2 5.98
&rst
ixpk= 0, nxpk= 0, iat=1051,1148, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48, &end
#
# 70 ARG HB2 71 HID HD2 4.99
&rst
ixpk= 0, nxpk= 0, iat=1114,1148, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49, &end
#
# 9 SER H 60 TYR QE 5.36
&rst
ixpk= 0, nxpk= 0, iat= 113, -1, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,
igr2= 954, 959,
&end
#
# 6 SER H 60 TYR QE 5.41
&rst
ixpk= 0, nxpk= 0, iat= 66, -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
igr2= 954, 959,
&end
#
# 7 LYS H 60 TYR QE 5.88
&rst
ixpk= 0, nxpk= 0, iat= 77, -1, r1= 1.30, r2= 1.80, r3= 6.60, r4= 7.10,
igr2= 954, 959,
&end
#
# 60 TYR QE 87 GLN HE21 3.88
&rst
ixpk= 0, nxpk= 0, iat= -1,1404, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,
igr1= 954, 959,
&end
#
# 60 TYR QE 87 GLN HE22 3.88
&rst
ixpk= 0, nxpk= 0, iat= -1,1403, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,
igr1= 954, 959,
&end
#
# 8 THR HA 60 TYR QE 4.27
&rst
ixpk= 0, nxpk= 0, iat= 101, -1, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
igr2= 954, 959,
&end
#
# 60 TYR QE 87 GLN QG 3.82
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31,
igr1= 954, 959,
igr2=1398,1399,
&end
#
# 60 TYR QE 63 GLN HG2 4.47
&rst
ixpk= 0, nxpk= 0, iat= -1,1001, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
igr1= 954, 959,
&end
#
# 60 TYR QE 87 GLN HB2 4.99
&rst
ixpk= 0, nxpk= 0, iat= -1,1395, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
igr1= 954, 959,
&end
#
# 60 TYR QE 64 VAL HB 4.62
&rst
ixpk= 0, nxpk= 0, iat= -1,1015, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
igr1= 954, 959,
&end
#
# 8 THR QG2 60 TYR QE 4.62
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.23, r4= 6.73,
igr1= 105, 106, 107,
igr2= 954, 959,
&end
#
# 60 TYR QE 64 VAL QG2 5.31
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.16, r4= 7.66,
igr1= 954, 959,
igr2=1021,1022,1023,
&end
#
# 60 TYR QE 64 VAL QG1 3.95
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
igr1= 954, 959,
igr2=1017,1018,1019,
&end
#
# 28 TYR QE 71 HID HB3 4.04
&rst
ixpk= 0, nxpk= 0, iat= -1,1139, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
igr1= 433, 438,
&end
#
# 28 TYR QE 29 PHE QE 3.77
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25,
igr1= 433, 438,
igr2= 454, 458,
&end
#
# 28 TYR QE 29 PHE HZ 4.18
&rst
ixpk= 0, nxpk= 0, iat= -1, 456, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,
igr1= 433, 438,
&end
#
# 25 LEU QD1 28 TYR QE 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
igr1= 376, 377, 378,
igr2= 433, 438,
&end
#
# 25 LEU QD2 28 TYR QE 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
igr1= 380, 381, 382,
igr2= 433, 438,
&end
#
# 116 PHE QD 119 TYR QE 3.92
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
igr1=1871,1879,
igr2=1921,1926,
&end
#
# 115 PHE QE 119 TYR QE 3.19
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,
igr1=1853,1857,
igr2=1921,1926,
&end
#
# 115 PHE QD 119 TYR QE 4.32
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
igr1=1851,1859,
igr2=1921,1926,
&end
#
# 116 PHE HA 119 TYR QE 3.99
&rst
ixpk= 0, nxpk= 0, iat=1865, -1, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
igr2=1921,1926,
&end
#
# 119 TYR HA 119 TYR QE 4.67
&rst
ixpk= 0, nxpk= 0, iat=1913, -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr2=1921,1926,
&end
#
# 72 MET QE 77 TRP HZ2 3.49
&rst
ixpk= 0, nxpk= 0, iat= -1,1244, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,
igr1=1163,1164,1165,
&end
#
# 72 MET HB2 77 TRP HZ2 4.56
&rst
ixpk= 0, nxpk= 0, iat=1156,1244, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06, &end
#
# 72 MET HG2 77 TRP HZ2 6.06
&rst
ixpk= 0, nxpk= 0, iat=1159,1244, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56, &end
#
# 3 HIS HA 3 HIS QB 2.54
&rst
ixpk= 0, nxpk= 0, iat= 24, -1, r1= 1.30, r2= 1.80, r3= 2.85, r4= 3.35,
igr2= 26, 27,
&end
#
# 3 HIS QB 3 HIS HD2 3.24
&rst
ixpk= 0, nxpk= 0, iat= -1, 35, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
igr1= 26, 27,
&end
#
# 3 HIS QB 4 MET H 3.72
&rst
ixpk= 0, nxpk= 0, iat= -1, 39, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
igr1= 26, 27,
&end
#
# 3 HIS QB 4 MET QG 4.38
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
igr1= 26, 27,
igr2= 46, 47,
&end
#
# 4 MET H 4 MET QB 3.31
&rst
ixpk= 0, nxpk= 0, iat= 39, -1, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,
igr2= 43, 44,
&end
#
# 4 MET H 4 MET QG 3.39
&rst
ixpk= 0, nxpk= 0, iat= 39, -1, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,
igr2= 46, 47,
&end
#
# 4 MET HA 4 MET QB 2.55
&rst
ixpk= 0, nxpk= 0, iat= 41, -1, r1= 1.30, r2= 1.80, r3= 2.86, r4= 3.36,
igr2= 43, 44,
&end
#
# 4 MET HA 4 MET QG 3.52
&rst
ixpk= 0, nxpk= 0, iat= 41, -1, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
igr2= 46, 47,
&end
#
# 4 MET QB 4 MET QG 2.23
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 2.81, r4= 3.31,
igr1= 43, 44,
igr2= 46, 47,
&end
#
# 4 MET QG 4 MET QE 2.39
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.22, r4= 3.72,
igr1= 46, 47,
igr2= 50, 51, 52,
&end
#
# 4 MET QG 5 ALA QB 4.78
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,
igr1= 46, 47,
igr2= 60, 61, 62,
&end
#
# 5 ALA QB 6 SER QB 4.52
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.09, r4= 6.59,
igr1= 60, 61, 62,
igr2= 70, 71,
&end
#
# 6 SER H 6 SER QB 3.19
&rst
ixpk= 0, nxpk= 0, iat= 66, -1, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08,
igr2= 70, 71,
&end
#
# 6 SER QB 7 LYS H 3.65
&rst
ixpk= 0, nxpk= 0, iat= -1, 77, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,
igr1= 70, 71,
&end
#
# 6 SER QB 7 LYS HB3 5.51
&rst
ixpk= 0, nxpk= 0, iat= -1, 82, r1= 1.30, r2= 1.80, r3= 6.18, r4= 6.68,
igr1= 70, 71,
&end
#
# 6 SER QB 60 TYR HB2 5.59
&rst
ixpk= 0, nxpk= 0, iat= -1, 948, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
igr1= 70, 71,
&end
#
# 6 SER QB 60 TYR QD 3.89
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,
igr1= 70, 71,
igr2= 952, 961,
&end
#
# 6 SER QB 60 TYR QE 3.82
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31,
igr1= 70, 71,
igr2= 954, 959,
&end
#
# 6 SER QB 87 GLN QG 5.46
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.88, r4= 7.38,
igr1= 70, 71,
igr2=1398,1399,
&end
#
# 6 SER QB 87 GLN QE2 4.90
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 70, 71,
igr2=1403,1404,
&end
#
# 8 THR HA 87 GLN QE2 4.87
&rst
ixpk= 0, nxpk= 0, iat= 101, -1, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,
igr2=1403,1404,
&end
#
# 8 THR QG2 9 SER QB 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.16, r4= 8.66,
igr1= 105, 106, 107,
igr2= 117, 118,
&end
#
# 9 SER H 9 SER QB 3.61
&rst
ixpk= 0, nxpk= 0, iat= 113, -1, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,
igr2= 117, 118,
&end
#
# 9 SER H 11 LEU QQD 6.50
&rst
ixpk= 0, nxpk= 0, iat= 113, -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
igr2= 145, 146, 147, 149, 150, 151,
&end
#
# 9 SER H 56 ARG QD 5.03
&rst
ixpk= 0, nxpk= 0, iat= 113, -1, r1= 1.30, r2= 1.80, r3= 5.65, r4= 6.15,
igr2= 881, 882,
&end
#
# 9 SER H 82 LEU QQD 5.84
&rst
ixpk= 0, nxpk= 0, iat= 113, -1, r1= 1.30, r2= 1.80, r3= 7.87, r4= 8.37,
igr2=1320,1321,1322,1324,1325,1326,
&end
#
# 9 SER H 87 GLN QE2 5.26
&rst
ixpk= 0, nxpk= 0, iat= 113, -1, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
igr2=1403,1404,
&end
#
# 9 SER QB 10 ASP H 3.23
&rst
ixpk= 0, nxpk= 0, iat= -1, 124, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13,
igr1= 117, 118,
&end
#
# 9 SER QB 82 LEU QQD 4.05
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.13, r4= 6.63,
igr1= 117, 118,
igr2=1320,1321,1322,1324,1325,1326,
&end
#
# 9 SER QB 87 GLN QE2 5.46
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.88, r4= 7.38,
igr1= 117, 118,
igr2=1403,1404,
&end
#
# 10 ASP H 56 ARG QD 5.72
&rst
ixpk= 0, nxpk= 0, iat= 124, -1, r1= 1.30, r2= 1.80, r3= 6.42, r4= 6.92,
igr2= 881, 882,
&end
#
# 10 ASP H 82 LEU QQD 5.85
&rst
ixpk= 0, nxpk= 0, iat= 124, -1, r1= 1.30, r2= 1.80, r3= 7.89, r4= 8.39,
igr2=1320,1321,1322,1324,1325,1326,
&end
#
# 10 ASP HA 11 LEU QB 6.50
&rst
ixpk= 0, nxpk= 0, iat= 126, -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
igr2= 140, 141,
&end
#
# 11 LEU H 11 LEU QB 4.62
&rst
ixpk= 0, nxpk= 0, iat= 136, -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
igr2= 140, 141,
&end
#
# 11 LEU H 11 LEU QQD 4.63
&rst
ixpk= 0, nxpk= 0, iat= 136, -1, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
igr2= 145, 146, 147, 149, 150, 151,
&end
#
# 11 LEU H 55 VAL QQG 4.52
&rst
ixpk= 0, nxpk= 0, iat= 136, -1, r1= 1.30, r2= 1.80, r3= 6.09, r4= 6.59,
igr2= 861, 862, 863, 865, 866, 867,
&end
#
# 11 LEU H 56 ARG QD 5.65
&rst
ixpk= 0, nxpk= 0, iat= 136, -1, r1= 1.30, r2= 1.80, r3= 6.34, r4= 6.84,
igr2= 881, 882,
&end
#
# 11 LEU HA 11 LEU QQD 3.74
&rst
ixpk= 0, nxpk= 0, iat= 138, -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr2= 145, 146, 147, 149, 150, 151,
&end
#
# 11 LEU QB 11 LEU QQD 3.64
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
igr1= 140, 141,
igr2= 145, 146, 147, 149, 150, 151,
&end
#
# 11 LEU QB 12 ILE QD1 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
igr1= 140, 141,
igr2= 168, 169, 170,
&end
#
# 11 LEU QB 29 PHE QE 5.93
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.47, r4= 7.97,
igr1= 140, 141,
igr2= 454, 458,
&end
#
# 11 LEU QB 29 PHE HZ 6.18
&rst
ixpk= 0, nxpk= 0, iat= -1, 456, r1= 1.30, r2= 1.80, r3= 6.94, r4= 7.44,
igr1= 140, 141,
&end
#
# 11 LEU QB 55 VAL H 5.42
&rst
ixpk= 0, nxpk= 0, iat= -1, 855, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
igr1= 140, 141,
&end
#
# 11 LEU QB 55 VAL QQG 5.31
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.03, r4= 8.53,
igr1= 140, 141,
igr2= 861, 862, 863, 865, 866, 867,
&end
#
# 11 LEU QB 63 GLN HG3 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1002, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
igr1= 140, 141,
&end
#
# 11 LEU QB 66 VAL QQG 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.84, r4=10.34,
igr1= 140, 141,
igr2=1055,1056,1057,1059,1060,1061,
&end
#
# 11 LEU QB 80 CYS HB3 5.42
&rst
ixpk= 0, nxpk= 0, iat= -1,1283, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
igr1= 140, 141,
&end
#
# 11 LEU QB 83 PRO HD3 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1332, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
igr1= 140, 141,
&end
#
# 11 LEU HG 55 VAL QQG 5.26
&rst
ixpk= 0, nxpk= 0, iat= 143, -1, r1= 1.30, r2= 1.80, r3= 7.09, r4= 7.59,
igr2= 861, 862, 863, 865, 866, 867,
&end
#
# 11 LEU HG 66 VAL QQG 5.86
&rst
ixpk= 0, nxpk= 0, iat= 143, -1, r1= 1.30, r2= 1.80, r3= 7.90, r4= 8.40,
igr2=1055,1056,1057,1059,1060,1061,
&end
#
# 11 LEU HG 67 MET QG 5.87
&rst
ixpk= 0, nxpk= 0, iat= 143, -1, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
igr2=1072,1073,
&end
#
# 11 LEU HG 82 LEU QQD 4.88
&rst
ixpk= 0, nxpk= 0, iat= 143, -1, r1= 1.30, r2= 1.80, r3= 6.58, r4= 7.08,
igr2=1320,1321,1322,1324,1325,1326,
&end
#
# 11 LEU QQD 12 ILE H 4.46
&rst
ixpk= 0, nxpk= 0, iat= -1, 155, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51,
igr1= 145, 146, 147, 149, 150, 151,
&end
#
# 11 LEU QQD 12 ILE QD1 5.99
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.70, r4=10.20,
igr1= 145, 146, 147, 149, 150, 151,
igr2= 168, 169, 170,
&end
#
# 11 LEU QQD 55 VAL QQG 5.13
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.32, r4= 9.82,
igr1= 145, 146, 147, 149, 150, 151,
igr2= 861, 862, 863, 865, 866, 867,
&end
#
# 11 LEU QQD 57 PHE QD 5.17
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.82, r4= 8.32,
igr1= 145, 146, 147, 149, 150, 151,
igr2= 903, 911,
&end
#
# 11 LEU QQD 57 PHE QE 4.37
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 145, 146, 147, 149, 150, 151,
igr2= 905, 909,
&end
#
# 11 LEU QQD 63 GLN H 5.76
&rst
ixpk= 0, nxpk= 0, iat= -1, 994, r1= 1.30, r2= 1.80, r3= 7.76, r4= 8.26,
igr1= 145, 146, 147, 149, 150, 151,
&end
#
# 11 LEU QQD 63 GLN HA 4.40
&rst
ixpk= 0, nxpk= 0, iat= -1, 996, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr1= 145, 146, 147, 149, 150, 151,
&end
#
# 11 LEU QQD 63 GLN HB2 4.12
&rst
ixpk= 0, nxpk= 0, iat= -1, 998, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,
igr1= 145, 146, 147, 149, 150, 151,
&end
#
# 11 LEU QQD 63 GLN HG2 4.98
&rst
ixpk= 0, nxpk= 0, iat= -1,1001, r1= 1.30, r2= 1.80, r3= 6.71, r4= 7.21,
igr1= 145, 146, 147, 149, 150, 151,
&end
#
# 11 LEU QQD 63 GLN HG3 3.90
&rst
ixpk= 0, nxpk= 0, iat= -1,1002, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr1= 145, 146, 147, 149, 150, 151,
&end
#
# 11 LEU QQD 63 GLN HE21 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1007, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
igr1= 145, 146, 147, 149, 150, 151,
&end
#
# 11 LEU QQD 64 VAL HA 5.90
&rst
ixpk= 0, nxpk= 0, iat= -1,1013, r1= 1.30, r2= 1.80, r3= 7.95, r4= 8.45,
igr1= 145, 146, 147, 149, 150, 151,
&end
#
# 11 LEU QQD 65 LYS H 6.23
&rst
ixpk= 0, nxpk= 0, iat= -1,1027, r1= 1.30, r2= 1.80, r3= 8.40, r4= 8.90,
igr1= 145, 146, 147, 149, 150, 151,
&end
#
# 11 LEU QQD 66 VAL H 5.69
&rst
ixpk= 0, nxpk= 0, iat= -1,1049, r1= 1.30, r2= 1.80, r3= 7.67, r4= 8.17,
igr1= 145, 146, 147, 149, 150, 151,
&end
#
# 11 LEU QQD 66 VAL QQG 4.56
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.29, r4= 8.79,
igr1= 145, 146, 147, 149, 150, 151,
igr2=1055,1056,1057,1059,1060,1061,
&end
#
# 11 LEU QQD 67 MET H 4.70
&rst
ixpk= 0, nxpk= 0, iat= -1,1065, r1= 1.30, r2= 1.80, r3= 6.34, r4= 6.84,
igr1= 145, 146, 147, 149, 150, 151,
&end
#
# 11 LEU QQD 67 MET HA 5.41
&rst
ixpk= 0, nxpk= 0, iat= -1,1067, r1= 1.30, r2= 1.80, r3= 7.29, r4= 7.79,
igr1= 145, 146, 147, 149, 150, 151,
&end
#
# 11 LEU QQD 67 MET QG 4.21
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.37, r4= 6.87,
igr1= 145, 146, 147, 149, 150, 151,
igr2=1072,1073,
&end
#
# 11 LEU QD1 67 MET HG3 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1073, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr1= 145, 146, 147,
&end
#
# 11 LEU QD2 67 MET HG3 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1073, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr1= 149, 150, 151,
&end
#
# 11 LEU QQD 67 MET QE 3.45
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.59, r4= 6.09,
igr1= 145, 146, 147, 149, 150, 151,
igr2=1076,1077,1078,
&end
#
# 11 LEU QQD 80 CYS HA 5.64
&rst
ixpk= 0, nxpk= 0, iat= -1,1280, r1= 1.30, r2= 1.80, r3= 7.60, r4= 8.10,
igr1= 145, 146, 147, 149, 150, 151,
&end
#
# 11 LEU QQD 80 CYS HB2 5.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1282, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
igr1= 145, 146, 147, 149, 150, 151,
&end
#
# 11 LEU QQD 80 CYS HB3 4.30
&rst
ixpk= 0, nxpk= 0, iat= -1,1283, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
igr1= 145, 146, 147, 149, 150, 151,
&end
#
# 11 LEU QQD 81 LYS H 5.04
&rst
ixpk= 0, nxpk= 0, iat= -1,1289, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 145, 146, 147, 149, 150, 151,
&end
#
# 11 LEU QQD 82 LEU H 4.70
&rst
ixpk= 0, nxpk= 0, iat= -1,1311, r1= 1.30, r2= 1.80, r3= 6.34, r4= 6.84,
igr1= 145, 146, 147, 149, 150, 151,
&end
#
# 11 LEU QQD 82 LEU HB2 5.92
&rst
ixpk= 0, nxpk= 0, iat= -1,1315, r1= 1.30, r2= 1.80, r3= 7.98, r4= 8.48,
igr1= 145, 146, 147, 149, 150, 151,
&end
#
# 11 LEU QQD 82 LEU HB3 5.65
&rst
ixpk= 0, nxpk= 0, iat= -1,1316, r1= 1.30, r2= 1.80, r3= 7.62, r4= 8.12,
igr1= 145, 146, 147, 149, 150, 151,
&end
#
# 11 LEU QQD 82 LEU HG 5.09
&rst
ixpk= 0, nxpk= 0, iat= -1,1318, r1= 1.30, r2= 1.80, r3= 6.86, r4= 7.36,
igr1= 145, 146, 147, 149, 150, 151,
&end
#
# 11 LEU QQD 82 LEU QQD 3.87
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.03, r4= 7.53,
igr1= 145, 146, 147, 149, 150, 151,
igr2=1320,1321,1322,1324,1325,1326,
&end
#
# 11 LEU QQD 83 PRO HG3 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1335, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
igr1= 145, 146, 147, 149, 150, 151,
&end
#
# 11 LEU QQD 83 PRO HD3 5.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1332, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
igr1= 145, 146, 147, 149, 150, 151,
&end
#
# 11 LEU QQD 87 GLN QE2 6.36
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.62, r4=10.12,
igr1= 145, 146, 147, 149, 150, 151,
igr2=1403,1404,
&end
#
# 12 ILE H 12 ILE QG1 4.43
&rst
ixpk= 0, nxpk= 0, iat= 155, -1, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
igr2= 165, 166,
&end
#
# 12 ILE H 55 VAL QQG 6.23
&rst
ixpk= 0, nxpk= 0, iat= 155, -1, r1= 1.30, r2= 1.80, r3= 8.40, r4= 8.90,
igr2= 861, 862, 863, 865, 866, 867,
&end
#
# 12 ILE H 82 LEU QQD 5.51
&rst
ixpk= 0, nxpk= 0, iat= 155, -1, r1= 1.30, r2= 1.80, r3= 7.43, r4= 7.93,
igr2=1320,1321,1322,1324,1325,1326,
&end
#
# 12 ILE HA 13 VAL QQG 4.86
&rst
ixpk= 0, nxpk= 0, iat= 157, -1, r1= 1.30, r2= 1.80, r3= 6.55, r4= 7.05,
igr2= 180, 181, 182, 184, 185, 186,
&end
#
# 12 ILE HB 14 LEU QQD 4.01
&rst
ixpk= 0, nxpk= 0, iat= 159, -1, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,
igr2= 199, 200, 201, 203, 204, 205,
&end
#
# 12 ILE QG2 82 LEU QQD 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3=10.52, r4=11.02,
igr1= 161, 162, 163,
igr2=1320,1321,1322,1324,1325,1326,
&end
#
# 12 ILE QG1 13 VAL H 5.53
&rst
ixpk= 0, nxpk= 0, iat= -1, 174, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,
igr1= 165, 166,
&end
#
# 12 ILE QG1 14 LEU QQD 5.97
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.03, r4= 9.53,
igr1= 165, 166,
igr2= 199, 200, 201, 203, 204, 205,
&end
#
# 12 ILE QG1 52 PHE QD 5.69
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.17, r4= 7.67,
igr1= 165, 166,
igr2= 816, 824,
&end
#
# 12 ILE QG1 81 LYS HB2 5.86
&rst
ixpk= 0, nxpk= 0, iat= -1,1293, r1= 1.30, r2= 1.80, r3= 6.58, r4= 7.08,
igr1= 165, 166,
&end
#
# 12 ILE QG1 81 LYS HG3 5.13
&rst
ixpk= 0, nxpk= 0, iat= -1,1297, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
igr1= 165, 166,
&end
#
# 12 ILE QD1 14 LEU QQD 5.61
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
igr1= 168, 169, 170,
igr2= 199, 200, 201, 203, 204, 205,
&end
#
# 12 ILE QD1 81 LYS QE 5.66
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.63, r4= 8.13,
igr1= 168, 169, 170,
igr2=1302,1303,
&end
#
# 12 ILE QD1 82 LEU QQD 6.36
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3=10.30, r4=10.80,
igr1= 168, 169, 170,
igr2=1320,1321,1322,1324,1325,1326,
&end
#
# 13 VAL H 13 VAL QQG 4.17
&rst
ixpk= 0, nxpk= 0, iat= 174, -1, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
igr2= 180, 181, 182, 184, 185, 186,
&end
#
# 13 VAL H 14 LEU QQD 4.49
&rst
ixpk= 0, nxpk= 0, iat= 174, -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
igr2= 199, 200, 201, 203, 204, 205,
&end
#
# 13 VAL H 54 PHE QB 6.27
&rst
ixpk= 0, nxpk= 0, iat= 174, -1, r1= 1.30, r2= 1.80, r3= 7.04, r4= 7.54,
igr2= 839, 840,
&end
#
# 13 VAL H 55 VAL QQG 6.16
&rst
ixpk= 0, nxpk= 0, iat= 174, -1, r1= 1.30, r2= 1.80, r3= 8.30, r4= 8.80,
igr2= 861, 862, 863, 865, 866, 867,
&end
#
# 13 VAL HB 14 LEU QQD 6.50
&rst
ixpk= 0, nxpk= 0, iat= 178, -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
igr2= 199, 200, 201, 203, 204, 205,
&end
#
# 13 VAL HB 55 VAL QQG 6.33
&rst
ixpk= 0, nxpk= 0, iat= 178, -1, r1= 1.30, r2= 1.80, r3= 8.53, r4= 9.03,
igr2= 861, 862, 863, 865, 866, 867,
&end
#
# 13 VAL QQG 14 LEU H 4.62
&rst
ixpk= 0, nxpk= 0, iat= -1, 190, r1= 1.30, r2= 1.80, r3= 6.23, r4= 6.73,
igr1= 180, 181, 182, 184, 185, 186,
&end
#
# 13 VAL QQG 14 LEU QB 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.84, r4=10.34,
igr1= 180, 181, 182, 184, 185, 186,
igr2= 194, 195,
&end
#
# 13 VAL QQG 15 GLY H 6.12
&rst
ixpk= 0, nxpk= 0, iat= -1, 209, r1= 1.30, r2= 1.80, r3= 8.25, r4= 8.75,
igr1= 180, 181, 182, 184, 185, 186,
&end
#
# 13 VAL QQG 16 LEU H 5.23
&rst
ixpk= 0, nxpk= 0, iat= -1, 216, r1= 1.30, r2= 1.80, r3= 7.05, r4= 7.55,
igr1= 180, 181, 182, 184, 185, 186,
&end
#
# 13 VAL QQG 16 LEU HA 5.42
&rst
ixpk= 0, nxpk= 0, iat= -1, 218, r1= 1.30, r2= 1.80, r3= 7.31, r4= 7.81,
igr1= 180, 181, 182, 184, 185, 186,
&end
#
# 13 VAL QQG 16 LEU QB 6.30
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.53, r4=10.03,
igr1= 180, 181, 182, 184, 185, 186,
igr2= 220, 221,
&end
#
# 13 VAL QQG 29 PHE QD 5.86
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.87, r4= 9.37,
igr1= 180, 181, 182, 184, 185, 186,
igr2= 452, 460,
&end
#
# 13 VAL QQG 29 PHE QE 3.86
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
igr1= 180, 181, 182, 184, 185, 186,
igr2= 454, 458,
&end
#
# 13 VAL QQG 29 PHE HZ 3.96
&rst
ixpk= 0, nxpk= 0, iat= -1, 456, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr1= 180, 181, 182, 184, 185, 186,
&end
#
# 13 VAL QQG 52 PHE HA 5.64
&rst
ixpk= 0, nxpk= 0, iat= -1, 810, r1= 1.30, r2= 1.80, r3= 7.60, r4= 8.10,
igr1= 180, 181, 182, 184, 185, 186,
&end
#
# 13 VAL QQG 53 GLY H 4.34
&rst
ixpk= 0, nxpk= 0, iat= -1, 828, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
igr1= 180, 181, 182, 184, 185, 186,
&end
#
# 13 VAL QQG 54 PHE H 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 835, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
igr1= 180, 181, 182, 184, 185, 186,
&end
#
# 13 VAL QQG 54 PHE HA 4.94
&rst
ixpk= 0, nxpk= 0, iat= -1, 837, r1= 1.30, r2= 1.80, r3= 6.66, r4= 7.16,
igr1= 180, 181, 182, 184, 185, 186,
&end
#
# 13 VAL QQG 55 VAL H 4.74
&rst
ixpk= 0, nxpk= 0, iat= -1, 855, r1= 1.30, r2= 1.80, r3= 6.39, r4= 6.89,
igr1= 180, 181, 182, 184, 185, 186,
&end
#
# 13 VAL QQG 55 VAL HA 5.91
&rst
ixpk= 0, nxpk= 0, iat= -1, 857, r1= 1.30, r2= 1.80, r3= 7.97, r4= 8.47,
igr1= 180, 181, 182, 184, 185, 186,
&end
#
# 13 VAL QQG 55 VAL HB 4.67
&rst
ixpk= 0, nxpk= 0, iat= -1, 859, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
igr1= 180, 181, 182, 184, 185, 186,
&end
#
# 13 VAL QQG 55 VAL QQG 4.17
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.58, r4= 8.08,
igr1= 180, 181, 182, 184, 185, 186,
igr2= 861, 862, 863, 865, 866, 867,
&end
#
# 13 VAL QQG 71 HID HB2 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1138, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
igr1= 180, 181, 182, 184, 185, 186,
&end
#
# 13 VAL QQG 71 HID HD2 6.21
&rst
ixpk= 0, nxpk= 0, iat= -1,1148, r1= 1.30, r2= 1.80, r3= 8.37, r4= 8.87,
igr1= 180, 181, 182, 184, 185, 186,
&end
#
# 13 VAL QQG 73 ILE QG2 6.19
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3=10.02, r4=10.52,
igr1= 180, 181, 182, 184, 185, 186,
igr2=1175,1176,1177,
&end
#
# 13 VAL QQG 73 ILE HG13 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1180, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr1= 180, 181, 182, 184, 185, 186,
&end
#
# 13 VAL QQG 73 ILE QD1 4.42
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.16, r4= 7.66,
igr1= 180, 181, 182, 184, 185, 186,
igr2=1182,1183,1184,
&end
#
# 13 VAL QQG 78 CYS QB 4.31
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
igr1= 180, 181, 182, 184, 185, 186,
igr2=1259,1260,
&end
#
# 13 VAL QQG 79 ASP H 5.14
&rst
ixpk= 0, nxpk= 0, iat= -1,1266, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
igr1= 180, 181, 182, 184, 185, 186,
&end
#
# 13 VAL QQG 80 CYS HA 5.04
&rst
ixpk= 0, nxpk= 0, iat= -1,1280, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 180, 181, 182, 184, 185, 186,
&end
#
# 13 VAL QQG 80 CYS HB3 5.17
&rst
ixpk= 0, nxpk= 0, iat= -1,1283, r1= 1.30, r2= 1.80, r3= 6.97, r4= 7.47,
igr1= 180, 181, 182, 184, 185, 186,
&end
#
# 14 LEU HA 14 LEU QQD 4.16
&rst
ixpk= 0, nxpk= 0, iat= 192, -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr2= 199, 200, 201, 203, 204, 205,
&end
#
# 14 LEU QB 15 GLY H 5.35
&rst
ixpk= 0, nxpk= 0, iat= -1, 209, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51,
igr1= 194, 195,
&end
#
# 14 LEU QB 15 GLY QA 5.43
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.84, r4= 7.34,
igr1= 194, 195,
igr2= 211, 212,
&end
#
# 14 LEU QB 79 ASP HB2 5.60
&rst
ixpk= 0, nxpk= 0, iat= -1,1270, r1= 1.30, r2= 1.80, r3= 6.29, r4= 6.79,
igr1= 194, 195,
&end
#
# 14 LEU QB 79 ASP HB3 5.79
&rst
ixpk= 0, nxpk= 0, iat= -1,1271, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
igr1= 194, 195,
&end
#
# 14 LEU QQD 15 GLY H 5.07
&rst
ixpk= 0, nxpk= 0, iat= -1, 209, r1= 1.30, r2= 1.80, r3= 6.83, r4= 7.33,
igr1= 199, 200, 201, 203, 204, 205,
&end
#
# 14 LEU QQD 16 LEU H 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 216, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
igr1= 199, 200, 201, 203, 204, 205,
&end
#
# 14 LEU QQD 52 PHE H 5.95
&rst
ixpk= 0, nxpk= 0, iat= -1, 808, r1= 1.30, r2= 1.80, r3= 8.02, r4= 8.52,
igr1= 199, 200, 201, 203, 204, 205,
&end
#
# 14 LEU QQD 52 PHE HA 4.81
&rst
ixpk= 0, nxpk= 0, iat= -1, 810, r1= 1.30, r2= 1.80, r3= 6.48, r4= 6.98,
igr1= 199, 200, 201, 203, 204, 205,
&end
#
# 14 LEU QQD 52 PHE HB2 4.29
&rst
ixpk= 0, nxpk= 0, iat= -1, 812, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr1= 199, 200, 201, 203, 204, 205,
&end
#
# 14 LEU QQD 52 PHE QD 4.51
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.82, r4= 7.32,
igr1= 199, 200, 201, 203, 204, 205,
igr2= 816, 824,
&end
#
# 14 LEU QQD 52 PHE QE 5.78
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.75, r4= 9.25,
igr1= 199, 200, 201, 203, 204, 205,
igr2= 818, 822,
&end
#
# 14 LEU QQD 53 GLY H 4.78
&rst
ixpk= 0, nxpk= 0, iat= -1, 828, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,
igr1= 199, 200, 201, 203, 204, 205,
&end
#
# 14 LEU QQD 79 ASP H 5.33
&rst
ixpk= 0, nxpk= 0, iat= -1,1266, r1= 1.30, r2= 1.80, r3= 7.18, r4= 7.68,
igr1= 199, 200, 201, 203, 204, 205,
&end
#
# 14 LEU QQD 79 ASP HA 5.90
&rst
ixpk= 0, nxpk= 0, iat= -1,1268, r1= 1.30, r2= 1.80, r3= 7.95, r4= 8.45,
igr1= 199, 200, 201, 203, 204, 205,
&end
#
# 14 LEU QQD 79 ASP HB2 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1270, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
igr1= 199, 200, 201, 203, 204, 205,
&end
#
# 14 LEU QQD 79 ASP HB3 5.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1271, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
igr1= 199, 200, 201, 203, 204, 205,
&end
#
# 14 LEU QQD 80 CYS H 5.75
&rst
ixpk= 0, nxpk= 0, iat= -1,1278, r1= 1.30, r2= 1.80, r3= 7.75, r4= 8.25,
igr1= 199, 200, 201, 203, 204, 205,
&end
#
# 14 LEU QQD 81 LYS H 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1289, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
igr1= 199, 200, 201, 203, 204, 205,
&end
#
# 14 LEU QQD 81 LYS HB2 5.80
&rst
ixpk= 0, nxpk= 0, iat= -1,1293, r1= 1.30, r2= 1.80, r3= 7.82, r4= 8.32,
igr1= 199, 200, 201, 203, 204, 205,
&end
#
# 14 LEU QQD 81 LYS HG2 4.83
&rst
ixpk= 0, nxpk= 0, iat= -1,1296, r1= 1.30, r2= 1.80, r3= 6.51, r4= 7.01,
igr1= 199, 200, 201, 203, 204, 205,
&end
#
# 14 LEU QQD 81 LYS HG3 4.16
&rst
ixpk= 0, nxpk= 0, iat= -1,1297, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr1= 199, 200, 201, 203, 204, 205,
&end
#
# 14 LEU QQD 81 LYS QD 3.83
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
igr1= 199, 200, 201, 203, 204, 205,
igr2=1299,1300,
&end
#
# 14 LEU QQD 81 LYS QE 4.68
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.08, r4= 7.58,
igr1= 199, 200, 201, 203, 204, 205,
igr2=1302,1303,
&end
#
# 16 LEU HA 76 ARG QB 5.62
&rst
ixpk= 0, nxpk= 0, iat= 218, -1, r1= 1.30, r2= 1.80, r3= 6.31, r4= 6.81,
igr2=1211,1212,
&end
#
# 16 LEU HA 76 ARG QG 5.08
&rst
ixpk= 0, nxpk= 0, iat= 218, -1, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr2=1214,1215,
&end
#
# 16 LEU HA 76 ARG QD 5.99
&rst
ixpk= 0, nxpk= 0, iat= 218, -1, r1= 1.30, r2= 1.80, r3= 6.72, r4= 7.22,
igr2=1217,1218,
&end
#
# 16 LEU QB 16 LEU QQD 3.80
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
igr1= 220, 221,
igr2= 225, 226, 227, 229, 230, 231,
&end
#
# 16 LEU QB 51 GLY QA 5.63
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.09, r4= 7.59,
igr1= 220, 221,
igr2= 803, 804,
&end
#
# 16 LEU QQD 25 LEU QQD 3.83
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.96, r4= 7.46,
igr1= 225, 226, 227, 229, 230, 231,
igr2= 376, 377, 378, 380, 381, 382,
&end
#
# 16 LEU QQD 51 GLY QA 5.12
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.75, r4= 8.25,
igr1= 225, 226, 227, 229, 230, 231,
igr2= 803, 804,
&end
#
# 17 PRO QB 76 ARG QD 4.91
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.19, r4= 6.69,
igr1= 242, 243,
igr2=1217,1218,
&end
#
# 17 PRO QG 76 ARG QB 5.14
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.48, r4= 6.98,
igr1= 239, 240,
igr2=1211,1212,
&end
#
# 17 PRO QG 76 ARG QG 4.13
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
igr1= 239, 240,
igr2=1214,1215,
&end
#
# 18 TRP HZ3 51 GLY QA 3.95
&rst
ixpk= 0, nxpk= 0, iat= 266, -1, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
igr2= 803, 804,
&end
#
# 20 THR QG2 24 ASP QB 2.75
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21,
igr1= 301, 302, 303,
igr2= 359, 360,
&end
#
# 20 THR QG2 25 LEU QQD 3.40
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
igr1= 301, 302, 303,
igr2= 376, 377, 378, 380, 381, 382,
&end
#
# 21 THR H 24 ASP QB 3.38
&rst
ixpk= 0, nxpk= 0, iat= 309, -1, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,
igr2= 359, 360,
&end
#
# 21 THR H 25 LEU QQD 5.39
&rst
ixpk= 0, nxpk= 0, iat= 309, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 376, 377, 378, 380, 381, 382,
&end
#
# 21 THR H 40 VAL QQG 6.43
&rst
ixpk= 0, nxpk= 0, iat= 309, -1, r1= 1.30, r2= 1.80, r3= 8.67, r4= 9.17,
igr2= 622, 623, 624, 626, 627, 628,
&end
#
# 21 THR HA 40 VAL QQG 4.58
&rst
ixpk= 0, nxpk= 0, iat= 311, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 622, 623, 624, 626, 627, 628,
&end
#
# 21 THR QG2 23 GLN QG 5.07
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.83, r4= 7.33,
igr1= 315, 316, 317,
igr2= 345, 346,
&end
#
# 21 THR QG2 24 ASP QB 3.69
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
igr1= 315, 316, 317,
igr2= 359, 360,
&end
#
# 21 THR QG2 25 LEU QQD 4.92
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.96, r4= 8.46,
igr1= 315, 316, 317,
igr2= 376, 377, 378, 380, 381, 382,
&end
#
# 21 THR QG2 38 VAL QQG 5.84
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.45, r4= 9.95,
igr1= 315, 316, 317,
igr2= 589, 590, 591, 593, 594, 595,
&end
#
# 22 GLU H 38 VAL QQG 6.08
&rst
ixpk= 0, nxpk= 0, iat= 323, -1, r1= 1.30, r2= 1.80, r3= 8.20, r4= 8.70,
igr2= 589, 590, 591, 593, 594, 595,
&end
#
# 22 GLU H 40 VAL QQG 4.53
&rst
ixpk= 0, nxpk= 0, iat= 323, -1, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
igr2= 622, 623, 624, 626, 627, 628,
&end
#
# 22 GLU HA 25 LEU QQD 4.41
&rst
ixpk= 0, nxpk= 0, iat= 325, -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
igr2= 376, 377, 378, 380, 381, 382,
&end
#
# 22 GLU HA 38 VAL QQG 4.96
&rst
ixpk= 0, nxpk= 0, iat= 325, -1, r1= 1.30, r2= 1.80, r3= 6.69, r4= 7.19,
igr2= 589, 590, 591, 593, 594, 595,
&end
#
# 22 GLU HA 40 VAL QQG 4.09
&rst
ixpk= 0, nxpk= 0, iat= 325, -1, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
igr2= 622, 623, 624, 626, 627, 628,
&end
#
# 22 GLU HB2 40 VAL QQG 4.29
&rst
ixpk= 0, nxpk= 0, iat= 327, -1, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr2= 622, 623, 624, 626, 627, 628,
&end
#
# 22 GLU HB3 38 VAL QQG 4.81
&rst
ixpk= 0, nxpk= 0, iat= 328, -1, r1= 1.30, r2= 1.80, r3= 6.48, r4= 6.98,
igr2= 589, 590, 591, 593, 594, 595,
&end
#
# 22 GLU HB3 40 VAL QQG 4.16
&rst
ixpk= 0, nxpk= 0, iat= 328, -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr2= 622, 623, 624, 626, 627, 628,
&end
#
# 22 GLU HG2 38 VAL QQG 3.93
&rst
ixpk= 0, nxpk= 0, iat= 330, -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr2= 589, 590, 591, 593, 594, 595,
&end
#
# 22 GLU HG2 40 VAL QQG 4.42
&rst
ixpk= 0, nxpk= 0, iat= 330, -1, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
igr2= 622, 623, 624, 626, 627, 628,
&end
#
# 22 GLU HG3 25 LEU QQD 5.41
&rst
ixpk= 0, nxpk= 0, iat= 331, -1, r1= 1.30, r2= 1.80, r3= 7.29, r4= 7.79,
igr2= 376, 377, 378, 380, 381, 382,
&end
#
# 22 GLU HG3 38 VAL QQG 4.43
&rst
ixpk= 0, nxpk= 0, iat= 331, -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr2= 589, 590, 591, 593, 594, 595,
&end
#
# 22 GLU HG3 40 VAL QQG 3.99
&rst
ixpk= 0, nxpk= 0, iat= 331, -1, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
igr2= 622, 623, 624, 626, 627, 628,
&end
#
# 23 GLN H 24 ASP QB 5.07
&rst
ixpk= 0, nxpk= 0, iat= 338, -1, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
igr2= 359, 360,
&end
#
# 23 GLN H 40 VAL QQG 6.07
&rst
ixpk= 0, nxpk= 0, iat= 338, -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
igr2= 622, 623, 624, 626, 627, 628,
&end
#
# 23 GLN HA 23 GLN QG 2.89
&rst
ixpk= 0, nxpk= 0, iat= 340, -1, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,
igr2= 345, 346,
&end
#
# 23 GLN HA 38 VAL QQG 4.54
&rst
ixpk= 0, nxpk= 0, iat= 340, -1, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,
igr2= 589, 590, 591, 593, 594, 595,
&end
#
# 23 GLN HB2 38 VAL QQG 5.73
&rst
ixpk= 0, nxpk= 0, iat= 342, -1, r1= 1.30, r2= 1.80, r3= 7.72, r4= 8.22,
igr2= 589, 590, 591, 593, 594, 595,
&end
#
# 23 GLN HB3 24 ASP QB 4.86
&rst
ixpk= 0, nxpk= 0, iat= 343, -1, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
igr2= 359, 360,
&end
#
# 23 GLN HB3 38 VAL QQG 6.00
&rst
ixpk= 0, nxpk= 0, iat= 343, -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
igr2= 589, 590, 591, 593, 594, 595,
&end
#
# 23 GLN QG 23 GLN HE21 2.76
&rst
ixpk= 0, nxpk= 0, iat= -1, 351, r1= 1.30, r2= 1.80, r3= 3.10, r4= 3.60,
igr1= 345, 346,
&end
#
# 23 GLN QG 23 GLN HE22 3.37
&rst
ixpk= 0, nxpk= 0, iat= -1, 350, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,
igr1= 345, 346,
&end
#
# 23 GLN QG 24 ASP H 4.29
&rst
ixpk= 0, nxpk= 0, iat= -1, 355, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
igr1= 345, 346,
&end
#
# 23 GLN QG 24 ASP HA 4.87
&rst
ixpk= 0, nxpk= 0, iat= -1, 357, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,
igr1= 345, 346,
&end
#
# 23 GLN QG 26 LYS H 4.32
&rst
ixpk= 0, nxpk= 0, iat= -1, 386, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
igr1= 345, 346,
&end
#
# 23 GLN QG 26 LYS HG3 4.53
&rst
ixpk= 0, nxpk= 0, iat= -1, 394, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
igr1= 345, 346,
&end
#
# 23 GLN QG 26 LYS QD 3.94
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
igr1= 345, 346,
igr2= 396, 397,
&end
#
# 23 GLN QG 26 LYS QE 5.08
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.40, r4= 6.90,
igr1= 345, 346,
igr2= 399, 400,
&end
#
# 23 GLN QG 27 GLU H 4.04
&rst
ixpk= 0, nxpk= 0, iat= -1, 408, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
igr1= 345, 346,
&end
#
# 23 GLN QG 38 VAL QQG 5.44
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.23, r4= 8.73,
igr1= 345, 346,
igr2= 589, 590, 591, 593, 594, 595,
&end
#
# 24 ASP H 24 ASP QB 2.98
&rst
ixpk= 0, nxpk= 0, iat= 355, -1, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84,
igr2= 359, 360,
&end
#
# 24 ASP H 25 LEU QQD 5.19
&rst
ixpk= 0, nxpk= 0, iat= 355, -1, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,
igr2= 376, 377, 378, 380, 381, 382,
&end
#
# 24 ASP H 38 VAL QQG 5.68
&rst
ixpk= 0, nxpk= 0, iat= 355, -1, r1= 1.30, r2= 1.80, r3= 7.66, r4= 8.16,
igr2= 589, 590, 591, 593, 594, 595,
&end
#
# 24 ASP H 40 VAL QQG 6.50
&rst
ixpk= 0, nxpk= 0, iat= 355, -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
igr2= 622, 623, 624, 626, 627, 628,
&end
#
# 24 ASP HA 38 VAL QQG 6.50
&rst
ixpk= 0, nxpk= 0, iat= 357, -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
igr2= 589, 590, 591, 593, 594, 595,
&end
#
# 24 ASP QB 25 LEU H 3.21
&rst
ixpk= 0, nxpk= 0, iat= -1, 367, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr1= 359, 360,
&end
#
# 24 ASP QB 25 LEU HB2 5.13
&rst
ixpk= 0, nxpk= 0, iat= -1, 371, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
igr1= 359, 360,
&end
#
# 24 ASP QB 25 LEU QQD 4.63
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.01, r4= 7.51,
igr1= 359, 360,
igr2= 376, 377, 378, 380, 381, 382,
&end
#
# 24 ASP QB 26 LYS H 5.32
&rst
ixpk= 0, nxpk= 0, iat= -1, 386, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr1= 359, 360,
&end
#
# 24 ASP QB 27 GLU H 5.95
&rst
ixpk= 0, nxpk= 0, iat= -1, 408, r1= 1.30, r2= 1.80, r3= 6.68, r4= 7.18,
igr1= 359, 360,
&end
#
# 24 ASP QB 73 ILE QG2 5.61
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
igr1= 359, 360,
igr2=1175,1176,1177,
&end
#
# 25 LEU H 25 LEU QQD 4.13
&rst
ixpk= 0, nxpk= 0, iat= 367, -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
igr2= 376, 377, 378, 380, 381, 382,
&end
#
# 25 LEU H 38 VAL QQG 4.61
&rst
ixpk= 0, nxpk= 0, iat= 367, -1, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,
igr2= 589, 590, 591, 593, 594, 595,
&end
#
# 25 LEU HA 25 LEU QQD 3.75
&rst
ixpk= 0, nxpk= 0, iat= 369, -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
igr2= 376, 377, 378, 380, 381, 382,
&end
#
# 25 LEU HA 38 VAL QQG 5.98
&rst
ixpk= 0, nxpk= 0, iat= 369, -1, r1= 1.30, r2= 1.80, r3= 8.06, r4= 8.56,
igr2= 589, 590, 591, 593, 594, 595,
&end
#
# 25 LEU HB2 25 LEU QQD 3.72
&rst
ixpk= 0, nxpk= 0, iat= 371, -1, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
igr2= 376, 377, 378, 380, 381, 382,
&end
#
# 25 LEU HB2 38 VAL QQG 4.06
&rst
ixpk= 0, nxpk= 0, iat= 371, -1, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,
igr2= 589, 590, 591, 593, 594, 595,
&end
#
# 25 LEU HB2 40 VAL QQG 5.55
&rst
ixpk= 0, nxpk= 0, iat= 371, -1, r1= 1.30, r2= 1.80, r3= 7.48, r4= 7.98,
igr2= 622, 623, 624, 626, 627, 628,
&end
#
# 25 LEU HB3 25 LEU QQD 4.11
&rst
ixpk= 0, nxpk= 0, iat= 372, -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
igr2= 376, 377, 378, 380, 381, 382,
&end
#
# 25 LEU HB3 38 VAL QQG 3.76
&rst
ixpk= 0, nxpk= 0, iat= 372, -1, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
igr2= 589, 590, 591, 593, 594, 595,
&end
#
# 25 LEU HB3 40 VAL QQG 6.49
&rst
ixpk= 0, nxpk= 0, iat= 372, -1, r1= 1.30, r2= 1.80, r3= 8.75, r4= 9.25,
igr2= 622, 623, 624, 626, 627, 628,
&end
#
# 25 LEU HG 38 VAL QQG 5.43
&rst
ixpk= 0, nxpk= 0, iat= 374, -1, r1= 1.30, r2= 1.80, r3= 7.32, r4= 7.82,
igr2= 589, 590, 591, 593, 594, 595,
&end
#
# 25 LEU QQD 26 LYS H 5.16
&rst
ixpk= 0, nxpk= 0, iat= -1, 386, r1= 1.30, r2= 1.80, r3= 6.96, r4= 7.46,
igr1= 376, 377, 378, 380, 381, 382,
&end
#
# 25 LEU QQD 28 TYR QE 6.11
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.24, r4= 9.74,
igr1= 376, 377, 378, 380, 381, 382,
igr2= 433, 438,
&end
#
# 25 LEU QQD 29 PHE QE 4.34
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.57, r4= 7.07,
igr1= 376, 377, 378, 380, 381, 382,
igr2= 454, 458,
&end
#
# 25 LEU QQD 38 VAL HA 5.83
&rst
ixpk= 0, nxpk= 0, iat= -1, 585, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
igr1= 376, 377, 378, 380, 381, 382,
&end
#
# 25 LEU QQD 55 VAL HB 5.33
&rst
ixpk= 0, nxpk= 0, iat= -1, 859, r1= 1.30, r2= 1.80, r3= 7.18, r4= 7.68,
igr1= 376, 377, 378, 380, 381, 382,
&end
#
# 25 LEU QQD 73 ILE QG2 4.70
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.61, r4= 8.11,
igr1= 376, 377, 378, 380, 381, 382,
igr2=1175,1176,1177,
&end
#
# 25 LEU QQD 73 ILE QD1 5.53
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.95, r4= 9.45,
igr1= 376, 377, 378, 380, 381, 382,
igr2=1182,1183,1184,
&end
#
# 25 LEU QQD 74 ASP HB2 6.26
&rst
ixpk= 0, nxpk= 0, iat= -1,1192, r1= 1.30, r2= 1.80, r3= 8.44, r4= 8.94,
igr1= 376, 377, 378, 380, 381, 382,
&end
#
# 26 LYS H 35 VAL QQG 5.55
&rst
ixpk= 0, nxpk= 0, iat= 386, -1, r1= 1.30, r2= 1.80, r3= 7.48, r4= 7.98,
igr2= 537, 538, 539, 541, 542, 543,
&end
#
# 26 LYS H 55 VAL QQG 6.04
&rst
ixpk= 0, nxpk= 0, iat= 386, -1, r1= 1.30, r2= 1.80, r3= 8.14, r4= 8.64,
igr2= 861, 862, 863, 865, 866, 867,
&end
#
# 26 LYS HA 35 VAL QQG 4.13
&rst
ixpk= 0, nxpk= 0, iat= 388, -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
igr2= 537, 538, 539, 541, 542, 543,
&end
#
# 26 LYS HA 38 VAL QQG 4.09
&rst
ixpk= 0, nxpk= 0, iat= 388, -1, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
igr2= 589, 590, 591, 593, 594, 595,
&end
#
# 26 LYS HA 55 VAL QQG 5.49
&rst
ixpk= 0, nxpk= 0, iat= 388, -1, r1= 1.30, r2= 1.80, r3= 7.40, r4= 7.90,
igr2= 861, 862, 863, 865, 866, 867,
&end
#
# 26 LYS HB2 35 VAL QQG 4.45
&rst
ixpk= 0, nxpk= 0, iat= 390, -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr2= 537, 538, 539, 541, 542, 543,
&end
#
# 26 LYS HB2 38 VAL QQG 4.62
&rst
ixpk= 0, nxpk= 0, iat= 390, -1, r1= 1.30, r2= 1.80, r3= 6.23, r4= 6.73,
igr2= 589, 590, 591, 593, 594, 595,
&end
#
# 26 LYS HB3 35 VAL QQG 5.96
&rst
ixpk= 0, nxpk= 0, iat= 391, -1, r1= 1.30, r2= 1.80, r3= 8.03, r4= 8.53,
igr2= 537, 538, 539, 541, 542, 543,
&end
#
# 26 LYS HB3 38 VAL QQG 3.40
&rst
ixpk= 0, nxpk= 0, iat= 391, -1, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
igr2= 589, 590, 591, 593, 594, 595,
&end
#
# 26 LYS HG2 35 VAL QQG 5.05
&rst
ixpk= 0, nxpk= 0, iat= 393, -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
igr2= 537, 538, 539, 541, 542, 543,
&end
#
# 26 LYS HG2 38 VAL QQG 4.07
&rst
ixpk= 0, nxpk= 0, iat= 393, -1, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
igr2= 589, 590, 591, 593, 594, 595,
&end
#
# 26 LYS QD 35 VAL QQG 5.52
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.35, r4= 8.85,
igr1= 396, 397,
igr2= 537, 538, 539, 541, 542, 543,
&end
#
# 26 LYS QE 35 VAL QQG 3.40
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
igr1= 399, 400,
igr2= 537, 538, 539, 541, 542, 543,
&end
#
# 26 LYS QE 38 VAL QQG 5.06
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.66, r4= 8.16,
igr1= 399, 400,
igr2= 589, 590, 591, 593, 594, 595,
&end
#
# 27 GLU H 38 VAL QQG 5.37
&rst
ixpk= 0, nxpk= 0, iat= 408, -1, r1= 1.30, r2= 1.80, r3= 7.24, r4= 7.74,
igr2= 589, 590, 591, 593, 594, 595,
&end
#
# 28 TYR H 35 VAL QQG 5.95
&rst
ixpk= 0, nxpk= 0, iat= 423, -1, r1= 1.30, r2= 1.80, r3= 8.02, r4= 8.52,
igr2= 537, 538, 539, 541, 542, 543,
&end
#
# 28 TYR H 38 VAL QQG 6.03
&rst
ixpk= 0, nxpk= 0, iat= 423, -1, r1= 1.30, r2= 1.80, r3= 8.13, r4= 8.63,
igr2= 589, 590, 591, 593, 594, 595,
&end
#
# 29 PHE H 35 VAL QQG 4.89
&rst
ixpk= 0, nxpk= 0, iat= 444, -1, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
igr2= 537, 538, 539, 541, 542, 543,
&end
#
# 29 PHE H 55 VAL QQG 5.83
&rst
ixpk= 0, nxpk= 0, iat= 444, -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
igr2= 861, 862, 863, 865, 866, 867,
&end
#
# 29 PHE HA 66 VAL QQG 5.71
&rst
ixpk= 0, nxpk= 0, iat= 446, -1, r1= 1.30, r2= 1.80, r3= 7.70, r4= 8.20,
igr2=1055,1056,1057,1059,1060,1061,
&end
#
# 29 PHE HB2 35 VAL QQG 4.33
&rst
ixpk= 0, nxpk= 0, iat= 448, -1, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
igr2= 537, 538, 539, 541, 542, 543,
&end
#
# 29 PHE HB2 55 VAL QQG 4.54
&rst
ixpk= 0, nxpk= 0, iat= 448, -1, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,
igr2= 861, 862, 863, 865, 866, 867,
&end
#
# 29 PHE HB3 35 VAL QQG 4.26
&rst
ixpk= 0, nxpk= 0, iat= 449, -1, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
igr2= 537, 538, 539, 541, 542, 543,
&end
#
# 29 PHE HB3 55 VAL QQG 4.85
&rst
ixpk= 0, nxpk= 0, iat= 449, -1, r1= 1.30, r2= 1.80, r3= 6.54, r4= 7.04,
igr2= 861, 862, 863, 865, 866, 867,
&end
#
# 29 PHE HB3 66 VAL QQG 6.00
&rst
ixpk= 0, nxpk= 0, iat= 449, -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
igr2=1055,1056,1057,1059,1060,1061,
&end
#
# 29 PHE QD 38 VAL QQG 4.09
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.19, r4= 6.69,
igr1= 452, 460,
igr2= 589, 590, 591, 593, 594, 595,
&end
#
# 29 PHE QD 55 VAL QQG 3.88
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,
igr1= 452, 460,
igr2= 861, 862, 863, 865, 866, 867,
&end
#
# 29 PHE QE 38 VAL QQG 4.78
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.23, r4= 7.73,
igr1= 454, 458,
igr2= 589, 590, 591, 593, 594, 595,
&end
#
# 29 PHE QE 55 VAL QQG 4.36
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.60, r4= 7.10,
igr1= 454, 458,
igr2= 861, 862, 863, 865, 866, 867,
&end
#
# 29 PHE QE 66 VAL QQG 3.96
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1= 454, 458,
igr2=1055,1056,1057,1059,1060,1061,
&end
#
# 29 PHE HZ 55 VAL QQG 4.76
&rst
ixpk= 0, nxpk= 0, iat= 456, -1, r1= 1.30, r2= 1.80, r3= 6.42, r4= 6.92,
igr2= 861, 862, 863, 865, 866, 867,
&end
#
# 29 PHE HZ 66 VAL QQG 5.40
&rst
ixpk= 0, nxpk= 0, iat= 456, -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
igr2=1055,1056,1057,1059,1060,1061,
&end
#
# 30 SER H 30 SER QB 2.81
&rst
ixpk= 0, nxpk= 0, iat= 464, -1, r1= 1.30, r2= 1.80, r3= 3.15, r4= 3.65,
igr2= 468, 469,
&end
#
# 30 SER H 35 VAL QQG 4.07
&rst
ixpk= 0, nxpk= 0, iat= 464, -1, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
igr2= 537, 538, 539, 541, 542, 543,
&end
#
# 30 SER HA 35 VAL QQG 3.95
&rst
ixpk= 0, nxpk= 0, iat= 466, -1, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
igr2= 537, 538, 539, 541, 542, 543,
&end
#
# 30 SER QB 31 THR H 4.37
&rst
ixpk= 0, nxpk= 0, iat= -1, 475, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
igr1= 468, 469,
&end
#
# 30 SER QB 35 VAL QQG 4.48
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.78, r4= 7.28,
igr1= 468, 469,
igr2= 537, 538, 539, 541, 542, 543,
&end
#
# 31 THR H 35 VAL QQG 5.47
&rst
ixpk= 0, nxpk= 0, iat= 475, -1, r1= 1.30, r2= 1.80, r3= 7.37, r4= 7.87,
igr2= 537, 538, 539, 541, 542, 543,
&end
#
# 32 PHE H 35 VAL QQG 5.44
&rst
ixpk= 0, nxpk= 0, iat= 489, -1, r1= 1.30, r2= 1.80, r3= 7.33, r4= 7.83,
igr2= 537, 538, 539, 541, 542, 543,
&end
#
# 32 PHE H 66 VAL QQG 5.97
&rst
ixpk= 0, nxpk= 0, iat= 489, -1, r1= 1.30, r2= 1.80, r3= 8.05, r4= 8.55,
igr2=1055,1056,1057,1059,1060,1061,
&end
#
# 32 PHE HB2 35 VAL QQG 6.24
&rst
ixpk= 0, nxpk= 0, iat= 493, -1, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
igr2= 537, 538, 539, 541, 542, 543,
&end
#
# 32 PHE HB2 66 VAL QQG 5.05
&rst
ixpk= 0, nxpk= 0, iat= 493, -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
igr2=1055,1056,1057,1059,1060,1061,
&end
#
# 32 PHE HB3 65 LYS QG 4.85
&rst
ixpk= 0, nxpk= 0, iat= 494, -1, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
igr2=1034,1035,
&end
#
# 32 PHE HB3 65 LYS QD 4.93
&rst
ixpk= 0, nxpk= 0, iat= 494, -1, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03,
igr2=1037,1038,
&end
#
# 32 PHE HB3 66 VAL QQG 4.62
&rst
ixpk= 0, nxpk= 0, iat= 494, -1, r1= 1.30, r2= 1.80, r3= 6.23, r4= 6.73,
igr2=1055,1056,1057,1059,1060,1061,
&end
#
# 32 PHE QD 65 LYS QG 3.42
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,
igr1= 497, 505,
igr2=1034,1035,
&end
#
# 32 PHE QD 65 LYS QD 4.10
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67,
igr1= 497, 505,
igr2=1037,1038,
&end
#
# 32 PHE QD 66 VAL QQG 3.97
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51,
igr1= 497, 505,
igr2=1055,1056,1057,1059,1060,1061,
&end
#
# 32 PHE QE 65 LYS QG 4.89
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.16, r4= 6.66,
igr1= 499, 503,
igr2=1034,1035,
&end
#
# 32 PHE QE 66 VAL QQG 4.76
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.20, r4= 7.70,
igr1= 499, 503,
igr2=1055,1056,1057,1059,1060,1061,
&end
#
# 32 PHE HZ 66 VAL QQG 5.23
&rst
ixpk= 0, nxpk= 0, iat= 501, -1, r1= 1.30, r2= 1.80, r3= 7.05, r4= 7.55,
igr2=1055,1056,1057,1059,1060,1061,
&end
#
# 33 GLY H 35 VAL QQG 4.87
&rst
ixpk= 0, nxpk= 0, iat= 509, -1, r1= 1.30, r2= 1.80, r3= 6.56, r4= 7.06,
igr2= 537, 538, 539, 541, 542, 543,
&end
#
# 33 GLY HA3 59 GLU QG 4.36
&rst
ixpk= 0, nxpk= 0, iat= 512, -1, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
igr2= 936, 937,
&end
#
# 34 GLU H 35 VAL QQG 5.37
&rst
ixpk= 0, nxpk= 0, iat= 516, -1, r1= 1.30, r2= 1.80, r3= 7.24, r4= 7.74,
igr2= 537, 538, 539, 541, 542, 543,
&end
#
# 34 GLU HA 35 VAL QQG 4.63
&rst
ixpk= 0, nxpk= 0, iat= 518, -1, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
igr2= 537, 538, 539, 541, 542, 543,
&end
#
# 34 GLU HB2 35 VAL QQG 6.06
&rst
ixpk= 0, nxpk= 0, iat= 520, -1, r1= 1.30, r2= 1.80, r3= 8.17, r4= 8.67,
igr2= 537, 538, 539, 541, 542, 543,
&end
#
# 34 GLU HB2 36 LEU QQD 5.96
&rst
ixpk= 0, nxpk= 0, iat= 520, -1, r1= 1.30, r2= 1.80, r3= 8.03, r4= 8.53,
igr2= 556, 557, 558, 560, 561, 562,
&end
#
# 34 GLU HG2 36 LEU QQD 5.14
&rst
ixpk= 0, nxpk= 0, iat= 523, -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
igr2= 556, 557, 558, 560, 561, 562,
&end
#
# 34 GLU HG3 36 LEU QQD 5.05
&rst
ixpk= 0, nxpk= 0, iat= 524, -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
igr2= 556, 557, 558, 560, 561, 562,
&end
#
# 35 VAL H 35 VAL QQG 3.80
&rst
ixpk= 0, nxpk= 0, iat= 531, -1, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
igr2= 537, 538, 539, 541, 542, 543,
&end
#
# 35 VAL H 55 VAL QQG 6.20
&rst
ixpk= 0, nxpk= 0, iat= 531, -1, r1= 1.30, r2= 1.80, r3= 8.36, r4= 8.86,
igr2= 861, 862, 863, 865, 866, 867,
&end
#
# 35 VAL HA 35 VAL QQG 3.89
&rst
ixpk= 0, nxpk= 0, iat= 533, -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr2= 537, 538, 539, 541, 542, 543,
&end
#
# 35 VAL HB 55 VAL QQG 5.57
&rst
ixpk= 0, nxpk= 0, iat= 535, -1, r1= 1.30, r2= 1.80, r3= 7.51, r4= 8.01,
igr2= 861, 862, 863, 865, 866, 867,
&end
#
# 35 VAL QQG 36 LEU H 4.36
&rst
ixpk= 0, nxpk= 0, iat= -1, 547, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
igr1= 537, 538, 539, 541, 542, 543,
&end
#
# 35 VAL QQG 37 MET H 3.87
&rst
ixpk= 0, nxpk= 0, iat= -1, 566, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
igr1= 537, 538, 539, 541, 542, 543,
&end
#
# 35 VAL QQG 37 MET HA 4.73
&rst
ixpk= 0, nxpk= 0, iat= -1, 568, r1= 1.30, r2= 1.80, r3= 6.38, r4= 6.88,
igr1= 537, 538, 539, 541, 542, 543,
&end
#
# 35 VAL QQG 37 MET QE 5.61
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
igr1= 537, 538, 539, 541, 542, 543,
igr2= 577, 578, 579,
&end
#
# 35 VAL QQG 38 VAL H 5.33
&rst
ixpk= 0, nxpk= 0, iat= -1, 583, r1= 1.30, r2= 1.80, r3= 7.18, r4= 7.68,
igr1= 537, 538, 539, 541, 542, 543,
&end
#
# 35 VAL QQG 38 VAL QQG 3.54
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.43, r4= 6.93,
igr1= 537, 538, 539, 541, 542, 543,
igr2= 589, 590, 591, 593, 594, 595,
&end
#
# 35 VAL QQG 55 VAL HB 5.41
&rst
ixpk= 0, nxpk= 0, iat= -1, 859, r1= 1.30, r2= 1.80, r3= 7.29, r4= 7.79,
igr1= 537, 538, 539, 541, 542, 543,
&end
#
# 35 VAL QQG 55 VAL QQG 3.53
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.41, r4= 6.91,
igr1= 537, 538, 539, 541, 542, 543,
igr2= 861, 862, 863, 865, 866, 867,
&end
#
# 35 VAL QQG 56 ARG H 4.61
&rst
ixpk= 0, nxpk= 0, iat= -1, 871, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,
igr1= 537, 538, 539, 541, 542, 543,
&end
#
# 35 VAL QQG 57 PHE H 6.44
&rst
ixpk= 0, nxpk= 0, iat= -1, 895, r1= 1.30, r2= 1.80, r3= 8.68, r4= 9.18,
igr1= 537, 538, 539, 541, 542, 543,
&end
#
# 35 VAL QQG 57 PHE HA 4.89
&rst
ixpk= 0, nxpk= 0, iat= -1, 897, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
igr1= 537, 538, 539, 541, 542, 543,
&end
#
# 35 VAL QQG 57 PHE QD 4.36
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.60, r4= 7.10,
igr1= 537, 538, 539, 541, 542, 543,
igr2= 903, 911,
&end
#
# 35 VAL QQG 57 PHE QE 4.09
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.19, r4= 6.69,
igr1= 537, 538, 539, 541, 542, 543,
igr2= 905, 909,
&end
#
# 35 VAL QQG 57 PHE HZ 5.79
&rst
ixpk= 0, nxpk= 0, iat= -1, 907, r1= 1.30, r2= 1.80, r3= 7.80, r4= 8.30,
igr1= 537, 538, 539, 541, 542, 543,
&end
#
# 35 VAL QQG 62 THR QG2 5.42
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.77, r4= 9.27,
igr1= 537, 538, 539, 541, 542, 543,
igr2= 986, 987, 988,
&end
#
# 36 LEU H 36 LEU QQD 4.14
&rst
ixpk= 0, nxpk= 0, iat= 547, -1, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr2= 556, 557, 558, 560, 561, 562,
&end
#
# 36 LEU H 55 VAL QQG 5.68
&rst
ixpk= 0, nxpk= 0, iat= 547, -1, r1= 1.30, r2= 1.80, r3= 7.66, r4= 8.16,
igr2= 861, 862, 863, 865, 866, 867,
&end
#
# 36 LEU H 57 PHE QB 4.92
&rst
ixpk= 0, nxpk= 0, iat= 547, -1, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
igr2= 899, 900,
&end
#
# 36 LEU HA 36 LEU QQD 3.46
&rst
ixpk= 0, nxpk= 0, iat= 549, -1, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
igr2= 556, 557, 558, 560, 561, 562,
&end
#
# 36 LEU HB2 36 LEU QQD 3.35
&rst
ixpk= 0, nxpk= 0, iat= 551, -1, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
igr2= 556, 557, 558, 560, 561, 562,
&end
#
# 36 LEU HB2 55 VAL QQG 6.50
&rst
ixpk= 0, nxpk= 0, iat= 551, -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
igr2= 861, 862, 863, 865, 866, 867,
&end
#
# 36 LEU HB3 36 LEU QQD 4.03
&rst
ixpk= 0, nxpk= 0, iat= 552, -1, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
igr2= 556, 557, 558, 560, 561, 562,
&end
#
# 36 LEU HB3 56 ARG QD 6.19
&rst
ixpk= 0, nxpk= 0, iat= 552, -1, r1= 1.30, r2= 1.80, r3= 6.95, r4= 7.45,
igr2= 881, 882,
&end
#
# 36 LEU HG 56 ARG QD 5.18
&rst
ixpk= 0, nxpk= 0, iat= 554, -1, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
igr2= 881, 882,
&end
#
# 36 LEU QQD 37 MET H 5.54
&rst
ixpk= 0, nxpk= 0, iat= -1, 566, r1= 1.30, r2= 1.80, r3= 7.47, r4= 7.97,
igr1= 556, 557, 558, 560, 561, 562,
&end
#
# 36 LEU QQD 56 ARG QB 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.84, r4=10.34,
igr1= 556, 557, 558, 560, 561, 562,
igr2= 875, 876,
&end
#
# 36 LEU QQD 56 ARG QD 4.63
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.01, r4= 7.51,
igr1= 556, 557, 558, 560, 561, 562,
igr2= 881, 882,
&end
#
# 36 LEU QQD 56 ARG HE 5.57
&rst
ixpk= 0, nxpk= 0, iat= -1, 884, r1= 1.30, r2= 1.80, r3= 7.51, r4= 8.01,
igr1= 556, 557, 558, 560, 561, 562,
&end
#
# 36 LEU QQD 57 PHE HA 5.39
&rst
ixpk= 0, nxpk= 0, iat= -1, 897, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 556, 557, 558, 560, 561, 562,
&end
#
# 36 LEU QQD 58 THR HA 3.56
&rst
ixpk= 0, nxpk= 0, iat= -1, 917, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1= 556, 557, 558, 560, 561, 562,
&end
#
# 36 LEU QQD 58 THR HB 4.91
&rst
ixpk= 0, nxpk= 0, iat= -1, 919, r1= 1.30, r2= 1.80, r3= 6.62, r4= 7.12,
igr1= 556, 557, 558, 560, 561, 562,
&end
#
# 36 LEU QQD 59 GLU H 6.09
&rst
ixpk= 0, nxpk= 0, iat= -1, 929, r1= 1.30, r2= 1.80, r3= 8.21, r4= 8.71,
igr1= 556, 557, 558, 560, 561, 562,
&end
#
# 36 LEU QQD 154 ILE QD1 4.78
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.74, r4= 8.24,
igr1= 556, 557, 558, 560, 561, 562,
igr2=2459,2460,2461,
&end
#
# 37 MET H 37 MET QB 3.50
&rst
ixpk= 0, nxpk= 0, iat= 566, -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
igr2= 570, 571,
&end
#
# 37 MET H 55 VAL QQG 4.99
&rst
ixpk= 0, nxpk= 0, iat= 566, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2= 861, 862, 863, 865, 866, 867,
&end
#
# 37 MET H 56 ARG QD 5.94
&rst
ixpk= 0, nxpk= 0, iat= 566, -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
igr2= 881, 882,
&end
#
# 37 MET HA 38 VAL QQG 4.31
&rst
ixpk= 0, nxpk= 0, iat= 568, -1, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
igr2= 589, 590, 591, 593, 594, 595,
&end
#
# 37 MET HA 55 VAL QQG 5.96
&rst
ixpk= 0, nxpk= 0, iat= 568, -1, r1= 1.30, r2= 1.80, r3= 8.03, r4= 8.53,
igr2= 861, 862, 863, 865, 866, 867,
&end
#
# 37 MET QB 38 VAL H 3.65
&rst
ixpk= 0, nxpk= 0, iat= -1, 583, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,
igr1= 570, 571,
&end
#
# 37 MET QB 154 ILE QD1 4.86
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.55, r4= 7.05,
igr1= 570, 571,
igr2=2459,2460,2461,
&end
#
# 37 MET QE 38 VAL QQG 5.21
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.43, r4= 8.93,
igr1= 577, 578, 579,
igr2= 589, 590, 591, 593, 594, 595,
&end
#
# 37 MET QE 54 PHE QB 3.61
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,
igr1= 577, 578, 579,
igr2= 839, 840,
&end
#
# 37 MET QE 159 SER QB 3.26
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,
igr1= 577, 578, 579,
igr2=2536,2537,
&end
#
# 38 VAL H 38 VAL QQG 3.61
&rst
ixpk= 0, nxpk= 0, iat= 583, -1, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,
igr2= 589, 590, 591, 593, 594, 595,
&end
#
# 38 VAL H 55 VAL QQG 6.18
&rst
ixpk= 0, nxpk= 0, iat= 583, -1, r1= 1.30, r2= 1.80, r3= 8.33, r4= 8.83,
igr2= 861, 862, 863, 865, 866, 867,
&end
#
# 38 VAL HA 38 VAL QQG 3.63
&rst
ixpk= 0, nxpk= 0, iat= 585, -1, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
igr2= 589, 590, 591, 593, 594, 595,
&end
#
# 38 VAL HB 55 VAL QQG 5.56
&rst
ixpk= 0, nxpk= 0, iat= 587, -1, r1= 1.30, r2= 1.80, r3= 7.49, r4= 7.99,
igr2= 861, 862, 863, 865, 866, 867,
&end
#
# 38 VAL QQG 39 GLN H 4.55
&rst
ixpk= 0, nxpk= 0, iat= -1, 599, r1= 1.30, r2= 1.80, r3= 6.13, r4= 6.63,
igr1= 589, 590, 591, 593, 594, 595,
&end
#
# 38 VAL QQG 40 VAL H 5.74
&rst
ixpk= 0, nxpk= 0, iat= -1, 616, r1= 1.30, r2= 1.80, r3= 7.74, r4= 8.24,
igr1= 589, 590, 591, 593, 594, 595,
&end
#
# 38 VAL QQG 55 VAL H 5.39
&rst
ixpk= 0, nxpk= 0, iat= -1, 855, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 589, 590, 591, 593, 594, 595,
&end
#
# 38 VAL QQG 55 VAL HB 3.95
&rst
ixpk= 0, nxpk= 0, iat= -1, 859, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
igr1= 589, 590, 591, 593, 594, 595,
&end
#
# 38 VAL QQG 55 VAL QQG 3.37
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,
igr1= 589, 590, 591, 593, 594, 595,
igr2= 861, 862, 863, 865, 866, 867,
&end
#
# 38 VAL QQG 56 ARG H 4.69
&rst
ixpk= 0, nxpk= 0, iat= -1, 871, r1= 1.30, r2= 1.80, r3= 6.32, r4= 6.82,
igr1= 589, 590, 591, 593, 594, 595,
&end
#
# 38 VAL QQG 57 PHE QE 6.41
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.70, r4=10.20,
igr1= 589, 590, 591, 593, 594, 595,
igr2= 905, 909,
&end
#
# 39 GLN H 40 VAL QQG 5.43
&rst
ixpk= 0, nxpk= 0, iat= 599, -1, r1= 1.30, r2= 1.80, r3= 7.32, r4= 7.82,
igr2= 622, 623, 624, 626, 627, 628,
&end
#
# 39 GLN H 54 PHE QB 4.72
&rst
ixpk= 0, nxpk= 0, iat= 599, -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr2= 839, 840,
&end
#
# 39 GLN QB 40 VAL QQG 6.21
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.40, r4= 9.90,
igr1= 603, 604,
igr2= 622, 623, 624, 626, 627, 628,
&end
#
# 39 GLN QB 54 PHE QB 4.73
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
igr1= 603, 604,
igr2= 839, 840,
&end
#
# 39 GLN QG 54 PHE QB 5.44
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.85, r4= 7.35,
igr1= 606, 607,
igr2= 839, 840,
&end
#
# 40 VAL H 40 VAL QQG 3.90
&rst
ixpk= 0, nxpk= 0, iat= 616, -1, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr2= 622, 623, 624, 626, 627, 628,
&end
#
# 40 VAL HA 40 VAL QQG 3.67
&rst
ixpk= 0, nxpk= 0, iat= 618, -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr2= 622, 623, 624, 626, 627, 628,
&end
#
# 40 VAL QQG 41 LYS H 4.40
&rst
ixpk= 0, nxpk= 0, iat= -1, 632, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr1= 622, 623, 624, 626, 627, 628,
&end
#
# 40 VAL QQG 41 LYS HA 5.41
&rst
ixpk= 0, nxpk= 0, iat= -1, 634, r1= 1.30, r2= 1.80, r3= 7.29, r4= 7.79,
igr1= 622, 623, 624, 626, 627, 628,
&end
#
# 40 VAL QQG 42 LYS HB2 5.46
&rst
ixpk= 0, nxpk= 0, iat= -1, 658, r1= 1.30, r2= 1.80, r3= 7.36, r4= 7.86,
igr1= 622, 623, 624, 626, 627, 628,
&end
#
# 40 VAL QQG 42 LYS HB3 5.22
&rst
ixpk= 0, nxpk= 0, iat= -1, 659, r1= 1.30, r2= 1.80, r3= 7.04, r4= 7.54,
igr1= 622, 623, 624, 626, 627, 628,
&end
#
# 40 VAL QQG 42 LYS HG2 4.30
&rst
ixpk= 0, nxpk= 0, iat= -1, 661, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
igr1= 622, 623, 624, 626, 627, 628,
&end
#
# 40 VAL QQG 42 LYS HG3 4.20
&rst
ixpk= 0, nxpk= 0, iat= -1, 662, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr1= 622, 623, 624, 626, 627, 628,
&end
#
# 40 VAL QQG 42 LYS QD 4.60
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.96, r4= 7.46,
igr1= 622, 623, 624, 626, 627, 628,
igr2= 664, 665,
&end
#
# 40 VAL QQG 43 ASP H 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 676, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
igr1= 622, 623, 624, 626, 627, 628,
&end
#
# 40 VAL QQG 50 LYS H 5.98
&rst
ixpk= 0, nxpk= 0, iat= -1, 779, r1= 1.30, r2= 1.80, r3= 8.06, r4= 8.56,
igr1= 622, 623, 624, 626, 627, 628,
&end
#
# 40 VAL QQG 51 GLY H 5.47
&rst
ixpk= 0, nxpk= 0, iat= -1, 801, r1= 1.30, r2= 1.80, r3= 7.37, r4= 7.87,
igr1= 622, 623, 624, 626, 627, 628,
&end
#
# 40 VAL QQG 52 PHE H 5.06
&rst
ixpk= 0, nxpk= 0, iat= -1, 808, r1= 1.30, r2= 1.80, r3= 6.82, r4= 7.32,
igr1= 622, 623, 624, 626, 627, 628,
&end
#
# 40 VAL QQG 54 PHE H 5.78
&rst
ixpk= 0, nxpk= 0, iat= -1, 835, r1= 1.30, r2= 1.80, r3= 7.79, r4= 8.29,
igr1= 622, 623, 624, 626, 627, 628,
&end
#
# 42 LYS HA 42 LYS QD 4.34
&rst
ixpk= 0, nxpk= 0, iat= 656, -1, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,
igr2= 664, 665,
&end
#
# 42 LYS HA 43 ASP QB 4.94
&rst
ixpk= 0, nxpk= 0, iat= 656, -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
igr2= 680, 681,
&end
#
# 42 LYS HA 44 LEU QQD 6.25
&rst
ixpk= 0, nxpk= 0, iat= 656, -1, r1= 1.30, r2= 1.80, r3= 8.43, r4= 8.93,
igr2= 697, 698, 699, 701, 702, 703,
&end
#
# 42 LYS HA 50 LYS QG 4.10
&rst
ixpk= 0, nxpk= 0, iat= 656, -1, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
igr2= 786, 787,
&end
#
# 42 LYS HA 50 LYS QD 4.93
&rst
ixpk= 0, nxpk= 0, iat= 656, -1, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03,
igr2= 789, 790,
&end
#
# 42 LYS HA 50 LYS QE 4.19
&rst
ixpk= 0, nxpk= 0, iat= 656, -1, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
igr2= 792, 793,
&end
#
# 42 LYS HB2 43 ASP QB 5.17
&rst
ixpk= 0, nxpk= 0, iat= 658, -1, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
igr2= 680, 681,
&end
#
# 42 LYS HB2 49 SER QB 5.01
&rst
ixpk= 0, nxpk= 0, iat= 658, -1, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
igr2= 772, 773,
&end
#
# 42 LYS QD 43 ASP QB 4.23
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
igr1= 664, 665,
igr2= 680, 681,
&end
#
# 42 LYS QD 44 LEU H 5.49
&rst
ixpk= 0, nxpk= 0, iat= -1, 688, r1= 1.30, r2= 1.80, r3= 6.16, r4= 6.66,
igr1= 664, 665,
&end
#
# 42 LYS QD 47 GLY HA2 4.15
&rst
ixpk= 0, nxpk= 0, iat= -1, 745, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
igr1= 664, 665,
&end
#
# 42 LYS QD 47 GLY HA3 4.83
&rst
ixpk= 0, nxpk= 0, iat= -1, 746, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr1= 664, 665,
&end
#
# 42 LYS QD 50 LYS H 5.32
&rst
ixpk= 0, nxpk= 0, iat= -1, 779, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr1= 664, 665,
&end
#
# 42 LYS QE 44 LEU QQD 4.32
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.54, r4= 7.04,
igr1= 667, 668,
igr2= 697, 698, 699, 701, 702, 703,
&end
#
# 43 ASP H 43 ASP QB 2.83
&rst
ixpk= 0, nxpk= 0, iat= 676, -1, r1= 1.30, r2= 1.80, r3= 3.18, r4= 3.68,
igr2= 680, 681,
&end
#
# 43 ASP H 44 LEU QQD 5.65
&rst
ixpk= 0, nxpk= 0, iat= 676, -1, r1= 1.30, r2= 1.80, r3= 7.62, r4= 8.12,
igr2= 697, 698, 699, 701, 702, 703,
&end
#
# 43 ASP H 48 HID QB 4.93
&rst
ixpk= 0, nxpk= 0, iat= 676, -1, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03,
igr2= 754, 755,
&end
#
# 43 ASP H 50 LYS QG 4.33
&rst
ixpk= 0, nxpk= 0, iat= 676, -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
igr2= 786, 787,
&end
#
# 43 ASP H 50 LYS QD 6.25
&rst
ixpk= 0, nxpk= 0, iat= 676, -1, r1= 1.30, r2= 1.80, r3= 7.02, r4= 7.52,
igr2= 789, 790,
&end
#
# 43 ASP H 50 LYS QE 5.04
&rst
ixpk= 0, nxpk= 0, iat= 676, -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr2= 792, 793,
&end
#
# 43 ASP HA 44 LEU QQD 5.51
&rst
ixpk= 0, nxpk= 0, iat= 678, -1, r1= 1.30, r2= 1.80, r3= 7.43, r4= 7.93,
igr2= 697, 698, 699, 701, 702, 703,
&end
#
# 43 ASP HA 50 LYS QE 3.24
&rst
ixpk= 0, nxpk= 0, iat= 678, -1, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14,
igr2= 792, 793,
&end
#
# 43 ASP QB 44 LEU H 3.44
&rst
ixpk= 0, nxpk= 0, iat= -1, 688, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,
igr1= 680, 681,
&end
#
# 43 ASP QB 44 LEU HB2 5.54
&rst
ixpk= 0, nxpk= 0, iat= -1, 692, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
igr1= 680, 681,
&end
#
# 43 ASP QB 44 LEU QQD 5.89
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.91, r4= 9.41,
igr1= 680, 681,
igr2= 697, 698, 699, 701, 702, 703,
&end
#
# 43 ASP QB 45 LYS H 3.96
&rst
ixpk= 0, nxpk= 0, iat= -1, 707, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
igr1= 680, 681,
&end
#
# 43 ASP QB 45 LYS HG3 5.53
&rst
ixpk= 0, nxpk= 0, iat= -1, 715, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,
igr1= 680, 681,
&end
#
# 43 ASP QB 46 THR H 3.59
&rst
ixpk= 0, nxpk= 0, iat= -1, 729, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,
igr1= 680, 681,
&end
#
# 43 ASP QB 46 THR QG2 3.40
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
igr1= 680, 681,
igr2= 735, 736, 737,
&end
#
# 43 ASP QB 47 GLY HA2 4.53
&rst
ixpk= 0, nxpk= 0, iat= -1, 745, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
igr1= 680, 681,
&end
#
# 43 ASP QB 48 HID H 3.27
&rst
ixpk= 0, nxpk= 0, iat= -1, 750, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,
igr1= 680, 681,
&end
#
# 43 ASP QB 48 HID QB 4.64
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
igr1= 680, 681,
igr2= 754, 755,
&end
#
# 43 ASP QB 49 SER QB 5.13
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.46, r4= 6.96,
igr1= 680, 681,
igr2= 772, 773,
&end
#
# 43 ASP QB 50 LYS H 4.01
&rst
ixpk= 0, nxpk= 0, iat= -1, 779, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
igr1= 680, 681,
&end
#
# 43 ASP QB 50 LYS QG 4.73
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
igr1= 680, 681,
igr2= 786, 787,
&end
#
# 44 LEU H 50 LYS QE 4.98
&rst
ixpk= 0, nxpk= 0, iat= 688, -1, r1= 1.30, r2= 1.80, r3= 5.59, r4= 6.09,
igr2= 792, 793,
&end
#
# 44 LEU HA 44 LEU QQD 3.42
&rst
ixpk= 0, nxpk= 0, iat= 690, -1, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
igr2= 697, 698, 699, 701, 702, 703,
&end
#
# 44 LEU HB2 44 LEU QQD 3.57
&rst
ixpk= 0, nxpk= 0, iat= 692, -1, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31,
igr2= 697, 698, 699, 701, 702, 703,
&end
#
# 44 LEU HB3 44 LEU QQD 3.56
&rst
ixpk= 0, nxpk= 0, iat= 693, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2= 697, 698, 699, 701, 702, 703,
&end
#
# 44 LEU QQD 45 LYS H 4.58
&rst
ixpk= 0, nxpk= 0, iat= -1, 707, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 697, 698, 699, 701, 702, 703,
&end
#
# 44 LEU QQD 45 LYS HG2 4.63
&rst
ixpk= 0, nxpk= 0, iat= -1, 714, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
igr1= 697, 698, 699, 701, 702, 703,
&end
#
# 44 LEU QQD 45 LYS QE 5.19
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.85, r4= 8.35,
igr1= 697, 698, 699, 701, 702, 703,
igr2= 720, 721,
&end
#
# 44 LEU QQD 47 GLY H 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 743, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
igr1= 697, 698, 699, 701, 702, 703,
&end
#
# 44 LEU QQD 48 HID H 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 750, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
igr1= 697, 698, 699, 701, 702, 703,
&end
#
# 46 THR HB 48 HID QB 5.26
&rst
ixpk= 0, nxpk= 0, iat= 733, -1, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
igr2= 754, 755,
&end
#
# 46 THR QG2 48 HID QB 4.15
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.59, r4= 6.09,
igr1= 735, 736, 737,
igr2= 754, 755,
&end
#
# 47 GLY H 48 HID QB 5.29
&rst
ixpk= 0, nxpk= 0, iat= 743, -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
igr2= 754, 755,
&end
#
# 47 GLY HA3 48 HID QB 5.33
&rst
ixpk= 0, nxpk= 0, iat= 746, -1, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
igr2= 754, 755,
&end
#
# 48 HID H 48 HID QB 2.92
&rst
ixpk= 0, nxpk= 0, iat= 750, -1, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78,
igr2= 754, 755,
&end
#
# 49 SER HA 50 LYS QG 5.12
&rst
ixpk= 0, nxpk= 0, iat= 770, -1, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
igr2= 786, 787,
&end
#
# 50 LYS H 50 LYS QB 3.54
&rst
ixpk= 0, nxpk= 0, iat= 779, -1, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47,
igr2= 783, 784,
&end
#
# 50 LYS H 50 LYS QG 3.51
&rst
ixpk= 0, nxpk= 0, iat= 779, -1, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,
igr2= 786, 787,
&end
#
# 50 LYS H 50 LYS QD 4.29
&rst
ixpk= 0, nxpk= 0, iat= 779, -1, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
igr2= 789, 790,
&end
#
# 50 LYS H 51 GLY QA 4.92
&rst
ixpk= 0, nxpk= 0, iat= 779, -1, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
igr2= 803, 804,
&end
#
# 50 LYS HA 50 LYS QG 3.45
&rst
ixpk= 0, nxpk= 0, iat= 781, -1, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,
igr2= 786, 787,
&end
#
# 50 LYS QB 50 LYS QD 3.27
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
igr1= 783, 784,
igr2= 789, 790,
&end
#
# 50 LYS QB 50 LYS QE 4.91
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.19, r4= 6.69,
igr1= 783, 784,
igr2= 792, 793,
&end
#
# 50 LYS QB 52 PHE H 4.23
&rst
ixpk= 0, nxpk= 0, iat= -1, 808, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25,
igr1= 783, 784,
&end
#
# 50 LYS QB 52 PHE QD 4.15
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73,
igr1= 783, 784,
igr2= 816, 824,
&end
#
# 50 LYS QB 52 PHE QE 4.94
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
igr1= 783, 784,
igr2= 818, 822,
&end
#
# 50 LYS QG 50 LYS QE 3.17
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,
igr1= 786, 787,
igr2= 792, 793,
&end
#
# 50 LYS QG 51 GLY H 5.11
&rst
ixpk= 0, nxpk= 0, iat= -1, 801, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
igr1= 786, 787,
&end
#
# 50 LYS QG 52 PHE QE 4.43
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr1= 786, 787,
igr2= 818, 822,
&end
#
# 50 LYS QD 52 PHE H 6.27
&rst
ixpk= 0, nxpk= 0, iat= -1, 808, r1= 1.30, r2= 1.80, r3= 7.04, r4= 7.54,
igr1= 789, 790,
&end
#
# 50 LYS QE 52 PHE HZ 5.63
&rst
ixpk= 0, nxpk= 0, iat= -1, 820, r1= 1.30, r2= 1.80, r3= 6.32, r4= 6.82,
igr1= 792, 793,
&end
#
# 54 PHE H 54 PHE QB 3.46
&rst
ixpk= 0, nxpk= 0, iat= 835, -1, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,
igr2= 839, 840,
&end
#
# 54 PHE H 55 VAL QQG 6.09
&rst
ixpk= 0, nxpk= 0, iat= 835, -1, r1= 1.30, r2= 1.80, r3= 8.21, r4= 8.71,
igr2= 861, 862, 863, 865, 866, 867,
&end
#
# 54 PHE HA 55 VAL QQG 4.93
&rst
ixpk= 0, nxpk= 0, iat= 837, -1, r1= 1.30, r2= 1.80, r3= 6.65, r4= 7.15,
igr2= 861, 862, 863, 865, 866, 867,
&end
#
# 54 PHE QB 55 VAL H 3.91
&rst
ixpk= 0, nxpk= 0, iat= -1, 855, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89,
igr1= 839, 840,
&end
#
# 55 VAL H 55 VAL QQG 3.88
&rst
ixpk= 0, nxpk= 0, iat= 855, -1, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73,
igr2= 861, 862, 863, 865, 866, 867,
&end
#
# 55 VAL HA 55 VAL QQG 3.80
&rst
ixpk= 0, nxpk= 0, iat= 857, -1, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
igr2= 861, 862, 863, 865, 866, 867,
&end
#
# 55 VAL QQG 56 ARG H 3.82
&rst
ixpk= 0, nxpk= 0, iat= -1, 871, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
igr1= 861, 862, 863, 865, 866, 867,
&end
#
# 55 VAL QQG 56 ARG HA 5.87
&rst
ixpk= 0, nxpk= 0, iat= -1, 873, r1= 1.30, r2= 1.80, r3= 7.91, r4= 8.41,
igr1= 861, 862, 863, 865, 866, 867,
&end
#
# 55 VAL QQG 56 ARG QB 5.76
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.72, r4= 9.22,
igr1= 861, 862, 863, 865, 866, 867,
igr2= 875, 876,
&end
#
# 55 VAL QQG 56 ARG QG 6.20
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.38, r4= 9.88,
igr1= 861, 862, 863, 865, 866, 867,
igr2= 878, 879,
&end
#
# 55 VAL QQG 57 PHE H 5.27
&rst
ixpk= 0, nxpk= 0, iat= -1, 895, r1= 1.30, r2= 1.80, r3= 7.10, r4= 7.60,
igr1= 861, 862, 863, 865, 866, 867,
&end
#
# 55 VAL QQG 57 PHE QB 6.06
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.17, r4= 9.67,
igr1= 861, 862, 863, 865, 866, 867,
igr2= 899, 900,
&end
#
# 55 VAL QQG 57 PHE QD 5.04
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.63, r4= 8.13,
igr1= 861, 862, 863, 865, 866, 867,
igr2= 903, 911,
&end
#
# 55 VAL QQG 57 PHE HZ 4.36
&rst
ixpk= 0, nxpk= 0, iat= -1, 907, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
igr1= 861, 862, 863, 865, 866, 867,
&end
#
# 55 VAL QQG 58 THR H 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 915, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
igr1= 861, 862, 863, 865, 866, 867,
&end
#
# 55 VAL QQG 63 GLN HB2 5.74
&rst
ixpk= 0, nxpk= 0, iat= -1, 998, r1= 1.30, r2= 1.80, r3= 7.74, r4= 8.24,
igr1= 861, 862, 863, 865, 866, 867,
&end
#
# 55 VAL QQG 66 VAL QQG 4.77
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.67, r4= 9.17,
igr1= 861, 862, 863, 865, 866, 867,
igr2=1055,1056,1057,1059,1060,1061,
&end
#
# 55 VAL QQG 80 CYS HB2 6.39
&rst
ixpk= 0, nxpk= 0, iat= -1,1282, r1= 1.30, r2= 1.80, r3= 8.61, r4= 9.11,
igr1= 861, 862, 863, 865, 866, 867,
&end
#
# 55 VAL QQG 80 CYS HB3 5.10
&rst
ixpk= 0, nxpk= 0, iat= -1,1283, r1= 1.30, r2= 1.80, r3= 6.87, r4= 7.37,
igr1= 861, 862, 863, 865, 866, 867,
&end
#
# 55 VAL QQG 81 LYS H 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1289, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
igr1= 861, 862, 863, 865, 866, 867,
&end
#
# 56 ARG H 56 ARG QD 4.78
&rst
ixpk= 0, nxpk= 0, iat= 871, -1, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr2= 881, 882,
&end
#
# 56 ARG QD 57 PHE QD 5.30
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.68, r4= 7.18,
igr1= 881, 882,
igr2= 903, 911,
&end
#
# 56 ARG QD 154 ILE QD1 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr1= 881, 882,
igr2=2459,2460,2461,
&end
#
# 57 PHE H 57 PHE QB 3.42
&rst
ixpk= 0, nxpk= 0, iat= 895, -1, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
igr2= 899, 900,
&end
#
# 57 PHE QB 58 THR H 3.63
&rst
ixpk= 0, nxpk= 0, iat= -1, 915, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,
igr1= 899, 900,
&end
#
# 57 PHE QB 59 GLU H 3.60
&rst
ixpk= 0, nxpk= 0, iat= -1, 929, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
igr1= 899, 900,
&end
#
# 57 PHE QB 59 GLU QG 4.92
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
igr1= 899, 900,
igr2= 936, 937,
&end
#
# 57 PHE QB 62 THR H 5.68
&rst
ixpk= 0, nxpk= 0, iat= -1, 980, r1= 1.30, r2= 1.80, r3= 6.38, r4= 6.88,
igr1= 899, 900,
&end
#
# 57 PHE QB 62 THR HB 4.23
&rst
ixpk= 0, nxpk= 0, iat= -1, 984, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25,
igr1= 899, 900,
&end
#
# 57 PHE QB 62 THR QG2 4.19
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.65, r4= 6.15,
igr1= 899, 900,
igr2= 986, 987, 988,
&end
#
# 57 PHE QB 63 GLN H 4.79
&rst
ixpk= 0, nxpk= 0, iat= -1, 994, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
igr1= 899, 900,
&end
#
# 57 PHE QD 59 GLU QG 5.25
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 903, 911,
igr2= 936, 937,
&end
#
# 57 PHE QE 66 VAL QQG 4.10
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
igr1= 905, 909,
igr2=1055,1056,1057,1059,1060,1061,
&end
#
# 57 PHE HZ 66 VAL QQG 4.14
&rst
ixpk= 0, nxpk= 0, iat= 907, -1, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr2=1055,1056,1057,1059,1060,1061,
&end
#
# 58 THR H 59 GLU QG 4.70
&rst
ixpk= 0, nxpk= 0, iat= 915, -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
igr2= 936, 937,
&end
#
# 58 THR QG2 59 GLU QG 2.97
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,
igr1= 921, 922, 923,
igr2= 936, 937,
&end
#
# 59 GLU HA 59 GLU QG 3.40
&rst
ixpk= 0, nxpk= 0, iat= 931, -1, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,
igr2= 936, 937,
&end
#
# 59 GLU QG 60 TYR H 3.62
&rst
ixpk= 0, nxpk= 0, iat= -1, 944, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,
igr1= 936, 937,
&end
#
# 59 GLU QG 60 TYR HB3 5.60
&rst
ixpk= 0, nxpk= 0, iat= -1, 949, r1= 1.30, r2= 1.80, r3= 6.29, r4= 6.79,
igr1= 936, 937,
&end
#
# 59 GLU QG 61 GLU H 4.07
&rst
ixpk= 0, nxpk= 0, iat= -1, 965, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,
igr1= 936, 937,
&end
#
# 59 GLU QG 62 THR H 3.30
&rst
ixpk= 0, nxpk= 0, iat= -1, 980, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,
igr1= 936, 937,
&end
#
# 59 GLU QG 62 THR QG2 4.61
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,
igr1= 936, 937,
igr2= 986, 987, 988,
&end
#
# 59 GLU QG 63 GLN H 4.61
&rst
ixpk= 0, nxpk= 0, iat= -1, 994, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67,
igr1= 936, 937,
&end
#
# 60 TYR QD 87 GLN QE2 4.16
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr1= 952, 961,
igr2=1403,1404,
&end
#
# 60 TYR QE 82 LEU QQD 5.92
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.96, r4= 9.46,
igr1= 954, 959,
igr2=1320,1321,1322,1324,1325,1326,
&end
#
# 60 TYR QE 87 GLN QE2 3.38
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,
igr1= 954, 959,
igr2=1403,1404,
&end
#
# 61 GLU QG 65 LYS QG 4.63
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33,
igr1= 972, 973,
igr2=1034,1035,
&end
#
# 61 GLU QG 65 LYS QD 3.21
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
igr1= 972, 973,
igr2=1037,1038,
&end
#
# 62 THR H 65 LYS QD 4.69
&rst
ixpk= 0, nxpk= 0, iat= 980, -1, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr2=1037,1038,
&end
#
# 62 THR HA 66 VAL QQG 5.37
&rst
ixpk= 0, nxpk= 0, iat= 982, -1, r1= 1.30, r2= 1.80, r3= 7.24, r4= 7.74,
igr2=1055,1056,1057,1059,1060,1061,
&end
#
# 62 THR HB 66 VAL QQG 6.21
&rst
ixpk= 0, nxpk= 0, iat= 984, -1, r1= 1.30, r2= 1.80, r3= 8.37, r4= 8.87,
igr2=1055,1056,1057,1059,1060,1061,
&end
#
# 62 THR QG2 65 LYS QD 4.10
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03,
igr1= 986, 987, 988,
igr2=1037,1038,
&end
#
# 62 THR QG2 66 VAL QQG 4.09
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.62, r4= 7.12,
igr1= 986, 987, 988,
igr2=1055,1056,1057,1059,1060,1061,
&end
#
# 63 GLN H 65 LYS QD 4.27
&rst
ixpk= 0, nxpk= 0, iat= 994, -1, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
igr2=1037,1038,
&end
#
# 63 GLN H 66 VAL QQG 6.04
&rst
ixpk= 0, nxpk= 0, iat= 994, -1, r1= 1.30, r2= 1.80, r3= 8.14, r4= 8.64,
igr2=1055,1056,1057,1059,1060,1061,
&end
#
# 63 GLN HA 65 LYS QG 4.76
&rst
ixpk= 0, nxpk= 0, iat= 996, -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr2=1034,1035,
&end
#
# 63 GLN HA 66 VAL QQG 4.42
&rst
ixpk= 0, nxpk= 0, iat= 996, -1, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
igr2=1055,1056,1057,1059,1060,1061,
&end
#
# 63 GLN HB2 66 VAL QQG 5.39
&rst
ixpk= 0, nxpk= 0, iat= 998, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1055,1056,1057,1059,1060,1061,
&end
#
# 63 GLN HG2 87 GLN QE2 4.82
&rst
ixpk= 0, nxpk= 0, iat=1001, -1, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,
igr2=1403,1404,
&end
#
# 63 GLN HG3 82 LEU QQD 4.41
&rst
ixpk= 0, nxpk= 0, iat=1002, -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
igr2=1320,1321,1322,1324,1325,1326,
&end
#
# 63 GLN HE22 87 GLN QE2 3.16
&rst
ixpk= 0, nxpk= 0, iat=1006, -1, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05,
igr2=1403,1404,
&end
#
# 64 VAL H 65 LYS QG 4.45
&rst
ixpk= 0, nxpk= 0, iat=1011, -1, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,
igr2=1034,1035,
&end
#
# 64 VAL H 66 VAL QQG 5.87
&rst
ixpk= 0, nxpk= 0, iat=1011, -1, r1= 1.30, r2= 1.80, r3= 7.91, r4= 8.41,
igr2=1055,1056,1057,1059,1060,1061,
&end
#
# 64 VAL HA 87 GLN QE2 6.20
&rst
ixpk= 0, nxpk= 0, iat=1013, -1, r1= 1.30, r2= 1.80, r3= 6.96, r4= 7.46,
igr2=1403,1404,
&end
#
# 64 VAL QG1 65 LYS QG 6.06
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.17, r4= 8.67,
igr1=1017,1018,1019,
igr2=1034,1035,
&end
#
# 64 VAL QG1 67 MET QG 5.84
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.87, r4= 8.37,
igr1=1017,1018,1019,
igr2=1072,1073,
&end
#
# 64 VAL QG1 82 LEU QQD 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3=10.52, r4=11.02,
igr1=1017,1018,1019,
igr2=1320,1321,1322,1324,1325,1326,
&end
#
# 64 VAL QG1 87 GLN QE2 5.59
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.54, r4= 8.04,
igr1=1017,1018,1019,
igr2=1403,1404,
&end
#
# 64 VAL QG2 65 LYS QG 4.91
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.62, r4= 7.12,
igr1=1021,1022,1023,
igr2=1034,1035,
&end
#
# 64 VAL QG2 65 LYS QD 4.89
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
igr1=1021,1022,1023,
igr2=1037,1038,
&end
#
# 65 LYS H 65 LYS QG 2.93
&rst
ixpk= 0, nxpk= 0, iat=1027, -1, r1= 1.30, r2= 1.80, r3= 3.29, r4= 3.79,
igr2=1034,1035,
&end
#
# 65 LYS H 65 LYS QD 3.05
&rst
ixpk= 0, nxpk= 0, iat=1027, -1, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92,
igr2=1037,1038,
&end
#
# 65 LYS H 66 VAL QQG 4.58
&rst
ixpk= 0, nxpk= 0, iat=1027, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2=1055,1056,1057,1059,1060,1061,
&end
#
# 65 LYS HA 65 LYS QG 3.50
&rst
ixpk= 0, nxpk= 0, iat=1029, -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
igr2=1034,1035,
&end
#
# 65 LYS HA 66 VAL QQG 6.50
&rst
ixpk= 0, nxpk= 0, iat=1029, -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
igr2=1055,1056,1057,1059,1060,1061,
&end
#
# 65 LYS QB 65 LYS QG 2.35
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 2.96, r4= 3.46,
igr1=1031,1032,
igr2=1034,1035,
&end
#
# 65 LYS QB 65 LYS QD 2.45
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.09, r4= 3.59,
igr1=1031,1032,
igr2=1037,1038,
&end
#
# 65 LYS QB 66 VAL QQG 5.24
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
igr1=1031,1032,
igr2=1055,1056,1057,1059,1060,1061,
&end
#
# 65 LYS QG 65 LYS QD 2.18
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 2.75, r4= 3.25,
igr1=1034,1035,
igr2=1037,1038,
&end
#
# 65 LYS QG 65 LYS QE 2.54
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70,
igr1=1034,1035,
igr2=1040,1041,
&end
#
# 65 LYS QG 66 VAL H 3.10
&rst
ixpk= 0, nxpk= 0, iat= -1,1049, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98,
igr1=1034,1035,
&end
#
# 65 LYS QG 66 VAL QQG 4.19
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.34, r4= 6.84,
igr1=1034,1035,
igr2=1055,1056,1057,1059,1060,1061,
&end
#
# 65 LYS QD 66 VAL H 4.54
&rst
ixpk= 0, nxpk= 0, iat= -1,1049, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
igr1=1037,1038,
&end
#
# 65 LYS QD 66 VAL QQG 5.32
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.05, r4= 8.55,
igr1=1037,1038,
igr2=1055,1056,1057,1059,1060,1061,
&end
#
# 65 LYS QE 66 VAL QQG 5.06
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.66, r4= 8.16,
igr1=1040,1041,
igr2=1055,1056,1057,1059,1060,1061,
&end
#
# 66 VAL H 66 VAL QQG 3.62
&rst
ixpk= 0, nxpk= 0, iat=1049, -1, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
igr2=1055,1056,1057,1059,1060,1061,
&end
#
# 66 VAL H 67 MET QG 4.29
&rst
ixpk= 0, nxpk= 0, iat=1049, -1, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
igr2=1072,1073,
&end
#
# 66 VAL HA 66 VAL QQG 3.79
&rst
ixpk= 0, nxpk= 0, iat=1051, -1, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,
igr2=1055,1056,1057,1059,1060,1061,
&end
#
# 66 VAL HA 67 MET QG 5.38
&rst
ixpk= 0, nxpk= 0, iat=1051, -1, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54,
igr2=1072,1073,
&end
#
# 66 VAL HB 67 MET QG 4.29
&rst
ixpk= 0, nxpk= 0, iat=1053, -1, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
igr2=1072,1073,
&end
#
# 66 VAL QQG 67 MET H 4.31
&rst
ixpk= 0, nxpk= 0, iat= -1,1065, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
igr1=1055,1056,1057,1059,1060,1061,
&end
#
# 66 VAL QQG 67 MET HA 4.81
&rst
ixpk= 0, nxpk= 0, iat= -1,1067, r1= 1.30, r2= 1.80, r3= 6.48, r4= 6.98,
igr1=1055,1056,1057,1059,1060,1061,
&end
#
# 66 VAL QQG 67 MET QG 5.90
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.93, r4= 9.43,
igr1=1055,1056,1057,1059,1060,1061,
igr2=1072,1073,
&end
#
# 66 VAL QQG 68 SER H 5.73
&rst
ixpk= 0, nxpk= 0, iat= -1,1082, r1= 1.30, r2= 1.80, r3= 7.72, r4= 8.22,
igr1=1055,1056,1057,1059,1060,1061,
&end
#
# 66 VAL QQG 69 GLN H 5.74
&rst
ixpk= 0, nxpk= 0, iat= -1,1093, r1= 1.30, r2= 1.80, r3= 7.74, r4= 8.24,
igr1=1055,1056,1057,1059,1060,1061,
&end
#
# 66 VAL QQG 71 HID HD2 5.88
&rst
ixpk= 0, nxpk= 0, iat= -1,1148, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
igr1=1055,1056,1057,1059,1060,1061,
&end
#
# 66 VAL QQG 80 CYS H 5.41
&rst
ixpk= 0, nxpk= 0, iat= -1,1278, r1= 1.30, r2= 1.80, r3= 7.29, r4= 7.79,
igr1=1055,1056,1057,1059,1060,1061,
&end
#
# 66 VAL QQG 80 CYS HB2 4.35
&rst
ixpk= 0, nxpk= 0, iat= -1,1282, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
igr1=1055,1056,1057,1059,1060,1061,
&end
#
# 66 VAL QQG 80 CYS HB3 4.37
&rst
ixpk= 0, nxpk= 0, iat= -1,1283, r1= 1.30, r2= 1.80, r3= 5.89, r4= 6.39,
igr1=1055,1056,1057,1059,1060,1061,
&end
#
# 67 MET H 67 MET QG 2.91
&rst
ixpk= 0, nxpk= 0, iat=1065, -1, r1= 1.30, r2= 1.80, r3= 3.27, r4= 3.77,
igr2=1072,1073,
&end
#
# 67 MET HB2 67 MET QG 2.56
&rst
ixpk= 0, nxpk= 0, iat=1069, -1, r1= 1.30, r2= 1.80, r3= 2.87, r4= 3.37,
igr2=1072,1073,
&end
#
# 67 MET QG 67 MET QE 2.63
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05,
igr1=1072,1073,
igr2=1076,1077,1078,
&end
#
# 67 MET QG 68 SER H 3.72
&rst
ixpk= 0, nxpk= 0, iat= -1,1082, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
igr1=1072,1073,
&end
#
# 67 MET QG 81 LYS HA 4.22
&rst
ixpk= 0, nxpk= 0, iat= -1,1291, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr1=1072,1073,
&end
#
# 67 MET QG 82 LEU H 5.70
&rst
ixpk= 0, nxpk= 0, iat= -1,1311, r1= 1.30, r2= 1.80, r3= 6.40, r4= 6.90,
igr1=1072,1073,
&end
#
# 67 MET QG 82 LEU QQD 5.99
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.06, r4= 9.56,
igr1=1072,1073,
igr2=1320,1321,1322,1324,1325,1326,
&end
#
# 67 MET QE 82 LEU QQD 3.49
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.65, r4= 6.15,
igr1=1076,1077,1078,
igr2=1320,1321,1322,1324,1325,1326,
&end
#
# 67 MET QE 87 GLN QE2 3.37
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
igr1=1076,1077,1078,
igr2=1403,1404,
&end
#
# 69 GLN HA 70 ARG QG 4.82
&rst
ixpk= 0, nxpk= 0, iat=1095, -1, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,
igr2=1117,1118,
&end
#
# 70 ARG H 70 ARG QG 2.86
&rst
ixpk= 0, nxpk= 0, iat=1110, -1, r1= 1.30, r2= 1.80, r3= 3.21, r4= 3.71,
igr2=1117,1118,
&end
#
# 70 ARG H 70 ARG QD 4.01
&rst
ixpk= 0, nxpk= 0, iat=1110, -1, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
igr2=1120,1121,
&end
#
# 70 ARG HA 70 ARG QG 3.66
&rst
ixpk= 0, nxpk= 0, iat=1112, -1, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
igr2=1117,1118,
&end
#
# 70 ARG HA 70 ARG QD 4.98
&rst
ixpk= 0, nxpk= 0, iat=1112, -1, r1= 1.30, r2= 1.80, r3= 5.59, r4= 6.09,
igr2=1120,1121,
&end
#
# 70 ARG HB3 70 ARG QD 3.58
&rst
ixpk= 0, nxpk= 0, iat=1115, -1, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,
igr2=1120,1121,
&end
#
# 70 ARG QG 71 HID H 4.52
&rst
ixpk= 0, nxpk= 0, iat= -1,1134, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
igr1=1117,1118,
&end
#
# 70 ARG QG 77 TRP HE3 4.39
&rst
ixpk= 0, nxpk= 0, iat= -1,1250, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,
igr1=1117,1118,
&end
#
# 70 ARG QD 71 HID H 4.49
&rst
ixpk= 0, nxpk= 0, iat= -1,1134, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr1=1120,1121,
&end
#
# 70 ARG QD 71 HID HA 5.52
&rst
ixpk= 0, nxpk= 0, iat= -1,1136, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
igr1=1120,1121,
&end
#
# 70 ARG QD 77 TRP HA 5.83
&rst
ixpk= 0, nxpk= 0, iat= -1,1233, r1= 1.30, r2= 1.80, r3= 6.54, r4= 7.04,
igr1=1120,1121,
&end
#
# 70 ARG QD 77 TRP HE3 4.03
&rst
ixpk= 0, nxpk= 0, iat= -1,1250, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
igr1=1120,1121,
&end
#
# 72 MET QE 76 ARG QD 4.53
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
igr1=1163,1164,1165,
igr2=1217,1218,
&end
#
# 73 ILE H 76 ARG QB 5.21
&rst
ixpk= 0, nxpk= 0, iat=1169, -1, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
igr2=1211,1212,
&end
#
# 73 ILE H 76 ARG QD 6.27
&rst
ixpk= 0, nxpk= 0, iat=1169, -1, r1= 1.30, r2= 1.80, r3= 7.04, r4= 7.54,
igr2=1217,1218,
&end
#
# 73 ILE QG2 76 ARG QB 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
igr1=1175,1176,1177,
igr2=1211,1212,
&end
#
# 74 ASP HB3 76 ARG QB 4.80
&rst
ixpk= 0, nxpk= 0, iat=1193, -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr2=1211,1212,
&end
#
# 75 GLY H 76 ARG QB 5.19
&rst
ixpk= 0, nxpk= 0, iat=1200, -1, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33,
igr2=1211,1212,
&end
#
# 75 GLY HA2 76 ARG QB 4.89
&rst
ixpk= 0, nxpk= 0, iat=1202, -1, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
igr2=1211,1212,
&end
#
# 76 ARG H 76 ARG QB 3.19
&rst
ixpk= 0, nxpk= 0, iat=1207, -1, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08,
igr2=1211,1212,
&end
#
# 76 ARG H 76 ARG QG 4.21
&rst
ixpk= 0, nxpk= 0, iat=1207, -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
igr2=1214,1215,
&end
#
# 76 ARG HA 76 ARG QG 3.60
&rst
ixpk= 0, nxpk= 0, iat=1209, -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
igr2=1214,1215,
&end
#
# 76 ARG QB 76 ARG HE 4.93
&rst
ixpk= 0, nxpk= 0, iat= -1,1220, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03,
igr1=1211,1212,
&end
#
# 76 ARG QB 78 CYS QB 5.98
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.53, r4= 8.03,
igr1=1211,1212,
igr2=1259,1260,
&end
#
# 76 ARG QG 77 TRP H 3.43
&rst
ixpk= 0, nxpk= 0, iat= -1,1231, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35,
igr1=1214,1215,
&end
#
# 76 ARG QG 78 CYS H 4.48
&rst
ixpk= 0, nxpk= 0, iat= -1,1255, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
igr1=1214,1215,
&end
#
# 76 ARG QD 77 TRP H 3.19
&rst
ixpk= 0, nxpk= 0, iat= -1,1231, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08,
igr1=1217,1218,
&end
#
# 76 ARG QD 77 TRP HA 4.90
&rst
ixpk= 0, nxpk= 0, iat= -1,1233, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
igr1=1217,1218,
&end
#
# 79 ASP HB2 81 LYS QE 5.08
&rst
ixpk= 0, nxpk= 0, iat=1270, -1, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr2=1302,1303,
&end
#
# 79 ASP HB3 81 LYS QE 4.83
&rst
ixpk= 0, nxpk= 0, iat=1271, -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr2=1302,1303,
&end
#
# 81 LYS HB2 81 LYS QE 3.65
&rst
ixpk= 0, nxpk= 0, iat=1293, -1, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,
igr2=1302,1303,
&end
#
# 81 LYS HB3 81 LYS QE 3.87
&rst
ixpk= 0, nxpk= 0, iat=1294, -1, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,
igr2=1302,1303,
&end
#
# 81 LYS HG3 81 LYS QE 3.68
&rst
ixpk= 0, nxpk= 0, iat=1297, -1, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
igr2=1302,1303,
&end
#
# 82 LEU H 82 LEU QQD 4.66
&rst
ixpk= 0, nxpk= 0, iat=1311, -1, r1= 1.30, r2= 1.80, r3= 6.28, r4= 6.78,
igr2=1320,1321,1322,1324,1325,1326,
&end
#
# 82 LEU HA 82 LEU QQD 3.56
&rst
ixpk= 0, nxpk= 0, iat=1313, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2=1320,1321,1322,1324,1325,1326,
&end
#
# 82 LEU HA 87 GLN QE2 6.27
&rst
ixpk= 0, nxpk= 0, iat=1313, -1, r1= 1.30, r2= 1.80, r3= 7.04, r4= 7.54,
igr2=1403,1404,
&end
#
# 82 LEU HB2 82 LEU QQD 3.68
&rst
ixpk= 0, nxpk= 0, iat=1315, -1, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
igr2=1320,1321,1322,1324,1325,1326,
&end
#
# 82 LEU HB3 82 LEU QQD 3.58
&rst
ixpk= 0, nxpk= 0, iat=1316, -1, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
igr2=1320,1321,1322,1324,1325,1326,
&end
#
# 82 LEU QQD 83 PRO HG3 5.09
&rst
ixpk= 0, nxpk= 0, iat= -1,1335, r1= 1.30, r2= 1.80, r3= 6.86, r4= 7.36,
igr1=1320,1321,1322,1324,1325,1326,
&end
#
# 82 LEU QQD 83 PRO HD2 3.96
&rst
ixpk= 0, nxpk= 0, iat= -1,1331, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr1=1320,1321,1322,1324,1325,1326,
&end
#
# 82 LEU QQD 83 PRO HD3 4.14
&rst
ixpk= 0, nxpk= 0, iat= -1,1332, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr1=1320,1321,1322,1324,1325,1326,
&end
#
# 82 LEU QQD 86 LYS HB2 5.16
&rst
ixpk= 0, nxpk= 0, iat= -1,1373, r1= 1.30, r2= 1.80, r3= 6.96, r4= 7.46,
igr1=1320,1321,1322,1324,1325,1326,
&end
#
# 82 LEU QQD 86 LYS HB3 5.22
&rst
ixpk= 0, nxpk= 0, iat= -1,1374, r1= 1.30, r2= 1.80, r3= 7.04, r4= 7.54,
igr1=1320,1321,1322,1324,1325,1326,
&end
#
# 82 LEU QQD 86 LYS QD 5.11
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.73, r4= 8.23,
igr1=1320,1321,1322,1324,1325,1326,
igr2=1379,1380,
&end
#
# 82 LEU QQD 87 GLN HB2 3.71
&rst
ixpk= 0, nxpk= 0, iat= -1,1395, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,
igr1=1320,1321,1322,1324,1325,1326,
&end
#
# 82 LEU QQD 87 GLN QG 5.29
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.00, r4= 8.50,
igr1=1320,1321,1322,1324,1325,1326,
igr2=1398,1399,
&end
#
# 82 LEU QQD 87 GLN QE2 4.15
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.28, r4= 6.78,
igr1=1320,1321,1322,1324,1325,1326,
igr2=1403,1404,
&end
#
# 84 ASN H 84 ASN QB 3.12
&rst
ixpk= 0, nxpk= 0, iat=1344, -1, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,
igr2=1348,1349,
&end
#
# 84 ASN QB 84 ASN HD21 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1354, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87,
igr1=1348,1349,
&end
#
# 84 ASN QB 84 ASN HD22 3.41
&rst
ixpk= 0, nxpk= 0, iat= -1,1353, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,
igr1=1348,1349,
&end
#
# 84 ASN QB 85 SER H 4.17
&rst
ixpk= 0, nxpk= 0, iat= -1,1358, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
igr1=1348,1349,
&end
#
# 85 SER H 85 SER QB 3.34
&rst
ixpk= 0, nxpk= 0, iat=1358, -1, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,
igr2=1362,1363,
&end
#
# 85 SER QB 86 LYS H 3.89
&rst
ixpk= 0, nxpk= 0, iat= -1,1369, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
igr1=1362,1363,
&end
#
# 85 SER QB 86 LYS HB2 5.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1373, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
igr1=1362,1363,
&end
#
# 85 SER QB 86 LYS QD 4.91
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.19, r4= 6.69,
igr1=1362,1363,
igr2=1379,1380,
&end
#
# 85 SER QB 86 LYS QE 4.33
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
igr1=1362,1363,
igr2=1382,1383,
&end
#
# 87 GLN HB2 87 GLN QE2 3.46
&rst
ixpk= 0, nxpk= 0, iat=1395, -1, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,
igr2=1403,1404,
&end
#
# 89 GLN H 89 GLN QB 3.41
&rst
ixpk= 0, nxpk= 0, iat=1419, -1, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,
igr2=1423,1424,
&end
#
# 89 GLN HA 90 ASP QB 4.24
&rst
ixpk= 0, nxpk= 0, iat=1421, -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
igr2=1440,1441,
&end
#
# 89 GLN QB 89 GLN QG 2.36
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47,
igr1=1423,1424,
igr2=1426,1427,
&end
#
# 89 GLN QB 89 GLN HE21 4.58
&rst
ixpk= 0, nxpk= 0, iat= -1,1432, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
igr1=1423,1424,
&end
#
# 89 GLN QB 90 ASP H 3.12
&rst
ixpk= 0, nxpk= 0, iat= -1,1436, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,
igr1=1423,1424,
&end
#
# 89 GLN QB 90 ASP QB 4.78
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,
igr1=1423,1424,
igr2=1440,1441,
&end
#
# 90 ASP H 90 ASP QB 2.68
&rst
ixpk= 0, nxpk= 0, iat=1436, -1, r1= 1.30, r2= 1.80, r3= 3.01, r4= 3.51,
igr2=1440,1441,
&end
#
# 90 ASP QB 91 GLU H 2.88
&rst
ixpk= 0, nxpk= 0, iat= -1,1448, r1= 1.30, r2= 1.80, r3= 3.23, r4= 3.73,
igr1=1440,1441,
&end
#
# 90 ASP QB 91 GLU QB 4.25
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,
igr1=1440,1441,
igr2=1452,1453,
&end
#
# 91 GLU H 91 GLU QB 3.55
&rst
ixpk= 0, nxpk= 0, iat=1448, -1, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,
igr2=1452,1453,
&end
#
# 91 GLU HA 91 GLU QB 2.61
&rst
ixpk= 0, nxpk= 0, iat=1450, -1, r1= 1.30, r2= 1.80, r3= 2.93, r4= 3.43,
igr2=1452,1453,
&end
#
# 91 GLU QB 92 PRO HD2 3.02
&rst
ixpk= 0, nxpk= 0, iat= -1,1464, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89,
igr1=1452,1453,
&end
#
# 91 GLU QB 92 PRO HD3 3.81
&rst
ixpk= 0, nxpk= 0, iat= -1,1465, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,
igr1=1452,1453,
&end
#
# 92 PRO HA 149 CYS QB 5.16
&rst
ixpk= 0, nxpk= 0, iat=1473, -1, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,
igr2=2386,2387,
&end
#
# 92 PRO HB3 149 CYS QB 4.15
&rst
ixpk= 0, nxpk= 0, iat=1471, -1, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
igr2=2386,2387,
&end
#
# 92 PRO HG2 146 GLN QE2 4.85
&rst
ixpk= 0, nxpk= 0, iat=1467, -1, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
igr2=2347,2348,
&end
#
# 92 PRO HG2 149 CYS QB 5.00
&rst
ixpk= 0, nxpk= 0, iat=1467, -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr2=2386,2387,
&end
#
# 92 PRO HG3 149 CYS QB 4.18
&rst
ixpk= 0, nxpk= 0, iat=1468, -1, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,
igr2=2386,2387,
&end
#
# 93 LEU H 149 CYS QB 5.33
&rst
ixpk= 0, nxpk= 0, iat=1477, -1, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
igr2=2386,2387,
&end
#
# 93 LEU HB2 95 SER QB 5.71
&rst
ixpk= 0, nxpk= 0, iat=1481, -1, r1= 1.30, r2= 1.80, r3= 6.41, r4= 6.91,
igr2=1524,1525,
&end
#
# 93 LEU HG 149 CYS QB 5.77
&rst
ixpk= 0, nxpk= 0, iat=1484, -1, r1= 1.30, r2= 1.80, r3= 6.48, r4= 6.98,
igr2=2386,2387,
&end
#
# 93 LEU QD2 95 SER QB 5.55
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.48, r4= 7.98,
igr1=1490,1491,1492,
igr2=1524,1525,
&end
#
# 94 ARG H 95 SER QB 6.27
&rst
ixpk= 0, nxpk= 0, iat=1496, -1, r1= 1.30, r2= 1.80, r3= 7.04, r4= 7.54,
igr2=1524,1525,
&end
#
# 94 ARG H 146 GLN QE2 4.53
&rst
ixpk= 0, nxpk= 0, iat=1496, -1, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
igr2=2347,2348,
&end
#
# 94 ARG HA 146 GLN QE2 3.85
&rst
ixpk= 0, nxpk= 0, iat=1498, -1, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,
igr2=2347,2348,
&end
#
# 94 ARG HG2 146 GLN QE2 5.81
&rst
ixpk= 0, nxpk= 0, iat=1503, -1, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
igr2=2347,2348,
&end
#
# 94 ARG HG2 172 ASN QB 5.12
&rst
ixpk= 0, nxpk= 0, iat=1503, -1, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
igr2=2727,2728,
&end
#
# 94 ARG HG3 146 GLN QE2 4.23
&rst
ixpk= 0, nxpk= 0, iat=1504, -1, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25,
igr2=2347,2348,
&end
#
# 94 ARG QD 95 SER QB 4.41
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
igr1=1506,1507,
igr2=1524,1525,
&end
#
# 94 ARG QD 146 GLN QE2 4.36
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
igr1=1506,1507,
igr2=2347,2348,
&end
#
# 94 ARG QD 172 ASN QB 3.67
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
igr1=1506,1507,
igr2=2727,2728,
&end
#
# 94 ARG QD 174 GLN QB 3.66
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
igr1=1506,1507,
igr2=2765,2766,
&end
#
# 94 ARG QD 174 GLN QE2 4.76
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr1=1506,1507,
igr2=2773,2774,
&end
#
# 95 SER H 95 SER QB 3.37
&rst
ixpk= 0, nxpk= 0, iat=1520, -1, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,
igr2=1524,1525,
&end
#
# 95 SER QB 96 ARG H 3.89
&rst
ixpk= 0, nxpk= 0, iat= -1,1531, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
igr1=1524,1525,
&end
#
# 95 SER QB 97 LYS H 3.77
&rst
ixpk= 0, nxpk= 0, iat= -1,1555, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,
igr1=1524,1525,
&end
#
# 95 SER QB 145 ALA QB 4.44
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1=1524,1525,
igr2=2329,2330,2331,
&end
#
# 95 SER QB 165 ALA QB 5.70
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.68, r4= 8.18,
igr1=1524,1525,
igr2=2624,2625,2626,
&end
#
# 96 ARG H 96 ARG QG 4.90
&rst
ixpk= 0, nxpk= 0, iat=1531, -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
igr2=1538,1539,
&end
#
# 96 ARG HA 98 VAL QQG 5.87
&rst
ixpk= 0, nxpk= 0, iat=1533, -1, r1= 1.30, r2= 1.80, r3= 7.91, r4= 8.41,
igr2=1583,1584,1585,1587,1588,1589,
&end
#
# 96 ARG QG 97 LYS H 5.02
&rst
ixpk= 0, nxpk= 0, iat= -1,1555, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr1=1538,1539,
&end
#
# 96 ARG QG 142 ASP H 4.42
&rst
ixpk= 0, nxpk= 0, iat= -1,2277, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
igr1=1538,1539,
&end
#
# 96 ARG QG 142 ASP HA 4.17
&rst
ixpk= 0, nxpk= 0, iat= -1,2279, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
igr1=1538,1539,
&end
#
# 96 ARG QG 142 ASP HB2 3.95
&rst
ixpk= 0, nxpk= 0, iat= -1,2281, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
igr1=1538,1539,
&end
#
# 96 ARG QG 142 ASP HB3 3.90
&rst
ixpk= 0, nxpk= 0, iat= -1,2282, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
igr1=1538,1539,
&end
#
# 97 LYS H 98 VAL QQG 5.73
&rst
ixpk= 0, nxpk= 0, iat=1555, -1, r1= 1.30, r2= 1.80, r3= 7.72, r4= 8.22,
igr2=1583,1584,1585,1587,1588,1589,
&end
#
# 97 LYS HA 98 VAL QQG 5.10
&rst
ixpk= 0, nxpk= 0, iat=1557, -1, r1= 1.30, r2= 1.80, r3= 6.87, r4= 7.37,
igr2=1583,1584,1585,1587,1588,1589,
&end
#
# 97 LYS QB 98 VAL QQG 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
igr1=1559,1560,
igr2=1583,1584,1585,1587,1588,1589,
&end
#
# 97 LYS QD 136 PHE QB 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
igr1=1565,1566,
igr2=2189,2190,
&end
#
# 98 VAL H 98 VAL QQG 3.91
&rst
ixpk= 0, nxpk= 0, iat=1577, -1, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77,
igr2=1583,1584,1585,1587,1588,1589,
&end
#
# 98 VAL H 137 VAL QQG 5.17
&rst
ixpk= 0, nxpk= 0, iat=1577, -1, r1= 1.30, r2= 1.80, r3= 6.97, r4= 7.47,
igr2=2211,2212,2213,2215,2216,2217,
&end
#
# 98 VAL HA 98 VAL QQG 3.91
&rst
ixpk= 0, nxpk= 0, iat=1579, -1, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77,
igr2=1583,1584,1585,1587,1588,1589,
&end
#
# 98 VAL HA 100 VAL QQG 6.50
&rst
ixpk= 0, nxpk= 0, iat=1579, -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
igr2=1619,1620,1621,1623,1624,1625,
&end
#
# 98 VAL HB 100 VAL QQG 6.00
&rst
ixpk= 0, nxpk= 0, iat=1581, -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
igr2=1619,1620,1621,1623,1624,1625,
&end
#
# 98 VAL HB 148 LEU QQD 5.62
&rst
ixpk= 0, nxpk= 0, iat=1581, -1, r1= 1.30, r2= 1.80, r3= 7.58, r4= 8.08,
igr2=2372,2373,2374,2376,2377,2378,
&end
#
# 98 VAL QQG 100 VAL H 5.41
&rst
ixpk= 0, nxpk= 0, iat= -1,1613, r1= 1.30, r2= 1.80, r3= 7.29, r4= 7.79,
igr1=1583,1584,1585,1587,1588,1589,
&end
#
# 98 VAL QQG 100 VAL QQG 4.15
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.54, r4= 8.04,
igr1=1583,1584,1585,1587,1588,1589,
igr2=1619,1620,1621,1623,1624,1625,
&end
#
# 98 VAL QQG 116 PHE HB3 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1868, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
igr1=1583,1584,1585,1587,1588,1589,
&end
#
# 98 VAL QQG 116 PHE QD 5.36
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.11, r4= 8.61,
igr1=1583,1584,1585,1587,1588,1589,
igr2=1871,1879,
&end
#
# 98 VAL QQG 136 PHE HA 6.08
&rst
ixpk= 0, nxpk= 0, iat= -1,2187, r1= 1.30, r2= 1.80, r3= 8.20, r4= 8.70,
igr1=1583,1584,1585,1587,1588,1589,
&end
#
# 98 VAL QQG 137 VAL H 4.36
&rst
ixpk= 0, nxpk= 0, iat= -1,2205, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
igr1=1583,1584,1585,1587,1588,1589,
&end
#
# 98 VAL QQG 137 VAL HA 5.74
&rst
ixpk= 0, nxpk= 0, iat= -1,2207, r1= 1.30, r2= 1.80, r3= 7.74, r4= 8.24,
igr1=1583,1584,1585,1587,1588,1589,
&end
#
# 98 VAL QQG 137 VAL HB 5.02
&rst
ixpk= 0, nxpk= 0, iat= -1,2209, r1= 1.30, r2= 1.80, r3= 6.77, r4= 7.27,
igr1=1583,1584,1585,1587,1588,1589,
&end
#
# 98 VAL QQG 137 VAL QQG 3.87
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.03, r4= 7.53,
igr1=1583,1584,1585,1587,1588,1589,
igr2=2211,2212,2213,2215,2216,2217,
&end
#
# 98 VAL QQG 139 PHE H 5.79
&rst
ixpk= 0, nxpk= 0, iat= -1,2235, r1= 1.30, r2= 1.80, r3= 7.80, r4= 8.30,
igr1=1583,1584,1585,1587,1588,1589,
&end
#
# 98 VAL QQG 139 PHE QD 4.46
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.75, r4= 7.25,
igr1=1583,1584,1585,1587,1588,1589,
igr2=2243,2251,
&end
#
# 98 VAL QQG 139 PHE QE 3.77
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr1=1583,1584,1585,1587,1588,1589,
igr2=2245,2249,
&end
#
# 98 VAL QQG 139 PHE HZ 5.44
&rst
ixpk= 0, nxpk= 0, iat= -1,2247, r1= 1.30, r2= 1.80, r3= 7.33, r4= 7.83,
igr1=1583,1584,1585,1587,1588,1589,
&end
#
# 98 VAL QQG 144 ILE QG2 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3=10.52, r4=11.02,
igr1=1583,1584,1585,1587,1588,1589,
igr2=2312,2313,2314,
&end
#
# 98 VAL QQG 145 ALA H 5.63
&rst
ixpk= 0, nxpk= 0, iat= -1,2325, r1= 1.30, r2= 1.80, r3= 7.59, r4= 8.09,
igr1=1583,1584,1585,1587,1588,1589,
&end
#
# 98 VAL QQG 145 ALA HA 4.32
&rst
ixpk= 0, nxpk= 0, iat= -1,2327, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32,
igr1=1583,1584,1585,1587,1588,1589,
&end
#
# 98 VAL QQG 145 ALA QB 3.66
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr1=1583,1584,1585,1587,1588,1589,
igr2=2329,2330,2331,
&end
#
# 98 VAL QQG 146 GLN H 5.86
&rst
ixpk= 0, nxpk= 0, iat= -1,2335, r1= 1.30, r2= 1.80, r3= 7.90, r4= 8.40,
igr1=1583,1584,1585,1587,1588,1589,
&end
#
# 98 VAL QQG 148 LEU QQD 4.94
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
igr1=1583,1584,1585,1587,1588,1589,
igr2=2372,2373,2374,2376,2377,2378,
&end
#
# 98 VAL QQG 149 CYS H 5.87
&rst
ixpk= 0, nxpk= 0, iat= -1,2382, r1= 1.30, r2= 1.80, r3= 7.91, r4= 8.41,
igr1=1583,1584,1585,1587,1588,1589,
&end
#
# 98 VAL QQG 149 CYS QB 5.54
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.38, r4= 8.88,
igr1=1583,1584,1585,1587,1588,1589,
igr2=2386,2387,
&end
#
# 98 VAL QQG 162 ILE HA 6.36
&rst
ixpk= 0, nxpk= 0, iat= -1,2578, r1= 1.30, r2= 1.80, r3= 8.57, r4= 9.07,
igr1=1583,1584,1585,1587,1588,1589,
&end
#
# 98 VAL QQG 162 ILE QG2 4.92
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.96, r4= 8.46,
igr1=1583,1584,1585,1587,1588,1589,
igr2=2582,2583,2584,
&end
#
# 98 VAL QQG 163 SER H 6.01
&rst
ixpk= 0, nxpk= 0, iat= -1,2595, r1= 1.30, r2= 1.80, r3= 8.10, r4= 8.60,
igr1=1583,1584,1585,1587,1588,1589,
&end
#
# 98 VAL QQG 165 ALA H 6.38
&rst
ixpk= 0, nxpk= 0, iat= -1,2620, r1= 1.30, r2= 1.80, r3= 8.60, r4= 9.10,
igr1=1583,1584,1585,1587,1588,1589,
&end
#
# 98 VAL QQG 165 ALA QB 5.55
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
igr1=1583,1584,1585,1587,1588,1589,
igr2=2624,2625,2626,
&end
#
# 99 PHE H 100 VAL QQG 5.84
&rst
ixpk= 0, nxpk= 0, iat=1593, -1, r1= 1.30, r2= 1.80, r3= 7.87, r4= 8.37,
igr2=1619,1620,1621,1623,1624,1625,
&end
#
# 99 PHE QD 100 VAL QQG 6.23
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.43, r4= 9.93,
igr1=1601,1609,
igr2=1619,1620,1621,1623,1624,1625,
&end
#
# 99 PHE QD 101 GLY QA 4.76
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr1=1601,1609,
igr2=1631,1632,
&end
#
# 99 PHE QD 134 PHE QB 4.99
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.29, r4= 6.79,
igr1=1601,1609,
igr2=2159,2160,
&end
#
# 99 PHE QE 101 GLY QA 4.37
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
igr1=1603,1607,
igr2=1631,1632,
&end
#
# 99 PHE QE 134 PHE QB 5.03
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.34, r4= 6.84,
igr1=1603,1607,
igr2=2159,2160,
&end
#
# 100 VAL H 100 VAL QQG 4.23
&rst
ixpk= 0, nxpk= 0, iat=1613, -1, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr2=1619,1620,1621,1623,1624,1625,
&end
#
# 100 VAL H 137 VAL QQG 5.61
&rst
ixpk= 0, nxpk= 0, iat=1613, -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
igr2=2211,2212,2213,2215,2216,2217,
&end
#
# 100 VAL HA 101 GLY QA 4.17
&rst
ixpk= 0, nxpk= 0, iat=1615, -1, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
igr2=1631,1632,
&end
#
# 100 VAL HB 137 VAL QQG 6.04
&rst
ixpk= 0, nxpk= 0, iat=1617, -1, r1= 1.30, r2= 1.80, r3= 8.14, r4= 8.64,
igr2=2211,2212,2213,2215,2216,2217,
&end
#
# 100 VAL QQG 101 GLY H 4.23
&rst
ixpk= 0, nxpk= 0, iat= -1,1629, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr1=1619,1620,1621,1623,1624,1625,
&end
#
# 100 VAL QQG 101 GLY QA 5.71
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.64, r4= 9.14,
igr1=1619,1620,1621,1623,1624,1625,
igr2=1631,1632,
&end
#
# 100 VAL QQG 102 ARG H 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1636, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
igr1=1619,1620,1621,1623,1624,1625,
&end
#
# 100 VAL QQG 103 CYM HB3 5.49
&rst
ixpk= 0, nxpk= 0, iat= -1,1665, r1= 1.30, r2= 1.80, r3= 7.40, r4= 7.90,
igr1=1619,1620,1621,1623,1624,1625,
&end
#
# 100 VAL QQG 104 THR H 5.92
&rst
ixpk= 0, nxpk= 0, iat= -1,1671, r1= 1.30, r2= 1.80, r3= 7.98, r4= 8.48,
igr1=1619,1620,1621,1623,1624,1625,
&end
#
# 100 VAL QQG 107 MET QG 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.84, r4=10.34,
igr1=1619,1620,1621,1623,1624,1625,
igr2=1719,1720,
&end
#
# 100 VAL QQG 107 MET QE 5.88
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.52, r4=10.02,
igr1=1619,1620,1621,1623,1624,1625,
igr2=1723,1724,1725,
&end
#
# 100 VAL QQG 116 PHE QD 5.58
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.44, r4= 8.94,
igr1=1619,1620,1621,1623,1624,1625,
igr2=1871,1879,
&end
#
# 100 VAL QQG 116 PHE QE 4.21
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.37, r4= 6.87,
igr1=1619,1620,1621,1623,1624,1625,
igr2=1873,1877,
&end
#
# 100 VAL QQG 116 PHE HZ 4.21
&rst
ixpk= 0, nxpk= 0, iat= -1,1875, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
igr1=1619,1620,1621,1623,1624,1625,
&end
#
# 100 VAL QQG 134 PHE H 5.87
&rst
ixpk= 0, nxpk= 0, iat= -1,2155, r1= 1.30, r2= 1.80, r3= 7.91, r4= 8.41,
igr1=1619,1620,1621,1623,1624,1625,
&end
#
# 100 VAL QQG 134 PHE QD 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.84, r4=10.34,
igr1=1619,1620,1621,1623,1624,1625,
igr2=2163,2171,
&end
#
# 100 VAL QQG 135 ALA H 4.63
&rst
ixpk= 0, nxpk= 0, iat= -1,2175, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
igr1=1619,1620,1621,1623,1624,1625,
&end
#
# 100 VAL QQG 135 ALA QB 3.81
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1=1619,1620,1621,1623,1624,1625,
igr2=2179,2180,2181,
&end
#
# 100 VAL QQG 136 PHE H 5.75
&rst
ixpk= 0, nxpk= 0, iat= -1,2185, r1= 1.30, r2= 1.80, r3= 7.75, r4= 8.25,
igr1=1619,1620,1621,1623,1624,1625,
&end
#
# 100 VAL QQG 136 PHE HA 5.93
&rst
ixpk= 0, nxpk= 0, iat= -1,2187, r1= 1.30, r2= 1.80, r3= 7.99, r4= 8.49,
igr1=1619,1620,1621,1623,1624,1625,
&end
#
# 100 VAL QQG 137 VAL H 5.51
&rst
ixpk= 0, nxpk= 0, iat= -1,2205, r1= 1.30, r2= 1.80, r3= 7.43, r4= 7.93,
igr1=1619,1620,1621,1623,1624,1625,
&end
#
# 100 VAL QQG 137 VAL QQG 3.85
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,
igr1=1619,1620,1621,1623,1624,1625,
igr2=2211,2212,2213,2215,2216,2217,
&end
#
# 100 VAL QQG 153 LEU QQD 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3=11.81, r4=12.31,
igr1=1619,1620,1621,1623,1624,1625,
igr2=2436,2437,2438,2440,2441,2442,
&end
#
# 100 VAL QQG 155 ILE QD1 5.45
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
igr1=1619,1620,1621,1623,1624,1625,
igr2=2478,2479,2480,
&end
#
# 100 VAL QQG 160 VAL H 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2543, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
igr1=1619,1620,1621,1623,1624,1625,
&end
#
# 100 VAL QQG 160 VAL HA 5.88
&rst
ixpk= 0, nxpk= 0, iat= -1,2545, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
igr1=1619,1620,1621,1623,1624,1625,
&end
#
# 100 VAL QQG 160 VAL HB 4.67
&rst
ixpk= 0, nxpk= 0, iat= -1,2547, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
igr1=1619,1620,1621,1623,1624,1625,
&end
#
# 100 VAL QQG 161 HIS H 5.46
&rst
ixpk= 0, nxpk= 0, iat= -1,2559, r1= 1.30, r2= 1.80, r3= 7.36, r4= 7.86,
igr1=1619,1620,1621,1623,1624,1625,
&end
#
# 100 VAL QQG 162 ILE HA 4.87
&rst
ixpk= 0, nxpk= 0, iat= -1,2578, r1= 1.30, r2= 1.80, r3= 6.56, r4= 7.06,
igr1=1619,1620,1621,1623,1624,1625,
&end
#
# 100 VAL QQG 162 ILE QG2 5.77
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
igr1=1619,1620,1621,1623,1624,1625,
igr2=2582,2583,2584,
&end
#
# 100 VAL QQG 162 ILE QD1 4.71
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.62, r4= 8.12,
igr1=1619,1620,1621,1623,1624,1625,
igr2=2589,2590,2591,
&end
#
# 100 VAL QQG 163 SER H 6.26
&rst
ixpk= 0, nxpk= 0, iat= -1,2595, r1= 1.30, r2= 1.80, r3= 8.44, r4= 8.94,
igr1=1619,1620,1621,1623,1624,1625,
&end
#
# 101 GLY H 102 ARG QG 4.47
&rst
ixpk= 0, nxpk= 0, iat=1629, -1, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
igr2=1643,1644,
&end
#
# 101 GLY H 161 HIS QB 4.81
&rst
ixpk= 0, nxpk= 0, iat=1629, -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr2=2563,2564,
&end
#
# 101 GLY QA 102 ARG QG 4.76
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr1=1631,1632,
igr2=1643,1644,
&end
#
# 101 GLY QA 102 ARG HE 5.01
&rst
ixpk= 0, nxpk= 0, iat= -1,1649, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
igr1=1631,1632,
&end
#
# 101 GLY QA 134 PHE H 6.27
&rst
ixpk= 0, nxpk= 0, iat= -1,2155, r1= 1.30, r2= 1.80, r3= 7.04, r4= 7.54,
igr1=1631,1632,
&end
#
# 101 GLY QA 134 PHE QD 5.10
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.43, r4= 6.93,
igr1=1631,1632,
igr2=2163,2171,
&end
#
# 101 GLY QA 160 VAL QQG 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.84, r4=10.34,
igr1=1631,1632,
igr2=2549,2550,2551,2553,2554,2555,
&end
#
# 102 ARG QB 102 ARG QD 3.11
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
igr1=1640,1641,
igr2=1646,1647,
&end
#
# 102 ARG QB 133 ALA QB 4.73
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.38, r4= 6.88,
igr1=1640,1641,
igr2=2149,2150,2151,
&end
#
# 102 ARG QD 133 ALA QB 4.43
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr1=1646,1647,
igr2=2149,2150,2151,
&end
#
# 103 CYM HA 160 VAL QQG 4.56
&rst
ixpk= 0, nxpk= 0, iat=1662, -1, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
igr2=2549,2550,2551,2553,2554,2555,
&end
#
# 103 CYM HB2 160 VAL QQG 5.54
&rst
ixpk= 0, nxpk= 0, iat=1664, -1, r1= 1.30, r2= 1.80, r3= 7.47, r4= 7.97,
igr2=2549,2550,2551,2553,2554,2555,
&end
#
# 104 THR H 107 MET QG 3.78
&rst
ixpk= 0, nxpk= 0, iat=1671, -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
igr2=1719,1720,
&end
#
# 104 THR H 160 VAL QQG 5.22
&rst
ixpk= 0, nxpk= 0, iat=1671, -1, r1= 1.30, r2= 1.80, r3= 7.04, r4= 7.54,
igr2=2549,2550,2551,2553,2554,2555,
&end
#
# 104 THR QG2 160 VAL QQG 5.58
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.03, r4= 9.53,
igr1=1677,1678,1679,
igr2=2549,2550,2551,2553,2554,2555,
&end
#
# 105 GLU H 105 GLU QG 4.12
&rst
ixpk= 0, nxpk= 0, iat=1685, -1, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
igr2=1692,1693,
&end
#
# 105 GLU H 106 ASP QB 5.06
&rst
ixpk= 0, nxpk= 0, iat=1685, -1, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
igr2=1704,1705,
&end
#
# 105 GLU H 107 MET QG 5.71
&rst
ixpk= 0, nxpk= 0, iat=1685, -1, r1= 1.30, r2= 1.80, r3= 6.41, r4= 6.91,
igr2=1719,1720,
&end
#
# 105 GLU HA 105 GLU QG 3.21
&rst
ixpk= 0, nxpk= 0, iat=1687, -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr2=1692,1693,
&end
#
# 105 GLU QG 106 ASP H 4.54
&rst
ixpk= 0, nxpk= 0, iat= -1,1700, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
igr1=1692,1693,
&end
#
# 105 GLU QG 106 ASP HA 5.75
&rst
ixpk= 0, nxpk= 0, iat= -1,1702, r1= 1.30, r2= 1.80, r3= 6.45, r4= 6.95,
igr1=1692,1693,
&end
#
# 105 GLU QG 131 PHE HB2 4.69
&rst
ixpk= 0, nxpk= 0, iat= -1,2105, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr1=1692,1693,
&end
#
# 105 GLU QG 131 PHE HB3 5.22
&rst
ixpk= 0, nxpk= 0, iat= -1,2106, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
igr1=1692,1693,
&end
#
# 105 GLU QG 131 PHE QD 3.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
igr1=1692,1693,
igr2=2109,2117,
&end
#
# 105 GLU QG 131 PHE QE 4.19
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
igr1=1692,1693,
igr2=2111,2115,
&end
#
# 106 ASP H 107 MET QG 5.14
&rst
ixpk= 0, nxpk= 0, iat=1700, -1, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,
igr2=1719,1720,
&end
#
# 106 ASP HA 106 ASP QB 2.64
&rst
ixpk= 0, nxpk= 0, iat=1702, -1, r1= 1.30, r2= 1.80, r3= 2.96, r4= 3.46,
igr2=1704,1705,
&end
#
# 106 ASP QB 158 ILE HG13 4.96
&rst
ixpk= 0, nxpk= 0, iat= -1,2524, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
igr1=1704,1705,
&end
#
# 107 MET H 107 MET QG 3.12
&rst
ixpk= 0, nxpk= 0, iat=1712, -1, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,
igr2=1719,1720,
&end
#
# 107 MET H 112 LEU QQD 6.34
&rst
ixpk= 0, nxpk= 0, iat=1712, -1, r1= 1.30, r2= 1.80, r3= 8.55, r4= 9.05,
igr2=1794,1795,1796,1798,1799,1800,
&end
#
# 107 MET HA 107 MET QG 3.60
&rst
ixpk= 0, nxpk= 0, iat=1714, -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
igr2=1719,1720,
&end
#
# 107 MET HA 111 GLU QG 4.56
&rst
ixpk= 0, nxpk= 0, iat=1714, -1, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
igr2=1777,1778,
&end
#
# 107 MET HB3 112 LEU QQD 5.18
&rst
ixpk= 0, nxpk= 0, iat=1717, -1, r1= 1.30, r2= 1.80, r3= 6.98, r4= 7.48,
igr2=1794,1795,1796,1798,1799,1800,
&end
#
# 107 MET HB3 160 VAL QQG 5.84
&rst
ixpk= 0, nxpk= 0, iat=1717, -1, r1= 1.30, r2= 1.80, r3= 7.87, r4= 8.37,
igr2=2549,2550,2551,2553,2554,2555,
&end
#
# 107 MET QG 107 MET QE 3.36
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
igr1=1719,1720,
igr2=1723,1724,1725,
&end
#
# 107 MET QG 108 THR H 3.64
&rst
ixpk= 0, nxpk= 0, iat= -1,1729, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59,
igr1=1719,1720,
&end
#
# 107 MET QG 108 THR QG2 5.61
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
igr1=1719,1720,
igr2=1735,1736,1737,
&end
#
# 107 MET QG 112 LEU HG 6.01
&rst
ixpk= 0, nxpk= 0, iat= -1,1792, r1= 1.30, r2= 1.80, r3= 6.75, r4= 7.25,
igr1=1719,1720,
&end
#
# 107 MET QG 112 LEU QQD 4.40
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.66, r4= 7.16,
igr1=1719,1720,
igr2=1794,1795,1796,1798,1799,1800,
&end
#
# 107 MET QG 127 ILE QD1 6.31
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.51, r4= 9.01,
igr1=1719,1720,
igr2=2045,2046,2047,
&end
#
# 107 MET QG 155 ILE QD1 6.17
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
igr1=1719,1720,
igr2=2478,2479,2480,
&end
#
# 107 MET QG 158 ILE QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.16, r4= 8.66,
igr1=1719,1720,
igr2=2519,2520,2521,
&end
#
# 107 MET QG 160 VAL QQG 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.84, r4=10.34,
igr1=1719,1720,
igr2=2549,2550,2551,2553,2554,2555,
&end
#
# 107 MET QE 155 ILE QG1 4.93
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.65, r4= 7.15,
igr1=1723,1724,1725,
igr2=2475,2476,
&end
#
# 107 MET QE 160 VAL QQG 3.42
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
igr1=1723,1724,1725,
igr2=2549,2550,2551,2553,2554,2555,
&end
#
# 108 THR H 111 GLU QG 4.75
&rst
ixpk= 0, nxpk= 0, iat=1729, -1, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
igr2=1777,1778,
&end
#
# 108 THR H 112 LEU QQD 5.31
&rst
ixpk= 0, nxpk= 0, iat=1729, -1, r1= 1.30, r2= 1.80, r3= 7.16, r4= 7.66,
igr2=1794,1795,1796,1798,1799,1800,
&end
#
# 108 THR QG2 110 ASP QB 3.62
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
igr1=1735,1736,1737,
igr2=1762,1763,
&end
#
# 108 THR QG2 111 GLU QG 4.64
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75,
igr1=1735,1736,1737,
igr2=1777,1778,
&end
#
# 108 THR QG2 112 LEU QQD 5.54
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.97, r4= 9.47,
igr1=1735,1736,1737,
igr2=1794,1795,1796,1798,1799,1800,
&end
#
# 109 GLU H 110 ASP QB 5.19
&rst
ixpk= 0, nxpk= 0, iat=1743, -1, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33,
igr2=1762,1763,
&end
#
# 109 GLU H 112 LEU QQD 5.81
&rst
ixpk= 0, nxpk= 0, iat=1743, -1, r1= 1.30, r2= 1.80, r3= 7.83, r4= 8.33,
igr2=1794,1795,1796,1798,1799,1800,
&end
#
# 109 GLU H 125 VAL QQG 5.10
&rst
ixpk= 0, nxpk= 0, iat=1743, -1, r1= 1.30, r2= 1.80, r3= 6.87, r4= 7.37,
igr2=2002,2003,2004,2006,2007,2008,
&end
#
# 109 GLU HA 112 LEU QQD 4.33
&rst
ixpk= 0, nxpk= 0, iat=1745, -1, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
igr2=1794,1795,1796,1798,1799,1800,
&end
#
# 109 GLU HA 125 VAL QQG 4.26
&rst
ixpk= 0, nxpk= 0, iat=1745, -1, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
igr2=2002,2003,2004,2006,2007,2008,
&end
#
# 109 GLU HB2 125 VAL QQG 5.03
&rst
ixpk= 0, nxpk= 0, iat=1747, -1, r1= 1.30, r2= 1.80, r3= 6.78, r4= 7.28,
igr2=2002,2003,2004,2006,2007,2008,
&end
#
# 109 GLU HB3 112 LEU QQD 6.25
&rst
ixpk= 0, nxpk= 0, iat=1748, -1, r1= 1.30, r2= 1.80, r3= 8.43, r4= 8.93,
igr2=1794,1795,1796,1798,1799,1800,
&end
#
# 109 GLU HB3 125 VAL QQG 4.62
&rst
ixpk= 0, nxpk= 0, iat=1748, -1, r1= 1.30, r2= 1.80, r3= 6.23, r4= 6.73,
igr2=2002,2003,2004,2006,2007,2008,
&end
#
# 109 GLU HG2 125 VAL QQG 4.40
&rst
ixpk= 0, nxpk= 0, iat=1750, -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr2=2002,2003,2004,2006,2007,2008,
&end
#
# 109 GLU HG3 125 VAL QQG 4.99
&rst
ixpk= 0, nxpk= 0, iat=1751, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=2002,2003,2004,2006,2007,2008,
&end
#
# 110 ASP H 110 ASP QB 2.69
&rst
ixpk= 0, nxpk= 0, iat=1758, -1, r1= 1.30, r2= 1.80, r3= 3.02, r4= 3.52,
igr2=1762,1763,
&end
#
# 110 ASP H 125 VAL QQG 5.76
&rst
ixpk= 0, nxpk= 0, iat=1758, -1, r1= 1.30, r2= 1.80, r3= 7.76, r4= 8.26,
igr2=2002,2003,2004,2006,2007,2008,
&end
#
# 110 ASP QB 111 GLU H 3.16
&rst
ixpk= 0, nxpk= 0, iat= -1,1770, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05,
igr1=1762,1763,
&end
#
# 110 ASP QB 111 GLU HA 4.96
&rst
ixpk= 0, nxpk= 0, iat= -1,1772, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
igr1=1762,1763,
&end
#
# 110 ASP QB 111 GLU HB2 5.66
&rst
ixpk= 0, nxpk= 0, iat= -1,1774, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
igr1=1762,1763,
&end
#
# 110 ASP QB 112 LEU H 4.66
&rst
ixpk= 0, nxpk= 0, iat= -1,1785, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73,
igr1=1762,1763,
&end
#
# 110 ASP QB 113 ARG HD2 4.79
&rst
ixpk= 0, nxpk= 0, iat= -1,1814, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
igr1=1762,1763,
&end
#
# 110 ASP QB 113 ARG HD3 6.22
&rst
ixpk= 0, nxpk= 0, iat= -1,1815, r1= 1.30, r2= 1.80, r3= 6.98, r4= 7.48,
igr1=1762,1763,
&end
#
# 110 ASP QB 114 GLU HB2 4.95
&rst
ixpk= 0, nxpk= 0, iat= -1,1832, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
igr1=1762,1763,
&end
#
# 110 ASP QB 114 GLU HG3 4.69
&rst
ixpk= 0, nxpk= 0, iat= -1,1836, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr1=1762,1763,
&end
#
# 111 GLU H 111 GLU QG 3.87
&rst
ixpk= 0, nxpk= 0, iat=1770, -1, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,
igr2=1777,1778,
&end
#
# 111 GLU H 112 LEU QQD 5.96
&rst
ixpk= 0, nxpk= 0, iat=1770, -1, r1= 1.30, r2= 1.80, r3= 8.03, r4= 8.53,
igr2=1794,1795,1796,1798,1799,1800,
&end
#
# 111 GLU HA 111 GLU QG 3.31
&rst
ixpk= 0, nxpk= 0, iat=1772, -1, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,
igr2=1777,1778,
&end
#
# 111 GLU HB2 112 LEU QQD 5.90
&rst
ixpk= 0, nxpk= 0, iat=1774, -1, r1= 1.30, r2= 1.80, r3= 7.95, r4= 8.45,
igr2=1794,1795,1796,1798,1799,1800,
&end
#
# 111 GLU HB3 112 LEU QQD 4.98
&rst
ixpk= 0, nxpk= 0, iat=1775, -1, r1= 1.30, r2= 1.80, r3= 6.71, r4= 7.21,
igr2=1794,1795,1796,1798,1799,1800,
&end
#
# 111 GLU QG 112 LEU H 5.01
&rst
ixpk= 0, nxpk= 0, iat= -1,1785, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
igr1=1777,1778,
&end
#
# 112 LEU H 112 LEU QQD 4.20
&rst
ixpk= 0, nxpk= 0, iat=1785, -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr2=1794,1795,1796,1798,1799,1800,
&end
#
# 112 LEU H 125 VAL QQG 4.82
&rst
ixpk= 0, nxpk= 0, iat=1785, -1, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
igr2=2002,2003,2004,2006,2007,2008,
&end
#
# 112 LEU HA 112 LEU QQD 3.70
&rst
ixpk= 0, nxpk= 0, iat=1787, -1, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,
igr2=1794,1795,1796,1798,1799,1800,
&end
#
# 112 LEU HA 137 VAL QQG 6.21
&rst
ixpk= 0, nxpk= 0, iat=1787, -1, r1= 1.30, r2= 1.80, r3= 8.37, r4= 8.87,
igr2=2211,2212,2213,2215,2216,2217,
&end
#
# 112 LEU HB2 112 LEU QQD 3.83
&rst
ixpk= 0, nxpk= 0, iat=1789, -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
igr2=1794,1795,1796,1798,1799,1800,
&end
#
# 112 LEU HB2 125 VAL QQG 4.00
&rst
ixpk= 0, nxpk= 0, iat=1789, -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr2=2002,2003,2004,2006,2007,2008,
&end
#
# 112 LEU HB2 137 VAL QQG 5.65
&rst
ixpk= 0, nxpk= 0, iat=1789, -1, r1= 1.30, r2= 1.80, r3= 7.62, r4= 8.12,
igr2=2211,2212,2213,2215,2216,2217,
&end
#
# 112 LEU HB3 112 LEU QQD 4.02
&rst
ixpk= 0, nxpk= 0, iat=1790, -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr2=1794,1795,1796,1798,1799,1800,
&end
#
# 112 LEU HB3 125 VAL QQG 4.78
&rst
ixpk= 0, nxpk= 0, iat=1790, -1, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,
igr2=2002,2003,2004,2006,2007,2008,
&end
#
# 112 LEU HB3 137 VAL QQG 4.89
&rst
ixpk= 0, nxpk= 0, iat=1790, -1, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
igr2=2211,2212,2213,2215,2216,2217,
&end
#
# 112 LEU HG 125 VAL QQG 5.09
&rst
ixpk= 0, nxpk= 0, iat=1792, -1, r1= 1.30, r2= 1.80, r3= 6.86, r4= 7.36,
igr2=2002,2003,2004,2006,2007,2008,
&end
#
# 112 LEU HG 137 VAL QQG 6.27
&rst
ixpk= 0, nxpk= 0, iat=1792, -1, r1= 1.30, r2= 1.80, r3= 8.45, r4= 8.95,
igr2=2211,2212,2213,2215,2216,2217,
&end
#
# 112 LEU QQD 113 ARG H 5.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1804, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
igr1=1794,1795,1796,1798,1799,1800,
&end
#
# 112 LEU QQD 115 PHE HB3 5.72
&rst
ixpk= 0, nxpk= 0, iat= -1,1848, r1= 1.30, r2= 1.80, r3= 7.71, r4= 8.21,
igr1=1794,1795,1796,1798,1799,1800,
&end
#
# 112 LEU QQD 115 PHE QD 4.90
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr1=1794,1795,1796,1798,1799,1800,
igr2=1851,1859,
&end
#
# 112 LEU QQD 116 PHE QD 5.36
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.11, r4= 8.61,
igr1=1794,1795,1796,1798,1799,1800,
igr2=1871,1879,
&end
#
# 112 LEU QQD 125 VAL QQG 4.84
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.79, r4= 9.29,
igr1=1794,1795,1796,1798,1799,1800,
igr2=2002,2003,2004,2006,2007,2008,
&end
#
# 112 LEU QQD 135 ALA HA 5.66
&rst
ixpk= 0, nxpk= 0, iat= -1,2177, r1= 1.30, r2= 1.80, r3= 7.63, r4= 8.13,
igr1=1794,1795,1796,1798,1799,1800,
&end
#
# 112 LEU QQD 136 PHE H 5.56
&rst
ixpk= 0, nxpk= 0, iat= -1,2185, r1= 1.30, r2= 1.80, r3= 7.49, r4= 7.99,
igr1=1794,1795,1796,1798,1799,1800,
&end
#
# 112 LEU QQD 137 VAL HB 5.82
&rst
ixpk= 0, nxpk= 0, iat= -1,2209, r1= 1.30, r2= 1.80, r3= 7.85, r4= 8.35,
igr1=1794,1795,1796,1798,1799,1800,
&end
#
# 112 LEU QQD 137 VAL QQG 4.94
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.98, r4= 9.48,
igr1=1794,1795,1796,1798,1799,1800,
igr2=2211,2212,2213,2215,2216,2217,
&end
#
# 112 LEU QQD 155 ILE H 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2465, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
igr1=1794,1795,1796,1798,1799,1800,
&end
#
# 112 LEU QQD 155 ILE HB 5.63
&rst
ixpk= 0, nxpk= 0, iat= -1,2469, r1= 1.30, r2= 1.80, r3= 7.59, r4= 8.09,
igr1=1794,1795,1796,1798,1799,1800,
&end
#
# 112 LEU QQD 155 ILE QG2 4.70
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.61, r4= 8.11,
igr1=1794,1795,1796,1798,1799,1800,
igr2=2471,2472,2473,
&end
#
# 112 LEU QQD 155 ILE QG1 6.08
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.20, r4= 9.70,
igr1=1794,1795,1796,1798,1799,1800,
igr2=2475,2476,
&end
#
# 112 LEU QQD 155 ILE QD1 4.72
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
igr1=1794,1795,1796,1798,1799,1800,
igr2=2478,2479,2480,
&end
#
# 113 ARG H 122 VAL QQG 5.30
&rst
ixpk= 0, nxpk= 0, iat=1804, -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
igr2=1957,1958,1959,1961,1962,1963,
&end
#
# 113 ARG H 125 VAL QQG 4.11
&rst
ixpk= 0, nxpk= 0, iat=1804, -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
igr2=2002,2003,2004,2006,2007,2008,
&end
#
# 113 ARG HA 122 VAL QQG 4.02
&rst
ixpk= 0, nxpk= 0, iat=1806, -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr2=1957,1958,1959,1961,1962,1963,
&end
#
# 113 ARG HA 125 VAL QQG 4.03
&rst
ixpk= 0, nxpk= 0, iat=1806, -1, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
igr2=2002,2003,2004,2006,2007,2008,
&end
#
# 113 ARG HA 137 VAL QQG 4.80
&rst
ixpk= 0, nxpk= 0, iat=1806, -1, r1= 1.30, r2= 1.80, r3= 6.47, r4= 6.97,
igr2=2211,2212,2213,2215,2216,2217,
&end
#
# 113 ARG QB 122 VAL QQG 4.16
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.29, r4= 6.79,
igr1=1808,1809,
igr2=1957,1958,1959,1961,1962,1963,
&end
#
# 113 ARG QB 124 ASP QB 5.87
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.40, r4= 7.90,
igr1=1808,1809,
igr2=1988,1989,
&end
#
# 113 ARG QB 125 VAL QQG 3.98
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,
igr1=1808,1809,
igr2=2002,2003,2004,2006,2007,2008,
&end
#
# 113 ARG QB 137 VAL QQG 5.67
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.58, r4= 9.08,
igr1=1808,1809,
igr2=2211,2212,2213,2215,2216,2217,
&end
#
# 113 ARG HG3 122 VAL QQG 3.93
&rst
ixpk= 0, nxpk= 0, iat=1812, -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr2=1957,1958,1959,1961,1962,1963,
&end
#
# 113 ARG HG3 137 VAL QQG 6.50
&rst
ixpk= 0, nxpk= 0, iat=1812, -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
igr2=2211,2212,2213,2215,2216,2217,
&end
#
# 113 ARG HD2 125 VAL QQG 5.59
&rst
ixpk= 0, nxpk= 0, iat=1814, -1, r1= 1.30, r2= 1.80, r3= 7.54, r4= 8.04,
igr2=2002,2003,2004,2006,2007,2008,
&end
#
# 113 ARG HD3 122 VAL QQG 5.22
&rst
ixpk= 0, nxpk= 0, iat=1815, -1, r1= 1.30, r2= 1.80, r3= 7.04, r4= 7.54,
igr2=1957,1958,1959,1961,1962,1963,
&end
#
# 113 ARG HE 122 VAL QQG 6.21
&rst
ixpk= 0, nxpk= 0, iat=1817, -1, r1= 1.30, r2= 1.80, r3= 8.37, r4= 8.87,
igr2=1957,1958,1959,1961,1962,1963,
&end
#
# 114 GLU H 122 VAL QQG 6.33
&rst
ixpk= 0, nxpk= 0, iat=1828, -1, r1= 1.30, r2= 1.80, r3= 8.53, r4= 9.03,
igr2=1957,1958,1959,1961,1962,1963,
&end
#
# 114 GLU H 125 VAL QQG 5.41
&rst
ixpk= 0, nxpk= 0, iat=1828, -1, r1= 1.30, r2= 1.80, r3= 7.29, r4= 7.79,
igr2=2002,2003,2004,2006,2007,2008,
&end
#
# 115 PHE QD 148 LEU QQD 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.84, r4=10.34,
igr1=1851,1859,
igr2=2372,2373,2374,2376,2377,2378,
&end
#
# 115 PHE QD 153 LEU QQD 5.33
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.06, r4= 8.56,
igr1=1851,1859,
igr2=2436,2437,2438,2440,2441,2442,
&end
#
# 115 PHE QD 155 ILE QG1 5.71
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
igr1=1851,1859,
igr2=2475,2476,
&end
#
# 115 PHE QE 153 LEU QB 5.02
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.32, r4= 6.82,
igr1=1853,1857,
igr2=2431,2432,
&end
#
# 115 PHE QE 153 LEU QQD 4.01
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
igr1=1853,1857,
igr2=2436,2437,2438,2440,2441,2442,
&end
#
# 115 PHE QE 160 VAL QQG 4.76
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.20, r4= 7.70,
igr1=1853,1857,
igr2=2549,2550,2551,2553,2554,2555,
&end
#
# 115 PHE HZ 153 LEU QB 4.79
&rst
ixpk= 0, nxpk= 0, iat=1855, -1, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
igr2=2431,2432,
&end
#
# 115 PHE HZ 153 LEU QQD 4.12
&rst
ixpk= 0, nxpk= 0, iat=1855, -1, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,
igr2=2436,2437,2438,2440,2441,2442,
&end
#
# 115 PHE HZ 155 ILE QG1 5.52
&rst
ixpk= 0, nxpk= 0, iat=1855, -1, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
igr2=2475,2476,
&end
#
# 115 PHE HZ 160 VAL QQG 4.85
&rst
ixpk= 0, nxpk= 0, iat=1855, -1, r1= 1.30, r2= 1.80, r3= 6.54, r4= 7.04,
igr2=2549,2550,2551,2553,2554,2555,
&end
#
# 116 PHE H 122 VAL QQG 4.94
&rst
ixpk= 0, nxpk= 0, iat=1863, -1, r1= 1.30, r2= 1.80, r3= 6.66, r4= 7.16,
igr2=1957,1958,1959,1961,1962,1963,
&end
#
# 116 PHE H 137 VAL QQG 5.98
&rst
ixpk= 0, nxpk= 0, iat=1863, -1, r1= 1.30, r2= 1.80, r3= 8.06, r4= 8.56,
igr2=2211,2212,2213,2215,2216,2217,
&end
#
# 116 PHE HA 148 LEU QQD 5.46
&rst
ixpk= 0, nxpk= 0, iat=1865, -1, r1= 1.30, r2= 1.80, r3= 7.36, r4= 7.86,
igr2=2372,2373,2374,2376,2377,2378,
&end
#
# 116 PHE HB2 122 VAL QQG 4.43
&rst
ixpk= 0, nxpk= 0, iat=1867, -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr2=1957,1958,1959,1961,1962,1963,
&end
#
# 116 PHE HB2 137 VAL QQG 4.61
&rst
ixpk= 0, nxpk= 0, iat=1867, -1, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,
igr2=2211,2212,2213,2215,2216,2217,
&end
#
# 116 PHE HB3 122 VAL QQG 4.48
&rst
ixpk= 0, nxpk= 0, iat=1868, -1, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54,
igr2=1957,1958,1959,1961,1962,1963,
&end
#
# 116 PHE HB3 137 VAL QQG 4.45
&rst
ixpk= 0, nxpk= 0, iat=1868, -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr2=2211,2212,2213,2215,2216,2217,
&end
#
# 116 PHE QD 122 VAL QQG 5.27
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.97, r4= 8.47,
igr1=1871,1879,
igr2=1957,1958,1959,1961,1962,1963,
&end
#
# 116 PHE QD 125 VAL QQG 4.22
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.39, r4= 6.89,
igr1=1871,1879,
igr2=2002,2003,2004,2006,2007,2008,
&end
#
# 116 PHE QD 137 VAL QQG 4.03
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.10, r4= 6.60,
igr1=1871,1879,
igr2=2211,2212,2213,2215,2216,2217,
&end
#
# 116 PHE QD 148 LEU QQD 4.20
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
igr1=1871,1879,
igr2=2372,2373,2374,2376,2377,2378,
&end
#
# 116 PHE QD 153 LEU QQD 4.74
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.17, r4= 7.67,
igr1=1871,1879,
igr2=2436,2437,2438,2440,2441,2442,
&end
#
# 116 PHE QD 160 VAL QQG 6.20
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.38, r4= 9.88,
igr1=1871,1879,
igr2=2549,2550,2551,2553,2554,2555,
&end
#
# 116 PHE QE 125 VAL QQG 5.33
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.06, r4= 8.56,
igr1=1873,1877,
igr2=2002,2003,2004,2006,2007,2008,
&end
#
# 116 PHE QE 137 VAL QQG 4.31
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
igr1=1873,1877,
igr2=2211,2212,2213,2215,2216,2217,
&end
#
# 116 PHE QE 153 LEU QQD 4.36
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.60, r4= 7.10,
igr1=1873,1877,
igr2=2436,2437,2438,2440,2441,2442,
&end
#
# 116 PHE QE 160 VAL QQG 4.94
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.47, r4= 7.97,
igr1=1873,1877,
igr2=2549,2550,2551,2553,2554,2555,
&end
#
# 116 PHE HZ 137 VAL QQG 4.66
&rst
ixpk= 0, nxpk= 0, iat=1875, -1, r1= 1.30, r2= 1.80, r3= 6.28, r4= 6.78,
igr2=2211,2212,2213,2215,2216,2217,
&end
#
# 116 PHE HZ 160 VAL QQG 5.01
&rst
ixpk= 0, nxpk= 0, iat=1875, -1, r1= 1.30, r2= 1.80, r3= 6.75, r4= 7.25,
igr2=2549,2550,2551,2553,2554,2555,
&end
#
# 117 SER H 117 SER QB 2.90
&rst
ixpk= 0, nxpk= 0, iat=1883, -1, r1= 1.30, r2= 1.80, r3= 3.26, r4= 3.76,
igr2=1887,1888,
&end
#
# 117 SER H 122 VAL QQG 4.22
&rst
ixpk= 0, nxpk= 0, iat=1883, -1, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
igr2=1957,1958,1959,1961,1962,1963,
&end
#
# 117 SER H 137 VAL QQG 6.50
&rst
ixpk= 0, nxpk= 0, iat=1883, -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
igr2=2211,2212,2213,2215,2216,2217,
&end
#
# 117 SER HA 122 VAL QQG 4.16
&rst
ixpk= 0, nxpk= 0, iat=1885, -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr2=1957,1958,1959,1961,1962,1963,
&end
#
# 117 SER QB 122 VAL H 4.44
&rst
ixpk= 0, nxpk= 0, iat= -1,1951, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
igr1=1887,1888,
&end
#
# 118 GLN H 122 VAL QQG 5.49
&rst
ixpk= 0, nxpk= 0, iat=1894, -1, r1= 1.30, r2= 1.80, r3= 7.40, r4= 7.90,
igr2=1957,1958,1959,1961,1962,1963,
&end
#
# 119 TYR H 148 LEU QQD 6.04
&rst
ixpk= 0, nxpk= 0, iat=1911, -1, r1= 1.30, r2= 1.80, r3= 8.14, r4= 8.64,
igr2=2372,2373,2374,2376,2377,2378,
&end
#
# 119 TYR HB2 148 LEU QQD 4.68
&rst
ixpk= 0, nxpk= 0, iat=1915, -1, r1= 1.30, r2= 1.80, r3= 6.31, r4= 6.81,
igr2=2372,2373,2374,2376,2377,2378,
&end
#
# 119 TYR HB3 148 LEU QQD 5.19
&rst
ixpk= 0, nxpk= 0, iat=1916, -1, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,
igr2=2372,2373,2374,2376,2377,2378,
&end
#
# 119 TYR QD 153 LEU QQD 5.16
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr1=1919,1928,
igr2=2436,2437,2438,2440,2441,2442,
&end
#
# 119 TYR QE 148 LEU QQD 4.81
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
igr1=1921,1926,
igr2=2372,2373,2374,2376,2377,2378,
&end
#
# 119 TYR QE 153 LEU QQD 4.28
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.48, r4= 6.98,
igr1=1921,1926,
igr2=2436,2437,2438,2440,2441,2442,
&end
#
# 120 GLY QA 121 ASP QB 4.46
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
igr1=1934,1935,
igr2=1943,1944,
&end
#
# 121 ASP H 121 ASP QB 2.89
&rst
ixpk= 0, nxpk= 0, iat=1939, -1, r1= 1.30, r2= 1.80, r3= 3.24, r4= 3.74,
igr2=1943,1944,
&end
#
# 121 ASP HA 122 VAL QQG 4.59
&rst
ixpk= 0, nxpk= 0, iat=1941, -1, r1= 1.30, r2= 1.80, r3= 6.19, r4= 6.69,
igr2=1957,1958,1959,1961,1962,1963,
&end
#
# 121 ASP QB 122 VAL H 3.34
&rst
ixpk= 0, nxpk= 0, iat= -1,1951, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,
igr1=1943,1944,
&end
#
# 121 ASP QB 122 VAL HB 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1955, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1=1943,1944,
&end
#
# 121 ASP QB 122 VAL QQG 6.15
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.31, r4= 9.81,
igr1=1943,1944,
igr2=1957,1958,1959,1961,1962,1963,
&end
#
# 121 ASP QB 123 MET QE 3.09
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67,
igr1=1943,1944,
igr2=1978,1979,1980,
&end
#
# 121 ASP QB 140 ALA H 4.29
&rst
ixpk= 0, nxpk= 0, iat= -1,2255, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
igr1=1943,1944,
&end
#
# 121 ASP QB 144 ILE QD1 5.20
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.01, r4= 7.51,
igr1=1943,1944,
igr2=2319,2320,2321,
&end
#
# 122 VAL H 122 VAL QQG 3.79
&rst
ixpk= 0, nxpk= 0, iat=1951, -1, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,
igr2=1957,1958,1959,1961,1962,1963,
&end
#
# 122 VAL HB 137 VAL QQG 4.80
&rst
ixpk= 0, nxpk= 0, iat=1955, -1, r1= 1.30, r2= 1.80, r3= 6.47, r4= 6.97,
igr2=2211,2212,2213,2215,2216,2217,
&end
#
# 122 VAL QQG 123 MET H 3.79
&rst
ixpk= 0, nxpk= 0, iat= -1,1967, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,
igr1=1957,1958,1959,1961,1962,1963,
&end
#
# 122 VAL QQG 123 MET HA 5.26
&rst
ixpk= 0, nxpk= 0, iat= -1,1969, r1= 1.30, r2= 1.80, r3= 7.09, r4= 7.59,
igr1=1957,1958,1959,1961,1962,1963,
&end
#
# 122 VAL QQG 123 MET HB2 5.25
&rst
ixpk= 0, nxpk= 0, iat= -1,1971, r1= 1.30, r2= 1.80, r3= 7.08, r4= 7.58,
igr1=1957,1958,1959,1961,1962,1963,
&end
#
# 122 VAL QQG 123 MET HB3 6.03
&rst
ixpk= 0, nxpk= 0, iat= -1,1972, r1= 1.30, r2= 1.80, r3= 8.13, r4= 8.63,
igr1=1957,1958,1959,1961,1962,1963,
&end
#
# 122 VAL QQG 123 MET QE 5.42
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.77, r4= 9.27,
igr1=1957,1958,1959,1961,1962,1963,
igr2=1978,1979,1980,
&end
#
# 122 VAL QQG 124 ASP H 3.90
&rst
ixpk= 0, nxpk= 0, iat= -1,1984, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr1=1957,1958,1959,1961,1962,1963,
&end
#
# 122 VAL QQG 124 ASP HA 5.40
&rst
ixpk= 0, nxpk= 0, iat= -1,1986, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
igr1=1957,1958,1959,1961,1962,1963,
&end
#
# 122 VAL QQG 124 ASP QB 5.51
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.34, r4= 8.84,
igr1=1957,1958,1959,1961,1962,1963,
igr2=1988,1989,
&end
#
# 122 VAL QQG 125 VAL H 5.44
&rst
ixpk= 0, nxpk= 0, iat= -1,1996, r1= 1.30, r2= 1.80, r3= 7.33, r4= 7.83,
igr1=1957,1958,1959,1961,1962,1963,
&end
#
# 122 VAL QQG 125 VAL QQG 3.91
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.10, r4= 7.60,
igr1=1957,1958,1959,1961,1962,1963,
igr2=2002,2003,2004,2006,2007,2008,
&end
#
# 122 VAL QQG 137 VAL QQG 3.64
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1=1957,1958,1959,1961,1962,1963,
igr2=2211,2212,2213,2215,2216,2217,
&end
#
# 122 VAL QQG 138 THR H 4.89
&rst
ixpk= 0, nxpk= 0, iat= -1,2221, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
igr1=1957,1958,1959,1961,1962,1963,
&end
#
# 122 VAL QQG 138 THR QG2 5.93
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.60, r4=10.10,
igr1=1957,1958,1959,1961,1962,1963,
igr2=2227,2228,2229,
&end
#
# 122 VAL QQG 139 PHE HA 4.86
&rst
ixpk= 0, nxpk= 0, iat= -1,2237, r1= 1.30, r2= 1.80, r3= 6.55, r4= 7.05,
igr1=1957,1958,1959,1961,1962,1963,
&end
#
# 122 VAL QQG 139 PHE QE 4.84
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.32, r4= 7.82,
igr1=1957,1958,1959,1961,1962,1963,
igr2=2245,2249,
&end
#
# 122 VAL QQG 139 PHE HZ 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2247, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
igr1=1957,1958,1959,1961,1962,1963,
&end
#
# 122 VAL QQG 140 ALA QB 6.26
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3=10.13, r4=10.63,
igr1=1957,1958,1959,1961,1962,1963,
igr2=2259,2260,2261,
&end
#
# 123 MET H 124 ASP QB 5.21
&rst
ixpk= 0, nxpk= 0, iat=1967, -1, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
igr2=1988,1989,
&end
#
# 123 MET H 137 VAL QQG 5.75
&rst
ixpk= 0, nxpk= 0, iat=1967, -1, r1= 1.30, r2= 1.80, r3= 7.75, r4= 8.25,
igr2=2211,2212,2213,2215,2216,2217,
&end
#
# 123 MET HA 124 ASP QB 4.75
&rst
ixpk= 0, nxpk= 0, iat=1969, -1, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
igr2=1988,1989,
&end
#
# 123 MET HB2 124 ASP QB 4.45
&rst
ixpk= 0, nxpk= 0, iat=1971, -1, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,
igr2=1988,1989,
&end
#
# 123 MET HB3 124 ASP QB 5.18
&rst
ixpk= 0, nxpk= 0, iat=1972, -1, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
igr2=1988,1989,
&end
#
# 124 ASP H 124 ASP QB 3.20
&rst
ixpk= 0, nxpk= 0, iat=1984, -1, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09,
igr2=1988,1989,
&end
#
# 124 ASP H 125 VAL QQG 5.01
&rst
ixpk= 0, nxpk= 0, iat=1984, -1, r1= 1.30, r2= 1.80, r3= 6.75, r4= 7.25,
igr2=2002,2003,2004,2006,2007,2008,
&end
#
# 124 ASP H 137 VAL QQG 4.77
&rst
ixpk= 0, nxpk= 0, iat=1984, -1, r1= 1.30, r2= 1.80, r3= 6.43, r4= 6.93,
igr2=2211,2212,2213,2215,2216,2217,
&end
#
# 124 ASP HA 125 VAL QQG 5.34
&rst
ixpk= 0, nxpk= 0, iat=1986, -1, r1= 1.30, r2= 1.80, r3= 7.20, r4= 7.70,
igr2=2002,2003,2004,2006,2007,2008,
&end
#
# 124 ASP QB 125 VAL H 3.35
&rst
ixpk= 0, nxpk= 0, iat= -1,1996, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,
igr1=1988,1989,
&end
#
# 124 ASP QB 125 VAL HA 4.52
&rst
ixpk= 0, nxpk= 0, iat= -1,1998, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
igr1=1988,1989,
&end
#
# 124 ASP QB 125 VAL QQG 5.62
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.50, r4= 9.00,
igr1=1988,1989,
igr2=2002,2003,2004,2006,2007,2008,
&end
#
# 124 ASP QB 126 PHE H 5.60
&rst
ixpk= 0, nxpk= 0, iat= -1,2012, r1= 1.30, r2= 1.80, r3= 6.29, r4= 6.79,
igr1=1988,1989,
&end
#
# 124 ASP QB 138 THR H 4.47
&rst
ixpk= 0, nxpk= 0, iat= -1,2221, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
igr1=1988,1989,
&end
#
# 124 ASP QB 138 THR HB 3.97
&rst
ixpk= 0, nxpk= 0, iat= -1,2225, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
igr1=1988,1989,
&end
#
# 125 VAL H 125 VAL QQG 4.13
&rst
ixpk= 0, nxpk= 0, iat=1996, -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
igr2=2002,2003,2004,2006,2007,2008,
&end
#
# 125 VAL H 137 VAL QQG 6.48
&rst
ixpk= 0, nxpk= 0, iat=1996, -1, r1= 1.30, r2= 1.80, r3= 8.74, r4= 9.24,
igr2=2211,2212,2213,2215,2216,2217,
&end
#
# 125 VAL HA 125 VAL QQG 3.79
&rst
ixpk= 0, nxpk= 0, iat=1998, -1, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,
igr2=2002,2003,2004,2006,2007,2008,
&end
#
# 125 VAL HA 126 PHE QB 4.78
&rst
ixpk= 0, nxpk= 0, iat=1998, -1, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr2=2016,2017,
&end
#
# 125 VAL HB 137 VAL QQG 5.79
&rst
ixpk= 0, nxpk= 0, iat=2000, -1, r1= 1.30, r2= 1.80, r3= 7.80, r4= 8.30,
igr2=2211,2212,2213,2215,2216,2217,
&end
#
# 125 VAL QQG 126 PHE H 4.21
&rst
ixpk= 0, nxpk= 0, iat= -1,2012, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
igr1=2002,2003,2004,2006,2007,2008,
&end
#
# 125 VAL QQG 126 PHE HA 4.75
&rst
ixpk= 0, nxpk= 0, iat= -1,2014, r1= 1.30, r2= 1.80, r3= 6.40, r4= 6.90,
igr1=2002,2003,2004,2006,2007,2008,
&end
#
# 125 VAL QQG 127 ILE H 5.19
&rst
ixpk= 0, nxpk= 0, iat= -1,2032, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,
igr1=2002,2003,2004,2006,2007,2008,
&end
#
# 125 VAL QQG 127 ILE HB 5.24
&rst
ixpk= 0, nxpk= 0, iat= -1,2036, r1= 1.30, r2= 1.80, r3= 7.06, r4= 7.56,
igr1=2002,2003,2004,2006,2007,2008,
&end
#
# 125 VAL QQG 127 ILE HG13 4.32
&rst
ixpk= 0, nxpk= 0, iat= -1,2043, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32,
igr1=2002,2003,2004,2006,2007,2008,
&end
#
# 125 VAL QQG 127 ILE QD1 4.62
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.48, r4= 7.98,
igr1=2002,2003,2004,2006,2007,2008,
igr2=2045,2046,2047,
&end
#
# 125 VAL QQG 136 PHE QB 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.84, r4=10.34,
igr1=2002,2003,2004,2006,2007,2008,
igr2=2189,2190,
&end
#
# 125 VAL QQG 137 VAL H 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2205, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
igr1=2002,2003,2004,2006,2007,2008,
&end
#
# 125 VAL QQG 137 VAL HA 4.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2207, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
igr1=2002,2003,2004,2006,2007,2008,
&end
#
# 125 VAL QQG 137 VAL HB 4.93
&rst
ixpk= 0, nxpk= 0, iat= -1,2209, r1= 1.30, r2= 1.80, r3= 6.65, r4= 7.15,
igr1=2002,2003,2004,2006,2007,2008,
&end
#
# 125 VAL QQG 137 VAL QQG 3.60
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.54, r4= 7.04,
igr1=2002,2003,2004,2006,2007,2008,
igr2=2211,2212,2213,2215,2216,2217,
&end
#
# 125 VAL QQG 138 THR H 5.04
&rst
ixpk= 0, nxpk= 0, iat= -1,2221, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1=2002,2003,2004,2006,2007,2008,
&end
#
# 126 PHE H 137 VAL QQG 5.23
&rst
ixpk= 0, nxpk= 0, iat=2012, -1, r1= 1.30, r2= 1.80, r3= 7.05, r4= 7.55,
igr2=2211,2212,2213,2215,2216,2217,
&end
#
# 126 PHE QB 136 PHE H 4.61
&rst
ixpk= 0, nxpk= 0, iat= -1,2185, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67,
igr1=2016,2017,
&end
#
# 126 PHE QB 136 PHE QB 4.51
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
igr1=2016,2017,
igr2=2189,2190,
&end
#
# 127 ILE HA 128 PRO QG 4.47
&rst
ixpk= 0, nxpk= 0, iat=2034, -1, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
igr2=2055,2056,
&end
#
# 127 ILE QG2 129 LYS QG 6.28
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.47, r4= 8.97,
igr1=2038,2039,2040,
igr2=2072,2073,
&end
#
# 127 ILE QG2 129 LYS QE 5.10
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.87, r4= 7.37,
igr1=2038,2039,2040,
igr2=2078,2079,
&end
#
# 127 ILE QD1 137 VAL QQG 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3=10.52, r4=11.02,
igr1=2045,2046,2047,
igr2=2211,2212,2213,2215,2216,2217,
&end
#
# 128 PRO HA 129 LYS QG 6.09
&rst
ixpk= 0, nxpk= 0, iat=2061, -1, r1= 1.30, r2= 1.80, r3= 6.84, r4= 7.34,
igr2=2072,2073,
&end
#
# 128 PRO QB 129 LYS H 3.36
&rst
ixpk= 0, nxpk= 0, iat= -1,2065, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
igr1=2058,2059,
&end
#
# 128 PRO QG 129 LYS H 4.89
&rst
ixpk= 0, nxpk= 0, iat= -1,2065, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
igr1=2055,2056,
&end
#
# 128 PRO QG 134 PHE QE 4.85
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
igr1=2055,2056,
igr2=2165,2169,
&end
#
# 128 PRO QG 134 PHE HZ 4.81
&rst
ixpk= 0, nxpk= 0, iat= -1,2167, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr1=2055,2056,
&end
#
# 129 LYS H 129 LYS QB 4.32
&rst
ixpk= 0, nxpk= 0, iat=2065, -1, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
igr2=2069,2070,
&end
#
# 129 LYS H 129 LYS QE 5.00
&rst
ixpk= 0, nxpk= 0, iat=2065, -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr2=2078,2079,
&end
#
# 129 LYS QB 129 LYS QG 3.36
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,
igr1=2069,2070,
igr2=2072,2073,
&end
#
# 129 LYS QB 130 PRO HA 3.88
&rst
ixpk= 0, nxpk= 0, iat= -1,2097, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,
igr1=2069,2070,
&end
#
# 129 LYS QB 130 PRO HB2 4.95
&rst
ixpk= 0, nxpk= 0, iat= -1,2094, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
igr1=2069,2070,
&end
#
# 129 LYS QG 130 PRO HA 3.32
&rst
ixpk= 0, nxpk= 0, iat= -1,2097, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23,
igr1=2072,2073,
&end
#
# 129 LYS QG 130 PRO HB2 5.57
&rst
ixpk= 0, nxpk= 0, iat= -1,2094, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75,
igr1=2072,2073,
&end
#
# 129 LYS QG 130 PRO HB3 4.64
&rst
ixpk= 0, nxpk= 0, iat= -1,2095, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,
igr1=2072,2073,
&end
#
# 132 ARG H 132 ARG QG 4.31
&rst
ixpk= 0, nxpk= 0, iat=2121, -1, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
igr2=2128,2129,
&end
#
# 132 ARG QB 134 PHE H 4.65
&rst
ixpk= 0, nxpk= 0, iat= -1,2155, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
igr1=2125,2126,
&end
#
# 132 ARG QB 134 PHE QD 5.79
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.29, r4= 7.79,
igr1=2125,2126,
igr2=2163,2171,
&end
#
# 132 ARG QG 134 PHE H 5.48
&rst
ixpk= 0, nxpk= 0, iat= -1,2155, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
igr1=2128,2129,
&end
#
# 132 ARG QG 134 PHE QD 5.36
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.75, r4= 7.25,
igr1=2128,2129,
igr2=2163,2171,
&end
#
# 132 ARG QD 134 PHE H 5.53
&rst
ixpk= 0, nxpk= 0, iat= -1,2155, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,
igr1=2131,2132,
&end
#
# 134 PHE H 134 PHE QB 3.67
&rst
ixpk= 0, nxpk= 0, iat=2155, -1, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
igr2=2159,2160,
&end
#
# 134 PHE QB 135 ALA H 3.32
&rst
ixpk= 0, nxpk= 0, iat= -1,2175, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23,
igr1=2159,2160,
&end
#
# 135 ALA QB 137 VAL QQG 4.63
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.50, r4= 8.00,
igr1=2179,2180,2181,
igr2=2211,2212,2213,2215,2216,2217,
&end
#
# 136 PHE H 137 VAL QQG 5.65
&rst
ixpk= 0, nxpk= 0, iat=2185, -1, r1= 1.30, r2= 1.80, r3= 7.62, r4= 8.12,
igr2=2211,2212,2213,2215,2216,2217,
&end
#
# 136 PHE HA 137 VAL QQG 5.47
&rst
ixpk= 0, nxpk= 0, iat=2187, -1, r1= 1.30, r2= 1.80, r3= 7.37, r4= 7.87,
igr2=2211,2212,2213,2215,2216,2217,
&end
#
# 137 VAL H 137 VAL QQG 3.99
&rst
ixpk= 0, nxpk= 0, iat=2205, -1, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
igr2=2211,2212,2213,2215,2216,2217,
&end
#
# 137 VAL QQG 138 THR H 4.02
&rst
ixpk= 0, nxpk= 0, iat= -1,2221, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr1=2211,2212,2213,2215,2216,2217,
&end
#
# 137 VAL QQG 138 THR QG2 5.85
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.47, r4= 9.97,
igr1=2211,2212,2213,2215,2216,2217,
igr2=2227,2228,2229,
&end
#
# 137 VAL QQG 139 PHE H 5.79
&rst
ixpk= 0, nxpk= 0, iat= -1,2235, r1= 1.30, r2= 1.80, r3= 7.80, r4= 8.30,
igr1=2211,2212,2213,2215,2216,2217,
&end
#
# 137 VAL QQG 139 PHE QE 4.20
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
igr1=2211,2212,2213,2215,2216,2217,
igr2=2245,2249,
&end
#
# 137 VAL QQG 139 PHE HZ 5.68
&rst
ixpk= 0, nxpk= 0, iat= -1,2247, r1= 1.30, r2= 1.80, r3= 7.66, r4= 8.16,
igr1=2211,2212,2213,2215,2216,2217,
&end
#
# 137 VAL QQG 155 ILE QD1 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3=10.52, r4=11.02,
igr1=2211,2212,2213,2215,2216,2217,
igr2=2478,2479,2480,
&end
#
# 137 VAL QQG 162 ILE QG2 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3=10.52, r4=11.02,
igr1=2211,2212,2213,2215,2216,2217,
igr2=2582,2583,2584,
&end
#
# 139 PHE QE 148 LEU QQD 3.79
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23,
igr1=2245,2249,
igr2=2372,2373,2374,2376,2377,2378,
&end
#
# 139 PHE HZ 148 LEU QQD 4.79
&rst
ixpk= 0, nxpk= 0, iat=2247, -1, r1= 1.30, r2= 1.80, r3= 6.46, r4= 6.96,
igr2=2372,2373,2374,2376,2377,2378,
&end
#
# 144 ILE HA 148 LEU QQD 6.20
&rst
ixpk= 0, nxpk= 0, iat=2308, -1, r1= 1.30, r2= 1.80, r3= 8.36, r4= 8.86,
igr2=2372,2373,2374,2376,2377,2378,
&end
#
# 144 ILE QG2 148 LEU QQD 4.94
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.00, r4= 8.50,
igr1=2312,2313,2314,
igr2=2372,2373,2374,2376,2377,2378,
&end
#
# 144 ILE HG12 148 LEU QQD 6.50
&rst
ixpk= 0, nxpk= 0, iat=2316, -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
igr2=2372,2373,2374,2376,2377,2378,
&end
#
# 144 ILE QD1 148 LEU QQD 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3=10.52, r4=11.02,
igr1=2319,2320,2321,
igr2=2372,2373,2374,2376,2377,2378,
&end
#
# 145 ALA HA 148 LEU QQD 4.42
&rst
ixpk= 0, nxpk= 0, iat=2327, -1, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
igr2=2372,2373,2374,2376,2377,2378,
&end
#
# 145 ALA QB 148 LEU QQD 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
igr1=2329,2330,2331,
igr2=2372,2373,2374,2376,2377,2378,
&end
#
# 146 GLN HA 146 GLN QE2 4.90
&rst
ixpk= 0, nxpk= 0, iat=2337, -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
igr2=2347,2348,
&end
#
# 146 GLN HA 149 CYS QB 3.94
&rst
ixpk= 0, nxpk= 0, iat=2337, -1, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
igr2=2386,2387,
&end
#
# 146 GLN QB 146 GLN QE2 4.24
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr1=2339,2340,
igr2=2347,2348,
&end
#
# 146 GLN QG 149 CYS QB 5.78
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
igr1=2342,2343,
igr2=2386,2387,
&end
#
# 147 SER H 148 LEU QQD 6.48
&rst
ixpk= 0, nxpk= 0, iat=2352, -1, r1= 1.30, r2= 1.80, r3= 8.74, r4= 9.24,
igr2=2372,2373,2374,2376,2377,2378,
&end
#
# 148 LEU H 148 LEU QQD 4.26
&rst
ixpk= 0, nxpk= 0, iat=2363, -1, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
igr2=2372,2373,2374,2376,2377,2378,
&end
#
# 148 LEU H 149 CYS QB 4.09
&rst
ixpk= 0, nxpk= 0, iat=2363, -1, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
igr2=2386,2387,
&end
#
# 148 LEU H 151 GLU QG 5.31
&rst
ixpk= 0, nxpk= 0, iat=2363, -1, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
igr2=2407,2408,
&end
#
# 148 LEU H 153 LEU QQD 6.50
&rst
ixpk= 0, nxpk= 0, iat=2363, -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
igr2=2436,2437,2438,2440,2441,2442,
&end
#
# 148 LEU HA 148 LEU QQD 6.23
&rst
ixpk= 0, nxpk= 0, iat=2365, -1, r1= 1.30, r2= 1.80, r3= 8.40, r4= 8.90,
igr2=2372,2373,2374,2376,2377,2378,
&end
#
# 148 LEU HA 151 GLU QG 3.45
&rst
ixpk= 0, nxpk= 0, iat=2365, -1, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,
igr2=2407,2408,
&end
#
# 148 LEU HA 153 LEU QQD 5.15
&rst
ixpk= 0, nxpk= 0, iat=2365, -1, r1= 1.30, r2= 1.80, r3= 6.94, r4= 7.44,
igr2=2436,2437,2438,2440,2441,2442,
&end
#
# 148 LEU HB2 148 LEU QQD 3.79
&rst
ixpk= 0, nxpk= 0, iat=2367, -1, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,
igr2=2372,2373,2374,2376,2377,2378,
&end
#
# 148 LEU HB2 151 GLU QG 4.74
&rst
ixpk= 0, nxpk= 0, iat=2367, -1, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
igr2=2407,2408,
&end
#
# 148 LEU HG 153 LEU QQD 4.40
&rst
ixpk= 0, nxpk= 0, iat=2370, -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr2=2436,2437,2438,2440,2441,2442,
&end
#
# 148 LEU QQD 149 CYS H 6.14
&rst
ixpk= 0, nxpk= 0, iat= -1,2382, r1= 1.30, r2= 1.80, r3= 8.28, r4= 8.78,
igr1=2372,2373,2374,2376,2377,2378,
&end
#
# 148 LEU QQD 149 CYS QB 5.26
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.96, r4= 8.46,
igr1=2372,2373,2374,2376,2377,2378,
igr2=2386,2387,
&end
#
# 148 LEU QQD 151 GLU QG 6.06
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.17, r4= 9.67,
igr1=2372,2373,2374,2376,2377,2378,
igr2=2407,2408,
&end
#
# 148 LEU QQD 152 ASP H 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2415, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
igr1=2372,2373,2374,2376,2377,2378,
&end
#
# 148 LEU QQD 153 LEU QQD 3.74
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.80, r4= 7.30,
igr1=2372,2373,2374,2376,2377,2378,
igr2=2436,2437,2438,2440,2441,2442,
&end
#
# 148 LEU QQD 162 ILE HB 5.55
&rst
ixpk= 0, nxpk= 0, iat= -1,2580, r1= 1.30, r2= 1.80, r3= 7.48, r4= 7.98,
igr1=2372,2373,2374,2376,2377,2378,
&end
#
# 148 LEU QQD 162 ILE QG2 5.33
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.63, r4= 9.13,
igr1=2372,2373,2374,2376,2377,2378,
igr2=2582,2583,2584,
&end
#
# 148 LEU QQD 162 ILE QD1 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3=10.52, r4=11.02,
igr1=2372,2373,2374,2376,2377,2378,
igr2=2589,2590,2591,
&end
#
# 149 CYS H 149 CYS QB 2.96
&rst
ixpk= 0, nxpk= 0, iat=2382, -1, r1= 1.30, r2= 1.80, r3= 3.32, r4= 3.82,
igr2=2386,2387,
&end
#
# 149 CYS H 151 GLU QG 4.07
&rst
ixpk= 0, nxpk= 0, iat=2382, -1, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,
igr2=2407,2408,
&end
#
# 149 CYS QB 150 GLY H 3.68
&rst
ixpk= 0, nxpk= 0, iat= -1,2393, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
igr1=2386,2387,
&end
#
# 149 CYS QB 150 GLY QA 5.78
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
igr1=2386,2387,
igr2=2395,2396,
&end
#
# 149 CYS QB 151 GLU H 5.52
&rst
ixpk= 0, nxpk= 0, iat= -1,2400, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
igr1=2386,2387,
&end
#
# 149 CYS QB 151 GLU QG 5.83
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.35, r4= 7.85,
igr1=2386,2387,
igr2=2407,2408,
&end
#
# 149 CYS QB 162 ILE HB 4.82
&rst
ixpk= 0, nxpk= 0, iat= -1,2580, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91,
igr1=2386,2387,
&end
#
# 149 CYS QB 162 ILE QG2 4.99
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1=2386,2387,
igr2=2582,2583,2584,
&end
#
# 149 CYS QB 163 SER HA 4.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2597, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
igr1=2386,2387,
&end
#
# 149 CYS QB 164 ASN H 4.88
&rst
ixpk= 0, nxpk= 0, iat= -1,2606, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
igr1=2386,2387,
&end
#
# 149 CYS QB 164 ASN HD21 4.46
&rst
ixpk= 0, nxpk= 0, iat= -1,2616, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
igr1=2386,2387,
&end
#
# 150 GLY H 151 GLU QG 5.22
&rst
ixpk= 0, nxpk= 0, iat=2393, -1, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
igr2=2407,2408,
&end
#
# 150 GLY QA 162 ILE QG2 6.13
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.26, r4= 8.76,
igr1=2395,2396,
igr2=2582,2583,2584,
&end
#
# 151 GLU H 151 GLU QG 3.23
&rst
ixpk= 0, nxpk= 0, iat=2400, -1, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13,
igr2=2407,2408,
&end
#
# 151 GLU H 153 LEU QQD 5.17
&rst
ixpk= 0, nxpk= 0, iat=2400, -1, r1= 1.30, r2= 1.80, r3= 6.97, r4= 7.47,
igr2=2436,2437,2438,2440,2441,2442,
&end
#
# 151 GLU HA 151 GLU QG 3.55
&rst
ixpk= 0, nxpk= 0, iat=2402, -1, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,
igr2=2407,2408,
&end
#
# 151 GLU HA 153 LEU QQD 5.90
&rst
ixpk= 0, nxpk= 0, iat=2402, -1, r1= 1.30, r2= 1.80, r3= 7.95, r4= 8.45,
igr2=2436,2437,2438,2440,2441,2442,
&end
#
# 151 GLU QB 153 LEU QQD 4.06
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.14, r4= 6.64,
igr1=2404,2405,
igr2=2436,2437,2438,2440,2441,2442,
&end
#
# 151 GLU QG 152 ASP H 4.67
&rst
ixpk= 0, nxpk= 0, iat= -1,2415, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr1=2407,2408,
&end
#
# 151 GLU QG 153 LEU QQD 5.18
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.84, r4= 8.34,
igr1=2407,2408,
igr2=2436,2437,2438,2440,2441,2442,
&end
#
# 152 ASP H 152 ASP QB 3.62
&rst
ixpk= 0, nxpk= 0, iat=2415, -1, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,
igr2=2419,2420,
&end
#
# 152 ASP H 153 LEU QQD 4.94
&rst
ixpk= 0, nxpk= 0, iat=2415, -1, r1= 1.30, r2= 1.80, r3= 6.66, r4= 7.16,
igr2=2436,2437,2438,2440,2441,2442,
&end
#
# 152 ASP H 160 VAL QQG 6.50
&rst
ixpk= 0, nxpk= 0, iat=2415, -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
igr2=2549,2550,2551,2553,2554,2555,
&end
#
# 152 ASP HA 153 LEU QQD 5.13
&rst
ixpk= 0, nxpk= 0, iat=2417, -1, r1= 1.30, r2= 1.80, r3= 6.92, r4= 7.42,
igr2=2436,2437,2438,2440,2441,2442,
&end
#
# 152 ASP HA 160 VAL QQG 5.87
&rst
ixpk= 0, nxpk= 0, iat=2417, -1, r1= 1.30, r2= 1.80, r3= 7.91, r4= 8.41,
igr2=2549,2550,2551,2553,2554,2555,
&end
#
# 153 LEU H 153 LEU QB 4.45
&rst
ixpk= 0, nxpk= 0, iat=2427, -1, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,
igr2=2431,2432,
&end
#
# 153 LEU H 153 LEU QQD 4.72
&rst
ixpk= 0, nxpk= 0, iat=2427, -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
igr2=2436,2437,2438,2440,2441,2442,
&end
#
# 153 LEU H 160 VAL QQG 4.53
&rst
ixpk= 0, nxpk= 0, iat=2427, -1, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
igr2=2549,2550,2551,2553,2554,2555,
&end
#
# 153 LEU HA 153 LEU QQD 4.05
&rst
ixpk= 0, nxpk= 0, iat=2429, -1, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
igr2=2436,2437,2438,2440,2441,2442,
&end
#
# 153 LEU QB 153 LEU QQD 3.55
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr1=2431,2432,
igr2=2436,2437,2438,2440,2441,2442,
&end
#
# 153 LEU QB 154 ILE H 4.15
&rst
ixpk= 0, nxpk= 0, iat= -1,2446, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
igr1=2431,2432,
&end
#
# 153 LEU QB 160 VAL H 6.23
&rst
ixpk= 0, nxpk= 0, iat= -1,2543, r1= 1.30, r2= 1.80, r3= 6.99, r4= 7.49,
igr1=2431,2432,
&end
#
# 153 LEU QB 160 VAL QQG 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.08, r4= 8.58,
igr1=2431,2432,
igr2=2549,2550,2551,2553,2554,2555,
&end
#
# 153 LEU QB 162 ILE QD1 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
igr1=2431,2432,
igr2=2589,2590,2591,
&end
#
# 153 LEU HG 160 VAL QQG 4.51
&rst
ixpk= 0, nxpk= 0, iat=2434, -1, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
igr2=2549,2550,2551,2553,2554,2555,
&end
#
# 153 LEU QQD 154 ILE H 5.95
&rst
ixpk= 0, nxpk= 0, iat= -1,2446, r1= 1.30, r2= 1.80, r3= 8.02, r4= 8.52,
igr1=2436,2437,2438,2440,2441,2442,
&end
#
# 153 LEU QQD 155 ILE QG1 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.84, r4=10.34,
igr1=2436,2437,2438,2440,2441,2442,
igr2=2475,2476,
&end
#
# 153 LEU QQD 160 VAL H 6.88
&rst
ixpk= 0, nxpk= 0, iat= -1,2543, r1= 1.30, r2= 1.80, r3= 9.27, r4= 9.77,
igr1=2436,2437,2438,2440,2441,2442,
&end
#
# 153 LEU QQD 160 VAL QQG 5.20
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.45, r4= 9.95,
igr1=2436,2437,2438,2440,2441,2442,
igr2=2549,2550,2551,2553,2554,2555,
&end
#
# 153 LEU QQD 162 ILE H 5.61
&rst
ixpk= 0, nxpk= 0, iat= -1,2576, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
igr1=2436,2437,2438,2440,2441,2442,
&end
#
# 153 LEU QQD 162 ILE HB 5.66
&rst
ixpk= 0, nxpk= 0, iat= -1,2580, r1= 1.30, r2= 1.80, r3= 7.63, r4= 8.13,
igr1=2436,2437,2438,2440,2441,2442,
&end
#
# 153 LEU QQD 162 ILE QG2 5.96
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.65, r4=10.15,
igr1=2436,2437,2438,2440,2441,2442,
igr2=2582,2583,2584,
&end
#
# 153 LEU QQD 162 ILE QD1 4.83
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.82, r4= 8.32,
igr1=2436,2437,2438,2440,2441,2442,
igr2=2589,2590,2591,
&end
#
# 154 ILE H 160 VAL QQG 5.25
&rst
ixpk= 0, nxpk= 0, iat=2446, -1, r1= 1.30, r2= 1.80, r3= 7.08, r4= 7.58,
igr2=2549,2550,2551,2553,2554,2555,
&end
#
# 154 ILE HA 160 VAL QQG 5.35
&rst
ixpk= 0, nxpk= 0, iat=2448, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr2=2549,2550,2551,2553,2554,2555,
&end
#
# 154 ILE QG2 155 ILE QG1 5.60
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.55, r4= 8.05,
igr1=2452,2453,2454,
igr2=2475,2476,
&end
#
# 154 ILE QD1 159 SER QB 6.03
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.13, r4= 8.63,
igr1=2459,2460,2461,
igr2=2536,2537,
&end
#
# 155 ILE H 155 ILE QG1 4.81
&rst
ixpk= 0, nxpk= 0, iat=2465, -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr2=2475,2476,
&end
#
# 155 ILE H 160 VAL QQG 4.97
&rst
ixpk= 0, nxpk= 0, iat=2465, -1, r1= 1.30, r2= 1.80, r3= 6.70, r4= 7.20,
igr2=2549,2550,2551,2553,2554,2555,
&end
#
# 155 ILE HA 160 VAL QQG 5.66
&rst
ixpk= 0, nxpk= 0, iat=2467, -1, r1= 1.30, r2= 1.80, r3= 7.63, r4= 8.13,
igr2=2549,2550,2551,2553,2554,2555,
&end
#
# 155 ILE HB 160 VAL QQG 4.31
&rst
ixpk= 0, nxpk= 0, iat=2469, -1, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
igr2=2549,2550,2551,2553,2554,2555,
&end
#
# 155 ILE QG2 155 ILE QG1 4.15
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.59, r4= 6.09,
igr1=2471,2472,2473,
igr2=2475,2476,
&end
#
# 155 ILE QG2 160 VAL QQG 5.93
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.60, r4=10.10,
igr1=2471,2472,2473,
igr2=2549,2550,2551,2553,2554,2555,
&end
#
# 155 ILE QG1 156 LYS H 5.95
&rst
ixpk= 0, nxpk= 0, iat= -1,2484, r1= 1.30, r2= 1.80, r3= 6.68, r4= 7.18,
igr1=2475,2476,
&end
#
# 155 ILE QG1 158 ILE QG2 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
igr1=2475,2476,
igr2=2519,2520,2521,
&end
#
# 155 ILE QG1 160 VAL QQG 5.51
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.34, r4= 8.84,
igr1=2475,2476,
igr2=2549,2550,2551,2553,2554,2555,
&end
#
# 155 ILE QD1 160 VAL QQG 4.64
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.51, r4= 8.01,
igr1=2478,2479,2480,
igr2=2549,2550,2551,2553,2554,2555,
&end
#
# 158 ILE HA 160 VAL QQG 6.30
&rst
ixpk= 0, nxpk= 0, iat=2515, -1, r1= 1.30, r2= 1.80, r3= 8.49, r4= 8.99,
igr2=2549,2550,2551,2553,2554,2555,
&end
#
# 158 ILE HB 160 VAL QQG 5.01
&rst
ixpk= 0, nxpk= 0, iat=2517, -1, r1= 1.30, r2= 1.80, r3= 6.75, r4= 7.25,
igr2=2549,2550,2551,2553,2554,2555,
&end
#
# 158 ILE QG2 159 SER QB 6.41
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.64, r4= 9.14,
igr1=2519,2520,2521,
igr2=2536,2537,
&end
#
# 158 ILE QG2 160 VAL QQG 4.72
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
igr1=2519,2520,2521,
igr2=2549,2550,2551,2553,2554,2555,
&end
#
# 159 SER H 159 SER QB 3.34
&rst
ixpk= 0, nxpk= 0, iat=2532, -1, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25,
igr2=2536,2537,
&end
#
# 159 SER QB 160 VAL H 3.95
&rst
ixpk= 0, nxpk= 0, iat= -1,2543, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
igr1=2536,2537,
&end
#
# 160 VAL H 160 VAL QQG 3.97
&rst
ixpk= 0, nxpk= 0, iat=2543, -1, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,
igr2=2549,2550,2551,2553,2554,2555,
&end
#
# 160 VAL HA 160 VAL QQG 4.12
&rst
ixpk= 0, nxpk= 0, iat=2545, -1, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,
igr2=2549,2550,2551,2553,2554,2555,
&end
#
# 160 VAL HA 161 HIS QB 4.63
&rst
ixpk= 0, nxpk= 0, iat=2545, -1, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
igr2=2563,2564,
&end
#
# 160 VAL QQG 161 HIS H 4.67
&rst
ixpk= 0, nxpk= 0, iat= -1,2559, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
igr1=2549,2550,2551,2553,2554,2555,
&end
#
# 160 VAL QQG 161 HIS QB 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.84, r4=10.34,
igr1=2549,2550,2551,2553,2554,2555,
igr2=2563,2564,
&end
#
# 160 VAL QQG 162 ILE QD1 4.68
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.58, r4= 8.08,
igr1=2549,2550,2551,2553,2554,2555,
igr2=2589,2590,2591,
&end
#
# 161 HIS H 161 HIS QB 3.33
&rst
ixpk= 0, nxpk= 0, iat=2559, -1, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24,
igr2=2563,2564,
&end
#
# 161 HIS QB 162 ILE H 4.34
&rst
ixpk= 0, nxpk= 0, iat= -1,2576, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,
igr1=2563,2564,
&end
#
# 162 ILE HB 163 SER QB 6.12
&rst
ixpk= 0, nxpk= 0, iat=2580, -1, r1= 1.30, r2= 1.80, r3= 6.87, r4= 7.37,
igr2=2599,2600,
&end
#
# 163 SER QB 164 ASN H 3.08
&rst
ixpk= 0, nxpk= 0, iat= -1,2606, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96,
igr1=2599,2600,
&end
#
# 163 SER QB 164 ASN HD21 6.27
&rst
ixpk= 0, nxpk= 0, iat= -1,2616, r1= 1.30, r2= 1.80, r3= 7.04, r4= 7.54,
igr1=2599,2600,
&end
#
# 163 SER QB 165 ALA QB 6.27
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.45, r4= 8.95,
igr1=2599,2600,
igr2=2624,2625,2626,
&end
#
# 166 GLU H 166 GLU QB 3.40
&rst
ixpk= 0, nxpk= 0, iat=2630, -1, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,
igr2=2634,2635,
&end
#
# 167 PRO HA 168 LYS QB 4.66
&rst
ixpk= 0, nxpk= 0, iat=2655, -1, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73,
igr2=2663,2664,
&end
#
# 167 PRO QG 172 ASN QB 5.36
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.75, r4= 7.25,
igr1=2649,2650,
igr2=2727,2728,
&end
#
# 168 LYS H 168 LYS QB 2.84
&rst
ixpk= 0, nxpk= 0, iat=2659, -1, r1= 1.30, r2= 1.80, r3= 3.19, r4= 3.69,
igr2=2663,2664,
&end
#
# 168 LYS QB 168 LYS QD 2.84
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08,
igr1=2663,2664,
igr2=2669,2670,
&end
#
# 168 LYS QB 168 LYS QE 4.72
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.95, r4= 6.45,
igr1=2663,2664,
igr2=2672,2673,
&end
#
# 168 LYS QG 169 HIS QB 5.88
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr1=2666,2667,
igr2=2685,2686,
&end
#
# 169 HIS QB 170 ASN QB 5.24
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.60, r4= 7.10,
igr1=2685,2686,
igr2=2702,2703,
&end
#
# 170 ASN QB 170 ASN QD2 3.01
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,
igr1=2702,2703,
igr2=2707,2708,
&end
#
# 171 SER HA 172 ASN QB 4.99
&rst
ixpk= 0, nxpk= 0, iat=2714, -1, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
igr2=2727,2728,
&end
#
# 172 ASN HA 173 ARG QB 5.24
&rst
ixpk= 0, nxpk= 0, iat=2725, -1, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
igr2=2741,2742,
&end
#
# 172 ASN QB 173 ARG H 4.29
&rst
ixpk= 0, nxpk= 0, iat= -1,2737, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
igr1=2727,2728,
&end
#
# 172 ASN QB 173 ARG HA 4.69
&rst
ixpk= 0, nxpk= 0, iat= -1,2739, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr1=2727,2728,
&end
#
# 172 ASN QB 173 ARG QB 4.94
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
igr1=2727,2728,
igr2=2741,2742,
&end
#
# 172 ASN QB 174 GLN H 4.81
&rst
ixpk= 0, nxpk= 0, iat= -1,2761, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr1=2727,2728,
&end
#
# 172 ASN QB 174 GLN QG 3.47
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
igr1=2727,2728,
igr2=2768,2769,
&end
#
# 173 ARG H 173 ARG QB 3.06
&rst
ixpk= 0, nxpk= 0, iat=2737, -1, r1= 1.30, r2= 1.80, r3= 3.43, r4= 3.93,
igr2=2741,2742,
&end
#
# 173 ARG QB 174 GLN H 4.04
&rst
ixpk= 0, nxpk= 0, iat= -1,2761, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
igr1=2741,2742,
&end
#
# 174 GLN H 174 GLN QB 3.05
&rst
ixpk= 0, nxpk= 0, iat=2761, -1, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92,
igr2=2765,2766,
&end
#
# 76 ARG HE 15 GLY HA2 4.0
&rst
ixpk= 0, nxpk= 0, iat=1220, 211, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 76 ARG HE 15 GLY HA3 4.0
&rst
ixpk= 0, nxpk= 0, iat=1220, 212, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 76 ARG HE 16 LEU HA 5.0
&rst
ixpk= 0, nxpk= 0, iat=1220, 218, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 76 ARG HE 17 PRO QB 6.0
&rst
ixpk= 0, nxpk= 0, iat=1220, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2= 242, 243,
&end
#
# 76 ARG HE 17 PRO HD3 5.0
&rst
ixpk= 0, nxpk= 0, iat=1220, 237, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 76 ARG HA 76 ARG HE 6.0
&rst
ixpk= 0, nxpk= 0, iat=1209,1220, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 76 ARG HB2 76 ARG HE 5.5
&rst
ixpk= 0, nxpk= 0, iat=1211,1220, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 76 ARG HB3 76 ARG HE 5.5
&rst
ixpk= 0, nxpk= 0, iat=1212,1220, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 76 ARG HD2 76 ARG HE 4.0
&rst
ixpk= 0, nxpk= 0, iat=1217,1220, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 76 ARG HD3 76 ARG HE 4.0
&rst
ixpk= 0, nxpk= 0, iat=1218,1220, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 76 ARG HG2 76 ARG HE 4.0
&rst
ixpk= 0, nxpk= 0, iat=1214,1220, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 76 ARG HG3 76 ARG HE 4.0
&rst
ixpk= 0, nxpk= 0, iat=1215,1220, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 78 CYS QB 76 ARG HE 4.5
&rst
ixpk= 0, nxpk= 0, iat= -1,1220, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
igr1=1259,1260,
&end
#
# 102 ARG HE 85 SER HB2 6.0
&rst
ixpk= 0, nxpk= 0, iat=1649,1362, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 102 ARG HE 85 SER HB3 6.0
&rst
ixpk= 0, nxpk= 0, iat=1649,1363, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 102 ARG HE 101 GLY HA3 6.0
&rst
ixpk= 0, nxpk= 0, iat=1649,1632, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 102 ARG H 102 ARG HE 6.0
&rst
ixpk= 0, nxpk= 0, iat=1636,1649, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 102 ARG QB 102 ARG HE 5.5
&rst
ixpk= 0, nxpk= 0, iat= -1,1649, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1=1640,1641,
&end
#
# 102 ARG QD 102 ARG HE 4.0
&rst
ixpk= 0, nxpk= 0, iat= -1,1649, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
igr1=1646,1647,
&end
#
# 102 ARG HG2 102 ARG HE 6.0
&rst
ixpk= 0, nxpk= 0, iat=1643,1649, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 102 ARG HG3 102 ARG HE 5.5
&rst
ixpk= 0, nxpk= 0, iat=1644,1649, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 132 ARG HA 132 ARG HE 5.5
&rst
ixpk= 0, nxpk= 0, iat=2123,2134, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 132 ARG HB2 132 ARG HE 4.0
&rst
ixpk= 0, nxpk= 0, iat=2125,2134, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 132 ARG HB3 132 ARG HE 5.0
&rst
ixpk= 0, nxpk= 0, iat=2126,2134, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 132 ARG HD2 132 ARG HE 3.2
&rst
ixpk= 0, nxpk= 0, iat=2131,2134, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 132 ARG HD3 132 ARG HE 4.0
&rst
ixpk= 0, nxpk= 0, iat=2132,2134, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 132 ARG HG3 132 ARG HE 4.0
&rst
ixpk= 0, nxpk= 0, iat=2129,2134, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 134 PHE QD 132 ARG HE 5.5
&rst
ixpk= 0, nxpk= 0, iat= -1,2134, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1=2163,2171,
&end
#
# 134 PHE QE 132 ARG HE 4.0
&rst
ixpk= 0, nxpk= 0, iat= -1,2134, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
igr1=2165,2169,
&end
#
# 134 PHE HZ 132 ARG HE 5.5
&rst
ixpk= 0, nxpk= 0, iat=2167,2134, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 175 RGUA H1' 18 TRP HE1 6.0
&rst
ixpk= 0, nxpk= 0, iat=2787, 259, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 175 RGUA H8 18 TRP HE1 5.5
&rst
ixpk= 0, nxpk= 0, iat=2790, 259, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 177 RGUA H2' 15 GLY H 6.0
&rst
ixpk= 0, nxpk= 0, iat=2870, 209, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 177 RGUA H2' 16 LEU H 6.0
&rst
ixpk= 0, nxpk= 0, iat=2870, 216, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 178 URA H1' 84 ASN H 5.5
&rst
ixpk= 0, nxpk= 0, iat=2885,1344, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 181 RADE H1' 132 ARG HE 6.0
&rst
ixpk= 0, nxpk= 0, iat=2982,2134, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 181 RADE H2 132 ARG HE 6.0
&rst
ixpk= 0, nxpk= 0, iat=2994,2134, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 182 URA H4' 135 ALA H 6.0
&rst
ixpk= 0, nxpk= 0, iat=3012,2175, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 182 URA H5 164 ASN H 6.0
&rst
ixpk= 0, nxpk= 0, iat=3020,2606, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 182 URA H1' 166 GLU H 5.5
&rst
ixpk= 0, nxpk= 0, iat=3015,2630, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 182 URA H1' 168 LYS H 6.5
&rst
ixpk= 0, nxpk= 0, iat=3015,2659, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00, &end
#
# 177 RGUA H1' 14 LEU HB3 6.0
&rst
ixpk= 0, nxpk= 0, iat=2851, 195, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
rk2=50, rk3=50, ir6=1, ialtd=0,
&end
#
# 177 RGUA H2' 14 LEU HB3 6.0
&rst
ixpk= 0, nxpk= 0, iat=2870, 195, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 177 RGUA H1' 14 LEU QQD 5.0
&rst
ixpk= 0, nxpk= 0, iat=2851, -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
igr2= 199, 200, 201, 203, 204, 205,
&end
#
# 177 RGUA H2' 14 LEU QQD 4.0
&rst
ixpk= 0, nxpk= 0, iat=2870, -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr2= 199, 200, 201, 203, 204, 205,
&end
#
# 177 RGUA H3' 14 LEU QQD 4.0
&rst
ixpk= 0, nxpk= 0, iat=2868, -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr2= 199, 200, 201, 203, 204, 205,
&end
#
# 177 RGUA H4' 14 LEU QQD 6.0
&rst
ixpk= 0, nxpk= 0, iat=2848, -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
igr2= 199, 200, 201, 203, 204, 205,
&end
#
# 177 RGUA H8 14 LEU QQD 6.0
&rst
ixpk= 0, nxpk= 0, iat=2854, -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
igr2= 199, 200, 201, 203, 204, 205,
&end
#
# 177 RGUA H1' 51 GLY HA3 5.5
&rst
ixpk= 0, nxpk= 0, iat=2851, 804, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 177 RGUA H8 51 GLY HA2 6.5
&rst
ixpk= 0, nxpk= 0, iat=2854, 803, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00, &end
#
# 177 RGUA H8 51 GLY HA3 6.0
&rst
ixpk= 0, nxpk= 0, iat=2854, 804, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 178 URA H1' 12 ILE HB 6.5
&rst
ixpk= 0, nxpk= 0, iat=2885, 159, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00, &end
#
# 178 URA H1' 12 ILE QD1 6.5
&rst
ixpk= 0, nxpk= 0, iat=2885, -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr2= 168, 169, 170,
&end
#
# 178 URA H1' 12 ILE QG2 5.0
&rst
ixpk= 0, nxpk= 0, iat=2885, -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr2= 161, 162, 163,
&end
#
# 178 URA H2' 12 ILE QG2 6.5
&rst
ixpk= 0, nxpk= 0, iat=2900, -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr2= 161, 162, 163,
&end
#
# 178 URA H3' 12 ILE QG2 6.5
&rst
ixpk= 0, nxpk= 0, iat=2898, -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr2= 161, 162, 163,
&end
#
# 178 URA H4' 12 ILE QD1 6.0
&rst
ixpk= 0, nxpk= 0, iat=2882, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr2= 168, 169, 170,
&end
#
# 178 URA H4' 12 ILE QG2 6.5
&rst
ixpk= 0, nxpk= 0, iat=2882, -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr2= 161, 162, 163,
&end
#
# 178 URA H5 12 ILE QD1 6.0
&rst
ixpk= 0, nxpk= 0, iat=2890, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr2= 168, 169, 170,
&end
#
# 178 URA H5' 12 ILE QG2 6.0
&rst
ixpk= 0, nxpk= 0, iat=2879, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr2= 161, 162, 163,
&end
#
# 178 URA H5" 12 ILE QG2 6.5
&rst
ixpk= 0, nxpk= 0, iat=2880, -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr2= 161, 162, 163,
&end
#
# 178 URA H6 12 ILE QG2 6.0
&rst
ixpk= 0, nxpk= 0, iat=2888, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr2= 161, 162, 163,
&end
#
# 178 URA H1' 14 LEU QQD 6.0
&rst
ixpk= 0, nxpk= 0, iat=2885, -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
igr2= 199, 200, 201, 203, 204, 205,
&end
#
# 178 URA H2' 14 LEU QQD 6.5
&rst
ixpk= 0, nxpk= 0, iat=2900, -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
igr2= 199, 200, 201, 203, 204, 205,
&end
#
# 178 URA H3' 14 LEU QQD 6.5
&rst
ixpk= 0, nxpk= 0, iat=2898, -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
igr2= 199, 200, 201, 203, 204, 205,
&end
#
# 178 URA H4' 14 LEU QQD 6.5
&rst
ixpk= 0, nxpk= 0, iat=2882, -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
igr2= 199, 200, 201, 203, 204, 205,
&end
#
# 178 URA H5 14 LEU QQD 6.0
&rst
ixpk= 0, nxpk= 0, iat=2890, -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
igr2= 199, 200, 201, 203, 204, 205,
&end
#
# 178 URA H5" 14 LEU QQD 6.0
&rst
ixpk= 0, nxpk= 0, iat=2880, -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
igr2= 199, 200, 201, 203, 204, 205,
&end
#
# 178 URA H5' 14 LEU QQD 6.5
&rst
ixpk= 0, nxpk= 0, iat=2879, -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
igr2= 199, 200, 201, 203, 204, 205,
&end
#
# 178 URA H6 14 LEU QQD 6.5
&rst
ixpk= 0, nxpk= 0, iat=2888, -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
igr2= 199, 200, 201, 203, 204, 205,
&end
#
# 178 URA H5 81 LYS QD 4.0
&rst
ixpk= 0, nxpk= 0, iat=2890, -1, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
igr2=1299,1300,
&end
#
# 178 URA H1' 83 PRO HA 4.5
&rst
ixpk= 0, nxpk= 0, iat=2885,1340, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 178 URA H1' 83 PRO HB2 5.0
&rst
ixpk= 0, nxpk= 0, iat=2885,1337, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 178 URA H1' 83 PRO HB3 5.0
&rst
ixpk= 0, nxpk= 0, iat=2885,1338, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 178 URA H1' 84 ASN HB2 5.5
&rst
ixpk= 0, nxpk= 0, iat=2885,1348, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 178 URA H1' 84 ASN HB3 5.5
&rst
ixpk= 0, nxpk= 0, iat=2885,1349, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 178 URA H2' 84 ASN HB3 6.5
&rst
ixpk= 0, nxpk= 0, iat=2900,1349, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00, &end
#
# 179 RGUA H1' 12 ILE QG2 6.5
&rst
ixpk= 0, nxpk= 0, iat=2915, -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr2= 161, 162, 163,
&end
#
# 179 RGUA H2' 12 ILE QG2 6.5
&rst
ixpk= 0, nxpk= 0, iat=2934, -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr2= 161, 162, 163,
&end
#
# 179 RGUA H4' 12 ILE QG2 6.5
&rst
ixpk= 0, nxpk= 0, iat=2912, -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr2= 161, 162, 163,
&end
#
# 179 RGUA H5" 12 ILE QG2 6.0
&rst
ixpk= 0, nxpk= 0, iat=2910, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr2= 161, 162, 163,
&end
#
# 179 RGUA H5' 12 ILE QG2 6.0
&rst
ixpk= 0, nxpk= 0, iat=2909, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr2= 161, 162, 163,
&end
#
# 179 RGUA H8 12 ILE QG2 6.0
&rst
ixpk= 0, nxpk= 0, iat=2918, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr2= 161, 162, 163,
&end
#
# 179 RGUA H1' 41 LYS HB2 6.5
&rst
ixpk= 0, nxpk= 0, iat=2915, 636, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00, &end
#
# 179 RGUA H1' 41 LYS HB3 6.5
&rst
ixpk= 0, nxpk= 0, iat=2915, 637, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00, &end
#
# 179 RGUA H1' 41 LYS HE2 6.5
&rst
ixpk= 0, nxpk= 0, iat=2915, 645, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00, &end
#
# 179 RGUA H1' 41 LYS HE3 6.5
&rst
ixpk= 0, nxpk= 0, iat=2915, 646, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00, &end
#
# 179 RGUA H1' 41 LYS HG2 6.5
&rst
ixpk= 0, nxpk= 0, iat=2915, 639, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00, &end
#
# 179 RGUA H1' 41 LYS HG3 6.0
&rst
ixpk= 0, nxpk= 0, iat=2915, 640, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 179 RGUA H4' 41 LYS HG2 6.0
&rst
ixpk= 0, nxpk= 0, iat=2912, 639, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 179 RGUA H4' 50 LYS HD2 6.5
&rst
ixpk= 0, nxpk= 0, iat=2912, 789, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00, &end
#
# 179 RGUA H4' 50 LYS HD3 6.5
&rst
ixpk= 0, nxpk= 0, iat=2912, 790, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00, &end
#
# 179 RGUA H4' 50 LYS HE2 5.5
&rst
ixpk= 0, nxpk= 0, iat=2912, 792, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 179 RGUA H5' 50 LYS HD3 6.0
&rst
ixpk= 0, nxpk= 0, iat=2909, 790, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 179 RGUA H5' 50 LYS HE3 6.0
&rst
ixpk= 0, nxpk= 0, iat=2909, 793, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 179 RGUA H8 83 PRO HB2 6.0
&rst
ixpk= 0, nxpk= 0, iat=2918,1337, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 179 RGUA H2' 85 SER HB2 6.0
&rst
ixpk= 0, nxpk= 0, iat=2934,1362, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 179 RGUA H8 85 SER HA 6.0
&rst
ixpk= 0, nxpk= 0, iat=2918,1360, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 179 RGUA H8 85 SER HB2 5.5
&rst
ixpk= 0, nxpk= 0, iat=2918,1362, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 179 RGUA H1' 86 LYS QE 6.5
&rst
ixpk= 0, nxpk= 0, iat=2915, -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
igr2=1382,1383,
&end
#
# 179 RGUA H1' 102 ARG HB2 5.0
&rst
ixpk= 0, nxpk= 0, iat=2915,1640, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 179 RGUA H1' 102 ARG HD2 3.2
&rst
ixpk= 0, nxpk= 0, iat=2915,1646, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 179 RGUA H1' 102 ARG HD3 3.2
&rst
ixpk= 0, nxpk= 0, iat=2915,1647, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 179 RGUA H4' 102 ARG HD2 5.0
&rst
ixpk= 0, nxpk= 0, iat=2912,1646, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 179 RGUA H4' 102 ARG HD3 5.0
&rst
ixpk= 0, nxpk= 0, iat=2912,1647, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 179 RGUA H8 102 ARG HD3 6.0
&rst
ixpk= 0, nxpk= 0, iat=2918,1647, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 179 RGUA H1' 102 ARG HB3 4.5
&rst
ixpk= 0, nxpk= 0, iat=2915,1641, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 179 RGUA H1' 102 ARG HG2 6.0
&rst
ixpk= 0, nxpk= 0, iat=2915,1643, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 179 RGUA H1' 102 ARG HG3 6.0
&rst
ixpk= 0, nxpk= 0, iat=2915,1644, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 179 RGUA H2' 102 ARG HB3 6.0
&rst
ixpk= 0, nxpk= 0, iat=2934,1641, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 179 RGUA H2' 102 ARG HD2 6.0
&rst
ixpk= 0, nxpk= 0, iat=2934,1646, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 179 RGUA H2' 102 ARG HD3 6.0
&rst
ixpk= 0, nxpk= 0, iat=2934,1647, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 179 RGUA H3' 102 ARG HD2 6.0
&rst
ixpk= 0, nxpk= 0, iat=2932,1646, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 179 RGUA H3' 102 ARG HD3 6.0
&rst
ixpk= 0, nxpk= 0, iat=2932,1647, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 179 RGUA H4' 102 ARG HB2 6.5
&rst
ixpk= 0, nxpk= 0, iat=2912,1640, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00, &end
#
# 179 RGUA H4' 102 ARG HB3 5.5
&rst
ixpk= 0, nxpk= 0, iat=2912,1641, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 179 RGUA H4' 102 ARG HG2 6.5
&rst
ixpk= 0, nxpk= 0, iat=2912,1643, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00, &end
#
# 179 RGUA H4' 102 ARG HG3 6.5
&rst
ixpk= 0, nxpk= 0, iat=2912,1644, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00, &end
#
# 179 RGUA H5' 102 ARG HD3 6.5
&rst
ixpk= 0, nxpk= 0, iat=2909,1647, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00, &end
#
# 180 RADE H1' 44 LEU QQD 6.5
&rst
ixpk= 0, nxpk= 0, iat=2949, -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
igr2= 697, 698, 699, 701, 702, 703,
&end
#
# 180 RADE H2 44 LEU QQD 6.0
&rst
ixpk= 0, nxpk= 0, iat=2961, -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
igr2= 697, 698, 699, 701, 702, 703,
&end
#
# 180 RADE H8 44 LEU QQD 6.0
&rst
ixpk= 0, nxpk= 0, iat=2952, -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
igr2= 697, 698, 699, 701, 702, 703,
&end
#
# 180 RADE H8 44 LEU HG 6.5
&rst
ixpk= 0, nxpk= 0, iat=2952, 695, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00, &end
#
# 180 RADE H1' 133 ALA QB 6.0
&rst
ixpk= 0, nxpk= 0, iat=2949, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr2=2149,2150,2151,
&end
#
# 180 RADE H2 133 ALA QB 6.0
&rst
ixpk= 0, nxpk= 0, iat=2961, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr2=2149,2150,2151,
&end
#
# 180 RADE H4' 133 ALA QB 6.0
&rst
ixpk= 0, nxpk= 0, iat=2946, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr2=2149,2150,2151,
&end
#
# 180 RADE H8 133 ALA QB 6.0
&rst
ixpk= 0, nxpk= 0, iat=2952, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr2=2149,2150,2151,
&end
#
# 181 RADE H8 44 LEU QQD 6.5
&rst
ixpk= 0, nxpk= 0, iat=2985, -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
igr2= 697, 698, 699, 701, 702, 703,
&end
#
# 181 RADE H1' 132 ARG HB2 6.0
&rst
ixpk= 0, nxpk= 0, iat=2982,2125, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 181 RADE H1' 132 ARG HB3 6.0
&rst
ixpk= 0, nxpk= 0, iat=2982,2126, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 181 RADE H1' 132 ARG HD2 6.0
&rst
ixpk= 0, nxpk= 0, iat=2982,2131, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 181 RADE H1' 132 ARG HD3 6.0
&rst
ixpk= 0, nxpk= 0, iat=2982,2132, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 181 RADE H1' 132 ARG HG2 6.0
&rst
ixpk= 0, nxpk= 0, iat=2982,2128, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 181 RADE H1' 132 ARG HG3 6.5
&rst
ixpk= 0, nxpk= 0, iat=2982,2129, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00, &end
#
# 181 RADE H2 132 ARG HA 5.0
&rst
ixpk= 0, nxpk= 0, iat=2994,2123, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 181 RADE H2 132 ARG HB2 6.0
&rst
ixpk= 0, nxpk= 0, iat=2994,2125, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 181 RADE H2 132 ARG HB3 6.0
&rst
ixpk= 0, nxpk= 0, iat=2994,2126, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 181 RADE H2 132 ARG HD2 4.0
&rst
ixpk= 0, nxpk= 0, iat=2994,2131, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 181 RADE H2 132 ARG HD3 4.0
&rst
ixpk= 0, nxpk= 0, iat=2994,2132, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 181 RADE H2 132 ARG HG2 4.0
&rst
ixpk= 0, nxpk= 0, iat=2994,2128, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 181 RADE H2 132 ARG HG3 4.0
&rst
ixpk= 0, nxpk= 0, iat=2994,2129, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 181 RADE H8 133 ALA HA 6.0
&rst
ixpk= 0, nxpk= 0, iat=2985,2147, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 181 RADE H1' 133 ALA QB 5.5
&rst
ixpk= 0, nxpk= 0, iat=2982, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2=2149,2150,2151,
&end
#
# 181 RADE H2 133 ALA QB 6.0
&rst
ixpk= 0, nxpk= 0, iat=2994, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr2=2149,2150,2151,
&end
#
# 181 RADE H2' 133 ALA QB 6.0
&rst
ixpk= 0, nxpk= 0, iat=3000, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr2=2149,2150,2151,
&end
#
# 181 RADE H3' 133 ALA QB 6.0
&rst
ixpk= 0, nxpk= 0, iat=2998, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr2=2149,2150,2151,
&end
#
# 181 RADE H4' 133 ALA QB 6.0
&rst
ixpk= 0, nxpk= 0, iat=2979, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr2=2149,2150,2151,
&end
#
# 181 RADE H5" 133 ALA QB 6.0
&rst
ixpk= 0, nxpk= 0, iat=2977, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr2=2149,2150,2151,
&end
#
# 181 RADE H5' 133 ALA QB 6.0
&rst
ixpk= 0, nxpk= 0, iat=2976, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr2=2149,2150,2151,
&end
#
# 181 RADE H8 133 ALA QB 5.5
&rst
ixpk= 0, nxpk= 0, iat=2985, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2=2149,2150,2151,
&end
#
# 182 URA H5 163 SER HB2 6.0
&rst
ixpk= 0, nxpk= 0, iat=3020,2599, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 182 URA H6 163 SER HB3 6.5
&rst
ixpk= 0, nxpk= 0, iat=3018,2600, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00, &end
#
# 182 URA H1' 165 ALA HA 5.0
&rst
ixpk= 0, nxpk= 0, iat=3015,2622, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 182 URA H1' 165 ALA QB 6.0
&rst
ixpk= 0, nxpk= 0, iat=3015, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr2=2624,2625,2626,
&end
#
# 182 URA H1' 166 GLU HB2 6.0
&rst
ixpk= 0, nxpk= 0, iat=3015,2634, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 182 URA H1' 166 GLU QG 5.0
&rst
ixpk= 0, nxpk= 0, iat=3015, -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr2=2637,2638,
&end
#
# 183 RGUA H8 97 LYS QE 5.0
&rst
ixpk= 0, nxpk= 0, iat=3048, -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr2=1568,1569,
&end
#
# 183 RGUA H8 126 PHE HB3 6.0
&rst
ixpk= 0, nxpk= 0, iat=3048,2017, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 183 RGUA H1' 128 PRO HB2 6.0
&rst
ixpk= 0, nxpk= 0, iat=3045,2058, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 183 RGUA H1' 128 PRO HG2 6.5
&rst
ixpk= 0, nxpk= 0, iat=3045,2055, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00, &end
#
# 183 RGUA H4' 128 PRO HB2 6.0
&rst
ixpk= 0, nxpk= 0, iat=3042,2058, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 183 RGUA H4' 128 PRO HB3 6.0
&rst
ixpk= 0, nxpk= 0, iat=3042,2059, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 183 RGUA H4' 128 PRO HG2 6.0
&rst
ixpk= 0, nxpk= 0, iat=3042,2055, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 183 RGUA H4' 128 PRO HG3 6.0
&rst
ixpk= 0, nxpk= 0, iat=3042,2056, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 183 RGUA H2' 168 LYS HA 6.5
&rst
ixpk= 0, nxpk= 0, iat=3064,2661, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00, &end
#
# 183 RGUA H2' 168 LYS HB2 6.0
&rst
ixpk= 0, nxpk= 0, iat=3064,2663, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 183 RGUA H2' 168 LYS HB3 6.0
&rst
ixpk= 0, nxpk= 0, iat=3064,2664, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 183 RGUA H1' 168 LYS QD 5.5
&rst
ixpk= 0, nxpk= 0, iat=3045, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2=2669,2670,
&end
#
# 183 RGUA H2' 168 LYS QD 4.0
&rst
ixpk= 0, nxpk= 0, iat=3064, -1, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
igr2=2669,2670,
&end
#
# 183 RGUA H3' 168 LYS QD 5.0
&rst
ixpk= 0, nxpk= 0, iat=3062, -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr2=2669,2670,
&end
#
# 183 RGUA H4' 168 LYS QD 6.0
&rst
ixpk= 0, nxpk= 0, iat=3042, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=2669,2670,
&end
#
# 183 RGUA H1' 168 LYS QE 5.0
&rst
ixpk= 0, nxpk= 0, iat=3045, -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr2=2672,2673,
&end
#
# 183 RGUA H2' 168 LYS QE 5.0
&rst
ixpk= 0, nxpk= 0, iat=3064, -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr2=2672,2673,
&end
#
# 183 RGUA H3' 168 LYS QE 5.5
&rst
ixpk= 0, nxpk= 0, iat=3062, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2=2672,2673,
&end
#
# 183 RGUA H5' 168 LYS QD 6.0
&rst
ixpk= 0, nxpk= 0, iat=3039, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=2669,2670,
&end
#
# 183 RGUA H8 168 LYS QD 5.5
&rst
ixpk= 0, nxpk= 0, iat=3048, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2=2669,2670,
&end
#
# 183 RGUA H8 168 LYS QE 4.0
&rst
ixpk= 0, nxpk= 0, iat=3048, -1, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
igr2=2672,2673,
&end
#
# 183 RGUA H1' 168 LYS HG2 6.0
&rst
ixpk= 0, nxpk= 0, iat=3045,2666, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 183 RGUA H1' 168 LYS HG3 6.0
&rst
ixpk= 0, nxpk= 0, iat=3045,2667, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 183 RGUA H2' 168 LYS HG2 5.5
&rst
ixpk= 0, nxpk= 0, iat=3064,2666, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 183 RGUA H2' 168 LYS HG3 5.5
&rst
ixpk= 0, nxpk= 0, iat=3064,2667, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 183 RGUA H3' 168 LYS HG2 6.0
&rst
ixpk= 0, nxpk= 0, iat=3062,2666, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 183 RGUA H3' 168 LYS HG3 6.0
&rst
ixpk= 0, nxpk= 0, iat=3062,2667, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 183 RGUA H4' 168 LYS HG2 6.5
&rst
ixpk= 0, nxpk= 0, iat=3042,2666, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00, &end
#
# 183 RGUA H4' 168 LYS HG3 6.5
&rst
ixpk= 0, nxpk= 0, iat=3042,2667, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00, &end
#
# 183 RGUA H5' 168 LYS HG2 6.5
&rst
ixpk= 0, nxpk= 0, iat=3039,2666, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00, &end
#
# 183 RGUA H8 168 LYS HG2 6.0
&rst
ixpk= 0, nxpk= 0, iat=3048,2666, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 183 RGUA H8 168 LYS HG3 6.0
&rst
ixpk= 0, nxpk= 0, iat=3048,2667, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 184 RADE H1' 168 LYS QD 6.0
&rst
ixpk= 0, nxpk= 0, iat=3079, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=2669,2670,
&end
#
# 184 RADE H4' 168 LYS QD 6.0
&rst
ixpk= 0, nxpk= 0, iat=3076, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=2669,2670,
&end
#
# 184 RADE H1' 168 LYS QE 6.0
&rst
ixpk= 0, nxpk= 0, iat=3079, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=2672,2673,
&end
#
# 184 RADE H4' 168 LYS QE 6.0
&rst
ixpk= 0, nxpk= 0, iat=3076, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=2672,2673,
&end
#
# 184 RADE H5' 168 LYS QD 6.0
&rst
ixpk= 0, nxpk= 0, iat=3073, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=2669,2670,
&end
#
# 175 RGUA H1' 18 TRP HH2 4.0
&rst
ixpk= 0, nxpk= 0, iat=2787, 264, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 175 RGUA H1' 18 TRP HZ2 4.0
&rst
ixpk= 0, nxpk= 0, iat=2787, 262, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 175 RGUA H2' 18 TRP HH2 5.0
&rst
ixpk= 0, nxpk= 0, iat=2806, 264, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 175 RGUA H4' 18 TRP HZ2 5.0
&rst
ixpk= 0, nxpk= 0, iat=2784, 262, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 175 RGUA H5' 18 TRP HH2 5.0
&rst
ixpk= 0, nxpk= 0, iat=2781, 264, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 175 RGUA H5' 18 TRP HZ2 5.5
&rst
ixpk= 0, nxpk= 0, iat=2781, 262, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 175 RGUA H8 18 TRP HE3 5.0
&rst
ixpk= 0, nxpk= 0, iat=2790, 268, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 175 RGUA H8 18 TRP HH2 5.0
&rst
ixpk= 0, nxpk= 0, iat=2790, 264, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 175 RGUA H8 18 TRP HZ2 5.0
&rst
ixpk= 0, nxpk= 0, iat=2790, 262, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 175 RGUA H8 18 TRP HZ3 5.0
&rst
ixpk= 0, nxpk= 0, iat=2790, 266, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 177 RGUA H1' 18 TRP HH2 6.0
&rst
ixpk= 0, nxpk= 0, iat=2851, 264, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 178 URA H1' 52 PHE QD 6.0
&rst
ixpk= 0, nxpk= 0, iat=2885, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2= 816, 824,
&end
#
# 178 URA H1' 52 PHE QE 6.0
&rst
ixpk= 0, nxpk= 0, iat=2885, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2= 818, 822,
&end
#
# 178 URA H3' 52 PHE QD 6.5
&rst
ixpk= 0, nxpk= 0, iat=2898, -1, r1= 1.30, r2= 1.80, r3= 7.30, r4= 7.80,
igr2= 816, 824,
&end
#
# 178 URA H3' 52 PHE QE 6.0
&rst
ixpk= 0, nxpk= 0, iat=2898, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2= 818, 822,
&end
#
# 178 URA H4' 52 PHE HZ 4.5
&rst
ixpk= 0, nxpk= 0, iat=2882, 820, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 178 URA H4' 52 PHE QD 5.5
&rst
ixpk= 0, nxpk= 0, iat=2882, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 816, 824,
&end
#
# 178 URA H4' 52 PHE QE 5.5
&rst
ixpk= 0, nxpk= 0, iat=2882, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 818, 822,
&end
#
# 178 URA H5' 52 PHE QD 6.0
&rst
ixpk= 0, nxpk= 0, iat=2879, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2= 816, 824,
&end
#
# 178 URA H5" 52 PHE QD 6.0
&rst
ixpk= 0, nxpk= 0, iat=2880, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2= 816, 824,
&end
#
# 178 URA H5" 52 PHE QE 6.0
&rst
ixpk= 0, nxpk= 0, iat=2880, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2= 818, 822,
&end
#
# 178 URA H5' 52 PHE QE 6.0
&rst
ixpk= 0, nxpk= 0, iat=2879, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2= 818, 822,
&end
#
# 178 URA H1' 54 PHE HZ 6.0
&rst
ixpk= 0, nxpk= 0, iat=2885, 847, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 178 URA H4' 54 PHE HZ 6.0
&rst
ixpk= 0, nxpk= 0, iat=2882, 847, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 179 RGUA H1' 52 PHE HZ 6.0
&rst
ixpk= 0, nxpk= 0, iat=2915, 820, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 179 RGUA H1' 52 PHE QE 5.5
&rst
ixpk= 0, nxpk= 0, iat=2915, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 818, 822,
&end
#
# 179 RGUA H2' 52 PHE HZ 6.5
&rst
ixpk= 0, nxpk= 0, iat=2934, 820, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00, &end
#
# 179 RGUA H2' 52 PHE QE 6.0
&rst
ixpk= 0, nxpk= 0, iat=2934, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2= 818, 822,
&end
#
# 179 RGUA H3' 52 PHE HZ 6.0
&rst
ixpk= 0, nxpk= 0, iat=2932, 820, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 179 RGUA H3' 52 PHE QE 5.5
&rst
ixpk= 0, nxpk= 0, iat=2932, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 818, 822,
&end
#
# 179 RGUA H4' 52 PHE HZ 4.0
&rst
ixpk= 0, nxpk= 0, iat=2912, 820, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 179 RGUA H4' 52 PHE QE 4.0
&rst
ixpk= 0, nxpk= 0, iat=2912, -1, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
igr2= 818, 822,
&end
#
# 179 RGUA H5' 52 PHE HZ 6.0
&rst
ixpk= 0, nxpk= 0, iat=2909, 820, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 179 RGUA H5' 52 PHE QE 5.5
&rst
ixpk= 0, nxpk= 0, iat=2909, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 818, 822,
&end
#
# 179 RGUA H5" 52 PHE QE 6.0
&rst
ixpk= 0, nxpk= 0, iat=2910, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2= 818, 822,
&end
#
# 179 RGUA H8 52 PHE QE 6.0
&rst
ixpk= 0, nxpk= 0, iat=2918, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2= 818, 822,
&end
#
# 179 RGUA H1' 54 PHE HZ 5.5
&rst
ixpk= 0, nxpk= 0, iat=2915, 847, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 179 RGUA H1' 54 PHE QD 5.5
&rst
ixpk= 0, nxpk= 0, iat=2915, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 843, 851,
&end
#
# 179 RGUA H1' 54 PHE QE 5.5
&rst
ixpk= 0, nxpk= 0, iat=2915, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 845, 849,
&end
#
# 179 RGUA H2' 54 PHE HZ 6.0
&rst
ixpk= 0, nxpk= 0, iat=2934, 847, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 179 RGUA H3' 54 PHE QE 6.0
&rst
ixpk= 0, nxpk= 0, iat=2932, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2= 845, 849,
&end
#
# 179 RGUA H4' 54 PHE QE 5.5
&rst
ixpk= 0, nxpk= 0, iat=2912, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 845, 849,
&end
#
# 179 RGUA H5' 54 PHE HZ 6.0
&rst
ixpk= 0, nxpk= 0, iat=2909, 847, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 179 RGUA H5" 54 PHE HZ 6.0
&rst
ixpk= 0, nxpk= 0, iat=2910, 847, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 179 RGUA H5" 54 PHE QD 6.0
&rst
ixpk= 0, nxpk= 0, iat=2910, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2= 843, 851,
&end
#
# 179 RGUA H5' 54 PHE QD 6.0
&rst
ixpk= 0, nxpk= 0, iat=2909, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2= 843, 851,
&end
#
# 179 RGUA H8 54 PHE HZ 5.5
&rst
ixpk= 0, nxpk= 0, iat=2918, 847, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 179 RGUA H8 54 PHE QD 6.0
&rst
ixpk= 0, nxpk= 0, iat=2918, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2= 843, 851,
&end
#
# 179 RGUA H8 54 PHE QE 6.0
&rst
ixpk= 0, nxpk= 0, iat=2918, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2= 845, 849,
&end
#
# 181 RADE H3' 99 PHE QE 6.0
&rst
ixpk= 0, nxpk= 0, iat=2998, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=1603,1607,
&end
#
# 181 RADE H1' 134 PHE QD 5.5
&rst
ixpk= 0, nxpk= 0, iat=2982, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2=2163,2171,
&end
#
# 181 RADE H1' 134 PHE QE 6.0
&rst
ixpk= 0, nxpk= 0, iat=2982, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=2165,2169,
&end
#
# 181 RADE H2' 134 PHE QD 6.0
&rst
ixpk= 0, nxpk= 0, iat=3000, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=2163,2171,
&end
#
# 181 RADE H3' 134 PHE QD 6.0
&rst
ixpk= 0, nxpk= 0, iat=2998, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=2163,2171,
&end
#
# 181 RADE H4' 134 PHE QD 6.0
&rst
ixpk= 0, nxpk= 0, iat=2979, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=2163,2171,
&end
#
# 182 URA H1' 99 PHE QD 5.5
&rst
ixpk= 0, nxpk= 0, iat=3015, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2=1601,1609,
&end
#
# 182 URA H1' 99 PHE QE 6.0
&rst
ixpk= 0, nxpk= 0, iat=3015, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=1603,1607,
&end
#
# 182 URA H5 99 PHE HZ 6.0
&rst
ixpk= 0, nxpk= 0, iat=3020,1605, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 182 URA H5 99 PHE QD 5.5
&rst
ixpk= 0, nxpk= 0, iat=3020, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2=1601,1609,
&end
#
# 182 URA H5' 99 PHE QD 6.0
&rst
ixpk= 0, nxpk= 0, iat=3009, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=1601,1609,
&end
#
# 182 URA H5" 99 PHE QD 6.0
&rst
ixpk= 0, nxpk= 0, iat=3010, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=1601,1609,
&end
#
# 182 URA H5 99 PHE QE 6.0
&rst
ixpk= 0, nxpk= 0, iat=3020, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=1603,1607,
&end
#
# 182 URA H6 99 PHE QD 6.0
&rst
ixpk= 0, nxpk= 0, iat=3018, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=1601,1609,
&end
#
# 182 URA H6 99 PHE QE 6.0
&rst
ixpk= 0, nxpk= 0, iat=3018, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=1603,1607,
&end
#
# 182 URA H2' 134 PHE QD 6.0
&rst
ixpk= 0, nxpk= 0, iat=3030, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=2163,2171,
&end
#
# 182 URA H3' 134 PHE QD 6.0
&rst
ixpk= 0, nxpk= 0, iat=3028, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=2163,2171,
&end
#
# 182 URA H4' 134 PHE QD 5.5
&rst
ixpk= 0, nxpk= 0, iat=3012, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2=2163,2171,
&end
#
# 182 URA H5" 134 PHE HZ 6.0
&rst
ixpk= 0, nxpk= 0, iat=3010,2167, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 182 URA H5' 134 PHE HZ 6.0
&rst
ixpk= 0, nxpk= 0, iat=3009,2167, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 182 URA H5" 134 PHE QE 6.0
&rst
ixpk= 0, nxpk= 0, iat=3010, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=2165,2169,
&end
#
# 182 URA H5' 134 PHE QE 6.0
&rst
ixpk= 0, nxpk= 0, iat=3009, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=2165,2169,
&end
#
# 182 URA H6 134 PHE QE 6.0
&rst
ixpk= 0, nxpk= 0, iat=3018, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=2165,2169,
&end
#
# 182 URA H1' 136 PHE HZ 3.2
&rst
ixpk= 0, nxpk= 0, iat=3015,2197, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 182 URA H1' 136 PHE QD 4.5
&rst
ixpk= 0, nxpk= 0, iat=3015, -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
igr2=2193,2201,
&end
#
# 182 URA H1' 136 PHE QE 4.0
&rst
ixpk= 0, nxpk= 0, iat=3015, -1, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
igr2=2195,2199,
&end
#
# 182 URA H2' 136 PHE HZ 6.0
&rst
ixpk= 0, nxpk= 0, iat=3030,2197, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 183 RGUA H1' 126 PHE HZ 5.0
&rst
ixpk= 0, nxpk= 0, iat=3045,2024, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 183 RGUA H1' 126 PHE QD 4.0
&rst
ixpk= 0, nxpk= 0, iat=3045, -1, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
igr2=2020,2028,
&end
#
# 183 RGUA H1' 126 PHE QE 4.0
&rst
ixpk= 0, nxpk= 0, iat=3045, -1, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
igr2=2022,2026,
&end
#
# 183 RGUA H4' 126 PHE HZ 5.5
&rst
ixpk= 0, nxpk= 0, iat=3042,2024, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 183 RGUA H4' 126 PHE QE 5.0
&rst
ixpk= 0, nxpk= 0, iat=3042, -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr2=2022,2026,
&end
#
# 183 RGUA H8 126 PHE HZ 5.0
&rst
ixpk= 0, nxpk= 0, iat=3048,2024, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 183 RGUA H8 126 PHE QD 4.0
&rst
ixpk= 0, nxpk= 0, iat=3048, -1, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
igr2=2020,2028,
&end
#
# 183 RGUA H8 126 PHE QE 5.0
&rst
ixpk= 0, nxpk= 0, iat=3048, -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr2=2022,2026,
&end
#
# 183 RGUA H4' 134 PHE QD 6.0
&rst
ixpk= 0, nxpk= 0, iat=3042, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=2163,2171,
&end
#
# 183 RGUA H5" 134 PHE QD 6.0
&rst
ixpk= 0, nxpk= 0, iat=3040, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=2163,2171,
&end
#
# 183 RGUA H1' 136 PHE QE 5.0
&rst
ixpk= 0, nxpk= 0, iat=3045, -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr2=2195,2199,
&end
#
# 183 RGUA H2' 136 PHE QE 5.5
&rst
ixpk= 0, nxpk= 0, iat=3064, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2=2195,2199,
&end
#
# 183 RGUA H3' 136 PHE QE 5.5
&rst
ixpk= 0, nxpk= 0, iat=3062, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2=2195,2199,
&end
#
# 183 RGUA H4' 136 PHE HZ 4.0
&rst
ixpk= 0, nxpk= 0, iat=3042,2197, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 183 RGUA H4' 136 PHE QE 4.0
&rst
ixpk= 0, nxpk= 0, iat=3042, -1, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
igr2=2195,2199,
&end
#
# 183 RGUA H5" 136 PHE HZ 6.0
&rst
ixpk= 0, nxpk= 0, iat=3040,2197, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 183 RGUA H5" 136 PHE QE 6.0
&rst
ixpk= 0, nxpk= 0, iat=3040, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=2195,2199,
&end
#
# 183 RGUA H5' 136 PHE QE 6.0
&rst
ixpk= 0, nxpk= 0, iat=3039, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=2195,2199,
&end
#
# 183 RGUA H8 136 PHE QE 5.5
&rst
ixpk= 0, nxpk= 0, iat=3048, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2=2195,2199,
&end
#
# 184 RADE H1' 126 PHE HZ 6.0
&rst
ixpk= 0, nxpk= 0, iat=3079,2024, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 184 RADE H1' 126 PHE QE 6.0
&rst
ixpk= 0, nxpk= 0, iat=3079, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=2022,2026,
&end
#
# 184 RADE H5' 126 PHE HZ 6.0
&rst
ixpk= 0, nxpk= 0, iat=3073,2024, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 184 RADE H8 126 PHE HZ 6.0
&rst
ixpk= 0, nxpk= 0, iat=3082,2024, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 184 RADE H8 126 PHE QE 6.0
&rst
ixpk= 0, nxpk= 0, iat=3082, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=2022,2026,
&end
#
# 175 RGUA H2' 18 TRP HZ2 6.0
&rst
ixpk= 0, nxpk= 0, iat=2806, 262, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 178 URA H5' 52 PHE HZ 6.5
&rst
ixpk= 0, nxpk= 0, iat=2879, 820, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00, &end
#
# 179 RGUA H5" 52 PHE HZ 5.5
&rst
ixpk= 0, nxpk= 0, iat=2910, 820, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 182 URA H3' 134 PHE QE 6.0
&rst
ixpk= 0, nxpk= 0, iat=3028, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=2165,2169,
&end
#
# 182 URA H4' 134 PHE HZ 5.5
&rst
ixpk= 0, nxpk= 0, iat=3012,2167, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 182 URA H4' 134 PHE QE 5.5
&rst
ixpk= 0, nxpk= 0, iat=3012, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2=2165,2169,
&end
#
# 183 RGUA H1' 136 PHE HZ 5.5
&rst
ixpk= 0, nxpk= 0, iat=3045,2197, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 183 RGUA H1' 136 PHE QD 4.5
&rst
ixpk= 0, nxpk= 0, iat=3045, -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
igr2=2193,2201,
&end
#
# 183 RGUA H2' 136 PHE HZ 6.0
&rst
ixpk= 0, nxpk= 0, iat=3064,2197, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 183 RGUA H2' 136 PHE QD 6.0
&rst
ixpk= 0, nxpk= 0, iat=3064, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=2193,2201,
&end
#
# 183 RGUA H5' 136 PHE HZ 6.0
&rst
ixpk= 0, nxpk= 0, iat=3039,2197, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 71 HID NE2 66 VAL HA 6.0
&rst
ixpk= 0, nxpk= 0, iat=1145,1051, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 71 HID NE2 66 VAL HB 6.0
&rst
ixpk= 0, nxpk= 0, iat=1145,1053, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 71 HID NE2 66 VAL QQG 5.5
&rst
ixpk= 0, nxpk= 0, iat=1145, -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr2=1055,1056,1057,1059,1060,1061,
&end
#
# 71 HID NE2 66 VAL QQG 6.0
&rst
ixpk= 0, nxpk= 0, iat=1145, -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
igr2=1055,1056,1057,1059,1060,1061,
&end
#
# 71 HID NE2 69 GLN HE21 6.0
&rst
ixpk= 0, nxpk= 0, iat=1145,1106, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 71 HID NE2 69 GLN QB 6.0
&rst
ixpk= 0, nxpk= 0, iat=1145, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=1097,1098,
&end
#
# 71 HID NE2 69 GLN QG 5.5
&rst
ixpk= 0, nxpk= 0, iat=1145, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2=1100,1101,
&end
#
# 71 HID HD2 71 HID NE2 6.0
&rst
ixpk= 0, nxpk= 0, iat=1148,1145, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 71 HID HE1 71 HID NE2 6.0
&rst
ixpk= 0, nxpk= 0, iat=1144,1145, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 80 CYS HB2 71 HID NE2 6.0
&rst
ixpk= 0, nxpk= 0, iat=1282,1145, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 178 URA H3 12 ILE HG12 6.0
&rst
ixpk= 0, nxpk= 0, iat=2894, 165, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 178 URA H3 12 ILE QD1 3.0
&rst
ixpk= 0, nxpk= 0, iat=2894, -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr2= 168, 169, 170,
&end
#
# 178 URA H3 81 LYS HB2 5.0
&rst
ixpk= 0, nxpk= 0, iat=2894,1293, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 178 URA H3 81 LYS HB3 6.5
&rst
ixpk= 0, nxpk= 0, iat=2894,1294, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00, &end
#
# 178 URA H3 81 LYS QD 4.5
&rst
ixpk= 0, nxpk= 0, iat=2894, -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
igr2=1299,1300,
&end
#
# 178 URA H3 83 PRO HA 2.5
&rst
ixpk= 0, nxpk= 0, iat=2894,1340, r1= 1.30, r2= 1.80, r3= 2.50, r4= 3.00, &end
#
# 178 URA H3 83 PRO HD2 6.5
&rst
ixpk= 0, nxpk= 0, iat=2894,1331, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00, &end
#
# 178 URA H3 84 ASN HA 5.0
&rst
ixpk= 0, nxpk= 0, iat=2894,1346, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 178 URA H3 84 ASN HB2 6.0
&rst
ixpk= 0, nxpk= 0, iat=2894,1348, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 179 RGUA H1 10 ASP H 6.0
&rst
ixpk= 0, nxpk= 0, iat=2924, 124, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 179 RGUA H1 10 ASP HA 6.0
&rst
ixpk= 0, nxpk= 0, iat=2924, 126, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 179 RGUA H1 10 ASP HB2 6.0
&rst
ixpk= 0, nxpk= 0, iat=2924, 128, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 179 RGUA H1 10 ASP HB3 6.0
&rst
ixpk= 0, nxpk= 0, iat=2924, 129, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 179 RGUA H1 37 MET QE 5.5
&rst
ixpk= 0, nxpk= 0, iat=2924, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2= 577, 578, 579,
&end
#
# 179 RGUA H1 54 PHE HB2 6.0
&rst
ixpk= 0, nxpk= 0, iat=2924, 839, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 179 RGUA H1 54 PHE QD 6.0
&rst
ixpk= 0, nxpk= 0, iat=2924, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2= 843, 851,
&end
#
# 179 RGUA H1 159 SER H 6.0
&rst
ixpk= 0, nxpk= 0, iat=2924,2532, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 179 RGUA H1 159 SER HB2 4.5
&rst
ixpk= 0, nxpk= 0, iat=2924,2536, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 179 RGUA H1 159 SER HB3 3.5
&rst
ixpk= 0, nxpk= 0, iat=2924,2537, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 182 URA H3 164 ASN H 5.5
&rst
ixpk= 0, nxpk= 0, iat=3024,2606, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 182 URA H3 164 ASN QB 5.5
&rst
ixpk= 0, nxpk= 0, iat=3024, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2=2610,2611,
&end
#
# 182 URA H3 165 ALA H 6.0
&rst
ixpk= 0, nxpk= 0, iat=3024,2620, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 182 URA H3 165 ALA QB 5.0
&rst
ixpk= 0, nxpk= 0, iat=3024, -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr2=2624,2625,2626,
&end
#
# 182 URA H3 166 GLU H 5.0
&rst
ixpk= 0, nxpk= 0, iat=3024,2630, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 182 URA H3 166 GLU HA 5.5
&rst
ixpk= 0, nxpk= 0, iat=3024,2632, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 182 URA H3 166 GLU HB3 5.5
&rst
ixpk= 0, nxpk= 0, iat=3024,2635, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 182 URA H3 166 GLU QG 5.0
&rst
ixpk= 0, nxpk= 0, iat=3024, -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr2=2637,2638,
&end
#
# 183 RGUA H1 97 LYS HD2 6.0
&rst
ixpk= 0, nxpk= 0, iat=3054,1565, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 183 RGUA H1 97 LYS HD3 6.0
&rst
ixpk= 0, nxpk= 0, iat=3054,1566, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 183 RGUA H1 97 LYS QE 6.0
&rst
ixpk= 0, nxpk= 0, iat=3054, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=1568,1569,
&end
#
# 183 RGUA H1 136 PHE HZ 6.0
&rst
ixpk= 0, nxpk= 0, iat=3054,2197, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 183 RGUA H1 136 PHE QD 6.0
&rst
ixpk= 0, nxpk= 0, iat=3054, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=2193,2201,
&end
#
# 183 RGUA H1 136 PHE QE 6.0
&rst
ixpk= 0, nxpk= 0, iat=3054, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=2195,2199,
&end
#
# 183 RGUA H1 165 ALA QB 6.0
&rst
ixpk= 0, nxpk= 0, iat=3054, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr2=2624,2625,2626,
&end
#
# 183 RGUA H1 166 GLU HB3 6.0
&rst
ixpk= 0, nxpk= 0, iat=3054,2635, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 183 RGUA H1 166 GLU QG 6.0
&rst
ixpk= 0, nxpk= 0, iat=3054, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=2637,2638,
&end
#
# 183 RGUA H1 167 PRO HA 6.0
&rst
ixpk= 0, nxpk= 0, iat=3054,2655, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 183 RGUA H1 167 PRO QG 6.0
&rst
ixpk= 0, nxpk= 0, iat=3054, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=2649,2650,
&end
#
# 183 RGUA H1 168 LYS HB3 6.0
&rst
ixpk= 0, nxpk= 0, iat=3054,2664, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 183 RGUA H1 168 LYS QE 6.0
&rst
ixpk= 0, nxpk= 0, iat=3054, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=2672,2673,
&end
#
# 178 URA H1' 84 ASN HD21 6.0
&rst
ixpk= 0, nxpk= 0, iat=2885,1354, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 178 URA H1' 84 ASN HD22 6.0
&rst
ixpk= 0, nxpk= 0, iat=2885,1353, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 178 URA H2' 84 ASN HD21 6.0
&rst
ixpk= 0, nxpk= 0, iat=2900,1354, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 178 URA H2' 84 ASN HD22 6.0
&rst
ixpk= 0, nxpk= 0, iat=2900,1353, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 178 URA H1' 84 ASN H 4.0
&rst
ixpk= 0, nxpk= 0, iat=2885,1344, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 48 HID HE1 18 TRP HA 5.5
&rst
ixpk= 0, nxpk= 0, iat= 760, 251, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 48 HID HE1 18 TRP HB2 5.0
&rst
ixpk= 0, nxpk= 0, iat= 760, 253, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 48 HID HE1 18 TRP HB3 5.0
&rst
ixpk= 0, nxpk= 0, iat= 760, 254, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 48 HID HE1 18 TRP HE1 6.0
&rst
ixpk= 0, nxpk= 0, iat= 760, 259, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 48 HID HA 48 HID HE1 6.0
&rst
ixpk= 0, nxpk= 0, iat= 752, 760, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 48 HID HB2 48 HID HD2 4.0
&rst
ixpk= 0, nxpk= 0, iat= 754, 764, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 48 HID HB3 48 HID HD2 4.0
&rst
ixpk= 0, nxpk= 0, iat= 755, 764, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 71 HID HD2 28 TYR QE 6.0
&rst
ixpk= 0, nxpk= 0, iat=1148, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2= 433, 438,
&end
#
# 71 HID HE1 28 TYR QE 6.0
&rst
ixpk= 0, nxpk= 0, iat=1144, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2= 433, 438,
&end
#
# 71 HID HD2 29 PHE HZ 5.5
&rst
ixpk= 0, nxpk= 0, iat=1148, 456, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 71 HID HE1 32 PHE HZ 3.2
&rst
ixpk= 0, nxpk= 0, iat=1144, 501, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 71 HID HD2 66 VAL HA 6.0
&rst
ixpk= 0, nxpk= 0, iat=1148,1051, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 71 HID HD2 66 VAL HB 6.0
&rst
ixpk= 0, nxpk= 0, iat=1148,1053, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 71 HID HD2 66 VAL QG1 6.0
&rst
ixpk= 0, nxpk= 0, iat=1148, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr2=1055,1056,1057,
&end
#
# 71 HID HE1 66 VAL H 5.0
&rst
ixpk= 0, nxpk= 0, iat=1144,1049, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 71 HID HE1 66 VAL HA 3.2
&rst
ixpk= 0, nxpk= 0, iat=1144,1051, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 71 HID HE1 66 VAL HB 5.0
&rst
ixpk= 0, nxpk= 0, iat=1144,1053, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 71 HID HE1 66 VAL QG1 5.0
&rst
ixpk= 0, nxpk= 0, iat=1144, -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr2=1055,1056,1057,
&end
#
# 71 HID HE1 66 VAL QG2 5.0
&rst
ixpk= 0, nxpk= 0, iat=1144, -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr2=1059,1060,1061,
&end
#
# 71 HID HD2 69 GLN H 6.0
&rst
ixpk= 0, nxpk= 0, iat=1148,1093, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 71 HID HE1 69 GLN H 5.0
&rst
ixpk= 0, nxpk= 0, iat=1144,1093, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 71 HID HE1 69 GLN HE21 4.0
&rst
ixpk= 0, nxpk= 0, iat=1144,1106, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 71 HID HE1 69 GLN QG 4.0
&rst
ixpk= 0, nxpk= 0, iat=1144, -1, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
igr2=1100,1101,
&end
#
# 71 HID HD2 70 ARG H 6.0
&rst
ixpk= 0, nxpk= 0, iat=1148,1110, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 71 HID HE1 70 ARG H 6.0
&rst
ixpk= 0, nxpk= 0, iat=1144,1110, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 71 HID H 71 HID HD2 4.0
&rst
ixpk= 0, nxpk= 0, iat=1134,1148, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 73 ILE QD1 71 HID HD2 5.5
&rst
ixpk= 0, nxpk= 0, iat= -1,1148, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1=1182,1183,1184,
&end
#
# 78 CYS H 71 HID HD2 6.0
&rst
ixpk= 0, nxpk= 0, iat=1255,1148, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 79 ASP HA 71 HID HD2 5.5
&rst
ixpk= 0, nxpk= 0, iat=1268,1148, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 80 CYS H 71 HID HD2 5.0
&rst
ixpk= 0, nxpk= 0, iat=1278,1148, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 80 CYS HB2 71 HID HD2 5.0
&rst
ixpk= 0, nxpk= 0, iat=1282,1148, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 80 CYS HB2 71 HID HE1 6.0
&rst
ixpk= 0, nxpk= 0, iat=1282,1144, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 80 CYS HB3 71 HID HD2 5.0
&rst
ixpk= 0, nxpk= 0, iat=1283,1148, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 80 CYS HB3 71 HID HE1 6.0
&rst
ixpk= 0, nxpk= 0, iat=1283,1144, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 161 HIS HD2 152 ASP HB3 6.0
&rst
ixpk= 0, nxpk= 0, iat=2572,2420, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 175 RGUA H1' 18 TRP HZ3 5.5
&rst
ixpk= 0, nxpk= 0, iat=2787, 266, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 175 RGUA H4' 18 TRP HZ3 5.0
&rst
ixpk= 0, nxpk= 0, iat=2784, 266, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 175 RGUA H2' 175 RGUA H1' 5.0
&rst
ixpk= 0, nxpk= 0, iat=2806,2787, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,
rk2=50, rk3=50, ir6=1, ialtd=0,
&end
#
# 175 RGUA H3' 175 RGUA H1' 5.0
&rst
ixpk= 0, nxpk= 0, iat=2804,2787, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 175 RGUA H3' 175 RGUA H2' 2.8
&rst
ixpk= 0, nxpk= 0, iat=2804,2806, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30, &end
#
# 175 RGUA H4' 175 RGUA H1' 2.8
&rst
ixpk= 0, nxpk= 0, iat=2784,2787, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30, &end
#
# 175 RGUA H4' 175 RGUA H2' 4.0
&rst
ixpk= 0, nxpk= 0, iat=2784,2806, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 175 RGUA H5' 175 RGUA H1' 5.0
&rst
ixpk= 0, nxpk= 0, iat=2781,2787, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 175 RGUA H5' 175 RGUA H2' 4.0
&rst
ixpk= 0, nxpk= 0, iat=2781,2806, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 175 RGUA H5' 175 RGUA H3' 4.2
&rst
ixpk= 0, nxpk= 0, iat=2781,2804, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 175 RGUA H5' 175 RGUA H4' 3.8
&rst
ixpk= 0, nxpk= 0, iat=2781,2784, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30, &end
#
# 175 RGUA H8 175 RGUA H1' 4.0
&rst
ixpk= 0, nxpk= 0, iat=2790,2787, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 175 RGUA H8 175 RGUA H2' 4.0
&rst
ixpk= 0, nxpk= 0, iat=2790,2806, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 175 RGUA H8 175 RGUA H3' 5.0
&rst
ixpk= 0, nxpk= 0, iat=2790,2804, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 175 RGUA H8 175 RGUA H4' 5.0
&rst
ixpk= 0, nxpk= 0, iat=2790,2784, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 175 RGUA H8 175 RGUA H5' 5.5
&rst
ixpk= 0, nxpk= 0, iat=2790,2781, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 175 RGUA H1' 177 RGUA H8 5.0
&rst
ixpk= 0, nxpk= 0, iat=2787,2854, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 175 RGUA H4' 177 RGUA H1' 6.0
&rst
ixpk= 0, nxpk= 0, iat=2784,2851, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 175 RGUA H4' 177 RGUA H8 6.0
&rst
ixpk= 0, nxpk= 0, iat=2784,2854, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 176 URA H5' 175 RGUA H1' 5.5
&rst
ixpk= 0, nxpk= 0, iat=2815,2787, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 176 URA H5" 175 RGUA H1' 6.0
&rst
ixpk= 0, nxpk= 0, iat=2816,2787, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 176 URA H5" 175 RGUA H4' 6.0
&rst
ixpk= 0, nxpk= 0, iat=2816,2784, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 176 URA H2' 176 URA H1' 3.2
&rst
ixpk= 0, nxpk= 0, iat=2836,2821, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 176 URA H2' 176 URA H3' 2.8
&rst
ixpk= 0, nxpk= 0, iat=2836,2834, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30, &end
#
# 176 URA H3' 176 URA H1' 4.0
&rst
ixpk= 0, nxpk= 0, iat=2834,2821, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 176 URA H4' 176 URA H1' 4.0
&rst
ixpk= 0, nxpk= 0, iat=2818,2821, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 176 URA H4' 176 URA H3' 2.8
&rst
ixpk= 0, nxpk= 0, iat=2818,2834, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30, &end
#
# 176 URA H5' 176 URA H1' 6.0
&rst
ixpk= 0, nxpk= 0, iat=2815,2821, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 176 URA H5" 176 URA H1' 6.0
&rst
ixpk= 0, nxpk= 0, iat=2816,2821, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 176 URA H5 176 URA H2' 5.0
&rst
ixpk= 0, nxpk= 0, iat=2826,2836, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 176 URA H5" 176 URA H2' 5.5
&rst
ixpk= 0, nxpk= 0, iat=2816,2836, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 176 URA H5' 176 URA H2' 5.5
&rst
ixpk= 0, nxpk= 0, iat=2815,2836, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 176 URA H5" 176 URA H3' 4.0
&rst
ixpk= 0, nxpk= 0, iat=2816,2834, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 176 URA H5' 176 URA H3' 4.0
&rst
ixpk= 0, nxpk= 0, iat=2815,2834, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 176 URA H5 176 URA H3' 6.5
&rst
ixpk= 0, nxpk= 0, iat=2826,2834, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00, &end
#
# 176 URA H5" 176 URA H4' 3.2
&rst
ixpk= 0, nxpk= 0, iat=2816,2818, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 176 URA H5' 176 URA H4' 4.0
&rst
ixpk= 0, nxpk= 0, iat=2815,2818, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 176 URA H5" 176 URA H5' 3.2
&rst
ixpk= 0, nxpk= 0, iat=2816,2815, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 176 URA H5 176 URA H5" 6.0
&rst
ixpk= 0, nxpk= 0, iat=2826,2816, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 176 URA H5 176 URA H5' 6.0
&rst
ixpk= 0, nxpk= 0, iat=2826,2815, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 176 URA H6 176 URA H1' 4.0
&rst
ixpk= 0, nxpk= 0, iat=2824,2821, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 176 URA H6 176 URA H2' 2.8
&rst
ixpk= 0, nxpk= 0, iat=2824,2836, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30, &end
#
# 176 URA H6 176 URA H3' 4.0
&rst
ixpk= 0, nxpk= 0, iat=2824,2834, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 176 URA H6 176 URA H4' 5.5
&rst
ixpk= 0, nxpk= 0, iat=2824,2818, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 176 URA H6 176 URA H5 2.8
&rst
ixpk= 0, nxpk= 0, iat=2824,2826, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30, &end
#
# 176 URA H6 176 URA H5' 5.5
&rst
ixpk= 0, nxpk= 0, iat=2824,2815, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 176 URA H6 176 URA H5" 6.0
&rst
ixpk= 0, nxpk= 0, iat=2824,2816, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 176 URA H1' 177 RGUA H8 6.0
&rst
ixpk= 0, nxpk= 0, iat=2821,2854, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 176 URA H3' 177 RGUA H1' 6.0
&rst
ixpk= 0, nxpk= 0, iat=2834,2851, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 176 URA H4' 177 RGUA H1' 5.5
&rst
ixpk= 0, nxpk= 0, iat=2818,2851, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 176 URA H4' 177 RGUA H2' 6.0
&rst
ixpk= 0, nxpk= 0, iat=2818,2870, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 176 URA H4' 177 RGUA H8 6.0
&rst
ixpk= 0, nxpk= 0, iat=2818,2854, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 176 URA H5" 177 RGUA H1' 6.0
&rst
ixpk= 0, nxpk= 0, iat=2816,2851, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 176 URA H5' 177 RGUA H1' 6.0
&rst
ixpk= 0, nxpk= 0, iat=2815,2851, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 176 URA H5' 177 RGUA H2' 6.0
&rst
ixpk= 0, nxpk= 0, iat=2815,2870, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 176 URA H5" 177 RGUA H8 6.0
&rst
ixpk= 0, nxpk= 0, iat=2816,2854, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 176 URA H5' 177 RGUA H8 6.0
&rst
ixpk= 0, nxpk= 0, iat=2815,2854, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 176 URA H4' 178 URA H5 6.0
&rst
ixpk= 0, nxpk= 0, iat=2818,2890, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 177 RGUA H1' 175 RGUA H1' 5.0
&rst
ixpk= 0, nxpk= 0, iat=2851,2787, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 177 RGUA H1' 176 URA H1' 6.0
&rst
ixpk= 0, nxpk= 0, iat=2851,2821, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 177 RGUA H5" 176 URA H1' 6.0
&rst
ixpk= 0, nxpk= 0, iat=2846,2821, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 177 RGUA H2' 177 RGUA H1' 3.2
&rst
ixpk= 0, nxpk= 0, iat=2870,2851, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 177 RGUA H2' 177 RGUA H5" 6.0
&rst
ixpk= 0, nxpk= 0, iat=2870,2846, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 177 RGUA H3' 177 RGUA H1' 5.0
&rst
ixpk= 0, nxpk= 0, iat=2868,2851, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 177 RGUA H3' 177 RGUA H2' 4.0
&rst
ixpk= 0, nxpk= 0, iat=2868,2870, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 177 RGUA H3' 177 RGUA H5" 4.0
&rst
ixpk= 0, nxpk= 0, iat=2868,2846, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 177 RGUA H4' 177 RGUA H1' 4.0
&rst
ixpk= 0, nxpk= 0, iat=2848,2851, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 177 RGUA H4' 177 RGUA H2' 5.5
&rst
ixpk= 0, nxpk= 0, iat=2848,2870, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 177 RGUA H5" 177 RGUA H1' 6.0
&rst
ixpk= 0, nxpk= 0, iat=2846,2851, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 177 RGUA H5" 177 RGUA H2' 6.0
&rst
ixpk= 0, nxpk= 0, iat=2846,2870, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 177 RGUA H5" 177 RGUA H4' 4.0
&rst
ixpk= 0, nxpk= 0, iat=2846,2848, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 177 RGUA H8 177 RGUA H1' 2.8
&rst
ixpk= 0, nxpk= 0, iat=2854,2851, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30, &end
#
# 177 RGUA H8 177 RGUA H2' 5.5
&rst
ixpk= 0, nxpk= 0, iat=2854,2870, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 177 RGUA H8 177 RGUA H3' 6.0
&rst
ixpk= 0, nxpk= 0, iat=2854,2868, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 177 RGUA H8 177 RGUA H4' 5.5
&rst
ixpk= 0, nxpk= 0, iat=2854,2848, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 177 RGUA H8 177 RGUA H5" 6.0
&rst
ixpk= 0, nxpk= 0, iat=2854,2846, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 177 RGUA H1' 178 URA H5 6.0
&rst
ixpk= 0, nxpk= 0, iat=2851,2890, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 177 RGUA H1' 178 URA H6 6.0
&rst
ixpk= 0, nxpk= 0, iat=2851,2888, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 177 RGUA H2' 178 URA H5 5.5
&rst
ixpk= 0, nxpk= 0, iat=2870,2890, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 177 RGUA H2' 178 URA H6 5.5
&rst
ixpk= 0, nxpk= 0, iat=2870,2888, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 177 RGUA H3' 178 URA H5 4.0
&rst
ixpk= 0, nxpk= 0, iat=2868,2890, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 177 RGUA H3' 178 URA H6 5.0
&rst
ixpk= 0, nxpk= 0, iat=2868,2888, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 177 RGUA H4' 178 URA H5 5.0
&rst
ixpk= 0, nxpk= 0, iat=2848,2890, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 177 RGUA H4' 178 URA H6 6.0
&rst
ixpk= 0, nxpk= 0, iat=2848,2888, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 178 URA H5" 177 RGUA H2' 6.0
&rst
ixpk= 0, nxpk= 0, iat=2880,2870, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 178 URA H5' 177 RGUA H2' 6.0
&rst
ixpk= 0, nxpk= 0, iat=2879,2870, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 178 URA H2' 178 URA H1' 4.0
&rst
ixpk= 0, nxpk= 0, iat=2900,2885, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 178 URA H2' 178 URA H3' 3.2
&rst
ixpk= 0, nxpk= 0, iat=2900,2898, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 178 URA H3' 178 URA H1' 4.0
&rst
ixpk= 0, nxpk= 0, iat=2898,2885, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 178 URA H4' 178 URA H1' 5.0
&rst
ixpk= 0, nxpk= 0, iat=2882,2885, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 178 URA H4' 178 URA H2' 5.5
&rst
ixpk= 0, nxpk= 0, iat=2882,2900, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 178 URA H4' 178 URA H3' 4.0
&rst
ixpk= 0, nxpk= 0, iat=2882,2898, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 178 URA H4' 178 URA H5' 5.5
&rst
ixpk= 0, nxpk= 0, iat=2882,2879, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 178 URA H5" 178 URA H1' 6.0
&rst
ixpk= 0, nxpk= 0, iat=2880,2885, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 178 URA H5' 178 URA H1' 6.0
&rst
ixpk= 0, nxpk= 0, iat=2879,2885, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 178 URA H5 178 URA H2' 5.0
&rst
ixpk= 0, nxpk= 0, iat=2890,2900, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 178 URA H5" 178 URA H2' 6.0
&rst
ixpk= 0, nxpk= 0, iat=2880,2900, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 178 URA H5' 178 URA H2' 6.0
&rst
ixpk= 0, nxpk= 0, iat=2879,2900, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 178 URA H5" 178 URA H3' 5.5
&rst
ixpk= 0, nxpk= 0, iat=2880,2898, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 178 URA H5' 178 URA H3' 5.5
&rst
ixpk= 0, nxpk= 0, iat=2879,2898, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 178 URA H5 178 URA H3' 6.0
&rst
ixpk= 0, nxpk= 0, iat=2890,2898, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 178 URA H5' 178 URA H5" 6.0
&rst
ixpk= 0, nxpk= 0, iat=2879,2880, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 178 URA H5 178 URA H5" 6.0
&rst
ixpk= 0, nxpk= 0, iat=2890,2880, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 178 URA H5" 178 URA H5' 6.0
&rst
ixpk= 0, nxpk= 0, iat=2880,2879, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 178 URA H6 178 URA H1' 4.0
&rst
ixpk= 0, nxpk= 0, iat=2888,2885, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 178 URA H6 178 URA H2' 3.2
&rst
ixpk= 0, nxpk= 0, iat=2888,2900, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 178 URA H6 178 URA H3' 5.5
&rst
ixpk= 0, nxpk= 0, iat=2888,2898, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 178 URA H6 178 URA H4' 6.0
&rst
ixpk= 0, nxpk= 0, iat=2888,2882, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 178 URA H6 178 URA H5 2.8
&rst
ixpk= 0, nxpk= 0, iat=2888,2890, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30, &end
#
# 178 URA H6 178 URA H5" 6.0
&rst
ixpk= 0, nxpk= 0, iat=2888,2880, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 178 URA H6 178 URA H5' 6.0
&rst
ixpk= 0, nxpk= 0, iat=2888,2879, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 178 URA H1' 179 RGUA H2' 6.0
&rst
ixpk= 0, nxpk= 0, iat=2885,2934, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 178 URA H1' 179 RGUA H8 6.0
&rst
ixpk= 0, nxpk= 0, iat=2885,2918, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 178 URA H4' 179 RGUA H4' 6.0
&rst
ixpk= 0, nxpk= 0, iat=2882,2912, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 178 URA H4' 179 RGUA H5" 6.0
&rst
ixpk= 0, nxpk= 0, iat=2882,2910, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 178 URA H4' 179 RGUA H8 6.0
&rst
ixpk= 0, nxpk= 0, iat=2882,2918, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 179 RGUA H3' 178 URA H1' 6.0
&rst
ixpk= 0, nxpk= 0, iat=2932,2885, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 179 RGUA H5" 178 URA H1' 6.0
&rst
ixpk= 0, nxpk= 0, iat=2910,2885, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 179 RGUA H2' 179 RGUA H1' 4.0
&rst
ixpk= 0, nxpk= 0, iat=2934,2915, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 179 RGUA H3' 179 RGUA H1' 5.0
&rst
ixpk= 0, nxpk= 0, iat=2932,2915, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 179 RGUA H3' 179 RGUA H2' 3.2
&rst
ixpk= 0, nxpk= 0, iat=2932,2934, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 179 RGUA H3' 179 RGUA H4' 5.0
&rst
ixpk= 0, nxpk= 0, iat=2932,2912, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 179 RGUA H4' 179 RGUA H1' 3.2
&rst
ixpk= 0, nxpk= 0, iat=2912,2915, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 179 RGUA H4' 179 RGUA H2' 5.0
&rst
ixpk= 0, nxpk= 0, iat=2912,2934, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 179 RGUA H4' 179 RGUA H5" 5.5
&rst
ixpk= 0, nxpk= 0, iat=2912,2910, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 179 RGUA H4' 179 RGUA H5' 5.5
&rst
ixpk= 0, nxpk= 0, iat=2912,2909, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 179 RGUA H5" 179 RGUA H1' 6.0
&rst
ixpk= 0, nxpk= 0, iat=2910,2915, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 179 RGUA H5' 179 RGUA H1' 6.0
&rst
ixpk= 0, nxpk= 0, iat=2909,2915, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 179 RGUA H5" 179 RGUA H2' 6.0
&rst
ixpk= 0, nxpk= 0, iat=2910,2934, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 179 RGUA H5' 179 RGUA H2' 6.0
&rst
ixpk= 0, nxpk= 0, iat=2909,2934, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 179 RGUA H5' 179 RGUA H3' 5.5
&rst
ixpk= 0, nxpk= 0, iat=2909,2932, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 179 RGUA H5" 179 RGUA H3' 6.0
&rst
ixpk= 0, nxpk= 0, iat=2910,2932, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 179 RGUA H5" 179 RGUA H4' 5.5
&rst
ixpk= 0, nxpk= 0, iat=2910,2912, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 179 RGUA H5' 179 RGUA H4' 5.5
&rst
ixpk= 0, nxpk= 0, iat=2909,2912, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 179 RGUA H8 179 RGUA H1' 4.5
&rst
ixpk= 0, nxpk= 0, iat=2918,2915, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 179 RGUA H8 179 RGUA H2' 2.8
&rst
ixpk= 0, nxpk= 0, iat=2918,2934, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30, &end
#
# 179 RGUA H8 179 RGUA H3' 4.5
&rst
ixpk= 0, nxpk= 0, iat=2918,2932, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 179 RGUA H8 179 RGUA H4' 5.0
&rst
ixpk= 0, nxpk= 0, iat=2918,2912, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 179 RGUA H8 179 RGUA H5" 6.0
&rst
ixpk= 0, nxpk= 0, iat=2918,2910, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 179 RGUA H8 179 RGUA H5' 6.0
&rst
ixpk= 0, nxpk= 0, iat=2918,2909, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 179 RGUA H1' 180 RADE H8 6.0
&rst
ixpk= 0, nxpk= 0, iat=2915,2952, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 179 RGUA H2' 180 RADE H8 6.0
&rst
ixpk= 0, nxpk= 0, iat=2934,2952, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 179 RGUA H3' 180 RADE H8 6.0
&rst
ixpk= 0, nxpk= 0, iat=2932,2952, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 179 RGUA H4' 180 RADE H8 6.0
&rst
ixpk= 0, nxpk= 0, iat=2912,2952, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 180 RADE H2' 180 RADE H1' 6.0
&rst
ixpk= 0, nxpk= 0, iat=2967,2949, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 180 RADE H2 180 RADE H1' 6.0
&rst
ixpk= 0, nxpk= 0, iat=2961,2949, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 180 RADE H3' 180 RADE H1' 5.5
&rst
ixpk= 0, nxpk= 0, iat=2965,2949, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 180 RADE H4' 180 RADE H1' 5.0
&rst
ixpk= 0, nxpk= 0, iat=2946,2949, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 180 RADE H5' 180 RADE H4' 2.8
&rst
ixpk= 0, nxpk= 0, iat=2943,2946, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30, &end
#
# 180 RADE H8 180 RADE H1' 5.0
&rst
ixpk= 0, nxpk= 0, iat=2952,2949, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 180 RADE H8 180 RADE H3' 5.5
&rst
ixpk= 0, nxpk= 0, iat=2952,2965, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 180 RADE H8 180 RADE H4' 6.0
&rst
ixpk= 0, nxpk= 0, iat=2952,2946, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 180 RADE H8 180 RADE H5" 6.0
&rst
ixpk= 0, nxpk= 0, iat=2952,2944, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 180 RADE H8 180 RADE H5' 6.0
&rst
ixpk= 0, nxpk= 0, iat=2952,2943, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 180 RADE H1' 181 RADE H8 6.0
&rst
ixpk= 0, nxpk= 0, iat=2949,2985, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 180 RADE H2 181 RADE H1' 5.0
&rst
ixpk= 0, nxpk= 0, iat=2961,2982, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 180 RADE H2 181 RADE H2 5.5
&rst
ixpk= 0, nxpk= 0, iat=2961,2994, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 180 RADE H2' 181 RADE H8 6.0
&rst
ixpk= 0, nxpk= 0, iat=2967,2985, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 180 RADE H4' 181 RADE H8 5.0
&rst
ixpk= 0, nxpk= 0, iat=2946,2985, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 180 RADE H5" 181 RADE H8 6.0
&rst
ixpk= 0, nxpk= 0, iat=2944,2985, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 180 RADE H5' 181 RADE H8 6.0
&rst
ixpk= 0, nxpk= 0, iat=2943,2985, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 180 RADE H8 181 RADE H8 5.5
&rst
ixpk= 0, nxpk= 0, iat=2952,2985, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 181 RADE H2' 181 RADE H1' 5.0
&rst
ixpk= 0, nxpk= 0, iat=3000,2982, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 181 RADE H2 181 RADE H1' 6.0
&rst
ixpk= 0, nxpk= 0, iat=2994,2982, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 181 RADE H3' 181 RADE H1' 5.5
&rst
ixpk= 0, nxpk= 0, iat=2998,2982, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 181 RADE H3' 181 RADE H2' 2.8
&rst
ixpk= 0, nxpk= 0, iat=2998,3000, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30, &end
#
# 181 RADE H4' 181 RADE H1' 6.0
&rst
ixpk= 0, nxpk= 0, iat=2979,2982, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 181 RADE H5" 181 RADE H1' 6.0
&rst
ixpk= 0, nxpk= 0, iat=2977,2982, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 181 RADE H8 181 RADE H1' 5.0
&rst
ixpk= 0, nxpk= 0, iat=2985,2982, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 181 RADE H8 181 RADE H2' 5.0
&rst
ixpk= 0, nxpk= 0, iat=2985,3000, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 181 RADE H8 181 RADE H3' 5.5
&rst
ixpk= 0, nxpk= 0, iat=2985,2998, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 181 RADE H8 181 RADE H4' 5.5
&rst
ixpk= 0, nxpk= 0, iat=2985,2979, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 181 RADE H8 181 RADE H5" 6.0
&rst
ixpk= 0, nxpk= 0, iat=2985,2977, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 181 RADE H3' 182 URA H6 6.0
&rst
ixpk= 0, nxpk= 0, iat=2998,3018, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 182 URA H2' 182 URA H1' 5.5
&rst
ixpk= 0, nxpk= 0, iat=3030,3015, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 182 URA H2' 182 URA H3' 4.0
&rst
ixpk= 0, nxpk= 0, iat=3030,3028, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 182 URA H3' 182 URA H1' 5.5
&rst
ixpk= 0, nxpk= 0, iat=3028,3015, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 182 URA H3' 182 URA H5" 6.0
&rst
ixpk= 0, nxpk= 0, iat=3028,3010, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 182 URA H3' 182 URA H5' 6.0
&rst
ixpk= 0, nxpk= 0, iat=3028,3009, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 182 URA H4' 182 URA H1' 6.0
&rst
ixpk= 0, nxpk= 0, iat=3012,3015, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 182 URA H5 182 URA H1' 6.0
&rst
ixpk= 0, nxpk= 0, iat=3020,3015, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 182 URA H5 182 URA H2' 6.0
&rst
ixpk= 0, nxpk= 0, iat=3020,3030, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 182 URA H5 182 URA H3' 6.0
&rst
ixpk= 0, nxpk= 0, iat=3020,3028, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 182 URA H6 182 URA H1' 5.0
&rst
ixpk= 0, nxpk= 0, iat=3018,3015, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 182 URA H6 182 URA H2' 4.0
&rst
ixpk= 0, nxpk= 0, iat=3018,3030, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 182 URA H6 182 URA H3' 6.5
&rst
ixpk= 0, nxpk= 0, iat=3018,3028, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00, &end
#
# 182 URA H6 182 URA H4' 6.0
&rst
ixpk= 0, nxpk= 0, iat=3018,3012, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 182 URA H6 182 URA H5 3.2
&rst
ixpk= 0, nxpk= 0, iat=3018,3020, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 182 URA H6 182 URA H5' 6.0
&rst
ixpk= 0, nxpk= 0, iat=3018,3009, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 183 RGUA H1' 183 RGUA H2' 4.0
&rst
ixpk= 0, nxpk= 0, iat=3045,3064, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 183 RGUA H3' 183 RGUA H1' 5.0
&rst
ixpk= 0, nxpk= 0, iat=3062,3045, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 183 RGUA H3' 183 RGUA H2' 3.2
&rst
ixpk= 0, nxpk= 0, iat=3062,3064, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 183 RGUA H3' 183 RGUA H5' 5.5
&rst
ixpk= 0, nxpk= 0, iat=3062,3039, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 183 RGUA H3' 183 RGUA H5" 6.0
&rst
ixpk= 0, nxpk= 0, iat=3062,3040, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 183 RGUA H4' 183 RGUA H1' 5.5
&rst
ixpk= 0, nxpk= 0, iat=3042,3045, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 183 RGUA H4' 183 RGUA H2' 5.5
&rst
ixpk= 0, nxpk= 0, iat=3042,3064, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 183 RGUA H4' 183 RGUA H3' 5.0
&rst
ixpk= 0, nxpk= 0, iat=3042,3062, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 183 RGUA H4' 183 RGUA H5' 6.0
&rst
ixpk= 0, nxpk= 0, iat=3042,3039, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 183 RGUA H5" 183 RGUA H1' 6.0
&rst
ixpk= 0, nxpk= 0, iat=3040,3045, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 183 RGUA H5' 183 RGUA H2' 6.0
&rst
ixpk= 0, nxpk= 0, iat=3039,3064, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 183 RGUA H5" 183 RGUA H4' 6.0
&rst
ixpk= 0, nxpk= 0, iat=3040,3042, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 183 RGUA H8 183 RGUA H1' 2.8
&rst
ixpk= 0, nxpk= 0, iat=3048,3045, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30, &end
#
# 183 RGUA H8 183 RGUA H2' 5.5
&rst
ixpk= 0, nxpk= 0, iat=3048,3064, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 183 RGUA H8 183 RGUA H3' 6.0
&rst
ixpk= 0, nxpk= 0, iat=3048,3062, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 183 RGUA H8 183 RGUA H4' 6.0
&rst
ixpk= 0, nxpk= 0, iat=3048,3042, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 183 RGUA H1' 184 RADE H1' 6.0
&rst
ixpk= 0, nxpk= 0, iat=3045,3079, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 183 RGUA H1' 184 RADE H8 5.5
&rst
ixpk= 0, nxpk= 0, iat=3045,3082, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 183 RGUA H3' 184 RADE H8 6.0
&rst
ixpk= 0, nxpk= 0, iat=3062,3082, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 183 RGUA H8 184 RADE H8 6.0
&rst
ixpk= 0, nxpk= 0, iat=3048,3082, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 184 RADE H1' 184 RADE H3' 4.0
&rst
ixpk= 0, nxpk= 0, iat=3079,3095, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 184 RADE H2' 184 RADE H1' 3.2
&rst
ixpk= 0, nxpk= 0, iat=3097,3079, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 184 RADE H2 184 RADE H1' 6.0
&rst
ixpk= 0, nxpk= 0, iat=3091,3079, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 184 RADE H2 184 RADE H2' 6.0
&rst
ixpk= 0, nxpk= 0, iat=3091,3097, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 184 RADE H4' 184 RADE H1' 4.0
&rst
ixpk= 0, nxpk= 0, iat=3076,3079, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 184 RADE H5' 184 RADE H1' 5.5
&rst
ixpk= 0, nxpk= 0, iat=3073,3079, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 184 RADE H5' 184 RADE H2' 4.0
&rst
ixpk= 0, nxpk= 0, iat=3073,3097, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 184 RADE H5" 184 RADE H2' 5.5
&rst
ixpk= 0, nxpk= 0, iat=3074,3097, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 184 RADE H5' 184 RADE H4' 2.8
&rst
ixpk= 0, nxpk= 0, iat=3073,3076, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30, &end
#
# 184 RADE H8 184 RADE H1' 4.0
&rst
ixpk= 0, nxpk= 0, iat=3082,3079, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 184 RADE H8 184 RADE H2' 5.0
&rst
ixpk= 0, nxpk= 0, iat=3082,3097, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 184 RADE H8 184 RADE H3' 6.0
&rst
ixpk= 0, nxpk= 0, iat=3082,3095, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 184 RADE H8 184 RADE H4' 5.5
&rst
ixpk= 0, nxpk= 0, iat=3082,3076, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 184 RADE H8 184 RADE H5' 5.0
&rst
ixpk= 0, nxpk= 0, iat=3082,3073, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 184 RADE H8 184 RADE H5' 5.0
&rst
ixpk= 0, nxpk= 0, iat=3082,3073, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 184 RADE H1' 185 RADE H8 5.0
&rst
ixpk= 0, nxpk= 0, iat=3079,3115, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 184 RADE H2 185 RADE H1' 4.0
&rst
ixpk= 0, nxpk= 0, iat=3091,3112, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 184 RADE H2' 185 RADE H1' 6.0
&rst
ixpk= 0, nxpk= 0, iat=3097,3112, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 184 RADE H2 185 RADE H2 6.0
&rst
ixpk= 0, nxpk= 0, iat=3091,3124, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 184 RADE H2 185 RADE H2' 6.0
&rst
ixpk= 0, nxpk= 0, iat=3091,3130, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 184 RADE H2 185 RADE H4' 6.0
&rst
ixpk= 0, nxpk= 0, iat=3091,3109, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 184 RADE H2' 185 RADE H8 4.0
&rst
ixpk= 0, nxpk= 0, iat=3097,3115, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 184 RADE H3' 185 RADE H8 5.5
&rst
ixpk= 0, nxpk= 0, iat=3095,3115, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 184 RADE H4' 185 RADE H8 6.0
&rst
ixpk= 0, nxpk= 0, iat=3076,3115, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 184 RADE H5' 185 RADE H8 6.0
&rst
ixpk= 0, nxpk= 0, iat=3073,3115, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 184 RADE H8 185 RADE H5" 6.0
&rst
ixpk= 0, nxpk= 0, iat=3082,3107, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 184 RADE H2 186 URA H2' 6.0
&rst
ixpk= 0, nxpk= 0, iat=3091,3160, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 184 RADE H2 186 URA H3' 6.0
&rst
ixpk= 0, nxpk= 0, iat=3091,3158, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 185 RADE H2' 185 RADE H1' 2.8
&rst
ixpk= 0, nxpk= 0, iat=3130,3112, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30, &end
#
# 185 RADE H3' 185 RADE H1' 5.0
&rst
ixpk= 0, nxpk= 0, iat=3128,3112, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 185 RADE H4' 185 RADE H1' 3.2
&rst
ixpk= 0, nxpk= 0, iat=3109,3112, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 185 RADE H5" 185 RADE H1' 5.0
&rst
ixpk= 0, nxpk= 0, iat=3107,3112, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 185 RADE H5' 185 RADE H1' 5.5
&rst
ixpk= 0, nxpk= 0, iat=3106,3112, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 185 RADE H5" 185 RADE H3' 2.8
&rst
ixpk= 0, nxpk= 0, iat=3107,3128, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30, &end
#
# 185 RADE H5" 185 RADE H4' 3.8
&rst
ixpk= 0, nxpk= 0, iat=3107,3109, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30, &end
#
# 185 RADE H5" 185 RADE H5' 2.8
&rst
ixpk= 0, nxpk= 0, iat=3107,3106, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30, &end
#
# 185 RADE H8 185 RADE H1' 4.0
&rst
ixpk= 0, nxpk= 0, iat=3115,3112, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 185 RADE H8 185 RADE H2' 4.0
&rst
ixpk= 0, nxpk= 0, iat=3115,3130, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 185 RADE H8 185 RADE H3' 3.2
&rst
ixpk= 0, nxpk= 0, iat=3115,3128, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 185 RADE H8 185 RADE H4' 5.0
&rst
ixpk= 0, nxpk= 0, iat=3115,3109, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 185 RADE H8 185 RADE H5" 4.0
&rst
ixpk= 0, nxpk= 0, iat=3115,3107, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 185 RADE H8 185 RADE H5' 5.0
&rst
ixpk= 0, nxpk= 0, iat=3115,3106, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 185 RADE H1' 186 URA H6 6.0
&rst
ixpk= 0, nxpk= 0, iat=3112,3148, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 185 RADE H2 186 URA H1' 5.5
&rst
ixpk= 0, nxpk= 0, iat=3124,3145, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 185 RADE H2' 186 URA H1' 6.0
&rst
ixpk= 0, nxpk= 0, iat=3130,3145, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 185 RADE H2 186 URA H2' 5.5
&rst
ixpk= 0, nxpk= 0, iat=3124,3160, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 185 RADE H2' 186 URA H5 5.0
&rst
ixpk= 0, nxpk= 0, iat=3130,3150, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 185 RADE H2' 186 URA H6 2.8
&rst
ixpk= 0, nxpk= 0, iat=3130,3148, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30, &end
#
# 185 RADE H3' 186 URA H5 6.0
&rst
ixpk= 0, nxpk= 0, iat=3128,3150, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 185 RADE H3' 186 URA H6 4.0
&rst
ixpk= 0, nxpk= 0, iat=3128,3148, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 185 RADE H4' 186 URA H6 6.0
&rst
ixpk= 0, nxpk= 0, iat=3109,3148, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 185 RADE H8 186 URA H5 6.0
&rst
ixpk= 0, nxpk= 0, iat=3115,3150, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 185 RADE H8 186 URA H6 6.0
&rst
ixpk= 0, nxpk= 0, iat=3115,3148, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 186 URA H2' 185 RADE H3' 5.5
&rst
ixpk= 0, nxpk= 0, iat=3160,3128, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 186 URA H5 185 RADE H1' 6.0
&rst
ixpk= 0, nxpk= 0, iat=3150,3112, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 186 URA H5" 185 RADE H3' 5.5
&rst
ixpk= 0, nxpk= 0, iat=3140,3128, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 186 URA H2' 186 URA H1' 2.8
&rst
ixpk= 0, nxpk= 0, iat=3160,3145, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30, &end
#
# 186 URA H2' 186 URA H3' 2.8
&rst
ixpk= 0, nxpk= 0, iat=3160,3158, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30, &end
#
# 186 URA H3' 186 URA H1' 5.5
&rst
ixpk= 0, nxpk= 0, iat=3158,3145, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 186 URA H3' 186 URA H5' 4.0
&rst
ixpk= 0, nxpk= 0, iat=3158,3139, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 186 URA H4' 186 URA H1' 6.0
&rst
ixpk= 0, nxpk= 0, iat=3142,3145, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 186 URA H5" 186 URA H1' 6.0
&rst
ixpk= 0, nxpk= 0, iat=3140,3145, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 186 URA H5 186 URA H2' 5.0
&rst
ixpk= 0, nxpk= 0, iat=3150,3160, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 186 URA H5" 186 URA H3' 4.0
&rst
ixpk= 0, nxpk= 0, iat=3140,3158, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 186 URA H5 186 URA H3' 5.0
&rst
ixpk= 0, nxpk= 0, iat=3150,3158, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 186 URA H5" 186 URA H5' 2.8
&rst
ixpk= 0, nxpk= 0, iat=3140,3139, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30, &end
#
# 186 URA H6 186 URA H1' 4.0
&rst
ixpk= 0, nxpk= 0, iat=3148,3145, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 186 URA H6 186 URA H2' 3.2
&rst
ixpk= 0, nxpk= 0, iat=3148,3160, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 186 URA H6 186 URA H3' 2.8
&rst
ixpk= 0, nxpk= 0, iat=3148,3158, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30, &end
#
# 186 URA H6 186 URA H4' 5.5
&rst
ixpk= 0, nxpk= 0, iat=3148,3142, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 186 URA H6 186 URA H5 2.8
&rst
ixpk= 0, nxpk= 0, iat=3148,3150, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30, &end
#
# 186 URA H6 186 URA H5" 5.0
&rst
ixpk= 0, nxpk= 0, iat=3148,3140, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
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