NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
570001 |
2lu9   |
18513 | cing | 1-original | 1 | AMBER | distance | NOE | simple |
#
# 22 ILE HN 22 ILE QG2 4.24
&rst
ixpk= 0, nxpk= 0, iat= 328, -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
rk2=20.0, rk3=20.0, ir6=1, ialtd=0,
igr2= 334, 335, 336,
&end
#
# 22 ILE QG2 23 GLY HN 4.59
&rst
ixpk= 0, nxpk= 0, iat= -1, 347, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
igr1= 334, 335, 336,
&end
#
# 11 SER HN 11 SER QB 2.94
&rst
ixpk= 0, nxpk= 0, iat= 169, -1, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80,
igr2= 173, 174,
&end
#
# 20 LYS HN 20 LYS QG 5.16
&rst
ixpk= 0, nxpk= 0, iat= 296, -1, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,
igr2= 303, 304,
&end
#
# 13 ARG HN 13 ARG QD 5.50
&rst
ixpk= 0, nxpk= 0, iat= 190, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 200, 201,
&end
#
# 13 ARG HN 13 ARG HB3 3.56
&rst
ixpk= 0, nxpk= 0, iat= 190, 195, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06, &end
#
# 13 ARG HN 13 ARG QG 5.50
&rst
ixpk= 0, nxpk= 0, iat= 190, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 197, 198,
&end
#
# 24 GLU HN 24 GLU HG3 4.40
&rst
ixpk= 0, nxpk= 0, iat= 354, 362, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 24 GLU HN 24 GLU HG2 4.40
&rst
ixpk= 0, nxpk= 0, iat= 354, 361, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 24 GLU HN 24 GLU QB 3.99
&rst
ixpk= 0, nxpk= 0, iat= 354, -1, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
igr2= 358, 359,
&end
#
# 12 CYX HA 14 SER HN 5.12
&rst
ixpk= 0, nxpk= 0, iat= 182, 214, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, &end
#
# 12 CYX QB 14 SER HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 214, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 184, 185,
&end
#
# 25 GLU HN 25 GLU HG3 5.50
&rst
ixpk= 0, nxpk= 0, iat= 369, 377, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 14 SER HN 14 SER QB 3.27
&rst
ixpk= 0, nxpk= 0, iat= 214, -1, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,
igr2= 218, 219,
&end
#
# 9 GLU HN 9 GLU HB2 3.79
&rst
ixpk= 0, nxpk= 0, iat= 135, 139, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29, &end
#
# 10 LEU HN 10 LEU HB2 3.70
&rst
ixpk= 0, nxpk= 0, iat= 150, 154, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20, &end
#
# 10 LEU HN 10 LEU HG 3.73
&rst
ixpk= 0, nxpk= 0, iat= 150, 157, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23, &end
#
# 20 LYS HN 20 LYS QD 4.09
&rst
ixpk= 0, nxpk= 0, iat= 296, -1, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
igr2= 306, 307,
&end
#
# 21 CYX HA 22 ILE HN 2.76
&rst
ixpk= 0, nxpk= 0, iat= 320, 328, r1= 1.30, r2= 1.80, r3= 2.76, r4= 3.26, &end
#
# 21 CYX HB2 22 ILE HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 322, 328, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 21 CYX HB2 23 GLY HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 322, 347, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 21 CYX HB3 22 ILE HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 323, 328, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 21 CYX HB3 23 GLY HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 323, 347, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 24 GLU HN 25 GLU HN 3.31
&rst
ixpk= 0, nxpk= 0, iat= 354, 369, r1= 1.30, r2= 1.80, r3= 3.31, r4= 3.81, &end
#
# 25 GLU HG3 26 CYX HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 377, 384, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 25 GLU HB2 26 CYX HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 373, 384, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 25 GLU HB3 26 CYX HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 374, 384, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 20 LYS QB 21 CYX HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 318, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 300, 301,
&end
#
# 20 LYS QG 21 CYX HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 318, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 303, 304,
&end
#
# 19 GLY HA2 20 LYS HN 2.82
&rst
ixpk= 0, nxpk= 0, iat= 291, 296, r1= 1.30, r2= 1.80, r3= 2.82, r4= 3.32, &end
#
# 5 LEU HN 6 ARG HN 3.73
&rst
ixpk= 0, nxpk= 0, iat= 58, 77, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23, &end
#
# 10 LEU HN 11 SER HN 3.36
&rst
ixpk= 0, nxpk= 0, iat= 150, 169, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86, &end
#
# 10 LEU HG 11 SER HN 5.01
&rst
ixpk= 0, nxpk= 0, iat= 157, 169, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51, &end
#
# 10 LEU HN 10 LEU HB3 3.70
&rst
ixpk= 0, nxpk= 0, iat= 150, 155, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20, &end
#
# 9 GLU HN 10 LEU HN 3.39
&rst
ixpk= 0, nxpk= 0, iat= 135, 150, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89, &end
#
# 9 GLU HB2 10 LEU HN 4.10
&rst
ixpk= 0, nxpk= 0, iat= 139, 150, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60, &end
#
# 9 GLU HB3 10 LEU HN 4.10
&rst
ixpk= 0, nxpk= 0, iat= 140, 150, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60, &end
#
# 12 CYX QB 13 ARG HN 3.67
&rst
ixpk= 0, nxpk= 0, iat= -1, 190, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
igr1= 184, 185,
&end
#
# 13 ARG HN 14 SER HN 3.33
&rst
ixpk= 0, nxpk= 0, iat= 190, 214, r1= 1.30, r2= 1.80, r3= 3.33, r4= 3.83, &end
#
# 24 GLU HG2 25 GLU HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 361, 369, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 13 ARG QG 14 SER HN 5.19
&rst
ixpk= 0, nxpk= 0, iat= -1, 214, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33,
igr1= 197, 198,
&end
#
# 15 LEU HN 15 LEU HG 3.08
&rst
ixpk= 0, nxpk= 0, iat= 225, 232, r1= 1.30, r2= 1.80, r3= 3.08, r4= 3.58, &end
#
# 15 LEU HN 15 LEU QD1 5.50
&rst
ixpk= 0, nxpk= 0, iat= 225, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2= 234, 235, 236,
&end
#
# 15 LEU HN 15 LEU QD2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 225, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2= 238, 239, 240,
&end
#
# 14 SER QB 15 LEU HN 5.26
&rst
ixpk= 0, nxpk= 0, iat= -1, 225, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
igr1= 218, 219,
&end
#
# 14 SER HN 15 LEU HN 3.09
&rst
ixpk= 0, nxpk= 0, iat= 214, 225, r1= 1.30, r2= 1.80, r3= 3.09, r4= 3.59, &end
#
# 15 LEU HN 16 GLY HN 3.00
&rst
ixpk= 0, nxpk= 0, iat= 225, 244, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 15 LEU HN 15 LEU QB 3.20
&rst
ixpk= 0, nxpk= 0, iat= 225, -1, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09,
igr2= 229, 230,
&end
#
# 15 LEU QB 16 GLY HN 4.34
&rst
ixpk= 0, nxpk= 0, iat= -1, 244, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,
igr1= 229, 230,
&end
#
# 15 LEU HG 16 GLY HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 232, 244, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 17 LEU HN 17 LEU HG 3.32
&rst
ixpk= 0, nxpk= 0, iat= 251, 258, r1= 1.30, r2= 1.80, r3= 3.32, r4= 3.82, &end
#
# 17 LEU HN 17 LEU QD2 4.01
&rst
ixpk= 0, nxpk= 0, iat= 251, -1, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
igr2= 264, 265, 266,
&end
#
# 26 CYX HN 26 CYX HB2 3.49
&rst
ixpk= 0, nxpk= 0, iat= 384, 388, r1= 1.30, r2= 1.80, r3= 3.49, r4= 3.99, &end
#
# 26 CYX HN 26 CYX HB3 3.49
&rst
ixpk= 0, nxpk= 0, iat= 384, 389, r1= 1.30, r2= 1.80, r3= 3.49, r4= 3.99, &end
#
# 25 GLU HG2 26 CYX HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 376, 384, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 24 GLU HG3 25 GLU HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 362, 369, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 25 GLU HN 25 GLU HG2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 369, 376, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 25 GLU HA 26 CYX HN 2.79
&rst
ixpk= 0, nxpk= 0, iat= 371, 384, r1= 1.30, r2= 1.80, r3= 2.79, r4= 3.29, &end
#
# 27 LYS HN 27 LYS QG 5.50
&rst
ixpk= 0, nxpk= 0, iat= 394, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 401, 402,
&end
#
# 26 CYX HB2 27 LYS HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 388, 394, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 26 CYX HA 27 LYS HN 2.74
&rst
ixpk= 0, nxpk= 0, iat= 386, 394, r1= 1.30, r2= 1.80, r3= 2.74, r4= 3.24, &end
#
# 26 CYX HB3 27 LYS HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 389, 394, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 26 CYX HN 27 LYS HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 384, 394, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 27 LYS HB3 28 CYX HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 399, 416, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 27 LYS HB2 28 CYX HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 398, 416, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 27 LYS HA 28 CYX HN 2.72
&rst
ixpk= 0, nxpk= 0, iat= 396, 416, r1= 1.30, r2= 1.80, r3= 2.72, r4= 3.22, &end
#
# 27 LYS QD 28 CYX HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 416, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 404, 405,
&end
#
# 29 VAL HN 29 VAL QG1 3.76
&rst
ixpk= 0, nxpk= 0, iat= 426, -1, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
igr2= 432, 433, 434,
&end
#
# 28 CYX HA 29 VAL HN 2.72
&rst
ixpk= 0, nxpk= 0, iat= 418, 426, r1= 1.30, r2= 1.80, r3= 2.72, r4= 3.22, &end
#
# 27 LYS HN 28 CYX HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 394, 416, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 28 CYX HN 29 VAL HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 416, 426, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 29 VAL HB 30 PRO HD2 3.67
&rst
ixpk= 0, nxpk= 0, iat= 430, 443, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17, &end
#
# 29 VAL HB 30 PRO HD3 3.67
&rst
ixpk= 0, nxpk= 0, iat= 430, 444, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17, &end
#
# 31 TYR HA 31 TYR QD 3.98
&rst
ixpk= 0, nxpk= 0, iat= 458, -1, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
igr2= 464, 473,
&end
#
# 31 TYR HN 31 TYR HB3 4.02
&rst
ixpk= 0, nxpk= 0, iat= 456, 461, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52, &end
#
# 18 LEU HN 18 LEU QB 2.83
&rst
ixpk= 0, nxpk= 0, iat= 270, -1, r1= 1.30, r2= 1.80, r3= 3.18, r4= 3.68,
igr2= 274, 275,
&end
#
# 18 LEU HN 18 LEU QD1 4.14
&rst
ixpk= 0, nxpk= 0, iat= 270, -1, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
igr2= 279, 280, 281,
&end
#
# 17 LEU QB 18 LEU HN 4.02
&rst
ixpk= 0, nxpk= 0, iat= -1, 270, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,
igr1= 255, 256,
&end
#
# 18 LEU QB 18 LEU QD1 3.12
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,
igr1= 274, 275,
igr2= 279, 280, 281,
&end
#
# 18 LEU QB 18 LEU QD2 3.12
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71,
igr1= 274, 275,
igr2= 283, 284, 285,
&end
#
# 17 LEU HA 18 LEU HN 3.08
&rst
ixpk= 0, nxpk= 0, iat= 253, 270, r1= 1.30, r2= 1.80, r3= 3.08, r4= 3.58, &end
#
# 17 LEU HN 18 LEU HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 251, 270, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 9 GLU HN 9 GLU HG2 4.08
&rst
ixpk= 0, nxpk= 0, iat= 135, 142, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58, &end
#
# 8 CYX HN 9 GLU HN 3.36
&rst
ixpk= 0, nxpk= 0, iat= 125, 135, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86, &end
#
# 8 CYX HN 8 CYX HB2 3.28
&rst
ixpk= 0, nxpk= 0, iat= 125, 129, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78, &end
#
# 7 ARG HN 7 ARG QD 5.50
&rst
ixpk= 0, nxpk= 0, iat= 101, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 111, 112,
&end
#
# 6 ARG HB2 7 ARG HN 4.23
&rst
ixpk= 0, nxpk= 0, iat= 81, 101, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73, &end
#
# 7 ARG HA 7 ARG HE 5.50
&rst
ixpk= 0, nxpk= 0, iat= 103, 114, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 7 ARG QD 8 CYX HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 125, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 111, 112,
&end
#
# 7 ARG HB2 8 CYX HN 3.99
&rst
ixpk= 0, nxpk= 0, iat= 105, 125, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49, &end
#
# 7 ARG HB3 8 CYX HN 3.99
&rst
ixpk= 0, nxpk= 0, iat= 106, 125, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49, &end
#
# 7 ARG QG 8 CYX HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 125, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 108, 109,
&end
#
# 7 ARG HN 8 CYX HN 3.29
&rst
ixpk= 0, nxpk= 0, iat= 101, 125, r1= 1.30, r2= 1.80, r3= 3.29, r4= 3.79, &end
#
# 6 ARG HN 6 ARG QG 5.50
&rst
ixpk= 0, nxpk= 0, iat= 77, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 84, 85,
&end
#
# 5 LEU HN 5 LEU HB2 3.75
&rst
ixpk= 0, nxpk= 0, iat= 58, 62, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25, &end
#
# 5 LEU HN 5 LEU HB3 3.75
&rst
ixpk= 0, nxpk= 0, iat= 58, 63, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25, &end
#
# 5 LEU HN 5 LEU HG 4.58
&rst
ixpk= 0, nxpk= 0, iat= 58, 65, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08, &end
#
# 5 LEU HG 6 ARG HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 65, 77, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 4 ASN HB3 5 LEU HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 49, 58, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 4 ASN HB2 5 LEU HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 48, 58, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 4 ASN HA 5 LEU HN 3.14
&rst
ixpk= 0, nxpk= 0, iat= 46, 58, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64, &end
#
# 4 ASN HN 4 ASN HB3 3.73
&rst
ixpk= 0, nxpk= 0, iat= 44, 49, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23, &end
#
# 8 CYX HN 8 CYX HB3 3.28
&rst
ixpk= 0, nxpk= 0, iat= 125, 130, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78, &end
#
# 4 ASN HN 4 ASN HB2 3.73
&rst
ixpk= 0, nxpk= 0, iat= 44, 48, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23, &end
#
# 3 CYX HN 3 CYX HB2 3.68
&rst
ixpk= 0, nxpk= 0, iat= 34, 38, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18, &end
#
# 20 LYS HA 21 CYX HN 2.73
&rst
ixpk= 0, nxpk= 0, iat= 298, 318, r1= 1.30, r2= 1.80, r3= 2.73, r4= 3.23, &end
#
# 3 CYX HA 4 ASN HN 2.79
&rst
ixpk= 0, nxpk= 0, iat= 36, 44, r1= 1.30, r2= 1.80, r3= 2.79, r4= 3.29, &end
#
# 2 PHE HA 3 CYX HN 3.05
&rst
ixpk= 0, nxpk= 0, iat= 16, 34, r1= 1.30, r2= 1.80, r3= 3.05, r4= 3.55, &end
#
# 2 PHE HB2 3 CYX HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 18, 34, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 2 PHE HB3 3 CYX HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 19, 34, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 18 LEU QD2 19 GLY HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 289, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 283, 284, 285,
&end
#
# 18 LEU QD1 19 GLY HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 289, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 279, 280, 281,
&end
#
# 17 LEU QB 19 GLY HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 289, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 255, 256,
&end
#
# 18 LEU HG 19 GLY HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 277, 289, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 18 LEU HA 19 GLY HN 2.98
&rst
ixpk= 0, nxpk= 0, iat= 272, 289, r1= 1.30, r2= 1.80, r3= 2.98, r4= 3.48, &end
#
# 17 LEU HN 17 LEU QB 3.23
&rst
ixpk= 0, nxpk= 0, iat= 251, -1, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13,
igr2= 255, 256,
&end
#
# 15 LEU HG 17 LEU HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 232, 251, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 15 LEU QB 17 LEU HN 3.78
&rst
ixpk= 0, nxpk= 0, iat= -1, 251, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
igr1= 229, 230,
&end
#
# 20 LYS HN 20 LYS QE 5.50
&rst
ixpk= 0, nxpk= 0, iat= 296, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 309, 310,
&end
#
# 19 GLY HN 20 LYS HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 289, 296, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 23 GLY HN 24 GLU HN 3.66
&rst
ixpk= 0, nxpk= 0, iat= 347, 354, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16, &end
#
# 20 LYS HN 29 VAL HN 5.43
&rst
ixpk= 0, nxpk= 0, iat= 296, 426, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93, &end
#
# 22 ILE HN 27 LYS HN 4.57
&rst
ixpk= 0, nxpk= 0, iat= 328, 394, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07, &end
#
# 22 ILE HA 24 GLU HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 330, 354, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 21 CYX HA 27 LYS HN 4.37
&rst
ixpk= 0, nxpk= 0, iat= 320, 394, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87, &end
#
# 22 ILE HN 26 CYX HA 4.33
&rst
ixpk= 0, nxpk= 0, iat= 328, 386, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83, &end
#
# 20 LYS HN 28 CYX HA 4.48
&rst
ixpk= 0, nxpk= 0, iat= 296, 418, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98, &end
#
# 17 LEU QB 29 VAL HN 5.36
&rst
ixpk= 0, nxpk= 0, iat= -1, 426, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,
igr1= 255, 256,
&end
#
# 12 CYX QB 18 LEU HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 270, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 184, 185,
&end
#
# 18 LEU HN 28 CYX HB3 5.50
&rst
ixpk= 0, nxpk= 0, iat= 270, 421, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 9 GLU HB2 11 SER HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 139, 169, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 11 SER HN 12 CYX QB 5.50
&rst
ixpk= 0, nxpk= 0, iat= 169, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 184, 185,
&end
#
# 9 GLU HB3 11 SER HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 140, 169, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 4 ASN HB3 7 ARG HN 5.08
&rst
ixpk= 0, nxpk= 0, iat= 49, 101, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58, &end
#
# 9 GLU HG2 19 GLY HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 142, 289, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 9 GLU HG3 19 GLY HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 143, 289, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 18 LEU HN 28 CYX HB2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 270, 420, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 13 ARG HA 16 GLY HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 192, 244, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 4 ASN HB2 7 ARG HN 5.08
&rst
ixpk= 0, nxpk= 0, iat= 48, 101, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58, &end
#
# 14 SER HN 16 GLY HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 214, 244, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 12 CYX HN 14 SER HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 180, 214, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 11 SER HN 12 CYX HN 2.88
&rst
ixpk= 0, nxpk= 0, iat= 169, 180, r1= 1.30, r2= 1.80, r3= 2.88, r4= 3.38, &end
#
# 6 ARG HN 7 ARG HN 3.51
&rst
ixpk= 0, nxpk= 0, iat= 77, 101, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01, &end
#
# 10 LEU HN 12 CYX HN 4.65
&rst
ixpk= 0, nxpk= 0, iat= 150, 180, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15, &end
#
# 18 LEU QD1 31 TYR QD 5.30
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
igr1= 279, 280, 281,
igr2= 464, 473,
&end
#
# 18 LEU QD2 31 TYR QD 5.30
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
igr1= 283, 284, 285,
igr2= 464, 473,
&end
#
# 15 LEU HN 17 LEU HG 5.42
&rst
ixpk= 0, nxpk= 0, iat= 225, 258, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92, &end
#
# 18 LEU QB 31 TYR QD 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
igr1= 274, 275,
igr2= 464, 473,
&end
#
# 12 CYX QB 17 LEU HN 4.60
&rst
ixpk= 0, nxpk= 0, iat= -1, 251, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
igr1= 184, 185,
&end
#
# 18 LEU QD2 31 TYR QE 5.24
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.06, r4= 7.56,
igr1= 283, 284, 285,
igr2= 466, 473,
&end
#
# 18 LEU QD1 31 TYR QE 5.24
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.06, r4= 7.56,
igr1= 279, 280, 281,
igr2= 466, 473,
&end
#
# 10 LEU HA 13 ARG HB2 5.35
&rst
ixpk= 0, nxpk= 0, iat= 152, 194, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85, &end
#
# 10 LEU HA 13 ARG HB3 5.35
&rst
ixpk= 0, nxpk= 0, iat= 152, 195, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85, &end
#
# 9 GLU HA 19 GLY HA3 3.40
&rst
ixpk= 0, nxpk= 0, iat= 137, 292, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90, &end
#
# 15 LEU HG 17 LEU QD2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 232, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2= 264, 265, 266,
&end
#
# 17 LEU QB 28 CYX HB3 4.18
&rst
ixpk= 0, nxpk= 0, iat= -1, 421, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,
igr1= 255, 256,
&end
#
# 12 CYX QB 17 LEU QB 4.09
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
igr1= 184, 185,
igr2= 255, 256,
&end
#
# 12 CYX HA 17 LEU HN 4.87
&rst
ixpk= 0, nxpk= 0, iat= 182, 251, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37, &end
#
# 13 ARG HA 17 LEU HN 5.08
&rst
ixpk= 0, nxpk= 0, iat= 192, 251, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58, &end
#
# 20 LYS QB 20 LYS QE 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
igr1= 300, 301,
igr2= 309, 310,
&end
#
# 6 ARG HB3 7 ARG HN 4.23
&rst
ixpk= 0, nxpk= 0, iat= 82, 101, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73, &end
#
# 6 ARG HA 9 GLU HN 5.12
&rst
ixpk= 0, nxpk= 0, iat= 79, 135, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, &end
#
# 10 LEU HN 11 SER QB 4.46
&rst
ixpk= 0, nxpk= 0, iat= 150, -1, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
igr2= 173, 174,
&end
#
# 9 GLU HA 12 CYX HN 4.64
&rst
ixpk= 0, nxpk= 0, iat= 137, 180, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14, &end
#
# 11 SER QB 12 CYX HN 3.60
&rst
ixpk= 0, nxpk= 0, iat= -1, 180, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
igr1= 173, 174,
&end
#
# 13 ARG HN 13 ARG HB2 3.56
&rst
ixpk= 0, nxpk= 0, iat= 190, 194, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06, &end
#
# 9 GLU HA 13 ARG HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 137, 190, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 15 LEU HN 17 LEU QD2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 225, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2= 264, 265, 266,
&end
#
# 29 VAL HN 30 PRO HD2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 426, 443, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 29 VAL HN 30 PRO HD3 5.50
&rst
ixpk= 0, nxpk= 0, iat= 426, 444, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 12 CYX QB 19 GLY HA3 3.76
&rst
ixpk= 0, nxpk= 0, iat= -1, 292, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
igr1= 184, 185,
&end
#
# 29 VAL HA 29 VAL QG1 4.00
&rst
ixpk= 0, nxpk= 0, iat= 428, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2= 432, 433, 434,
&end
#
# 29 VAL HA 29 VAL QG2 4.00
&rst
ixpk= 0, nxpk= 0, iat= 428, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2= 436, 437, 438,
&end
#
# 29 VAL HN 29 VAL QG2 3.76
&rst
ixpk= 0, nxpk= 0, iat= 426, -1, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
igr2= 436, 437, 438,
&end
#
# 20 LYS HN 27 LYS HN 4.31
&rst
ixpk= 0, nxpk= 0, iat= 296, 394, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81, &end
#
# 9 GLU HN 9 GLU HG3 4.08
&rst
ixpk= 0, nxpk= 0, iat= 135, 143, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58, &end
#
# 9 GLU HN 9 GLU HB3 3.79
&rst
ixpk= 0, nxpk= 0, iat= 135, 140, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29, &end
#
# 22 ILE HN 22 ILE HB 3.95
&rst
ixpk= 0, nxpk= 0, iat= 328, 332, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45, &end
#
# 22 ILE HB 23 GLY HN 4.44
&rst
ixpk= 0, nxpk= 0, iat= 332, 347, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94, &end
#
# 22 ILE HB 22 ILE QD1 3.61
&rst
ixpk= 0, nxpk= 0, iat= 332, -1, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,
igr2= 341, 342, 343,
&end
#
# 22 ILE HA 22 ILE QD1 3.85
&rst
ixpk= 0, nxpk= 0, iat= 330, -1, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
igr2= 341, 342, 343,
&end
#
# 22 ILE HN 22 ILE QD1 5.18
&rst
ixpk= 0, nxpk= 0, iat= 328, -1, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
igr2= 341, 342, 343,
&end
#
# 22 ILE QD1 23 GLY HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 347, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 341, 342, 343,
&end
#
# 20 LYS HA 20 LYS QD 4.97
&rst
ixpk= 0, nxpk= 0, iat= 298, -1, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr2= 306, 307,
&end
#
# 20 LYS QG 20 LYS QD 2.69
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89,
igr1= 303, 304,
igr2= 306, 307,
&end
#
# 17 LEU QB 17 LEU HG 2.60
&rst
ixpk= 0, nxpk= 0, iat= -1, 258, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
igr1= 255, 256,
&end
#
# 18 LEU QB 18 LEU HG 2.77
&rst
ixpk= 0, nxpk= 0, iat= -1, 277, r1= 1.30, r2= 1.80, r3= 3.11, r4= 3.61,
igr1= 274, 275,
&end
#
# 18 LEU HN 29 VAL HN 3.80
&rst
ixpk= 0, nxpk= 0, iat= 270, 426, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30, &end
#
# 13 ARG HA 13 ARG QG 3.92
&rst
ixpk= 0, nxpk= 0, iat= 192, -1, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,
igr2= 197, 198,
&end
#
# 10 LEU HA 13 ARG HN 3.93
&rst
ixpk= 0, nxpk= 0, iat= 152, 190, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43, &end
#
# 12 CYX HN 12 CYX QB 2.92
&rst
ixpk= 0, nxpk= 0, iat= 180, -1, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78,
igr2= 184, 185,
&end
#
# 3 CYX HN 3 CYX HB3 3.68
&rst
ixpk= 0, nxpk= 0, iat= 34, 39, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18, &end
#
# 31 TYR HN 31 TYR HB2 4.02
&rst
ixpk= 0, nxpk= 0, iat= 456, 460, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52, &end
#
# 6 ARG HA 6 ARG QG 3.94
&rst
ixpk= 0, nxpk= 0, iat= 79, -1, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92,
igr2= 84, 85,
&end
#
# 6 ARG QG 7 ARG HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 101, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 84, 85,
&end
#
# 7 ARG HN 7 ARG QG 5.50
&rst
ixpk= 0, nxpk= 0, iat= 101, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 108, 109,
&end
#
# 23 GLY HN 25 GLU HN 4.01
&rst
ixpk= 0, nxpk= 0, iat= 347, 369, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51, &end
#
# 17 LEU HA 17 LEU HG 3.94
&rst
ixpk= 0, nxpk= 0, iat= 253, 258, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44, &end
#
# 27 LYS HA 27 LYS QD 4.19
&rst
ixpk= 0, nxpk= 0, iat= 396, -1, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
igr2= 404, 405,
&end
#
# 17 LEU HA 17 LEU QD2 2.99
&rst
ixpk= 0, nxpk= 0, iat= 253, -1, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09,
igr2= 264, 265, 266,
&end
#
# 17 LEU QB 17 LEU QD2 3.45
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
igr1= 255, 256,
igr2= 264, 265, 266,
&end
#
# 16 GLY HN 17 LEU HN 3.11
&rst
ixpk= 0, nxpk= 0, iat= 244, 251, r1= 1.30, r2= 1.80, r3= 3.11, r4= 3.61, &end
#
# 31 TYR HN 31 TYR QD 4.15
&rst
ixpk= 0, nxpk= 0, iat= 456, -1, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
igr2= 464, 473,
&end
#
# 27 LYS HN 27 LYS QD 4.07
&rst
ixpk= 0, nxpk= 0, iat= 394, -1, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07,
igr2= 404, 405,
&end
#
# 19 GLY HA2 28 CYX HA 3.85
&rst
ixpk= 0, nxpk= 0, iat= 291, 418, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35, &end
#
# 29 VAL HA 30 PRO HD2 3.17
&rst
ixpk= 0, nxpk= 0, iat= 428, 443, r1= 1.30, r2= 1.80, r3= 3.17, r4= 3.67, &end
#
# 29 VAL HA 30 PRO HD3 3.17
&rst
ixpk= 0, nxpk= 0, iat= 428, 444, r1= 1.30, r2= 1.80, r3= 3.17, r4= 3.67, &end
#
# 18 LEU HN 18 LEU QD2 4.14
&rst
ixpk= 0, nxpk= 0, iat= 270, -1, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
igr2= 283, 284, 285,
&end
#
# 16 GLY HN 17 LEU QD2 4.16
&rst
ixpk= 0, nxpk= 0, iat= 244, -1, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,
igr2= 264, 265, 266,
&end
#
# 12 CYX QB 17 LEU HG 3.77
&rst
ixpk= 0, nxpk= 0, iat= -1, 258, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,
igr1= 184, 185,
&end
#
# 17 LEU QB 28 CYX HB2 4.18
&rst
ixpk= 0, nxpk= 0, iat= -1, 420, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19,
igr1= 255, 256,
&end
#
# 12 CYX QB 19 GLY HA2 4.19
&rst
ixpk= 0, nxpk= 0, iat= -1, 291, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
igr1= 184, 185,
&end
#
# 12 CYX QB 19 GLY HN 4.10
&rst
ixpk= 0, nxpk= 0, iat= -1, 289, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
igr1= 184, 185,
&end
#
# 9 GLU HA 12 CYX QB 4.02
&rst
ixpk= 0, nxpk= 0, iat= 137, -1, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01,
igr2= 184, 185,
&end
#
# 9 GLU HA 19 GLY HN 3.75
&rst
ixpk= 0, nxpk= 0, iat= 137, 289, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25, &end
#
# 3 CYX HN 3 CYX QB 2.91
&rst
ixpk= 0, nxpk= 0, iat= 34, -1, r1= 1.30, r2= 1.80, r3= 3.27, r4= 3.77,
igr2= 38, 39,
&end
#
# 3 CYX HN 5 LEU QQD 3.82
&rst
ixpk= 0, nxpk= 0, iat= 34, 64, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32, &end
#
# 3 CYX HA 5 LEU QQD 4.62
&rst
ixpk= 0, nxpk= 0, iat= 36, 64, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12, &end
#
# 4 ASN HN 4 ASN QB 2.98
&rst
ixpk= 0, nxpk= 0, iat= 44, -1, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84,
igr2= 48, 49,
&end
#
# 4 ASN HN 5 LEU QQD 5.37
&rst
ixpk= 0, nxpk= 0, iat= 44, 64, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87, &end
#
# 4 ASN QB 4 ASN QD2 3.16
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,
igr1= 48, 49,
igr2= 53, 54,
&end
#
# 4 ASN QB 7 ARG HN 4.29
&rst
ixpk= 0, nxpk= 0, iat= -1, 101, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
igr1= 48, 49,
&end
#
# 4 ASN QB 7 ARG QB 5.18
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.53, r4= 7.03,
igr1= 48, 49,
igr2= 105, 106,
&end
#
# 5 LEU HN 5 LEU QQD 4.25
&rst
ixpk= 0, nxpk= 0, iat= 58, 64, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75, &end
#
# 5 LEU HN 6 ARG QB 5.34
&rst
ixpk= 0, nxpk= 0, iat= 58, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2= 81, 82,
&end
#
# 5 LEU HA 5 LEU QQD 3.06
&rst
ixpk= 0, nxpk= 0, iat= 60, 64, r1= 1.30, r2= 1.80, r3= 3.06, r4= 3.56, &end
#
# 5 LEU HA 8 CYX QB 3.83
&rst
ixpk= 0, nxpk= 0, iat= 60, -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
igr2= 129, 130,
&end
#
# 5 LEU QB 5 LEU QQD 2.69
&rst
ixpk= 0, nxpk= 0, iat= -1, 64, r1= 1.30, r2= 1.80, r3= 3.02, r4= 3.52,
igr1= 62, 63,
&end
#
# 5 LEU QB 6 ARG HN 3.72
&rst
ixpk= 0, nxpk= 0, iat= -1, 77, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
igr1= 62, 63,
&end
#
# 5 LEU QQD 6 ARG HN 4.41
&rst
ixpk= 0, nxpk= 0, iat= 64, 77, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, &end
#
# 5 LEU QQD 9 GLU HN 5.44
&rst
ixpk= 0, nxpk= 0, iat= 64, 135, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94, &end
#
# 5 LEU QQD 9 GLU QG 5.28
&rst
ixpk= 0, nxpk= 0, iat= 64, -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr2= 142, 143,
&end
#
# 6 ARG HN 6 ARG QB 2.83
&rst
ixpk= 0, nxpk= 0, iat= 77, -1, r1= 1.30, r2= 1.80, r3= 3.18, r4= 3.68,
igr2= 81, 82,
&end
#
# 6 ARG HA 9 GLU QB 5.34
&rst
ixpk= 0, nxpk= 0, iat= 79, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2= 139, 140,
&end
#
# 6 ARG HA 9 GLU QG 5.34
&rst
ixpk= 0, nxpk= 0, iat= 79, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2= 142, 143,
&end
#
# 6 ARG QB 7 ARG HN 3.67
&rst
ixpk= 0, nxpk= 0, iat= -1, 101, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
igr1= 81, 82,
&end
#
# 6 ARG QB 7 ARG QD 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1= 81, 82,
igr2= 111, 112,
&end
#
# 6 ARG QB 8 CYX HN 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, 125, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1= 81, 82,
&end
#
# 7 ARG HN 7 ARG QB 3.21
&rst
ixpk= 0, nxpk= 0, iat= 101, -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr2= 105, 106,
&end
#
# 7 ARG HN 8 CYX QB 5.34
&rst
ixpk= 0, nxpk= 0, iat= 101, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2= 129, 130,
&end
#
# 7 ARG QB 7 ARG QG 2.32
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 2.92, r4= 3.42,
igr1= 105, 106,
igr2= 108, 109,
&end
#
# 7 ARG QB 7 ARG HE 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, 114, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1= 105, 106,
&end
#
# 7 ARG QB 8 CYX HN 3.48
&rst
ixpk= 0, nxpk= 0, iat= -1, 125, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41,
igr1= 105, 106,
&end
#
# 8 CYX HN 8 CYX QB 2.84
&rst
ixpk= 0, nxpk= 0, iat= 125, -1, r1= 1.30, r2= 1.80, r3= 3.19, r4= 3.69,
igr2= 129, 130,
&end
#
# 8 CYX QB 9 GLU HN 3.27
&rst
ixpk= 0, nxpk= 0, iat= -1, 135, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,
igr1= 129, 130,
&end
#
# 8 CYX QB 10 LEU HN 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, 150, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1= 129, 130,
&end
#
# 9 GLU HN 9 GLU QB 3.18
&rst
ixpk= 0, nxpk= 0, iat= 135, -1, r1= 1.30, r2= 1.80, r3= 3.57, r4= 4.07,
igr2= 139, 140,
&end
#
# 9 GLU HN 9 GLU QG 3.30
&rst
ixpk= 0, nxpk= 0, iat= 135, -1, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,
igr2= 142, 143,
&end
#
# 9 GLU HN 10 LEU QB 5.34
&rst
ixpk= 0, nxpk= 0, iat= 135, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2= 154, 155,
&end
#
# 9 GLU HA 9 GLU QG 3.62
&rst
ixpk= 0, nxpk= 0, iat= 137, -1, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,
igr2= 142, 143,
&end
#
# 9 GLU QB 10 LEU HN 3.58
&rst
ixpk= 0, nxpk= 0, iat= -1, 150, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,
igr1= 139, 140,
&end
#
# 9 GLU QB 19 GLY HN 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, 289, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1= 139, 140,
&end
#
# 9 GLU QG 10 LEU HN 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, 150, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1= 142, 143,
&end
#
# 10 LEU HN 10 LEU QB 3.10
&rst
ixpk= 0, nxpk= 0, iat= 150, -1, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98,
igr2= 154, 155,
&end
#
# 10 LEU HN 10 LEU QQD 4.22
&rst
ixpk= 0, nxpk= 0, iat= 150, 156, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 10 LEU HA 10 LEU QQD 3.52
&rst
ixpk= 0, nxpk= 0, iat= 152, 156, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02, &end
#
# 10 LEU HA 13 ARG QB 4.57
&rst
ixpk= 0, nxpk= 0, iat= 152, -1, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
igr2= 194, 195,
&end
#
# 10 LEU QB 11 SER HN 4.14
&rst
ixpk= 0, nxpk= 0, iat= -1, 169, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
igr1= 154, 155,
&end
#
# 10 LEU QQD 11 SER HN 5.44
&rst
ixpk= 0, nxpk= 0, iat= 156, 169, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94, &end
#
# 12 CYX HN 13 ARG QB 5.34
&rst
ixpk= 0, nxpk= 0, iat= 180, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2= 194, 195,
&end
#
# 12 CYX QB 28 CYX QB 3.86
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
igr1= 184, 185,
igr2= 420, 421,
&end
#
# 13 ARG HN 13 ARG QB 3.00
&rst
ixpk= 0, nxpk= 0, iat= 190, -1, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87,
igr2= 194, 195,
&end
#
# 13 ARG QB 13 ARG HE 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, 203, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1= 194, 195,
&end
#
# 13 ARG QB 14 SER HN 3.79
&rst
ixpk= 0, nxpk= 0, iat= -1, 214, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75,
igr1= 194, 195,
&end
#
# 13 ARG QB 14 SER QB 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1= 194, 195,
igr2= 218, 219,
&end
#
# 15 LEU HN 16 GLY QA 5.34
&rst
ixpk= 0, nxpk= 0, iat= 225, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2= 246, 247,
&end
#
# 15 LEU HA 15 LEU QQD 3.86
&rst
ixpk= 0, nxpk= 0, iat= 227, 231, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 15 LEU QQD 17 LEU QD2 3.51
&rst
ixpk= 0, nxpk= 0, iat= 231, -1, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
igr2= 264, 265, 266,
&end
#
# 17 LEU HG 28 CYX QB 4.20
&rst
ixpk= 0, nxpk= 0, iat= 258, -1, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
igr2= 420, 421,
&end
#
# 17 LEU QD2 28 CYX QB 4.30
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
igr1= 264, 265, 266,
igr2= 420, 421,
&end
#
# 18 LEU HN 18 LEU QQD 3.41
&rst
ixpk= 0, nxpk= 0, iat= 270, 276, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91, &end
#
# 18 LEU HA 18 LEU QQD 3.05
&rst
ixpk= 0, nxpk= 0, iat= 272, 276, r1= 1.30, r2= 1.80, r3= 3.05, r4= 3.55, &end
#
# 18 LEU QB 18 LEU QQD 2.56
&rst
ixpk= 0, nxpk= 0, iat= -1, 276, r1= 1.30, r2= 1.80, r3= 2.87, r4= 3.37,
igr1= 274, 275,
&end
#
# 18 LEU QQD 19 GLY HN 4.03
&rst
ixpk= 0, nxpk= 0, iat= 276, 289, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53, &end
#
# 18 LEU QQD 20 LYS QE 5.25
&rst
ixpk= 0, nxpk= 0, iat= 276, -1, r1= 1.30, r2= 1.80, r3= 5.89, r4= 6.39,
igr2= 309, 310,
&end
#
# 18 LEU QQD 31 TYR QD 4.34
&rst
ixpk= 0, nxpk= 0, iat= 276, -1, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,
igr2= 464, 473,
&end
#
# 18 LEU QQD 31 TYR QE 4.56
&rst
ixpk= 0, nxpk= 0, iat= 276, -1, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
igr2= 466, 473,
&end
#
# 19 GLY HN 28 CYX QB 5.34
&rst
ixpk= 0, nxpk= 0, iat= 289, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2= 420, 421,
&end
#
# 21 CYX HN 21 CYX QB 2.94
&rst
ixpk= 0, nxpk= 0, iat= 318, -1, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80,
igr2= 322, 323,
&end
#
# 22 ILE HN 22 ILE QG1 4.29
&rst
ixpk= 0, nxpk= 0, iat= 328, -1, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
igr2= 338, 339,
&end
#
# 22 ILE QG1 23 GLY HN 4.90
&rst
ixpk= 0, nxpk= 0, iat= -1, 347, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
igr1= 338, 339,
&end
#
# 22 ILE QG1 27 LYS HN 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, 394, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1= 338, 339,
&end
#
# 23 GLY QA 24 GLU HN 2.90
&rst
ixpk= 0, nxpk= 0, iat= -1, 354, r1= 1.30, r2= 1.80, r3= 3.26, r4= 3.76,
igr1= 349, 350,
&end
#
# 23 GLY QA 25 GLU HN 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, 369, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1= 349, 350,
&end
#
# 24 GLU HN 24 GLU QG 3.76
&rst
ixpk= 0, nxpk= 0, iat= 354, -1, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
igr2= 361, 362,
&end
#
# 24 GLU QB 24 GLU QG 2.31
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 2.91, r4= 3.41,
igr1= 358, 359,
igr2= 361, 362,
&end
#
# 25 GLU HN 25 GLU QB 3.25
&rst
ixpk= 0, nxpk= 0, iat= 369, -1, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15,
igr2= 373, 374,
&end
#
# 25 GLU QG 26 CYX HN 4.67
&rst
ixpk= 0, nxpk= 0, iat= -1, 384, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr1= 376, 377,
&end
#
# 26 CYX HN 26 CYX QB 2.80
&rst
ixpk= 0, nxpk= 0, iat= 384, -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
igr2= 388, 389,
&end
#
# 27 LYS HN 27 LYS QB 3.44
&rst
ixpk= 0, nxpk= 0, iat= 394, -1, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,
igr2= 398, 399,
&end
#
# 27 LYS QB 27 LYS QD 2.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.15, r4= 3.65,
igr1= 398, 399,
igr2= 404, 405,
&end
#
# 28 CYX HN 28 CYX QB 3.49
&rst
ixpk= 0, nxpk= 0, iat= 416, -1, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
igr2= 420, 421,
&end
#
# 28 CYX HN 29 VAL QQG 5.20
&rst
ixpk= 0, nxpk= 0, iat= 416, 429, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70, &end
#
# 28 CYX HA 29 VAL QQG 5.10
&rst
ixpk= 0, nxpk= 0, iat= 418, 429, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, &end
#
# 28 CYX QB 29 VAL HN 4.19
&rst
ixpk= 0, nxpk= 0, iat= -1, 426, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
igr1= 420, 421,
&end
#
# 28 CYX QB 29 VAL QQG 4.76
&rst
ixpk= 0, nxpk= 0, iat= -1, 429, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr1= 420, 421,
&end
#
# 29 VAL HN 29 VAL QQG 3.12
&rst
ixpk= 0, nxpk= 0, iat= 426, 429, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62, &end
#
# 29 VAL HA 30 PRO QD 2.64
&rst
ixpk= 0, nxpk= 0, iat= 428, -1, r1= 1.30, r2= 1.80, r3= 2.96, r4= 3.46,
igr2= 443, 444,
&end
#
# 29 VAL HB 30 PRO QD 3.06
&rst
ixpk= 0, nxpk= 0, iat= 430, -1, r1= 1.30, r2= 1.80, r3= 3.43, r4= 3.93,
igr2= 443, 444,
&end
#
# 29 VAL QQG 30 PRO QD 3.68
&rst
ixpk= 0, nxpk= 0, iat= 429, -1, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
igr2= 443, 444,
&end
#
# 31 TYR HN 31 TYR QB 3.28
&rst
ixpk= 0, nxpk= 0, iat= 456, -1, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18,
igr2= 460, 461,
&end
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