Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
510945 | 2ky3 RC | 17227 | cing | 1-original | 1 | AMBER | dihedral angle |
#
# 24 ILE HN 24 ILE QG2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 346, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
rk2=20.0, rk3=20.0, ir6=1, ialtd=0,
igr2= 352, 353, 354,
&end
#
# 15 ARG HN 15 ARG QG 5.50
&rst
ixpk= 0, nxpk= 0, iat= 208, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 215, 216,
&end
#
# 15 ARG HA 15 ARG HE 5.50
&rst
ixpk= 0, nxpk= 0, iat= 210, 221, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 15 ARG HB3 15 ARG HE 5.50
&rst
ixpk= 0, nxpk= 0, iat= 213, 221, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 26 GLU HN 26 GLU HG2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 372, 379, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 23 CYX HB3 24 ILE HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 341, 346, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 24 ILE HB 25 GLY HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 350, 365, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 24 ILE HG12 25 GLY HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 356, 365, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 24 ILE HG13 25 GLY HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 357, 365, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 24 ILE QD1 25 GLY HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 365, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 359, 360, 361,
&end
#
# 27 GLU HG3 28 CYX HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 395, 402, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 11 GLU HG2 12 LEU HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 160, 168, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 11 GLU HG3 12 LEU HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 161, 168, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 11 GLU HB3 12 LEU HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 158, 168, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 14 CYX QB 15 ARG HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 208, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 202, 203,
&end
#
# 15 ARG QG 16 SER HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 232, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 215, 216,
&end
#
# 17 LEU QB 18 GLY HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 262, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 247, 248,
&end
#
# 17 LEU HG 18 GLY HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 250, 262, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 17 LEU QD1 18 GLY HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 262, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 252, 253, 254,
&end
#
# 17 LEU QD2 18 GLY HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 262, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 256, 257, 258,
&end
#
# 27 GLU HG2 28 CYX HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 394, 402, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 28 CYX HB3 29 LYS HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 407, 412, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 28 CYX HN 29 LYS HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 402, 412, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 29 LYS QD 30 CYX HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 434, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 422, 423,
&end
#
# 29 LYS HN 29 LYS QD 5.50
&rst
ixpk= 0, nxpk= 0, iat= 412, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 422, 423,
&end
#
# 29 LYS QD 31 VAL HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 444, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 422, 423,
&end
#
# 29 LYS QG 30 CYX HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 434, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 419, 420,
&end
#
# 29 LYS HN 30 CYX HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 412, 434, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 30 CYX HN 31 VAL HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 434, 444, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 20 LEU HN 20 LEU HG 5.50
&rst
ixpk= 0, nxpk= 0, iat= 288, 295, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 20 LEU HA 20 LEU QD1 5.50
&rst
ixpk= 0, nxpk= 0, iat= 290, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2= 297, 298, 299,
&end
#
# 9 ARG HN 9 ARG QD 5.50
&rst
ixpk= 0, nxpk= 0, iat= 119, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 129, 130,
&end
#
# 9 ARG HA 9 ARG HE 5.50
&rst
ixpk= 0, nxpk= 0, iat= 121, 132, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 6 ASN HN 9 ARG QD 5.50
&rst
ixpk= 0, nxpk= 0, iat= 62, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 129, 130,
&end
#
# 6 ASN HN 9 ARG QG 5.50
&rst
ixpk= 0, nxpk= 0, iat= 62, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 126, 127,
&end
#
# 9 ARG QG 10 CYX HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 143, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 126, 127,
&end
#
# 9 ARG HN 10 CYX HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 119, 143, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 8 ARG HA 8 ARG HE 5.50
&rst
ixpk= 0, nxpk= 0, iat= 97, 108, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 8 ARG HB2 8 ARG HE 5.50
&rst
ixpk= 0, nxpk= 0, iat= 99, 108, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 9 ARG HB2 9 ARG HE 5.50
&rst
ixpk= 0, nxpk= 0, iat= 123, 132, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 8 ARG HB3 8 ARG HE 5.50
&rst
ixpk= 0, nxpk= 0, iat= 100, 108, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 8 ARG HN 8 ARG QG 5.50
&rst
ixpk= 0, nxpk= 0, iat= 95, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 102, 103,
&end
#
# 6 ASN HB2 7 LEU HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 66, 76, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 2 SER HN 3 ALA HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 11, 22, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 24 ILE HA 24 ILE QD1 5.50
&rst
ixpk= 0, nxpk= 0, iat= 348, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2= 359, 360, 361,
&end
#
# 17 LEU HG 19 LEU HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 250, 269, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 15 ARG QG 19 LEU HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 269, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 215, 216,
&end
#
# 17 LEU QB 19 LEU HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 269, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 247, 248,
&end
#
# 22 LYS HN 22 LYS QE 5.50
&rst
ixpk= 0, nxpk= 0, iat= 314, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 327, 328,
&end
#
# 22 LYS HN 23 CYX HB3 5.50
&rst
ixpk= 0, nxpk= 0, iat= 314, 341, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 11 GLU HN 21 GLY HA2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 153, 309, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 8 ARG HA 11 GLU HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 97, 153, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 7 LEU HA 11 GLU HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 78, 153, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 9 ARG HA 11 GLU HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 121, 153, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 20 LEU HN 31 VAL HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 288, 444, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 25 GLY HN 26 GLU HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 365, 372, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 24 ILE HN 29 LYS HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 346, 412, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 22 LYS HN 29 LYS HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 314, 412, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 24 ILE HA 26 GLU HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 348, 372, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 8 ARG QG 11 GLU HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 153, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 102, 103,
&end
#
# 11 GLU HN 12 LEU HB2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 153, 172, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 21 GLY HA2 31 VAL HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 309, 444, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 24 ILE HN 28 CYX HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= 346, 404, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 22 LYS HN 28 CYX HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= 314, 404, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 20 LEU HN 30 CYX HB2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 288, 438, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 15 ARG HB2 18 GLY HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 212, 262, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 18 GLY HN 19 LEU HG 5.50
&rst
ixpk= 0, nxpk= 0, iat= 262, 276, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 18 GLY HN 19 LEU QB 5.50
&rst
ixpk= 0, nxpk= 0, iat= 262, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 273, 274,
&end
#
# 11 GLU HA 14 CYX HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 155, 198, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 15 ARG HA 18 GLY HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 210, 262, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 10 CYX HA 14 CYX HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 145, 198, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 10 CYX HA 13 SER HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 145, 187, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 21 GLY HN 30 CYX HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= 307, 436, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 14 CYX HN 16 SER HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 198, 232, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 7 LEU HN 8 ARG HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 76, 95, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 11 GLU HN 13 SER HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 153, 187, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 10 CYX HN 11 GLU HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 143, 153, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 10 CYX HN 13 SER HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 143, 187, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 8 ARG HN 10 CYX HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 95, 143, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 10 CYX HN 12 LEU HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 143, 168, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 13 SER HN 14 CYX HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 187, 198, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 12 LEU HN 14 CYX HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 168, 198, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 3 ALA HN 4 PHE HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 22, 32, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 8 ARG HN 9 ARG HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 95, 119, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 7 LEU HN 9 ARG HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 76, 119, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 9 ARG HN 11 GLU HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 119, 153, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 11 GLU HN 21 GLY HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 153, 307, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 21 GLY HN 22 LYS HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 307, 314, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 20 LEU HN 21 GLY HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 288, 307, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 12 LEU HN 13 SER HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 168, 187, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 5 CYX HN 6 ASN HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 52, 62, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 11 GLU HN 12 LEU HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 153, 168, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 11 GLU HN 23 CYX HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 153, 336, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 23 CYX HN 24 ILE HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 336, 346, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 8 ARG HN 11 GLU HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 95, 153, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 11 GLU HN 14 CYX HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 153, 198, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 22 LYS HN 23 CYX HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 314, 336, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 20 LEU HN 33 TYR HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 288, 474, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 30 CYX HN 31 VAL QG2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 434, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2= 454, 455, 456,
&end
#
# 30 CYX HN 31 VAL QG1 5.50
&rst
ixpk= 0, nxpk= 0, iat= 434, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2= 450, 451, 452,
&end
#
# 16 SER HN 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= 256, 257, 258,
&end
#
# 16 SER HN 17 LEU QD1 5.50
&rst
ixpk= 0, nxpk= 0, iat= 232, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2= 252, 253, 254,
&end
#
# 17 LEU QD1 19 LEU HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 269, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 252, 253, 254,
&end
#
# 17 LEU QD2 19 LEU HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 269, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 256, 257, 258,
&end
#
# 17 LEU HN 19 LEU QB 5.50
&rst
ixpk= 0, nxpk= 0, iat= 243, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 273, 274,
&end
#
# 17 LEU HN 19 LEU HG 5.50
&rst
ixpk= 0, nxpk= 0, iat= 243, 276, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 20 LEU QB 33 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= 292, 293,
igr2= 482, 491,
&end
#
# 19 LEU HN 30 CYX HB3 5.50
&rst
ixpk= 0, nxpk= 0, iat= 269, 439, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 13 SER HA 16 SER HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 189, 232, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 19 LEU HA 33 TYR QD 5.50
&rst
ixpk= 0, nxpk= 0, iat= 271, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 482, 491,
&end
#
# 16 SER HN 17 LEU HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 232, 243, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 17 LEU HN 18 GLY HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 243, 262, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 18 GLY HN 19 LEU HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 262, 269, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 15 ARG HN 19 LEU HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 208, 269, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 15 ARG HN 17 LEU HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 208, 243, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 19 LEU HN 20 LEU HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 269, 288, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 26 GLU HN 27 GLU HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 372, 387, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 24 ILE HN 27 GLU HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 346, 387, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 15 ARG HN 16 SER HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 208, 232, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 16 SER HN 18 GLY HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 232, 262, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 20 LEU HN 33 TYR QD 5.50
&rst
ixpk= 0, nxpk= 0, iat= 288, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 482, 491,
&end
#
# 33 TYR HN 33 TYR QD 5.50
&rst
ixpk= 0, nxpk= 0, iat= 474, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 482, 491,
&end
#
# 21 GLY HN 33 TYR QD 5.50
&rst
ixpk= 0, nxpk= 0, iat= 307, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 482, 491,
&end
#
# 20 LEU QB 33 TYR QE 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
igr1= 292, 293,
igr2= 484, 491,
&end
#
# 20 LEU HA 33 TYR QE 5.50
&rst
ixpk= 0, nxpk= 0, iat= 290, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 484, 491,
&end
#
# 33 TYR HN 33 TYR QE 5.50
&rst
ixpk= 0, nxpk= 0, iat= 474, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 484, 491,
&end
#
# 20 LEU HN 33 TYR QE 5.50
&rst
ixpk= 0, nxpk= 0, iat= 288, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 484, 491,
&end
#
# 29 LYS QD 30 CYX HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 436, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 422, 423,
&end
#
# 20 LEU HN 30 CYX HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= 288, 436, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 22 LYS HN 30 CYX HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= 314, 436, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 29 LYS HN 30 CYX HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= 412, 436, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 23 CYX HA 29 LYS HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 338, 412, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 23 CYX HA 28 CYX HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= 338, 404, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 7 LEU HB3 22 LYS HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= 81, 316, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 12 LEU HA 15 ARG QD 5.50
&rst
ixpk= 0, nxpk= 0, iat= 170, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 218, 219,
&end
#
# 14 CYX QB 16 SER QB 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
igr1= 202, 203,
igr2= 236, 237,
&end
#
# 10 CYX HA 13 SER QB 5.50
&rst
ixpk= 0, nxpk= 0, iat= 145, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 191, 192,
&end
#
# 33 TYR HA 33 TYR QD 5.50
&rst
ixpk= 0, nxpk= 0, iat= 476, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 482, 491,
&end
#
# 13 SER HA 15 ARG HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 189, 208, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 13 SER QB 14 CYX HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 198, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 191, 192,
&end
#
# 12 LEU HA 15 ARG HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 170, 208, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 9 ARG HA 12 LEU HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 121, 168, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 16 SER QB 17 LEU HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 243, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 236, 237,
&end
#
# 11 GLU HA 22 LYS HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 155, 314, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 11 GLU HA 15 ARG HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 155, 208, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 11 GLU HA 21 GLY HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 155, 307, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 10 CYX HB2 11 GLU HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 147, 153, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 15 ARG HN 15 ARG QD 5.50
&rst
ixpk= 0, nxpk= 0, iat= 208, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 218, 219,
&end
#
# 15 ARG HA 15 ARG QD 5.50
&rst
ixpk= 0, nxpk= 0, iat= 210, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 218, 219,
&end
#
# 8 ARG HA 8 ARG QD 5.50
&rst
ixpk= 0, nxpk= 0, iat= 97, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 105, 106,
&end
#
# 7 LEU HA 10 CYX HB2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 78, 147, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 9 ARG HA 9 ARG QD 5.50
&rst
ixpk= 0, nxpk= 0, iat= 121, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 129, 130,
&end
#
# 22 LYS QB 24 ILE HG13 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 357, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 318, 319,
&end
#
# 19 LEU QB 30 CYX HB3 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 439, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 273, 274,
&end
#
# 20 LEU QB 30 CYX HB3 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 439, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 292, 293,
&end
#
# 15 ARG QG 30 CYX HB3 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 439, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 215, 216,
&end
#
# 19 LEU QB 30 CYX HB2 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 438, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 273, 274,
&end
#
# 19 LEU HG 30 CYX HB2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 276, 438, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 7 LEU HG 11 GLU HG2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 83, 160, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 7 LEU HG 11 GLU HG3 5.50
&rst
ixpk= 0, nxpk= 0, iat= 83, 161, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 14 CYX QB 20 LEU QB 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
igr1= 202, 203,
igr2= 292, 293,
&end
#
# 14 CYX QB 19 LEU QB 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
igr1= 202, 203,
igr2= 273, 274,
&end
#
# 14 CYX QB 15 ARG QG 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
igr1= 202, 203,
igr2= 215, 216,
&end
#
# 14 CYX QB 30 CYX HB2 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 438, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 202, 203,
&end
#
# 11 GLU HA 14 CYX QB 5.50
&rst
ixpk= 0, nxpk= 0, iat= 155, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 202, 203,
&end
#
# 11 GLU HB2 12 LEU HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= 157, 170, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 12 LEU HA 14 CYX QB 5.50
&rst
ixpk= 0, nxpk= 0, iat= 170, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 202, 203,
&end
#
# 5 CYX HB3 26 GLU HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= 57, 374, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 8 ARG HA 11 GLU HG2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 97, 160, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 8 ARG HA 11 GLU HG3 5.50
&rst
ixpk= 0, nxpk= 0, iat= 97, 161, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 5 CYX HB2 26 GLU HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= 56, 374, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 7 LEU HA 10 CYX HB3 5.50
&rst
ixpk= 0, nxpk= 0, iat= 78, 148, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 27 GLU HA 28 CYX HB2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 389, 406, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 15 ARG HA 30 CYX HB3 5.50
&rst
ixpk= 0, nxpk= 0, iat= 210, 439, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 27 GLU HA 28 CYX HB3 5.50
&rst
ixpk= 0, nxpk= 0, iat= 389, 407, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 14 CYX QB 30 CYX HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 436, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 202, 203,
&end
#
# 14 CYX QB 19 LEU HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 269, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 202, 203,
&end
#
# 27 GLU HN 27 GLU HG3 5.50
&rst
ixpk= 0, nxpk= 0, iat= 387, 395, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 14 CYX QB 16 SER HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 232, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 202, 203,
&end
#
# 27 GLU HN 27 GLU HG2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 387, 394, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 14 CYX QB 21 GLY HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 307, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 202, 203,
&end
#
# 11 GLU HB2 12 LEU HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 157, 168, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 13 SER HN 14 CYX QB 5.50
&rst
ixpk= 0, nxpk= 0, iat= 187, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 202, 203,
&end
#
# 14 CYX QB 20 LEU HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 288, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 202, 203,
&end
#
# 26 GLU HN 26 GLU HG3 5.50
&rst
ixpk= 0, nxpk= 0, iat= 372, 380, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 11 GLU HN 11 GLU HG3 5.50
&rst
ixpk= 0, nxpk= 0, iat= 153, 161, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 11 GLU HN 11 GLU HG2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 153, 160, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 10 CYX HB3 11 GLU HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 148, 153, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 6 ASN HB3 7 LEU HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 67, 76, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 11 GLU HG2 21 GLY HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 160, 307, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 11 GLU HG3 21 GLY HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 161, 307, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 5 CYX HB3 27 GLU HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 57, 387, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 6 ASN HB3 9 ARG HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 67, 119, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 6 ASN HB2 9 ARG HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 66, 119, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 2 SER QB 3 ALA HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 22, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 15, 16,
&end
#
# 27 GLU HN 28 CYX HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 387, 402, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 20 LEU HN 30 CYX HB3 5.50
&rst
ixpk= 0, nxpk= 0, iat= 288, 439, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 3 ALA QB 4 PHE HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 32, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 26, 27, 28,
&end
#
# 15 ARG HA 19 LEU QB 5.50
&rst
ixpk= 0, nxpk= 0, iat= 210, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 273, 274,
&end
#
# 4 PHE HB2 5 CYX HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 36, 52, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 4 PHE HB3 5 CYX HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 37, 52, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 14 CYX HA 19 LEU HG 5.50
&rst
ixpk= 0, nxpk= 0, iat= 200, 276, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 20 LEU HG 21 GLY HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 295, 307, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 14 CYX HA 17 LEU QB 5.50
&rst
ixpk= 0, nxpk= 0, iat= 200, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 247, 248,
&end
#
# 15 ARG HA 17 LEU QB 5.50
&rst
ixpk= 0, nxpk= 0, iat= 210, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 247, 248,
&end
#
# 20 LEU QB 33 TYR HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 476, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 292, 293,
&end
#
# 11 GLU HA 20 LEU QB 5.50
&rst
ixpk= 0, nxpk= 0, iat= 155, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 292, 293,
&end
#
# 14 CYX QB 15 ARG HB2 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 212, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 202, 203,
&end
#
# 12 LEU HA 15 ARG HB2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 170, 212, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 11 GLU HB3 12 LEU HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= 158, 170, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 12 LEU HA 15 ARG HB3 5.50
&rst
ixpk= 0, nxpk= 0, iat= 170, 213, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 31 VAL HB 32 PRO HD3 5.50
&rst
ixpk= 0, nxpk= 0, iat= 448, 462, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 15 ARG HB2 15 ARG HE 5.50
&rst
ixpk= 0, nxpk= 0, iat= 212, 221, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 15 ARG HB2 16 SER HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 212, 232, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 12 LEU HN 15 ARG HB2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 168, 212, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 15 ARG HB3 16 SER HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 213, 232, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 27 GLU HB2 28 CYX HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 391, 402, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 30 CYX HB2 31 VAL HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 438, 444, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 30 CYX HB3 31 VAL HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 439, 444, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 21 GLY HA3 31 VAL HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 310, 444, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 11 GLU HN 21 GLY HA3 5.50
&rst
ixpk= 0, nxpk= 0, iat= 153, 310, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 23 CYX HB2 24 ILE HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 340, 346, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 14 CYX QB 31 VAL HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 444, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 202, 203,
&end
#
# 20 LEU QB 31 VAL HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 444, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 292, 293,
&end
#
# 29 LYS HN 29 LYS QG 5.50
&rst
ixpk= 0, nxpk= 0, iat= 412, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 419, 420,
&end
#
# 29 LYS QG 31 VAL HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 444, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 419, 420,
&end
#
# 19 LEU QB 31 VAL HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 444, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 273, 274,
&end
#
# 22 LYS QG 23 CYX HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 336, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 321, 322,
&end
#
# 19 LEU QB 33 TYR HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 474, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 273, 274,
&end
#
# 19 LEU QB 20 LEU HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 288, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 273, 274,
&end
#
# 22 LYS HN 22 LYS QG 5.50
&rst
ixpk= 0, nxpk= 0, iat= 314, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 321, 322,
&end
#
# 24 ILE HN 24 ILE HG12 5.50
&rst
ixpk= 0, nxpk= 0, iat= 346, 356, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 22 LYS HN 22 LYS QD 5.50
&rst
ixpk= 0, nxpk= 0, iat= 314, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 324, 325,
&end
#
# 7 LEU HN 7 LEU HG 5.50
&rst
ixpk= 0, nxpk= 0, iat= 76, 83, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 27 GLU HB3 28 CYX HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 392, 402, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 9 ARG HB2 10 CYX HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 123, 143, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 9 ARG HB3 10 CYX HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 124, 143, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 12 LEU HB2 13 SER HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 172, 187, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 12 LEU HB3 15 ARG HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 173, 208, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 29 LYS HB2 30 CYX HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 416, 434, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 12 LEU HB3 13 SER HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 173, 187, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 9 ARG QG 13 SER HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 187, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 126, 127,
&end
#
# 12 LEU HG 13 SER HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 175, 187, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 29 LYS HB3 30 CYX HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 417, 434, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 22 LYS QB 23 CYX HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 336, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 318, 319,
&end
#
# 12 LEU HN 12 LEU HG 5.50
&rst
ixpk= 0, nxpk= 0, iat= 168, 175, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 8 ARG HB2 9 ARG HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 99, 119, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 8 ARG HB3 9 ARG HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 100, 119, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 8 ARG QG 9 ARG HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 119, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 102, 103,
&end
#
# 9 ARG HN 9 ARG QG 5.50
&rst
ixpk= 0, nxpk= 0, iat= 119, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 126, 127,
&end
#
# 20 LEU QB 21 GLY HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 307, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 292, 293,
&end
#
# 7 LEU HG 8 ARG HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 83, 95, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 7 LEU HB3 8 ARG HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 81, 95, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 7 LEU HB3 23 CYX HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 81, 336, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 22 LYS QD 23 CYX HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 336, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 324, 325,
&end
#
# 19 LEU HN 19 LEU HG 5.50
&rst
ixpk= 0, nxpk= 0, iat= 269, 276, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 17 LEU HN 17 LEU HG 5.50
&rst
ixpk= 0, nxpk= 0, iat= 243, 250, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 24 ILE HB 27 GLU HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 350, 387, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 9 ARG HB3 9 ARG HE 5.50
&rst
ixpk= 0, nxpk= 0, iat= 124, 132, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 7 LEU HG 8 ARG HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= 83, 97, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 16 SER QB 17 LEU HG 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 250, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 236, 237,
&end
#
# 9 ARG HA 12 LEU HB3 5.50
&rst
ixpk= 0, nxpk= 0, iat= 121, 173, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 11 GLU HA 12 LEU HB2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 155, 172, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 9 ARG QG 12 LEU HB2 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 172, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 126, 127,
&end
#
# 7 LEU HB2 24 ILE HG12 5.50
&rst
ixpk= 0, nxpk= 0, iat= 80, 356, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 20 LEU QB 22 LYS QB 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
igr1= 292, 293,
igr2= 318, 319,
&end
#
# 6 ASN HB2 9 ARG HB3 5.50
&rst
ixpk= 0, nxpk= 0, iat= 66, 124, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 6 ASN HB2 9 ARG HB2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 66, 123, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 6 ASN HB3 9 ARG HB2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 67, 123, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 6 ASN HB3 9 ARG HB3 5.50
&rst
ixpk= 0, nxpk= 0, iat= 67, 124, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 20 LEU QD2 33 TYR HB3 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 479, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 301, 302, 303,
&end
#
# 20 LEU QD2 33 TYR HB2 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 478, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 301, 302, 303,
&end
#
# 20 LEU QD1 33 TYR HB2 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 478, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 297, 298, 299,
&end
#
# 20 LEU QD1 33 TYR HB3 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 479, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 297, 298, 299,
&end
#
# 22 LYS QE 31 VAL QG1 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr1= 327, 328,
igr2= 450, 451, 452,
&end
#
# 22 LYS QE 31 VAL QG2 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr1= 327, 328,
igr2= 454, 455, 456,
&end
#
# 7 LEU HB2 24 ILE QD1 5.50
&rst
ixpk= 0, nxpk= 0, iat= 80, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2= 359, 360, 361,
&end
#
# 7 LEU HB2 24 ILE QG2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 80, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2= 352, 353, 354,
&end
#
# 7 LEU HB2 24 ILE HG13 5.50
&rst
ixpk= 0, nxpk= 0, iat= 80, 357, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 22 LYS QD 24 ILE HG13 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 357, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 324, 325,
&end
#
# 31 VAL QG1 32 PRO HD3 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 462, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 450, 451, 452,
&end
#
# 31 VAL QG2 32 PRO HD3 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 462, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 454, 455, 456,
&end
#
# 31 VAL QG2 32 PRO HD2 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 461, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 454, 455, 456,
&end
#
# 31 VAL QG1 32 PRO HD2 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 461, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 450, 451, 452,
&end
#
# 17 LEU HA 17 LEU QD1 5.50
&rst
ixpk= 0, nxpk= 0, iat= 245, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2= 252, 253, 254,
&end
#
# 17 LEU HA 17 LEU QD2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 245, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2= 256, 257, 258,
&end
#
# 20 LEU HA 20 LEU QD2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 290, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2= 301, 302, 303,
&end
#
# 20 LEU QD1 33 TYR QE 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr1= 297, 298, 299,
igr2= 484, 491,
&end
#
# 20 LEU QD1 33 TYR QD 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr1= 297, 298, 299,
igr2= 482, 491,
&end
#
# 20 LEU QD2 33 TYR QD 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr1= 301, 302, 303,
igr2= 482, 491,
&end
#
# 20 LEU QD2 33 TYR QE 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr1= 301, 302, 303,
igr2= 484, 491,
&end
#
# 17 LEU HN 17 LEU QD2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 243, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2= 256, 257, 258,
&end
#
# 17 LEU HN 17 LEU QD1 5.50
&rst
ixpk= 0, nxpk= 0, iat= 243, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2= 252, 253, 254,
&end
#
# 20 LEU QD2 21 GLY HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 307, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 301, 302, 303,
&end
#
# 20 LEU HN 20 LEU QD2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 288, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2= 301, 302, 303,
&end
#
# 20 LEU HN 20 LEU QD1 5.50
&rst
ixpk= 0, nxpk= 0, iat= 288, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2= 297, 298, 299,
&end
#
# 24 ILE HN 24 ILE QD1 5.50
&rst
ixpk= 0, nxpk= 0, iat= 346, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2= 359, 360, 361,
&end
#
# 24 ILE QG2 25 GLY HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 365, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 352, 353, 354,
&end
#
# 24 ILE HN 24 ILE HG13 5.50
&rst
ixpk= 0, nxpk= 0, iat= 346, 357, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 20 LEU QD1 21 GLY HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 307, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 297, 298, 299,
&end
#
# 31 VAL HN 31 VAL QG2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 444, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2= 454, 455, 456,
&end
#
# 31 VAL HN 31 VAL QG1 5.50
&rst
ixpk= 0, nxpk= 0, iat= 444, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2= 450, 451, 452,
&end
#
# 14 CYX HA 17 LEU HG 5.50
&rst
ixpk= 0, nxpk= 0, iat= 200, 250, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 7 LEU HG 23 CYX HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 83, 336, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 20 LEU QB 33 TYR HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 474, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 292, 293,
&end
#
# 31 VAL HB 32 PRO HD2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 448, 461, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 22 LYS HN 23 CYX HB2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 314, 340, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 28 CYX HB2 29 LYS HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 406, 412, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 15 ARG HA 17 LEU HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 210, 243, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 15 ARG HA 19 LEU HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 210, 269, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 5 CYX HB2 27 GLU HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 56, 387, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 29 LYS HN 29 LYS QE 5.50
&rst
ixpk= 0, nxpk= 0, iat= 412, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 425, 426,
&end
#
# 23 CYX HA 27 GLU HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 338, 387, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 22 LYS HA 22 LYS QD 5.50
&rst
ixpk= 0, nxpk= 0, iat= 316, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 324, 325,
&end
#
# 22 LYS QB 22 LYS QE 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
igr1= 318, 319,
igr2= 327, 328,
&end
#
# 5 CYX QB 27 GLU HA 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, 389, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1= 56, 57,
&end
#
# 6 ASN HN 9 ARG QB 5.34
&rst
ixpk= 0, nxpk= 0, iat= 62, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2= 123, 124,
&end
#
# 6 ASN QB 8 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= 66, 67,
igr2= 105, 106,
&end
#
# 6 ASN QB 9 ARG QG 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1= 66, 67,
igr2= 126, 127,
&end
#
# 7 LEU HN 7 LEU QQD 5.44
&rst
ixpk= 0, nxpk= 0, iat= 76, 82, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94, &end
#
# 7 LEU QQD 8 ARG HN 5.44
&rst
ixpk= 0, nxpk= 0, iat= 82, 95, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94, &end
#
# 7 LEU QQD 10 CYX HN 5.44
&rst
ixpk= 0, nxpk= 0, iat= 82, 143, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94, &end
#
# 7 LEU QQD 10 CYX QB 5.28
&rst
ixpk= 0, nxpk= 0, iat= 82, -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr2= 147, 148,
&end
#
# 7 LEU QQD 11 GLU HN 5.44
&rst
ixpk= 0, nxpk= 0, iat= 82, 153, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94, &end
#
# 7 LEU QQD 11 GLU HA 5.44
&rst
ixpk= 0, nxpk= 0, iat= 82, 155, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94, &end
#
# 7 LEU QQD 11 GLU QB 5.28
&rst
ixpk= 0, nxpk= 0, iat= 82, -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr2= 157, 158,
&end
#
# 7 LEU QQD 11 GLU QG 4.85
&rst
ixpk= 0, nxpk= 0, iat= 82, -1, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
igr2= 160, 161,
&end
#
# 7 LEU QQD 22 LYS HA 5.44
&rst
ixpk= 0, nxpk= 0, iat= 82, 316, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94, &end
#
# 7 LEU QQD 22 LYS QB 5.44
&rst
ixpk= 0, nxpk= 0, iat= 82, -1, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
igr2= 318, 319,
&end
#
# 7 LEU QQD 22 LYS QD 5.44
&rst
ixpk= 0, nxpk= 0, iat= 82, -1, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
igr2= 324, 325,
&end
#
# 7 LEU QQD 23 CYX HN 5.44
&rst
ixpk= 0, nxpk= 0, iat= 82, 336, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94, &end
#
# 7 LEU QQD 23 CYX QB 5.28
&rst
ixpk= 0, nxpk= 0, iat= 82, -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr2= 340, 341,
&end
#
# 7 LEU QQD 24 ILE HN 5.44
&rst
ixpk= 0, nxpk= 0, iat= 82, 346, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94, &end
#
# 8 ARG HA 10 CYX QB 5.34
&rst
ixpk= 0, nxpk= 0, iat= 97, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2= 147, 148,
&end
#
# 8 ARG HA 11 GLU QB 5.34
&rst
ixpk= 0, nxpk= 0, iat= 97, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2= 157, 158,
&end
#
# 8 ARG QB 9 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= 99, 100,
igr2= 129, 130,
&end
#
# 8 ARG QB 11 GLU QB 5.18
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.53, r4= 7.03,
igr1= 99, 100,
igr2= 157, 158,
&end
#
# 8 ARG QG 11 GLU QB 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1= 102, 103,
igr2= 157, 158,
&end
#
# 8 ARG QD 9 ARG QB 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1= 105, 106,
igr2= 123, 124,
&end
#
# 9 ARG HN 10 CYX QB 5.34
&rst
ixpk= 0, nxpk= 0, iat= 119, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2= 147, 148,
&end
#
# 9 ARG HA 12 LEU QQD 5.44
&rst
ixpk= 0, nxpk= 0, iat= 121, 174, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94, &end
#
# 9 ARG QG 12 LEU QQD 5.44
&rst
ixpk= 0, nxpk= 0, iat= -1, 174, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
igr1= 126, 127,
&end
#
# 10 CYX HA 28 CYX QB 5.34
&rst
ixpk= 0, nxpk= 0, iat= 145, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2= 406, 407,
&end
#
# 10 CYX QB 12 LEU HN 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, 168, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1= 147, 148,
&end
#
# 10 CYX QB 14 CYX QB 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1= 147, 148,
igr2= 202, 203,
&end
#
# 10 CYX QB 28 CYX HA 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, 404, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1= 147, 148,
&end
#
# 10 CYX QB 28 CYX QB 5.18
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.53, r4= 7.03,
igr1= 147, 148,
igr2= 406, 407,
&end
#
# 11 GLU HA 21 GLY QA 5.34
&rst
ixpk= 0, nxpk= 0, iat= 155, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2= 309, 310,
&end
#
# 11 GLU QB 12 LEU QQD 5.28
&rst
ixpk= 0, nxpk= 0, iat= -1, 174, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr1= 157, 158,
&end
#
# 11 GLU QB 13 SER HN 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, 187, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1= 157, 158,
&end
#
# 11 GLU QB 20 LEU QQD 5.28
&rst
ixpk= 0, nxpk= 0, iat= -1, 294, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr1= 157, 158,
&end
#
# 11 GLU QB 21 GLY HN 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, 307, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1= 157, 158,
&end
#
# 11 GLU QB 21 GLY QA 5.18
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.53, r4= 7.03,
igr1= 157, 158,
igr2= 309, 310,
&end
#
# 11 GLU QG 20 LEU QB 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1= 160, 161,
igr2= 292, 293,
&end
#
# 11 GLU QG 20 LEU QQD 4.76
&rst
ixpk= 0, nxpk= 0, iat= -1, 294, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr1= 160, 161,
&end
#
# 12 LEU HN 12 LEU QQD 5.44
&rst
ixpk= 0, nxpk= 0, iat= 168, 174, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94, &end
#
# 12 LEU QQD 13 SER HN 5.44
&rst
ixpk= 0, nxpk= 0, iat= 174, 187, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94, &end
#
# 12 LEU QQD 15 ARG HN 5.44
&rst
ixpk= 0, nxpk= 0, iat= 174, 208, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94, &end
#
# 12 LEU QQD 15 ARG QG 5.44
&rst
ixpk= 0, nxpk= 0, iat= 174, -1, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
igr2= 215, 216,
&end
#
# 12 LEU QQD 15 ARG QD 5.44
&rst
ixpk= 0, nxpk= 0, iat= 174, -1, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
igr2= 218, 219,
&end
#
# 12 LEU QQD 15 ARG HE 5.44
&rst
ixpk= 0, nxpk= 0, iat= 174, 221, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94, &end
#
# 14 CYX HA 17 LEU QQD 5.44
&rst
ixpk= 0, nxpk= 0, iat= 200, 249, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94, &end
#
# 14 CYX QB 17 LEU QQD 5.44
&rst
ixpk= 0, nxpk= 0, iat= -1, 249, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
igr1= 202, 203,
&end
#
# 14 CYX QB 19 LEU QQD 5.44
&rst
ixpk= 0, nxpk= 0, iat= -1, 275, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
igr1= 202, 203,
&end
#
# 14 CYX QB 20 LEU QQD 5.44
&rst
ixpk= 0, nxpk= 0, iat= -1, 294, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
igr1= 202, 203,
&end
#
# 14 CYX QB 21 GLY QA 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1= 202, 203,
igr2= 309, 310,
&end
#
# 15 ARG HB2 17 LEU QQD 5.44
&rst
ixpk= 0, nxpk= 0, iat= 212, 249, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94, &end
#
# 16 SER QB 17 LEU QQD 5.44
&rst
ixpk= 0, nxpk= 0, iat= -1, 249, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
igr1= 236, 237,
&end
#
# 17 LEU HN 19 LEU QQD 5.44
&rst
ixpk= 0, nxpk= 0, iat= 243, 275, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94, &end
#
# 17 LEU HA 19 LEU QQD 5.44
&rst
ixpk= 0, nxpk= 0, iat= 245, 275, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94, &end
#
# 17 LEU QB 19 LEU QQD 5.44
&rst
ixpk= 0, nxpk= 0, iat= -1, 275, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
igr1= 247, 248,
&end
#
# 17 LEU HG 19 LEU QQD 5.44
&rst
ixpk= 0, nxpk= 0, iat= 250, 275, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94, &end
#
# 17 LEU QQD 19 LEU HG 5.44
&rst
ixpk= 0, nxpk= 0, iat= 249, 276, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94, &end
#
# 17 LEU QQD 19 LEU QQD 4.85
&rst
ixpk= 0, nxpk= 0, iat= 249, 275, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35, &end
#
# 18 GLY HN 19 LEU QQD 5.44
&rst
ixpk= 0, nxpk= 0, iat= 262, 275, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94, &end
#
# 18 GLY QA 19 LEU QQD 5.28
&rst
ixpk= 0, nxpk= 0, iat= -1, 275, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr1= 264, 265,
&end
#
# 19 LEU HN 19 LEU QQD 5.44
&rst
ixpk= 0, nxpk= 0, iat= 269, 275, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94, &end
#
# 19 LEU QB 33 TYR QB 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1= 273, 274,
igr2= 478, 479,
&end
#
# 19 LEU QQD 30 CYX HB2 5.44
&rst
ixpk= 0, nxpk= 0, iat= 275, 438, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94, &end
#
# 19 LEU QQD 30 CYX HB3 5.44
&rst
ixpk= 0, nxpk= 0, iat= 275, 439, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94, &end
#
# 19 LEU QQD 32 PRO QG 5.44
&rst
ixpk= 0, nxpk= 0, iat= 275, -1, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
igr2= 464, 465,
&end
#
# 19 LEU QQD 32 PRO QD 5.28
&rst
ixpk= 0, nxpk= 0, iat= 275, -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr2= 461, 462,
&end
#
# 19 LEU QQD 33 TYR HN 5.44
&rst
ixpk= 0, nxpk= 0, iat= 275, 474, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94, &end
#
# 20 LEU HN 31 VAL QQG 5.44
&rst
ixpk= 0, nxpk= 0, iat= 288, 447, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94, &end
#
# 20 LEU QB 33 TYR QB 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1= 292, 293,
igr2= 478, 479,
&end
#
# 20 LEU QQD 22 LYS HN 5.44
&rst
ixpk= 0, nxpk= 0, iat= 294, 314, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94, &end
#
# 20 LEU QQD 22 LYS QE 5.44
&rst
ixpk= 0, nxpk= 0, iat= 294, -1, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
igr2= 327, 328,
&end
#
# 20 LEU QQD 30 CYX HA 5.44
&rst
ixpk= 0, nxpk= 0, iat= 294, 436, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94, &end
#
# 20 LEU QQD 33 TYR HN 5.44
&rst
ixpk= 0, nxpk= 0, iat= 294, 474, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94, &end
#
# 20 LEU QQD 33 TYR HA 5.44
&rst
ixpk= 0, nxpk= 0, iat= 294, 476, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94, &end
#
# 21 GLY QA 29 LYS HN 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, 412, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1= 309, 310,
&end
#
# 21 GLY QA 30 CYX HA 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, 436, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1= 309, 310,
&end
#
# 22 LYS HN 29 LYS QB 5.34
&rst
ixpk= 0, nxpk= 0, iat= 314, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2= 416, 417,
&end
#
# 22 LYS HN 31 VAL QQG 5.44
&rst
ixpk= 0, nxpk= 0, iat= 314, 447, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94, &end
#
# 22 LYS HA 23 CYX QB 5.34
&rst
ixpk= 0, nxpk= 0, iat= 316, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2= 340, 341,
&end
#
# 23 CYX HA 28 CYX QB 5.34
&rst
ixpk= 0, nxpk= 0, iat= 338, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2= 406, 407,
&end
#
# 23 CYX QB 27 GLU HN 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, 387, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1= 340, 341,
&end
#
# 24 ILE HA 25 GLY QA 5.34
&rst
ixpk= 0, nxpk= 0, iat= 348, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2= 367, 368,
&end
#
# 24 ILE QG2 25 GLY QA 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.20, r4= 7.70,
igr1= 352, 353, 354,
igr2= 367, 368,
&end
#
# 24 ILE HG13 29 LYS QB 5.34
&rst
ixpk= 0, nxpk= 0, iat= 357, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2= 416, 417,
&end
#
# 24 ILE QD1 29 LYS QB 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.20, r4= 7.70,
igr1= 359, 360, 361,
igr2= 416, 417,
&end
#
# 28 CYX HA 29 LYS QB 5.34
&rst
ixpk= 0, nxpk= 0, iat= 404, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr2= 416, 417,
&end
#
# 29 LYS QB 29 LYS QE 5.34
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1= 416, 417,
igr2= 425, 426,
&end
#
# 29 LYS QB 31 VAL QQG 5.28
&rst
ixpk= 0, nxpk= 0, iat= -1, 447, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr1= 416, 417,
&end
#
# 29 LYS QD 31 VAL QQG 5.44
&rst
ixpk= 0, nxpk= 0, iat= -1, 447, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
igr1= 422, 423,
&end
#
# 29 LYS QE 31 VAL QQG 5.44
&rst
ixpk= 0, nxpk= 0, iat= -1, 447, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
igr1= 425, 426,
&end
#
# 30 CYX HA 31 VAL QQG 5.44
&rst
ixpk= 0, nxpk= 0, iat= 436, 447, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94, &end
#
# 30 CYX HB3 31 VAL QQG 5.44
&rst
ixpk= 0, nxpk= 0, iat= 439, 447, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94, &end
#
# 31 VAL HN 32 PRO QD 5.35
&rst
ixpk= 0, nxpk= 0, iat= 444, -1, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51,
igr2= 461, 462,
&end
#
# 31 VAL QQG 32 PRO QG 5.44
&rst
ixpk= 0, nxpk= 0, iat= 447, -1, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
igr2= 464, 465,
&end
#
# 31 VAL QQG 33 TYR HN 5.44
&rst
ixpk= 0, nxpk= 0, iat= 447, 474, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94, &end
#
# 31 VAL QQG 33 TYR HA 5.44
&rst
ixpk= 0, nxpk= 0, iat= 447, 476, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94, &end
#
# 31 VAL QQG 33 TYR QD 5.44
&rst
ixpk= 0, nxpk= 0, iat= 447, -1, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
igr2= 482, 491,
&end
#
# 31 VAL QQG 33 TYR QE 5.44
&rst
ixpk= 0, nxpk= 0, iat= 447, -1, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
igr2= 484, 491,
&end
#
# 32 PRO QD 33 TYR HN 4.96
&rst
ixpk= 0, nxpk= 0, iat= -1, 474, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
igr1= 461, 462,
&end
# 494 atoms read from pdb file tam.amb.pdb.