NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
656049 |
6y3l   |
28016 | cing | 1-original | 1 | AMBER | distance | NOE | simple |
# Restraints file 1: Cora10404_2.rst
#
# 2 VAL H 2 VAL QQG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 11, 14, r1= 1.35, r2= 1.85, r3= 7.20, r4= 7.70,
rk2=150.0, rk3=150.0, ir6=1, ialtd=0,
/
#
# 2 VAL QQG 2 VAL HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 14, 13, r1= 1.35, r2= 1.85, r3= 7.20, r4= 7.70, /
#
# 2 VAL QG1 4 SER H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 47, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr1= 17, 18, 19,
/
#
# 2 VAL QG1 120 LYS HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1826, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1= 17, 18, 19,
/
#
# 2 VAL QG1 120 LYS QD 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.74, r4= 7.24,
igr1= 17, 18, 19,
igr2=1834,1835,
/
#
# 2 VAL HA 123 THR QG2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 13, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=1890,1891,1892,
/
#
# 3 PHE H 2 VAL HA 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 27, 13, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 3 PHE H 2 VAL QG1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 27, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2= 17, 18, 19,
/
#
# 3 PHE H 2 VAL QQG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 27, 14, r1= 1.35, r2= 1.85, r3= 8.20, r4= 8.70, /
#
# 3 PHE H 2 VAL HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 27, 13, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 3 PHE H 3 PHE QD 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 27, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2= 35, 43,
/
#
# 3 PHE H 3 PHE HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 27, 29, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 3 PHE H 3 PHE 1HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 27, 31, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 3 PHE H 3 PHE 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 27, 32, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 3 PHE 1HB 3 PHE 2HB 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= 31, 32, r1= 1.35, r2= 1.85, r3= 2.80, r4= 3.30, /
#
# 3 PHE 1HB 3 PHE 2HB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 31, 32, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 3 PHE HA 3 PHE 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 29, 32, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 3 PHE QD 3 PHE 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 32, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr1= 35, 43,
/
#
# 3 PHE HA 4 SER H 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 29, 47, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 3 PHE HA 4 SER H 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= 29, 47, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 3 PHE H 121 TYR H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 27,1846, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 3 PHE H 121 TYR HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= 27,1848, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 3 PHE H 122 HIS HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 27,1869, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 3 PHE QD 129 ILE QD1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.09, r4= 8.59,
igr1= 35, 43,
igr2=1975,1976,1977,
/
#
# 3 PHE HA 129 ILE QG2 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= 29, -1, r1= 1.35, r2= 1.85, r3= 7.81, r4= 8.31,
igr2=1968,1969,1970,
/
#
# 3 PHE 1HB 129 ILE QD1 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= 31, -1, r1= 1.35, r2= 1.85, r3= 7.81, r4= 8.31,
igr2=1975,1976,1977,
/
#
# 3 PHE 1HB 134 ILE HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 31,2042, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 3 PHE 2HB 134 ILE HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 32,2042, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 4 SER H 4 SER HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 47, 49, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 4 SER H 4 SER QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 47, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2= 51, 52,
/
#
# 4 SER HA 4 SER QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 49, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2= 51, 52,
/
#
# 4 SER HA 4 SER QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 49, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2= 51, 52,
/
#
# 4 SER 2HB 5 TYR HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= 52, 60, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 4 SER QB 120 LYS QE 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 7.56, r4= 8.06,
igr1= 51, 52,
igr2=1837,1838,
/
#
# 4 SER QB 120 LYS QG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 7.56, r4= 8.06,
igr1= 51, 52,
igr2=1831,1832,
/
#
# 5 TYR H 4 SER H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 58, 47, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 5 TYR H 4 SER HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 58, 49, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 5 TYR H 4 SER QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 58, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2= 51, 52,
/
#
# 5 TYR H 4 SER HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 58, 49, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 121 TYR H 4 SER HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1846, 49, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 5 TYR H 5 TYR QD 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= 58, -1, r1= 1.35, r2= 1.85, r3= 7.30, r4= 7.80,
igr2= 66, 75,
/
#
# 5 TYR H 5 TYR HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 58, 60, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 5 TYR H 5 TYR 1HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 58, 62, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 5 TYR H 5 TYR 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 58, 63, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 5 TYR HA 5 TYR 2HB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 60, 63, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 5 TYR H 5 TYR 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 58, 63, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 5 TYR HA 5 TYR 1HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 60, 62, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 5 TYR HA 5 TYR 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 60, 63, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 5 TYR 1HB 5 TYR 2HB 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= 62, 63, r1= 1.35, r2= 1.85, r3= 2.80, r4= 3.30, /
#
# 5 TYR QD 5 TYR HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 60, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr1= 66, 75,
/
#
# 5 TYR HA 5 TYR QE 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 60, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2= 68, 73,
/
#
# 5 TYR 1HB 5 TYR 2HB 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= 62, 63, r1= 1.35, r2= 1.85, r3= 2.80, r4= 3.30, /
#
# 5 TYR H 6 GLU H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 58, 79, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 5 TYR QD 6 GLU H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 79, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr1= 66, 75,
/
#
# 5 TYR HA 6 GLU H 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 60, 79, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 5 TYR 2HB 6 GLU H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 63, 79, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 5 TYR HA 6 GLU QG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 60, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2= 86, 87,
/
#
# 5 TYR HA 6 GLU HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 60, 81, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 5 TYR H 118 THR QG2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 58, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=1805,1806,1807,
/
#
# 119 SER H 118 THR QG2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1813, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=1805,1806,1807,
/
#
# 5 TYR HA 118 THR HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= 60,1801, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 5 TYR 2HB 138 LYS QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 63, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=2102,2103,
/
#
# 5 TYR 1HB 138 LYS 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 62,2103, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 5 TYR QD 142 ALA QB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.76, r4= 9.26,
igr1= 66, 75,
igr2=2171,2172,2173,
/
#
# 5 TYR QD 141 ALA QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.09, r4= 8.59,
igr1= 66, 75,
igr2=2161,2162,2163,
/
#
# 6 GLU H 6 GLU QG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 79, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2= 86, 87,
/
#
# 6 GLU H 6 GLU QB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 79, -1, r1= 1.35, r2= 1.85, r3= 3.37, r4= 3.87,
igr2= 83, 84,
/
#
# 6 GLU QB 6 GLU HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 81, r1= 1.35, r2= 1.85, r3= 7.30, r4= 7.80,
igr1= 83, 84,
/
#
# 6 GLU H 6 GLU QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 79, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2= 83, 84,
/
#
# 6 GLU QG 6 GLU HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 81, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr1= 86, 87,
/
#
# 6 GLU QG 6 GLU QB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.78, r4= 4.28,
igr1= 86, 87,
igr2= 83, 84,
/
#
# 6 GLU QG 6 GLU QB 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.53, r4= 4.03,
igr1= 86, 87,
igr2= 83, 84,
/
#
# 6 GLU H 6 GLU QG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 79, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2= 86, 87,
/
#
# 6 GLU HA 7 ASP QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 81, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2= 98, 99,
/
#
# 6 GLU QB 116 LYS QE 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.30, r4= 6.80,
igr1= 83, 84,
igr2=1771,1772,
/
#
# 6 GLU QG 116 LYS QE 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 7.56, r4= 8.06,
igr1= 86, 87,
igr2=1771,1772,
/
#
# 6 GLU QB 118 THR QG2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.74, r4= 7.24,
igr1= 83, 84,
igr2=1805,1806,1807,
/
#
# 6 GLU QB 118 THR HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1801, r1= 1.35, r2= 1.85, r3= 7.30, r4= 7.80,
igr1= 83, 84,
/
#
# 7 ASP H 6 GLU H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 94, 79, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 7 ASP H 6 GLU H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 94, 79, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 7 ASP H 6 GLU HA 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 94, 81, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 7 ASP H 6 GLU QG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 94, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2= 86, 87,
/
#
# 7 ASP H 6 GLU QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 94, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2= 83, 84,
/
#
# 7 ASP H 7 ASP QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 94, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2= 98, 99,
/
#
# 7 ASP QB 7 ASP HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 96, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr1= 98, 99,
/
#
# 7 ASP QB 7 ASP HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 96, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr1= 98, 99,
/
#
# 7 ASP H 8 GLU H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 94, 106, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 9 ALA H 8 GLU H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 121, 106, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 7 ASP QB 8 GLU H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 106, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr1= 98, 99,
/
#
# 7 ASP HA 8 GLU 2HG 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= 96, 114, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 8 GLU H 7 ASP HA 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= 106, 96, r1= 1.35, r2= 1.85, r3= 2.80, r4= 3.30, /
#
# 8 GLU H 7 ASP HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 106, 96, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 8 GLU H 8 GLU HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 106, 108, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 8 GLU H 8 GLU QB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 106, -1, r1= 1.35, r2= 1.85, r3= 3.37, r4= 3.87,
igr2= 110, 111,
/
#
# 8 GLU QB 8 GLU QG 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.53, r4= 4.03,
igr1= 110, 111,
igr2= 113, 114,
/
#
# 8 GLU HA 8 GLU QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 108, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2= 110, 111,
/
#
# 8 GLU QB 8 GLU QG 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.53, r4= 4.03,
igr1= 110, 111,
igr2= 113, 114,
/
#
# 8 GLU H 8 GLU QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 106, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2= 110, 111,
/
#
# 8 GLU HA 8 GLU QG 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= 108, -1, r1= 1.35, r2= 1.85, r3= 7.30, r4= 7.80,
igr2= 113, 114,
/
#
# 8 GLU HA 9 ALA HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 108, 123, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 8 GLU HA 9 ALA HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= 108, 123, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 8 GLU QB 114 ILE QG2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.09, r4= 8.59,
igr1= 110, 111,
igr2=1726,1727,1728,
/
#
# 8 GLU QB 114 ILE QG2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.74, r4= 7.24,
igr1= 110, 111,
igr2=1726,1727,1728,
/
#
# 8 GLU QB 116 LYS QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.30, r4= 6.80,
igr1= 110, 111,
igr2=1762,1763,
/
#
# 8 GLU QB 116 LYS HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1760, r1= 1.35, r2= 1.85, r3= 7.30, r4= 7.80,
igr1= 110, 111,
/
#
# 9 ALA H 8 GLU H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 121, 106, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 9 ALA H 8 GLU HA 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 121, 108, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 9 ALA H 8 GLU QG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 121, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2= 113, 114,
/
#
# 9 ALA H 8 GLU QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 121, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2= 110, 111,
/
#
# 9 ALA H 8 GLU HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 121, 108, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 117 ILE H 8 GLU HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1780, 108, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 9 ALA H 8 GLU QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 121, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2= 110, 111,
/
#
# 9 ALA H 8 GLU 1HG 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= 121, 113, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 9 ALA HA 8 GLU 1HG 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= 123, 113, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 9 ALA H 9 ALA HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 121, 123, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 9 ALA H 9 ALA QB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 121, -1, r1= 1.35, r2= 1.85, r3= 3.60, r4= 4.10,
igr2= 125, 126, 127,
/
#
# 9 ALA H 9 ALA HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= 121, 123, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 9 ALA H 9 ALA QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 121, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2= 125, 126, 127,
/
#
# 9 ALA HA 9 ALA QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 123, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2= 125, 126, 127,
/
#
# 9 ALA HA 10 THR QG2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 123, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2= 137, 138, 139,
/
#
# 9 ALA H 10 THR H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 121, 131, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 9 ALA QB 10 THR H 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= -1, 131, r1= 1.35, r2= 1.85, r3= 3.36, r4= 3.86,
igr1= 125, 126, 127,
/
#
# 10 THR H 10 THR QG2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 131, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2= 137, 138, 139,
/
#
# 9 ALA HA 10 THR H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 123, 131, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 9 ALA QB 10 THR H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 131, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr1= 125, 126, 127,
/
#
# 9 ALA H 115 LEU H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 121,1739, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 9 ALA H 115 LEU H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 121,1739, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 9 ALA H 115 LEU HG 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= 121,1746, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 116 LYS H 115 LEU HG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1758,1746, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 9 ALA QB 115 LEU QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.74, r4= 7.24,
igr1= 125, 126, 127,
igr2=1743,1744,
/
#
# 9 ALA QB 115 LEU QD1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1= 125, 126, 127,
igr2=1748,1749,1750,
/
#
# 9 ALA H 116 LYS HA 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 121,1760, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 9 ALA H 115 LEU HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 121,1741, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 9 ALA H 116 LYS HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 121,1760, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 116 LYS H 116 LYS HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1758,1760, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 9 ALA HA 149 GLU 1HG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 123,2278, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 9 ALA QB 149 GLU QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.74, r4= 7.24,
igr1= 125, 126, 127,
igr2=2275,2276,
/
#
# 9 ALA QB 152 LEU 2HB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2322, r1= 1.35, r2= 1.85, r3= 3.60, r4= 4.10,
igr1= 125, 126, 127,
/
#
# 9 ALA QB 153 LEU QD2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1= 125, 126, 127,
igr2=2349,2350,2351,
/
#
# 10 THR H 10 THR HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 131, 133, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 10 THR H 10 THR HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 131, 135, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 10 THR H 10 THR HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 131, 133, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 11 SER H 10 THR HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 145, 133, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 10 THR HA 10 THR HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 133, 135, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 10 THR HB 10 THR QG2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 135, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2= 137, 138, 139,
/
#
# 10 THR HB 10 THR QG2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 135, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2= 137, 138, 139,
/
#
# 10 THR HA 10 THR QG2 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= 133, -1, r1= 1.35, r2= 1.85, r3= 7.81, r4= 8.31,
igr2= 137, 138, 139,
/
#
# 10 THR HA 114 ILE QD1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 133, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=1733,1734,1735,
/
#
# 11 SER H 10 THR HA 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 145, 133, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 11 SER H 10 THR HB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 145, 135, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 11 SER H 10 THR QG2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 145, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2= 137, 138, 139,
/
#
# 11 SER H 10 THR QG2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 145, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2= 137, 138, 139,
/
#
# 10 THR H 10 THR QG2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 131, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2= 137, 138, 139,
/
#
# 11 SER H 10 THR HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 145, 135, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 10 THR H 10 THR HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 131, 135, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 11 SER H 11 SER HA 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 145, 147, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 11 SER H 11 SER 1HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 145, 149, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 11 SER H 11 SER 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 145, 150, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 11 SER 1HB 11 SER 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 149, 150, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 11 SER HA 11 SER 2HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 147, 150, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 11 SER HA 11 SER 1HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 147, 149, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 11 SER 1HB 11 SER 2HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 149, 150, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 11 SER HA 11 SER 1HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 147, 149, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 11 SER HA 12 VAL H 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 147, 156, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 11 SER 1HB 12 VAL H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 149, 156, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 11 SER HA 12 VAL HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 147, 158, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 11 SER HA 12 VAL HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= 147, 158, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 11 SER H 12 VAL HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 145, 158, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 11 SER 1HB 13 ILE H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 149, 172, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 13 ILE H 112 GLY 1HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 172,1704, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 11 SER 2HB 13 ILE H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 150, 172, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 11 SER 2HB 18 LEU QD2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 150, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2= 266, 267, 268,
/
#
# 11 SER 1HB 18 LEU QD2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 149, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2= 266, 267, 268,
/
#
# 11 SER H 112 GLY 2HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 145,1705, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 11 SER H 113 SER H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 145,1709, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 11 SER H 113 SER H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 145,1709, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 11 SER H 114 ILE HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 145,1722, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 11 SER H 114 ILE 1HG1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 145,1730, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 10 THR H 114 ILE 1HG1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 131,1730, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 11 SER HA 152 LEU QQD 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= 147,2323, r1= 1.35, r2= 1.85, r3= 8.70, r4= 9.20, /
#
# 12 VAL H 12 VAL HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 156, 158, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 12 VAL H 12 VAL HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 156, 160, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 12 VAL H 12 VAL QQG 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 156, 159, r1= 1.35, r2= 1.85, r3= 5.20, r4= 5.70, /
#
# 12 VAL HA 12 VAL HB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= 158, 160, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 12 VAL HA 12 VAL QQG 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= 158, 159, r1= 1.35, r2= 1.85, r3= 8.70, r4= 9.20, /
#
# 12 VAL H 12 VAL HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 156, 160, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 12 VAL HB 12 VAL QG2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 160, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2= 166, 167, 168,
/
#
# 12 VAL HA 12 VAL QG2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 158, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2= 166, 167, 168,
/
#
# 12 VAL H 13 ILE H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 156, 172, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 12 VAL H 13 ILE H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 156, 172, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 12 VAL HB 13 ILE HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 160, 174, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 12 VAL HA 12 VAL HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 158, 160, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 12 VAL HA 112 GLY 1HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 158,1704, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 13 ILE H 12 VAL HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 172, 158, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 13 ILE H 13 ILE HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 172, 174, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 13 ILE H 13 ILE HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 172, 176, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 13 ILE H 13 ILE QG2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 172, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2= 178, 179, 180,
/
#
# 13 ILE H 13 ILE QD1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 172, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2= 185, 186, 187,
/
#
# 13 ILE HA 13 ILE HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 174, 176, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 13 ILE HB 13 ILE QG2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 176, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2= 178, 179, 180,
/
#
# 13 ILE HA 13 ILE QG2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 174, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2= 178, 179, 180,
/
#
# 13 ILE QG2 13 ILE QD1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1= 178, 179, 180,
igr2= 185, 186, 187,
/
#
# 13 ILE H 13 ILE HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 172, 176, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 13 ILE HB 13 ILE QG2 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= 176, -1, r1= 1.35, r2= 1.85, r3= 7.81, r4= 8.31,
igr2= 178, 179, 180,
/
#
# 13 ILE H 13 ILE QG2 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= 172, -1, r1= 1.35, r2= 1.85, r3= 7.81, r4= 8.31,
igr2= 178, 179, 180,
/
#
# 13 ILE QG2 17 ARG QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.09, r4= 8.59,
igr1= 178, 179, 180,
igr2= 233, 234,
/
#
# 13 ILE QD1 17 ARG QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.09, r4= 8.59,
igr1= 185, 186, 187,
igr2= 233, 234,
/
#
# 13 ILE QD1 17 ARG QD 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.76, r4= 9.26,
igr1= 185, 186, 187,
igr2= 239, 240,
/
#
# 13 ILE QG2 17 ARG QG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.74, r4= 7.24,
igr1= 178, 179, 180,
igr2= 236, 237,
/
#
# 13 ILE QG2 17 ARG QG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.74, r4= 7.24,
igr1= 178, 179, 180,
igr2= 236, 237,
/
#
# 13 ILE QG2 17 ARG H 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 229, r1= 1.35, r2= 1.85, r3= 7.81, r4= 8.31,
igr1= 178, 179, 180,
/
#
# 13 ILE QG2 18 LEU H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 253, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr1= 178, 179, 180,
/
#
# 13 ILE HB 18 LEU QQD 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 176, 259, r1= 1.35, r2= 1.85, r3= 7.20, r4= 7.70, /
#
# 13 ILE QG2 18 LEU QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.74, r4= 7.24,
igr1= 178, 179, 180,
igr2= 257, 258,
/
#
# 13 ILE QG2 18 LEU HG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 260, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1= 178, 179, 180,
/
#
# 13 ILE QG2 18 LEU HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 255, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1= 178, 179, 180,
/
#
# 13 ILE QG2 18 LEU H 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 253, r1= 1.35, r2= 1.85, r3= 7.81, r4= 8.31,
igr1= 178, 179, 180,
/
#
# 13 ILE QG2 18 LEU QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.09, r4= 8.59,
igr1= 178, 179, 180,
igr2= 257, 258,
/
#
# 13 ILE QG2 18 LEU QQD 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 259, r1= 1.35, r2= 1.85, r3= 5.80, r4= 6.30,
igr1= 178, 179, 180,
/
#
# 13 ILE QG2 13 ILE QD1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.65, r4= 9.15,
igr1= 178, 179, 180,
igr2= 185, 186, 187,
/
#
# 13 ILE HB 18 LEU QQD 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 176, 259, r1= 1.35, r2= 1.85, r3= 8.20, r4= 8.70, /
#
# 13 ILE HB 13 ILE QD1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 176, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2= 185, 186, 187,
/
#
# 13 ILE H 112 GLY 2HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= 172,1705, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 13 ILE H 112 GLY 1HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 172,1704, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 15 PRO 1HB 15 PRO 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 212, 213, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 15 PRO 1HB 15 PRO 2HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 212, 213, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 15 PRO 2HB 15 PRO HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 213, 215, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 15 PRO QG 15 PRO HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 215, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr1= 209, 210,
/
#
# 15 PRO 2HB 15 PRO HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 213, 215, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 15 PRO 2HB 15 PRO QG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 213, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2= 209, 210,
/
#
# 15 PRO 1HB 15 PRO QG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 212, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2= 209, 210,
/
#
# 15 PRO 1HB 79 PHE QE 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 212, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1210,1214,
/
#
# 15 PRO 2HB 79 PHE QE 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 213, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1210,1214,
/
#
# 15 PRO QG 104 MET QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.30, r4= 6.80,
igr1= 209, 210,
igr2=1614,1615,
/
#
# 15 PRO 2HB 104 MET QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 213, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1614,1615,
/
#
# 105 ALA QB 104 MET QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.09, r4= 8.59,
igr1=1631,1632,1633,
igr2=1614,1615,
/
#
# 15 PRO QD 113 SER QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.30, r4= 6.80,
igr1= 206, 207,
igr2=1713,1714,
/
#
# 15 PRO QD 113 SER QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.30, r4= 6.80,
igr1= 206, 207,
igr2=1713,1714,
/
#
# 16 ALA H 15 PRO QD 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 219, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2= 206, 207,
/
#
# 16 ALA H 15 PRO 1HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 219, 212, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 16 ALA H 15 PRO QG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 219, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2= 209, 210,
/
#
# 16 ALA H 15 PRO 1HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 219, 212, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 16 ALA H 15 PRO 2HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 219, 213, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 16 ALA H 16 ALA HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 219, 221, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 16 ALA H 16 ALA QB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 219, -1, r1= 1.35, r2= 1.85, r3= 3.60, r4= 4.10,
igr2= 223, 224, 225,
/
#
# 16 ALA H 16 ALA QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 219, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2= 223, 224, 225,
/
#
# 16 ALA HA 16 ALA QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 221, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2= 223, 224, 225,
/
#
# 16 ALA HA 16 ALA QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 221, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2= 223, 224, 225,
/
#
# 16 ALA H 16 ALA HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 219, 221, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 16 ALA H 17 ARG H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 219, 229, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 16 ALA H 17 ARG H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 219, 229, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 16 ALA QB 17 ARG HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 231, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr1= 223, 224, 225,
/
#
# 16 ALA QB 79 PHE QE 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.74, r4= 7.24,
igr1= 223, 224, 225,
igr2=1210,1214,
/
#
# 16 ALA HA 79 PHE QE 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 221, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1210,1214,
/
#
# 17 ARG H 16 ALA QB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 229, -1, r1= 1.35, r2= 1.85, r3= 3.60, r4= 4.10,
igr2= 223, 224, 225,
/
#
# 17 ARG H 16 ALA QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 229, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2= 223, 224, 225,
/
#
# 17 ARG H 17 ARG HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 229, 231, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 17 ARG H 17 ARG QG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 229, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2= 236, 237,
/
#
# 17 ARG H 17 ARG QB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 229, -1, r1= 1.35, r2= 1.85, r3= 3.37, r4= 3.87,
igr2= 233, 234,
/
#
# 17 ARG QG 17 ARG QD 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.19, r4= 8.69,
igr1= 236, 237,
igr2= 239, 240,
/
#
# 17 ARG H 17 ARG QD 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= 229, -1, r1= 1.35, r2= 1.85, r3= 7.30, r4= 7.80,
igr2= 239, 240,
/
#
# 17 ARG QG 17 ARG QB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.78, r4= 4.28,
igr1= 236, 237,
igr2= 233, 234,
/
#
# 17 ARG QG 17 ARG QD 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.19, r4= 8.69,
igr1= 236, 237,
igr2= 239, 240,
/
#
# 17 ARG QG 17 ARG QB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.78, r4= 4.28,
igr1= 236, 237,
igr2= 233, 234,
/
#
# 17 ARG H 18 LEU H 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 229, 253, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 17 ARG H 18 LEU H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 229, 253, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 17 ARG HA 20 LYS QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 231, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2= 296, 297,
/
#
# 18 LEU H 17 ARG HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 253, 231, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 18 LEU H 17 ARG QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 253, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2= 233, 234,
/
#
# 18 LEU H 17 ARG QG 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= 253, -1, r1= 1.35, r2= 1.85, r3= 7.30, r4= 7.80,
igr2= 236, 237,
/
#
# 18 LEU H 17 ARG HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= 253, 231, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 18 LEU H 18 LEU HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 253, 255, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 18 LEU H 18 LEU QB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 253, -1, r1= 1.35, r2= 1.85, r3= 3.37, r4= 3.87,
igr2= 257, 258,
/
#
# 18 LEU H 18 LEU QQD 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 253, 259, r1= 1.35, r2= 1.85, r3= 7.20, r4= 7.70, /
#
# 18 LEU QB 18 LEU QQD 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 259, r1= 1.35, r2= 1.85, r3= 8.93, r4= 9.43,
igr1= 257, 258,
/
#
# 18 LEU HA 18 LEU QQD 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 255, 259, r1= 1.35, r2= 1.85, r3= 8.20, r4= 8.70, /
#
# 18 LEU QD2 15 PRO HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 215, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1= 266, 267, 268,
/
#
# 18 LEU H 18 LEU QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 253, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2= 257, 258,
/
#
# 18 LEU QB 18 LEU QQD 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 259, r1= 1.35, r2= 1.85, r3= 7.81, r4= 8.31,
igr1= 257, 258,
/
#
# 18 LEU HA 18 LEU QQD 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 255, 259, r1= 1.35, r2= 1.85, r3= 7.20, r4= 7.70, /
#
# 18 LEU HA 18 LEU QB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= 255, -1, r1= 1.35, r2= 1.85, r3= 7.30, r4= 7.80,
igr2= 257, 258,
/
#
# 18 LEU HA 18 LEU HG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 255, 260, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 18 LEU QB 19 PHE HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 274, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr1= 257, 258,
/
#
# 19 PHE HA 18 LEU HG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 274, 260, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 18 LEU HG 115 LEU QD1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 260, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=1748,1749,1750,
/
#
# 18 LEU HG 115 LEU QD2 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= 260, -1, r1= 1.35, r2= 1.85, r3= 7.81, r4= 8.31,
igr2=1752,1753,1754,
/
#
# 19 PHE H 18 LEU H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 272, 253, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 19 PHE H 18 LEU H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 272, 253, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 19 PHE H 18 LEU HA 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 272, 255, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 19 PHE H 19 PHE HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 272, 274, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 19 PHE H 15 PRO HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 272, 215, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 19 PHE H 18 LEU HG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 272, 260, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 19 PHE H 18 LEU QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 272, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2= 257, 258,
/
#
# 19 PHE H 19 PHE 1HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 272, 276, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 19 PHE H 19 PHE 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 272, 277, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 121 TYR H 3 PHE 2HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1846, 32, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 19 PHE 1HB 19 PHE 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 276, 277, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 19 PHE H 19 PHE 1HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 272, 276, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 19 PHE HA 19 PHE 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 274, 277, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 19 PHE 1HB 19 PHE 2HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 276, 277, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 19 PHE H 19 PHE 2HB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= 272, 277, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 19 PHE H 20 LYS H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 272, 292, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 19 PHE H 20 LYS H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 272, 292, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 19 PHE HA 22 PHE QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 274, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2= 329, 330,
/
#
# 19 PHE HA 22 PHE QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 274, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2= 329, 330,
/
#
# 19 PHE HA 19 PHE 2HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 274, 277, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 19 PHE H 22 PHE QB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= 272, -1, r1= 1.35, r2= 1.85, r3= 7.30, r4= 7.80,
igr2= 329, 330,
/
#
# 19 PHE HA 23 VAL QG2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 274, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2= 355, 356, 357,
/
#
# 20 LYS HA 23 VAL QG2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 294, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2= 355, 356, 357,
/
#
# 20 LYS H 18 LEU H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 292, 253, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 20 LYS H 19 PHE HA 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 292, 274, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 20 LYS H 20 LYS HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 292, 294, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 20 LYS H 19 PHE 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 292, 277, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 20 LYS H 19 PHE 1HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 292, 276, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 20 LYS H 20 LYS QB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 292, -1, r1= 1.35, r2= 1.85, r3= 3.37, r4= 3.87,
igr2= 296, 297,
/
#
# 20 LYS H 20 LYS QD 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 292, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2= 302, 303,
/
#
# 20 LYS H 20 LYS QG 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 292, -1, r1= 1.35, r2= 1.85, r3= 3.37, r4= 3.87,
igr2= 299, 300,
/
#
# 20 LYS QG 20 LYS QE 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.30, r4= 6.80,
igr1= 299, 300,
igr2= 305, 306,
/
#
# 20 LYS QD 20 LYS QG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.30, r4= 6.80,
igr1= 302, 303,
igr2= 299, 300,
/
#
# 20 LYS QB 20 LYS QG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 7.56, r4= 8.06,
igr1= 296, 297,
igr2= 299, 300,
/
#
# 20 LYS QG 20 LYS QE 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.78, r4= 4.28,
igr1= 299, 300,
igr2= 305, 306,
/
#
# 20 LYS QD 20 LYS QE 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.30, r4= 6.80,
igr1= 302, 303,
igr2= 305, 306,
/
#
# 20 LYS QD 20 LYS QG 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.53, r4= 4.03,
igr1= 302, 303,
igr2= 299, 300,
/
#
# 20 LYS QD 20 LYS QE 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.19, r4= 8.69,
igr1= 302, 303,
igr2= 305, 306,
/
#
# 20 LYS H 20 LYS QB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= 292, -1, r1= 1.35, r2= 1.85, r3= 7.30, r4= 7.80,
igr2= 296, 297,
/
#
# 20 LYS H 20 LYS QG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 292, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2= 299, 300,
/
#
# 20 LYS HA 20 LYS QG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 294, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2= 299, 300,
/
#
# 20 LYS HA 20 LYS QD 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 294, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2= 302, 303,
/
#
# 20 LYS QB 20 LYS HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 294, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr1= 296, 297,
/
#
# 20 LYS H 21 SER H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 292, 314, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 20 LYS H 21 SER H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 292, 314, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 20 LYS HA 24 LEU HG 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= 294, 368, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 20 LYS QG 24 LEU 1HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 365, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr1= 299, 300,
/
#
# 20 LYS QB 24 LEU QD1 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.76, r4= 9.26,
igr1= 296, 297,
igr2= 370, 371, 372,
/
#
# 20 LYS HA 24 LEU HG 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= 294, 368, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 20 LYS QG 24 LEU HG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 368, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr1= 299, 300,
/
#
# 20 LYS H 79 PHE QE 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 292, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1210,1214,
/
#
# 21 SER H 18 LEU QD1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 314, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2= 262, 263, 264,
/
#
# 21 SER H 20 LYS HA 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 314, 294, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 21 SER H 18 LEU HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 314, 255, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 21 SER H 20 LYS QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 314, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2= 296, 297,
/
#
# 21 SER H 20 LYS HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 314, 294, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 21 SER H 21 SER QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 314, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2= 318, 319,
/
#
# 21 SER H 22 PHE H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 314, 325, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 21 SER H 22 PHE H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 314, 325, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 21 SER 2HB 25 ASP 1HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 319, 384, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 21 SER 2HB 25 ASP 2HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 319, 385, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 22 PHE H 18 LEU HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 325, 255, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 22 PHE H 19 PHE HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 325, 274, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 22 PHE H 18 LEU QD1 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 325, -1, r1= 1.35, r2= 1.85, r3= 3.60, r4= 4.10,
igr2= 262, 263, 264,
/
#
# 22 PHE H 18 LEU HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= 325, 255, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 22 PHE H 22 PHE QB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 325, -1, r1= 1.35, r2= 1.85, r3= 3.37, r4= 3.87,
igr2= 329, 330,
/
#
# 22 PHE QB 22 PHE QE 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 7.56, r4= 8.06,
igr1= 329, 330,
igr2= 335, 339,
/
#
# 21 SER H 22 PHE QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 314, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2= 329, 330,
/
#
# 22 PHE QB 22 PHE QD 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.30, r4= 6.80,
igr1= 329, 330,
igr2= 333, 341,
/
#
# 22 PHE H 22 PHE QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 325, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2= 329, 330,
/
#
# 22 PHE QD 26 ALA H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 392, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr1= 333, 341,
/
#
# 22 PHE QD 102 ILE HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1573, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr1= 333, 341,
/
#
# 22 PHE QD 152 LEU QQD 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2323, r1= 1.35, r2= 1.85, r3= 8.93, r4= 9.43,
igr1= 333, 341,
/
#
# 23 VAL H 22 PHE QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 345, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2= 329, 330,
/
#
# 23 VAL HA 22 PHE QE 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 347, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2= 335, 339,
/
#
# 23 VAL QG2 22 PHE QD 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.76, r4= 9.26,
igr1= 355, 356, 357,
igr2= 333, 341,
/
#
# 23 VAL H 23 VAL HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 345, 347, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 23 VAL H 23 VAL QG1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 345, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2= 351, 352, 353,
/
#
# 23 VAL H 23 VAL QG2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 345, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2= 355, 356, 357,
/
#
# 23 VAL HA 23 VAL QG2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 347, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2= 355, 356, 357,
/
#
# 23 VAL H 23 VAL HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 345, 347, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 23 VAL QG1 23 VAL QG2 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 9.37, r4= 9.87,
igr1= 351, 352, 353,
igr2= 355, 356, 357,
/
#
# 23 VAL QG1 23 VAL QG2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.65, r4= 9.15,
igr1= 351, 352, 353,
igr2= 355, 356, 357,
/
#
# 23 VAL QG2 24 LEU QD2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.65, r4= 9.15,
igr1= 355, 356, 357,
igr2= 374, 375, 376,
/
#
# 23 VAL QG2 23 VAL HB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 349, r1= 1.35, r2= 1.85, r3= 7.81, r4= 8.31,
igr1= 355, 356, 357,
/
#
# 23 VAL QG2 74 ILE QG1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.09, r4= 8.59,
igr1= 355, 356, 357,
igr2=1138,1139,
/
#
# 23 VAL HA 23 VAL QG1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 347, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2= 351, 352, 353,
/
#
# 23 VAL HA 23 VAL QG2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 347, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2= 355, 356, 357,
/
#
# 23 VAL QG1 23 VAL HB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 349, r1= 1.35, r2= 1.85, r3= 7.81, r4= 8.31,
igr1= 351, 352, 353,
/
#
# 23 VAL H 24 LEU H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 345, 361, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 23 VAL H 24 LEU HG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 345, 368, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 23 VAL H 24 LEU H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 345, 361, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 23 VAL QG2 24 LEU HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 363, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1= 355, 356, 357,
/
#
# 23 VAL QG2 24 LEU QD2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1= 355, 356, 357,
igr2= 374, 375, 376,
/
#
# 23 VAL HA 25 ASP H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 347, 380, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 23 VAL QG1 25 ASP H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 380, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr1= 351, 352, 353,
/
#
# 25 ASP H 24 LEU QQD 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 380, 367, r1= 1.35, r2= 1.85, r3= 8.20, r4= 8.70, /
#
# 23 VAL QG1 26 ALA H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 392, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1= 351, 352, 353,
/
#
# 23 VAL QG1 26 ALA QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1= 351, 352, 353,
igr2= 396, 397, 398,
/
#
# 30 ILE QD1 26 ALA QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.65, r4= 9.15,
igr1= 460, 461, 462,
igr2= 396, 397, 398,
/
#
# 23 VAL QG1 74 ILE QG2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1= 351, 352, 353,
igr2=1134,1135,1136,
/
#
# 23 VAL QG1 74 ILE QD1 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 4.04, r4= 4.54,
igr1= 351, 352, 353,
igr2=1141,1142,1143,
/
#
# 23 VAL QG2 74 ILE QD1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1= 355, 356, 357,
igr2=1141,1142,1143,
/
#
# 23 VAL QG2 74 ILE QG2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1= 355, 356, 357,
igr2=1134,1135,1136,
/
#
# 24 LEU HG 23 VAL QG2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 368, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2= 355, 356, 357,
/
#
# 23 VAL QG1 74 ILE QD1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1= 351, 352, 353,
igr2=1141,1142,1143,
/
#
# 23 VAL QG1 81 TYR QB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.76, r4= 9.26,
igr1= 351, 352, 353,
igr2=1246,1247,
/
#
# 23 VAL QG2 81 TYR QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.09, r4= 8.59,
igr1= 355, 356, 357,
igr2=1246,1247,
/
#
# 22 PHE 1HB 23 VAL QG2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 329, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2= 355, 356, 357,
/
#
# 23 VAL QG2 81 TYR HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1244, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1= 355, 356, 357,
/
#
# 23 VAL QG2 81 TYR QE 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.76, r4= 9.26,
igr1= 355, 356, 357,
igr2=1252,1257,
/
#
# 23 VAL H 23 VAL QG2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 345, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2= 355, 356, 357,
/
#
# 23 VAL QG2 81 TYR QD 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.09, r4= 8.59,
igr1= 355, 356, 357,
igr2=1250,1259,
/
#
# 24 LEU H 20 LYS HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 361, 294, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 24 LEU QD1 20 LYS QE 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.74, r4= 7.24,
igr1= 370, 371, 372,
igr2= 305, 306,
/
#
# 24 LEU 2HB 21 SER HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 366, 316, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 24 LEU H 23 VAL HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 361, 347, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 24 LEU H 23 VAL QG2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 361, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2= 355, 356, 357,
/
#
# 24 LEU HG 23 VAL HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 368, 349, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 74 ILE QG2 23 VAL HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 349, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1=1134,1135,1136,
/
#
# 24 LEU H 23 VAL HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 361, 347, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 24 LEU H 23 VAL QG1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 361, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2= 351, 352, 353,
/
#
# 24 LEU HG 23 VAL HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 368, 349, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 24 LEU HG 24 LEU 2HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 368, 366, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 24 LEU H 23 VAL QG2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 361, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2= 355, 356, 357,
/
#
# 24 LEU H 24 LEU 1HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 361, 365, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 24 LEU H 24 LEU 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 361, 366, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 24 LEU H 24 LEU HG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 361, 368, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 24 LEU H 24 LEU QQD 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 361, 367, r1= 1.35, r2= 1.85, r3= 7.20, r4= 7.70, /
#
# 24 LEU H 23 VAL QG1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 361, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2= 351, 352, 353,
/
#
# 24 LEU H 24 LEU HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= 361, 363, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 24 LEU 1HB 24 LEU HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 365, 363, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 24 LEU QQD 24 LEU HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 367, 363, r1= 1.35, r2= 1.85, r3= 8.20, r4= 8.70, /
#
# 24 LEU QQD 24 LEU HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 367, 363, r1= 1.35, r2= 1.85, r3= 8.20, r4= 8.70, /
#
# 23 VAL QG1 24 LEU HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 363, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1= 351, 352, 353,
/
#
# 24 LEU 1HB 24 LEU 2HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 365, 366, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 24 LEU HG 24 LEU 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 368, 366, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 24 LEU 2HB 24 LEU HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 366, 363, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 24 LEU HA 23 VAL HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 363, 349, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 24 LEU HG 24 LEU 1HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 368, 365, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 24 LEU 2HB 24 LEU QQD 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 366, 367, r1= 1.35, r2= 1.85, r3= 7.20, r4= 7.70, /
#
# 24 LEU 1HB 24 LEU QQD 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 365, 367, r1= 1.35, r2= 1.85, r3= 7.20, r4= 7.70, /
#
# 24 LEU 1HB 24 LEU 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 365, 366, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 24 LEU H 24 LEU 2HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 361, 366, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 24 LEU H 24 LEU 1HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 361, 365, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 24 LEU HG 23 VAL QG1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 368, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2= 351, 352, 353,
/
#
# 24 LEU H 25 ASP H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 361, 380, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 24 LEU H 25 ASP H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 361, 380, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 24 LEU HG 25 ASP H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 368, 380, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 24 LEU 2HB 26 ALA H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 366, 392, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 24 LEU HA 26 ALA QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 363, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2= 396, 397, 398,
/
#
# 25 ASP H 21 SER HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 380, 316, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 25 ASP H 24 LEU HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 380, 363, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 25 ASP H 24 LEU 1HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 380, 365, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 25 ASP H 24 LEU 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 380, 366, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 25 ASP HA 24 LEU HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= 382, 363, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 25 ASP H 25 ASP HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 380, 382, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 25 ASP H 25 ASP 1HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 380, 384, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 25 ASP H 25 ASP 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 380, 385, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 25 ASP HA 25 ASP 1HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 382, 384, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 25 ASP H 25 ASP 2HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 380, 385, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 25 ASP 2HB 28 ASN H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 385, 414, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 25 ASP HA 25 ASP 2HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 382, 385, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 25 ASP HA 25 ASP 2HB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= 382, 385, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 25 ASP H 25 ASP HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 380, 382, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 25 ASP HA 28 ASN H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 382, 414, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 25 ASP 1HB 25 ASP 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 384, 385, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 25 ASP H 26 ALA H 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 380, 392, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 25 ASP HA 27 ASP H 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= 382, 402, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 25 ASP 1HB 28 ASN 1HD2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 384, 423, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 28 ASN 1HD2 28 ASN QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 423, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2= 418, 419,
/
#
# 25 ASP 1HB 28 ASN 2HD2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 384, 424, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 28 ASN 2HD2 28 ASN QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 424, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2= 418, 419,
/
#
# 25 ASP 1HB 28 ASN H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 384, 414, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 25 ASP H 25 ASP 1HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 380, 384, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 25 ASP HA 28 ASN QB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= 382, -1, r1= 1.35, r2= 1.85, r3= 7.30, r4= 7.80,
igr2= 418, 419,
/
#
# 25 ASP HA 25 ASP 1HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 382, 384, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 25 ASP 2HB 28 ASN 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 385, 419, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 25 ASP 1HB 25 ASP 2HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 384, 385, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 26 ALA H 24 LEU HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 392, 363, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 26 ALA H 24 LEU HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 392, 363, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 26 ALA H 25 ASP HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 392, 382, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 26 ALA H 25 ASP 1HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 392, 384, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 26 ALA H 25 ASP 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 392, 385, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 26 ALA H 25 ASP 1HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 392, 384, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 26 ALA H 25 ASP 2HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 392, 385, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 26 ALA H 25 ASP HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 392, 382, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 26 ALA H 26 ALA QB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 392, -1, r1= 1.35, r2= 1.85, r3= 3.60, r4= 4.10,
igr2= 396, 397, 398,
/
#
# 26 ALA H 27 ASP H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 392, 402, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 26 ALA H 27 ASP H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 392, 402, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 26 ALA QB 27 ASP HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 404, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr1= 396, 397, 398,
/
#
# 26 ALA H 28 ASN H 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 392, 414, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 25 ASP H 26 ALA H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 380, 392, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 26 ALA QB 81 TYR QE 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.76, r4= 9.26,
igr1= 396, 397, 398,
igr2=1252,1257,
/
#
# 26 ALA H 26 ALA QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 392, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2= 396, 397, 398,
/
#
# 27 ASP H 26 ALA QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 402, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2= 396, 397, 398,
/
#
# 27 ASP H 26 ALA QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 402, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2= 396, 397, 398,
/
#
# 27 ASP H 27 ASP HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 402, 404, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 27 ASP H 27 ASP 1HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 402, 406, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 27 ASP H 27 ASP 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 402, 407, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 27 ASP HA 27 ASP 2HB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= 404, 407, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 27 ASP HA 27 ASP 1HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 404, 406, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 27 ASP HA 27 ASP 1HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 404, 406, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 27 ASP 1HB 27 ASP 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 406, 407, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 27 ASP 1HB 27 ASP 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 406, 407, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 27 ASP H 27 ASP 2HB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= 402, 407, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 27 ASP H 27 ASP HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= 402, 404, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 27 ASP H 28 ASN H 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 402, 414, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 27 ASP H 28 ASN H 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 402, 414, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 27 ASP H 29 LEU HG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 402, 435, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 27 ASP HA 41 ALA QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 404, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2= 625, 626, 627,
/
#
# 27 ASP 2HB 41 ALA QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 407, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2= 625, 626, 627,
/
#
# 28 ASN H 27 ASP HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 414, 404, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 28 ASN H 27 ASP 2HB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 414, 407, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 28 ASN H 27 ASP HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 414, 404, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 28 ASN H 28 ASN HA 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 414, 416, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 28 ASN H 28 ASN QB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 414, -1, r1= 1.35, r2= 1.85, r3= 3.37, r4= 3.87,
igr2= 418, 419,
/
#
# 78 ASN H 75 ASP 1HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1186,1151, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 78 ASN H 78 ASN 1HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1186,1190, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 28 ASN HA 28 ASN QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 416, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2= 418, 419,
/
#
# 28 ASN 2HD2 28 ASN QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 424, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2= 418, 419,
/
#
# 28 ASN H 28 ASN QB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= 414, -1, r1= 1.35, r2= 1.85, r3= 7.30, r4= 7.80,
igr2= 418, 419,
/
#
# 28 ASN 1HD2 28 ASN QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 423, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2= 418, 419,
/
#
# 28 ASN HA 28 ASN QB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= 416, -1, r1= 1.35, r2= 1.85, r3= 7.30, r4= 7.80,
igr2= 418, 419,
/
#
# 28 ASN 1HD2 28 ASN HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 423, 416, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 29 LEU H 28 ASN HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 428, 416, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 29 LEU QD1 22 PHE QE 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.09, r4= 8.59,
igr1= 437, 438, 439,
igr2= 335, 339,
/
#
# 29 LEU H 27 ASP HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 428, 404, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 29 LEU H 28 ASN H 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 428, 414, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 28 ASN H 28 ASN 1HD2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 414, 423, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 29 LEU H 28 ASN H 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 428, 414, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 29 LEU H 28 ASN QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 428, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2= 418, 419,
/
#
# 29 LEU H 29 LEU HG 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 428, 435, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 29 LEU H 29 LEU QQD 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 428, 434, r1= 1.35, r2= 1.85, r3= 7.20, r4= 7.70, /
#
# 29 LEU QQD 29 LEU HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 434, 430, r1= 1.35, r2= 1.85, r3= 8.20, r4= 8.70, /
#
# 29 LEU HA 29 LEU QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 430, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2= 432, 433,
/
#
# 29 LEU H 29 LEU QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 428, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2= 432, 433,
/
#
# 29 LEU H 29 LEU HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 428, 430, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 29 LEU QD2 29 LEU HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 430, r1= 1.35, r2= 1.85, r3= 7.81, r4= 8.31,
igr1= 441, 442, 443,
/
#
# 29 LEU QD2 151 TYR QD 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.09, r4= 8.59,
igr1= 441, 442, 443,
igr2=2304,2313,
/
#
# 30 ILE QD1 26 ALA QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.65, r4= 9.15,
igr1= 460, 461, 462,
igr2= 396, 397, 398,
/
#
# 30 ILE QD1 29 LEU QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.09, r4= 8.59,
igr1= 460, 461, 462,
igr2= 432, 433,
/
#
# 30 ILE QD1 27 ASP HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 404, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1= 460, 461, 462,
/
#
# 30 ILE H 29 LEU H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 447, 428, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 30 ILE H 30 ILE HA 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 447, 449, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 30 ILE H 30 ILE QD1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 447, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2= 460, 461, 462,
/
#
# 30 ILE H 30 ILE HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 447, 449, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 30 ILE H 32 LYS 1HG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 447, 487, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 31 PRO HA 31 PRO QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 476, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2= 473, 474,
/
#
# 31 PRO QG 31 PRO QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 7.56, r4= 8.06,
igr1= 470, 471,
igr2= 473, 474,
/
#
# 31 PRO QG 31 PRO QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 7.56, r4= 8.06,
igr1= 470, 471,
igr2= 473, 474,
/
#
# 32 LYS 1HG 29 LEU QD2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 487, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2= 441, 442, 443,
/
#
# 32 LYS 2HG 29 LEU HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 488, 430, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 32 LYS 1HG 29 LEU HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 487, 430, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 29 LEU HG 29 LEU HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 435, 430, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 32 LYS 1HG 29 LEU HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 487, 430, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 29 LEU HA 29 LEU QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 430, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2= 432, 433,
/
#
# 32 LYS 2HG 29 LEU QD2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 488, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2= 441, 442, 443,
/
#
# 32 LYS 2HG 29 LEU QD2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 488, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2= 441, 442, 443,
/
#
# 32 LYS QB 29 LEU HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 430, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr1= 484, 485,
/
#
# 32 LYS H 31 PRO QG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 480, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2= 470, 471,
/
#
# 32 LYS H 31 PRO QB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= 480, -1, r1= 1.35, r2= 1.85, r3= 7.30, r4= 7.80,
igr2= 473, 474,
/
#
# 32 LYS H 32 LYS HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 480, 482, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 32 LYS H 32 LYS 1HG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 480, 487, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 32 LYS QD 32 LYS QE 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.30, r4= 6.80,
igr1= 490, 491,
igr2= 493, 494,
/
#
# 32 LYS 1HG 32 LYS 2HG 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= 487, 488, r1= 1.35, r2= 1.85, r3= 2.80, r4= 3.30, /
#
# 32 LYS 2HG 32 LYS QE 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 488, -1, r1= 1.35, r2= 1.85, r3= 3.37, r4= 3.87,
igr2= 493, 494,
/
#
# 32 LYS 1HG 32 LYS QB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 487, -1, r1= 1.35, r2= 1.85, r3= 3.37, r4= 3.87,
igr2= 484, 485,
/
#
# 32 LYS 2HG 32 LYS QE 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 488, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2= 493, 494,
/
#
# 32 LYS HA 32 LYS QB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= 482, -1, r1= 1.35, r2= 1.85, r3= 7.30, r4= 7.80,
igr2= 484, 485,
/
#
# 32 LYS 2HG 32 LYS HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 488, 482, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 32 LYS 2HG 32 LYS QB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 488, -1, r1= 1.35, r2= 1.85, r3= 3.37, r4= 3.87,
igr2= 484, 485,
/
#
# 32 LYS 2HG 32 LYS QB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 488, -1, r1= 1.35, r2= 1.85, r3= 3.37, r4= 3.87,
igr2= 484, 485,
/
#
# 32 LYS 1HG 32 LYS QD 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= 487, -1, r1= 1.35, r2= 1.85, r3= 3.14, r4= 3.64,
igr2= 490, 491,
/
#
# 32 LYS 1HG 32 LYS HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 487, 482, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 32 LYS 1HG 32 LYS 2HG 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= 487, 488, r1= 1.35, r2= 1.85, r3= 2.80, r4= 3.30, /
#
# 32 LYS QD 32 LYS QE 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.53, r4= 4.03,
igr1= 490, 491,
igr2= 493, 494,
/
#
# 32 LYS 2HG 32 LYS QD 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= 488, -1, r1= 1.35, r2= 1.85, r3= 3.14, r4= 3.64,
igr2= 490, 491,
/
#
# 32 LYS 1HG 32 LYS QE 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 487, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2= 493, 494,
/
#
# 32 LYS H 32 LYS QB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= 480, -1, r1= 1.35, r2= 1.85, r3= 7.30, r4= 7.80,
igr2= 484, 485,
/
#
# 32 LYS 2HG 32 LYS QD 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= 488, -1, r1= 1.35, r2= 1.85, r3= 3.14, r4= 3.64,
igr2= 490, 491,
/
#
# 32 LYS QB 32 LYS QD 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.53, r4= 4.03,
igr1= 484, 485,
igr2= 490, 491,
/
#
# 32 LYS HA 32 LYS QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 482, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2= 484, 485,
/
#
# 32 LYS HA 32 LYS QD 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 482, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2= 490, 491,
/
#
# 32 LYS 1HG 32 LYS QE 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 487, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2= 493, 494,
/
#
# 32 LYS QB 32 LYS QE 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.78, r4= 4.28,
igr1= 484, 485,
igr2= 493, 494,
/
#
# 32 LYS H 32 LYS HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 480, 482, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 32 LYS H 33 VAL H 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 480, 502, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 32 LYS H 33 VAL H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 480, 502, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 32 LYS H 33 VAL QG2 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= 480, -1, r1= 1.35, r2= 1.85, r3= 7.81, r4= 8.31,
igr2= 512, 513, 514,
/
#
# 32 LYS H 33 VAL QG1 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= 480, -1, r1= 1.35, r2= 1.85, r3= 7.81, r4= 8.31,
igr2= 508, 509, 510,
/
#
# 32 LYS QB 151 TYR 2HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2301, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr1= 484, 485,
/
#
# 32 LYS HA 151 TYR QD 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 482, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=2304,2313,
/
#
# 33 VAL QG1 29 LEU QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.74, r4= 7.24,
igr1= 508, 509, 510,
igr2= 432, 433,
/
#
# 33 VAL H 30 ILE HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 502, 449, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 33 VAL QG2 30 ILE HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 449, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1= 512, 513, 514,
/
#
# 148 VAL HA 33 VAL QG2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2257, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2= 512, 513, 514,
/
#
# 33 VAL QG1 30 ILE HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 449, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1= 508, 509, 510,
/
#
# 33 VAL H 32 LYS QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 502, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2= 484, 485,
/
#
# 33 VAL H 32 LYS HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 502, 482, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 33 VAL H 33 VAL HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 502, 504, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 33 VAL H 33 VAL QG1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 502, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2= 508, 509, 510,
/
#
# 33 VAL QQG 33 VAL HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 505, 504, r1= 1.35, r2= 1.85, r3= 8.20, r4= 8.70, /
#
# 33 VAL H 33 VAL QG1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 502, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2= 508, 509, 510,
/
#
# 33 VAL QG1 33 VAL HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 504, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr1= 508, 509, 510,
/
#
# 33 VAL QG1 33 VAL HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 506, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr1= 508, 509, 510,
/
#
# 33 VAL H 33 VAL QG2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 502, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2= 512, 513, 514,
/
#
# 33 VAL H 33 VAL HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= 502, 504, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 33 VAL HA 33 VAL HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 504, 506, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 33 VAL QG2 33 VAL HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 504, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1= 512, 513, 514,
/
#
# 33 VAL QG2 33 VAL HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 506, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1= 512, 513, 514,
/
#
# 33 VAL HA 35 PRO QD 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 504, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2= 529, 530,
/
#
# 33 VAL QG1 151 TYR QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.09, r4= 8.59,
igr1= 508, 509, 510,
igr2=2300,2301,
/
#
# 35 PRO HA 31 PRO HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 538, 476, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 35 PRO 1HB 31 PRO HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 535, 476, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 35 PRO 2HB 31 PRO HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 536, 476, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 35 PRO QG 35 PRO 1HB 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= -1, 535, r1= 1.35, r2= 1.85, r3= 3.14, r4= 3.64,
igr1= 532, 533,
/
#
# 35 PRO HA 35 PRO 2HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 538, 536, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 35 PRO 1HB 35 PRO 2HB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 535, 536, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 35 PRO QG 35 PRO QD 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.30, r4= 6.80,
igr1= 532, 533,
igr2= 529, 530,
/
#
# 35 PRO QG 35 PRO 2HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 536, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr1= 532, 533,
/
#
# 35 PRO QG 35 PRO 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 536, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr1= 532, 533,
/
#
# 35 PRO QG 35 PRO 1HB 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= -1, 535, r1= 1.35, r2= 1.85, r3= 3.14, r4= 3.64,
igr1= 532, 533,
/
#
# 35 PRO QG 35 PRO HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 538, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr1= 532, 533,
/
#
# 35 PRO HA 35 PRO 1HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 538, 535, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 35 PRO 1HB 35 PRO 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 535, 536, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 35 PRO QG 36 GLN H 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 542, r1= 1.35, r2= 1.85, r3= 3.37, r4= 3.87,
igr1= 532, 533,
/
#
# 35 PRO QG 36 GLN H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 542, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr1= 532, 533,
/
#
# 36 GLN 1HE2 35 PRO QG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 554, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2= 532, 533,
/
#
# 36 GLN 2HE2 35 PRO QG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 555, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2= 532, 533,
/
#
# 36 GLN H 35 PRO HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 542, 538, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 36 GLN H 35 PRO 1HB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 542, 535, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 36 GLN 1HE2 36 GLN 2HE2 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= 554, 555, r1= 1.35, r2= 1.85, r3= 2.80, r4= 3.30, /
#
# 36 GLN 1HE2 36 GLN 2HE2 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 554, 555, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 36 GLN H 36 GLN QB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 542, -1, r1= 1.35, r2= 1.85, r3= 3.37, r4= 3.87,
igr2= 546, 547,
/
#
# 36 GLN HA 36 GLN QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 544, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2= 546, 547,
/
#
# 36 GLN HA 36 GLN QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 544, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2= 546, 547,
/
#
# 36 GLN H 36 GLN QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 542, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2= 546, 547,
/
#
# 39 THR QG2 64 PHE QD 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.09, r4= 8.59,
igr1= 602, 603, 604,
igr2= 949, 957,
/
#
# 40 SER H 39 THR QG2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 610, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2= 602, 603, 604,
/
#
# 40 SER H 40 SER HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 610, 612, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 40 SER H 40 SER QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 610, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2= 614, 615,
/
#
# 40 SER H 40 SER HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 610, 612, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 40 SER HA 40 SER QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 612, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2= 614, 615,
/
#
# 40 SER HA 41 ALA H 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 612, 621, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 40 SER QB 41 ALA H 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 621, r1= 1.35, r2= 1.85, r3= 3.37, r4= 3.87,
igr1= 614, 615,
/
#
# 40 SER HA 41 ALA QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 612, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2= 625, 626, 627,
/
#
# 40 SER H 57 THR QG2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 610, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2= 852, 853, 854,
/
#
# 41 ALA H 41 ALA HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 621, 623, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 41 ALA H 41 ALA QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 621, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2= 625, 626, 627,
/
#
# 41 ALA HA 41 ALA QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 623, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2= 625, 626, 627,
/
#
# 41 ALA HA 41 ALA QB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= 623, -1, r1= 1.35, r2= 1.85, r3= 7.81, r4= 8.31,
igr2= 625, 626, 627,
/
#
# 41 ALA H 41 ALA QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 621, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2= 625, 626, 627,
/
#
# 41 ALA H 41 ALA HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 621, 623, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 41 ALA QB 56 ILE QD1 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 9.37, r4= 9.87,
igr1= 625, 626, 627,
igr2= 840, 841, 842,
/
#
# 41 ALA QB 56 ILE QG2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1= 625, 626, 627,
igr2= 833, 834, 835,
/
#
# 41 ALA QB 56 ILE QD1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.65, r4= 9.15,
igr1= 625, 626, 627,
igr2= 840, 841, 842,
/
#
# 41 ALA HA 56 ILE HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 623, 829, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 42 GLU H 41 ALA HA 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 631, 623, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 42 GLU H 41 ALA QB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 631, -1, r1= 1.35, r2= 1.85, r3= 3.60, r4= 4.10,
igr2= 625, 626, 627,
/
#
# 42 GLU H 41 ALA QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 631, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2= 625, 626, 627,
/
#
# 42 GLU H 41 ALA HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 631, 623, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 42 GLU H 42 GLU QG 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 631, -1, r1= 1.35, r2= 1.85, r3= 3.37, r4= 3.87,
igr2= 638, 639,
/
#
# 42 GLU HA 42 GLU QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 633, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2= 635, 636,
/
#
# 42 GLU H 42 GLU QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 631, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2= 635, 636,
/
#
# 42 GLU H 42 GLU QG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 631, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2= 638, 639,
/
#
# 42 GLU HA 42 GLU QG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 633, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2= 638, 639,
/
#
# 42 GLU H 43 ASN HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 631, 648, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 42 GLU 1HB 44 LEU QD2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 635, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2= 673, 674, 675,
/
#
# 42 GLU H 55 LYS H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 631, 805, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 42 GLU H 55 LYS H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 631, 805, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 42 GLU H 56 ILE HA 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 631, 829, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 42 GLU H 42 GLU HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 631, 633, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 42 GLU H 56 ILE H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 631, 827, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 43 ASN H 42 GLU HA 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 646, 633, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 43 ASN H 42 GLU QG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 646, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2= 638, 639,
/
#
# 43 ASN H 42 GLU QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 646, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2= 635, 636,
/
#
# 43 ASN H 42 GLU QG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 646, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2= 638, 639,
/
#
# 43 ASN H 43 ASN HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 646, 648, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 43 ASN H 43 ASN 1HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 646, 650, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 43 ASN H 43 ASN 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 646, 651, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 43 ASN 1HD2 43 ASN 2HD2 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 655, 656, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 43 ASN 1HD2 43 ASN 2HD2 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 655, 656, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 43 ASN 1HB 43 ASN 1HD2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 650, 655, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 43 ASN 1HB 43 ASN 2HD2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 650, 656, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 43 ASN 2HB 43 ASN 1HD2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 651, 655, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 43 ASN 2HB 43 ASN 2HD2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 651, 656, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 43 ASN HA 43 ASN 1HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 648, 650, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 43 ASN 1HB 43 ASN 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 650, 651, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 43 ASN 1HB 43 ASN 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 650, 651, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 43 ASN HA 43 ASN 2HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 648, 651, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 43 ASN 1HB 43 ASN 1HD2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 650, 655, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 43 ASN HA 43 ASN 1HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 648, 650, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 43 ASN H 43 ASN 1HB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= 646, 650, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 43 ASN HA 44 LEU HG 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= 648, 667, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 44 LEU H 43 ASN H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 660, 646, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 44 LEU H 43 ASN HA 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 660, 648, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 44 LEU H 43 ASN 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 660, 651, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 44 LEU H 43 ASN 1HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 660, 650, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 44 LEU H 44 LEU HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 660, 662, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 44 LEU H 44 LEU QB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 660, -1, r1= 1.35, r2= 1.85, r3= 3.37, r4= 3.87,
igr2= 664, 665,
/
#
# 44 LEU H 44 LEU HG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 660, 667, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 44 LEU H 44 LEU QQD 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 660, 666, r1= 1.35, r2= 1.85, r3= 7.20, r4= 7.70, /
#
# 44 LEU HG 44 LEU QD1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 667, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2= 669, 670, 671,
/
#
# 44 LEU QB 44 LEU QD1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.09, r4= 8.59,
igr1= 664, 665,
igr2= 669, 670, 671,
/
#
# 44 LEU QB 44 LEU QQD 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 666, r1= 1.35, r2= 1.85, r3= 7.81, r4= 8.31,
igr1= 664, 665,
/
#
# 44 LEU HA 44 LEU QD1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 662, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2= 669, 670, 671,
/
#
# 44 LEU HA 44 LEU HG 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= 662, 667, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 44 LEU H 44 LEU QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 660, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2= 664, 665,
/
#
# 44 LEU H 44 LEU HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 660, 662, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 44 LEU HA 44 LEU QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 662, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2= 664, 665,
/
#
# 44 LEU HA 44 LEU QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 662, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2= 664, 665,
/
#
# 44 LEU HA 44 LEU HG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 662, 667, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 44 LEU H 45 GLU H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 660, 679, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 44 LEU H 45 GLU H 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 660, 679, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 44 LEU H 53 ILE H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 660, 764, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 44 LEU QB 53 ILE QG2 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 4.04, r4= 4.54,
igr1= 664, 665,
igr2= 770, 771, 772,
/
#
# 44 LEU QD1 53 ILE HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 768, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr1= 669, 670, 671,
/
#
# 44 LEU H 53 ILE QG2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 660, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2= 770, 771, 772,
/
#
# 44 LEU 2HB 53 ILE HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 665, 768, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 44 LEU QB 53 ILE HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 768, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr1= 664, 665,
/
#
# 44 LEU H 54 LYS HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 660, 785, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 44 LEU H 54 LYS H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 660, 783, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 44 LEU H 54 LYS HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 660, 785, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 55 LYS H 54 LYS HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 805, 785, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 44 LEU HG 55 LYS QB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 667, -1, r1= 1.35, r2= 1.85, r3= 3.37, r4= 3.87,
igr2= 809, 810,
/
#
# 44 LEU QQD 55 LYS QD 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 666, -1, r1= 1.35, r2= 1.85, r3= 7.81, r4= 8.31,
igr2= 815, 816,
/
#
# 44 LEU QD1 55 LYS QD 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.74, r4= 7.24,
igr1= 669, 670, 671,
igr2= 815, 816,
/
#
# 44 LEU QD2 55 LYS 2HD 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 816, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr1= 673, 674, 675,
/
#
# 44 LEU QD2 55 LYS 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 810, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr1= 673, 674, 675,
/
#
# 44 LEU QD1 55 LYS HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 807, r1= 1.35, r2= 1.85, r3= 7.81, r4= 8.31,
igr1= 669, 670, 671,
/
#
# 45 GLU H 43 ASN HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 679, 648, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 45 GLU H 44 LEU HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 679, 662, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 45 GLU H 44 LEU QB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 679, -1, r1= 1.35, r2= 1.85, r3= 3.37, r4= 3.87,
igr2= 664, 665,
/
#
# 45 GLU H 44 LEU HG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 679, 667, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 45 GLU H 44 LEU QQD 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 679, 666, r1= 1.35, r2= 1.85, r3= 7.20, r4= 7.70, /
#
# 45 GLU H 44 LEU QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 679, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2= 664, 665,
/
#
# 45 GLU H 45 GLU HA 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 679, 681, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 45 GLU H 45 GLU QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 679, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2= 683, 684,
/
#
# 45 GLU QB 45 GLU QG 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.53, r4= 4.03,
igr1= 683, 684,
igr2= 686, 687,
/
#
# 45 GLU HA 45 GLU QG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 681, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2= 686, 687,
/
#
# 45 GLU HA 45 GLU QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 681, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2= 683, 684,
/
#
# 45 GLU HA 46 GLY H 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= 681, 694, r1= 1.35, r2= 1.85, r3= 2.80, r4= 3.30, /
#
# 45 GLU HA 46 GLY H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 681, 694, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 45 GLU H 52 THR QG2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 679, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2= 756, 757, 758,
/
#
# 45 GLU H 53 ILE H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 679, 764, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 45 GLU H 53 ILE HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 679, 768, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 45 GLU H 53 ILE H 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= 679, 764, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 45 GLU QB 53 ILE QD1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.74, r4= 7.24,
igr1= 683, 684,
igr2= 777, 778, 779,
/
#
# 45 GLU QB 53 ILE QG2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.09, r4= 8.59,
igr1= 683, 684,
igr2= 770, 771, 772,
/
#
# 45 GLU QB 53 ILE HB 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= -1, 768, r1= 1.35, r2= 1.85, r3= 3.14, r4= 3.64,
igr1= 683, 684,
/
#
# 46 GLY H 45 GLU QG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 694, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2= 686, 687,
/
#
# 46 GLY H 45 GLU QG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 694, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2= 686, 687,
/
#
# 46 GLY H 46 GLY 1HA 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 694, 696, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 46 GLY H 46 GLY 2HA 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 694, 697, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 46 GLY 1HA 46 GLY 2HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 696, 697, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 46 GLY 2HA 52 THR HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 697, 752, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 46 GLY H 46 GLY 2HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= 694, 697, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 46 GLY 2HA 47 ASN H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 697, 701, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 46 GLY 1HA 47 ASN HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 696, 703, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 46 GLY 2HA 47 ASN H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 697, 701, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 46 GLY 1HA 47 ASN HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= 696, 703, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 47 ASN 1HD2 47 ASN 2HD2 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 710, 711, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 47 ASN 1HD2 47 ASN 2HD2 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= 710, 711, r1= 1.35, r2= 1.85, r3= 2.80, r4= 3.30, /
#
# 47 ASN 1HB 47 ASN 2HB 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= 705, 706, r1= 1.35, r2= 1.85, r3= 2.80, r4= 3.30, /
#
# 47 ASN HA 47 ASN 1HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 703, 705, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 47 ASN 1HB 47 ASN 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 705, 706, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 47 ASN H 52 THR HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 701, 752, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 46 GLY 1HA 47 ASN H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 696, 701, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 48 GLY H 47 ASN H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 715, 701, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 48 GLY H 47 ASN HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 715, 703, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 48 GLY H 48 GLY QA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 715, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2= 717, 718,
/
#
# 48 GLY H 48 GLY QA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 715, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2= 717, 718,
/
#
# 48 GLY H 49 GLY H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 715, 722, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 48 GLY H 52 THR HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 715, 752, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 46 GLY 1HA 48 GLY H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 696, 715, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 48 GLY H 52 THR HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 715, 754, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 48 GLY H 52 THR HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 715, 754, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 49 GLY H 49 GLY QA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= 722, -1, r1= 1.35, r2= 1.85, r3= 7.30, r4= 7.80,
igr2= 724, 725,
/
#
# 49 GLY H 52 THR HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 722, 754, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 50 PRO QD 49 GLY QA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.30, r4= 6.80,
igr1= 730, 731,
igr2= 724, 725,
/
#
# 50 PRO QG 49 GLY QA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 7.56, r4= 8.06,
igr1= 733, 734,
igr2= 724, 725,
/
#
# 50 PRO 2HB 50 PRO QD 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 737, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2= 730, 731,
/
#
# 50 PRO 1HB 50 PRO QD 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 736, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2= 730, 731,
/
#
# 50 PRO 2HB 50 PRO QG 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 737, -1, r1= 1.35, r2= 1.85, r3= 3.37, r4= 3.87,
igr2= 733, 734,
/
#
# 50 PRO 1HB 50 PRO 2HB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 736, 737, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 50 PRO 1HG 50 PRO QD 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 733, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2= 730, 731,
/
#
# 50 PRO QD 50 PRO 2HG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 734, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr1= 730, 731,
/
#
# 50 PRO 1HB 50 PRO QD 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 736, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2= 730, 731,
/
#
# 50 PRO 1HB 50 PRO 2HB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 736, 737, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 50 PRO 2HB 50 PRO QG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 737, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2= 733, 734,
/
#
# 51 GLY H 51 GLY 1HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 743, 745, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 51 GLY H 51 GLY 2HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 743, 746, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 51 GLY 1HA 51 GLY 2HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 745, 746, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 51 GLY 1HA 51 GLY 2HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 745, 746, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 51 GLY H 51 GLY 1HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 743, 745, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 51 GLY H 51 GLY 2HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 743, 746, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 51 GLY H 52 THR H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 743, 750, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 51 GLY H 52 THR H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 743, 750, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 51 GLY H 70 LYS QG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 743, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1067,1068,
/
#
# 51 GLY 1HA 70 LYS QE 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= 745, -1, r1= 1.35, r2= 1.85, r3= 7.30, r4= 7.80,
igr2=1073,1074,
/
#
# 51 GLY H 71 VAL HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 743,1086, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 51 GLY H 72 GLU HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 743,1100, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 52 THR QG2 46 GLY 1HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 696, r1= 1.35, r2= 1.85, r3= 7.81, r4= 8.31,
igr1= 756, 757, 758,
/
#
# 52 THR QG2 47 ASN H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 701, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr1= 756, 757, 758,
/
#
# 52 THR QG2 47 ASN HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 703, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1= 756, 757, 758,
/
#
# 52 THR QG2 48 GLY H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 715, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr1= 756, 757, 758,
/
#
# 52 THR QG2 48 GLY QA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.76, r4= 9.26,
igr1= 756, 757, 758,
igr2= 717, 718,
/
#
# 52 THR QG2 48 GLY H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 715, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1= 756, 757, 758,
/
#
# 52 THR H 51 GLY 1HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 750, 745, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 52 THR HA 52 THR H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 752, 750, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 52 THR H 51 GLY 2HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 750, 746, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 52 THR HB 52 THR H 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 754, 750, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 52 THR QG2 52 THR HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 754, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr1= 756, 757, 758,
/
#
# 52 THR QG2 52 THR H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 750, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1= 756, 757, 758,
/
#
# 52 THR QG2 52 THR HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 752, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr1= 756, 757, 758,
/
#
# 52 THR QG2 46 GLY 1HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 696, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1= 756, 757, 758,
/
#
# 52 THR QG2 52 THR HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 754, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr1= 756, 757, 758,
/
#
# 52 THR HB 53 ILE HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 754, 766, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 52 THR HA 53 ILE HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= 752, 766, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 52 THR QG2 53 ILE HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 766, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1= 756, 757, 758,
/
#
# 53 ILE HA 53 ILE 2HG1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 766, 775, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 53 ILE 1HG1 53 ILE HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 774, 766, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 52 THR QG2 54 LYS QD 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 4.04, r4= 4.54,
igr1= 756, 757, 758,
igr2= 793, 794,
/
#
# 52 THR QG2 54 LYS QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.74, r4= 7.24,
igr1= 756, 757, 758,
igr2= 787, 788,
/
#
# 52 THR HB 70 LYS HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 754,1062, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 52 THR H 71 VAL HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 750,1086, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 52 THR H 71 VAL QQG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 750,1085, r1= 1.35, r2= 1.85, r3= 7.20, r4= 7.70, /
#
# 52 THR H 71 VAL H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 750,1082, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 52 THR HB 71 VAL HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 754,1086, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 52 THR HB 71 VAL QQG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 754,1085, r1= 1.35, r2= 1.85, r3= 8.20, r4= 8.70, /
#
# 53 ILE H 44 LEU 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 764, 665, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 53 ILE H 52 THR HA 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 764, 752, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 53 ILE H 46 GLY 1HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 764, 696, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 53 ILE H 52 THR HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 764, 754, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 53 ILE H 52 THR QG2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 764, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2= 756, 757, 758,
/
#
# 53 ILE H 53 ILE 1HG1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 764, 774, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 53 ILE H 52 THR QG2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 764, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2= 756, 757, 758,
/
#
# 53 ILE H 53 ILE HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 764, 768, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 53 ILE H 53 ILE QG2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 764, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2= 770, 771, 772,
/
#
# 53 ILE QG2 53 ILE HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 766, r1= 1.35, r2= 1.85, r3= 7.81, r4= 8.31,
igr1= 770, 771, 772,
/
#
# 53 ILE QG2 53 ILE QD1 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 4.04, r4= 4.54,
igr1= 770, 771, 772,
igr2= 777, 778, 779,
/
#
# 44 LEU QD1 53 ILE QG2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.65, r4= 9.15,
igr1= 669, 670, 671,
igr2= 770, 771, 772,
/
#
# 53 ILE HB 53 ILE QG2 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 768, -1, r1= 1.35, r2= 1.85, r3= 3.60, r4= 4.10,
igr2= 770, 771, 772,
/
#
# 53 ILE H 53 ILE QG1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 764, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2= 774, 775,
/
#
# 53 ILE QG2 53 ILE HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 766, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr1= 770, 771, 772,
/
#
# 53 ILE QG1 53 ILE QD1 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 4.04, r4= 4.54,
igr1= 774, 775,
igr2= 777, 778, 779,
/
#
# 53 ILE 1HG1 53 ILE QG2 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 774, -1, r1= 1.35, r2= 1.85, r3= 3.60, r4= 4.10,
igr2= 770, 771, 772,
/
#
# 53 ILE QG2 53 ILE 2HG1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 775, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1= 770, 771, 772,
/
#
# 53 ILE HB 53 ILE QG2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 768, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2= 770, 771, 772,
/
#
# 53 ILE HB 53 ILE QG1 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= 768, -1, r1= 1.35, r2= 1.85, r3= 7.30, r4= 7.80,
igr2= 774, 775,
/
#
# 53 ILE 2HG1 70 LYS 2HD 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 775,1071, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 70 LYS QG 70 LYS QD 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 7.56, r4= 8.06,
igr1=1067,1068,
igr2=1070,1071,
/
#
# 53 ILE HA 70 LYS HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= 766,1062, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 53 ILE 2HG1 70 LYS 1HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 775,1064, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 70 LYS QG 70 LYS 1HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1064, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr1=1067,1068,
/
#
# 53 ILE QG2 70 LYS 2HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1065, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1= 770, 771, 772,
/
#
# 70 LYS 2HB 86 ILE QD1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1065, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=1338,1339,1340,
/
#
# 70 LYS 2HB 86 ILE QG2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1065, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=1331,1332,1333,
/
#
# 53 ILE QG2 70 LYS HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1062, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1= 770, 771, 772,
/
#
# 53 ILE HA 71 VAL H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 766,1082, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 53 ILE 2HG1 86 ILE QD1 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= 775, -1, r1= 1.35, r2= 1.85, r3= 3.36, r4= 3.86,
igr2=1338,1339,1340,
/
#
# 53 ILE 2HG1 86 ILE QG2 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 775, -1, r1= 1.35, r2= 1.85, r3= 3.60, r4= 4.10,
igr2=1331,1332,1333,
/
#
# 53 ILE QG1 86 ILE QD1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.09, r4= 8.59,
igr1= 774, 775,
igr2=1338,1339,1340,
/
#
# 54 LYS H 53 ILE HA 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 783, 766, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 118 THR H 117 ILE HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1799,1782, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 54 LYS H 53 ILE 2HG1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 783, 775, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 54 LYS H 52 THR QG2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 783, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2= 756, 757, 758,
/
#
# 54 LYS H 53 ILE QG2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 783, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2= 770, 771, 772,
/
#
# 54 LYS H 53 ILE HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 783, 766, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 54 LYS H 53 ILE QG2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 783, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2= 770, 771, 772,
/
#
# 54 LYS H 54 LYS QD 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 783, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2= 793, 794,
/
#
# 54 LYS H 54 LYS QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 783, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2= 787, 788,
/
#
# 54 LYS HA 54 LYS QD 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 785, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2= 793, 794,
/
#
# 54 LYS HA 54 LYS QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 785, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2= 787, 788,
/
#
# 54 LYS H 55 LYS HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 783, 807, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 54 LYS QB 56 ILE QD1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.09, r4= 8.59,
igr1= 787, 788,
igr2= 840, 841, 842,
/
#
# 56 ILE HB 56 ILE QD1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 831, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2= 840, 841, 842,
/
#
# 54 LYS H 69 HIS H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 783,1043, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 54 LYS H 69 HIS H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 783,1043, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 55 LYS H 44 LEU QQD 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 805, 666, r1= 1.35, r2= 1.85, r3= 7.20, r4= 7.70, /
#
# 55 LYS H 44 LEU QD1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 805, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2= 669, 670, 671,
/
#
# 55 LYS H 54 LYS HA 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= 805, 785, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 55 LYS H 54 LYS QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 805, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2= 787, 788,
/
#
# 55 LYS H 55 LYS HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 805, 807, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 55 LYS H 55 LYS QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 805, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2= 809, 810,
/
#
# 55 LYS H 55 LYS QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 805, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2= 809, 810,
/
#
# 55 LYS H 55 LYS QD 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 805, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2= 815, 816,
/
#
# 55 LYS QB 55 LYS QD 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.30, r4= 6.80,
igr1= 809, 810,
igr2= 815, 816,
/
#
# 55 LYS HA 66 TYR QD 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= 807, -1, r1= 1.35, r2= 1.85, r3= 7.30, r4= 7.80,
igr2= 991,1000,
/
#
# 56 ILE H 55 LYS HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 827, 807, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 56 ILE H 56 ILE HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 827, 829, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 56 ILE H 56 ILE HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 827, 831, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 56 ILE QD1 56 ILE QG2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.65, r4= 9.15,
igr1= 840, 841, 842,
igr2= 833, 834, 835,
/
#
# 56 ILE HB 56 ILE QG2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 831, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2= 833, 834, 835,
/
#
# 56 ILE QD1 56 ILE QG2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1= 840, 841, 842,
igr2= 833, 834, 835,
/
#
# 56 ILE HB 57 THR HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 831, 848, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 56 ILE H 68 LYS HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 827,1023, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 56 ILE H 68 LYS HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 827,1023, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 56 ILE HB 85 ILE QD1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 831, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=1319,1320,1321,
/
#
# 57 THR H 56 ILE H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 846, 827, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 57 THR H 56 ILE HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 846, 829, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 57 THR H 56 ILE QD1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 846, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2= 840, 841, 842,
/
#
# 57 THR H 56 ILE HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= 846, 829, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 57 THR HB 56 ILE QG2 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= 850, -1, r1= 1.35, r2= 1.85, r3= 7.81, r4= 8.31,
igr2= 833, 834, 835,
/
#
# 57 THR H 57 THR HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 846, 848, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 57 THR H 57 THR HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 846, 850, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 57 THR H 57 THR QG2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 846, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2= 852, 853, 854,
/
#
# 57 THR QG2 57 THR HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 850, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr1= 852, 853, 854,
/
#
# 57 THR QG2 57 THR HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 850, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr1= 852, 853, 854,
/
#
# 57 THR HA 57 THR HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= 848, 850, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 57 THR QG2 64 PHE QD 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.09, r4= 8.59,
igr1= 852, 853, 854,
igr2= 949, 957,
/
#
# 66 TYR QE 88 GLY H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1359, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr1= 993, 998,
/
#
# 67 MET HA 66 TYR QD 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1006, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2= 991,1000,
/
#
# 67 MET QG 90 PRO 1HB 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= -1,1380, r1= 1.35, r2= 1.85, r3= 3.14, r4= 3.64,
igr1=1011,1012,
/
#
# 68 LYS H 66 TYR QE 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1021, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2= 993, 998,
/
#
# 68 LYS H 67 MET HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1021,1006, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 68 LYS HA 68 LYS H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1023,1021, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 68 LYS HA 68 LYS QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1023, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1025,1026,
/
#
# 68 LYS QB 86 ILE QD1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.74, r4= 7.24,
igr1=1025,1026,
igr2=1338,1339,1340,
/
#
# 68 LYS QB 86 ILE QG1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 7.56, r4= 8.06,
igr1=1025,1026,
igr2=1335,1336,
/
#
# 68 LYS QB 86 ILE QG1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.30, r4= 6.80,
igr1=1025,1026,
igr2=1335,1336,
/
#
# 68 LYS H 87 GLU 1HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1021,1348, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 68 LYS H 87 GLU H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1021,1344, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 68 LYS H 88 GLY 1HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1021,1361, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 68 LYS H 88 GLY 1HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1021,1361, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 69 HIS H 53 ILE QG2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1043, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2= 770, 771, 772,
/
#
# 69 HIS H 53 ILE QG2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1043, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2= 770, 771, 772,
/
#
# 69 HIS H 54 LYS QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1043, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2= 787, 788,
/
#
# 69 HIS H 68 LYS H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1043,1021, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 69 HIS H 68 LYS HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1043,1023, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 69 HIS H 68 LYS HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1043,1023, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 69 HIS H 69 HIS HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1043,1045, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 69 HIS HA 85 ILE HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1045,1308, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 70 LYS QG 53 ILE QD1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.74, r4= 7.24,
igr1=1067,1068,
igr2= 777, 778, 779,
/
#
# 53 ILE QG1 53 ILE QD1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.09, r4= 8.59,
igr1= 774, 775,
igr2= 777, 778, 779,
/
#
# 70 LYS 1HB 53 ILE QD1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1064, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2= 777, 778, 779,
/
#
# 53 ILE QD1 70 LYS QD 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.09, r4= 8.59,
igr1= 777, 778, 779,
igr2=1070,1071,
/
#
# 70 LYS 2HB 53 ILE QD1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1065, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2= 777, 778, 779,
/
#
# 53 ILE HB 53 ILE QD1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 768, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2= 777, 778, 779,
/
#
# 70 LYS QG 53 ILE QD1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.74, r4= 7.24,
igr1=1067,1068,
igr2= 777, 778, 779,
/
#
# 70 LYS H 69 HIS HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1060,1045, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 70 LYS H 70 LYS HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1060,1062, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 70 LYS H 70 LYS 1HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1060,1064, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 70 LYS H 70 LYS QG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1060, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1067,1068,
/
#
# 70 LYS 2HB 70 LYS QD 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=1065, -1, r1= 1.35, r2= 1.85, r3= 3.37, r4= 3.87,
igr2=1070,1071,
/
#
# 70 LYS QE 70 LYS QD 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.30, r4= 6.80,
igr1=1073,1074,
igr2=1070,1071,
/
#
# 70 LYS QG 70 LYS QD 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.78, r4= 4.28,
igr1=1067,1068,
igr2=1070,1071,
/
#
# 70 LYS QG 70 LYS QE 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.30, r4= 6.80,
igr1=1067,1068,
igr2=1073,1074,
/
#
# 70 LYS QG 70 LYS HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1062, r1= 1.35, r2= 1.85, r3= 7.30, r4= 7.80,
igr1=1067,1068,
/
#
# 70 LYS HA 70 LYS 1HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1062,1064, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 70 LYS HA 70 LYS 2HB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1062,1065, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 70 LYS 1HB 70 LYS 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1064,1065, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 70 LYS HA 70 LYS 2HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1062,1065, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 70 LYS QG 70 LYS QE 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.30, r4= 6.80,
igr1=1067,1068,
igr2=1073,1074,
/
#
# 70 LYS QG 70 LYS 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1065, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr1=1067,1068,
/
#
# 70 LYS QE 70 LYS QD 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.53, r4= 4.03,
igr1=1073,1074,
igr2=1070,1071,
/
#
# 70 LYS 1HB 70 LYS QE 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1064, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1073,1074,
/
#
# 70 LYS 2HB 70 LYS QE 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=1065, -1, r1= 1.35, r2= 1.85, r3= 3.37, r4= 3.87,
igr2=1073,1074,
/
#
# 70 LYS 2HB 70 LYS QD 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1065, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1070,1071,
/
#
# 70 LYS 1HB 70 LYS 2HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1064,1065, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 70 LYS HA 71 VAL H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1062,1082, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 70 LYS 1HB 71 VAL H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1064,1082, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 70 LYS 1HB 71 VAL H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1064,1082, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 70 LYS 2HB 71 VAL H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1065,1082, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 70 LYS 2HG 72 GLU QG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1068, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1105,1106,
/
#
# 70 LYS H 83 TYR 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1060,1279, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 70 LYS H 84 SER H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1060,1295, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 70 LYS H 84 SER H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1060,1295, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 70 LYS H 86 ILE QG2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1060, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=1331,1332,1333,
/
#
# 70 LYS HA 86 ILE QG2 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1062, -1, r1= 1.35, r2= 1.85, r3= 7.81, r4= 8.31,
igr2=1331,1332,1333,
/
#
# 70 LYS HA 86 ILE QD1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1062, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=1338,1339,1340,
/
#
# 70 LYS 2HB 86 ILE QD1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1065, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=1338,1339,1340,
/
#
# 53 ILE HB 86 ILE QD1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 768, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=1338,1339,1340,
/
#
# 70 LYS 1HB 86 ILE QD1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1064, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=1338,1339,1340,
/
#
# 70 LYS 1HB 86 ILE QG2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1064, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=1331,1332,1333,
/
#
# 53 ILE QG2 70 LYS 1HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1064, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1= 770, 771, 772,
/
#
# 70 LYS 2HB 86 ILE QG2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1065, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=1331,1332,1333,
/
#
# 70 LYS H 86 ILE QG2 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1060, -1, r1= 1.35, r2= 1.85, r3= 7.81, r4= 8.31,
igr2=1331,1332,1333,
/
#
# 71 VAL QQG 49 GLY QA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1085, -1, r1= 1.35, r2= 1.85, r3= 8.93, r4= 9.43,
igr2= 724, 725,
/
#
# 71 VAL QQG 49 GLY QA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1085, -1, r1= 1.35, r2= 1.85, r3= 7.81, r4= 8.31,
igr2= 724, 725,
/
#
# 71 VAL QG1 50 PRO 1HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 736, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr1=1088,1089,1090,
/
#
# 71 VAL QG1 50 PRO QG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.09, r4= 8.59,
igr1=1088,1089,1090,
igr2= 733, 734,
/
#
# 71 VAL QG1 50 PRO QG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.74, r4= 7.24,
igr1=1088,1089,1090,
igr2= 733, 734,
/
#
# 71 VAL HA 71 VAL H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1084,1082, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 71 VAL HB 71 VAL H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1086,1082, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 71 VAL HA 71 VAL HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1084,1086, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 71 VAL HB 71 VAL H 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1086,1082, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 71 VAL HA 72 GLU 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1084,1103, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 71 VAL HB 74 ILE QD1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1086, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=1141,1142,1143,
/
#
# 71 VAL QQG 74 ILE QD1 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat=1085, -1, r1= 1.35, r2= 1.85, r3= 5.56, r4= 6.06,
igr2=1141,1142,1143,
/
#
# 71 VAL QQG 74 ILE QD1 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat=1085, -1, r1= 1.35, r2= 1.85, r3= 5.56, r4= 6.06,
igr2=1141,1142,1143,
/
#
# 71 VAL QQG 74 ILE QG1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1085, -1, r1= 1.35, r2= 1.85, r3= 7.81, r4= 8.31,
igr2=1138,1139,
/
#
# 71 VAL HA 83 TYR HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1084,1276, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 71 VAL QQG 83 TYR QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1085, -1, r1= 1.35, r2= 1.85, r3= 7.81, r4= 8.31,
igr2=1278,1279,
/
#
# 71 VAL HA 83 TYR HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1084,1276, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 71 VAL HA 83 TYR QB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1084, -1, r1= 1.35, r2= 1.85, r3= 7.30, r4= 7.80,
igr2=1278,1279,
/
#
# 72 GLU HA 70 LYS 2HG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1100,1068, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 72 GLU H 71 VAL HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1098,1084, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 72 GLU H 71 VAL QQG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1098,1085, r1= 1.35, r2= 1.85, r3= 7.20, r4= 7.70, /
#
# 72 GLU HA 71 VAL HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1100,1084, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 72 GLU H 71 VAL HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1098,1084, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 72 GLU HA 71 VAL HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1100,1084, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 72 GLU H 72 GLU HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1098,1100, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 72 GLU H 72 GLU QG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1098, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1105,1106,
/
#
# 72 GLU H 71 VAL HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1098,1086, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 72 GLU QG 72 GLU QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.30, r4= 6.80,
igr1=1105,1106,
igr2=1102,1103,
/
#
# 72 GLU HA 72 GLU QG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1100, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1105,1106,
/
#
# 72 GLU HA 72 GLU QG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1100, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1105,1106,
/
#
# 72 GLU HA 72 GLU QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1100, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1102,1103,
/
#
# 72 GLU H 72 GLU HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1098,1100, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 72 GLU H 73 GLU H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1098,1113, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 72 GLU H 73 GLU H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1098,1113, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 72 GLU H 82 CYS 1HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1098,1267, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 72 GLU H 83 TYR HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1098,1276, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 73 GLU H 50 PRO 1HB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=1113, 736, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 73 GLU H 50 PRO 1HG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1113, 733, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 73 GLU HA 50 PRO 1HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1115, 736, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 73 GLU HA 50 PRO 2HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1115, 737, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 73 GLU H 71 VAL HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1113,1084, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 73 GLU H 72 GLU QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1113, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1102,1103,
/
#
# 73 GLU H 73 GLU HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1113,1115, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 73 GLU H 73 GLU QG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1113, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1120,1121,
/
#
# 73 GLU H 73 GLU HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1113,1115, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 73 GLU QG 73 GLU QB 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.53, r4= 4.03,
igr1=1120,1121,
igr2=1117,1118,
/
#
# 73 GLU HA 73 GLU QG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1115, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1120,1121,
/
#
# 73 GLU HA 73 GLU QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1115, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1117,1118,
/
#
# 73 GLU HA 74 ILE H 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=1115,1128, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 73 GLU QG 74 ILE H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1128, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr1=1120,1121,
/
#
# 73 GLU HA 74 ILE QG1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1115, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1138,1139,
/
#
# 73 GLU HA 74 ILE H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1115,1128, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 73 GLU H 82 CYS H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1113,1263, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 73 GLU H 82 CYS HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1113,1265, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 73 GLU H 81 TYR HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1113,1244, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 73 GLU H 82 CYS 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1113,1268, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 73 GLU H 82 CYS 1HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1113,1267, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 73 GLU H 82 CYS H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1113,1263, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 73 GLU H 82 CYS 1HB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1113,1267, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 73 GLU H 82 CYS 2HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1113,1268, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 73 GLU H 83 TYR HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1113,1276, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 74 ILE H 50 PRO QD 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1128, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2= 730, 731,
/
#
# 74 ILE H 50 PRO 2HG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1128, 734, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 50 PRO 1HG 74 ILE H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 733,1128, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 74 ILE H 73 GLU QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1128, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1117,1118,
/
#
# 74 ILE H 74 ILE HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1128,1132, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 74 ILE HA 73 GLU QG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1130, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1120,1121,
/
#
# 74 ILE HA 73 GLU 1HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1130,1117, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 74 ILE H 74 ILE QD1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1128, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=1141,1142,1143,
/
#
# 74 ILE QG2 74 ILE QD1 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 4.33, r4= 4.83,
igr1=1134,1135,1136,
igr2=1141,1142,1143,
/
#
# 74 ILE HB 74 ILE QD1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1132, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=1141,1142,1143,
/
#
# 74 ILE QG2 74 ILE QD1 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 4.04, r4= 4.54,
igr1=1134,1135,1136,
igr2=1141,1142,1143,
/
#
# 74 ILE QG2 74 ILE QG1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.74, r4= 7.24,
igr1=1134,1135,1136,
igr2=1138,1139,
/
#
# 74 ILE HA 74 ILE QG2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1130, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=1134,1135,1136,
/
#
# 74 ILE HB 74 ILE QD1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1132, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=1141,1142,1143,
/
#
# 74 ILE QG2 74 ILE HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1132, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr1=1134,1135,1136,
/
#
# 74 ILE HB 74 ILE QG1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1132, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1138,1139,
/
#
# 74 ILE QD1 74 ILE QG1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.74, r4= 7.24,
igr1=1141,1142,1143,
igr2=1138,1139,
/
#
# 74 ILE QG2 74 ILE HB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1132, r1= 1.35, r2= 1.85, r3= 3.60, r4= 4.10,
igr1=1134,1135,1136,
/
#
# 74 ILE H 74 ILE HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1128,1132, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 74 ILE QG2 76 HIS QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.09, r4= 8.59,
igr1=1134,1135,1136,
igr2=1163,1164,
/
#
# 75 ASP H 73 GLU QG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1147, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1120,1121,
/
#
# 75 ASP H 74 ILE HA 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=1147,1130, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 75 ASP H 74 ILE QG2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1147, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=1134,1135,1136,
/
#
# 75 ASP H 74 ILE H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1147,1128, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 75 ASP HA 74 ILE HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1149,1132, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 75 ASP HA 74 ILE QG2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1149, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=1134,1135,1136,
/
#
# 75 ASP H 74 ILE HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1147,1130, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 75 ASP H 75 ASP HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1147,1149, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 75 ASP 2HB 75 ASP H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1152,1147, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 75 ASP 1HB 75 ASP H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1151,1147, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 75 ASP 1HB 75 ASP 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1151,1152, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 75 ASP H 75 ASP HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1147,1149, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 75 ASP 2HB 75 ASP H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1152,1147, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 75 ASP HA 76 HIS H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1149,1159, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 75 ASP 2HB 76 HIS H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1152,1159, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 75 ASP 1HB 76 HIS H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1151,1159, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 75 ASP 1HB 76 HIS H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1151,1159, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 75 ASP 2HB 76 HIS H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1152,1159, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 75 ASP H 80 LYS QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1147, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1224,1225,
/
#
# 75 ASP 2HB 80 LYS 1HG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1152,1227, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 80 LYS QG 103 LYS 1HE 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1601, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr1=1227,1228,
/
#
# 75 ASP 1HB 80 LYS QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1151, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1224,1225,
/
#
# 75 ASP 2HB 80 LYS QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1152, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1224,1225,
/
#
# 75 ASP H 81 TYR QD 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1147, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1250,1259,
/
#
# 75 ASP H 81 TYR HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1147,1244, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 76 HIS H 76 HIS HD2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1159,1172, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 76 HIS HA 76 HIS H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1161,1159, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 76 HIS HD2 76 HIS QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1172, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1163,1164,
/
#
# 76 HIS HA 77 ALA H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1161,1176, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 77 ALA H 75 ASP HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1176,1149, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 77 ALA H 76 HIS H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1176,1159, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 77 ALA H 76 HIS H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1176,1159, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 77 ALA H 76 HIS QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1176, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1163,1164,
/
#
# 77 ALA H 77 ALA HA 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=1176,1178, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 77 ALA QB 77 ALA H 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= -1,1176, r1= 1.35, r2= 1.85, r3= 3.36, r4= 3.86,
igr1=1180,1181,1182,
/
#
# 77 ALA QB 77 ALA HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1178, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1=1180,1181,1182,
/
#
# 77 ALA QB 77 ALA H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1176, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1=1180,1181,1182,
/
#
# 77 ALA QB 77 ALA HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1178, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1=1180,1181,1182,
/
#
# 77 ALA QB 78 ASN 1HD2 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1195, r1= 1.35, r2= 1.85, r3= 7.81, r4= 8.31,
igr1=1180,1181,1182,
/
#
# 77 ALA QB 78 ASN 2HD2 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1196, r1= 1.35, r2= 1.85, r3= 7.81, r4= 8.31,
igr1=1180,1181,1182,
/
#
# 78 ASN H 76 HIS HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1186,1161, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 78 ASN H 77 ALA H 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=1186,1176, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 78 ASN H 77 ALA HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1186,1178, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 78 ASN H 77 ALA QB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=1186, -1, r1= 1.35, r2= 1.85, r3= 3.60, r4= 4.10,
igr2=1180,1181,1182,
/
#
# 28 ASN H 29 LEU HG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 414, 435, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 78 ASN H 77 ALA H 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=1186,1176, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 78 ASN HA 77 ALA QB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1188, -1, r1= 1.35, r2= 1.85, r3= 7.81, r4= 8.31,
igr2=1180,1181,1182,
/
#
# 78 ASN H 78 ASN 1HD2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1186,1195, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 78 ASN H 78 ASN HA 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=1186,1188, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 78 ASN H 78 ASN 2HB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=1186,1191, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 78 ASN 1HD2 78 ASN 2HD2 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=1195,1196, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 78 ASN 1HD2 78 ASN 2HD2 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=1195,1196, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 78 ASN H 78 ASN HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1186,1188, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 78 ASN 1HB 78 ASN 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1190,1191, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 78 ASN 1HB 78 ASN 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1190,1191, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 78 ASN 2HB 75 ASP 1HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1191,1151, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 78 ASN HA 78 ASN 2HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1188,1191, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 78 ASN HA 78 ASN 1HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1188,1190, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 78 ASN 2HB 80 LYS QD 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1191, -1, r1= 1.35, r2= 1.85, r3= 7.30, r4= 7.80,
igr2=1230,1231,
/
#
# 79 PHE H 76 HIS HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1200,1161, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 79 PHE H 76 HIS HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1200,1161, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 79 PHE H 77 ALA QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1200, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=1180,1181,1182,
/
#
# 79 PHE H 77 ALA QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1200, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=1180,1181,1182,
/
#
# 79 PHE H 78 ASN H 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=1200,1186, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 79 PHE H 78 ASN HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1200,1188, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 79 PHE H 78 ASN H 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=1200,1186, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 79 PHE H 79 PHE QD 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1200, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1208,1216,
/
#
# 79 PHE H 79 PHE HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1200,1202, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 79 PHE H 79 PHE QB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=1200, -1, r1= 1.35, r2= 1.85, r3= 3.37, r4= 3.87,
igr2=1204,1205,
/
#
# 79 PHE HA 79 PHE QB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1202, -1, r1= 1.35, r2= 1.85, r3= 7.30, r4= 7.80,
igr2=1204,1205,
/
#
# 79 PHE H 79 PHE HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1200,1202, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 79 PHE H 80 LYS H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1200,1220, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 79 PHE H 80 LYS H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1200,1220, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 79 PHE QB 80 LYS HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1222, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr1=1204,1205,
/
#
# 80 LYS H 75 ASP H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1220,1147, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 80 LYS H 75 ASP 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1220,1152, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 80 LYS H 75 ASP 1HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1220,1151, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 80 LYS H 76 HIS HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1220,1161, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 80 LYS H 78 ASN H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1220,1186, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 80 LYS H 79 PHE HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1220,1202, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 80 LYS H 80 LYS HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1220,1222, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 80 LYS H 80 LYS QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1220, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1224,1225,
/
#
# 80 LYS H 80 LYS QG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1220, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1227,1228,
/
#
# 80 LYS QG 80 LYS QD 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.53, r4= 4.03,
igr1=1227,1228,
igr2=1230,1231,
/
#
# 80 LYS QD 80 LYS QE 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.30, r4= 6.80,
igr1=1230,1231,
igr2=1233,1234,
/
#
# 80 LYS QG 80 LYS HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1222, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr1=1227,1228,
/
#
# 80 LYS QB 80 LYS QG 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.78, r4= 4.28,
igr1=1224,1225,
igr2=1227,1228,
/
#
# 103 LYS 2HB 80 LYS QG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1593, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1227,1228,
/
#
# 80 LYS HA 80 LYS QD 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1222, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1230,1231,
/
#
# 80 LYS QG 80 LYS QE 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.30, r4= 6.80,
igr1=1227,1228,
igr2=1233,1234,
/
#
# 80 LYS H 80 LYS QG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1220, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1227,1228,
/
#
# 80 LYS QG 80 LYS HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1222, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr1=1227,1228,
/
#
# 80 LYS H 80 LYS HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1220,1222, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 80 LYS HA 80 LYS QD 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1222, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1230,1231,
/
#
# 80 LYS QB 80 LYS QG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.30, r4= 6.80,
igr1=1224,1225,
igr2=1227,1228,
/
#
# 80 LYS 1HB 101 GLU QG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1224, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1561,1562,
/
#
# 103 LYS 2HB 101 GLU QG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1593, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1561,1562,
/
#
# 81 TYR H 80 LYS H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1242,1220, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 81 TYR H 80 LYS HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1242,1222, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 81 TYR H 80 LYS 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1242,1225, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 81 TYR H 80 LYS HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1242,1222, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 102 ILE H 80 LYS HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1569,1222, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 81 TYR H 81 TYR QD 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1242, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1250,1259,
/
#
# 81 TYR H 81 TYR HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1242,1244, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 81 TYR H 81 TYR QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1242, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1246,1247,
/
#
# 81 TYR QB 81 TYR QE 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.19, r4= 8.69,
igr1=1246,1247,
igr2=1252,1257,
/
#
# 81 TYR QD 81 TYR HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1244, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr1=1250,1259,
/
#
# 81 TYR QD 81 TYR QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.30, r4= 6.80,
igr1=1250,1259,
igr2=1246,1247,
/
#
# 81 TYR QB 22 PHE QE 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 7.56, r4= 8.06,
igr1=1246,1247,
igr2= 335, 339,
/
#
# 81 TYR HA 81 TYR QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1244, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1246,1247,
/
#
# 81 TYR H 102 ILE HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1242,1573, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 81 TYR QE 102 ILE QD1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.09, r4= 8.59,
igr1=1252,1257,
igr2=1582,1583,1584,
/
#
# 81 TYR QD 102 ILE QG2 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.76, r4= 9.26,
igr1=1250,1259,
igr2=1575,1576,1577,
/
#
# 81 TYR QB 102 ILE HB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1573, r1= 1.35, r2= 1.85, r3= 7.30, r4= 7.80,
igr1=1246,1247,
/
#
# 82 CYS HA 72 GLU 2HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1265,1103, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 82 CYS 1HB 72 GLU QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1267, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1102,1103,
/
#
# 82 CYS 2HB 72 GLU QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1268, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1102,1103,
/
#
# 82 CYS H 73 GLU QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1263, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1117,1118,
/
#
# 82 CYS 1HB 73 GLU QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1267, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1117,1118,
/
#
# 82 CYS H 74 ILE HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1263,1130, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 82 CYS H 81 TYR H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1263,1242, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 82 CYS H 81 TYR QD 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1263, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1250,1259,
/
#
# 82 CYS H 81 TYR QE 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1263, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1252,1257,
/
#
# 82 CYS H 81 TYR HA 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=1263,1244, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 82 CYS H 82 CYS HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1263,1265, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 82 CYS H 82 CYS 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1263,1268, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 82 CYS H 82 CYS 1HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1263,1267, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 82 CYS 1HB 82 CYS 2HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1267,1268, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 82 CYS 1HB 82 CYS 2HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1267,1268, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 82 CYS 2HB 82 CYS HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1268,1265, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 82 CYS H 82 CYS 1HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1263,1267, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 82 CYS H 82 CYS 2HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1263,1268, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 82 CYS H 82 CYS HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1263,1265, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 82 CYS H 83 TYR H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1263,1274, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 83 TYR H 72 GLU 1HG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1274,1105, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 83 TYR HA 72 GLU QG 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1276, -1, r1= 1.35, r2= 1.85, r3= 7.30, r4= 7.80,
igr2=1105,1106,
/
#
# 83 TYR H 72 GLU 2HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1274,1103, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 83 TYR H 82 CYS HA 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=1274,1265, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 83 TYR HA 82 CYS 2HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1276,1268, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 83 TYR H 82 CYS 1HB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1274,1267, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 83 TYR H 82 CYS 2HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1274,1268, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 83 TYR H 82 CYS HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1274,1265, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 83 TYR H 83 TYR QD 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1274, -1, r1= 1.35, r2= 1.85, r3= 7.30, r4= 7.80,
igr2=1282,1291,
/
#
# 83 TYR H 83 TYR QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1274, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1278,1279,
/
#
# 83 TYR H 83 TYR QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1274, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1278,1279,
/
#
# 83 TYR HA 83 TYR 1HB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1276,1278, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 83 TYR 2HB 83 TYR HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1279,1276, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 83 TYR H 84 SER HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1274,1297, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 85 ILE H 84 SER HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1306,1297, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 83 TYR QD 99 PRO HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1529, r1= 1.35, r2= 1.85, r3= 7.30, r4= 7.80,
igr1=1282,1291,
/
#
# 83 TYR H 100 TYR H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1274,1533, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 83 TYR H 100 TYR 1HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1274,1537, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 83 TYR H 100 TYR 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1274,1538, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 83 TYR H 100 TYR H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1274,1533, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 83 TYR H 101 GLU HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1274,1556, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 83 TYR QD 102 ILE QD1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.09, r4= 8.59,
igr1=1282,1291,
igr2=1582,1583,1584,
/
#
# 83 TYR QE 102 ILE QD1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.09, r4= 8.59,
igr1=1284,1289,
igr2=1582,1583,1584,
/
#
# 84 SER H 72 GLU H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1295,1098, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 84 SER H 72 GLU QG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1295, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1105,1106,
/
#
# 84 SER H 72 GLU QG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1295, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1105,1106,
/
#
# 84 SER H 83 TYR QD 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1295, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1282,1291,
/
#
# 84 SER H 83 TYR HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1295,1276, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 84 SER H 83 TYR QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1295, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1278,1279,
/
#
# 84 SER H 83 TYR HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1295,1276, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 84 SER H 84 SER HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1295,1297, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 84 SER H 84 SER QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1295, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1299,1300,
/
#
# 84 SER H 84 SER HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1295,1297, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 84 SER H 86 ILE QG2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1295, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=1331,1332,1333,
/
#
# 84 SER QB 97 LYS 2HD 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1489, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr1=1299,1300,
/
#
# 84 SER 2HB 97 LYS QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1300, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1482,1483,
/
#
# 84 SER QB 99 PRO HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1529, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr1=1299,1300,
/
#
# 85 ILE QD1 83 TYR QE 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.09, r4= 8.59,
igr1=1319,1320,1321,
igr2=1284,1289,
/
#
# 69 HIS HA 85 ILE QD1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1045, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=1319,1320,1321,
/
#
# 85 ILE H 84 SER HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1306,1297, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 85 ILE H 84 SER QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1306, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1299,1300,
/
#
# 85 ILE H 85 ILE HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1306,1308, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 85 ILE H 85 ILE HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1306,1310, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 85 ILE H 85 ILE QD1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1306, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=1319,1320,1321,
/
#
# 85 ILE HB 85 ILE QD1 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=1310, -1, r1= 1.35, r2= 1.85, r3= 3.60, r4= 4.10,
igr2=1319,1320,1321,
/
#
# 85 ILE H 85 ILE HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1306,1310, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 85 ILE HB 85 ILE QD1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1310, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=1319,1320,1321,
/
#
# 85 ILE QD1 90 PRO 2HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1381, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1=1319,1320,1321,
/
#
# 85 ILE QD1 90 PRO 1HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1380, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1=1319,1320,1321,
/
#
# 85 ILE QD1 91 LEU QD2 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 4.33, r4= 4.83,
igr1=1319,1320,1321,
igr2=1400,1401,1402,
/
#
# 85 ILE HB 91 LEU QD1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1310, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=1396,1397,1398,
/
#
# 85 ILE HB 91 LEU HG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1310,1394, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 85 ILE HB 98 ILE HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1310,1504, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 85 ILE QD1 91 LEU QD1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1=1319,1320,1321,
igr2=1396,1397,1398,
/
#
# 85 ILE H 97 LYS 2HB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1306,1483, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 85 ILE H 98 ILE H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1306,1500, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 85 ILE H 98 ILE QG2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1306, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=1506,1507,1508,
/
#
# 85 ILE H 98 ILE QD1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1306, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=1513,1514,1515,
/
#
# 85 ILE H 98 ILE H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1306,1500, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 85 ILE HB 98 ILE HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1310,1504, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 85 ILE QD1 98 ILE HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1504, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr1=1319,1320,1321,
/
#
# 86 ILE QG1 53 ILE QD1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.74, r4= 7.24,
igr1=1335,1336,
igr2= 777, 778, 779,
/
#
# 86 ILE QG2 70 LYS QD 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.74, r4= 7.24,
igr1=1331,1332,1333,
igr2=1070,1071,
/
#
# 86 ILE QD1 70 LYS QD 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.09, r4= 8.59,
igr1=1338,1339,1340,
igr2=1070,1071,
/
#
# 86 ILE QD1 70 LYS QD 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.74, r4= 7.24,
igr1=1338,1339,1340,
igr2=1070,1071,
/
#
# 70 LYS 1HB 86 ILE QD1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1064, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=1338,1339,1340,
/
#
# 86 ILE QG2 70 LYS QD 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.09, r4= 8.59,
igr1=1331,1332,1333,
igr2=1070,1071,
/
#
# 70 LYS 1HB 86 ILE QG2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1064, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=1331,1332,1333,
/
#
# 86 ILE QG2 84 SER QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.74, r4= 7.24,
igr1=1331,1332,1333,
igr2=1299,1300,
/
#
# 86 ILE QG2 84 SER QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.09, r4= 8.59,
igr1=1331,1332,1333,
igr2=1299,1300,
/
#
# 86 ILE QG1 86 ILE QD1 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 4.04, r4= 4.54,
igr1=1335,1336,
igr2=1338,1339,1340,
/
#
# 86 ILE QG2 86 ILE HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1327, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1=1331,1332,1333,
/
#
# 86 ILE QG1 86 ILE QD1 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 4.04, r4= 4.54,
igr1=1335,1336,
igr2=1338,1339,1340,
/
#
# 53 ILE QG2 86 ILE QG1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.09, r4= 8.59,
igr1= 770, 771, 772,
igr2=1335,1336,
/
#
# 86 ILE QG2 86 ILE QG1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.09, r4= 8.59,
igr1=1331,1332,1333,
igr2=1335,1336,
/
#
# 86 ILE QG1 86 ILE HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1327, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr1=1335,1336,
/
#
# 86 ILE HB 86 ILE HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1329,1327, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 86 ILE HB 86 ILE QD1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1329, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=1338,1339,1340,
/
#
# 86 ILE QG2 86 ILE HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1329, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1=1331,1332,1333,
/
#
# 86 ILE QG2 87 GLU H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1344, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr1=1331,1332,1333,
/
#
# 87 GLU H 86 ILE QD1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1344, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=1338,1339,1340,
/
#
# 86 ILE QG2 87 GLU H 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1344, r1= 1.35, r2= 1.85, r3= 7.81, r4= 8.31,
igr1=1331,1332,1333,
/
#
# 86 ILE QG2 97 LYS QD 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.74, r4= 7.24,
igr1=1331,1332,1333,
igr2=1488,1489,
/
#
# 86 ILE QG2 97 LYS QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.74, r4= 7.24,
igr1=1331,1332,1333,
igr2=1482,1483,
/
#
# 86 ILE QG2 97 LYS QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.09, r4= 8.59,
igr1=1331,1332,1333,
igr2=1482,1483,
/
#
# 87 GLU H 68 LYS QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1344, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1025,1026,
/
#
# 87 GLU QB 68 LYS 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1026, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr1=1348,1349,
/
#
# 87 GLU 1HB 68 LYS 1HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1348,1025, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 87 GLU H 86 ILE QG1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1344, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1335,1336,
/
#
# 87 GLU QB 86 ILE QD1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.09, r4= 8.59,
igr1=1348,1349,
igr2=1338,1339,1340,
/
#
# 87 GLU QB 86 ILE QG1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 7.56, r4= 8.06,
igr1=1348,1349,
igr2=1335,1336,
/
#
# 87 GLU QB 86 ILE QD1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.74, r4= 7.24,
igr1=1348,1349,
igr2=1338,1339,1340,
/
#
# 86 ILE HB 86 ILE QD1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1329, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=1338,1339,1340,
/
#
# 87 GLU H 87 GLU HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1344,1346, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 87 GLU H 87 GLU QG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1344, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1351,1352,
/
#
# 87 GLU H 87 GLU 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1344,1349, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 87 GLU H 86 ILE HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1344,1329, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 87 GLU 1HB 87 GLU H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1348,1344, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 87 GLU HA 87 GLU 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1346,1349, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 87 GLU 1HB 87 GLU HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1348,1346, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 87 GLU QG 87 GLU 2HB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1349, r1= 1.35, r2= 1.85, r3= 3.37, r4= 3.87,
igr1=1351,1352,
/
#
# 87 GLU 1HB 87 GLU QG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1348, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1351,1352,
/
#
# 87 GLU 1HB 87 GLU QG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1348, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1351,1352,
/
#
# 87 GLU QG 87 GLU 2HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1349, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr1=1351,1352,
/
#
# 87 GLU HA 87 GLU 2HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1346,1349, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 87 GLU 1HB 87 GLU HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1348,1346, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 87 GLU HA 87 GLU QG 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1346, -1, r1= 1.35, r2= 1.85, r3= 7.30, r4= 7.80,
igr2=1351,1352,
/
#
# 87 GLU H 88 GLY H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1344,1359, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 87 GLU 1HB 88 GLY H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1348,1359, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 88 GLY H 87 GLU 2HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1359,1349, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 87 GLU H 91 LEU QD1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1344, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=1396,1397,1398,
/
#
# 87 GLU HA 91 LEU HG 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1346,1394, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 88 GLY 1HA 67 MET QG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1361, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1011,1012,
/
#
# 88 GLY 2HA 67 MET QG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1362, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1011,1012,
/
#
# 88 GLY 2HA 87 GLU H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1362,1344, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 88 GLY H 87 GLU HA 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=1359,1346, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 88 GLY H 87 GLU QG 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1359, -1, r1= 1.35, r2= 1.85, r3= 7.30, r4= 7.80,
igr2=1351,1352,
/
#
# 88 GLY 1HA 87 GLU HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1361,1346, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 88 GLY H 87 GLU HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1359,1346, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 88 GLY 1HA 88 GLY H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1361,1359, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 88 GLY 1HA 88 GLY 2HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1361,1362, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 88 GLY H 91 LEU H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1359,1387, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 88 GLY H 91 LEU HG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1359,1394, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 88 GLY H 91 LEU QD1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1359, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=1396,1397,1398,
/
#
# 88 GLY 1HA 91 LEU HG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1361,1394, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 88 GLY 2HA 91 LEU HG 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1362,1394, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 90 PRO QG 67 MET QG 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.53, r4= 4.03,
igr1=1377,1378,
igr2=1011,1012,
/
#
# 90 PRO QG 90 PRO 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1381, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr1=1377,1378,
/
#
# 90 PRO 1HB 90 PRO 2HB 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat=1380,1381, r1= 1.35, r2= 1.85, r3= 2.80, r4= 3.30, /
#
# 90 PRO 1HB 90 PRO 2HB 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat=1380,1381, r1= 1.35, r2= 1.85, r3= 2.80, r4= 3.30, /
#
# 90 PRO QG 90 PRO 1HB 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= -1,1380, r1= 1.35, r2= 1.85, r3= 3.14, r4= 3.64,
igr1=1377,1378,
/
#
# 90 PRO HA 90 PRO 2HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1383,1381, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 90 PRO HA 90 PRO 1HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1383,1380, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 90 PRO HA 90 PRO 2HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1383,1381, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 90 PRO QG 90 PRO 2HB 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= -1,1381, r1= 1.35, r2= 1.85, r3= 3.14, r4= 3.64,
igr1=1377,1378,
/
#
# 91 LEU HG 67 MET 2HG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1394,1012, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 91 LEU H 90 PRO HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1387,1383, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 91 LEU H 90 PRO QG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1387, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1377,1378,
/
#
# 91 LEU H 91 LEU HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1387,1389, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 91 LEU H 91 LEU QB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=1387, -1, r1= 1.35, r2= 1.85, r3= 3.37, r4= 3.87,
igr2=1391,1392,
/
#
# 91 LEU H 91 LEU HG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1387,1394, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 91 LEU QD1 91 LEU H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1387, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr1=1396,1397,1398,
/
#
# 91 LEU QD2 91 LEU HG 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1394, r1= 1.35, r2= 1.85, r3= 3.60, r4= 4.10,
igr1=1400,1401,1402,
/
#
# 91 LEU HA 91 LEU QB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1389, -1, r1= 1.35, r2= 1.85, r3= 7.30, r4= 7.80,
igr2=1391,1392,
/
#
# 91 LEU QD2 91 LEU HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1389, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr1=1400,1401,1402,
/
#
# 91 LEU QD1 91 LEU QB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.76, r4= 9.26,
igr1=1396,1397,1398,
igr2=1391,1392,
/
#
# 91 LEU H 91 LEU QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1387, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1391,1392,
/
#
# 91 LEU HA 91 LEU QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1389, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1391,1392,
/
#
# 91 LEU HG 91 LEU HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1394,1389, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 91 LEU H 92 GLY H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1387,1406, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 91 LEU H 92 GLY H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1387,1406, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 91 LEU HA 94 THR H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1389,1430, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 91 LEU H 95 LEU QD1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1387, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=1453,1454,1455,
/
#
# 91 LEU HA 95 LEU H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1389,1444, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 91 LEU HA 95 LEU QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1389, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1448,1449,
/
#
# 91 LEU QD2 95 LEU QD1 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 4.04, r4= 4.54,
igr1=1400,1401,1402,
igr2=1453,1454,1455,
/
#
# 95 LEU QQD 129 ILE 1HG1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1450,1972, r1= 1.35, r2= 1.85, r3= 8.20, r4= 8.70, /
#
# 95 LEU QD2 129 ILE 2HG1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1973, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1=1457,1458,1459,
/
#
# 91 LEU QD1 97 LYS HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1480, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1=1396,1397,1398,
/
#
# 91 LEU QD2 97 LYS HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1480, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr1=1400,1401,1402,
/
#
# 91 LEU QD2 98 ILE HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1504, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr1=1400,1401,1402,
/
#
# 91 LEU QD1 121 TYR HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1848, r1= 1.35, r2= 1.85, r3= 7.81, r4= 8.31,
igr1=1396,1397,1398,
/
#
# 92 GLY H 91 LEU QB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=1406, -1, r1= 1.35, r2= 1.85, r3= 3.37, r4= 3.87,
igr2=1391,1392,
/
#
# 92 GLY H 92 GLY QA 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=1406, -1, r1= 1.35, r2= 1.85, r3= 3.37, r4= 3.87,
igr2=1408,1409,
/
#
# 92 GLY QA 94 THR H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1430, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr1=1408,1409,
/
#
# 93 HIS QB 94 THR QG2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.09, r4= 8.59,
igr1=1417,1418,
igr2=1436,1437,1438,
/
#
# 93 HIS QB 94 THR QG2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.09, r4= 8.59,
igr1=1417,1418,
igr2=1436,1437,1438,
/
#
# 94 THR H 93 HIS QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1430, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1417,1418,
/
#
# 94 THR HA 93 HIS QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1432, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1417,1418,
/
#
# 94 THR HA 94 THR QG2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1432, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=1436,1437,1438,
/
#
# 94 THR H 94 THR HB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1430,1434, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 94 THR QG2 94 THR HB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1434, r1= 1.35, r2= 1.85, r3= 7.81, r4= 8.31,
igr1=1436,1437,1438,
/
#
# 94 THR QG2 94 THR HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1434, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr1=1436,1437,1438,
/
#
# 94 THR HA 94 THR HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1432,1434, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 94 THR H 95 LEU H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1430,1444, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 94 THR HA 95 LEU H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1432,1444, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 94 THR H 95 LEU HG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1430,1451, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 94 THR H 124 LYS QD 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1430, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1908,1909,
/
#
# 95 LEU QQD 94 THR H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1450,1430, r1= 1.35, r2= 1.85, r3= 7.20, r4= 7.70, /
#
# 95 LEU H 94 THR QG2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1444, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=1436,1437,1438,
/
#
# 95 LEU HA 94 THR HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1446,1434, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 95 LEU H 95 LEU HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1444,1446, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 95 LEU H 95 LEU QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1444, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1448,1449,
/
#
# 95 LEU H 95 LEU HG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1444,1451, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 95 LEU QQD 95 LEU H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1450,1444, r1= 1.35, r2= 1.85, r3= 7.20, r4= 7.70, /
#
# 95 LEU HA 95 LEU QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1446, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1448,1449,
/
#
# 95 LEU HA 95 LEU HG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1446,1451, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 95 LEU HA 96 GLU H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1446,1463, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 95 LEU QQD 96 GLU H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1450,1463, r1= 1.35, r2= 1.85, r3= 7.20, r4= 7.70, /
#
# 95 LEU QB 96 GLU HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1465, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr1=1448,1449,
/
#
# 95 LEU QQD 123 THR QG2 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat=1450, -1, r1= 1.35, r2= 1.85, r3= 5.56, r4= 6.06,
igr2=1890,1891,1892,
/
#
# 95 LEU QQD 129 ILE QD1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1450, -1, r1= 1.35, r2= 1.85, r3= 8.20, r4= 8.70,
igr2=1975,1976,1977,
/
#
# 95 LEU QQD 129 ILE QG1 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=1450, -1, r1= 1.35, r2= 1.85, r3= 5.57, r4= 6.07,
igr2=1972,1973,
/
#
# 95 LEU QQD 129 ILE HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1450,1966, r1= 1.35, r2= 1.85, r3= 8.20, r4= 8.70, /
#
# 96 GLU H 96 GLU HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1463,1465, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 96 GLU H 96 GLU QG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1463, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1470,1471,
/
#
# 96 GLU H 96 GLU QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1463, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1467,1468,
/
#
# 96 GLU QG 96 GLU QB 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.53, r4= 4.03,
igr1=1470,1471,
igr2=1467,1468,
/
#
# 96 GLU H 96 GLU QG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1463, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1470,1471,
/
#
# 96 GLU QG 96 GLU QB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.78, r4= 4.28,
igr1=1470,1471,
igr2=1467,1468,
/
#
# 96 GLU HA 96 GLU QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1465, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1467,1468,
/
#
# 96 GLU HA 96 GLU QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1465, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1467,1468,
/
#
# 96 GLU H 96 GLU QB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1463, -1, r1= 1.35, r2= 1.85, r3= 7.30, r4= 7.80,
igr2=1467,1468,
/
#
# 96 GLU HA 96 GLU QG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1465, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1470,1471,
/
#
# 96 GLU H 96 GLU HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1463,1465, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 96 GLU QG 97 LYS 1HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1482, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr1=1470,1471,
/
#
# 96 GLU 2HG 97 LYS QD 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1471, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1488,1489,
/
#
# 96 GLU QG 97 LYS QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.30, r4= 6.80,
igr1=1470,1471,
igr2=1482,1483,
/
#
# 97 LYS H 91 LEU QD2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1478, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=1400,1401,1402,
/
#
# 97 LYS H 91 LEU QD1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1478, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=1396,1397,1398,
/
#
# 97 LYS H 95 LEU HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1478,1446, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 97 LYS H 95 LEU HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1478,1446, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 97 LYS H 96 GLU H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1478,1463, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 97 LYS H 96 GLU H 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=1478,1463, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 97 LYS H 96 GLU HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1478,1465, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 97 LYS H 96 GLU QB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=1478, -1, r1= 1.35, r2= 1.85, r3= 3.37, r4= 3.87,
igr2=1467,1468,
/
#
# 97 LYS H 96 GLU QB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1478, -1, r1= 1.35, r2= 1.85, r3= 7.30, r4= 7.80,
igr2=1467,1468,
/
#
# 97 LYS H 97 LYS HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1478,1480, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 97 LYS H 97 LYS QG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1478, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1485,1486,
/
#
# 97 LYS HA 97 LYS QD 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1480, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1488,1489,
/
#
# 97 LYS QG 97 LYS QB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.78, r4= 4.28,
igr1=1485,1486,
igr2=1482,1483,
/
#
# 97 LYS HA 97 LYS QG 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1480, -1, r1= 1.35, r2= 1.85, r3= 7.30, r4= 7.80,
igr2=1485,1486,
/
#
# 97 LYS H 97 LYS QG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1478, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1485,1486,
/
#
# 97 LYS QG 97 LYS QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.30, r4= 6.80,
igr1=1485,1486,
igr2=1482,1483,
/
#
# 97 LYS QB 97 LYS QD 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.30, r4= 6.80,
igr1=1482,1483,
igr2=1488,1489,
/
#
# 97 LYS HA 97 LYS QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1480, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1482,1483,
/
#
# 97 LYS HA 97 LYS QG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1480, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1485,1486,
/
#
# 97 LYS QB 97 LYS QD 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.78, r4= 4.28,
igr1=1482,1483,
igr2=1488,1489,
/
#
# 97 LYS HA 98 ILE HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1480,1504, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 97 LYS H 122 HIS QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1478, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1871,1872,
/
#
# 98 ILE H 84 SER HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1500,1297, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 98 ILE H 85 ILE HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1500,1310, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 98 ILE H 91 LEU QD1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1500, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=1396,1397,1398,
/
#
# 98 ILE QD1 91 LEU QD1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1=1513,1514,1515,
igr2=1396,1397,1398,
/
#
# 98 ILE QG2 91 LEU QD1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.65, r4= 9.15,
igr1=1506,1507,1508,
igr2=1396,1397,1398,
/
#
# 98 ILE QG2 91 LEU QD2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.65, r4= 9.15,
igr1=1506,1507,1508,
igr2=1400,1401,1402,
/
#
# 98 ILE QD1 91 LEU QD2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.65, r4= 9.15,
igr1=1513,1514,1515,
igr2=1400,1401,1402,
/
#
# 98 ILE QD1 95 LEU QD1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.65, r4= 9.15,
igr1=1513,1514,1515,
igr2=1453,1454,1455,
/
#
# 98 ILE QG2 95 LEU QD1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.65, r4= 9.15,
igr1=1506,1507,1508,
igr2=1453,1454,1455,
/
#
# 98 ILE H 97 LYS H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1500,1478, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 98 ILE HB 98 ILE HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1504,1502, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 98 ILE QG2 98 ILE HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1502, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1=1506,1507,1508,
/
#
# 98 ILE QD1 98 ILE HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1502, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1=1513,1514,1515,
/
#
# 98 ILE QG2 98 ILE HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1502, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr1=1506,1507,1508,
/
#
# 98 ILE QD1 98 ILE HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1502, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1=1513,1514,1515,
/
#
# 98 ILE QD1 98 ILE HB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1504, r1= 1.35, r2= 1.85, r3= 7.81, r4= 8.31,
igr1=1513,1514,1515,
/
#
# 98 ILE QG2 98 ILE HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1504, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1=1506,1507,1508,
/
#
# 98 ILE QD1 91 LEU HG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1394, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1=1513,1514,1515,
/
#
# 98 ILE H 98 ILE HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1500,1504, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 98 ILE QG2 99 PRO HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1529, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1=1506,1507,1508,
/
#
# 98 ILE QG2 119 SER HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1815, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1=1506,1507,1508,
/
#
# 98 ILE QG2 119 SER HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1815, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1=1506,1507,1508,
/
#
# 98 ILE QD1 121 TYR QE 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.76, r4= 9.26,
igr1=1513,1514,1515,
igr2=1856,1861,
/
#
# 98 ILE QG2 121 TYR QE 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.09, r4= 8.59,
igr1=1506,1507,1508,
igr2=1856,1861,
/
#
# 98 ILE QG2 121 TYR HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1848, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr1=1506,1507,1508,
/
#
# 98 ILE QD1 121 TYR HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1848, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1=1513,1514,1515,
/
#
# 99 PRO HA 98 ILE HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1529,1502, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 100 TYR HA 99 PRO HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1535,1529, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 99 PRO QB 120 LYS QD 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.78, r4= 4.28,
igr1=1526,1527,
igr2=1834,1835,
/
#
# 99 PRO 2HB 120 LYS QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1527, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1828,1829,
/
#
# 99 PRO 2HG 120 LYS QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1524, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1828,1829,
/
#
# 99 PRO 1HB 120 LYS 2HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1526,1829, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 100 TYR H 84 SER HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1533,1297, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 100 TYR H 84 SER QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1533, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1299,1300,
/
#
# 100 TYR 2HB 84 SER HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1538,1297, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 100 TYR 1HB 84 SER HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1537,1297, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 100 TYR H 99 PRO HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1533,1529, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 100 TYR H 99 PRO QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1533, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1526,1527,
/
#
# 100 TYR H 99 PRO HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1533,1529, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 100 TYR 1HB 99 PRO HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1537,1529, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 100 TYR 2HB 99 PRO HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1538,1529, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 99 PRO HA 98 ILE HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1529,1504, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 100 TYR HA 99 PRO 2HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1535,1527, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 99 PRO 2HB 98 ILE HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1527,1502, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 100 TYR H 100 TYR 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1533,1538, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 100 TYR H 100 TYR 1HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1533,1537, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 100 TYR 1HB 100 TYR 2HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1537,1538, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 100 TYR 1HB 100 TYR 2HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1537,1538, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 100 TYR H 101 GLU HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1533,1556, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 100 TYR H 100 TYR HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1533,1535, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 100 TYR 2HB 102 ILE QD1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1538, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=1582,1583,1584,
/
#
# 100 TYR H 119 SER HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1533,1815, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 101 GLU H 100 TYR 1HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1554,1537, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 101 GLU H 100 TYR 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1554,1538, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 101 GLU HA 100 TYR 2HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1556,1538, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 101 GLU H 101 GLU HA 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=1554,1556, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 101 GLU H 100 TYR HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1554,1535, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 101 GLU H 101 GLU QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1554, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1558,1559,
/
#
# 101 GLU QB 101 GLU QG 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.53, r4= 4.03,
igr1=1558,1559,
igr2=1561,1562,
/
#
# 101 GLU QB 101 GLU QG 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.78, r4= 4.28,
igr1=1558,1559,
igr2=1561,1562,
/
#
# 101 GLU HA 101 GLU QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1556, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1558,1559,
/
#
# 101 GLU H 101 GLU QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1554, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1558,1559,
/
#
# 101 GLU HA 101 GLU QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1556, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1558,1559,
/
#
# 101 GLU HA 102 ILE QD1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1556, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=1582,1583,1584,
/
#
# 101 GLU H 117 ILE QG2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1554, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=1786,1787,1788,
/
#
# 101 GLU H 118 THR H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1554,1799, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 101 GLU H 118 THR H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1554,1799, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 101 GLU H 118 THR HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1554,1803, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 101 GLU H 118 THR HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1554,1801, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 101 GLU H 120 LYS 1HE 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1554,1837, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 102 ILE QG2 22 PHE QE 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.76, r4= 9.26,
igr1=1575,1576,1577,
igr2= 335, 339,
/
#
# 102 ILE 1HG1 81 TYR QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1579, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1246,1247,
/
#
# 102 ILE 2HG1 81 TYR QB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1580, -1, r1= 1.35, r2= 1.85, r3= 7.30, r4= 7.80,
igr2=1246,1247,
/
#
# 102 ILE 1HG1 81 TYR 1HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1579,1246, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 102 ILE H 82 CYS HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1569,1265, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 102 ILE H 101 GLU HA 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=1569,1556, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 102 ILE H 101 GLU QG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1569, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1561,1562,
/
#
# 102 ILE H 101 GLU QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1569, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1558,1559,
/
#
# 102 ILE 2HG1 101 GLU HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1580,1556, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 102 ILE HB 101 GLU HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1573,1556, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 102 ILE H 101 GLU HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1569,1556, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 102 ILE H 102 ILE HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1569,1571, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 102 ILE H 102 ILE HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1569,1573, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 102 ILE H 102 ILE 1HG1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1569,1579, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 102 ILE H 102 ILE QG2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1569, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=1575,1576,1577,
/
#
# 102 ILE QG2 102 ILE QD1 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 4.04, r4= 4.54,
igr1=1575,1576,1577,
igr2=1582,1583,1584,
/
#
# 102 ILE HA 102 ILE QG2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1571, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=1575,1576,1577,
/
#
# 102 ILE H 102 ILE QG2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1569, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=1575,1576,1577,
/
#
# 102 ILE 2HG1 102 ILE QG2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1580, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=1575,1576,1577,
/
#
# 102 ILE 1HG1 102 ILE QD1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1579, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=1582,1583,1584,
/
#
# 102 ILE 1HG1 102 ILE 2HG1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1579,1580, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 102 ILE 1HG1 102 ILE 2HG1 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1579,1580, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 102 ILE 2HG1 102 ILE HB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1580,1573, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 102 ILE H 102 ILE 1HG1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1569,1579, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 102 ILE 1HG1 102 ILE HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1579,1573, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 102 ILE HB 102 ILE QG2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1573, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=1575,1576,1577,
/
#
# 102 ILE HB 102 ILE QD1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1573, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=1582,1583,1584,
/
#
# 102 ILE HB 102 ILE HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1573,1571, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 102 ILE 2HG1 102 ILE QG2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1580, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=1575,1576,1577,
/
#
# 102 ILE HB 102 ILE QG2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1573, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=1575,1576,1577,
/
#
# 102 ILE 2HG1 102 ILE QD1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1580, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=1582,1583,1584,
/
#
# 102 ILE 1HG1 102 ILE QG2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1579, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=1575,1576,1577,
/
#
# 102 ILE 1HG1 102 ILE HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1579,1573, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 102 ILE H 102 ILE 2HG1 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1569,1580, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 102 ILE QG2 115 LEU QD2 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 9.37, r4= 9.87,
igr1=1575,1576,1577,
igr2=1752,1753,1754,
/
#
# 102 ILE HA 115 LEU QD1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1571, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=1748,1749,1750,
/
#
# 103 LYS 2HB 80 LYS QG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1593, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1227,1228,
/
#
# 103 LYS 1HB 80 LYS QG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1592, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1227,1228,
/
#
# 103 LYS 1HB 80 LYS QE 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1592, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1233,1234,
/
#
# 103 LYS HA 80 LYS HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1590,1222, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 103 LYS 1HE 80 LYS 2HD 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=1601,1231, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 103 LYS H 102 ILE HA 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=1588,1571, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 103 LYS H 102 ILE QG2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1588, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=1575,1576,1577,
/
#
# 103 LYS H 102 ILE QG2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1588, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=1575,1576,1577,
/
#
# 103 LYS H 103 LYS HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1588,1590, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 103 LYS H 103 LYS 1HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1588,1592, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 103 LYS H 103 LYS 2HB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=1588,1593, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 103 LYS H 116 LYS QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1588, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1762,1763,
/
#
# 103 LYS H 103 LYS QG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1588, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1595,1596,
/
#
# 103 LYS QG 103 LYS QD 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.53, r4= 4.03,
igr1=1595,1596,
igr2=1598,1599,
/
#
# 103 LYS QG 103 LYS QE 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.30, r4= 6.80,
igr1=1595,1596,
igr2=1601,1602,
/
#
# 105 ALA QB 103 LYS 2HE 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1602, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1=1631,1632,1633,
/
#
# 103 LYS QE 103 LYS QD 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.30, r4= 6.80,
igr1=1601,1602,
igr2=1598,1599,
/
#
# 103 LYS QG 103 LYS 2HB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1593, r1= 1.35, r2= 1.85, r3= 3.37, r4= 3.87,
igr1=1595,1596,
/
#
# 103 LYS QG 103 LYS QE 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.30, r4= 6.80,
igr1=1595,1596,
igr2=1601,1602,
/
#
# 103 LYS QG 103 LYS 1HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1592, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr1=1595,1596,
/
#
# 103 LYS 1HB 103 LYS QD 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1592, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1598,1599,
/
#
# 103 LYS QG 103 LYS 1HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1592, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr1=1595,1596,
/
#
# 103 LYS 2HB 103 LYS QD 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1593, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1598,1599,
/
#
# 103 LYS QG 103 LYS 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1593, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr1=1595,1596,
/
#
# 103 LYS 1HB 103 LYS QD 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1592, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1598,1599,
/
#
# 103 LYS 1HB 103 LYS 2HB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1592,1593, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 103 LYS HA 103 LYS 2HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1590,1593, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 103 LYS HA 103 LYS 1HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1590,1592, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 103 LYS HA 103 LYS 1HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1590,1592, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 103 LYS QE 103 LYS QD 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.78, r4= 4.28,
igr1=1601,1602,
igr2=1598,1599,
/
#
# 103 LYS 2HB 103 LYS QE 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=1593, -1, r1= 1.35, r2= 1.85, r3= 3.37, r4= 3.87,
igr2=1601,1602,
/
#
# 103 LYS 1HB 103 LYS QE 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1592, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1601,1602,
/
#
# 103 LYS 2HB 103 LYS QD 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat=1593, -1, r1= 1.35, r2= 1.85, r3= 3.14, r4= 3.64,
igr2=1598,1599,
/
#
# 103 LYS QG 103 LYS QD 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.53, r4= 4.03,
igr1=1595,1596,
igr2=1598,1599,
/
#
# 103 LYS HA 115 LEU QD1 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1590, -1, r1= 1.35, r2= 1.85, r3= 7.81, r4= 8.31,
igr2=1748,1749,1750,
/
#
# 103 LYS H 117 ILE HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1588,1782, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 104 MET H 79 PHE QD 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1610, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1208,1216,
/
#
# 104 MET H 79 PHE QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1610, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1204,1205,
/
#
# 104 MET H 80 LYS QG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1610, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1227,1228,
/
#
# 104 MET H 80 LYS HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1610,1222, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 104 MET H 103 LYS H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1610,1588, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 104 MET H 103 LYS HA 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=1610,1590, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 104 MET H 103 LYS 1HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1610,1592, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 104 MET H 103 LYS 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1610,1593, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 104 MET H 103 LYS QG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1610, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1595,1596,
/
#
# 104 MET 2HG 103 LYS HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1618,1590, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 104 MET H 103 LYS HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1610,1590, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 104 MET 1HG 103 LYS HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1617,1590, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 104 MET H 104 MET HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1610,1612, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 104 MET H 104 MET 2HG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1610,1618, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 104 MET H 104 MET 2HG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1610,1618, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 104 MET H 104 MET 1HG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1610,1617, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 104 MET 1HG 104 MET QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1617, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1614,1615,
/
#
# 104 MET 1HG 104 MET 2HG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1617,1618, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 104 MET 1HG 104 MET 2HG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1617,1618, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 104 MET 1HG 104 MET QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1617, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1614,1615,
/
#
# 104 MET 2HG 104 MET QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1618, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1614,1615,
/
#
# 104 MET HA 104 MET 1HG 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1612,1617, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 104 MET H 105 ALA HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1610,1629, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 104 MET HA 105 ALA QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1612, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=1631,1632,1633,
/
#
# 104 MET HA 105 ALA HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1612,1629, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 104 MET HA 114 ILE HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1612,1724, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 104 MET HA 114 ILE QG2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1612, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=1726,1727,1728,
/
#
# 104 MET HA 114 ILE HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1612,1722, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 104 MET 1HG 115 LEU QD1 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1617, -1, r1= 1.35, r2= 1.85, r3= 7.81, r4= 8.31,
igr2=1748,1749,1750,
/
#
# 104 MET 1HG 115 LEU QD2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1617, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=1752,1753,1754,
/
#
# 105 ALA HA 79 PHE QD 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1629, -1, r1= 1.35, r2= 1.85, r3= 7.30, r4= 7.80,
igr2=1208,1216,
/
#
# 105 ALA H 103 LYS QG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1627, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1595,1596,
/
#
# 105 ALA HA 103 LYS QG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1629, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1595,1596,
/
#
# 105 ALA QB 103 LYS 1HD 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1598, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr1=1631,1632,1633,
/
#
# 105 ALA QB 103 LYS QE 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.76, r4= 9.26,
igr1=1631,1632,1633,
igr2=1601,1602,
/
#
# 105 ALA HA 103 LYS QE 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1629, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1601,1602,
/
#
# 105 ALA HA 103 LYS QE 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1629, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1601,1602,
/
#
# 3 PHE HA 3 PHE 2HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 29, 32, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 105 ALA H 104 MET HA 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=1627,1612, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 105 ALA H 104 MET 1HG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1627,1617, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 105 ALA H 104 MET 1HG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1627,1617, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 105 ALA H 104 MET 2HG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1627,1618, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 105 ALA HA 104 MET QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1629, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1614,1615,
/
#
# 105 ALA H 104 MET HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1627,1612, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 104 MET H 104 MET HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1610,1612, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 105 ALA H 105 ALA HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1627,1629, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 105 ALA H 105 ALA QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1627, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=1631,1632,1633,
/
#
# 105 ALA H 103 LYS QG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1627, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1595,1596,
/
#
# 105 ALA HA 105 ALA QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1629, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=1631,1632,1633,
/
#
# 105 ALA H 105 ALA QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1627, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=1631,1632,1633,
/
#
# 105 ALA HA 105 ALA QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1629, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=1631,1632,1633,
/
#
# 105 ALA HA 106 ALA QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1629, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=1641,1642,1643,
/
#
# 105 ALA HA 106 ALA H 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=1629,1637, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 105 ALA HA 106 ALA QB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1629, -1, r1= 1.35, r2= 1.85, r3= 7.81, r4= 8.31,
igr2=1641,1642,1643,
/
#
# 105 ALA QB 106 ALA H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1637, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr1=1631,1632,1633,
/
#
# 105 ALA H 114 ILE H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1627,1720, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 105 ALA H 114 ILE QG2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1627, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=1726,1727,1728,
/
#
# 105 ALA QB 114 ILE 1HG1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1730, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr1=1631,1632,1633,
/
#
# 105 ALA H 115 LEU HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1627,1741, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 106 ALA HA 106 ALA H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1639,1637, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 106 ALA H 106 ALA QB 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat=1637, -1, r1= 1.35, r2= 1.85, r3= 3.36, r4= 3.86,
igr2=1641,1642,1643,
/
#
# 105 ALA QB 106 ALA H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1637, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1=1631,1632,1633,
/
#
# 106 ALA HA 106 ALA QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1639, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=1641,1642,1643,
/
#
# 106 ALA HA 106 ALA QB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=1639, -1, r1= 1.35, r2= 1.85, r3= 3.60, r4= 4.10,
igr2=1641,1642,1643,
/
#
# 106 ALA H 106 ALA QB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1637, -1, r1= 1.35, r2= 1.85, r3= 7.81, r4= 8.31,
igr2=1641,1642,1643,
/
#
# 106 ALA QB 107 ALA H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1647, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr1=1641,1642,1643,
/
#
# 107 ALA HA 107 ALA H 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=1649,1647, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 106 ALA HA 107 ALA H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1639,1647, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 107 ALA QB 107 ALA H 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1647, r1= 1.35, r2= 1.85, r3= 3.60, r4= 4.10,
igr1=1651,1652,1653,
/
#
# 107 ALA QB 107 ALA H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1647, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1=1651,1652,1653,
/
#
# 107 ALA QB 107 ALA HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1649, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr1=1651,1652,1653,
/
#
# 107 ALA QB 106 ALA HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1639, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1=1651,1652,1653,
/
#
# 107 ALA QB 107 ALA HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1649, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1=1651,1652,1653,
/
#
# 107 ALA HA 114 ILE 1HG1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1649,1730, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 107 ALA HA 108 PRO QD 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1649, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1658,1659,
/
#
# 107 ALA QB 109 HIS H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1671, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr1=1651,1652,1653,
/
#
# 107 ALA QB 110 GLY 1HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1690, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1=1651,1652,1653,
/
#
# 112 GLY 1HA 107 ALA QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1704, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=1651,1652,1653,
/
#
# 107 ALA QB 108 PRO QD 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.09, r4= 8.59,
igr1=1651,1652,1653,
igr2=1658,1659,
/
#
# 107 ALA H 110 GLY 2HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1647,1691, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 107 ALA H 110 GLY 1HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1647,1690, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 107 ALA HA 114 ILE QD1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1649, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=1733,1734,1735,
/
#
# 107 ALA HA 114 ILE QD1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1649, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=1733,1734,1735,
/
#
# 106 ALA HA 114 ILE QD1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1639, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=1733,1734,1735,
/
#
# 108 PRO HA 108 PRO QG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1667, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1661,1662,
/
#
# 108 PRO HA 108 PRO 1HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1667,1664, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 108 PRO QD 108 PRO HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1667, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr1=1658,1659,
/
#
# 108 PRO HA 108 PRO QG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1667, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1661,1662,
/
#
# 107 ALA HA 108 PRO QG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1649, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1661,1662,
/
#
# 108 PRO QD 108 PRO 2HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1665, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr1=1658,1659,
/
#
# 108 PRO QD 108 PRO QG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.30, r4= 6.80,
igr1=1658,1659,
igr2=1661,1662,
/
#
# 108 PRO QD 108 PRO 1HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1664, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr1=1658,1659,
/
#
# 108 PRO 2HB 108 PRO QG 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=1665, -1, r1= 1.35, r2= 1.85, r3= 3.37, r4= 3.87,
igr2=1661,1662,
/
#
# 108 PRO QD 108 PRO HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1667, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr1=1658,1659,
/
#
# 108 PRO 1HB 108 PRO QG 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat=1664, -1, r1= 1.35, r2= 1.85, r3= 3.14, r4= 3.64,
igr2=1661,1662,
/
#
# 108 PRO 2HB 108 PRO QG 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat=1665, -1, r1= 1.35, r2= 1.85, r3= 3.14, r4= 3.64,
igr2=1661,1662,
/
#
# 108 PRO 1HB 108 PRO 2HB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=1664,1665, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 108 PRO QD 108 PRO 1HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1664, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr1=1658,1659,
/
#
# 108 PRO HA 108 PRO 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1667,1665, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 108 PRO QD 108 PRO 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1665, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr1=1658,1659,
/
#
# 108 PRO HA 108 PRO 1HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1667,1664, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 108 PRO HA 108 PRO 2HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1667,1665, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 108 PRO 1HB 108 PRO QG 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=1664, -1, r1= 1.35, r2= 1.85, r3= 3.37, r4= 3.87,
igr2=1661,1662,
/
#
# 108 PRO QD 108 PRO QG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.30, r4= 6.80,
igr1=1658,1659,
igr2=1661,1662,
/
#
# 108 PRO 1HB 108 PRO 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1664,1665, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 109 HIS H 108 PRO QD 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1671, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1658,1659,
/
#
# 109 HIS HA 108 PRO 1HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1673,1664, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 109 HIS H 109 HIS HD2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1671,1684, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 109 HIS H 109 HIS HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1671,1673, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 109 HIS HA 109 HIS QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1673, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1675,1676,
/
#
# 109 HIS HA 109 HIS QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1673, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1675,1676,
/
#
# 109 HIS HD2 109 HIS QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1684, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1675,1676,
/
#
# 109 HIS HA 110 GLY 1HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1673,1690, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 109 HIS HA 110 GLY 2HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1673,1691, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 109 HIS HA 111 GLY H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1673,1695, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 110 GLY 1HA 109 HIS QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1690, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1675,1676,
/
#
# 110 GLY 1HA 110 GLY 2HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1690,1691, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 110 GLY 1HA 110 GLY 2HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1690,1691, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 111 GLY QA 110 GLY 1HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1690, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr1=1697,1698,
/
#
# 112 GLY 1HA 111 GLY QA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1704, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1697,1698,
/
#
# 111 GLY H 110 GLY 2HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1695,1691, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 111 GLY H 111 GLY QA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1695, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1697,1698,
/
#
# 112 GLY H 107 ALA QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1702, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=1651,1652,1653,
/
#
# 112 GLY H 111 GLY QA 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=1702, -1, r1= 1.35, r2= 1.85, r3= 3.37, r4= 3.87,
igr2=1697,1698,
/
#
# 112 GLY H 111 GLY QA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1702, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1697,1698,
/
#
# 112 GLY 2HA 112 GLY H 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=1705,1702, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 112 GLY 1HA 112 GLY H 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=1704,1702, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 112 GLY 1HA 112 GLY 2HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1704,1705, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 112 GLY 1HA 112 GLY H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1704,1702, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 112 GLY 2HA 112 GLY H 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1705,1702, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 112 GLY 1HA 112 GLY 2HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1704,1705, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 113 SER H 10 THR HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1709, 133, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 113 SER H 11 SER 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1709, 150, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 113 SER H 12 VAL HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1709, 158, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 113 SER HA 106 ALA HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1711,1639, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 113 SER H 107 ALA QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1709, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=1651,1652,1653,
/
#
# 113 SER HA 107 ALA H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1711,1647, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 113 SER HA 107 ALA HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1711,1649, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 113 SER H 112 GLY H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1709,1702, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 113 SER H 112 GLY 2HA 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=1709,1705, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 36 GLN H 36 GLN HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 542, 544, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 113 SER H 112 GLY 1HA 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=1709,1704, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 36 GLN H 35 PRO QD 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 542, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2= 529, 530,
/
#
# 113 SER H 11 SER 1HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1709, 149, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 113 SER H 112 GLY H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1709,1702, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 113 SER H 112 GLY 2HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1709,1705, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 113 SER H 112 GLY 1HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1709,1704, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 113 SER H 113 SER HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1709,1711, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 113 SER H 113 SER HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1709,1711, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 114 ILE QG2 10 THR HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 133, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1=1726,1727,1728,
/
#
# 114 ILE QG2 10 THR QG2 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 4.33, r4= 4.83,
igr1=1726,1727,1728,
igr2= 137, 138, 139,
/
#
# 114 ILE QG2 114 ILE 1HG1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1730, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1=1726,1727,1728,
/
#
# 114 ILE H 105 ALA QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1720, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=1631,1632,1633,
/
#
# 114 ILE H 105 ALA QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1720, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=1631,1632,1633,
/
#
# 114 ILE H 106 ALA HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1720,1639, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 114 ILE H 107 ALA HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1720,1649, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 114 ILE H 107 ALA H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1720,1647, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 114 ILE QD1 107 ALA H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1647, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr1=1733,1734,1735,
/
#
# 114 ILE H 107 ALA QB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1720, -1, r1= 1.35, r2= 1.85, r3= 7.81, r4= 8.31,
igr2=1651,1652,1653,
/
#
# 114 ILE 2HG1 107 ALA H 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1731,1647, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 114 ILE QD1 108 PRO QD 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.09, r4= 8.59,
igr1=1733,1734,1735,
igr2=1658,1659,
/
#
# 114 ILE 1HG1 108 PRO QD 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1730, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1658,1659,
/
#
# 107 ALA QB 108 PRO QD 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.09, r4= 8.59,
igr1=1651,1652,1653,
igr2=1658,1659,
/
#
# 114 ILE QD1 108 PRO QD 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.76, r4= 9.26,
igr1=1733,1734,1735,
igr2=1658,1659,
/
#
# 114 ILE QD1 108 PRO QG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.09, r4= 8.59,
igr1=1733,1734,1735,
igr2=1661,1662,
/
#
# 114 ILE QD1 108 PRO 2HB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1665, r1= 1.35, r2= 1.85, r3= 7.81, r4= 8.31,
igr1=1733,1734,1735,
/
#
# 114 ILE H 113 SER HA 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=1720,1711, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 114 ILE H 113 SER QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1720, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1713,1714,
/
#
# 114 ILE HA 113 SER QB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1722, -1, r1= 1.35, r2= 1.85, r3= 7.30, r4= 7.80,
igr2=1713,1714,
/
#
# 114 ILE H 114 ILE HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1720,1722, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 114 ILE H 114 ILE HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1720,1724, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 114 ILE H 114 ILE 1HG1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1720,1730, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 114 ILE H 107 ALA QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1720, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=1651,1652,1653,
/
#
# 114 ILE H 114 ILE QD1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1720, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=1733,1734,1735,
/
#
# 114 ILE QG2 114 ILE QD1 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 4.04, r4= 4.54,
igr1=1726,1727,1728,
igr2=1733,1734,1735,
/
#
# 114 ILE 2HG1 114 ILE QD1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1731, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=1733,1734,1735,
/
#
# 114 ILE 1HG1 114 ILE 2HG1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1730,1731, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 114 ILE 1HG1 114 ILE QD1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1730, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=1733,1734,1735,
/
#
# 107 ALA QB 114 ILE QD1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.65, r4= 9.15,
igr1=1651,1652,1653,
igr2=1733,1734,1735,
/
#
# 10 THR QG2 114 ILE QD1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.65, r4= 9.15,
igr1= 137, 138, 139,
igr2=1733,1734,1735,
/
#
# 114 ILE QG2 114 ILE QD1 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 4.04, r4= 4.54,
igr1=1726,1727,1728,
igr2=1733,1734,1735,
/
#
# 114 ILE QG2 114 ILE HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1722, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1=1726,1727,1728,
/
#
# 114 ILE 1HG1 114 ILE QD1 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=1730, -1, r1= 1.35, r2= 1.85, r3= 3.60, r4= 4.10,
igr2=1733,1734,1735,
/
#
# 114 ILE QG2 114 ILE 1HG1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1730, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr1=1726,1727,1728,
/
#
# 114 ILE HB 114 ILE QD1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1724, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=1733,1734,1735,
/
#
# 114 ILE 1HG1 114 ILE 2HG1 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=1730,1731, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 10 THR QG2 114 ILE 2HG1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1731, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1= 137, 138, 139,
/
#
# 107 ALA QB 114 ILE 2HG1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1731, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1=1651,1652,1653,
/
#
# 114 ILE 2HG1 114 ILE QD1 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=1731, -1, r1= 1.35, r2= 1.85, r3= 3.60, r4= 4.10,
igr2=1733,1734,1735,
/
#
# 114 ILE HB 114 ILE QD1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1724, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=1733,1734,1735,
/
#
# 114 ILE H 114 ILE HB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1720,1724, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 115 LEU H 114 ILE HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1739,1724, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 114 ILE QG2 114 ILE HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1724, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr1=1726,1727,1728,
/
#
# 114 ILE HB 114 ILE 1HG1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1724,1730, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 107 ALA QB 114 ILE HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1724, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1=1651,1652,1653,
/
#
# 114 ILE QG2 114 ILE HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1722, r1= 1.35, r2= 1.85, r3= 7.81, r4= 8.31,
igr1=1726,1727,1728,
/
#
# 114 ILE HB 114 ILE 2HG1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1724,1731, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 114 ILE HA 115 LEU QB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1722, -1, r1= 1.35, r2= 1.85, r3= 7.30, r4= 7.80,
igr2=1743,1744,
/
#
# 114 ILE QG2 116 LYS HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1760, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr1=1726,1727,1728,
/
#
# 114 ILE QG2 116 LYS HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1760, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr1=1726,1727,1728,
/
#
# 115 LEU HA 114 ILE QG2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1741, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=1726,1727,1728,
/
#
# 114 ILE QG2 10 THR HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 133, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1=1726,1727,1728,
/
#
# 115 LEU H 9 ALA QB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=1739, -1, r1= 1.35, r2= 1.85, r3= 3.60, r4= 4.10,
igr2= 125, 126, 127,
/
#
# 115 LEU H 9 ALA QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1739, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2= 125, 126, 127,
/
#
# 115 LEU H 10 THR HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1739, 133, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 115 LEU H 115 LEU HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1739,1741, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 115 LEU HA 104 MET QB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1741, -1, r1= 1.35, r2= 1.85, r3= 7.30, r4= 7.80,
igr2=1614,1615,
/
#
# 115 LEU HA 104 MET 2HG 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1741,1618, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 115 LEU HA 104 MET QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1741, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1614,1615,
/
#
# 115 LEU H 114 ILE HA 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=1739,1722, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 115 LEU H 114 ILE QG2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1739, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=1726,1727,1728,
/
#
# 115 LEU HA 114 ILE QG2 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1741, -1, r1= 1.35, r2= 1.85, r3= 7.81, r4= 8.31,
igr2=1726,1727,1728,
/
#
# 115 LEU HA 18 LEU QD2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1741, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2= 266, 267, 268,
/
#
# 115 LEU HA 114 ILE HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1741,1722, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 10 THR HA 114 ILE HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 133,1722, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 115 LEU HA 115 LEU HG 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1741,1746, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 116 LYS HA 115 LEU HG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1760,1746, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 115 LEU QD2 115 LEU QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.09, r4= 8.59,
igr1=1752,1753,1754,
igr2=1743,1744,
/
#
# 115 LEU QD1 115 LEU QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.09, r4= 8.59,
igr1=1748,1749,1750,
igr2=1743,1744,
/
#
# 115 LEU HA 115 LEU QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1741, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1743,1744,
/
#
# 115 LEU HA 115 LEU QD1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1741, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=1748,1749,1750,
/
#
# 115 LEU HA 115 LEU HG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1741,1746, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 115 LEU HA 115 LEU QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1741, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1743,1744,
/
#
# 115 LEU QD1 115 LEU QD2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1=1748,1749,1750,
igr2=1752,1753,1754,
/
#
# 115 LEU QD1 115 LEU QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.09, r4= 8.59,
igr1=1748,1749,1750,
igr2=1743,1744,
/
#
# 115 LEU HG 115 LEU QD1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1746, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=1748,1749,1750,
/
#
# 115 LEU HG 115 LEU QD2 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1746, -1, r1= 1.35, r2= 1.85, r3= 7.81, r4= 8.31,
igr2=1752,1753,1754,
/
#
# 115 LEU QD2 115 LEU QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.09, r4= 8.59,
igr1=1752,1753,1754,
igr2=1743,1744,
/
#
# 115 LEU HA 116 LYS QB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1741, -1, r1= 1.35, r2= 1.85, r3= 7.30, r4= 7.80,
igr2=1762,1763,
/
#
# 115 LEU H 152 LEU QQD 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1739,2323, r1= 1.35, r2= 1.85, r3= 7.20, r4= 7.70, /
#
# 115 LEU HA 152 LEU QD1 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1741, -1, r1= 1.35, r2= 1.85, r3= 7.81, r4= 8.31,
igr2=2326,2327,2328,
/
#
# 115 LEU H 152 LEU QQD 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1739,2323, r1= 1.35, r2= 1.85, r3= 8.20, r4= 8.70, /
#
# 116 LYS H 8 GLU QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1758, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2= 110, 111,
/
#
# 116 LYS 1HB 103 LYS 1HB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=1762,1592, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 103 LYS 1HB 103 LYS 2HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1592,1593, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 116 LYS H 104 MET HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1758,1612, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 116 LYS H 104 MET HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1758,1612, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 116 LYS H 115 LEU HG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1758,1746, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 116 LYS H 115 LEU HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1758,1741, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 116 LYS HA 115 LEU QD1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1760, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=1748,1749,1750,
/
#
# 116 LYS HA 115 LEU QD1 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1760, -1, r1= 1.35, r2= 1.85, r3= 7.81, r4= 8.31,
igr2=1748,1749,1750,
/
#
# 115 LEU HA 115 LEU QD1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1741, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=1748,1749,1750,
/
#
# 116 LYS H 115 LEU QD1 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1758, -1, r1= 1.35, r2= 1.85, r3= 7.81, r4= 8.31,
igr2=1748,1749,1750,
/
#
# 116 LYS H 116 LYS HA 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=1758,1760, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 116 LYS H 115 LEU HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1758,1741, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 116 LYS H 116 LYS QB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=1758, -1, r1= 1.35, r2= 1.85, r3= 3.37, r4= 3.87,
igr2=1762,1763,
/
#
# 116 LYS H 116 LYS QG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1758, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1765,1766,
/
#
# 116 LYS QE 116 LYS QD 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.53, r4= 4.03,
igr1=1771,1772,
igr2=1768,1769,
/
#
# 116 LYS QB 116 LYS QE 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.30, r4= 6.80,
igr1=1762,1763,
igr2=1771,1772,
/
#
# 116 LYS QB 116 LYS QD 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.53, r4= 4.03,
igr1=1762,1763,
igr2=1768,1769,
/
#
# 116 LYS QG 116 LYS QD 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.53, r4= 4.03,
igr1=1765,1766,
igr2=1768,1769,
/
#
# 116 LYS QE 116 LYS QD 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.30, r4= 6.80,
igr1=1771,1772,
igr2=1768,1769,
/
#
# 116 LYS QB 116 LYS QG 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.78, r4= 4.28,
igr1=1762,1763,
igr2=1765,1766,
/
#
# 116 LYS QG 116 LYS QD 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.53, r4= 4.03,
igr1=1765,1766,
igr2=1768,1769,
/
#
# 116 LYS HA 116 LYS QG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1760, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1765,1766,
/
#
# 116 LYS H 116 LYS QG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1758, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1765,1766,
/
#
# 117 ILE H 116 LYS QG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1780, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1765,1766,
/
#
# 7 ASP H 116 LYS QG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 94, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1765,1766,
/
#
# 116 LYS QB 116 LYS QG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.30, r4= 6.80,
igr1=1762,1763,
igr2=1765,1766,
/
#
# 116 LYS H 116 LYS QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1758, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1762,1763,
/
#
# 116 LYS HA 116 LYS QG 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1760, -1, r1= 1.35, r2= 1.85, r3= 7.30, r4= 7.80,
igr2=1765,1766,
/
#
# 116 LYS QG 116 LYS QE 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.78, r4= 4.28,
igr1=1765,1766,
igr2=1771,1772,
/
#
# 116 LYS HA 117 ILE HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1760,1782, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 116 LYS QG 117 ILE HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1782, r1= 1.35, r2= 1.85, r3= 7.30, r4= 7.80,
igr1=1765,1766,
/
#
# 117 ILE HA 102 ILE 2HG1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1782,1580, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 117 ILE H 8 GLU HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1780, 108, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 117 ILE QG2 100 TYR HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1535, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1=1786,1787,1788,
/
#
# 117 ILE QG2 102 ILE 2HG1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1580, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr1=1786,1787,1788,
/
#
# 117 ILE QG2 102 ILE HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1573, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1=1786,1787,1788,
/
#
# 117 ILE QD1 102 ILE QD1 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 4.33, r4= 4.83,
igr1=1793,1794,1795,
igr2=1582,1583,1584,
/
#
# 117 ILE QD1 102 ILE QG2 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 4.04, r4= 4.54,
igr1=1793,1794,1795,
igr2=1575,1576,1577,
/
#
# 117 ILE QG2 102 ILE 1HG1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1579, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr1=1786,1787,1788,
/
#
# 117 ILE QG2 102 ILE 2HG1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1580, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr1=1786,1787,1788,
/
#
# 117 ILE QG2 102 ILE HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1571, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1=1786,1787,1788,
/
#
# 102 ILE HA 102 ILE QG2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1571, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=1575,1576,1577,
/
#
# 117 ILE QD1 102 ILE QD1 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 4.33, r4= 4.83,
igr1=1793,1794,1795,
igr2=1582,1583,1584,
/
#
# 117 ILE QG2 117 ILE QD1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.65, r4= 9.15,
igr1=1786,1787,1788,
igr2=1793,1794,1795,
/
#
# 117 ILE QD1 152 LEU QD1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.65, r4= 9.15,
igr1=1793,1794,1795,
igr2=2326,2327,2328,
/
#
# 117 ILE HB 102 ILE QG2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1784, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=1575,1576,1577,
/
#
# 117 ILE HB 117 ILE QG2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1784, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=1786,1787,1788,
/
#
# 117 ILE QG2 102 ILE HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1571, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr1=1786,1787,1788,
/
#
# 117 ILE QD1 102 ILE 2HG1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1580, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr1=1793,1794,1795,
/
#
# 117 ILE HA 102 ILE HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1782,1571, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 117 ILE QD1 115 LEU QD1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1=1793,1794,1795,
igr2=1748,1749,1750,
/
#
# 117 ILE QG2 115 LEU QD2 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 9.37, r4= 9.87,
igr1=1786,1787,1788,
igr2=1752,1753,1754,
/
#
# 117 ILE HA 115 LEU QD2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1782, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=1752,1753,1754,
/
#
# 117 ILE HB 115 LEU HG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1784,1746, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 117 ILE H 116 LYS HA 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=1780,1760, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 117 ILE H 116 LYS QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1780, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1762,1763,
/
#
# 117 ILE H 116 LYS QG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1780, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1765,1766,
/
#
# 117 ILE H 117 ILE HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1780,1784, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 117 ILE H 117 ILE QG2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1780, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=1786,1787,1788,
/
#
# 117 ILE H 117 ILE QD1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1780, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=1793,1794,1795,
/
#
# 117 ILE HB 117 ILE QD1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1784, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=1793,1794,1795,
/
#
# 117 ILE QD1 117 ILE HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1782, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1=1793,1794,1795,
/
#
# 117 ILE H 117 ILE QD1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1780, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=1793,1794,1795,
/
#
# 117 ILE QG2 117 ILE QD1 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 4.04, r4= 4.54,
igr1=1786,1787,1788,
igr2=1793,1794,1795,
/
#
# 148 VAL QG2 117 ILE QG2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.65, r4= 9.15,
igr1=2265,2266,2267,
igr2=1786,1787,1788,
/
#
# 117 ILE HB 117 ILE QG2 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=1784, -1, r1= 1.35, r2= 1.85, r3= 3.60, r4= 4.10,
igr2=1786,1787,1788,
/
#
# 117 ILE H 117 ILE HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1780,1784, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 117 ILE H 117 ILE HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1780,1782, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 118 THR HB 101 GLU QG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1803, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1561,1562,
/
#
# 118 THR HB 101 GLU QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1803, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1558,1559,
/
#
# 118 THR H 102 ILE 1HG1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1799,1579, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 118 THR H 117 ILE HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1799,1784, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 118 THR H 102 ILE QG2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1799, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=1575,1576,1577,
/
#
# 118 THR H 102 ILE HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1799,1571, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 118 THR H 117 ILE QG2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1799, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=1786,1787,1788,
/
#
# 118 THR H 118 THR HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1799,1803, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 118 THR H 118 THR QG2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1799, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=1805,1806,1807,
/
#
# 118 THR HB 118 THR QG2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1803, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=1805,1806,1807,
/
#
# 118 THR QG2 119 SER HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1815, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1=1805,1806,1807,
/
#
# 5 TYR HA 118 THR QG2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 60, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=1805,1806,1807,
/
#
# 118 THR QG2 120 LYS QE 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.09, r4= 8.59,
igr1=1805,1806,1807,
igr2=1837,1838,
/
#
# 118 THR QG2 120 LYS QE 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.74, r4= 7.24,
igr1=1805,1806,1807,
igr2=1837,1838,
/
#
# 118 THR QG2 120 LYS QD 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.74, r4= 7.24,
igr1=1805,1806,1807,
igr2=1834,1835,
/
#
# 118 THR QG2 120 LYS QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.74, r4= 7.24,
igr1=1805,1806,1807,
igr2=1828,1829,
/
#
# 118 THR QG2 145 PHE QE 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.76, r4= 9.26,
igr1=1805,1806,1807,
igr2=2213,2217,
/
#
# 119 SER H 118 THR HA 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=1813,1801, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 119 SER H 118 THR HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1813,1803, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 119 SER H 118 THR QG2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1813, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=1805,1806,1807,
/
#
# 119 SER H 119 SER HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1813,1815, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 119 SER HA 121 TYR QE 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1815, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1856,1861,
/
#
# 120 LYS H 98 ILE QG2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1824, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=1506,1507,1508,
/
#
# 120 LYS H 98 ILE QG2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1824, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=1506,1507,1508,
/
#
# 120 LYS QD 99 PRO QG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.30, r4= 6.80,
igr1=1834,1835,
igr2=1523,1524,
/
#
# 120 LYS H 100 TYR HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1824,1535, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 120 LYS HA 118 THR QG2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1826, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=1805,1806,1807,
/
#
# 118 THR QG2 118 THR HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1801, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1=1805,1806,1807,
/
#
# 120 LYS H 119 SER HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1824,1815, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 120 LYS HA 119 SER HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1826,1815, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 120 LYS H 120 LYS QD 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=1824, -1, r1= 1.35, r2= 1.85, r3= 3.37, r4= 3.87,
igr2=1834,1835,
/
#
# 120 LYS H 120 LYS QG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1824, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1831,1832,
/
#
# 120 LYS QG 120 LYS QE 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.30, r4= 6.80,
igr1=1831,1832,
igr2=1837,1838,
/
#
# 120 LYS QD 120 LYS QE 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.78, r4= 4.28,
igr1=1834,1835,
igr2=1837,1838,
/
#
# 120 LYS QE 120 LYS QB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.78, r4= 4.28,
igr1=1837,1838,
igr2=1828,1829,
/
#
# 120 LYS QD 120 LYS QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.30, r4= 6.80,
igr1=1834,1835,
igr2=1828,1829,
/
#
# 120 LYS H 120 LYS QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1824, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1828,1829,
/
#
# 120 LYS QG 120 LYS QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.30, r4= 6.80,
igr1=1831,1832,
igr2=1828,1829,
/
#
# 120 LYS HA 120 LYS QG 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1826, -1, r1= 1.35, r2= 1.85, r3= 7.30, r4= 7.80,
igr2=1831,1832,
/
#
# 120 LYS HA 120 LYS QB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1826, -1, r1= 1.35, r2= 1.85, r3= 7.30, r4= 7.80,
igr2=1828,1829,
/
#
# 121 TYR H 3 PHE QD 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1846, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2= 35, 43,
/
#
# 121 TYR H 3 PHE 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1846, 32, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 121 TYR QD 95 LEU HG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1451, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr1=1854,1863,
/
#
# 121 TYR QD 95 LEU QD1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.09, r4= 8.59,
igr1=1854,1863,
igr2=1453,1454,1455,
/
#
# 95 LEU QD2 121 TYR QD 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.09, r4= 8.59,
igr1=1457,1458,1459,
igr2=1854,1863,
/
#
# 121 TYR H 120 LYS HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1846,1826, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 121 TYR H 120 LYS HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1846,1826, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 5 TYR H 120 LYS HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 58,1826, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 119 SER H 120 LYS HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1813,1826, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 121 TYR H 121 TYR QD 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1846, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1854,1863,
/
#
# 121 TYR H 121 TYR QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1846, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1850,1851,
/
#
# 121 TYR QB 121 TYR HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1848, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr1=1850,1851,
/
#
# 121 TYR QD 121 TYR QB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.19, r4= 8.69,
igr1=1854,1863,
igr2=1850,1851,
/
#
# 121 TYR QB 121 TYR HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1848, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr1=1850,1851,
/
#
# 121 TYR HA 121 TYR QE 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1848, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1856,1861,
/
#
# 121 TYR QB 129 ILE QD1 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.76, r4= 9.26,
igr1=1850,1851,
igr2=1975,1976,1977,
/
#
# 121 TYR QD 134 ILE HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2042, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr1=1854,1863,
/
#
# 122 HIS HA 95 LEU QD2 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1869, -1, r1= 1.35, r2= 1.85, r3= 7.81, r4= 8.31,
igr2=1457,1458,1459,
/
#
# 122 HIS HA 96 GLU H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1869,1463, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 121 TYR H 122 HIS HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1846,1869, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 123 THR H 122 HIS HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1884,1869, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 122 HIS QB 99 PRO QG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.30, r4= 6.80,
igr1=1871,1872,
igr2=1523,1524,
/
#
# 122 HIS H 121 TYR HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1867,1848, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 122 HIS H 121 TYR HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1867,1848, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 120 LYS H 121 TYR HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1824,1848, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 122 HIS H 122 HIS HD2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1867,1880, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 122 HIS H 122 HIS QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1867, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1871,1872,
/
#
# 122 HIS H 122 HIS HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1867,1869, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 123 THR H 2 VAL HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1884, 13, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 123 THR H 2 VAL QG2 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1884, -1, r1= 1.35, r2= 1.85, r3= 7.81, r4= 8.31,
igr2= 21, 22, 23,
/
#
# 121 TYR H 2 VAL QG1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1846, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2= 17, 18, 19,
/
#
# 123 THR HB 95 LEU QD2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1888, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=1457,1458,1459,
/
#
# 123 THR H 122 HIS H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1884,1867, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 121 TYR H 122 HIS H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1846,1867, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 123 THR H 122 HIS HD2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1884,1880, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 123 THR H 122 HIS HA 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=1884,1869, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 123 THR H 123 THR HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1884,1886, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 123 THR H 123 THR HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1884,1888, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 123 THR H 123 THR QG2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1884, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=1890,1891,1892,
/
#
# 123 THR H 124 LYS H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1884,1898, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 123 THR HA 124 LYS HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1886,1900, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 123 THR QG2 129 ILE H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1962, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr1=1890,1891,1892,
/
#
# 123 THR QG2 129 ILE QD1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1=1890,1891,1892,
igr2=1975,1976,1977,
/
#
# 129 ILE QD1 129 ILE HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1966, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1=1975,1976,1977,
/
#
# 123 THR QG2 129 ILE QD1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1=1890,1891,1892,
igr2=1975,1976,1977,
/
#
# 123 THR QG2 129 ILE QG2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.65, r4= 9.15,
igr1=1890,1891,1892,
igr2=1968,1969,1970,
/
#
# 123 THR QG2 129 ILE HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1964, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr1=1890,1891,1892,
/
#
# 123 THR QG2 130 ASN H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1981, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr1=1890,1891,1892,
/
#
# 124 LYS 2HB 94 THR H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1903,1430, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 94 THR H 124 LYS 2HD 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1430,1909, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 124 LYS H 95 LEU QD2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1898, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=1457,1458,1459,
/
#
# 124 LYS HA 96 GLU H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1900,1463, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 124 LYS 1HG 96 GLU HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1905,1465, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 124 LYS H 123 THR HA 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=1898,1886, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 124 LYS H 94 THR HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1898,1432, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 124 LYS H 123 THR HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1898,1888, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 124 LYS HA 123 THR QG2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1900, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=1890,1891,1892,
/
#
# 124 LYS HA 123 THR HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1900,1888, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 124 LYS H 124 LYS HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1898,1900, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 124 LYS H 124 LYS QB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=1898, -1, r1= 1.35, r2= 1.85, r3= 3.37, r4= 3.87,
igr2=1902,1903,
/
#
# 124 LYS H 127 ALA QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1898, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=1945,1946,1947,
/
#
# 124 LYS H 124 LYS QG 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=1898, -1, r1= 1.35, r2= 1.85, r3= 3.37, r4= 3.87,
igr2=1905,1906,
/
#
# 124 LYS QG 124 LYS QE 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.30, r4= 6.80,
igr1=1905,1906,
igr2=1911,1912,
/
#
# 124 LYS 2HD 124 LYS QE 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=1909, -1, r1= 1.35, r2= 1.85, r3= 3.37, r4= 3.87,
igr2=1911,1912,
/
#
# 124 LYS QE 124 LYS 1HD 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1908, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr1=1911,1912,
/
#
# 124 LYS QB 124 LYS QE 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 7.56, r4= 8.06,
igr1=1902,1903,
igr2=1911,1912,
/
#
# 124 LYS QG 124 LYS QD 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.53, r4= 4.03,
igr1=1905,1906,
igr2=1908,1909,
/
#
# 124 LYS QE 124 LYS 1HD 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1908, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr1=1911,1912,
/
#
# 124 LYS 2HD 124 LYS QE 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1909, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1911,1912,
/
#
# 124 LYS QG 124 LYS QD 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.53, r4= 4.03,
igr1=1905,1906,
igr2=1908,1909,
/
#
# 124 LYS QB 124 LYS QG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 7.56, r4= 8.06,
igr1=1902,1903,
igr2=1905,1906,
/
#
# 127 ALA QB 124 LYS QG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.09, r4= 8.59,
igr1=1945,1946,1947,
igr2=1905,1906,
/
#
# 124 LYS HA 124 LYS QG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1900, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1905,1906,
/
#
# 124 LYS HA 124 LYS QG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1900, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1905,1906,
/
#
# 124 LYS HA 124 LYS QE 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1900, -1, r1= 1.35, r2= 1.85, r3= 7.30, r4= 7.80,
igr2=1911,1912,
/
#
# 124 LYS QG 124 LYS QE 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.30, r4= 6.80,
igr1=1905,1906,
igr2=1911,1912,
/
#
# 124 LYS H 124 LYS QG 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1898, -1, r1= 1.35, r2= 1.85, r3= 7.30, r4= 7.80,
igr2=1905,1906,
/
#
# 124 LYS QB 124 LYS QG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 7.56, r4= 8.06,
igr1=1902,1903,
igr2=1905,1906,
/
#
# 124 LYS HA 124 LYS QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1900, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1902,1903,
/
#
# 124 LYS HA 125 GLY H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1900,1920, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 124 LYS HA 125 GLY QA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1900, -1, r1= 1.35, r2= 1.85, r3= 7.30, r4= 7.80,
igr2=1922,1923,
/
#
# 124 LYS HA 125 GLY QA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1900, -1, r1= 1.35, r2= 1.85, r3= 7.30, r4= 7.80,
igr2=1922,1923,
/
#
# 125 GLY H 125 GLY QA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1920, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1922,1923,
/
#
# 125 GLY QA 126 ASN 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1932, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr1=1922,1923,
/
#
# 125 GLY QA 126 ASN 1HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1931, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr1=1922,1923,
/
#
# 125 GLY H 126 ASN HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1920,1929, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 125 GLY H 127 ALA H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1920,1941, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 125 GLY QA 127 ALA H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1941, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr1=1922,1923,
/
#
# 125 GLY QA 127 ALA H 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1941, r1= 1.35, r2= 1.85, r3= 7.30, r4= 7.80,
igr1=1922,1923,
/
#
# 126 ASN HA 122 HIS HE1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1929,1876, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 126 ASN 1HD2 126 ASN HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1936,1929, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 126 ASN 1HD2 126 ASN 2HD2 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat=1936,1937, r1= 1.35, r2= 1.85, r3= 2.80, r4= 3.30, /
#
# 62 ASN 1HD2 62 ASN 2HD2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 921, 922, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 126 ASN 1HD2 126 ASN 2HD2 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat=1936,1937, r1= 1.35, r2= 1.85, r3= 2.80, r4= 3.30, /
#
# 62 ASN 1HD2 62 ASN 2HD2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 921, 922, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 126 ASN 1HB 126 ASN 2HB 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat=1931,1932, r1= 1.35, r2= 1.85, r3= 2.80, r4= 3.30, /
#
# 126 ASN 1HB 126 ASN 2HB 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat=1931,1932, r1= 1.35, r2= 1.85, r3= 2.80, r4= 3.30, /
#
# 126 ASN 1HD2 126 ASN 2HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1936,1932, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 126 ASN HA 126 ASN 1HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1929,1931, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 127 ALA QB 94 THR QG2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.65, r4= 9.15,
igr1=1945,1946,1947,
igr2=1436,1437,1438,
/
#
# 127 ALA QB 94 THR HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1434, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1=1945,1946,1947,
/
#
# 127 ALA QB 125 GLY QA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.09, r4= 8.59,
igr1=1945,1946,1947,
igr2=1922,1923,
/
#
# 127 ALA H 126 ASN HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1941,1929, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 127 ALA HA 126 ASN 1HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1943,1931, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 127 ALA H 127 ALA HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1941,1943, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 127 ALA QB 127 ALA H 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1941, r1= 1.35, r2= 1.85, r3= 3.60, r4= 4.10,
igr1=1945,1946,1947,
/
#
# 127 ALA H 127 ALA HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1941,1943, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 127 ALA QB 127 ALA HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1943, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr1=1945,1946,1947,
/
#
# 127 ALA QB 127 ALA H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1941, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1=1945,1946,1947,
/
#
# 127 ALA QB 127 ALA HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1943, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr1=1945,1946,1947,
/
#
# 127 ALA HA 128 SER H 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=1943,1951, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 127 ALA QB 128 SER H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1951, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr1=1945,1946,1947,
/
#
# 127 ALA HA 128 SER QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1943, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1955,1956,
/
#
# 127 ALA QB 128 SER HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1953, r1= 1.35, r2= 1.85, r3= 7.81, r4= 8.31,
igr1=1945,1946,1947,
/
#
# 128 SER H 128 SER HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1951,1953, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 128 SER H 128 SER QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1951, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1955,1956,
/
#
# 128 SER HA 128 SER QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1953, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1955,1956,
/
#
# 128 SER HA 128 SER QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1953, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1955,1956,
/
#
# 128 SER H 128 SER QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1951, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1955,1956,
/
#
# 128 SER HA 129 ILE H 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=1953,1962, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 128 SER QB 129 ILE H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1962, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr1=1955,1956,
/
#
# 128 SER HA 129 ILE HB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1953,1966, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 128 SER HA 129 ILE HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1953,1964, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 128 SER QB 129 ILE H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1962, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr1=1955,1956,
/
#
# 129 ILE QD1 3 PHE QE 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.76, r4= 9.26,
igr1=1975,1976,1977,
igr2= 37, 41,
/
#
# 134 ILE H 129 ILE QD1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2040, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=1975,1976,1977,
/
#
# 129 ILE H 129 ILE HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1962,1964, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 129 ILE H 129 ILE QG2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1962, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=1968,1969,1970,
/
#
# 129 ILE H 129 ILE QD1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1962, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=1975,1976,1977,
/
#
# 129 ILE H 129 ILE HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1962,1966, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 129 ILE QD1 129 ILE QG1 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 4.04, r4= 4.54,
igr1=1975,1976,1977,
igr2=1972,1973,
/
#
# 129 ILE H 129 ILE HB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1962,1966, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 129 ILE H 129 ILE QG2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1962, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=1968,1969,1970,
/
#
# 134 ILE H 129 ILE QG2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2040, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=1968,1969,1970,
/
#
# 129 ILE QD1 129 ILE QG1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.74, r4= 7.24,
igr1=1975,1976,1977,
igr2=1972,1973,
/
#
# 129 ILE QG2 129 ILE HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1966, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1=1968,1969,1970,
/
#
# 129 ILE QD1 129 ILE HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1966, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1=1975,1976,1977,
/
#
# 129 ILE HA 129 ILE HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1964,1966, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 129 ILE HB 129 ILE QG1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1966, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1972,1973,
/
#
# 129 ILE QG2 129 ILE QG1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.74, r4= 7.24,
igr1=1968,1969,1970,
igr2=1972,1973,
/
#
# 129 ILE HA 130 ASN H 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=1964,1981, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 129 ILE HB 130 ASN H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1966,1981, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 129 ILE QG2 130 ASN H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1981, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr1=1968,1969,1970,
/
#
# 129 ILE QD1 130 ASN H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1981, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr1=1975,1976,1977,
/
#
# 129 ILE HB 130 ASN H 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1966,1981, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 129 ILE QD1 133 GLU HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2027, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1=1975,1976,1977,
/
#
# 137 GLY 1HA 129 ILE QD1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2093, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=1975,1976,1977,
/
#
# 129 ILE HA 129 ILE QD1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1964, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=1975,1976,1977,
/
#
# 129 ILE QG2 134 ILE QG2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1=1968,1969,1970,
igr2=2046,2047,2048,
/
#
# 129 ILE HB 134 ILE QD1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1966, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=2053,2054,2055,
/
#
# 130 ASN H 129 ILE QG1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1981, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1972,1973,
/
#
# 130 ASN HA 129 ILE QG1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1983, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=1972,1973,
/
#
# 130 ASN 1HD2 130 ASN 2HD2 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat=1990,1991, r1= 1.35, r2= 1.85, r3= 2.80, r4= 3.30, /
#
# 130 ASN 1HD2 130 ASN 2HD2 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat=1990,1991, r1= 1.35, r2= 1.85, r3= 2.80, r4= 3.30, /
#
# 130 ASN HA 130 ASN H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1983,1981, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 130 ASN 1HB 130 ASN H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1985,1981, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 130 ASN 2HB 130 ASN H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1986,1981, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 130 ASN 1HD2 130 ASN 1HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1990,1985, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 133 GLU H 130 ASN 1HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2025,1985, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 130 ASN HA 130 ASN 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1983,1986, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 130 ASN HA 130 ASN 1HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1983,1985, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 130 ASN 1HB 130 ASN 2HB 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat=1985,1986, r1= 1.35, r2= 1.85, r3= 2.80, r4= 3.30, /
#
# 130 ASN 1HB 130 ASN 2HB 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat=1985,1986, r1= 1.35, r2= 1.85, r3= 2.80, r4= 3.30, /
#
# 130 ASN HA 131 GLU QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1983, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1999,2000,
/
#
# 130 ASN H 133 GLU QG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1981, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=2032,2033,
/
#
# 130 ASN H 133 GLU QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1981, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=2029,2030,
/
#
# 130 ASN 2HB 133 GLU QG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1986, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=2032,2033,
/
#
# 130 ASN H 134 ILE QD1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1981, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=2053,2054,2055,
/
#
# 131 GLU H 130 ASN HA 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=1995,1983, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 131 GLU H 131 GLU HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1995,1997, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 131 GLU H 131 GLU QG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1995, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=2002,2003,
/
#
# 131 GLU H 131 GLU QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1995, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1999,2000,
/
#
# 131 GLU QB 131 GLU QG 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.53, r4= 4.03,
igr1=1999,2000,
igr2=2002,2003,
/
#
# 131 GLU QB 131 GLU QG 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.53, r4= 4.03,
igr1=1999,2000,
igr2=2002,2003,
/
#
# 131 GLU HA 131 GLU QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1997, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1999,2000,
/
#
# 131 GLU HA 131 GLU QG 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=1997, -1, r1= 1.35, r2= 1.85, r3= 7.30, r4= 7.80,
igr2=2002,2003,
/
#
# 131 GLU H 134 ILE QD1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=1995, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=2053,2054,2055,
/
#
# 131 GLU QG 134 ILE HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2044, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr1=2002,2003,
/
#
# 131 GLU QB 135 LYS 1HE 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2072, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr1=1999,2000,
/
#
# 132 GLU H 130 ASN 1HD2 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2010,1990, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 132 GLU H 133 GLU H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2010,2025, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 132 GLU H 130 ASN HA 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2010,1983, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 132 GLU H 130 ASN 1HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2010,1985, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 132 GLU H 131 GLU H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2010,1995, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 132 GLU H 131 GLU HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2010,1997, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 132 GLU H 131 GLU QB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2010, -1, r1= 1.35, r2= 1.85, r3= 3.37, r4= 3.87,
igr2=1999,2000,
/
#
# 132 GLU H 131 GLU H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2010,1995, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 132 GLU H 132 GLU HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2010,2012, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 132 GLU H 132 GLU QG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2010, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=2017,2018,
/
#
# 132 GLU H 132 GLU QB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2010, -1, r1= 1.35, r2= 1.85, r3= 3.37, r4= 3.87,
igr2=2014,2015,
/
#
# 132 GLU QG 132 GLU QB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.78, r4= 4.28,
igr1=2017,2018,
igr2=2014,2015,
/
#
# 132 GLU HA 132 GLU QG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2012, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=2017,2018,
/
#
# 132 GLU HA 132 GLU QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2012, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=2014,2015,
/
#
# 132 GLU H 132 GLU QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2010, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=2014,2015,
/
#
# 132 GLU HA 132 GLU QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2012, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=2014,2015,
/
#
# 132 GLU QG 132 GLU QB 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.53, r4= 4.03,
igr1=2017,2018,
igr2=2014,2015,
/
#
# 132 GLU HA 132 GLU QG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2012, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=2017,2018,
/
#
# 132 GLU H 132 GLU HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=2010,2012, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 132 GLU H 132 GLU QG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2010, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=2017,2018,
/
#
# 132 GLU H 133 GLU H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2010,2025, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 132 GLU H 134 ILE H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2010,2040, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 132 GLU H 134 ILE H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2010,2040, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 132 GLU HA 135 LYS QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2012, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=2063,2064,
/
#
# 132 GLU HA 135 LYS QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2012, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=2063,2064,
/
#
# 133 GLU H 130 ASN H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2025,1981, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 133 GLU H 130 ASN HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2025,1983, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 133 GLU H 130 ASN 2HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2025,1986, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 130 ASN 1HD2 130 ASN 2HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=1990,1986, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 133 GLU H 132 GLU QB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2025, -1, r1= 1.35, r2= 1.85, r3= 3.37, r4= 3.87,
igr2=2014,2015,
/
#
# 133 GLU H 133 GLU QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2025, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=2029,2030,
/
#
# 133 GLU H 132 GLU QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2025, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=2014,2015,
/
#
# 133 GLU H 132 GLU QG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2025, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=2017,2018,
/
#
# 133 GLU H 133 GLU HA 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2025,2027, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 133 GLU H 133 GLU QG 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2025, -1, r1= 1.35, r2= 1.85, r3= 3.37, r4= 3.87,
igr2=2032,2033,
/
#
# 133 GLU QG 133 GLU QB 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.53, r4= 4.03,
igr1=2032,2033,
igr2=2029,2030,
/
#
# 133 GLU QG 133 GLU HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2027, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr1=2032,2033,
/
#
# 133 GLU H 133 GLU QG 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=2025, -1, r1= 1.35, r2= 1.85, r3= 7.30, r4= 7.80,
igr2=2032,2033,
/
#
# 133 GLU QG 133 GLU QB 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.53, r4= 4.03,
igr1=2032,2033,
igr2=2029,2030,
/
#
# 133 GLU H 133 GLU QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2025, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=2029,2030,
/
#
# 133 GLU QB 133 GLU HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2027, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr1=2029,2030,
/
#
# 133 GLU H 134 ILE H 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2025,2040, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 133 GLU H 134 ILE H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2025,2040, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 134 ILE HA 3 PHE QE 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=2042, -1, r1= 1.35, r2= 1.85, r3= 7.30, r4= 7.80,
igr2= 37, 41,
/
#
# 3 PHE QD 134 ILE HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2042, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr1= 35, 43,
/
#
# 134 ILE H 134 ILE HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2040,2042, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 134 ILE HB 3 PHE QE 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=2044, -1, r1= 1.35, r2= 1.85, r3= 7.30, r4= 7.80,
igr2= 37, 41,
/
#
# 134 ILE H 134 ILE HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2040,2044, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 134 ILE H 129 ILE QG1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2040, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=1972,1973,
/
#
# 134 ILE HA 129 ILE QD1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2042, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=1975,1976,1977,
/
#
# 134 ILE H 131 GLU HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2040,1997, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 134 ILE H 131 GLU HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=2040,1997, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 134 ILE H 132 GLU QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2040, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=2014,2015,
/
#
# 134 ILE H 133 GLU QG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2040, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=2032,2033,
/
#
# 134 ILE H 133 GLU QB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2040, -1, r1= 1.35, r2= 1.85, r3= 3.37, r4= 3.87,
igr2=2029,2030,
/
#
# 134 ILE H 133 GLU QG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2040, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=2032,2033,
/
#
# 134 ILE H 134 ILE HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2040,2042, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 134 ILE H 134 ILE HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2040,2044, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 134 ILE H 134 ILE QG2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2040, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=2046,2047,2048,
/
#
# 134 ILE H 134 ILE QD1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2040, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=2053,2054,2055,
/
#
# 134 ILE HB 134 ILE QG2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2044, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=2046,2047,2048,
/
#
# 134 ILE HA 134 ILE HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2042,2044, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 134 ILE HA 134 ILE QD1 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=2042, -1, r1= 1.35, r2= 1.85, r3= 7.81, r4= 8.31,
igr2=2053,2054,2055,
/
#
# 134 ILE HA 134 ILE QG2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2042, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=2046,2047,2048,
/
#
# 134 ILE HA 134 ILE QG2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2042, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=2046,2047,2048,
/
#
# 134 ILE QD1 134 ILE QG2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1=2053,2054,2055,
igr2=2046,2047,2048,
/
#
# 134 ILE HB 135 LYS QG 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat=2044, -1, r1= 1.35, r2= 1.85, r3= 3.14, r4= 3.64,
igr2=2066,2067,
/
#
# 135 LYS QG 135 LYS QD 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 7.56, r4= 8.06,
igr1=2066,2067,
igr2=2069,2070,
/
#
# 134 ILE HB 135 LYS QG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2044, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=2066,2067,
/
#
# 134 ILE QG2 138 LYS QD 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.09, r4= 8.59,
igr1=2046,2047,2048,
igr2=2108,2109,
/
#
# 134 ILE HB 134 ILE QG2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2044, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=2046,2047,2048,
/
#
# 135 LYS H 132 GLU HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2059,2012, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 135 LYS H 133 GLU H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2059,2025, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 135 LYS H 133 GLU HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2059,2027, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 135 LYS H 134 ILE H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2059,2040, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 135 LYS H 134 ILE H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2059,2040, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 135 LYS H 134 ILE HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2059,2042, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 135 LYS H 134 ILE HB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2059,2044, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 135 LYS H 134 ILE QG2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2059, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=2046,2047,2048,
/
#
# 135 LYS H 134 ILE QG2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2059, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=2046,2047,2048,
/
#
# 135 LYS H 134 ILE HB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=2059,2044, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 135 LYS H 135 LYS HA 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2059,2061, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 135 LYS H 135 LYS QB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2059, -1, r1= 1.35, r2= 1.85, r3= 3.37, r4= 3.87,
igr2=2063,2064,
/
#
# 135 LYS QB 135 LYS QE 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 7.56, r4= 8.06,
igr1=2063,2064,
igr2=2072,2073,
/
#
# 135 LYS HA 135 LYS QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2061, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=2063,2064,
/
#
# 135 LYS H 135 LYS QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2059, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=2063,2064,
/
#
# 135 LYS HA 135 LYS QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2061, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=2063,2064,
/
#
# 135 LYS H 135 LYS QG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2059, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=2066,2067,
/
#
# 135 LYS QB 135 LYS QE 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.78, r4= 4.28,
igr1=2063,2064,
igr2=2072,2073,
/
#
# 135 LYS QG 135 LYS QD 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.53, r4= 4.03,
igr1=2066,2067,
igr2=2069,2070,
/
#
# 135 LYS QB 135 LYS QD 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.53, r4= 4.03,
igr1=2063,2064,
igr2=2069,2070,
/
#
# 135 LYS H 135 LYS QD 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2059, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=2069,2070,
/
#
# 135 LYS QE 135 LYS QD 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.78, r4= 4.28,
igr1=2072,2073,
igr2=2069,2070,
/
#
# 135 LYS HA 135 LYS QD 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=2061, -1, r1= 1.35, r2= 1.85, r3= 7.30, r4= 7.80,
igr2=2069,2070,
/
#
# 135 LYS QG 135 LYS QE 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.78, r4= 4.28,
igr1=2066,2067,
igr2=2072,2073,
/
#
# 135 LYS QE 135 LYS QD 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.78, r4= 4.28,
igr1=2072,2073,
igr2=2069,2070,
/
#
# 135 LYS QB 135 LYS QG 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.78, r4= 4.28,
igr1=2063,2064,
igr2=2066,2067,
/
#
# 135 LYS H 135 LYS HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2059,2061, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 135 LYS QG 135 LYS QE 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.30, r4= 6.80,
igr1=2066,2067,
igr2=2072,2073,
/
#
# 135 LYS QB 135 LYS QG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.30, r4= 6.80,
igr1=2063,2064,
igr2=2066,2067,
/
#
# 135 LYS HA 135 LYS QG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2061, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=2066,2067,
/
#
# 135 LYS QB 135 LYS QD 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.53, r4= 4.03,
igr1=2063,2064,
igr2=2069,2070,
/
#
# 135 LYS HA 138 LYS QD 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2061, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=2108,2109,
/
#
# 135 LYS HA 138 LYS QD 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=2061, -1, r1= 1.35, r2= 1.85, r3= 7.30, r4= 7.80,
igr2=2108,2109,
/
#
# 135 LYS HA 138 LYS QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2061, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=2102,2103,
/
#
# 136 ALA QB 133 GLU HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2027, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr1=2085,2086,2087,
/
#
# 136 ALA QB 133 GLU HA 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2027, r1= 1.35, r2= 1.85, r3= 3.60, r4= 4.10,
igr1=2085,2086,2087,
/
#
# 136 ALA H 135 LYS HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2081,2061, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 136 ALA H 135 LYS QB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2081, -1, r1= 1.35, r2= 1.85, r3= 3.37, r4= 3.87,
igr2=2063,2064,
/
#
# 136 ALA H 135 LYS QD 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2081, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=2069,2070,
/
#
# 136 ALA QB 135 LYS QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.74, r4= 7.24,
igr1=2085,2086,2087,
igr2=2063,2064,
/
#
# 136 ALA H 136 ALA HA 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2081,2083, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 136 ALA H 136 ALA QB 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat=2081, -1, r1= 1.35, r2= 1.85, r3= 3.36, r4= 3.86,
igr2=2085,2086,2087,
/
#
# 136 ALA HA 136 ALA QB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2083, -1, r1= 1.35, r2= 1.85, r3= 3.60, r4= 4.10,
igr2=2085,2086,2087,
/
#
# 136 ALA H 136 ALA HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2081,2083, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 136 ALA H 136 ALA QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2081, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=2085,2086,2087,
/
#
# 136 ALA HA 136 ALA QB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2083, -1, r1= 1.35, r2= 1.85, r3= 3.60, r4= 4.10,
igr2=2085,2086,2087,
/
#
# 136 ALA H 137 GLY H 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2081,2091, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 136 ALA H 137 GLY H 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2081,2091, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 136 ALA H 138 LYS H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2081,2098, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 136 ALA QB 140 LYS QE 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.74, r4= 7.24,
igr1=2085,2086,2087,
igr2=2148,2149,
/
#
# 136 ALA HA 140 LYS QE 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2083, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=2148,2149,
/
#
# 137 GLY H 134 ILE HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2091,2042, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 137 GLY H 136 ALA HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2091,2083, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 137 GLY H 136 ALA QB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2091, -1, r1= 1.35, r2= 1.85, r3= 3.60, r4= 4.10,
igr2=2085,2086,2087,
/
#
# 137 GLY H 137 GLY QA 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2091, -1, r1= 1.35, r2= 1.85, r3= 3.37, r4= 3.87,
igr2=2093,2094,
/
#
# 137 GLY H 137 GLY QA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2091, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=2093,2094,
/
#
# 140 LYS H 137 GLY QA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2135, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=2093,2094,
/
#
# 137 GLY QA 140 LYS 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2140, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr1=2093,2094,
/
#
# 137 GLY 2HA 140 LYS QG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2094, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=2142,2143,
/
#
# 138 LYS H 135 LYS HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2098,2061, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 138 LYS H 137 GLY QA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2098, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=2093,2094,
/
#
# 138 LYS H 138 LYS HA 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2098,2100, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 138 LYS H 138 LYS QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2098, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=2102,2103,
/
#
# 138 LYS H 138 LYS QD 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2098, -1, r1= 1.35, r2= 1.85, r3= 3.37, r4= 3.87,
igr2=2108,2109,
/
#
# 138 LYS QD 138 LYS QG 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.53, r4= 4.03,
igr1=2108,2109,
igr2=2105,2106,
/
#
# 138 LYS QG 138 LYS QE 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.30, r4= 6.80,
igr1=2105,2106,
igr2=2111,2112,
/
#
# 138 LYS QD 138 LYS QE 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.78, r4= 4.28,
igr1=2108,2109,
igr2=2111,2112,
/
#
# 142 ALA QB 138 LYS QE 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.09, r4= 8.59,
igr1=2171,2172,2173,
igr2=2111,2112,
/
#
# 138 LYS QB 138 LYS QE 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 7.56, r4= 8.06,
igr1=2102,2103,
igr2=2111,2112,
/
#
# 138 LYS QD 138 LYS QE 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.30, r4= 6.80,
igr1=2108,2109,
igr2=2111,2112,
/
#
# 138 LYS HA 138 LYS QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2100, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=2102,2103,
/
#
# 138 LYS H 138 LYS QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2098, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=2102,2103,
/
#
# 139 GLU H 138 LYS QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2120, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=2102,2103,
/
#
# 138 LYS H 138 LYS QD 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2098, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=2108,2109,
/
#
# 138 LYS QD 138 LYS QG 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.53, r4= 4.03,
igr1=2108,2109,
igr2=2105,2106,
/
#
# 138 LYS QB 138 LYS QD 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.78, r4= 4.28,
igr1=2102,2103,
igr2=2108,2109,
/
#
# 138 LYS QB 138 LYS QG 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.78, r4= 4.28,
igr1=2102,2103,
igr2=2105,2106,
/
#
# 138 LYS QB 139 GLU HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2122, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr1=2102,2103,
/
#
# 138 LYS QB 139 GLU HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2122, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr1=2102,2103,
/
#
# 138 LYS 1HD 139 GLU 1HG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2108,2127, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 142 ALA QB 139 GLU 2HG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2128, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1=2171,2172,2173,
/
#
# 138 LYS HA 141 ALA QB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2100, -1, r1= 1.35, r2= 1.85, r3= 3.60, r4= 4.10,
igr2=2161,2162,2163,
/
#
# 139 GLU H 135 LYS HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2120,2061, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 139 GLU H 136 ALA QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2120, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=2085,2086,2087,
/
#
# 138 LYS H 136 ALA QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2098, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=2085,2086,2087,
/
#
# 139 GLU H 138 LYS QB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2120, -1, r1= 1.35, r2= 1.85, r3= 3.37, r4= 3.87,
igr2=2102,2103,
/
#
# 139 GLU H 139 GLU HA 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2120,2122, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 139 GLU H 139 GLU QG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2120, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=2127,2128,
/
#
# 139 GLU HA 139 GLU QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2122, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=2124,2125,
/
#
# 139 GLU HA 139 GLU QG 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=2122, -1, r1= 1.35, r2= 1.85, r3= 7.30, r4= 7.80,
igr2=2127,2128,
/
#
# 139 GLU QG 139 GLU QB 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.53, r4= 4.03,
igr1=2127,2128,
igr2=2124,2125,
/
#
# 139 GLU HA 139 GLU QG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2122, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=2127,2128,
/
#
# 139 GLU HA 139 GLU QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2122, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=2124,2125,
/
#
# 139 GLU H 141 ALA H 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2120,2157, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 141 ALA H 143 GLY H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2157,2177, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 139 GLU H 142 ALA QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2120, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=2171,2172,2173,
/
#
# 140 LYS H 139 GLU QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2135, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=2124,2125,
/
#
# 140 LYS H 139 GLU HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2135,2122, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 140 LYS H 140 LYS QB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2135, -1, r1= 1.35, r2= 1.85, r3= 3.37, r4= 3.87,
igr2=2139,2140,
/
#
# 140 LYS H 140 LYS QD 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2135, -1, r1= 1.35, r2= 1.85, r3= 3.37, r4= 3.87,
igr2=2145,2146,
/
#
# 140 LYS H 142 ALA QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2135, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=2171,2172,2173,
/
#
# 140 LYS QB 140 LYS QE 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 7.56, r4= 8.06,
igr1=2139,2140,
igr2=2148,2149,
/
#
# 140 LYS QB 140 LYS QD 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.78, r4= 4.28,
igr1=2139,2140,
igr2=2145,2146,
/
#
# 140 LYS QB 140 LYS HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2137, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr1=2139,2140,
/
#
# 140 LYS H 140 LYS QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2135, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=2139,2140,
/
#
# 140 LYS QG 140 LYS HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2137, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr1=2142,2143,
/
#
# 140 LYS H 140 LYS HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2135,2137, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 140 LYS QD 140 LYS QG 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.53, r4= 4.03,
igr1=2145,2146,
igr2=2142,2143,
/
#
# 140 LYS QB 140 LYS QG 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.78, r4= 4.28,
igr1=2139,2140,
igr2=2142,2143,
/
#
# 140 LYS QE 140 LYS QG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.30, r4= 6.80,
igr1=2148,2149,
igr2=2142,2143,
/
#
# 140 LYS QD 140 LYS QE 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.78, r4= 4.28,
igr1=2145,2146,
igr2=2148,2149,
/
#
# 140 LYS H 141 ALA H 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2135,2157, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 140 LYS QB 141 ALA HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2159, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr1=2139,2140,
/
#
# 137 GLY QA 140 LYS 2HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2140, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr1=2093,2094,
/
#
# 144 LEU QD2 33 VAL HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 506, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1=2197,2198,2199,
/
#
# 141 ALA H 139 GLU HA 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2157,2122, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 141 ALA H 140 LYS QG 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=2157, -1, r1= 1.35, r2= 1.85, r3= 7.30, r4= 7.80,
igr2=2142,2143,
/
#
# 141 ALA H 140 LYS QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2157, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=2139,2140,
/
#
# 141 ALA H 141 ALA HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2157,2159, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 141 ALA H 141 ALA QB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2157, -1, r1= 1.35, r2= 1.85, r3= 3.60, r4= 4.10,
igr2=2161,2162,2163,
/
#
# 141 ALA H 142 ALA QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2157, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=2171,2172,2173,
/
#
# 141 ALA HA 141 ALA QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2159, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=2161,2162,2163,
/
#
# 141 ALA H 141 ALA QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2157, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=2161,2162,2163,
/
#
# 141 ALA H 142 ALA H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2157,2167, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 141 ALA H 144 LEU HG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2157,2191, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 145 PHE H 144 LEU HG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2203,2191, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 141 ALA HA 144 LEU QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2159, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=2188,2189,
/
#
# 141 ALA QB 145 PHE QE 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.09, r4= 8.59,
igr1=2161,2162,2163,
igr2=2213,2217,
/
#
# 142 ALA H 139 GLU HA 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2167,2122, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 142 ALA H 139 GLU HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2167,2122, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 139 GLU H 139 GLU HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2120,2122, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 142 ALA QB 139 GLU HA 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2122, r1= 1.35, r2= 1.85, r3= 3.60, r4= 4.10,
igr1=2171,2172,2173,
/
#
# 142 ALA QB 139 GLU QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.74, r4= 7.24,
igr1=2171,2172,2173,
igr2=2124,2125,
/
#
# 136 ALA QB 139 GLU 2HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2125, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1=2085,2086,2087,
/
#
# 142 ALA QB 139 GLU HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2122, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr1=2171,2172,2173,
/
#
# 142 ALA QB 140 LYS HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2137, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr1=2171,2172,2173,
/
#
# 141 ALA QB 140 LYS HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2137, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1=2161,2162,2163,
/
#
# 140 LYS QD 140 LYS HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2137, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr1=2145,2146,
/
#
# 142 ALA H 140 LYS HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2167,2137, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 143 GLY H 140 LYS HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2177,2137, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 142 ALA H 141 ALA QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2167, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=2161,2162,2163,
/
#
# 141 ALA HA 141 ALA QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2159, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=2161,2162,2163,
/
#
# 142 ALA H 142 ALA QB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2167, -1, r1= 1.35, r2= 1.85, r3= 3.60, r4= 4.10,
igr2=2171,2172,2173,
/
#
# 142 ALA H 141 ALA QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2167, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=2161,2162,2163,
/
#
# 142 ALA HA 142 ALA QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2169, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=2171,2172,2173,
/
#
# 142 ALA HA 141 ALA QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2169, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=2161,2162,2163,
/
#
# 142 ALA HA 142 ALA QB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2169, -1, r1= 1.35, r2= 1.85, r3= 3.60, r4= 4.10,
igr2=2171,2172,2173,
/
#
# 142 ALA HA 145 PHE QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2169, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=2207,2208,
/
#
# 142 ALA HA 145 PHE QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2169, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=2207,2208,
/
#
# 147 ALA HA 146 LYS 1HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2247,2227, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 143 GLY H 139 GLU HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2177,2122, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 143 GLY QA 140 LYS HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2137, r1= 1.35, r2= 1.85, r3= 7.30, r4= 7.80,
igr1=2179,2180,
/
#
# 143 GLY H 141 ALA HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2177,2159, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 143 GLY H 141 ALA QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2177, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=2161,2162,2163,
/
#
# 143 GLY H 142 ALA QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2177, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=2171,2172,2173,
/
#
# 143 GLY H 142 ALA HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2177,2169, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 143 GLY H 142 ALA QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2177, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=2171,2172,2173,
/
#
# 142 ALA H 142 ALA QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2167, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=2171,2172,2173,
/
#
# 143 GLY H 143 GLY QA 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2177, -1, r1= 1.35, r2= 1.85, r3= 3.37, r4= 3.87,
igr2=2179,2180,
/
#
# 143 GLY H 143 GLY QA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2177, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=2179,2180,
/
#
# 143 GLY H 144 LEU H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2177,2184, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 143 GLY H 144 LEU H 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2177,2184, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 142 ALA H 144 LEU H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2167,2184, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 143 GLY H 145 PHE H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2177,2203, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 144 LEU HG 33 VAL HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2191, 506, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 140 LYS QB 144 LEU HG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2191, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr1=2139,2140,
/
#
# 144 LEU H 141 ALA HA 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2184,2159, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 144 LEU H 144 LEU HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2184,2186, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 144 LEU H 141 ALA HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2184,2159, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 144 LEU H 142 ALA HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2184,2169, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 144 LEU H 143 GLY QA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2184, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=2179,2180,
/
#
# 145 PHE H 143 GLY QA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2203, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=2179,2180,
/
#
# 144 LEU H 144 LEU QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2184, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=2188,2189,
/
#
# 144 LEU H 144 LEU HG 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2184,2191, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 144 LEU H 144 LEU QQD 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2184,2190, r1= 1.35, r2= 1.85, r3= 7.20, r4= 7.70, /
#
# 144 LEU QB 144 LEU QQD 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2190, r1= 1.35, r2= 1.85, r3= 8.93, r4= 9.43,
igr1=2188,2189,
/
#
# 144 LEU HA 144 LEU QQD 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2186,2190, r1= 1.35, r2= 1.85, r3= 8.20, r4= 8.70, /
#
# 144 LEU HA 144 LEU HG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2186,2191, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 144 LEU QB 144 LEU HG 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2191, r1= 1.35, r2= 1.85, r3= 3.37, r4= 3.87,
igr1=2188,2189,
/
#
# 144 LEU HA 144 LEU QQD 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2186,2190, r1= 1.35, r2= 1.85, r3= 8.20, r4= 8.70, /
#
# 141 ALA HA 144 LEU QQD 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2159,2190, r1= 1.35, r2= 1.85, r3= 8.20, r4= 8.70, /
#
# 144 LEU H 144 LEU HG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2184,2191, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 144 LEU QB 144 LEU HG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2191, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr1=2188,2189,
/
#
# 146 LYS H 147 ALA H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2223,2245, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 145 PHE QD 118 THR HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1801, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr1=2211,2219,
/
#
# 145 PHE H 141 ALA HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2203,2159, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 145 PHE H 144 LEU HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2203,2186, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 145 PHE H 142 ALA QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2203, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=2171,2172,2173,
/
#
# 145 PHE H 141 ALA QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2203, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=2161,2162,2163,
/
#
# 145 PHE H 144 LEU QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2203, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=2188,2189,
/
#
# 145 PHE H 145 PHE QE 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2203, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=2213,2217,
/
#
# 145 PHE H 145 PHE QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2203, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=2207,2208,
/
#
# 145 PHE QD 145 PHE QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 7.56, r4= 8.06,
igr1=2211,2219,
igr2=2207,2208,
/
#
# 145 PHE H 145 PHE QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2203, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=2207,2208,
/
#
# 145 PHE H 146 LYS H 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2203,2223, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 145 PHE H 148 VAL QG2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2203, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=2265,2266,2267,
/
#
# 146 LYS QB 142 ALA QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.74, r4= 7.24,
igr1=2227,2228,
igr2=2171,2172,2173,
/
#
# 146 LYS H 145 PHE QD 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2223, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=2211,2219,
/
#
# 146 LYS H 145 PHE QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2223, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=2207,2208,
/
#
# 146 LYS H 146 LYS HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2223,2225, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 146 LYS H 146 LYS QB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2223, -1, r1= 1.35, r2= 1.85, r3= 3.37, r4= 3.87,
igr2=2227,2228,
/
#
# 146 LYS H 146 LYS QG 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2223, -1, r1= 1.35, r2= 1.85, r3= 3.37, r4= 3.87,
igr2=2230,2231,
/
#
# 146 LYS HA 146 LYS QD 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2225, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=2233,2234,
/
#
# 146 LYS H 146 LYS QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2223, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=2227,2228,
/
#
# 146 LYS HA 146 LYS QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2225, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=2227,2228,
/
#
# 146 LYS HA 149 GLU QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2225, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=2275,2276,
/
#
# 146 LYS HA 146 LYS QE 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=2225, -1, r1= 1.35, r2= 1.85, r3= 7.30, r4= 7.80,
igr2=2236,2237,
/
#
# 146 LYS H 146 LYS HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=2223,2225, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 146 LYS QB 146 LYS QG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.30, r4= 6.80,
igr1=2227,2228,
igr2=2230,2231,
/
#
# 146 LYS QG 146 LYS QD 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.53, r4= 4.03,
igr1=2230,2231,
igr2=2233,2234,
/
#
# 146 LYS QB 146 LYS QD 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.78, r4= 4.28,
igr1=2227,2228,
igr2=2233,2234,
/
#
# 146 LYS QE 146 LYS QD 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 7.56, r4= 8.06,
igr1=2236,2237,
igr2=2233,2234,
/
#
# 146 LYS QG 146 LYS QD 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.53, r4= 4.03,
igr1=2230,2231,
igr2=2233,2234,
/
#
# 146 LYS HA 146 LYS QG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2225, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=2230,2231,
/
#
# 146 LYS HA 146 LYS QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2225, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=2227,2228,
/
#
# 146 LYS H 146 LYS QG 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=2223, -1, r1= 1.35, r2= 1.85, r3= 7.30, r4= 7.80,
igr2=2230,2231,
/
#
# 150 ALA H 146 LYS 1HG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2286,2230, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 146 LYS QB 146 LYS QG 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.78, r4= 4.28,
igr1=2227,2228,
igr2=2230,2231,
/
#
# 146 LYS QB 146 LYS QD 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.53, r4= 4.03,
igr1=2227,2228,
igr2=2233,2234,
/
#
# 146 LYS HA 146 LYS QD 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=2225, -1, r1= 1.35, r2= 1.85, r3= 7.30, r4= 7.80,
igr2=2233,2234,
/
#
# 146 LYS QG 146 LYS QE 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.78, r4= 4.28,
igr1=2230,2231,
igr2=2236,2237,
/
#
# 146 LYS HA 146 LYS QG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2225, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=2230,2231,
/
#
# 146 LYS QB 146 LYS QE 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.30, r4= 6.80,
igr1=2227,2228,
igr2=2236,2237,
/
#
# 146 LYS QG 146 LYS QE 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 7.56, r4= 8.06,
igr1=2230,2231,
igr2=2236,2237,
/
#
# 146 LYS HA 146 LYS QE 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=2225, -1, r1= 1.35, r2= 1.85, r3= 7.30, r4= 7.80,
igr2=2236,2237,
/
#
# 146 LYS QE 146 LYS QD 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.78, r4= 4.28,
igr1=2236,2237,
igr2=2233,2234,
/
#
# 146 LYS H 147 ALA HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2223,2247, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 146 LYS H 142 ALA HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2223,2169, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 146 LYS H 147 ALA H 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2223,2245, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 147 ALA H 148 VAL H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2245,2255, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 146 LYS HA 150 ALA QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2225, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=2290,2291,2292,
/
#
# 147 ALA QB 33 VAL HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 506, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr1=2249,2250,2251,
/
#
# 150 ALA QB 149 GLU 2HG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2279, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1=2290,2291,2292,
/
#
# 147 ALA QB 148 VAL HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2259, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1=2249,2250,2251,
/
#
# 150 ALA QB 149 GLU 1HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2275, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1=2290,2291,2292,
/
#
# 147 ALA QB 33 VAL HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 504, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1=2249,2250,2251,
/
#
# 147 ALA QB 33 VAL HA 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 504, r1= 1.35, r2= 1.85, r3= 3.60, r4= 4.10,
igr1=2249,2250,2251,
/
#
# 147 ALA QB 33 VAL QG2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.65, r4= 9.15,
igr1=2249,2250,2251,
igr2= 512, 513, 514,
/
#
# 147 ALA QB 144 LEU QD2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.65, r4= 9.15,
igr1=2249,2250,2251,
igr2=2197,2198,2199,
/
#
# 147 ALA QB 33 VAL QQG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 505, r1= 1.35, r2= 1.85, r3= 9.41, r4= 9.91,
igr1=2249,2250,2251,
/
#
# 147 ALA QB 144 LEU HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2186, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr1=2249,2250,2251,
/
#
# 147 ALA QB 144 LEU HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2186, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr1=2249,2250,2251,
/
#
# 147 ALA H 144 LEU HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=2245,2186, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 144 LEU H 144 LEU HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2184,2186, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 147 ALA HA 146 LYS HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=2247,2225, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 147 ALA H 146 LYS QG 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=2245, -1, r1= 1.35, r2= 1.85, r3= 7.30, r4= 7.80,
igr2=2230,2231,
/
#
# 147 ALA H 147 ALA HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2245,2247, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 147 ALA H 147 ALA QB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2245, -1, r1= 1.35, r2= 1.85, r3= 3.60, r4= 4.10,
igr2=2249,2250,2251,
/
#
# 147 ALA QB 147 ALA HA 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2247, r1= 1.35, r2= 1.85, r3= 3.60, r4= 4.10,
igr1=2249,2250,2251,
/
#
# 151 TYR HA 150 ALA QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2298, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=2290,2291,2292,
/
#
# 147 ALA HA 150 ALA QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2247, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=2290,2291,2292,
/
#
# 147 ALA H 147 ALA QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2245, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=2249,2250,2251,
/
#
# 151 TYR H 150 ALA QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2296, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=2290,2291,2292,
/
#
# 147 ALA QB 147 ALA HA 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2247, r1= 1.35, r2= 1.85, r3= 3.60, r4= 4.10,
igr1=2249,2250,2251,
/
#
# 147 ALA HA 150 ALA QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2247, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=2290,2291,2292,
/
#
# 147 ALA H 148 VAL H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2245,2255, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 147 ALA QB 148 VAL QG2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.65, r4= 9.15,
igr1=2249,2250,2251,
igr2=2265,2266,2267,
/
#
# 147 ALA QB 148 VAL QG2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1=2249,2250,2251,
igr2=2265,2266,2267,
/
#
# 147 ALA H 149 GLU H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2245,2271, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 150 ALA H 151 TYR H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2286,2296, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 148 VAL QG2 22 PHE QE 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.09, r4= 8.59,
igr1=2265,2266,2267,
igr2= 335, 339,
/
#
# 148 VAL H 33 VAL QG1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2255, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2= 508, 509, 510,
/
#
# 148 VAL QG2 33 VAL QQG 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 505, r1= 1.35, r2= 1.85, r3= 5.80, r4= 6.30,
igr1=2265,2266,2267,
/
#
# 148 VAL HA 33 VAL QQG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2257, 505, r1= 1.35, r2= 1.85, r3= 8.20, r4= 8.70, /
#
# 148 VAL QG2 33 VAL HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 506, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1=2265,2266,2267,
/
#
# 148 VAL QG2 33 VAL QG2 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 4.04, r4= 4.54,
igr1=2265,2266,2267,
igr2= 512, 513, 514,
/
#
# 148 VAL QG1 115 LEU QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.09, r4= 8.59,
igr1=2261,2262,2263,
igr2=1743,1744,
/
#
# 148 VAL QG1 115 LEU HG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1746, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr1=2261,2262,2263,
/
#
# 117 ILE QD1 115 LEU HG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1746, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1=1793,1794,1795,
/
#
# 148 VAL QG1 117 ILE HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1784, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr1=2261,2262,2263,
/
#
# 148 VAL QG2 144 LEU QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.74, r4= 7.24,
igr1=2265,2266,2267,
igr2=2188,2189,
/
#
# 148 VAL QG2 144 LEU HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2186, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1=2265,2266,2267,
/
#
# 148 VAL H 144 LEU HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=2255,2186, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 146 LYS H 144 LEU HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2223,2186, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 148 VAL H 147 ALA QB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2255, -1, r1= 1.35, r2= 1.85, r3= 3.60, r4= 4.10,
igr2=2249,2250,2251,
/
#
# 148 VAL QG2 147 ALA HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2247, r1= 1.35, r2= 1.85, r3= 7.81, r4= 8.31,
igr1=2265,2266,2267,
/
#
# 148 VAL H 148 VAL HA 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2255,2257, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 148 VAL H 148 VAL HB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2255,2259, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 148 VAL H 148 VAL QG2 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=2255, -1, r1= 1.35, r2= 1.85, r3= 7.81, r4= 8.31,
igr2=2265,2266,2267,
/
#
# 148 VAL HB 148 VAL QG1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2259, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=2261,2262,2263,
/
#
# 148 VAL HB 148 VAL QG2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2259, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=2265,2266,2267,
/
#
# 148 VAL HB 117 ILE QD1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2259, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=1793,1794,1795,
/
#
# 148 VAL H 148 VAL HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2255,2259, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 150 ALA H 148 VAL HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2286,2259, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 148 VAL H 149 GLU H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2255,2271, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 148 VAL QG2 149 GLU HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2273, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1=2265,2266,2267,
/
#
# 148 VAL HA 148 VAL QG2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2257, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=2265,2266,2267,
/
#
# 148 VAL QQG 149 GLU QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2258, -1, r1= 1.35, r2= 1.85, r3= 8.93, r4= 9.43,
igr2=2275,2276,
/
#
# 150 ALA H 151 TYR H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2286,2296, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 149 GLU QB 146 LYS QD 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 3.78, r4= 4.28,
igr1=2275,2276,
igr2=2233,2234,
/
#
# 149 GLU QG 146 LYS QD 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 7.56, r4= 8.06,
igr1=2278,2279,
igr2=2233,2234,
/
#
# 149 GLU QB 146 LYS 2HE 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2237, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr1=2275,2276,
/
#
# 149 GLU 1HB 146 LYS 1HE 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2275,2236, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 149 GLU H 148 VAL QQG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2271,2258, r1= 1.35, r2= 1.85, r3= 7.20, r4= 7.70, /
#
# 149 GLU H 148 VAL HB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=2271,2259, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 149 GLU H 148 VAL QG2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2271, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=2265,2266,2267,
/
#
# 149 GLU H 149 GLU HA 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2271,2273, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 149 GLU H 148 VAL HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2271,2257, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 149 GLU H 149 GLU QB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2271, -1, r1= 1.35, r2= 1.85, r3= 3.37, r4= 3.87,
igr2=2275,2276,
/
#
# 149 GLU H 148 VAL HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2271,2259, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 149 GLU H 149 GLU QG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2271, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=2278,2279,
/
#
# 149 GLU HA 149 GLU QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2273, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=2275,2276,
/
#
# 149 GLU HA 149 GLU QG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2273, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=2278,2279,
/
#
# 149 GLU H 150 ALA H 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2271,2286, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 148 VAL H 149 GLU H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2255,2271, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 149 GLU H 150 ALA H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2271,2286, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 150 ALA H 152 LEU H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2286,2317, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 150 ALA H 149 GLU QB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2286, -1, r1= 1.35, r2= 1.85, r3= 3.37, r4= 3.87,
igr2=2275,2276,
/
#
# 150 ALA H 149 GLU QG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2286, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=2278,2279,
/
#
# 150 ALA H 149 GLU HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2286,2273, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 150 ALA H 149 GLU QG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2286, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=2278,2279,
/
#
# 150 ALA H 149 GLU QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2286, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=2275,2276,
/
#
# 148 VAL H 149 GLU QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2255, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=2275,2276,
/
#
# 150 ALA H 150 ALA HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2286,2288, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 150 ALA H 150 ALA QB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2286, -1, r1= 1.35, r2= 1.85, r3= 3.60, r4= 4.10,
igr2=2290,2291,2292,
/
#
# 150 ALA H 150 ALA QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2286, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=2290,2291,2292,
/
#
# 148 VAL H 147 ALA QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2255, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=2249,2250,2251,
/
#
# 150 ALA HA 150 ALA QB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2288, -1, r1= 1.35, r2= 1.85, r3= 3.60, r4= 4.10,
igr2=2290,2291,2292,
/
#
# 150 ALA H 150 ALA HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2286,2288, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 150 ALA HA 150 ALA QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2288, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=2290,2291,2292,
/
#
# 150 ALA H 152 LEU H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2286,2317, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 150 ALA H 153 LEU QD1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2286, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=2345,2346,2347,
/
#
# 150 ALA H 153 LEU HG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2286,2343, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 150 ALA HA 153 LEU QQD 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=2288,2342, r1= 1.35, r2= 1.85, r3= 8.70, r4= 9.20, /
#
# 150 ALA HA 153 LEU 1HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2288,2340, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 150 ALA HA 153 LEU HG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2288,2343, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 150 ALA HA 154 ALA QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2288, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=2359,2360,2361,
/
#
# 151 TYR H 147 ALA HA 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2296,2247, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 151 TYR H 151 TYR HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2296,2298, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 151 TYR H 147 ALA HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2296,2247, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 147 ALA H 147 ALA HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2245,2247, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 151 TYR H 148 VAL HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2296,2257, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 151 TYR H 149 GLU HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2296,2273, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 151 TYR H 150 ALA HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2296,2288, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 151 TYR H 150 ALA QB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2296, -1, r1= 1.35, r2= 1.85, r3= 3.60, r4= 4.10,
igr2=2290,2291,2292,
/
#
# 151 TYR H 147 ALA QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2296, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=2249,2250,2251,
/
#
# 151 TYR H 151 TYR QD 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2296, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=2304,2313,
/
#
# 151 TYR H 151 TYR QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2296, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=2300,2301,
/
#
# 151 TYR QB 151 TYR QE 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 7.56, r4= 8.06,
igr1=2300,2301,
igr2=2306,2311,
/
#
# 151 TYR HA 151 TYR QE 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=2298, -1, r1= 1.35, r2= 1.85, r3= 7.30, r4= 7.80,
igr2=2306,2311,
/
#
# 151 TYR QD 151 TYR QB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.19, r4= 8.69,
igr1=2304,2313,
igr2=2300,2301,
/
#
# 151 TYR QD 151 TYR HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2298, r1= 1.35, r2= 1.85, r3= 7.30, r4= 7.80,
igr1=2304,2313,
/
#
# 151 TYR HA 151 TYR QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2298, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=2300,2301,
/
#
# 147 ALA HA 151 TYR QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2247, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=2300,2301,
/
#
# 151 TYR H 152 LEU H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2296,2317, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 149 GLU H 151 TYR H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2271,2296, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 151 TYR H 152 LEU H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2296,2317, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 151 TYR H 152 LEU 1HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2296,2321, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 152 LEU QQD 115 LEU QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2323, -1, r1= 1.35, r2= 1.85, r3= 7.81, r4= 8.31,
igr2=1743,1744,
/
#
# 152 LEU QQD 115 LEU HG 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2323,1746, r1= 1.35, r2= 1.85, r3= 5.20, r4= 5.70, /
#
# 152 LEU QQD 115 LEU QD1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2323, -1, r1= 1.35, r2= 1.85, r3= 8.20, r4= 8.70,
igr2=1748,1749,1750,
/
#
# 152 LEU H 150 ALA QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2317, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=2290,2291,2292,
/
#
# 152 LEU H 151 TYR QD 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2317, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=2304,2313,
/
#
# 152 LEU H 151 TYR QE 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2317, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=2306,2311,
/
#
# 152 LEU H 151 TYR HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2317,2298, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 152 LEU H 151 TYR QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2317, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=2300,2301,
/
#
# 152 LEU H 152 LEU HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2317,2319, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 152 LEU H 152 LEU 1HB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2317,2321, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 152 LEU 2HB 152 LEU QQD 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2322,2323, r1= 1.35, r2= 1.85, r3= 7.20, r4= 7.70, /
#
# 152 LEU QQD 152 LEU HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2323,2319, r1= 1.35, r2= 1.85, r3= 8.20, r4= 8.70, /
#
# 152 LEU HA 152 LEU HG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2319,2324, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 152 LEU 2HB 152 LEU HG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2322,2324, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 152 LEU 2HB 153 LEU QD2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2322, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=2349,2350,2351,
/
#
# 152 LEU H 152 LEU HG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2317,2324, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 152 LEU 1HB 152 LEU 2HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2321,2322, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 152 LEU 2HB 152 LEU HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2322,2319, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 152 LEU H 152 LEU QQD 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=2317,2323, r1= 1.35, r2= 1.85, r3= 8.70, r4= 9.20, /
#
# 152 LEU 1HB 152 LEU 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2321,2322, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 18 LEU QQD 152 LEU QD2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 259, -1, r1= 1.35, r2= 1.85, r3= 9.41, r4= 9.91,
igr2=2330,2331,2332,
/
#
# 148 VAL QG1 152 LEU QD1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.65, r4= 9.15,
igr1=2261,2262,2263,
igr2=2326,2327,2328,
/
#
# 18 LEU QD2 152 LEU QD1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.65, r4= 9.15,
igr1= 266, 267, 268,
igr2=2326,2327,2328,
/
#
# 152 LEU 1HB 152 LEU QQD 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2321,2323, r1= 1.35, r2= 1.85, r3= 7.20, r4= 7.70, /
#
# 13 ILE HB 152 LEU QD2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 176, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=2330,2331,2332,
/
#
# 152 LEU 2HB 152 LEU HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2322,2319, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 152 LEU H 153 LEU H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2317,2336, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 152 LEU H 153 LEU H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2317,2336, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 152 LEU 2HB 153 LEU HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2322,2338, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 152 LEU 1HB 153 LEU QD2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2321, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=2349,2350,2351,
/
#
# 152 LEU 1HB 152 LEU HG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2321,2324, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 153 LEU QD1 149 GLU QG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.74, r4= 7.24,
igr1=2345,2346,2347,
igr2=2278,2279,
/
#
# 153 LEU HG 149 GLU QG 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2343, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=2278,2279,
/
#
# 153 LEU H 150 ALA HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2336,2288, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 153 LEU H 152 LEU 1HB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2336,2321, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 153 LEU H 152 LEU 2HB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2336,2322, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 153 LEU H 153 LEU 2HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2336,2341, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 153 LEU H 152 LEU QQD 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2336,2323, r1= 1.35, r2= 1.85, r3= 7.20, r4= 7.70, /
#
# 11 SER H 152 LEU QD1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 145, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=2326,2327,2328,
/
#
# 10 THR H 152 LEU QD1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= 131, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=2326,2327,2328,
/
#
# 153 LEU HG 152 LEU 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2343,2322, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 153 LEU H 152 LEU HG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2336,2324, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 153 LEU H 152 LEU 2HB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=2336,2322, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 153 LEU HG 152 LEU 1HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2343,2321, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 153 LEU H 153 LEU HG 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2336,2343, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 153 LEU H 153 LEU 1HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2336,2340, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 153 LEU H 153 LEU QQD 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2336,2342, r1= 1.35, r2= 1.85, r3= 5.20, r4= 5.70, /
#
# 153 LEU H 153 LEU QD1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2336, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=2345,2346,2347,
/
#
# 153 LEU HG 153 LEU QD2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2343, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=2349,2350,2351,
/
#
# 153 LEU 1HB 153 LEU QD2 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2340, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=2349,2350,2351,
/
#
# 153 LEU 1HB 153 LEU 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2340,2341, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 153 LEU H 153 LEU HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2336,2338, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 153 LEU 1HB 153 LEU HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2340,2338, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 153 LEU HG 153 LEU HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2343,2338, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 153 LEU 2HB 153 LEU HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2341,2338, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 153 LEU 2HB 154 ALA HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2341,2357, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 153 LEU 2HB 153 LEU QQD 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2341,2342, r1= 1.35, r2= 1.85, r3= 7.20, r4= 7.70, /
#
# 153 LEU 2HB 153 LEU QD2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2341, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=2349,2350,2351,
/
#
# 153 LEU 1HB 153 LEU QD1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2340, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=2345,2346,2347,
/
#
# 153 LEU HG 153 LEU QD1 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2343, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=2345,2346,2347,
/
#
# 153 LEU QQD 153 LEU HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2342,2338, r1= 1.35, r2= 1.85, r3= 7.20, r4= 7.70, /
#
# 153 LEU 2HB 153 LEU HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2341,2338, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 152 LEU 2HB 153 LEU HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2322,2338, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 153 LEU QD1 153 LEU HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2338, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr1=2345,2346,2347,
/
#
# 153 LEU 1HB 153 LEU QQD 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2340,2342, r1= 1.35, r2= 1.85, r3= 7.20, r4= 7.70, /
#
# 153 LEU HG 153 LEU 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2343,2341, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 153 LEU 1HB 153 LEU 2HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2340,2341, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 153 LEU 2HB 153 LEU QD1 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2341, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=2345,2346,2347,
/
#
# 153 LEU H 154 ALA H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2336,2355, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 153 LEU H 154 ALA QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2336, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=2359,2360,2361,
/
#
# 153 LEU H 154 ALA H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2336,2355, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 153 LEU 1HB 154 ALA HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2340,2357, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 153 LEU 1HB 153 LEU HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2340,2338, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 153 LEU HA 155 HIS 1HB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=2338,2369, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 153 LEU HA 155 HIS 2HB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=2338,2370, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 154 ALA QB 150 ALA QB 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 4.04, r4= 4.54,
igr1=2359,2360,2361,
igr2=2290,2291,2292,
/
#
# 154 ALA QB 151 TYR HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2298, r1= 1.35, r2= 1.85, r3= 7.81, r4= 8.31,
igr1=2359,2360,2361,
/
#
# 154 ALA QB 151 TYR HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2298, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1=2359,2360,2361,
/
#
# 154 ALA H 153 LEU 1HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2355,2340, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 154 ALA H 153 LEU 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2355,2341, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 154 ALA H 153 LEU QQD 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2355,2342, r1= 1.35, r2= 1.85, r3= 7.20, r4= 7.70, /
#
# 154 ALA H 153 LEU 2HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2355,2341, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 154 ALA H 153 LEU HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2355,2338, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 154 ALA QB 153 LEU HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2338, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr1=2359,2360,2361,
/
#
# 154 ALA QB 154 ALA HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2357, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1=2359,2360,2361,
/
#
# 154 ALA H 153 LEU 1HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2355,2340, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 154 ALA H 154 ALA HA 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2355,2357, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 154 ALA H 153 LEU HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2355,2338, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 154 ALA H 154 ALA QB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2355, -1, r1= 1.35, r2= 1.85, r3= 3.60, r4= 4.10,
igr2=2359,2360,2361,
/
#
# 154 ALA H 154 ALA HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2355,2357, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 154 ALA H 154 ALA QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2355, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=2359,2360,2361,
/
#
# 154 ALA QB 154 ALA HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2357, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr1=2359,2360,2361,
/
#
# 154 ALA H 155 HIS H 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2355,2365, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 154 ALA H 155 HIS H 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2355,2365, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 154 ALA HA 155 HIS HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2357,2367, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 155 HIS H 153 LEU HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2365,2338, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 155 HIS H 154 ALA HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2365,2357, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 155 HIS H 154 ALA QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2365, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=2359,2360,2361,
/
#
# 155 HIS H 154 ALA HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2365,2357, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 155 HIS H 154 ALA QB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=2365, -1, r1= 1.35, r2= 1.85, r3= 7.81, r4= 8.31,
igr2=2359,2360,2361,
/
#
# 155 HIS H 155 HIS HD2 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2365,2378, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 155 HIS H 155 HIS HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2365,2367, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 155 HIS H 155 HIS 1HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2365,2369, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 155 HIS H 155 HIS 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2365,2370, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 155 HIS H 155 HIS 2HB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=2365,2370, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 155 HIS H 155 HIS 1HB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=2365,2369, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 155 HIS H 155 HIS HA 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=2365,2367, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 155 HIS HA 155 HIS 1HB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=2367,2369, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 155 HIS HA 155 HIS 2HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2367,2370, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 155 HIS 1HB 155 HIS 2HB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=2369,2370, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 155 HIS 1HB 155 HIS 2HB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=2369,2370, r1= 1.35, r2= 1.85, r3= 6.50, r4= 7.00, /
#
# 156 PRO 1HB 156 PRO 2HB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2389,2390, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 156 PRO HA 156 PRO 2HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2392,2390, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 156 PRO QG 156 PRO QD 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.30, r4= 6.80,
igr1=2386,2387,
igr2=2383,2384,
/
#
# 156 PRO HA 156 PRO QG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2392, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=2386,2387,
/
#
# 156 PRO HA 156 PRO 1HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2392,2389, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 156 PRO 2HB 156 PRO QG 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2390, -1, r1= 1.35, r2= 1.85, r3= 3.37, r4= 3.87,
igr2=2386,2387,
/
#
# 156 PRO 2HB 156 PRO QG 1.85 2.80
&rst
ixpk= 0, nxpk= 0, iat=2390, -1, r1= 1.35, r2= 1.85, r3= 3.14, r4= 3.64,
igr2=2386,2387,
/
#
# 156 PRO 1HB 156 PRO 2HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2389,2390, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 156 PRO HA 156 PRO 1HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2392,2389, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 156 PRO HA 156 PRO 2HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2392,2390, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 156 PRO QG 156 PRO QD 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.30, r4= 6.80,
igr1=2386,2387,
igr2=2383,2384,
/
#
# 156 PRO 1HB 156 PRO QD 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2389, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=2383,2384,
/
#
# 157 ASP H 156 PRO HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2396,2392, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 157 ASP H 156 PRO 1HB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2396,2389, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 157 ASP H 156 PRO 1HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2396,2389, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 157 ASP H 156 PRO HA 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2396,2392, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 157 ASP H 156 PRO 2HB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2396,2390, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 157 ASP H 156 PRO QD 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2396, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=2383,2384,
/
#
# 157 ASP H 156 PRO QG 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2396, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=2386,2387,
/
#
# 157 ASP H 157 ASP HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2396,2398, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 157 ASP H 157 ASP QB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2396, -1, r1= 1.35, r2= 1.85, r3= 3.37, r4= 3.87,
igr2=2400,2401,
/
#
# 157 ASP HA 157 ASP QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2398, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=2400,2401,
/
#
# 157 ASP H 157 ASP QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2396, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=2400,2401,
/
#
# 157 ASP QB 159 TYR QD 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 6.30, r4= 6.80,
igr1=2400,2401,
igr2=2426,2435,
/
#
# 158 ALA H 157 ASP H 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2408,2396, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 158 ALA H 157 ASP HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2408,2398, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 158 ALA H 157 ASP QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2408, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=2400,2401,
/
#
# 158 ALA H 157 ASP H 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2408,2396, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 158 ALA QB 157 ASP H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2396, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr1=2412,2413,2414,
/
#
# 158 ALA H 157 ASP QB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=2408, -1, r1= 1.35, r2= 1.85, r3= 7.30, r4= 7.80,
igr2=2400,2401,
/
#
# 158 ALA HA 158 ALA H 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2410,2408, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 158 ALA QB 158 ALA H 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2408, r1= 1.35, r2= 1.85, r3= 3.60, r4= 4.10,
igr1=2412,2413,2414,
/
#
# 158 ALA QB 158 ALA H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2408, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr1=2412,2413,2414,
/
#
# 158 ALA HA 158 ALA QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2410, -1, r1= 1.35, r2= 1.85, r3= 7.21, r4= 7.71,
igr2=2412,2413,2414,
/
#
# 158 ALA HA 158 ALA QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2410, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=2412,2413,2414,
/
#
# 158 ALA HA 159 TYR QD 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2410, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=2426,2435,
/
#
# 158 ALA HA 159 TYR QE 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=2410, -1, r1= 1.35, r2= 1.85, r3= 7.30, r4= 7.80,
igr2=2428,2433,
/
#
# 158 ALA QB 159 TYR QD 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.76, r4= 9.26,
igr1=2412,2413,2414,
igr2=2426,2435,
/
#
# 158 ALA QB 160 CYS QB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.76, r4= 9.26,
igr1=2412,2413,2414,
igr2=2443,2444,
/
#
# 159 TYR H 158 ALA HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2418,2410, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 159 TYR H 158 ALA QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2418, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=2412,2413,2414,
/
#
# 159 TYR H 158 ALA HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2418,2410, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 159 TYR H 159 TYR HA 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2418,2420, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 159 TYR HA 159 TYR QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2420, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=2422,2423,
/
#
# 159 TYR QD 159 TYR QB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 8.19, r4= 8.69,
igr1=2426,2435,
igr2=2422,2423,
/
#
# 159 TYR QB 159 TYR QE 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 7.56, r4= 8.06,
igr1=2422,2423,
igr2=2428,2433,
/
#
# 159 TYR HA 159 TYR QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2420, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=2422,2423,
/
#
# 159 TYR H 160 CYS H 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2418,2439, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50, /
#
# 159 TYR H 160 CYS H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2418,2439, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 159 TYR QB 160 CYS QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.35, r2= 1.85, r3= 7.56, r4= 8.06,
igr1=2422,2423,
igr2=2443,2444,
/
#
# 160 CYS H 158 ALA H 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2439,2408, r1= 1.35, r2= 1.85, r3= 5.00, r4= 5.50, /
#
# 160 CYS H 158 ALA QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2439, -1, r1= 1.35, r2= 1.85, r3= 6.00, r4= 6.50,
igr2=2412,2413,2414,
/
#
# 160 CYS H 158 ALA QB 1.85 6.50
&rst
ixpk= 0, nxpk= 0, iat=2439, -1, r1= 1.35, r2= 1.85, r3= 7.81, r4= 8.31,
igr2=2412,2413,2414,
/
#
# 160 CYS H 159 TYR QD 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2439, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=2426,2435,
/
#
# 160 CYS H 159 TYR HA 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2439,2420, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 160 CYS H 159 TYR QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2439, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=2422,2423,
/
#
# 160 CYS H 160 CYS HA 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2439,2441, r1= 1.35, r2= 1.85, r3= 3.00, r4= 3.50, /
#
# 160 CYS H 160 CYS QB 1.85 3.00
&rst
ixpk= 0, nxpk= 0, iat=2439, -1, r1= 1.35, r2= 1.85, r3= 3.37, r4= 3.87,
igr2=2443,2444,
/
#
# 160 CYS HA 160 CYS QB 1.85 5.00
&rst
ixpk= 0, nxpk= 0, iat=2441, -1, r1= 1.35, r2= 1.85, r3= 5.61, r4= 6.11,
igr2=2443,2444,
/
#
# 160 CYS H 160 CYS QB 1.85 6.00
&rst
ixpk= 0, nxpk= 0, iat=2439, -1, r1= 1.35, r2= 1.85, r3= 6.73, r4= 7.23,
igr2=2443,2444,
/
#
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