NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
492202 |
2k4w   |
15112 | cing | 1-original | 1 | AMBER | distance | NOE | simple |
#
# 1 ALA HA 2 SER HN 2.97
&rst
ixpk= 0, nxpk= 0, iat= 6, 14, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47,
rk2=50.0, rk3=50.0, ir6=1, ialtd=0,
&end
#
# 1 ALA HA 2 SER HN 3.16
&rst
ixpk= 0, nxpk= 0, iat= 6, 14, r1= 1.30, r2= 1.80, r3= 3.16, r4= 3.66, &end
#
# 1 ALA HA 2 SER HN 3.16
&rst
ixpk= 0, nxpk= 0, iat= 6, 14, r1= 1.30, r2= 1.80, r3= 3.16, r4= 3.66, &end
#
# 1 ALA HA 2 SER HN 3.16
&rst
ixpk= 0, nxpk= 0, iat= 6, 14, r1= 1.30, r2= 1.80, r3= 3.16, r4= 3.66, &end
#
# 1 ALA HA 2 SER HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 6, 16, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 1 ALA HA 2 SER HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 6, 16, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 1 ALA HA 2 SER HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 6, 16, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 1 ALA HA 117 LEU QD2 5.69
&rst
ixpk= 0, nxpk= 0, iat= 6, -1, r1= 1.30, r2= 1.80, r3= 6.83, r4= 7.33,
igr2=1652,1653,1654,
&end
#
# 1 ALA HA 117 LEU QD2 5.69
&rst
ixpk= 0, nxpk= 0, iat= 6, -1, r1= 1.30, r2= 1.80, r3= 6.83, r4= 7.33,
igr2=1652,1653,1654,
&end
#
# 1 ALA HA 117 LEU QD2 5.69
&rst
ixpk= 0, nxpk= 0, iat= 6, -1, r1= 1.30, r2= 1.80, r3= 6.83, r4= 7.33,
igr2=1652,1653,1654,
&end
#
# 1 ALA QB 2 SER HN 5.72
&rst
ixpk= 0, nxpk= 0, iat= -1, 14, r1= 1.30, r2= 1.80, r3= 6.87, r4= 7.37,
igr1= 8, 9, 10,
&end
#
# 1 ALA QB 1 ALA HA 3.66
&rst
ixpk= 0, nxpk= 0, iat= -1, 6, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,
igr1= 8, 9, 10,
&end
#
# 1 ALA QB 2 SER HN 3.48
&rst
ixpk= 0, nxpk= 0, iat= -1, 14, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
igr1= 8, 9, 10,
&end
#
# 1 ALA QB 2 SER HN 3.48
&rst
ixpk= 0, nxpk= 0, iat= -1, 14, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
igr1= 8, 9, 10,
&end
#
# 1 ALA QB 2 SER HN 3.48
&rst
ixpk= 0, nxpk= 0, iat= -1, 14, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
igr1= 8, 9, 10,
&end
#
# 1 ALA QB 2 SER HA 5.40
&rst
ixpk= 0, nxpk= 0, iat= -1, 16, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
igr1= 8, 9, 10,
&end
#
# 1 ALA QB 2 SER HA 5.40
&rst
ixpk= 0, nxpk= 0, iat= -1, 16, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
igr1= 8, 9, 10,
&end
#
# 1 ALA QB 2 SER HA 5.40
&rst
ixpk= 0, nxpk= 0, iat= -1, 16, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
igr1= 8, 9, 10,
&end
#
# 1 ALA QB 2 SER HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 18, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 8, 9, 10,
&end
#
# 1 ALA QB 2 SER HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 18, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 8, 9, 10,
&end
#
# 1 ALA QB 2 SER HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 18, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 8, 9, 10,
&end
#
# 1 ALA QB 2 SER HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 19, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 8, 9, 10,
&end
#
# 1 ALA QB 2 SER HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 19, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 8, 9, 10,
&end
#
# 1 ALA QB 2 SER HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 19, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 8, 9, 10,
&end
#
# 1 ALA QB 26 GLU HN 5.63
&rst
ixpk= 0, nxpk= 0, iat= -1, 353, r1= 1.30, r2= 1.80, r3= 6.76, r4= 7.26,
igr1= 8, 9, 10,
&end
#
# 1 ALA QB 26 GLU HN 5.63
&rst
ixpk= 0, nxpk= 0, iat= -1, 353, r1= 1.30, r2= 1.80, r3= 6.76, r4= 7.26,
igr1= 8, 9, 10,
&end
#
# 1 ALA QB 26 GLU HN 5.63
&rst
ixpk= 0, nxpk= 0, iat= -1, 353, r1= 1.30, r2= 1.80, r3= 6.76, r4= 7.26,
igr1= 8, 9, 10,
&end
#
# 1 ALA QB 117 LEU QD2 3.83
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
igr1= 8, 9, 10,
igr2=1652,1653,1654,
&end
#
# 1 ALA QB 117 LEU QD2 3.83
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
igr1= 8, 9, 10,
igr2=1652,1653,1654,
&end
#
# 1 ALA QB 117 LEU QD2 3.83
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
igr1= 8, 9, 10,
igr2=1652,1653,1654,
&end
#
# 2 SER HN 2 SER HA 4.01
&rst
ixpk= 0, nxpk= 0, iat= 14, 16, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51, &end
#
# 2 SER HN 2 SER HB2 4.51
&rst
ixpk= 0, nxpk= 0, iat= 14, 18, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01, &end
#
# 2 SER HN 2 SER HB2 4.51
&rst
ixpk= 0, nxpk= 0, iat= 14, 18, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01, &end
#
# 2 SER HN 2 SER HB2 4.51
&rst
ixpk= 0, nxpk= 0, iat= 14, 18, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01, &end
#
# 2 SER HN 2 SER HB3 4.52
&rst
ixpk= 0, nxpk= 0, iat= 14, 19, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02, &end
#
# 2 SER HN 2 SER HB3 4.52
&rst
ixpk= 0, nxpk= 0, iat= 14, 19, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02, &end
#
# 2 SER HN 2 SER HB3 4.52
&rst
ixpk= 0, nxpk= 0, iat= 14, 19, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02, &end
#
# 2 SER HN 3 GLU HN 5.05
&rst
ixpk= 0, nxpk= 0, iat= 14, 25, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55, &end
#
# 2 SER HN 3 GLU HN 5.05
&rst
ixpk= 0, nxpk= 0, iat= 14, 25, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55, &end
#
# 2 SER HN 3 GLU HN 5.05
&rst
ixpk= 0, nxpk= 0, iat= 14, 25, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55, &end
#
# 2 SER HN 3 GLU HN 5.28
&rst
ixpk= 0, nxpk= 0, iat= 14, 25, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 2 SER HN 25 ASP HA 5.60
&rst
ixpk= 0, nxpk= 0, iat= 14, 343, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10, &end
#
# 2 SER HN 25 ASP HA 5.60
&rst
ixpk= 0, nxpk= 0, iat= 14, 343, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10, &end
#
# 2 SER HN 25 ASP HA 5.60
&rst
ixpk= 0, nxpk= 0, iat= 14, 343, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10, &end
#
# 2 SER HN 26 GLU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 14, 353, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 2 SER HN 26 GLU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 14, 353, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 2 SER HN 26 GLU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 14, 353, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 2 SER HN 117 LEU QD2 3.76
&rst
ixpk= 0, nxpk= 0, iat= 14, -1, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
igr2=1652,1653,1654,
&end
#
# 2 SER HN 117 LEU QD2 3.76
&rst
ixpk= 0, nxpk= 0, iat= 14, -1, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
igr2=1652,1653,1654,
&end
#
# 2 SER HN 117 LEU QD2 3.76
&rst
ixpk= 0, nxpk= 0, iat= 14, -1, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
igr2=1652,1653,1654,
&end
#
# 2 SER HA 2 SER HB2 4.10
&rst
ixpk= 0, nxpk= 0, iat= 16, 18, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60, &end
#
# 2 SER HA 2 SER HB3 3.88
&rst
ixpk= 0, nxpk= 0, iat= 16, 19, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38, &end
#
# 2 SER HA 3 GLU HN 2.97
&rst
ixpk= 0, nxpk= 0, iat= 16, 25, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 2 SER HA 3 GLU HN 3.34
&rst
ixpk= 0, nxpk= 0, iat= 16, 25, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84, &end
#
# 2 SER HA 3 GLU HN 3.34
&rst
ixpk= 0, nxpk= 0, iat= 16, 25, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84, &end
#
# 2 SER HA 3 GLU HN 3.34
&rst
ixpk= 0, nxpk= 0, iat= 16, 25, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84, &end
#
# 2 SER HA 3 GLU HA 5.82
&rst
ixpk= 0, nxpk= 0, iat= 16, 27, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32, &end
#
# 2 SER HA 3 GLU HA 5.82
&rst
ixpk= 0, nxpk= 0, iat= 16, 27, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32, &end
#
# 2 SER HA 3 GLU HA 5.82
&rst
ixpk= 0, nxpk= 0, iat= 16, 27, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32, &end
#
# 2 SER HA 3 GLU HB2 5.35
&rst
ixpk= 0, nxpk= 0, iat= 16, 29, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85, &end
#
# 2 SER HA 3 GLU HB2 5.35
&rst
ixpk= 0, nxpk= 0, iat= 16, 29, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85, &end
#
# 2 SER HA 3 GLU HB2 5.35
&rst
ixpk= 0, nxpk= 0, iat= 16, 29, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85, &end
#
# 2 SER HA 3 GLU HB3 5.80
&rst
ixpk= 0, nxpk= 0, iat= 16, 30, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30, &end
#
# 2 SER HA 3 GLU HB3 5.80
&rst
ixpk= 0, nxpk= 0, iat= 16, 30, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30, &end
#
# 2 SER HA 3 GLU HB3 5.80
&rst
ixpk= 0, nxpk= 0, iat= 16, 30, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30, &end
#
# 2 SER HA 4 LYS HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 16, 40, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 2 SER HA 4 LYS HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 16, 40, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 2 SER HA 4 LYS HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 16, 40, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 2 SER HA 24 ILE HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 16, 322, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 2 SER HA 24 ILE HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 16, 322, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 2 SER HA 24 ILE HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 16, 322, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 2 SER HA 24 ILE HB 5.88
&rst
ixpk= 0, nxpk= 0, iat= 16, 326, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38, &end
#
# 2 SER HA 24 ILE HB 5.88
&rst
ixpk= 0, nxpk= 0, iat= 16, 326, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38, &end
#
# 2 SER HA 24 ILE HB 5.88
&rst
ixpk= 0, nxpk= 0, iat= 16, 326, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38, &end
#
# 2 SER HA 24 ILE QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 16, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 328, 329, 330,
&end
#
# 2 SER HA 24 ILE QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 16, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 328, 329, 330,
&end
#
# 2 SER HA 24 ILE QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 16, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 328, 329, 330,
&end
#
# 2 SER HA 25 ASP HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 16, 341, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 2 SER HA 25 ASP HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 16, 341, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 2 SER HA 25 ASP HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 16, 341, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 2 SER HA 25 ASP HA 4.01
&rst
ixpk= 0, nxpk= 0, iat= 16, 343, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51, &end
#
# 2 SER HA 25 ASP HA 4.01
&rst
ixpk= 0, nxpk= 0, iat= 16, 343, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51, &end
#
# 2 SER HA 25 ASP HA 4.01
&rst
ixpk= 0, nxpk= 0, iat= 16, 343, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51, &end
#
# 2 SER HA 25 ASP HB3 5.43
&rst
ixpk= 0, nxpk= 0, iat= 16, 346, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93, &end
#
# 2 SER HA 25 ASP HB3 5.43
&rst
ixpk= 0, nxpk= 0, iat= 16, 346, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93, &end
#
# 2 SER HA 25 ASP HB3 5.43
&rst
ixpk= 0, nxpk= 0, iat= 16, 346, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93, &end
#
# 2 SER HA 26 GLU HN 4.47
&rst
ixpk= 0, nxpk= 0, iat= 16, 353, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97, &end
#
# 2 SER HA 26 GLU HN 4.47
&rst
ixpk= 0, nxpk= 0, iat= 16, 353, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97, &end
#
# 2 SER HA 26 GLU HN 4.47
&rst
ixpk= 0, nxpk= 0, iat= 16, 353, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97, &end
#
# 2 SER HA 117 LEU QD2 4.38
&rst
ixpk= 0, nxpk= 0, iat= 16, -1, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr2=1652,1653,1654,
&end
#
# 2 SER HA 117 LEU QD2 4.38
&rst
ixpk= 0, nxpk= 0, iat= 16, -1, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr2=1652,1653,1654,
&end
#
# 2 SER HA 117 LEU QD2 4.38
&rst
ixpk= 0, nxpk= 0, iat= 16, -1, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr2=1652,1653,1654,
&end
#
# 2 SER HB2 3 GLU HN 4.09
&rst
ixpk= 0, nxpk= 0, iat= 18, 25, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59, &end
#
# 2 SER HB2 3 GLU HN 4.09
&rst
ixpk= 0, nxpk= 0, iat= 18, 25, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59, &end
#
# 2 SER HB2 3 GLU HN 4.09
&rst
ixpk= 0, nxpk= 0, iat= 18, 25, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59, &end
#
# 2 SER HB2 3 GLU HN 5.72
&rst
ixpk= 0, nxpk= 0, iat= 18, 25, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 2 SER HB2 23 VAL QG2 5.87
&rst
ixpk= 0, nxpk= 0, iat= 18, -1, r1= 1.30, r2= 1.80, r3= 7.05, r4= 7.55,
igr2= 316, 317, 318,
&end
#
# 2 SER HB2 23 VAL QG2 5.87
&rst
ixpk= 0, nxpk= 0, iat= 18, -1, r1= 1.30, r2= 1.80, r3= 7.05, r4= 7.55,
igr2= 316, 317, 318,
&end
#
# 2 SER HB2 23 VAL QG2 5.87
&rst
ixpk= 0, nxpk= 0, iat= 18, -1, r1= 1.30, r2= 1.80, r3= 7.05, r4= 7.55,
igr2= 316, 317, 318,
&end
#
# 2 SER HB2 25 ASP HA 5.31
&rst
ixpk= 0, nxpk= 0, iat= 18, 343, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81, &end
#
# 2 SER HB2 25 ASP HA 5.31
&rst
ixpk= 0, nxpk= 0, iat= 18, 343, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81, &end
#
# 2 SER HB2 25 ASP HA 5.31
&rst
ixpk= 0, nxpk= 0, iat= 18, 343, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81, &end
#
# 2 SER HB3 3 GLU HN 5.51
&rst
ixpk= 0, nxpk= 0, iat= 19, 25, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01, &end
#
# 2 SER HB3 3 GLU HN 5.51
&rst
ixpk= 0, nxpk= 0, iat= 19, 25, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01, &end
#
# 2 SER HB3 3 GLU HN 5.51
&rst
ixpk= 0, nxpk= 0, iat= 19, 25, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01, &end
#
# 2 SER HB3 3 GLU HA 5.48
&rst
ixpk= 0, nxpk= 0, iat= 19, 27, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98, &end
#
# 2 SER HB3 3 GLU HA 5.48
&rst
ixpk= 0, nxpk= 0, iat= 19, 27, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98, &end
#
# 2 SER HB3 3 GLU HA 5.48
&rst
ixpk= 0, nxpk= 0, iat= 19, 27, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98, &end
#
# 2 SER HB3 4 LYS QB 5.51
&rst
ixpk= 0, nxpk= 0, iat= 19, -1, r1= 1.30, r2= 1.80, r3= 6.18, r4= 6.68,
igr2= 44, 45,
&end
#
# 2 SER HB3 4 LYS QB 5.51
&rst
ixpk= 0, nxpk= 0, iat= 19, -1, r1= 1.30, r2= 1.80, r3= 6.18, r4= 6.68,
igr2= 44, 45,
&end
#
# 2 SER HB3 4 LYS QB 5.51
&rst
ixpk= 0, nxpk= 0, iat= 19, -1, r1= 1.30, r2= 1.80, r3= 6.18, r4= 6.68,
igr2= 44, 45,
&end
#
# 2 SER HB3 23 VAL QG2 5.09
&rst
ixpk= 0, nxpk= 0, iat= 19, -1, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
igr2= 316, 317, 318,
&end
#
# 2 SER HB3 23 VAL QG2 5.09
&rst
ixpk= 0, nxpk= 0, iat= 19, -1, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
igr2= 316, 317, 318,
&end
#
# 2 SER HB3 23 VAL QG2 5.09
&rst
ixpk= 0, nxpk= 0, iat= 19, -1, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
igr2= 316, 317, 318,
&end
#
# 2 SER HB3 24 ILE HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 19, 322, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 2 SER HB3 24 ILE HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 19, 322, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 2 SER HB3 24 ILE HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 19, 322, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 2 SER HB3 25 ASP HA 4.71
&rst
ixpk= 0, nxpk= 0, iat= 19, 343, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21, &end
#
# 2 SER HB3 25 ASP HA 4.71
&rst
ixpk= 0, nxpk= 0, iat= 19, 343, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21, &end
#
# 2 SER HB3 25 ASP HA 4.71
&rst
ixpk= 0, nxpk= 0, iat= 19, 343, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21, &end
#
# 2 SER HB3 25 ASP HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 19, 345, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 2 SER HB3 25 ASP HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 19, 345, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 2 SER HB3 25 ASP HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 19, 345, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 2 SER HB3 25 ASP HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 19, 346, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 2 SER HB3 25 ASP HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 19, 346, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 2 SER HB3 25 ASP HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 19, 346, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 2 SER HB3 117 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 19, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1652,1653,1654,
&end
#
# 2 SER HB3 117 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 19, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1652,1653,1654,
&end
#
# 2 SER HB3 117 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 19, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1652,1653,1654,
&end
#
# 3 GLU HN 3 GLU HB2 4.41
&rst
ixpk= 0, nxpk= 0, iat= 25, 29, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, &end
#
# 3 GLU HN 3 GLU HB2 4.41
&rst
ixpk= 0, nxpk= 0, iat= 25, 29, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, &end
#
# 3 GLU HN 3 GLU HB2 4.41
&rst
ixpk= 0, nxpk= 0, iat= 25, 29, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, &end
#
# 3 GLU HN 3 GLU HB3 4.59
&rst
ixpk= 0, nxpk= 0, iat= 25, 30, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 3 GLU HN 3 GLU HB3 4.59
&rst
ixpk= 0, nxpk= 0, iat= 25, 30, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 3 GLU HN 3 GLU HB3 4.59
&rst
ixpk= 0, nxpk= 0, iat= 25, 30, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 3 GLU HN 3 GLU HG2 5.54
&rst
ixpk= 0, nxpk= 0, iat= 25, 32, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04, &end
#
# 3 GLU HN 3 GLU HG2 5.54
&rst
ixpk= 0, nxpk= 0, iat= 25, 32, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04, &end
#
# 3 GLU HN 3 GLU HG2 5.54
&rst
ixpk= 0, nxpk= 0, iat= 25, 32, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04, &end
#
# 3 GLU HN 4 LYS HN 5.28
&rst
ixpk= 0, nxpk= 0, iat= 25, 40, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 3 GLU HN 4 LYS HN 5.42
&rst
ixpk= 0, nxpk= 0, iat= 25, 40, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92, &end
#
# 3 GLU HN 4 LYS HN 5.42
&rst
ixpk= 0, nxpk= 0, iat= 25, 40, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92, &end
#
# 3 GLU HN 4 LYS HN 5.42
&rst
ixpk= 0, nxpk= 0, iat= 25, 40, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92, &end
#
# 3 GLU HN 5 VAL QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 25, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 72, 73, 74,
&end
#
# 3 GLU HN 5 VAL QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 25, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 72, 73, 74,
&end
#
# 3 GLU HN 5 VAL QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 25, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 72, 73, 74,
&end
#
# 3 GLU HN 23 VAL QG2 5.47
&rst
ixpk= 0, nxpk= 0, iat= 25, -1, r1= 1.30, r2= 1.80, r3= 6.57, r4= 7.07,
igr2= 316, 317, 318,
&end
#
# 3 GLU HN 23 VAL QG2 5.47
&rst
ixpk= 0, nxpk= 0, iat= 25, -1, r1= 1.30, r2= 1.80, r3= 6.57, r4= 7.07,
igr2= 316, 317, 318,
&end
#
# 3 GLU HN 23 VAL QG2 5.47
&rst
ixpk= 0, nxpk= 0, iat= 25, -1, r1= 1.30, r2= 1.80, r3= 6.57, r4= 7.07,
igr2= 316, 317, 318,
&end
#
# 3 GLU HN 24 ILE HN 4.09
&rst
ixpk= 0, nxpk= 0, iat= 25, 322, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59, &end
#
# 3 GLU HN 24 ILE HN 4.09
&rst
ixpk= 0, nxpk= 0, iat= 25, 322, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59, &end
#
# 3 GLU HN 24 ILE HN 4.09
&rst
ixpk= 0, nxpk= 0, iat= 25, 322, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59, &end
#
# 3 GLU HN 24 ILE HA 5.33
&rst
ixpk= 0, nxpk= 0, iat= 25, 324, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83, &end
#
# 3 GLU HN 24 ILE HA 5.33
&rst
ixpk= 0, nxpk= 0, iat= 25, 324, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83, &end
#
# 3 GLU HN 24 ILE HA 5.33
&rst
ixpk= 0, nxpk= 0, iat= 25, 324, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83, &end
#
# 3 GLU HN 24 ILE HB 4.49
&rst
ixpk= 0, nxpk= 0, iat= 25, 326, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99, &end
#
# 3 GLU HN 24 ILE HB 4.49
&rst
ixpk= 0, nxpk= 0, iat= 25, 326, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99, &end
#
# 3 GLU HN 24 ILE HB 4.49
&rst
ixpk= 0, nxpk= 0, iat= 25, 326, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99, &end
#
# 3 GLU HN 24 ILE HG12 6.05
&rst
ixpk= 0, nxpk= 0, iat= 25, 332, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 3 GLU HN 24 ILE HG12 6.05
&rst
ixpk= 0, nxpk= 0, iat= 25, 332, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 3 GLU HN 24 ILE HG12 6.05
&rst
ixpk= 0, nxpk= 0, iat= 25, 332, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 3 GLU HN 24 ILE QG2 5.24
&rst
ixpk= 0, nxpk= 0, iat= 25, -1, r1= 1.30, r2= 1.80, r3= 6.29, r4= 6.79,
igr2= 328, 329, 330,
&end
#
# 3 GLU HN 24 ILE QG2 5.24
&rst
ixpk= 0, nxpk= 0, iat= 25, -1, r1= 1.30, r2= 1.80, r3= 6.29, r4= 6.79,
igr2= 328, 329, 330,
&end
#
# 3 GLU HN 24 ILE QG2 5.24
&rst
ixpk= 0, nxpk= 0, iat= 25, -1, r1= 1.30, r2= 1.80, r3= 6.29, r4= 6.79,
igr2= 328, 329, 330,
&end
#
# 3 GLU HN 25 ASP HA 4.65
&rst
ixpk= 0, nxpk= 0, iat= 25, 343, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15, &end
#
# 3 GLU HN 25 ASP HA 4.65
&rst
ixpk= 0, nxpk= 0, iat= 25, 343, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15, &end
#
# 3 GLU HN 25 ASP HA 4.65
&rst
ixpk= 0, nxpk= 0, iat= 25, 343, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15, &end
#
# 3 GLU HN 25 ASP HB2 4.69
&rst
ixpk= 0, nxpk= 0, iat= 25, 345, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, &end
#
# 3 GLU HN 25 ASP HB2 4.69
&rst
ixpk= 0, nxpk= 0, iat= 25, 345, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, &end
#
# 3 GLU HN 25 ASP HB2 4.69
&rst
ixpk= 0, nxpk= 0, iat= 25, 345, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, &end
#
# 3 GLU HN 25 ASP HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 25, 346, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 3 GLU HN 25 ASP HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 25, 346, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 3 GLU HN 25 ASP HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 25, 346, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 3 GLU HN 26 GLU HN 5.41
&rst
ixpk= 0, nxpk= 0, iat= 25, 353, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91, &end
#
# 3 GLU HN 26 GLU HN 5.41
&rst
ixpk= 0, nxpk= 0, iat= 25, 353, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91, &end
#
# 3 GLU HN 26 GLU HN 5.41
&rst
ixpk= 0, nxpk= 0, iat= 25, 353, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91, &end
#
# 3 GLU HN 117 LEU QD2 3.56
&rst
ixpk= 0, nxpk= 0, iat= 25, -1, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,
igr2=1652,1653,1654,
&end
#
# 3 GLU HN 117 LEU QD2 3.56
&rst
ixpk= 0, nxpk= 0, iat= 25, -1, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,
igr2=1652,1653,1654,
&end
#
# 3 GLU HN 117 LEU QD2 3.56
&rst
ixpk= 0, nxpk= 0, iat= 25, -1, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,
igr2=1652,1653,1654,
&end
#
# 3 GLU HA 3 GLU HB2 3.83
&rst
ixpk= 0, nxpk= 0, iat= 27, 29, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33, &end
#
# 3 GLU HA 3 GLU HB3 3.77
&rst
ixpk= 0, nxpk= 0, iat= 27, 30, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27, &end
#
# 3 GLU HA 3 GLU HG3 3.97
&rst
ixpk= 0, nxpk= 0, iat= 27, 33, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47, &end
#
# 3 GLU HA 3 GLU HG3 3.97
&rst
ixpk= 0, nxpk= 0, iat= 27, 33, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47, &end
#
# 3 GLU HA 3 GLU HG3 3.97
&rst
ixpk= 0, nxpk= 0, iat= 27, 33, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47, &end
#
# 3 GLU HA 4 LYS HN 2.97
&rst
ixpk= 0, nxpk= 0, iat= 27, 40, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 3 GLU HA 4 LYS HN 3.06
&rst
ixpk= 0, nxpk= 0, iat= 27, 40, r1= 1.30, r2= 1.80, r3= 3.06, r4= 3.56, &end
#
# 3 GLU HA 4 LYS HN 3.06
&rst
ixpk= 0, nxpk= 0, iat= 27, 40, r1= 1.30, r2= 1.80, r3= 3.06, r4= 3.56, &end
#
# 3 GLU HA 4 LYS HN 3.06
&rst
ixpk= 0, nxpk= 0, iat= 27, 40, r1= 1.30, r2= 1.80, r3= 3.06, r4= 3.56, &end
#
# 3 GLU HB2 3 GLU HB3 3.31
&rst
ixpk= 0, nxpk= 0, iat= 29, 30, r1= 1.30, r2= 1.80, r3= 3.31, r4= 3.81, &end
#
# 3 GLU HB2 4 LYS HN 4.70
&rst
ixpk= 0, nxpk= 0, iat= 29, 40, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 3 GLU HB2 4 LYS HN 4.70
&rst
ixpk= 0, nxpk= 0, iat= 29, 40, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 3 GLU HB2 4 LYS HN 4.70
&rst
ixpk= 0, nxpk= 0, iat= 29, 40, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 3 GLU HB2 4 LYS HN 5.72
&rst
ixpk= 0, nxpk= 0, iat= 29, 40, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 3 GLU HB2 24 ILE QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 29, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 328, 329, 330,
&end
#
# 3 GLU HB2 24 ILE QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 29, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 328, 329, 330,
&end
#
# 3 GLU HB2 24 ILE QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 29, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 328, 329, 330,
&end
#
# 3 GLU HB2 117 LEU QD1 4.60
&rst
ixpk= 0, nxpk= 0, iat= 29, -1, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
igr2=1648,1649,1650,
&end
#
# 3 GLU HB2 117 LEU QD1 4.60
&rst
ixpk= 0, nxpk= 0, iat= 29, -1, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
igr2=1648,1649,1650,
&end
#
# 3 GLU HB2 117 LEU QD1 4.60
&rst
ixpk= 0, nxpk= 0, iat= 29, -1, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
igr2=1648,1649,1650,
&end
#
# 3 GLU HB2 154 LYS HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 29,2170, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 3 GLU HB2 154 LYS HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 29,2170, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 3 GLU HB2 154 LYS HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 29,2170, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 3 GLU HB3 4 LYS HN 5.08
&rst
ixpk= 0, nxpk= 0, iat= 30, 40, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58, &end
#
# 3 GLU HB3 4 LYS HN 5.08
&rst
ixpk= 0, nxpk= 0, iat= 30, 40, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58, &end
#
# 3 GLU HB3 4 LYS HN 5.08
&rst
ixpk= 0, nxpk= 0, iat= 30, 40, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58, &end
#
# 3 GLU HB3 24 ILE HB 5.52
&rst
ixpk= 0, nxpk= 0, iat= 30, 326, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02, &end
#
# 3 GLU HB3 24 ILE HB 5.52
&rst
ixpk= 0, nxpk= 0, iat= 30, 326, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02, &end
#
# 3 GLU HB3 24 ILE HB 5.52
&rst
ixpk= 0, nxpk= 0, iat= 30, 326, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02, &end
#
# 3 GLU HB3 24 ILE QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 30, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 328, 329, 330,
&end
#
# 3 GLU HB3 24 ILE QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 30, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 328, 329, 330,
&end
#
# 3 GLU HB3 24 ILE QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 30, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 328, 329, 330,
&end
#
# 3 GLU HB3 117 LEU QD1 4.72
&rst
ixpk= 0, nxpk= 0, iat= 30, -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
igr2=1648,1649,1650,
&end
#
# 3 GLU HB3 117 LEU QD1 4.72
&rst
ixpk= 0, nxpk= 0, iat= 30, -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
igr2=1648,1649,1650,
&end
#
# 3 GLU HB3 117 LEU QD1 4.72
&rst
ixpk= 0, nxpk= 0, iat= 30, -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
igr2=1648,1649,1650,
&end
#
# 3 GLU HG2 3 GLU HG3 3.07
&rst
ixpk= 0, nxpk= 0, iat= 32, 33, r1= 1.30, r2= 1.80, r3= 3.07, r4= 3.57, &end
#
# 3 GLU HG2 4 LYS HN 5.19
&rst
ixpk= 0, nxpk= 0, iat= 32, 40, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69, &end
#
# 3 GLU HG2 4 LYS HN 5.19
&rst
ixpk= 0, nxpk= 0, iat= 32, 40, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69, &end
#
# 3 GLU HG2 4 LYS HN 5.19
&rst
ixpk= 0, nxpk= 0, iat= 32, 40, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69, &end
#
# 3 GLU HG2 117 LEU QD1 5.29
&rst
ixpk= 0, nxpk= 0, iat= 32, -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
igr2=1648,1649,1650,
&end
#
# 3 GLU HG2 117 LEU QD1 5.29
&rst
ixpk= 0, nxpk= 0, iat= 32, -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
igr2=1648,1649,1650,
&end
#
# 3 GLU HG2 117 LEU QD1 5.29
&rst
ixpk= 0, nxpk= 0, iat= 32, -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
igr2=1648,1649,1650,
&end
#
# 3 GLU HG2 154 LYS HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 32,2170, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 3 GLU HG2 154 LYS HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 32,2170, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 3 GLU HG2 154 LYS HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 32,2170, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 3 GLU HG3 4 LYS HN 4.24
&rst
ixpk= 0, nxpk= 0, iat= 33, 40, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74, &end
#
# 3 GLU HG3 4 LYS HN 4.24
&rst
ixpk= 0, nxpk= 0, iat= 33, 40, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74, &end
#
# 3 GLU HG3 4 LYS HN 4.24
&rst
ixpk= 0, nxpk= 0, iat= 33, 40, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74, &end
#
# 3 GLU HG3 5 VAL HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 33, 62, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 3 GLU HG3 5 VAL HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 33, 62, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 3 GLU HG3 5 VAL HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 33, 62, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 3 GLU HG3 117 LEU QD2 5.28
&rst
ixpk= 0, nxpk= 0, iat= 33, -1, r1= 1.30, r2= 1.80, r3= 6.34, r4= 6.84,
igr2=1652,1653,1654,
&end
#
# 3 GLU HG3 117 LEU QD2 5.28
&rst
ixpk= 0, nxpk= 0, iat= 33, -1, r1= 1.30, r2= 1.80, r3= 6.34, r4= 6.84,
igr2=1652,1653,1654,
&end
#
# 3 GLU HG3 117 LEU QD2 5.28
&rst
ixpk= 0, nxpk= 0, iat= 33, -1, r1= 1.30, r2= 1.80, r3= 6.34, r4= 6.84,
igr2=1652,1653,1654,
&end
#
# 4 LYS HN 4 LYS HA 4.16
&rst
ixpk= 0, nxpk= 0, iat= 40, 42, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66, &end
#
# 4 LYS HN 4 LYS QB 3.48
&rst
ixpk= 0, nxpk= 0, iat= 40, -1, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41,
igr2= 44, 45,
&end
#
# 4 LYS HN 4 LYS QB 3.48
&rst
ixpk= 0, nxpk= 0, iat= 40, -1, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41,
igr2= 44, 45,
&end
#
# 4 LYS HN 4 LYS QB 3.48
&rst
ixpk= 0, nxpk= 0, iat= 40, -1, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41,
igr2= 44, 45,
&end
#
# 4 LYS HN 4 LYS QD 5.93
&rst
ixpk= 0, nxpk= 0, iat= 40, -1, r1= 1.30, r2= 1.80, r3= 6.66, r4= 7.16,
igr2= 50, 51,
&end
#
# 4 LYS HN 4 LYS QD 5.93
&rst
ixpk= 0, nxpk= 0, iat= 40, -1, r1= 1.30, r2= 1.80, r3= 6.66, r4= 7.16,
igr2= 50, 51,
&end
#
# 4 LYS HN 4 LYS QD 5.93
&rst
ixpk= 0, nxpk= 0, iat= 40, -1, r1= 1.30, r2= 1.80, r3= 6.66, r4= 7.16,
igr2= 50, 51,
&end
#
# 4 LYS HN 4 LYS QG 3.81
&rst
ixpk= 0, nxpk= 0, iat= 40, -1, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,
igr2= 47, 48,
&end
#
# 4 LYS HN 4 LYS QG 3.81
&rst
ixpk= 0, nxpk= 0, iat= 40, -1, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,
igr2= 47, 48,
&end
#
# 4 LYS HN 4 LYS QG 3.81
&rst
ixpk= 0, nxpk= 0, iat= 40, -1, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,
igr2= 47, 48,
&end
#
# 4 LYS HN 5 VAL HN 5.12
&rst
ixpk= 0, nxpk= 0, iat= 40, 62, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, &end
#
# 4 LYS HN 5 VAL HN 5.12
&rst
ixpk= 0, nxpk= 0, iat= 40, 62, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, &end
#
# 4 LYS HN 5 VAL HN 5.12
&rst
ixpk= 0, nxpk= 0, iat= 40, 62, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, &end
#
# 4 LYS HN 5 VAL HN 5.28
&rst
ixpk= 0, nxpk= 0, iat= 40, 62, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 4 LYS HN 5 VAL QG2 5.83
&rst
ixpk= 0, nxpk= 0, iat= 40, -1, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,
igr2= 72, 73, 74,
&end
#
# 4 LYS HN 5 VAL QG2 5.83
&rst
ixpk= 0, nxpk= 0, iat= 40, -1, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,
igr2= 72, 73, 74,
&end
#
# 4 LYS HN 5 VAL QG2 5.83
&rst
ixpk= 0, nxpk= 0, iat= 40, -1, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,
igr2= 72, 73, 74,
&end
#
# 4 LYS HN 23 VAL QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 40, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 316, 317, 318,
&end
#
# 4 LYS HN 23 VAL QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 40, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 316, 317, 318,
&end
#
# 4 LYS HN 23 VAL QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 40, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 316, 317, 318,
&end
#
# 4 LYS HN 24 ILE HB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 40, 326, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 4 LYS HN 24 ILE HB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 40, 326, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 4 LYS HN 24 ILE HB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 40, 326, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 4 LYS HA 4 LYS QB 3.72
&rst
ixpk= 0, nxpk= 0, iat= 42, -1, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
igr2= 44, 45,
&end
#
# 4 LYS HA 4 LYS QD 5.95
&rst
ixpk= 0, nxpk= 0, iat= 42, -1, r1= 1.30, r2= 1.80, r3= 6.68, r4= 7.18,
igr2= 50, 51,
&end
#
# 4 LYS HA 4 LYS QD 5.95
&rst
ixpk= 0, nxpk= 0, iat= 42, -1, r1= 1.30, r2= 1.80, r3= 6.68, r4= 7.18,
igr2= 50, 51,
&end
#
# 4 LYS HA 4 LYS QD 5.95
&rst
ixpk= 0, nxpk= 0, iat= 42, -1, r1= 1.30, r2= 1.80, r3= 6.68, r4= 7.18,
igr2= 50, 51,
&end
#
# 4 LYS HA 4 LYS QE 5.35
&rst
ixpk= 0, nxpk= 0, iat= 42, -1, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51,
igr2= 53, 54,
&end
#
# 4 LYS HA 4 LYS QE 5.35
&rst
ixpk= 0, nxpk= 0, iat= 42, -1, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51,
igr2= 53, 54,
&end
#
# 4 LYS HA 4 LYS QE 5.35
&rst
ixpk= 0, nxpk= 0, iat= 42, -1, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51,
igr2= 53, 54,
&end
#
# 4 LYS HA 5 VAL HN 2.97
&rst
ixpk= 0, nxpk= 0, iat= 42, 62, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 4 LYS HA 5 VAL HN 3.34
&rst
ixpk= 0, nxpk= 0, iat= 42, 62, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84, &end
#
# 4 LYS HA 5 VAL HN 3.34
&rst
ixpk= 0, nxpk= 0, iat= 42, 62, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84, &end
#
# 4 LYS HA 5 VAL HN 3.34
&rst
ixpk= 0, nxpk= 0, iat= 42, 62, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84, &end
#
# 4 LYS HA 5 VAL HA 4.86
&rst
ixpk= 0, nxpk= 0, iat= 42, 64, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36, &end
#
# 4 LYS HA 5 VAL HA 4.86
&rst
ixpk= 0, nxpk= 0, iat= 42, 64, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36, &end
#
# 4 LYS HA 5 VAL HA 4.86
&rst
ixpk= 0, nxpk= 0, iat= 42, 64, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36, &end
#
# 4 LYS HA 5 VAL QG2 3.89
&rst
ixpk= 0, nxpk= 0, iat= 42, -1, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
igr2= 72, 73, 74,
&end
#
# 4 LYS HA 5 VAL QG2 3.89
&rst
ixpk= 0, nxpk= 0, iat= 42, -1, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
igr2= 72, 73, 74,
&end
#
# 4 LYS HA 5 VAL QG2 3.89
&rst
ixpk= 0, nxpk= 0, iat= 42, -1, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
igr2= 72, 73, 74,
&end
#
# 4 LYS HA 6 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 42, 78, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 4 LYS HA 6 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 42, 78, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 4 LYS HA 6 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 42, 78, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 4 LYS HA 21 THR HB 5.95
&rst
ixpk= 0, nxpk= 0, iat= 42, 280, r1= 1.30, r2= 1.80, r3= 5.95, r4= 6.45, &end
#
# 4 LYS HA 21 THR HB 5.95
&rst
ixpk= 0, nxpk= 0, iat= 42, 280, r1= 1.30, r2= 1.80, r3= 5.95, r4= 6.45, &end
#
# 4 LYS HA 21 THR HB 5.95
&rst
ixpk= 0, nxpk= 0, iat= 42, 280, r1= 1.30, r2= 1.80, r3= 5.95, r4= 6.45, &end
#
# 4 LYS HA 23 VAL QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 42, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 316, 317, 318,
&end
#
# 4 LYS HA 23 VAL QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 42, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 316, 317, 318,
&end
#
# 4 LYS HA 23 VAL QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 42, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 316, 317, 318,
&end
#
# 4 LYS HA 24 ILE HN 3.16
&rst
ixpk= 0, nxpk= 0, iat= 42, 322, r1= 1.30, r2= 1.80, r3= 3.16, r4= 3.66, &end
#
# 4 LYS HA 24 ILE HN 3.16
&rst
ixpk= 0, nxpk= 0, iat= 42, 322, r1= 1.30, r2= 1.80, r3= 3.16, r4= 3.66, &end
#
# 4 LYS HA 24 ILE HN 3.16
&rst
ixpk= 0, nxpk= 0, iat= 42, 322, r1= 1.30, r2= 1.80, r3= 3.16, r4= 3.66, &end
#
# 4 LYS HA 24 ILE QD1 5.78
&rst
ixpk= 0, nxpk= 0, iat= 42, -1, r1= 1.30, r2= 1.80, r3= 6.94, r4= 7.44,
igr2= 335, 336, 337,
&end
#
# 4 LYS HA 24 ILE QD1 5.78
&rst
ixpk= 0, nxpk= 0, iat= 42, -1, r1= 1.30, r2= 1.80, r3= 6.94, r4= 7.44,
igr2= 335, 336, 337,
&end
#
# 4 LYS HA 24 ILE QD1 5.78
&rst
ixpk= 0, nxpk= 0, iat= 42, -1, r1= 1.30, r2= 1.80, r3= 6.94, r4= 7.44,
igr2= 335, 336, 337,
&end
#
# 4 LYS HB2 5 VAL HN 5.72
&rst
ixpk= 0, nxpk= 0, iat= 44, 62, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 4 LYS QB 5 VAL HN 4.53
&rst
ixpk= 0, nxpk= 0, iat= -1, 62, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
igr1= 44, 45,
&end
#
# 4 LYS QB 5 VAL HN 4.53
&rst
ixpk= 0, nxpk= 0, iat= -1, 62, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
igr1= 44, 45,
&end
#
# 4 LYS QB 5 VAL HN 4.53
&rst
ixpk= 0, nxpk= 0, iat= -1, 62, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
igr1= 44, 45,
&end
#
# 4 LYS QB 6 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 78, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 44, 45,
&end
#
# 4 LYS QB 6 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 78, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 44, 45,
&end
#
# 4 LYS QB 6 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 78, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 44, 45,
&end
#
# 4 LYS QD 21 THR HB 5.42
&rst
ixpk= 0, nxpk= 0, iat= -1, 280, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
igr1= 50, 51,
&end
#
# 4 LYS QD 21 THR HB 5.42
&rst
ixpk= 0, nxpk= 0, iat= -1, 280, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
igr1= 50, 51,
&end
#
# 4 LYS QD 21 THR HB 5.42
&rst
ixpk= 0, nxpk= 0, iat= -1, 280, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
igr1= 50, 51,
&end
#
# 4 LYS QG 5 VAL HN 5.87
&rst
ixpk= 0, nxpk= 0, iat= -1, 62, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
igr1= 47, 48,
&end
#
# 4 LYS QG 5 VAL HN 5.87
&rst
ixpk= 0, nxpk= 0, iat= -1, 62, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
igr1= 47, 48,
&end
#
# 4 LYS QG 5 VAL HN 5.87
&rst
ixpk= 0, nxpk= 0, iat= -1, 62, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
igr1= 47, 48,
&end
#
# 4 LYS QG 24 ILE HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 322, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 47, 48,
&end
#
# 4 LYS QG 24 ILE HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 322, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 47, 48,
&end
#
# 4 LYS QG 24 ILE HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 322, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 47, 48,
&end
#
# 5 VAL HN 5 VAL HA 4.17
&rst
ixpk= 0, nxpk= 0, iat= 62, 64, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67, &end
#
# 5 VAL HN 5 VAL HB 3.81
&rst
ixpk= 0, nxpk= 0, iat= 62, 66, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31, &end
#
# 5 VAL HN 5 VAL HB 3.81
&rst
ixpk= 0, nxpk= 0, iat= 62, 66, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31, &end
#
# 5 VAL HN 5 VAL HB 3.81
&rst
ixpk= 0, nxpk= 0, iat= 62, 66, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31, &end
#
# 5 VAL HN 5 VAL QG1 4.92
&rst
ixpk= 0, nxpk= 0, iat= 62, -1, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41,
igr2= 68, 69, 70,
&end
#
# 5 VAL HN 5 VAL QG1 4.92
&rst
ixpk= 0, nxpk= 0, iat= 62, -1, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41,
igr2= 68, 69, 70,
&end
#
# 5 VAL HN 5 VAL QG1 4.92
&rst
ixpk= 0, nxpk= 0, iat= 62, -1, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41,
igr2= 68, 69, 70,
&end
#
# 5 VAL HN 5 VAL QG2 3.73
&rst
ixpk= 0, nxpk= 0, iat= 62, -1, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
igr2= 72, 73, 74,
&end
#
# 5 VAL HN 5 VAL QG2 3.73
&rst
ixpk= 0, nxpk= 0, iat= 62, -1, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
igr2= 72, 73, 74,
&end
#
# 5 VAL HN 5 VAL QG2 3.73
&rst
ixpk= 0, nxpk= 0, iat= 62, -1, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
igr2= 72, 73, 74,
&end
#
# 5 VAL HN 6 GLY HN 5.24
&rst
ixpk= 0, nxpk= 0, iat= 62, 78, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74, &end
#
# 5 VAL HN 6 GLY HN 5.24
&rst
ixpk= 0, nxpk= 0, iat= 62, 78, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74, &end
#
# 5 VAL HN 6 GLY HN 5.24
&rst
ixpk= 0, nxpk= 0, iat= 62, 78, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74, &end
#
# 5 VAL HN 6 GLY HN 5.28
&rst
ixpk= 0, nxpk= 0, iat= 62, 78, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 5 VAL HN 7 MET HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 62, 85, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 5 VAL HN 7 MET HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 62, 85, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 5 VAL HN 7 MET HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 62, 85, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 5 VAL HN 21 THR HA 5.24
&rst
ixpk= 0, nxpk= 0, iat= 62, 278, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74, &end
#
# 5 VAL HN 21 THR HA 5.24
&rst
ixpk= 0, nxpk= 0, iat= 62, 278, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74, &end
#
# 5 VAL HN 21 THR HA 5.24
&rst
ixpk= 0, nxpk= 0, iat= 62, 278, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74, &end
#
# 5 VAL HN 21 THR HB 4.73
&rst
ixpk= 0, nxpk= 0, iat= 62, 280, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, &end
#
# 5 VAL HN 21 THR HB 4.73
&rst
ixpk= 0, nxpk= 0, iat= 62, 280, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, &end
#
# 5 VAL HN 21 THR HB 4.73
&rst
ixpk= 0, nxpk= 0, iat= 62, 280, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, &end
#
# 5 VAL HN 21 THR QG2 5.71
&rst
ixpk= 0, nxpk= 0, iat= 62, -1, r1= 1.30, r2= 1.80, r3= 6.86, r4= 7.36,
igr2= 282, 283, 284,
&end
#
# 5 VAL HN 21 THR QG2 5.71
&rst
ixpk= 0, nxpk= 0, iat= 62, -1, r1= 1.30, r2= 1.80, r3= 6.86, r4= 7.36,
igr2= 282, 283, 284,
&end
#
# 5 VAL HN 21 THR QG2 5.71
&rst
ixpk= 0, nxpk= 0, iat= 62, -1, r1= 1.30, r2= 1.80, r3= 6.86, r4= 7.36,
igr2= 282, 283, 284,
&end
#
# 5 VAL HN 22 VAL HN 4.03
&rst
ixpk= 0, nxpk= 0, iat= 62, 290, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53, &end
#
# 5 VAL HN 22 VAL HN 4.03
&rst
ixpk= 0, nxpk= 0, iat= 62, 290, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53, &end
#
# 5 VAL HN 22 VAL HN 4.03
&rst
ixpk= 0, nxpk= 0, iat= 62, 290, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53, &end
#
# 5 VAL HN 22 VAL HB 5.29
&rst
ixpk= 0, nxpk= 0, iat= 62, 294, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79, &end
#
# 5 VAL HN 22 VAL HB 5.29
&rst
ixpk= 0, nxpk= 0, iat= 62, 294, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79, &end
#
# 5 VAL HN 22 VAL HB 5.29
&rst
ixpk= 0, nxpk= 0, iat= 62, 294, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79, &end
#
# 5 VAL HN 23 VAL HA 4.54
&rst
ixpk= 0, nxpk= 0, iat= 62, 308, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 5 VAL HN 23 VAL HA 4.54
&rst
ixpk= 0, nxpk= 0, iat= 62, 308, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 5 VAL HN 23 VAL HA 4.54
&rst
ixpk= 0, nxpk= 0, iat= 62, 308, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 5 VAL HN 24 ILE HB 5.76
&rst
ixpk= 0, nxpk= 0, iat= 62, 326, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26, &end
#
# 5 VAL HN 24 ILE HB 5.76
&rst
ixpk= 0, nxpk= 0, iat= 62, 326, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26, &end
#
# 5 VAL HN 24 ILE HB 5.76
&rst
ixpk= 0, nxpk= 0, iat= 62, 326, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26, &end
#
# 5 VAL HN 24 ILE HG12 5.12
&rst
ixpk= 0, nxpk= 0, iat= 62, 332, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, &end
#
# 5 VAL HN 24 ILE HG12 5.12
&rst
ixpk= 0, nxpk= 0, iat= 62, 332, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, &end
#
# 5 VAL HN 24 ILE HG12 5.12
&rst
ixpk= 0, nxpk= 0, iat= 62, 332, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, &end
#
# 5 VAL HN 24 ILE HG13 5.76
&rst
ixpk= 0, nxpk= 0, iat= 62, 333, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26, &end
#
# 5 VAL HN 24 ILE HG13 5.76
&rst
ixpk= 0, nxpk= 0, iat= 62, 333, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26, &end
#
# 5 VAL HN 24 ILE HG13 5.76
&rst
ixpk= 0, nxpk= 0, iat= 62, 333, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26, &end
#
# 5 VAL HN 24 ILE QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 62, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 335, 336, 337,
&end
#
# 5 VAL HN 24 ILE QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 62, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 335, 336, 337,
&end
#
# 5 VAL HN 24 ILE QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 62, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 335, 336, 337,
&end
#
# 5 VAL HA 5 VAL HB 4.53
&rst
ixpk= 0, nxpk= 0, iat= 64, 66, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03, &end
#
# 5 VAL HA 5 VAL QG1 3.95
&rst
ixpk= 0, nxpk= 0, iat= 64, -1, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr2= 68, 69, 70,
&end
#
# 5 VAL HA 5 VAL QG1 3.95
&rst
ixpk= 0, nxpk= 0, iat= 64, -1, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr2= 68, 69, 70,
&end
#
# 5 VAL HA 5 VAL QG1 3.95
&rst
ixpk= 0, nxpk= 0, iat= 64, -1, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr2= 68, 69, 70,
&end
#
# 5 VAL HA 5 VAL QG2 4.12
&rst
ixpk= 0, nxpk= 0, iat= 64, -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr2= 72, 73, 74,
&end
#
# 5 VAL HA 5 VAL QG2 4.12
&rst
ixpk= 0, nxpk= 0, iat= 64, -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr2= 72, 73, 74,
&end
#
# 5 VAL HA 5 VAL QG2 4.12
&rst
ixpk= 0, nxpk= 0, iat= 64, -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr2= 72, 73, 74,
&end
#
# 5 VAL HA 6 GLY HN 2.97
&rst
ixpk= 0, nxpk= 0, iat= 64, 78, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 5 VAL HA 6 GLY HN 3.34
&rst
ixpk= 0, nxpk= 0, iat= 64, 78, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84, &end
#
# 5 VAL HA 6 GLY HN 3.34
&rst
ixpk= 0, nxpk= 0, iat= 64, 78, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84, &end
#
# 5 VAL HA 6 GLY HN 3.34
&rst
ixpk= 0, nxpk= 0, iat= 64, 78, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84, &end
#
# 5 VAL HA 6 GLY HA3 5.10
&rst
ixpk= 0, nxpk= 0, iat= 64, 81, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, &end
#
# 5 VAL HA 6 GLY HA3 5.10
&rst
ixpk= 0, nxpk= 0, iat= 64, 81, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, &end
#
# 5 VAL HA 6 GLY HA3 5.10
&rst
ixpk= 0, nxpk= 0, iat= 64, 81, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, &end
#
# 5 VAL HA 21 THR HB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 64, 280, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 5 VAL HA 21 THR HB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 64, 280, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 5 VAL HA 21 THR HB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 64, 280, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 5 VAL HB 5 VAL QG2 3.92
&rst
ixpk= 0, nxpk= 0, iat= 66, -1, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
igr2= 72, 73, 74,
&end
#
# 5 VAL HB 6 GLY HN 4.80
&rst
ixpk= 0, nxpk= 0, iat= 66, 78, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30, &end
#
# 5 VAL HB 6 GLY HN 4.80
&rst
ixpk= 0, nxpk= 0, iat= 66, 78, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30, &end
#
# 5 VAL HB 6 GLY HN 4.80
&rst
ixpk= 0, nxpk= 0, iat= 66, 78, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30, &end
#
# 5 VAL HB 6 GLY HN 5.72
&rst
ixpk= 0, nxpk= 0, iat= 66, 78, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 5 VAL HB 22 VAL HN 4.48
&rst
ixpk= 0, nxpk= 0, iat= 66, 290, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98, &end
#
# 5 VAL HB 22 VAL HN 4.48
&rst
ixpk= 0, nxpk= 0, iat= 66, 290, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98, &end
#
# 5 VAL HB 22 VAL HN 4.48
&rst
ixpk= 0, nxpk= 0, iat= 66, 290, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98, &end
#
# 5 VAL QG1 5 VAL HB 3.83
&rst
ixpk= 0, nxpk= 0, iat= -1, 66, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
igr1= 68, 69, 70,
&end
#
# 5 VAL QG1 5 VAL QG2 3.43
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr1= 68, 69, 70,
igr2= 72, 73, 74,
&end
#
# 5 VAL QG1 6 GLY HN 4.03
&rst
ixpk= 0, nxpk= 0, iat= -1, 78, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
igr1= 68, 69, 70,
&end
#
# 5 VAL QG1 6 GLY HN 4.03
&rst
ixpk= 0, nxpk= 0, iat= -1, 78, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
igr1= 68, 69, 70,
&end
#
# 5 VAL QG1 6 GLY HN 4.03
&rst
ixpk= 0, nxpk= 0, iat= -1, 78, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
igr1= 68, 69, 70,
&end
#
# 5 VAL QG1 6 GLY HA2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 80, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 68, 69, 70,
&end
#
# 5 VAL QG1 6 GLY HA2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 80, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 68, 69, 70,
&end
#
# 5 VAL QG1 6 GLY HA2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 80, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 68, 69, 70,
&end
#
# 5 VAL QG1 7 MET HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 85, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 68, 69, 70,
&end
#
# 5 VAL QG1 7 MET HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 85, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 68, 69, 70,
&end
#
# 5 VAL QG1 7 MET HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 85, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 68, 69, 70,
&end
#
# 5 VAL QG1 22 VAL HN 4.87
&rst
ixpk= 0, nxpk= 0, iat= -1, 290, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
igr1= 68, 69, 70,
&end
#
# 5 VAL QG1 22 VAL HN 4.87
&rst
ixpk= 0, nxpk= 0, iat= -1, 290, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
igr1= 68, 69, 70,
&end
#
# 5 VAL QG1 22 VAL HN 4.87
&rst
ixpk= 0, nxpk= 0, iat= -1, 290, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
igr1= 68, 69, 70,
&end
#
# 5 VAL QG1 151 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,2128, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 68, 69, 70,
&end
#
# 5 VAL QG1 151 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,2128, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 68, 69, 70,
&end
#
# 5 VAL QG1 151 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,2128, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 68, 69, 70,
&end
#
# 5 VAL QG1 151 GLY HA3 4.10
&rst
ixpk= 0, nxpk= 0, iat= -1,2131, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
igr1= 68, 69, 70,
&end
#
# 5 VAL QG1 151 GLY HA3 4.10
&rst
ixpk= 0, nxpk= 0, iat= -1,2131, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
igr1= 68, 69, 70,
&end
#
# 5 VAL QG1 151 GLY HA3 4.10
&rst
ixpk= 0, nxpk= 0, iat= -1,2131, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
igr1= 68, 69, 70,
&end
#
# 5 VAL QG1 152 VAL HN 4.10
&rst
ixpk= 0, nxpk= 0, iat= -1,2135, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
igr1= 68, 69, 70,
&end
#
# 5 VAL QG1 152 VAL HN 4.10
&rst
ixpk= 0, nxpk= 0, iat= -1,2135, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
igr1= 68, 69, 70,
&end
#
# 5 VAL QG1 152 VAL HN 4.10
&rst
ixpk= 0, nxpk= 0, iat= -1,2135, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
igr1= 68, 69, 70,
&end
#
# 5 VAL QG2 6 GLY HN 4.42
&rst
ixpk= 0, nxpk= 0, iat= -1, 78, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
igr1= 72, 73, 74,
&end
#
# 5 VAL QG2 6 GLY HN 4.42
&rst
ixpk= 0, nxpk= 0, iat= -1, 78, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
igr1= 72, 73, 74,
&end
#
# 5 VAL QG2 6 GLY HN 4.42
&rst
ixpk= 0, nxpk= 0, iat= -1, 78, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
igr1= 72, 73, 74,
&end
#
# 5 VAL QG2 24 ILE QD1 3.64
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
igr1= 72, 73, 74,
igr2= 335, 336, 337,
&end
#
# 5 VAL QG2 24 ILE QD1 3.64
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
igr1= 72, 73, 74,
igr2= 335, 336, 337,
&end
#
# 5 VAL QG2 24 ILE QD1 3.64
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
igr1= 72, 73, 74,
igr2= 335, 336, 337,
&end
#
# 5 VAL QG2 24 ILE QG2 5.98
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.62, r4= 9.12,
igr1= 72, 73, 74,
igr2= 328, 329, 330,
&end
#
# 5 VAL QG2 24 ILE QG2 5.98
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.62, r4= 9.12,
igr1= 72, 73, 74,
igr2= 328, 329, 330,
&end
#
# 5 VAL QG2 24 ILE QG2 5.98
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.62, r4= 9.12,
igr1= 72, 73, 74,
igr2= 328, 329, 330,
&end
#
# 5 VAL QG2 153 ILE HA 3.70
&rst
ixpk= 0, nxpk= 0, iat= -1,2153, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
igr1= 72, 73, 74,
&end
#
# 5 VAL QG2 153 ILE HA 3.70
&rst
ixpk= 0, nxpk= 0, iat= -1,2153, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
igr1= 72, 73, 74,
&end
#
# 5 VAL QG2 153 ILE HA 3.70
&rst
ixpk= 0, nxpk= 0, iat= -1,2153, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
igr1= 72, 73, 74,
&end
#
# 5 VAL QG2 153 ILE HG13 3.32
&rst
ixpk= 0, nxpk= 0, iat= -1,2162, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,
igr1= 72, 73, 74,
&end
#
# 5 VAL QG2 153 ILE HG13 3.32
&rst
ixpk= 0, nxpk= 0, iat= -1,2162, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,
igr1= 72, 73, 74,
&end
#
# 5 VAL QG2 153 ILE HG13 3.32
&rst
ixpk= 0, nxpk= 0, iat= -1,2162, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49,
igr1= 72, 73, 74,
&end
#
# 5 VAL QG2 154 LYS HN 4.66
&rst
ixpk= 0, nxpk= 0, iat= -1,2170, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
igr1= 72, 73, 74,
&end
#
# 5 VAL QG2 154 LYS HN 4.66
&rst
ixpk= 0, nxpk= 0, iat= -1,2170, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
igr1= 72, 73, 74,
&end
#
# 5 VAL QG2 154 LYS HN 4.66
&rst
ixpk= 0, nxpk= 0, iat= -1,2170, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
igr1= 72, 73, 74,
&end
#
# 6 GLY HN 6 GLY HA3 3.73
&rst
ixpk= 0, nxpk= 0, iat= 78, 81, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23, &end
#
# 6 GLY HN 7 MET HN 4.67
&rst
ixpk= 0, nxpk= 0, iat= 78, 85, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, &end
#
# 6 GLY HN 7 MET HN 4.67
&rst
ixpk= 0, nxpk= 0, iat= 78, 85, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, &end
#
# 6 GLY HN 7 MET HN 4.67
&rst
ixpk= 0, nxpk= 0, iat= 78, 85, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, &end
#
# 6 GLY HN 7 MET HN 5.28
&rst
ixpk= 0, nxpk= 0, iat= 78, 85, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 6 GLY HN 7 MET HG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 78, 92, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 6 GLY HN 7 MET HG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 78, 92, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 6 GLY HN 7 MET HG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 78, 92, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 6 GLY HN 7 MET HG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 78, 92, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 6 GLY HN 7 MET HG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 78, 92, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 6 GLY HN 7 MET HG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 78, 92, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 6 GLY HN 21 THR HA 5.61
&rst
ixpk= 0, nxpk= 0, iat= 78, 278, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11, &end
#
# 6 GLY HN 21 THR HA 5.61
&rst
ixpk= 0, nxpk= 0, iat= 78, 278, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11, &end
#
# 6 GLY HN 21 THR HA 5.61
&rst
ixpk= 0, nxpk= 0, iat= 78, 278, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11, &end
#
# 6 GLY HN 21 THR HB 4.05
&rst
ixpk= 0, nxpk= 0, iat= 78, 280, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55, &end
#
# 6 GLY HN 21 THR HB 4.05
&rst
ixpk= 0, nxpk= 0, iat= 78, 280, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55, &end
#
# 6 GLY HN 21 THR HB 4.05
&rst
ixpk= 0, nxpk= 0, iat= 78, 280, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55, &end
#
# 6 GLY HN 21 THR QG2 4.65
&rst
ixpk= 0, nxpk= 0, iat= 78, -1, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr2= 282, 283, 284,
&end
#
# 6 GLY HN 21 THR QG2 4.65
&rst
ixpk= 0, nxpk= 0, iat= 78, -1, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr2= 282, 283, 284,
&end
#
# 6 GLY HN 21 THR QG2 4.65
&rst
ixpk= 0, nxpk= 0, iat= 78, -1, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr2= 282, 283, 284,
&end
#
# 6 GLY HN 152 VAL HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 78,2135, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 6 GLY HN 152 VAL HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 78,2135, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 6 GLY HN 152 VAL HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 78,2135, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 6 GLY HA2 6 GLY HA3 3.59
&rst
ixpk= 0, nxpk= 0, iat= 80, 81, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09, &end
#
# 6 GLY HA2 7 MET HN 2.97
&rst
ixpk= 0, nxpk= 0, iat= 80, 85, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 6 GLY HA2 7 MET HN 3.22
&rst
ixpk= 0, nxpk= 0, iat= 80, 85, r1= 1.30, r2= 1.80, r3= 3.22, r4= 3.72, &end
#
# 6 GLY HA2 7 MET HN 3.22
&rst
ixpk= 0, nxpk= 0, iat= 80, 85, r1= 1.30, r2= 1.80, r3= 3.22, r4= 3.72, &end
#
# 6 GLY HA2 7 MET HN 3.22
&rst
ixpk= 0, nxpk= 0, iat= 80, 85, r1= 1.30, r2= 1.80, r3= 3.22, r4= 3.72, &end
#
# 6 GLY HA2 7 MET HG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 80, 92, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 6 GLY HA2 7 MET HG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 80, 92, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 6 GLY HA2 7 MET HG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 80, 92, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 6 GLY HA2 7 MET HG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 80, 92, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 6 GLY HA2 7 MET HG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 80, 92, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 6 GLY HA2 7 MET HG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 80, 92, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 6 GLY HA2 21 THR HA 4.62
&rst
ixpk= 0, nxpk= 0, iat= 80, 278, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12, &end
#
# 6 GLY HA2 21 THR HA 4.62
&rst
ixpk= 0, nxpk= 0, iat= 80, 278, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12, &end
#
# 6 GLY HA2 21 THR HA 4.62
&rst
ixpk= 0, nxpk= 0, iat= 80, 278, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12, &end
#
# 6 GLY HA2 21 THR HB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 80, 280, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 6 GLY HA2 21 THR HB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 80, 280, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 6 GLY HA2 21 THR HB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 80, 280, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 6 GLY HA2 21 THR QG2 4.32
&rst
ixpk= 0, nxpk= 0, iat= 80, -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
igr2= 282, 283, 284,
&end
#
# 6 GLY HA2 21 THR QG2 4.32
&rst
ixpk= 0, nxpk= 0, iat= 80, -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
igr2= 282, 283, 284,
&end
#
# 6 GLY HA2 21 THR QG2 4.32
&rst
ixpk= 0, nxpk= 0, iat= 80, -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
igr2= 282, 283, 284,
&end
#
# 6 GLY HA2 22 VAL HN 5.79
&rst
ixpk= 0, nxpk= 0, iat= 80, 290, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29, &end
#
# 6 GLY HA2 22 VAL HN 5.79
&rst
ixpk= 0, nxpk= 0, iat= 80, 290, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29, &end
#
# 6 GLY HA2 22 VAL HN 5.79
&rst
ixpk= 0, nxpk= 0, iat= 80, 290, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29, &end
#
# 6 GLY HA3 7 MET HN 3.80
&rst
ixpk= 0, nxpk= 0, iat= 81, 85, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30, &end
#
# 6 GLY HA3 7 MET HN 3.80
&rst
ixpk= 0, nxpk= 0, iat= 81, 85, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30, &end
#
# 6 GLY HA3 7 MET HN 3.80
&rst
ixpk= 0, nxpk= 0, iat= 81, 85, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30, &end
#
# 6 GLY HA3 21 THR HA 5.12
&rst
ixpk= 0, nxpk= 0, iat= 81, 278, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, &end
#
# 6 GLY HA3 21 THR HA 5.12
&rst
ixpk= 0, nxpk= 0, iat= 81, 278, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, &end
#
# 6 GLY HA3 21 THR HA 5.12
&rst
ixpk= 0, nxpk= 0, iat= 81, 278, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, &end
#
# 6 GLY HA3 21 THR QG2 4.92
&rst
ixpk= 0, nxpk= 0, iat= 81, -1, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41,
igr2= 282, 283, 284,
&end
#
# 6 GLY HA3 21 THR QG2 4.92
&rst
ixpk= 0, nxpk= 0, iat= 81, -1, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41,
igr2= 282, 283, 284,
&end
#
# 6 GLY HA3 21 THR QG2 4.92
&rst
ixpk= 0, nxpk= 0, iat= 81, -1, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41,
igr2= 282, 283, 284,
&end
#
# 7 MET HN 7 MET HA 4.36
&rst
ixpk= 0, nxpk= 0, iat= 85, 87, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86, &end
#
# 7 MET HN 7 MET HB2 4.42
&rst
ixpk= 0, nxpk= 0, iat= 85, 89, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92, &end
#
# 7 MET HN 7 MET HB2 4.42
&rst
ixpk= 0, nxpk= 0, iat= 85, 89, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92, &end
#
# 7 MET HN 7 MET HB2 4.42
&rst
ixpk= 0, nxpk= 0, iat= 85, 89, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92, &end
#
# 7 MET HN 7 MET HB3 4.67
&rst
ixpk= 0, nxpk= 0, iat= 85, 90, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, &end
#
# 7 MET HN 7 MET HG2 4.58
&rst
ixpk= 0, nxpk= 0, iat= 85, 92, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08, &end
#
# 7 MET HN 7 MET HG2 4.58
&rst
ixpk= 0, nxpk= 0, iat= 85, 92, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08, &end
#
# 7 MET HN 7 MET HG2 4.58
&rst
ixpk= 0, nxpk= 0, iat= 85, 92, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08, &end
#
# 7 MET HN 7 MET HG2 5.04
&rst
ixpk= 0, nxpk= 0, iat= 85, 92, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54, &end
#
# 7 MET HN 7 MET HG2 5.04
&rst
ixpk= 0, nxpk= 0, iat= 85, 92, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54, &end
#
# 7 MET HN 7 MET HG2 5.04
&rst
ixpk= 0, nxpk= 0, iat= 85, 92, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54, &end
#
# 7 MET HN 7 MET QE 5.79
&rst
ixpk= 0, nxpk= 0, iat= 85, -1, r1= 1.30, r2= 1.80, r3= 6.95, r4= 7.45,
igr2= 96, 97, 98,
&end
#
# 7 MET HN 7 MET QE 5.79
&rst
ixpk= 0, nxpk= 0, iat= 85, -1, r1= 1.30, r2= 1.80, r3= 6.95, r4= 7.45,
igr2= 96, 97, 98,
&end
#
# 7 MET HN 7 MET QE 5.79
&rst
ixpk= 0, nxpk= 0, iat= 85, -1, r1= 1.30, r2= 1.80, r3= 6.95, r4= 7.45,
igr2= 96, 97, 98,
&end
#
# 7 MET HN 8 ASN HN 5.12
&rst
ixpk= 0, nxpk= 0, iat= 85, 102, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, &end
#
# 7 MET HN 8 ASN HN 5.12
&rst
ixpk= 0, nxpk= 0, iat= 85, 102, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, &end
#
# 7 MET HN 8 ASN HN 5.12
&rst
ixpk= 0, nxpk= 0, iat= 85, 102, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, &end
#
# 7 MET HN 8 ASN HN 5.28
&rst
ixpk= 0, nxpk= 0, iat= 85, 102, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 7 MET HN 8 ASN HA 5.94
&rst
ixpk= 0, nxpk= 0, iat= 85, 104, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44, &end
#
# 7 MET HN 8 ASN HA 5.94
&rst
ixpk= 0, nxpk= 0, iat= 85, 104, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44, &end
#
# 7 MET HN 8 ASN HA 5.94
&rst
ixpk= 0, nxpk= 0, iat= 85, 104, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44, &end
#
# 7 MET HN 21 THR HA 4.15
&rst
ixpk= 0, nxpk= 0, iat= 85, 278, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65, &end
#
# 7 MET HN 21 THR HA 4.15
&rst
ixpk= 0, nxpk= 0, iat= 85, 278, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65, &end
#
# 7 MET HN 21 THR HA 4.15
&rst
ixpk= 0, nxpk= 0, iat= 85, 278, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65, &end
#
# 7 MET HN 21 THR HB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 85, 280, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 7 MET HN 21 THR HB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 85, 280, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 7 MET HN 21 THR HB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 85, 280, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 7 MET HN 21 THR QG2 4.69
&rst
ixpk= 0, nxpk= 0, iat= 85, -1, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr2= 282, 283, 284,
&end
#
# 7 MET HN 21 THR QG2 4.69
&rst
ixpk= 0, nxpk= 0, iat= 85, -1, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr2= 282, 283, 284,
&end
#
# 7 MET HN 21 THR QG2 4.69
&rst
ixpk= 0, nxpk= 0, iat= 85, -1, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr2= 282, 283, 284,
&end
#
# 7 MET HN 22 VAL HN 4.85
&rst
ixpk= 0, nxpk= 0, iat= 85, 290, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35, &end
#
# 7 MET HN 22 VAL HN 4.85
&rst
ixpk= 0, nxpk= 0, iat= 85, 290, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35, &end
#
# 7 MET HN 22 VAL HN 4.85
&rst
ixpk= 0, nxpk= 0, iat= 85, 290, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35, &end
#
# 7 MET HN 37 LEU QD2 4.72
&rst
ixpk= 0, nxpk= 0, iat= 85, -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
igr2= 530, 531, 532,
&end
#
# 7 MET HN 37 LEU QD2 4.72
&rst
ixpk= 0, nxpk= 0, iat= 85, -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
igr2= 530, 531, 532,
&end
#
# 7 MET HN 37 LEU QD2 4.72
&rst
ixpk= 0, nxpk= 0, iat= 85, -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
igr2= 530, 531, 532,
&end
#
# 7 MET HN 151 GLY HA2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 85,2130, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 7 MET HN 151 GLY HA2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 85,2130, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 7 MET HN 151 GLY HA2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 85,2130, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 7 MET HA 7 MET HB2 4.40
&rst
ixpk= 0, nxpk= 0, iat= 87, 89, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 7 MET HA 7 MET HB3 3.94
&rst
ixpk= 0, nxpk= 0, iat= 87, 90, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44, &end
#
# 7 MET HA 7 MET HG2 5.37
&rst
ixpk= 0, nxpk= 0, iat= 87, 92, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87, &end
#
# 7 MET HA 7 MET HG2 5.42
&rst
ixpk= 0, nxpk= 0, iat= 87, 92, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92, &end
#
# 7 MET HA 7 MET QE 4.28
&rst
ixpk= 0, nxpk= 0, iat= 87, -1, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
igr2= 96, 97, 98,
&end
#
# 7 MET HA 7 MET QE 4.28
&rst
ixpk= 0, nxpk= 0, iat= 87, -1, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
igr2= 96, 97, 98,
&end
#
# 7 MET HA 7 MET QE 4.28
&rst
ixpk= 0, nxpk= 0, iat= 87, -1, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
igr2= 96, 97, 98,
&end
#
# 7 MET HA 8 ASN HN 2.97
&rst
ixpk= 0, nxpk= 0, iat= 87, 102, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 7 MET HA 8 ASN HN 3.32
&rst
ixpk= 0, nxpk= 0, iat= 87, 102, r1= 1.30, r2= 1.80, r3= 3.32, r4= 3.82, &end
#
# 7 MET HA 8 ASN HN 3.32
&rst
ixpk= 0, nxpk= 0, iat= 87, 102, r1= 1.30, r2= 1.80, r3= 3.32, r4= 3.82, &end
#
# 7 MET HA 8 ASN HN 3.32
&rst
ixpk= 0, nxpk= 0, iat= 87, 102, r1= 1.30, r2= 1.80, r3= 3.32, r4= 3.82, &end
#
# 7 MET HA 8 ASN HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 87, 107, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 7 MET HA 8 ASN HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 87, 107, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 7 MET HA 8 ASN HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 87, 107, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 7 MET HA 37 LEU QD2 5.92
&rst
ixpk= 0, nxpk= 0, iat= 87, -1, r1= 1.30, r2= 1.80, r3= 7.11, r4= 7.61,
igr2= 530, 531, 532,
&end
#
# 7 MET HA 37 LEU QD2 5.92
&rst
ixpk= 0, nxpk= 0, iat= 87, -1, r1= 1.30, r2= 1.80, r3= 7.11, r4= 7.61,
igr2= 530, 531, 532,
&end
#
# 7 MET HA 37 LEU QD2 5.92
&rst
ixpk= 0, nxpk= 0, iat= 87, -1, r1= 1.30, r2= 1.80, r3= 7.11, r4= 7.61,
igr2= 530, 531, 532,
&end
#
# 7 MET HA 151 GLY HN 4.41
&rst
ixpk= 0, nxpk= 0, iat= 87,2128, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, &end
#
# 7 MET HA 151 GLY HN 4.41
&rst
ixpk= 0, nxpk= 0, iat= 87,2128, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, &end
#
# 7 MET HA 151 GLY HN 4.41
&rst
ixpk= 0, nxpk= 0, iat= 87,2128, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, &end
#
# 7 MET HA 151 GLY HA2 5.43
&rst
ixpk= 0, nxpk= 0, iat= 87,2130, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93, &end
#
# 7 MET HA 151 GLY HA2 5.43
&rst
ixpk= 0, nxpk= 0, iat= 87,2130, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93, &end
#
# 7 MET HA 151 GLY HA2 5.43
&rst
ixpk= 0, nxpk= 0, iat= 87,2130, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93, &end
#
# 7 MET HA 151 GLY HA3 5.38
&rst
ixpk= 0, nxpk= 0, iat= 87,2131, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88, &end
#
# 7 MET HA 151 GLY HA3 5.38
&rst
ixpk= 0, nxpk= 0, iat= 87,2131, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88, &end
#
# 7 MET HA 151 GLY HA3 5.38
&rst
ixpk= 0, nxpk= 0, iat= 87,2131, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88, &end
#
# 7 MET HB2 7 MET HB3 4.48
&rst
ixpk= 0, nxpk= 0, iat= 89, 90, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98, &end
#
# 7 MET HB2 7 MET HG2 4.83
&rst
ixpk= 0, nxpk= 0, iat= 89, 92, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33, &end
#
# 7 MET HB2 8 ASN HN 5.20
&rst
ixpk= 0, nxpk= 0, iat= 89, 102, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70, &end
#
# 7 MET HB2 8 ASN HN 5.20
&rst
ixpk= 0, nxpk= 0, iat= 89, 102, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70, &end
#
# 7 MET HB2 8 ASN HN 5.20
&rst
ixpk= 0, nxpk= 0, iat= 89, 102, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70, &end
#
# 7 MET HB2 8 ASN HN 5.72
&rst
ixpk= 0, nxpk= 0, iat= 89, 102, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 7 MET HB2 21 THR HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 89, 278, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 7 MET HB2 21 THR HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 89, 278, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 7 MET HB2 21 THR HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 89, 278, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 7 MET HB2 37 LEU QD2 5.30
&rst
ixpk= 0, nxpk= 0, iat= 89, -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
igr2= 530, 531, 532,
&end
#
# 7 MET HB2 37 LEU QD2 5.30
&rst
ixpk= 0, nxpk= 0, iat= 89, -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
igr2= 530, 531, 532,
&end
#
# 7 MET HB2 37 LEU QD2 5.30
&rst
ixpk= 0, nxpk= 0, iat= 89, -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
igr2= 530, 531, 532,
&end
#
# 7 MET HB3 7 MET HG2 5.63
&rst
ixpk= 0, nxpk= 0, iat= 90, 92, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13, &end
#
# 7 MET HB3 7 MET QE 5.88
&rst
ixpk= 0, nxpk= 0, iat= 90, -1, r1= 1.30, r2= 1.80, r3= 7.06, r4= 7.56,
igr2= 96, 97, 98,
&end
#
# 7 MET HB3 7 MET QE 5.88
&rst
ixpk= 0, nxpk= 0, iat= 90, -1, r1= 1.30, r2= 1.80, r3= 7.06, r4= 7.56,
igr2= 96, 97, 98,
&end
#
# 7 MET HB3 7 MET QE 5.88
&rst
ixpk= 0, nxpk= 0, iat= 90, -1, r1= 1.30, r2= 1.80, r3= 7.06, r4= 7.56,
igr2= 96, 97, 98,
&end
#
# 7 MET HB3 8 ASN HN 5.07
&rst
ixpk= 0, nxpk= 0, iat= 90, 102, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, &end
#
# 7 MET HB3 8 ASN HN 5.07
&rst
ixpk= 0, nxpk= 0, iat= 90, 102, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, &end
#
# 7 MET HB3 8 ASN HN 5.07
&rst
ixpk= 0, nxpk= 0, iat= 90, 102, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, &end
#
# 7 MET HB3 8 ASN HA 5.96
&rst
ixpk= 0, nxpk= 0, iat= 90, 104, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46, &end
#
# 7 MET HB3 8 ASN HA 5.96
&rst
ixpk= 0, nxpk= 0, iat= 90, 104, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46, &end
#
# 7 MET HB3 8 ASN HA 5.96
&rst
ixpk= 0, nxpk= 0, iat= 90, 104, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46, &end
#
# 7 MET HB3 37 LEU QD2 5.59
&rst
ixpk= 0, nxpk= 0, iat= 90, -1, r1= 1.30, r2= 1.80, r3= 6.71, r4= 7.21,
igr2= 530, 531, 532,
&end
#
# 7 MET HB3 37 LEU QD2 5.59
&rst
ixpk= 0, nxpk= 0, iat= 90, -1, r1= 1.30, r2= 1.80, r3= 6.71, r4= 7.21,
igr2= 530, 531, 532,
&end
#
# 7 MET HB3 37 LEU QD2 5.59
&rst
ixpk= 0, nxpk= 0, iat= 90, -1, r1= 1.30, r2= 1.80, r3= 6.71, r4= 7.21,
igr2= 530, 531, 532,
&end
#
# 7 MET HB3 149 ALA QB 4.20
&rst
ixpk= 0, nxpk= 0, iat= 90, -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr2=2112,2113,2114,
&end
#
# 7 MET HB3 149 ALA QB 4.20
&rst
ixpk= 0, nxpk= 0, iat= 90, -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr2=2112,2113,2114,
&end
#
# 7 MET HB3 149 ALA QB 4.20
&rst
ixpk= 0, nxpk= 0, iat= 90, -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr2=2112,2113,2114,
&end
#
# 7 MET HB3 150 CYX HN 4.98
&rst
ixpk= 0, nxpk= 0, iat= 90,2118, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48, &end
#
# 7 MET HB3 150 CYX HN 4.98
&rst
ixpk= 0, nxpk= 0, iat= 90,2118, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48, &end
#
# 7 MET HB3 150 CYX HN 4.98
&rst
ixpk= 0, nxpk= 0, iat= 90,2118, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48, &end
#
# 7 MET HB3 150 CYX HA 5.70
&rst
ixpk= 0, nxpk= 0, iat= 90,2120, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20, &end
#
# 7 MET HB3 150 CYX HA 5.70
&rst
ixpk= 0, nxpk= 0, iat= 90,2120, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20, &end
#
# 7 MET HB3 150 CYX HA 5.70
&rst
ixpk= 0, nxpk= 0, iat= 90,2120, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20, &end
#
# 7 MET HG2 7 MET QE 5.06
&rst
ixpk= 0, nxpk= 0, iat= 92, -1, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
igr2= 96, 97, 98,
&end
#
# 7 MET HG2 7 MET QE 5.06
&rst
ixpk= 0, nxpk= 0, iat= 92, -1, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
igr2= 96, 97, 98,
&end
#
# 7 MET HG2 7 MET QE 5.06
&rst
ixpk= 0, nxpk= 0, iat= 92, -1, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
igr2= 96, 97, 98,
&end
#
# 7 MET HG2 7 MET QE 5.14
&rst
ixpk= 0, nxpk= 0, iat= 92, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 96, 97, 98,
&end
#
# 7 MET HG2 21 THR HA 5.49
&rst
ixpk= 0, nxpk= 0, iat= 92, 278, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99, &end
#
# 7 MET HG2 21 THR HA 5.49
&rst
ixpk= 0, nxpk= 0, iat= 92, 278, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99, &end
#
# 7 MET HG2 21 THR HA 5.49
&rst
ixpk= 0, nxpk= 0, iat= 92, 278, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99, &end
#
# 7 MET HG2 21 THR HA 6.01
&rst
ixpk= 0, nxpk= 0, iat= 92, 278, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51, &end
#
# 7 MET HG2 21 THR HA 6.01
&rst
ixpk= 0, nxpk= 0, iat= 92, 278, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51, &end
#
# 7 MET HG2 21 THR HA 6.01
&rst
ixpk= 0, nxpk= 0, iat= 92, 278, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51, &end
#
# 7 MET HG2 22 VAL HN 5.78
&rst
ixpk= 0, nxpk= 0, iat= 92, 290, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28, &end
#
# 7 MET HG2 22 VAL HN 5.78
&rst
ixpk= 0, nxpk= 0, iat= 92, 290, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28, &end
#
# 7 MET HG2 22 VAL HN 5.78
&rst
ixpk= 0, nxpk= 0, iat= 92, 290, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28, &end
#
# 7 MET HG2 22 VAL QQG 5.46
&rst
ixpk= 0, nxpk= 0, iat= 92, -1, r1= 1.30, r2= 1.80, r3= 7.36, r4= 7.86,
igr2= 296, 297, 298, 300, 301, 302,
&end
#
# 7 MET HG2 22 VAL QQG 5.46
&rst
ixpk= 0, nxpk= 0, iat= 92, -1, r1= 1.30, r2= 1.80, r3= 7.36, r4= 7.86,
igr2= 296, 297, 298, 300, 301, 302,
&end
#
# 7 MET HG2 22 VAL QQG 5.46
&rst
ixpk= 0, nxpk= 0, iat= 92, -1, r1= 1.30, r2= 1.80, r3= 7.36, r4= 7.86,
igr2= 296, 297, 298, 300, 301, 302,
&end
#
# 7 MET HG2 22 VAL QQG 5.46
&rst
ixpk= 0, nxpk= 0, iat= 92, -1, r1= 1.30, r2= 1.80, r3= 7.36, r4= 7.86,
igr2= 296, 297, 298, 300, 301, 302,
&end
#
# 7 MET HG2 22 VAL QQG 5.46
&rst
ixpk= 0, nxpk= 0, iat= 92, -1, r1= 1.30, r2= 1.80, r3= 7.36, r4= 7.86,
igr2= 296, 297, 298, 300, 301, 302,
&end
#
# 7 MET HG2 22 VAL QQG 5.46
&rst
ixpk= 0, nxpk= 0, iat= 92, -1, r1= 1.30, r2= 1.80, r3= 7.36, r4= 7.86,
igr2= 296, 297, 298, 300, 301, 302,
&end
#
# 7 MET HG2 33 PHE HZ 6.05
&rst
ixpk= 0, nxpk= 0, iat= 92, 464, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 7 MET HG2 33 PHE HZ 6.05
&rst
ixpk= 0, nxpk= 0, iat= 92, 464, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 7 MET HG2 33 PHE HZ 6.05
&rst
ixpk= 0, nxpk= 0, iat= 92, 464, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 7 MET HG2 37 LEU QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 92, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 526, 527, 528,
&end
#
# 7 MET HG2 37 LEU QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 92, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 526, 527, 528,
&end
#
# 7 MET HG2 37 LEU QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 92, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 526, 527, 528,
&end
#
# 7 MET HG2 37 LEU QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 92, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 526, 527, 528,
&end
#
# 7 MET HG2 37 LEU QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 92, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 526, 527, 528,
&end
#
# 7 MET HG2 37 LEU QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 92, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 526, 527, 528,
&end
#
# 7 MET HG2 37 LEU QD2 4.72
&rst
ixpk= 0, nxpk= 0, iat= 92, -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
igr2= 530, 531, 532,
&end
#
# 7 MET HG2 37 LEU QD2 4.72
&rst
ixpk= 0, nxpk= 0, iat= 92, -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
igr2= 530, 531, 532,
&end
#
# 7 MET HG2 37 LEU QD2 4.72
&rst
ixpk= 0, nxpk= 0, iat= 92, -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
igr2= 530, 531, 532,
&end
#
# 7 MET HG2 37 LEU QD2 5.42
&rst
ixpk= 0, nxpk= 0, iat= 92, -1, r1= 1.30, r2= 1.80, r3= 6.51, r4= 7.01,
igr2= 530, 531, 532,
&end
#
# 7 MET HG2 37 LEU QD2 5.42
&rst
ixpk= 0, nxpk= 0, iat= 92, -1, r1= 1.30, r2= 1.80, r3= 6.51, r4= 7.01,
igr2= 530, 531, 532,
&end
#
# 7 MET HG2 37 LEU QD2 5.42
&rst
ixpk= 0, nxpk= 0, iat= 92, -1, r1= 1.30, r2= 1.80, r3= 6.51, r4= 7.01,
igr2= 530, 531, 532,
&end
#
# 7 MET HG2 151 GLY HA2 4.55
&rst
ixpk= 0, nxpk= 0, iat= 92,2130, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05, &end
#
# 7 MET HG2 151 GLY HA2 4.55
&rst
ixpk= 0, nxpk= 0, iat= 92,2130, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05, &end
#
# 7 MET HG2 151 GLY HA2 4.55
&rst
ixpk= 0, nxpk= 0, iat= 92,2130, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05, &end
#
# 7 MET QE 8 ASN HN 5.35
&rst
ixpk= 0, nxpk= 0, iat= -1, 102, r1= 1.30, r2= 1.80, r3= 6.43, r4= 6.93,
igr1= 96, 97, 98,
&end
#
# 7 MET QE 8 ASN HN 5.35
&rst
ixpk= 0, nxpk= 0, iat= -1, 102, r1= 1.30, r2= 1.80, r3= 6.43, r4= 6.93,
igr1= 96, 97, 98,
&end
#
# 7 MET QE 8 ASN HN 5.35
&rst
ixpk= 0, nxpk= 0, iat= -1, 102, r1= 1.30, r2= 1.80, r3= 6.43, r4= 6.93,
igr1= 96, 97, 98,
&end
#
# 7 MET QE 22 VAL HN 5.65
&rst
ixpk= 0, nxpk= 0, iat= -1, 290, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 96, 97, 98,
&end
#
# 7 MET QE 22 VAL HN 5.65
&rst
ixpk= 0, nxpk= 0, iat= -1, 290, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 96, 97, 98,
&end
#
# 7 MET QE 22 VAL HN 5.65
&rst
ixpk= 0, nxpk= 0, iat= -1, 290, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 96, 97, 98,
&end
#
# 7 MET QE 33 PHE HZ 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 464, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 96, 97, 98,
&end
#
# 7 MET QE 33 PHE HZ 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 464, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 96, 97, 98,
&end
#
# 7 MET QE 33 PHE HZ 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 464, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 96, 97, 98,
&end
#
# 7 MET QE 33 PHE QE 4.62
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.23, r4= 6.73,
igr1= 96, 97, 98,
igr2= 462, 466,
&end
#
# 7 MET QE 33 PHE QE 4.62
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.23, r4= 6.73,
igr1= 96, 97, 98,
igr2= 462, 466,
&end
#
# 7 MET QE 33 PHE QE 4.62
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.23, r4= 6.73,
igr1= 96, 97, 98,
igr2= 462, 466,
&end
#
# 7 MET QE 47 PHE QD 5.93
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.99, r4= 8.49,
igr1= 96, 97, 98,
igr2= 670, 678,
&end
#
# 7 MET QE 47 PHE QD 5.93
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.99, r4= 8.49,
igr1= 96, 97, 98,
igr2= 670, 678,
&end
#
# 7 MET QE 47 PHE QD 5.93
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.99, r4= 8.49,
igr1= 96, 97, 98,
igr2= 670, 678,
&end
#
# 7 MET QE 127 ILE HN 4.78
&rst
ixpk= 0, nxpk= 0, iat= -1,1803, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
igr1= 96, 97, 98,
&end
#
# 7 MET QE 127 ILE HN 4.78
&rst
ixpk= 0, nxpk= 0, iat= -1,1803, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
igr1= 96, 97, 98,
&end
#
# 7 MET QE 127 ILE HN 4.78
&rst
ixpk= 0, nxpk= 0, iat= -1,1803, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
igr1= 96, 97, 98,
&end
#
# 7 MET QE 127 ILE QD1 4.05
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
igr1= 96, 97, 98,
igr2=1816,1817,1818,
&end
#
# 7 MET QE 127 ILE QD1 4.05
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
igr1= 96, 97, 98,
igr2=1816,1817,1818,
&end
#
# 7 MET QE 127 ILE QD1 4.05
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
igr1= 96, 97, 98,
igr2=1816,1817,1818,
&end
#
# 7 MET QE 149 ALA QB 4.09
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
igr1= 96, 97, 98,
igr2=2112,2113,2114,
&end
#
# 7 MET QE 149 ALA QB 4.09
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
igr1= 96, 97, 98,
igr2=2112,2113,2114,
&end
#
# 7 MET QE 149 ALA QB 4.09
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
igr1= 96, 97, 98,
igr2=2112,2113,2114,
&end
#
# 7 MET QE 150 CYX HN 5.59
&rst
ixpk= 0, nxpk= 0, iat= -1,2118, r1= 1.30, r2= 1.80, r3= 6.71, r4= 7.21,
igr1= 96, 97, 98,
&end
#
# 7 MET QE 150 CYX HN 5.59
&rst
ixpk= 0, nxpk= 0, iat= -1,2118, r1= 1.30, r2= 1.80, r3= 6.71, r4= 7.21,
igr1= 96, 97, 98,
&end
#
# 7 MET QE 150 CYX HN 5.59
&rst
ixpk= 0, nxpk= 0, iat= -1,2118, r1= 1.30, r2= 1.80, r3= 6.71, r4= 7.21,
igr1= 96, 97, 98,
&end
#
# 7 MET QE 150 CYX HA 4.20
&rst
ixpk= 0, nxpk= 0, iat= -1,2120, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr1= 96, 97, 98,
&end
#
# 7 MET QE 150 CYX HA 4.20
&rst
ixpk= 0, nxpk= 0, iat= -1,2120, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr1= 96, 97, 98,
&end
#
# 7 MET QE 150 CYX HA 4.20
&rst
ixpk= 0, nxpk= 0, iat= -1,2120, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr1= 96, 97, 98,
&end
#
# 7 MET QE 150 CYX HB2 5.96
&rst
ixpk= 0, nxpk= 0, iat= -1,2123, r1= 1.30, r2= 1.80, r3= 7.16, r4= 7.66,
igr1= 96, 97, 98,
&end
#
# 7 MET QE 150 CYX HB2 5.96
&rst
ixpk= 0, nxpk= 0, iat= -1,2123, r1= 1.30, r2= 1.80, r3= 7.16, r4= 7.66,
igr1= 96, 97, 98,
&end
#
# 7 MET QE 150 CYX HB2 5.96
&rst
ixpk= 0, nxpk= 0, iat= -1,2123, r1= 1.30, r2= 1.80, r3= 7.16, r4= 7.66,
igr1= 96, 97, 98,
&end
#
# 7 MET QE 151 GLY HN 4.67
&rst
ixpk= 0, nxpk= 0, iat= -1,2128, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr1= 96, 97, 98,
&end
#
# 7 MET QE 151 GLY HN 4.67
&rst
ixpk= 0, nxpk= 0, iat= -1,2128, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr1= 96, 97, 98,
&end
#
# 7 MET QE 151 GLY HN 4.67
&rst
ixpk= 0, nxpk= 0, iat= -1,2128, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr1= 96, 97, 98,
&end
#
# 7 MET QE 151 GLY HA2 5.75
&rst
ixpk= 0, nxpk= 0, iat= -1,2130, r1= 1.30, r2= 1.80, r3= 6.91, r4= 7.41,
igr1= 96, 97, 98,
&end
#
# 7 MET QE 151 GLY HA2 5.75
&rst
ixpk= 0, nxpk= 0, iat= -1,2130, r1= 1.30, r2= 1.80, r3= 6.91, r4= 7.41,
igr1= 96, 97, 98,
&end
#
# 7 MET QE 151 GLY HA2 5.75
&rst
ixpk= 0, nxpk= 0, iat= -1,2130, r1= 1.30, r2= 1.80, r3= 6.91, r4= 7.41,
igr1= 96, 97, 98,
&end
#
# 7 MET QE 151 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,2131, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 96, 97, 98,
&end
#
# 7 MET QE 151 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,2131, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 96, 97, 98,
&end
#
# 7 MET QE 151 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,2131, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 96, 97, 98,
&end
#
# 8 ASN HN 8 ASN HA 3.87
&rst
ixpk= 0, nxpk= 0, iat= 102, 104, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37, &end
#
# 8 ASN HN 8 ASN HB2 4.46
&rst
ixpk= 0, nxpk= 0, iat= 102, 106, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, &end
#
# 8 ASN HN 8 ASN HB2 4.46
&rst
ixpk= 0, nxpk= 0, iat= 102, 106, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, &end
#
# 8 ASN HN 8 ASN HB2 4.46
&rst
ixpk= 0, nxpk= 0, iat= 102, 106, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, &end
#
# 8 ASN HN 8 ASN HB3 3.97
&rst
ixpk= 0, nxpk= 0, iat= 102, 107, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47, &end
#
# 8 ASN HN 8 ASN HB3 3.97
&rst
ixpk= 0, nxpk= 0, iat= 102, 107, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47, &end
#
# 8 ASN HN 8 ASN HB3 3.97
&rst
ixpk= 0, nxpk= 0, iat= 102, 107, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47, &end
#
# 8 ASN HN 8 ASN HD21 5.80
&rst
ixpk= 0, nxpk= 0, iat= 102, 111, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30, &end
#
# 8 ASN HN 8 ASN HD21 5.80
&rst
ixpk= 0, nxpk= 0, iat= 102, 111, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30, &end
#
# 8 ASN HN 8 ASN HD21 5.80
&rst
ixpk= 0, nxpk= 0, iat= 102, 111, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30, &end
#
# 8 ASN HN 8 ASN HD22 6.05
&rst
ixpk= 0, nxpk= 0, iat= 102, 112, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 8 ASN HN 8 ASN HD22 6.05
&rst
ixpk= 0, nxpk= 0, iat= 102, 112, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 8 ASN HN 8 ASN HD22 6.05
&rst
ixpk= 0, nxpk= 0, iat= 102, 112, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 8 ASN HN 9 LEU HN 5.28
&rst
ixpk= 0, nxpk= 0, iat= 102, 116, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 8 ASN HN 10 VAL QG1 5.09
&rst
ixpk= 0, nxpk= 0, iat= 102, -1, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
igr2= 141, 142, 143,
&end
#
# 8 ASN HN 10 VAL QG1 5.09
&rst
ixpk= 0, nxpk= 0, iat= 102, -1, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
igr2= 141, 142, 143,
&end
#
# 8 ASN HN 10 VAL QG1 5.09
&rst
ixpk= 0, nxpk= 0, iat= 102, -1, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
igr2= 141, 142, 143,
&end
#
# 8 ASN HN 10 VAL QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 102, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 145, 146, 147,
&end
#
# 8 ASN HN 10 VAL QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 102, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 145, 146, 147,
&end
#
# 8 ASN HN 10 VAL QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 102, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 145, 146, 147,
&end
#
# 8 ASN HN 15 VAL QG1 5.26
&rst
ixpk= 0, nxpk= 0, iat= 102, -1, r1= 1.30, r2= 1.80, r3= 6.32, r4= 6.82,
igr2= 205, 206, 207,
&end
#
# 8 ASN HN 15 VAL QG1 5.26
&rst
ixpk= 0, nxpk= 0, iat= 102, -1, r1= 1.30, r2= 1.80, r3= 6.32, r4= 6.82,
igr2= 205, 206, 207,
&end
#
# 8 ASN HN 15 VAL QG1 5.26
&rst
ixpk= 0, nxpk= 0, iat= 102, -1, r1= 1.30, r2= 1.80, r3= 6.32, r4= 6.82,
igr2= 205, 206, 207,
&end
#
# 8 ASN HN 150 CYX HN 4.12
&rst
ixpk= 0, nxpk= 0, iat= 102,2118, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62, &end
#
# 8 ASN HN 150 CYX HN 4.12
&rst
ixpk= 0, nxpk= 0, iat= 102,2118, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62, &end
#
# 8 ASN HN 150 CYX HN 4.12
&rst
ixpk= 0, nxpk= 0, iat= 102,2118, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62, &end
#
# 8 ASN HN 150 CYX HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 102,2120, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 8 ASN HN 150 CYX HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 102,2120, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 8 ASN HN 150 CYX HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 102,2120, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 8 ASN HN 151 GLY HN 5.63
&rst
ixpk= 0, nxpk= 0, iat= 102,2128, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13, &end
#
# 8 ASN HN 151 GLY HN 5.63
&rst
ixpk= 0, nxpk= 0, iat= 102,2128, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13, &end
#
# 8 ASN HN 151 GLY HN 5.63
&rst
ixpk= 0, nxpk= 0, iat= 102,2128, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13, &end
#
# 8 ASN HN 151 GLY HA3 6.03
&rst
ixpk= 0, nxpk= 0, iat= 102,2131, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53, &end
#
# 8 ASN HN 151 GLY HA3 6.03
&rst
ixpk= 0, nxpk= 0, iat= 102,2131, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53, &end
#
# 8 ASN HN 151 GLY HA3 6.03
&rst
ixpk= 0, nxpk= 0, iat= 102,2131, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53, &end
#
# 8 ASN HA 8 ASN HB2 4.70
&rst
ixpk= 0, nxpk= 0, iat= 104, 106, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 8 ASN HA 8 ASN HB3 4.88
&rst
ixpk= 0, nxpk= 0, iat= 104, 107, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38, &end
#
# 8 ASN HA 8 ASN HD21 5.33
&rst
ixpk= 0, nxpk= 0, iat= 104, 111, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83, &end
#
# 8 ASN HA 8 ASN HD21 5.33
&rst
ixpk= 0, nxpk= 0, iat= 104, 111, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83, &end
#
# 8 ASN HA 8 ASN HD21 5.33
&rst
ixpk= 0, nxpk= 0, iat= 104, 111, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83, &end
#
# 8 ASN HA 8 ASN HD22 5.49
&rst
ixpk= 0, nxpk= 0, iat= 104, 112, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99, &end
#
# 8 ASN HA 8 ASN HD22 5.49
&rst
ixpk= 0, nxpk= 0, iat= 104, 112, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99, &end
#
# 8 ASN HA 8 ASN HD22 5.49
&rst
ixpk= 0, nxpk= 0, iat= 104, 112, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99, &end
#
# 8 ASN HA 9 LEU HN 2.97
&rst
ixpk= 0, nxpk= 0, iat= 104, 116, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 8 ASN HA 9 LEU HN 3.55
&rst
ixpk= 0, nxpk= 0, iat= 104, 116, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05, &end
#
# 8 ASN HA 9 LEU HN 3.55
&rst
ixpk= 0, nxpk= 0, iat= 104, 116, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05, &end
#
# 8 ASN HA 9 LEU HN 3.55
&rst
ixpk= 0, nxpk= 0, iat= 104, 116, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05, &end
#
# 8 ASN HA 9 LEU HB2 5.22
&rst
ixpk= 0, nxpk= 0, iat= 104, 120, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72, &end
#
# 8 ASN HA 9 LEU HB2 5.22
&rst
ixpk= 0, nxpk= 0, iat= 104, 120, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72, &end
#
# 8 ASN HA 9 LEU HB2 5.22
&rst
ixpk= 0, nxpk= 0, iat= 104, 120, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72, &end
#
# 8 ASN HA 9 LEU QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 104, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 125, 126, 127,
&end
#
# 8 ASN HA 9 LEU QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 104, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 125, 126, 127,
&end
#
# 8 ASN HA 9 LEU QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 104, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 125, 126, 127,
&end
#
# 8 ASN HA 10 VAL QG1 6.00
&rst
ixpk= 0, nxpk= 0, iat= 104, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr2= 141, 142, 143,
&end
#
# 8 ASN HA 10 VAL QG1 6.00
&rst
ixpk= 0, nxpk= 0, iat= 104, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr2= 141, 142, 143,
&end
#
# 8 ASN HA 10 VAL QG1 6.00
&rst
ixpk= 0, nxpk= 0, iat= 104, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr2= 141, 142, 143,
&end
#
# 8 ASN HA 15 VAL QG1 5.54
&rst
ixpk= 0, nxpk= 0, iat= 104, -1, r1= 1.30, r2= 1.80, r3= 6.65, r4= 7.15,
igr2= 205, 206, 207,
&end
#
# 8 ASN HA 15 VAL QG1 5.54
&rst
ixpk= 0, nxpk= 0, iat= 104, -1, r1= 1.30, r2= 1.80, r3= 6.65, r4= 7.15,
igr2= 205, 206, 207,
&end
#
# 8 ASN HA 15 VAL QG1 5.54
&rst
ixpk= 0, nxpk= 0, iat= 104, -1, r1= 1.30, r2= 1.80, r3= 6.65, r4= 7.15,
igr2= 205, 206, 207,
&end
#
# 8 ASN HA 16 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 104, 215, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 8 ASN HA 16 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 104, 215, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 8 ASN HA 16 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 104, 215, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 8 ASN HA 17 GLN HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 104, 222, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 8 ASN HA 17 GLN HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 104, 222, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 8 ASN HA 17 GLN HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 104, 222, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 8 ASN HA 18 SER HN 5.30
&rst
ixpk= 0, nxpk= 0, iat= 104, 239, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80, &end
#
# 8 ASN HA 18 SER HN 5.30
&rst
ixpk= 0, nxpk= 0, iat= 104, 239, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80, &end
#
# 8 ASN HA 18 SER HN 5.30
&rst
ixpk= 0, nxpk= 0, iat= 104, 239, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80, &end
#
# 8 ASN HA 18 SER HA 5.62
&rst
ixpk= 0, nxpk= 0, iat= 104, 241, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12, &end
#
# 8 ASN HA 18 SER HA 5.62
&rst
ixpk= 0, nxpk= 0, iat= 104, 241, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12, &end
#
# 8 ASN HA 18 SER HA 5.62
&rst
ixpk= 0, nxpk= 0, iat= 104, 241, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12, &end
#
# 8 ASN HA 18 SER HB2 5.40
&rst
ixpk= 0, nxpk= 0, iat= 104, 243, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90, &end
#
# 8 ASN HA 18 SER HB2 5.40
&rst
ixpk= 0, nxpk= 0, iat= 104, 243, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90, &end
#
# 8 ASN HA 18 SER HB2 5.40
&rst
ixpk= 0, nxpk= 0, iat= 104, 243, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90, &end
#
# 8 ASN HA 18 SER HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 104, 244, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 8 ASN HA 18 SER HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 104, 244, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 8 ASN HA 18 SER HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 104, 244, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 8 ASN HA 150 CYX HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 104,2118, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 8 ASN HA 150 CYX HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 104,2118, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 8 ASN HA 150 CYX HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 104,2118, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 8 ASN HB2 8 ASN HB3 3.61
&rst
ixpk= 0, nxpk= 0, iat= 106, 107, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11, &end
#
# 8 ASN HB2 8 ASN HD21 4.28
&rst
ixpk= 0, nxpk= 0, iat= 106, 111, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78, &end
#
# 8 ASN HB2 8 ASN HD21 4.28
&rst
ixpk= 0, nxpk= 0, iat= 106, 111, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78, &end
#
# 8 ASN HB2 8 ASN HD21 4.28
&rst
ixpk= 0, nxpk= 0, iat= 106, 111, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78, &end
#
# 8 ASN HB2 8 ASN HD22 4.57
&rst
ixpk= 0, nxpk= 0, iat= 106, 112, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07, &end
#
# 8 ASN HB2 9 LEU HN 4.33
&rst
ixpk= 0, nxpk= 0, iat= 106, 116, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83, &end
#
# 8 ASN HB2 9 LEU HN 4.33
&rst
ixpk= 0, nxpk= 0, iat= 106, 116, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83, &end
#
# 8 ASN HB2 9 LEU HN 4.33
&rst
ixpk= 0, nxpk= 0, iat= 106, 116, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83, &end
#
# 8 ASN HB2 9 LEU HN 5.72
&rst
ixpk= 0, nxpk= 0, iat= 106, 116, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 8 ASN HB2 9 LEU HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 106, 118, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 8 ASN HB2 9 LEU HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 106, 118, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 8 ASN HB2 9 LEU HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 106, 118, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 8 ASN HB2 15 VAL HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 106, 201, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 8 ASN HB2 15 VAL HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 106, 201, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 8 ASN HB2 15 VAL HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 106, 201, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 8 ASN HB2 15 VAL QG1 4.11
&rst
ixpk= 0, nxpk= 0, iat= 106, -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
igr2= 205, 206, 207,
&end
#
# 8 ASN HB2 15 VAL QG1 4.11
&rst
ixpk= 0, nxpk= 0, iat= 106, -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
igr2= 205, 206, 207,
&end
#
# 8 ASN HB2 15 VAL QG1 4.11
&rst
ixpk= 0, nxpk= 0, iat= 106, -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
igr2= 205, 206, 207,
&end
#
# 8 ASN HB2 16 GLY HN 5.07
&rst
ixpk= 0, nxpk= 0, iat= 106, 215, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, &end
#
# 8 ASN HB2 16 GLY HN 5.07
&rst
ixpk= 0, nxpk= 0, iat= 106, 215, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, &end
#
# 8 ASN HB2 16 GLY HN 5.07
&rst
ixpk= 0, nxpk= 0, iat= 106, 215, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, &end
#
# 8 ASN HB2 17 GLN HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 106, 222, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 8 ASN HB2 17 GLN HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 106, 222, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 8 ASN HB2 17 GLN HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 106, 222, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 8 ASN HB2 18 SER HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 106, 239, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 8 ASN HB2 18 SER HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 106, 239, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 8 ASN HB2 18 SER HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 106, 239, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 8 ASN HB2 18 SER HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 106, 241, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 8 ASN HB2 18 SER HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 106, 241, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 8 ASN HB2 18 SER HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 106, 241, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 8 ASN HB3 8 ASN HD21 4.62
&rst
ixpk= 0, nxpk= 0, iat= 107, 111, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12, &end
#
# 8 ASN HB3 9 LEU HN 4.74
&rst
ixpk= 0, nxpk= 0, iat= 107, 116, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24, &end
#
# 8 ASN HB3 9 LEU HN 4.74
&rst
ixpk= 0, nxpk= 0, iat= 107, 116, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24, &end
#
# 8 ASN HB3 9 LEU HN 4.74
&rst
ixpk= 0, nxpk= 0, iat= 107, 116, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24, &end
#
# 8 ASN HB3 15 VAL QG1 4.01
&rst
ixpk= 0, nxpk= 0, iat= 107, -1, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
igr2= 205, 206, 207,
&end
#
# 8 ASN HB3 15 VAL QG1 4.01
&rst
ixpk= 0, nxpk= 0, iat= 107, -1, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
igr2= 205, 206, 207,
&end
#
# 8 ASN HB3 15 VAL QG1 4.01
&rst
ixpk= 0, nxpk= 0, iat= 107, -1, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
igr2= 205, 206, 207,
&end
#
# 8 ASN HB3 16 GLY HN 5.26
&rst
ixpk= 0, nxpk= 0, iat= 107, 215, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76, &end
#
# 8 ASN HB3 16 GLY HN 5.26
&rst
ixpk= 0, nxpk= 0, iat= 107, 215, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76, &end
#
# 8 ASN HB3 16 GLY HN 5.26
&rst
ixpk= 0, nxpk= 0, iat= 107, 215, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76, &end
#
# 8 ASN HD21 8 ASN HD22 3.15
&rst
ixpk= 0, nxpk= 0, iat= 111, 112, r1= 1.30, r2= 1.80, r3= 3.15, r4= 3.65, &end
#
# 8 ASN HD21 9 LEU HN 5.43
&rst
ixpk= 0, nxpk= 0, iat= 111, 116, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93, &end
#
# 8 ASN HD21 9 LEU HN 5.43
&rst
ixpk= 0, nxpk= 0, iat= 111, 116, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93, &end
#
# 8 ASN HD21 9 LEU HN 5.43
&rst
ixpk= 0, nxpk= 0, iat= 111, 116, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93, &end
#
# 8 ASN HD21 15 VAL QG1 4.69
&rst
ixpk= 0, nxpk= 0, iat= 111, -1, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr2= 205, 206, 207,
&end
#
# 8 ASN HD21 15 VAL QG1 4.69
&rst
ixpk= 0, nxpk= 0, iat= 111, -1, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr2= 205, 206, 207,
&end
#
# 8 ASN HD21 15 VAL QG1 4.69
&rst
ixpk= 0, nxpk= 0, iat= 111, -1, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr2= 205, 206, 207,
&end
#
# 8 ASN HD21 15 VAL QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 111, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 209, 210, 211,
&end
#
# 8 ASN HD21 15 VAL QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 111, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 209, 210, 211,
&end
#
# 8 ASN HD21 15 VAL QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 111, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 209, 210, 211,
&end
#
# 8 ASN HD21 16 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 111, 215, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 8 ASN HD21 16 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 111, 215, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 8 ASN HD21 16 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 111, 215, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 8 ASN HD21 16 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 111, 218, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 8 ASN HD21 16 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 111, 218, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 8 ASN HD21 16 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 111, 218, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 8 ASN HD21 17 GLN HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 111, 222, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 8 ASN HD21 17 GLN HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 111, 222, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 8 ASN HD21 17 GLN HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 111, 222, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 8 ASN HD21 17 GLN HA 5.64
&rst
ixpk= 0, nxpk= 0, iat= 111, 224, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14, &end
#
# 8 ASN HD21 17 GLN HA 5.64
&rst
ixpk= 0, nxpk= 0, iat= 111, 224, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14, &end
#
# 8 ASN HD21 17 GLN HA 5.64
&rst
ixpk= 0, nxpk= 0, iat= 111, 224, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14, &end
#
# 8 ASN HD21 17 GLN QB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 111, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2= 226, 227,
&end
#
# 8 ASN HD21 17 GLN QB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 111, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2= 226, 227,
&end
#
# 8 ASN HD21 17 GLN QB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 111, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2= 226, 227,
&end
#
# 8 ASN HD21 18 SER HN 4.97
&rst
ixpk= 0, nxpk= 0, iat= 111, 239, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 8 ASN HD21 18 SER HN 4.97
&rst
ixpk= 0, nxpk= 0, iat= 111, 239, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 8 ASN HD21 18 SER HN 4.97
&rst
ixpk= 0, nxpk= 0, iat= 111, 239, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 8 ASN HD21 18 SER HA 5.35
&rst
ixpk= 0, nxpk= 0, iat= 111, 241, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85, &end
#
# 8 ASN HD21 18 SER HA 5.35
&rst
ixpk= 0, nxpk= 0, iat= 111, 241, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85, &end
#
# 8 ASN HD21 18 SER HA 5.35
&rst
ixpk= 0, nxpk= 0, iat= 111, 241, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85, &end
#
# 8 ASN HD21 18 SER HB2 5.52
&rst
ixpk= 0, nxpk= 0, iat= 111, 243, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02, &end
#
# 8 ASN HD21 18 SER HB2 5.52
&rst
ixpk= 0, nxpk= 0, iat= 111, 243, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02, &end
#
# 8 ASN HD21 18 SER HB2 5.52
&rst
ixpk= 0, nxpk= 0, iat= 111, 243, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02, &end
#
# 8 ASN HD21 18 SER HB3 3.80
&rst
ixpk= 0, nxpk= 0, iat= 111, 244, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30, &end
#
# 8 ASN HD21 18 SER HB3 3.80
&rst
ixpk= 0, nxpk= 0, iat= 111, 244, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30, &end
#
# 8 ASN HD21 18 SER HB3 3.80
&rst
ixpk= 0, nxpk= 0, iat= 111, 244, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30, &end
#
# 8 ASN HD22 15 VAL QG1 5.63
&rst
ixpk= 0, nxpk= 0, iat= 112, -1, r1= 1.30, r2= 1.80, r3= 6.76, r4= 7.26,
igr2= 205, 206, 207,
&end
#
# 8 ASN HD22 15 VAL QG1 5.63
&rst
ixpk= 0, nxpk= 0, iat= 112, -1, r1= 1.30, r2= 1.80, r3= 6.76, r4= 7.26,
igr2= 205, 206, 207,
&end
#
# 8 ASN HD22 15 VAL QG1 5.63
&rst
ixpk= 0, nxpk= 0, iat= 112, -1, r1= 1.30, r2= 1.80, r3= 6.76, r4= 7.26,
igr2= 205, 206, 207,
&end
#
# 8 ASN HD22 16 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 112, 215, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 8 ASN HD22 16 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 112, 215, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 8 ASN HD22 16 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 112, 215, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 8 ASN HD22 17 GLN HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 112, 222, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 8 ASN HD22 17 GLN HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 112, 222, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 8 ASN HD22 17 GLN HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 112, 222, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 8 ASN HD22 17 GLN HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 112, 224, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 8 ASN HD22 17 GLN HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 112, 224, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 8 ASN HD22 17 GLN HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 112, 224, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 8 ASN HD22 18 SER HN 4.95
&rst
ixpk= 0, nxpk= 0, iat= 112, 239, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45, &end
#
# 8 ASN HD22 18 SER HN 4.95
&rst
ixpk= 0, nxpk= 0, iat= 112, 239, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45, &end
#
# 8 ASN HD22 18 SER HN 4.95
&rst
ixpk= 0, nxpk= 0, iat= 112, 239, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45, &end
#
# 8 ASN HD22 18 SER HA 5.62
&rst
ixpk= 0, nxpk= 0, iat= 112, 241, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12, &end
#
# 8 ASN HD22 18 SER HA 5.62
&rst
ixpk= 0, nxpk= 0, iat= 112, 241, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12, &end
#
# 8 ASN HD22 18 SER HA 5.62
&rst
ixpk= 0, nxpk= 0, iat= 112, 241, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12, &end
#
# 8 ASN HD22 18 SER HB2 5.52
&rst
ixpk= 0, nxpk= 0, iat= 112, 243, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02, &end
#
# 8 ASN HD22 18 SER HB2 5.52
&rst
ixpk= 0, nxpk= 0, iat= 112, 243, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02, &end
#
# 8 ASN HD22 18 SER HB2 5.52
&rst
ixpk= 0, nxpk= 0, iat= 112, 243, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02, &end
#
# 8 ASN HD22 18 SER HB3 5.85
&rst
ixpk= 0, nxpk= 0, iat= 112, 244, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35, &end
#
# 8 ASN HD22 18 SER HB3 5.85
&rst
ixpk= 0, nxpk= 0, iat= 112, 244, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35, &end
#
# 8 ASN HD22 18 SER HB3 5.85
&rst
ixpk= 0, nxpk= 0, iat= 112, 244, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35, &end
#
# 9 LEU HN 9 LEU HA 4.03
&rst
ixpk= 0, nxpk= 0, iat= 116, 118, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53, &end
#
# 9 LEU HN 9 LEU HB2 3.58
&rst
ixpk= 0, nxpk= 0, iat= 116, 120, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08, &end
#
# 9 LEU HN 9 LEU HB2 3.58
&rst
ixpk= 0, nxpk= 0, iat= 116, 120, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08, &end
#
# 9 LEU HN 9 LEU HB2 3.58
&rst
ixpk= 0, nxpk= 0, iat= 116, 120, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08, &end
#
# 9 LEU HN 9 LEU HB3 3.85
&rst
ixpk= 0, nxpk= 0, iat= 116, 121, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35, &end
#
# 9 LEU HN 9 LEU HB3 3.85
&rst
ixpk= 0, nxpk= 0, iat= 116, 121, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35, &end
#
# 9 LEU HN 9 LEU HB3 3.85
&rst
ixpk= 0, nxpk= 0, iat= 116, 121, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35, &end
#
# 9 LEU HN 9 LEU HG 4.59
&rst
ixpk= 0, nxpk= 0, iat= 116, 123, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 9 LEU HN 9 LEU HG 4.59
&rst
ixpk= 0, nxpk= 0, iat= 116, 123, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 9 LEU HN 9 LEU HG 4.59
&rst
ixpk= 0, nxpk= 0, iat= 116, 123, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 9 LEU HN 9 LEU QD1 4.36
&rst
ixpk= 0, nxpk= 0, iat= 116, -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr2= 125, 126, 127,
&end
#
# 9 LEU HN 9 LEU QD1 4.36
&rst
ixpk= 0, nxpk= 0, iat= 116, -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr2= 125, 126, 127,
&end
#
# 9 LEU HN 9 LEU QD1 4.36
&rst
ixpk= 0, nxpk= 0, iat= 116, -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr2= 125, 126, 127,
&end
#
# 9 LEU HN 9 LEU QD2 4.32
&rst
ixpk= 0, nxpk= 0, iat= 116, -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
igr2= 129, 130, 131,
&end
#
# 9 LEU HN 9 LEU QD2 4.32
&rst
ixpk= 0, nxpk= 0, iat= 116, -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
igr2= 129, 130, 131,
&end
#
# 9 LEU HN 9 LEU QD2 4.32
&rst
ixpk= 0, nxpk= 0, iat= 116, -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
igr2= 129, 130, 131,
&end
#
# 9 LEU HN 10 VAL HN 5.17
&rst
ixpk= 0, nxpk= 0, iat= 116, 135, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67, &end
#
# 9 LEU HN 10 VAL HN 5.17
&rst
ixpk= 0, nxpk= 0, iat= 116, 135, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67, &end
#
# 9 LEU HN 10 VAL HN 5.17
&rst
ixpk= 0, nxpk= 0, iat= 116, 135, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67, &end
#
# 9 LEU HN 10 VAL HN 5.28
&rst
ixpk= 0, nxpk= 0, iat= 116, 135, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 9 LEU HN 10 VAL QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 116, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 145, 146, 147,
&end
#
# 9 LEU HN 10 VAL QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 116, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 145, 146, 147,
&end
#
# 9 LEU HN 10 VAL QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 116, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 145, 146, 147,
&end
#
# 9 LEU HN 16 GLY HN 5.91
&rst
ixpk= 0, nxpk= 0, iat= 116, 215, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41, &end
#
# 9 LEU HN 16 GLY HN 5.91
&rst
ixpk= 0, nxpk= 0, iat= 116, 215, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41, &end
#
# 9 LEU HN 16 GLY HN 5.91
&rst
ixpk= 0, nxpk= 0, iat= 116, 215, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41, &end
#
# 9 LEU HN 16 GLY HA3 5.95
&rst
ixpk= 0, nxpk= 0, iat= 116, 218, r1= 1.30, r2= 1.80, r3= 5.95, r4= 6.45, &end
#
# 9 LEU HN 16 GLY HA3 5.95
&rst
ixpk= 0, nxpk= 0, iat= 116, 218, r1= 1.30, r2= 1.80, r3= 5.95, r4= 6.45, &end
#
# 9 LEU HN 16 GLY HA3 5.95
&rst
ixpk= 0, nxpk= 0, iat= 116, 218, r1= 1.30, r2= 1.80, r3= 5.95, r4= 6.45, &end
#
# 9 LEU HN 17 GLN HN 4.66
&rst
ixpk= 0, nxpk= 0, iat= 116, 222, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16, &end
#
# 9 LEU HN 17 GLN HN 4.66
&rst
ixpk= 0, nxpk= 0, iat= 116, 222, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16, &end
#
# 9 LEU HN 17 GLN HN 4.66
&rst
ixpk= 0, nxpk= 0, iat= 116, 222, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16, &end
#
# 9 LEU HN 17 GLN QB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 116, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2= 226, 227,
&end
#
# 9 LEU HN 17 GLN QB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 116, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2= 226, 227,
&end
#
# 9 LEU HN 17 GLN QB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 116, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2= 226, 227,
&end
#
# 9 LEU HN 18 SER HA 4.57
&rst
ixpk= 0, nxpk= 0, iat= 116, 241, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07, &end
#
# 9 LEU HN 18 SER HA 4.57
&rst
ixpk= 0, nxpk= 0, iat= 116, 241, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07, &end
#
# 9 LEU HN 18 SER HA 4.57
&rst
ixpk= 0, nxpk= 0, iat= 116, 241, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07, &end
#
# 9 LEU HN 149 ALA HA 5.67
&rst
ixpk= 0, nxpk= 0, iat= 116,2110, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17, &end
#
# 9 LEU HN 149 ALA HA 5.67
&rst
ixpk= 0, nxpk= 0, iat= 116,2110, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17, &end
#
# 9 LEU HN 149 ALA HA 5.67
&rst
ixpk= 0, nxpk= 0, iat= 116,2110, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17, &end
#
# 9 LEU HA 9 LEU HB2 4.36
&rst
ixpk= 0, nxpk= 0, iat= 118, 120, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86, &end
#
# 9 LEU HA 9 LEU HB3 4.29
&rst
ixpk= 0, nxpk= 0, iat= 118, 121, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79, &end
#
# 9 LEU HA 9 LEU QD1 4.96
&rst
ixpk= 0, nxpk= 0, iat= 118, -1, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
igr2= 125, 126, 127,
&end
#
# 9 LEU HA 9 LEU QD1 4.96
&rst
ixpk= 0, nxpk= 0, iat= 118, -1, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
igr2= 125, 126, 127,
&end
#
# 9 LEU HA 9 LEU QD1 4.96
&rst
ixpk= 0, nxpk= 0, iat= 118, -1, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
igr2= 125, 126, 127,
&end
#
# 9 LEU HA 9 LEU QD2 3.77
&rst
ixpk= 0, nxpk= 0, iat= 118, -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
igr2= 129, 130, 131,
&end
#
# 9 LEU HA 9 LEU QD2 3.77
&rst
ixpk= 0, nxpk= 0, iat= 118, -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
igr2= 129, 130, 131,
&end
#
# 9 LEU HA 9 LEU QD2 3.77
&rst
ixpk= 0, nxpk= 0, iat= 118, -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
igr2= 129, 130, 131,
&end
#
# 9 LEU HA 10 VAL HN 2.97
&rst
ixpk= 0, nxpk= 0, iat= 118, 135, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 9 LEU HA 10 VAL HN 3.46
&rst
ixpk= 0, nxpk= 0, iat= 118, 135, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96, &end
#
# 9 LEU HA 10 VAL HN 3.46
&rst
ixpk= 0, nxpk= 0, iat= 118, 135, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96, &end
#
# 9 LEU HA 10 VAL HN 3.46
&rst
ixpk= 0, nxpk= 0, iat= 118, 135, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96, &end
#
# 9 LEU HA 10 VAL HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 118, 137, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 9 LEU HA 10 VAL HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 118, 137, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 9 LEU HA 10 VAL HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 118, 137, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 9 LEU HA 10 VAL QG1 4.71
&rst
ixpk= 0, nxpk= 0, iat= 118, -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr2= 141, 142, 143,
&end
#
# 9 LEU HA 10 VAL QG1 4.71
&rst
ixpk= 0, nxpk= 0, iat= 118, -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr2= 141, 142, 143,
&end
#
# 9 LEU HA 10 VAL QG1 4.71
&rst
ixpk= 0, nxpk= 0, iat= 118, -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr2= 141, 142, 143,
&end
#
# 9 LEU HA 10 VAL QG2 4.41
&rst
ixpk= 0, nxpk= 0, iat= 118, -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr2= 145, 146, 147,
&end
#
# 9 LEU HA 10 VAL QG2 4.41
&rst
ixpk= 0, nxpk= 0, iat= 118, -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr2= 145, 146, 147,
&end
#
# 9 LEU HA 10 VAL QG2 4.41
&rst
ixpk= 0, nxpk= 0, iat= 118, -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr2= 145, 146, 147,
&end
#
# 9 LEU HA 149 ALA HA 4.25
&rst
ixpk= 0, nxpk= 0, iat= 118,2110, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75, &end
#
# 9 LEU HA 149 ALA HA 4.25
&rst
ixpk= 0, nxpk= 0, iat= 118,2110, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75, &end
#
# 9 LEU HA 149 ALA HA 4.25
&rst
ixpk= 0, nxpk= 0, iat= 118,2110, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75, &end
#
# 9 LEU HA 150 CYX HN 4.66
&rst
ixpk= 0, nxpk= 0, iat= 118,2118, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16, &end
#
# 9 LEU HA 150 CYX HN 4.66
&rst
ixpk= 0, nxpk= 0, iat= 118,2118, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16, &end
#
# 9 LEU HA 150 CYX HN 4.66
&rst
ixpk= 0, nxpk= 0, iat= 118,2118, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16, &end
#
# 9 LEU HB2 9 LEU QD1 3.71
&rst
ixpk= 0, nxpk= 0, iat= 120, -1, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
igr2= 125, 126, 127,
&end
#
# 9 LEU HB2 9 LEU QD1 3.71
&rst
ixpk= 0, nxpk= 0, iat= 120, -1, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
igr2= 125, 126, 127,
&end
#
# 9 LEU HB2 9 LEU QD1 3.71
&rst
ixpk= 0, nxpk= 0, iat= 120, -1, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
igr2= 125, 126, 127,
&end
#
# 9 LEU HB2 10 VAL HN 5.12
&rst
ixpk= 0, nxpk= 0, iat= 120, 135, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, &end
#
# 9 LEU HB2 10 VAL HN 5.12
&rst
ixpk= 0, nxpk= 0, iat= 120, 135, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, &end
#
# 9 LEU HB2 10 VAL HN 5.12
&rst
ixpk= 0, nxpk= 0, iat= 120, 135, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, &end
#
# 9 LEU HB2 10 VAL HN 5.72
&rst
ixpk= 0, nxpk= 0, iat= 120, 135, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 9 LEU HB2 16 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 120, 218, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 9 LEU HB2 16 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 120, 218, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 9 LEU HB2 16 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 120, 218, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 9 LEU HB2 17 GLN HN 4.70
&rst
ixpk= 0, nxpk= 0, iat= 120, 222, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 9 LEU HB2 17 GLN HN 4.70
&rst
ixpk= 0, nxpk= 0, iat= 120, 222, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 9 LEU HB2 17 GLN HN 4.70
&rst
ixpk= 0, nxpk= 0, iat= 120, 222, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 9 LEU HB2 18 SER HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 120, 239, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 9 LEU HB2 18 SER HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 120, 239, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 9 LEU HB2 18 SER HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 120, 239, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 9 LEU HB3 9 LEU QD1 3.96
&rst
ixpk= 0, nxpk= 0, iat= 121, -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
igr2= 125, 126, 127,
&end
#
# 9 LEU HB3 9 LEU QD1 3.96
&rst
ixpk= 0, nxpk= 0, iat= 121, -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
igr2= 125, 126, 127,
&end
#
# 9 LEU HB3 9 LEU QD1 3.96
&rst
ixpk= 0, nxpk= 0, iat= 121, -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
igr2= 125, 126, 127,
&end
#
# 9 LEU HB3 10 VAL HN 4.48
&rst
ixpk= 0, nxpk= 0, iat= 121, 135, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98, &end
#
# 9 LEU HB3 10 VAL HN 4.48
&rst
ixpk= 0, nxpk= 0, iat= 121, 135, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98, &end
#
# 9 LEU HB3 10 VAL HN 4.48
&rst
ixpk= 0, nxpk= 0, iat= 121, 135, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98, &end
#
# 9 LEU HB3 17 GLN HN 5.27
&rst
ixpk= 0, nxpk= 0, iat= 121, 222, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77, &end
#
# 9 LEU HB3 17 GLN HN 5.27
&rst
ixpk= 0, nxpk= 0, iat= 121, 222, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77, &end
#
# 9 LEU HB3 17 GLN HN 5.27
&rst
ixpk= 0, nxpk= 0, iat= 121, 222, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77, &end
#
# 9 LEU HG 9 LEU QD2 3.64
&rst
ixpk= 0, nxpk= 0, iat= 123, -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
igr2= 129, 130, 131,
&end
#
# 9 LEU QD1 16 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 218, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 125, 126, 127,
&end
#
# 9 LEU QD1 16 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 218, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 125, 126, 127,
&end
#
# 9 LEU QD1 16 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 218, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 125, 126, 127,
&end
#
# 9 LEU QD1 17 GLN HN 4.44
&rst
ixpk= 0, nxpk= 0, iat= -1, 222, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
igr1= 125, 126, 127,
&end
#
# 9 LEU QD1 17 GLN HN 4.44
&rst
ixpk= 0, nxpk= 0, iat= -1, 222, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
igr1= 125, 126, 127,
&end
#
# 9 LEU QD1 17 GLN HN 4.44
&rst
ixpk= 0, nxpk= 0, iat= -1, 222, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
igr1= 125, 126, 127,
&end
#
# 9 LEU QD1 17 GLN HNE1 4.83
&rst
ixpk= 0, nxpk= 0, iat= -1, 234, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
igr1= 125, 126, 127,
&end
#
# 9 LEU QD1 17 GLN HNE1 4.83
&rst
ixpk= 0, nxpk= 0, iat= -1, 234, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
igr1= 125, 126, 127,
&end
#
# 9 LEU QD1 17 GLN HNE1 4.83
&rst
ixpk= 0, nxpk= 0, iat= -1, 234, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
igr1= 125, 126, 127,
&end
#
# 9 LEU QD1 17 GLN HNE2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 235, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 125, 126, 127,
&end
#
# 9 LEU QD1 17 GLN HNE2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 235, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 125, 126, 127,
&end
#
# 9 LEU QD1 17 GLN HNE2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 235, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 125, 126, 127,
&end
#
# 9 LEU QD1 17 GLN HG3 4.94
&rst
ixpk= 0, nxpk= 0, iat= -1, 230, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr1= 125, 126, 127,
&end
#
# 9 LEU QD1 17 GLN HG3 4.94
&rst
ixpk= 0, nxpk= 0, iat= -1, 230, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr1= 125, 126, 127,
&end
#
# 9 LEU QD1 17 GLN HG3 4.94
&rst
ixpk= 0, nxpk= 0, iat= -1, 230, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr1= 125, 126, 127,
&end
#
# 9 LEU QD1 17 GLN QB 4.90
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 125, 126, 127,
igr2= 226, 227,
&end
#
# 9 LEU QD1 17 GLN QB 4.90
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 125, 126, 127,
igr2= 226, 227,
&end
#
# 9 LEU QD1 17 GLN QB 4.90
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 125, 126, 127,
igr2= 226, 227,
&end
#
# 9 LEU QD1 18 SER HN 5.08
&rst
ixpk= 0, nxpk= 0, iat= -1, 239, r1= 1.30, r2= 1.80, r3= 6.10, r4= 6.60,
igr1= 125, 126, 127,
&end
#
# 9 LEU QD1 18 SER HN 5.08
&rst
ixpk= 0, nxpk= 0, iat= -1, 239, r1= 1.30, r2= 1.80, r3= 6.10, r4= 6.60,
igr1= 125, 126, 127,
&end
#
# 9 LEU QD1 18 SER HN 5.08
&rst
ixpk= 0, nxpk= 0, iat= -1, 239, r1= 1.30, r2= 1.80, r3= 6.10, r4= 6.60,
igr1= 125, 126, 127,
&end
#
# 9 LEU QD1 19 ILE HN 5.25
&rst
ixpk= 0, nxpk= 0, iat= -1, 250, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
igr1= 125, 126, 127,
&end
#
# 9 LEU QD1 19 ILE HN 5.25
&rst
ixpk= 0, nxpk= 0, iat= -1, 250, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
igr1= 125, 126, 127,
&end
#
# 9 LEU QD1 19 ILE HN 5.25
&rst
ixpk= 0, nxpk= 0, iat= -1, 250, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
igr1= 125, 126, 127,
&end
#
# 9 LEU QD1 39 ALA HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 560, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 125, 126, 127,
&end
#
# 9 LEU QD1 39 ALA HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 560, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 125, 126, 127,
&end
#
# 9 LEU QD1 39 ALA HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 560, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 125, 126, 127,
&end
#
# 9 LEU QD1 39 ALA QB 3.88
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
igr1= 125, 126, 127,
igr2= 562, 563, 564,
&end
#
# 9 LEU QD1 39 ALA QB 3.88
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
igr1= 125, 126, 127,
igr2= 562, 563, 564,
&end
#
# 9 LEU QD1 39 ALA QB 3.88
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
igr1= 125, 126, 127,
igr2= 562, 563, 564,
&end
#
# 9 LEU QD1 148 TYR QD 5.84
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.87, r4= 8.37,
igr1= 125, 126, 127,
igr2=2095,2104,
&end
#
# 9 LEU QD1 148 TYR QD 5.84
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.87, r4= 8.37,
igr1= 125, 126, 127,
igr2=2095,2104,
&end
#
# 9 LEU QD1 148 TYR QD 5.84
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.87, r4= 8.37,
igr1= 125, 126, 127,
igr2=2095,2104,
&end
#
# 9 LEU QD2 9 LEU QD1 3.18
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09,
igr1= 129, 130, 131,
igr2= 125, 126, 127,
&end
#
# 9 LEU QD2 10 VAL HN 4.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 135, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr1= 129, 130, 131,
&end
#
# 9 LEU QD2 10 VAL HN 4.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 135, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr1= 129, 130, 131,
&end
#
# 9 LEU QD2 10 VAL HN 4.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 135, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr1= 129, 130, 131,
&end
#
# 9 LEU QD2 148 TYR QD 4.03
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
igr1= 129, 130, 131,
igr2=2095,2104,
&end
#
# 9 LEU QD2 148 TYR QD 4.03
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
igr1= 129, 130, 131,
igr2=2095,2104,
&end
#
# 9 LEU QD2 148 TYR QD 4.03
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
igr1= 129, 130, 131,
igr2=2095,2104,
&end
#
# 9 LEU QD2 149 ALA HA 5.21
&rst
ixpk= 0, nxpk= 0, iat= -1,2110, r1= 1.30, r2= 1.80, r3= 6.26, r4= 6.76,
igr1= 129, 130, 131,
&end
#
# 9 LEU QD2 149 ALA HA 5.21
&rst
ixpk= 0, nxpk= 0, iat= -1,2110, r1= 1.30, r2= 1.80, r3= 6.26, r4= 6.76,
igr1= 129, 130, 131,
&end
#
# 9 LEU QD2 149 ALA HA 5.21
&rst
ixpk= 0, nxpk= 0, iat= -1,2110, r1= 1.30, r2= 1.80, r3= 6.26, r4= 6.76,
igr1= 129, 130, 131,
&end
#
# 9 LEU QD2 149 ALA QB 3.61
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,
igr1= 129, 130, 131,
igr2=2112,2113,2114,
&end
#
# 9 LEU QD2 149 ALA QB 3.61
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,
igr1= 129, 130, 131,
igr2=2112,2113,2114,
&end
#
# 9 LEU QD2 149 ALA QB 3.61
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71,
igr1= 129, 130, 131,
igr2=2112,2113,2114,
&end
#
# 9 LEU QD2 150 CYX HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,2118, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 129, 130, 131,
&end
#
# 9 LEU QD2 150 CYX HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,2118, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 129, 130, 131,
&end
#
# 9 LEU QD2 150 CYX HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,2118, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 129, 130, 131,
&end
#
# 10 VAL HN 10 VAL HA 4.54
&rst
ixpk= 0, nxpk= 0, iat= 135, 137, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 10 VAL HN 10 VAL HB 4.65
&rst
ixpk= 0, nxpk= 0, iat= 135, 139, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15, &end
#
# 10 VAL HN 10 VAL QG1 4.50
&rst
ixpk= 0, nxpk= 0, iat= 135, -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr2= 141, 142, 143,
&end
#
# 10 VAL HN 10 VAL QG1 4.50
&rst
ixpk= 0, nxpk= 0, iat= 135, -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr2= 141, 142, 143,
&end
#
# 10 VAL HN 10 VAL QG1 4.50
&rst
ixpk= 0, nxpk= 0, iat= 135, -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr2= 141, 142, 143,
&end
#
# 10 VAL HN 10 VAL QG2 3.70
&rst
ixpk= 0, nxpk= 0, iat= 135, -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
igr2= 145, 146, 147,
&end
#
# 10 VAL HN 10 VAL QG2 3.70
&rst
ixpk= 0, nxpk= 0, iat= 135, -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
igr2= 145, 146, 147,
&end
#
# 10 VAL HN 10 VAL QG2 3.70
&rst
ixpk= 0, nxpk= 0, iat= 135, -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
igr2= 145, 146, 147,
&end
#
# 10 VAL HN 11 THR HN 5.28
&rst
ixpk= 0, nxpk= 0, iat= 135, 151, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 10 VAL HN 11 THR HN 5.47
&rst
ixpk= 0, nxpk= 0, iat= 135, 151, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97, &end
#
# 10 VAL HN 11 THR HN 5.47
&rst
ixpk= 0, nxpk= 0, iat= 135, 151, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97, &end
#
# 10 VAL HN 11 THR HN 5.47
&rst
ixpk= 0, nxpk= 0, iat= 135, 151, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97, &end
#
# 10 VAL HN 11 THR HB 5.75
&rst
ixpk= 0, nxpk= 0, iat= 135, 155, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25, &end
#
# 10 VAL HN 11 THR HB 5.75
&rst
ixpk= 0, nxpk= 0, iat= 135, 155, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25, &end
#
# 10 VAL HN 11 THR HB 5.75
&rst
ixpk= 0, nxpk= 0, iat= 135, 155, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25, &end
#
# 10 VAL HN 15 VAL HA 5.94
&rst
ixpk= 0, nxpk= 0, iat= 135, 201, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44, &end
#
# 10 VAL HN 15 VAL HA 5.94
&rst
ixpk= 0, nxpk= 0, iat= 135, 201, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44, &end
#
# 10 VAL HN 15 VAL HA 5.94
&rst
ixpk= 0, nxpk= 0, iat= 135, 201, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44, &end
#
# 10 VAL HN 16 GLY HN 5.84
&rst
ixpk= 0, nxpk= 0, iat= 135, 215, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34, &end
#
# 10 VAL HN 16 GLY HN 5.84
&rst
ixpk= 0, nxpk= 0, iat= 135, 215, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34, &end
#
# 10 VAL HN 16 GLY HN 5.84
&rst
ixpk= 0, nxpk= 0, iat= 135, 215, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34, &end
#
# 10 VAL HN 148 TYR HA 6.03
&rst
ixpk= 0, nxpk= 0, iat= 135,2089, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53, &end
#
# 10 VAL HN 148 TYR HA 6.03
&rst
ixpk= 0, nxpk= 0, iat= 135,2089, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53, &end
#
# 10 VAL HN 148 TYR HA 6.03
&rst
ixpk= 0, nxpk= 0, iat= 135,2089, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53, &end
#
# 10 VAL HN 149 ALA HN 5.68
&rst
ixpk= 0, nxpk= 0, iat= 135,2108, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18, &end
#
# 10 VAL HN 149 ALA HN 5.68
&rst
ixpk= 0, nxpk= 0, iat= 135,2108, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18, &end
#
# 10 VAL HN 149 ALA HN 5.68
&rst
ixpk= 0, nxpk= 0, iat= 135,2108, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18, &end
#
# 10 VAL HN 149 ALA HA 4.10
&rst
ixpk= 0, nxpk= 0, iat= 135,2110, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60, &end
#
# 10 VAL HN 149 ALA HA 4.10
&rst
ixpk= 0, nxpk= 0, iat= 135,2110, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60, &end
#
# 10 VAL HN 149 ALA HA 4.10
&rst
ixpk= 0, nxpk= 0, iat= 135,2110, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60, &end
#
# 10 VAL HN 149 ALA QB 4.69
&rst
ixpk= 0, nxpk= 0, iat= 135, -1, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr2=2112,2113,2114,
&end
#
# 10 VAL HN 149 ALA QB 4.69
&rst
ixpk= 0, nxpk= 0, iat= 135, -1, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr2=2112,2113,2114,
&end
#
# 10 VAL HN 149 ALA QB 4.69
&rst
ixpk= 0, nxpk= 0, iat= 135, -1, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr2=2112,2113,2114,
&end
#
# 10 VAL HN 150 CYX HN 5.00
&rst
ixpk= 0, nxpk= 0, iat= 135,2118, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 10 VAL HN 150 CYX HN 5.00
&rst
ixpk= 0, nxpk= 0, iat= 135,2118, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 10 VAL HN 150 CYX HN 5.00
&rst
ixpk= 0, nxpk= 0, iat= 135,2118, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 10 VAL HN 150 CYX HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 135,2123, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 10 VAL HN 150 CYX HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 135,2123, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 10 VAL HN 150 CYX HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 135,2123, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 10 VAL HA 10 VAL HB 4.35
&rst
ixpk= 0, nxpk= 0, iat= 137, 139, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85, &end
#
# 10 VAL HA 10 VAL QG1 3.95
&rst
ixpk= 0, nxpk= 0, iat= 137, -1, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr2= 141, 142, 143,
&end
#
# 10 VAL HA 10 VAL QG1 3.95
&rst
ixpk= 0, nxpk= 0, iat= 137, -1, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr2= 141, 142, 143,
&end
#
# 10 VAL HA 10 VAL QG1 3.95
&rst
ixpk= 0, nxpk= 0, iat= 137, -1, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr2= 141, 142, 143,
&end
#
# 10 VAL HA 10 VAL QG2 4.64
&rst
ixpk= 0, nxpk= 0, iat= 137, -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
igr2= 145, 146, 147,
&end
#
# 10 VAL HA 10 VAL QG2 4.64
&rst
ixpk= 0, nxpk= 0, iat= 137, -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
igr2= 145, 146, 147,
&end
#
# 10 VAL HA 10 VAL QG2 4.64
&rst
ixpk= 0, nxpk= 0, iat= 137, -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
igr2= 145, 146, 147,
&end
#
# 10 VAL HA 11 THR HN 2.97
&rst
ixpk= 0, nxpk= 0, iat= 137, 151, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 10 VAL HA 11 THR HN 3.42
&rst
ixpk= 0, nxpk= 0, iat= 137, 151, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92, &end
#
# 10 VAL HA 11 THR HN 3.42
&rst
ixpk= 0, nxpk= 0, iat= 137, 151, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92, &end
#
# 10 VAL HA 11 THR HN 3.42
&rst
ixpk= 0, nxpk= 0, iat= 137, 151, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92, &end
#
# 10 VAL HA 12 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 137, 165, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 10 VAL HA 12 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 137, 165, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 10 VAL HA 12 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 137, 165, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 10 VAL HA 14 GLY HN 5.65
&rst
ixpk= 0, nxpk= 0, iat= 137, 192, r1= 1.30, r2= 1.80, r3= 5.65, r4= 6.15, &end
#
# 10 VAL HA 14 GLY HN 5.65
&rst
ixpk= 0, nxpk= 0, iat= 137, 192, r1= 1.30, r2= 1.80, r3= 5.65, r4= 6.15, &end
#
# 10 VAL HA 14 GLY HN 5.65
&rst
ixpk= 0, nxpk= 0, iat= 137, 192, r1= 1.30, r2= 1.80, r3= 5.65, r4= 6.15, &end
#
# 10 VAL HA 15 VAL HA 4.36
&rst
ixpk= 0, nxpk= 0, iat= 137, 201, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86, &end
#
# 10 VAL HA 15 VAL HA 4.36
&rst
ixpk= 0, nxpk= 0, iat= 137, 201, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86, &end
#
# 10 VAL HA 15 VAL HA 4.36
&rst
ixpk= 0, nxpk= 0, iat= 137, 201, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86, &end
#
# 10 VAL HA 15 VAL QG1 5.25
&rst
ixpk= 0, nxpk= 0, iat= 137, -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
igr2= 205, 206, 207,
&end
#
# 10 VAL HA 15 VAL QG1 5.25
&rst
ixpk= 0, nxpk= 0, iat= 137, -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
igr2= 205, 206, 207,
&end
#
# 10 VAL HA 15 VAL QG1 5.25
&rst
ixpk= 0, nxpk= 0, iat= 137, -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
igr2= 205, 206, 207,
&end
#
# 10 VAL HA 16 GLY HN 4.22
&rst
ixpk= 0, nxpk= 0, iat= 137, 215, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 10 VAL HA 16 GLY HN 4.22
&rst
ixpk= 0, nxpk= 0, iat= 137, 215, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 10 VAL HA 16 GLY HN 4.22
&rst
ixpk= 0, nxpk= 0, iat= 137, 215, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 10 VAL HB 11 THR HN 3.77
&rst
ixpk= 0, nxpk= 0, iat= 139, 151, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27, &end
#
# 10 VAL HB 11 THR HN 3.77
&rst
ixpk= 0, nxpk= 0, iat= 139, 151, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27, &end
#
# 10 VAL HB 11 THR HN 3.77
&rst
ixpk= 0, nxpk= 0, iat= 139, 151, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27, &end
#
# 10 VAL HB 11 THR HN 5.72
&rst
ixpk= 0, nxpk= 0, iat= 139, 151, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 10 VAL HB 14 GLY HN 5.33
&rst
ixpk= 0, nxpk= 0, iat= 139, 192, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83, &end
#
# 10 VAL HB 14 GLY HN 5.33
&rst
ixpk= 0, nxpk= 0, iat= 139, 192, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83, &end
#
# 10 VAL HB 14 GLY HN 5.33
&rst
ixpk= 0, nxpk= 0, iat= 139, 192, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83, &end
#
# 10 VAL HB 15 VAL HA 5.37
&rst
ixpk= 0, nxpk= 0, iat= 139, 201, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87, &end
#
# 10 VAL HB 15 VAL HA 5.37
&rst
ixpk= 0, nxpk= 0, iat= 139, 201, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87, &end
#
# 10 VAL HB 15 VAL HA 5.37
&rst
ixpk= 0, nxpk= 0, iat= 139, 201, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87, &end
#
# 10 VAL HB 67 ALA QB 5.32
&rst
ixpk= 0, nxpk= 0, iat= 139, -1, r1= 1.30, r2= 1.80, r3= 6.39, r4= 6.89,
igr2= 945, 946, 947,
&end
#
# 10 VAL HB 67 ALA QB 5.32
&rst
ixpk= 0, nxpk= 0, iat= 139, -1, r1= 1.30, r2= 1.80, r3= 6.39, r4= 6.89,
igr2= 945, 946, 947,
&end
#
# 10 VAL HB 67 ALA QB 5.32
&rst
ixpk= 0, nxpk= 0, iat= 139, -1, r1= 1.30, r2= 1.80, r3= 6.39, r4= 6.89,
igr2= 945, 946, 947,
&end
#
# 10 VAL QG1 10 VAL HB 4.08
&rst
ixpk= 0, nxpk= 0, iat= -1, 139, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,
igr1= 141, 142, 143,
&end
#
# 10 VAL QG1 10 VAL QG2 3.64
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
igr1= 141, 142, 143,
igr2= 145, 146, 147,
&end
#
# 10 VAL QG1 15 VAL HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 199, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 141, 142, 143,
&end
#
# 10 VAL QG1 15 VAL HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 199, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 141, 142, 143,
&end
#
# 10 VAL QG1 15 VAL HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 199, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 141, 142, 143,
&end
#
# 10 VAL QG1 15 VAL HA 3.64
&rst
ixpk= 0, nxpk= 0, iat= -1, 201, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
igr1= 141, 142, 143,
&end
#
# 10 VAL QG1 15 VAL HA 3.64
&rst
ixpk= 0, nxpk= 0, iat= -1, 201, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
igr1= 141, 142, 143,
&end
#
# 10 VAL QG1 15 VAL HA 3.64
&rst
ixpk= 0, nxpk= 0, iat= -1, 201, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
igr1= 141, 142, 143,
&end
#
# 10 VAL QG1 16 GLY HN 4.51
&rst
ixpk= 0, nxpk= 0, iat= -1, 215, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr1= 141, 142, 143,
&end
#
# 10 VAL QG1 16 GLY HN 4.51
&rst
ixpk= 0, nxpk= 0, iat= -1, 215, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr1= 141, 142, 143,
&end
#
# 10 VAL QG1 16 GLY HN 4.51
&rst
ixpk= 0, nxpk= 0, iat= -1, 215, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr1= 141, 142, 143,
&end
#
# 10 VAL QG1 17 GLN HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 222, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 141, 142, 143,
&end
#
# 10 VAL QG1 17 GLN HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 222, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 141, 142, 143,
&end
#
# 10 VAL QG1 17 GLN HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 222, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 141, 142, 143,
&end
#
# 10 VAL QG1 55 CYX HB2 3.96
&rst
ixpk= 0, nxpk= 0, iat= -1, 782, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
igr1= 141, 142, 143,
&end
#
# 10 VAL QG1 55 CYX HB2 3.96
&rst
ixpk= 0, nxpk= 0, iat= -1, 782, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
igr1= 141, 142, 143,
&end
#
# 10 VAL QG1 55 CYX HB2 3.96
&rst
ixpk= 0, nxpk= 0, iat= -1, 782, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
igr1= 141, 142, 143,
&end
#
# 10 VAL QG1 55 CYX HB3 5.08
&rst
ixpk= 0, nxpk= 0, iat= -1, 781, r1= 1.30, r2= 1.80, r3= 6.10, r4= 6.60,
igr1= 141, 142, 143,
&end
#
# 10 VAL QG1 55 CYX HB3 5.08
&rst
ixpk= 0, nxpk= 0, iat= -1, 781, r1= 1.30, r2= 1.80, r3= 6.10, r4= 6.60,
igr1= 141, 142, 143,
&end
#
# 10 VAL QG1 55 CYX HB3 5.08
&rst
ixpk= 0, nxpk= 0, iat= -1, 781, r1= 1.30, r2= 1.80, r3= 6.10, r4= 6.60,
igr1= 141, 142, 143,
&end
#
# 10 VAL QG1 149 ALA HA 4.78
&rst
ixpk= 0, nxpk= 0, iat= -1,2110, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
igr1= 141, 142, 143,
&end
#
# 10 VAL QG1 149 ALA HA 4.78
&rst
ixpk= 0, nxpk= 0, iat= -1,2110, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
igr1= 141, 142, 143,
&end
#
# 10 VAL QG1 149 ALA HA 4.78
&rst
ixpk= 0, nxpk= 0, iat= -1,2110, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
igr1= 141, 142, 143,
&end
#
# 10 VAL QG1 150 CYX HN 4.27
&rst
ixpk= 0, nxpk= 0, iat= -1,2118, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
igr1= 141, 142, 143,
&end
#
# 10 VAL QG1 150 CYX HN 4.27
&rst
ixpk= 0, nxpk= 0, iat= -1,2118, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
igr1= 141, 142, 143,
&end
#
# 10 VAL QG1 150 CYX HN 4.27
&rst
ixpk= 0, nxpk= 0, iat= -1,2118, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
igr1= 141, 142, 143,
&end
#
# 10 VAL QG1 150 CYX HA 5.58
&rst
ixpk= 0, nxpk= 0, iat= -1,2120, r1= 1.30, r2= 1.80, r3= 6.70, r4= 7.20,
igr1= 141, 142, 143,
&end
#
# 10 VAL QG1 150 CYX HA 5.58
&rst
ixpk= 0, nxpk= 0, iat= -1,2120, r1= 1.30, r2= 1.80, r3= 6.70, r4= 7.20,
igr1= 141, 142, 143,
&end
#
# 10 VAL QG1 150 CYX HA 5.58
&rst
ixpk= 0, nxpk= 0, iat= -1,2120, r1= 1.30, r2= 1.80, r3= 6.70, r4= 7.20,
igr1= 141, 142, 143,
&end
#
# 10 VAL QG1 150 CYX HB2 4.57
&rst
ixpk= 0, nxpk= 0, iat= -1,2123, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
igr1= 141, 142, 143,
&end
#
# 10 VAL QG1 150 CYX HB2 4.57
&rst
ixpk= 0, nxpk= 0, iat= -1,2123, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
igr1= 141, 142, 143,
&end
#
# 10 VAL QG1 150 CYX HB2 4.57
&rst
ixpk= 0, nxpk= 0, iat= -1,2123, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
igr1= 141, 142, 143,
&end
#
# 10 VAL QG1 150 CYX HB3 4.31
&rst
ixpk= 0, nxpk= 0, iat= -1,2122, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
igr1= 141, 142, 143,
&end
#
# 10 VAL QG1 150 CYX HB3 4.31
&rst
ixpk= 0, nxpk= 0, iat= -1,2122, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
igr1= 141, 142, 143,
&end
#
# 10 VAL QG1 150 CYX HB3 4.31
&rst
ixpk= 0, nxpk= 0, iat= -1,2122, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
igr1= 141, 142, 143,
&end
#
# 10 VAL QG2 10 VAL HB 4.14
&rst
ixpk= 0, nxpk= 0, iat= -1, 139, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47,
igr1= 145, 146, 147,
&end
#
# 10 VAL QG2 11 THR HN 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 151, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr1= 145, 146, 147,
&end
#
# 10 VAL QG2 11 THR HN 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 151, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr1= 145, 146, 147,
&end
#
# 10 VAL QG2 11 THR HN 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 151, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr1= 145, 146, 147,
&end
#
# 10 VAL QG2 11 THR HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 153, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 145, 146, 147,
&end
#
# 10 VAL QG2 11 THR HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 153, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 145, 146, 147,
&end
#
# 10 VAL QG2 11 THR HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 153, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 145, 146, 147,
&end
#
# 10 VAL QG2 12 ALA HN 5.60
&rst
ixpk= 0, nxpk= 0, iat= -1, 165, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1= 145, 146, 147,
&end
#
# 10 VAL QG2 12 ALA HN 5.60
&rst
ixpk= 0, nxpk= 0, iat= -1, 165, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1= 145, 146, 147,
&end
#
# 10 VAL QG2 12 ALA HN 5.60
&rst
ixpk= 0, nxpk= 0, iat= -1, 165, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1= 145, 146, 147,
&end
#
# 10 VAL QG2 15 VAL HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 201, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 145, 146, 147,
&end
#
# 10 VAL QG2 15 VAL HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 201, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 145, 146, 147,
&end
#
# 10 VAL QG2 15 VAL HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 201, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 145, 146, 147,
&end
#
# 10 VAL QG2 55 CYX HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 782, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 145, 146, 147,
&end
#
# 10 VAL QG2 55 CYX HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 782, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 145, 146, 147,
&end
#
# 10 VAL QG2 55 CYX HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 782, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 145, 146, 147,
&end
#
# 10 VAL QG2 66 ALA HA 5.28
&rst
ixpk= 0, nxpk= 0, iat= -1, 933, r1= 1.30, r2= 1.80, r3= 6.34, r4= 6.84,
igr1= 145, 146, 147,
&end
#
# 10 VAL QG2 66 ALA HA 5.28
&rst
ixpk= 0, nxpk= 0, iat= -1, 933, r1= 1.30, r2= 1.80, r3= 6.34, r4= 6.84,
igr1= 145, 146, 147,
&end
#
# 10 VAL QG2 66 ALA HA 5.28
&rst
ixpk= 0, nxpk= 0, iat= -1, 933, r1= 1.30, r2= 1.80, r3= 6.34, r4= 6.84,
igr1= 145, 146, 147,
&end
#
# 10 VAL QG2 66 ALA QB 4.76
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.87, r4= 7.37,
igr1= 145, 146, 147,
igr2= 935, 936, 937,
&end
#
# 10 VAL QG2 66 ALA QB 4.76
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.87, r4= 7.37,
igr1= 145, 146, 147,
igr2= 935, 936, 937,
&end
#
# 10 VAL QG2 66 ALA QB 4.76
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.87, r4= 7.37,
igr1= 145, 146, 147,
igr2= 935, 936, 937,
&end
#
# 10 VAL QG2 67 ALA HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 943, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 145, 146, 147,
&end
#
# 10 VAL QG2 67 ALA HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 943, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 145, 146, 147,
&end
#
# 10 VAL QG2 67 ALA HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 943, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 145, 146, 147,
&end
#
# 10 VAL QG2 67 ALA QB 3.86
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
igr1= 145, 146, 147,
igr2= 945, 946, 947,
&end
#
# 10 VAL QG2 67 ALA QB 3.86
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
igr1= 145, 146, 147,
igr2= 945, 946, 947,
&end
#
# 10 VAL QG2 67 ALA QB 3.86
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
igr1= 145, 146, 147,
igr2= 945, 946, 947,
&end
#
# 10 VAL QG2 147 ARG HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,2063, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 145, 146, 147,
&end
#
# 10 VAL QG2 147 ARG HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,2063, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 145, 146, 147,
&end
#
# 10 VAL QG2 147 ARG HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,2063, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 145, 146, 147,
&end
#
# 10 VAL QG2 147 ARG HA 5.80
&rst
ixpk= 0, nxpk= 0, iat= -1,2065, r1= 1.30, r2= 1.80, r3= 6.97, r4= 7.47,
igr1= 145, 146, 147,
&end
#
# 10 VAL QG2 147 ARG HA 5.80
&rst
ixpk= 0, nxpk= 0, iat= -1,2065, r1= 1.30, r2= 1.80, r3= 6.97, r4= 7.47,
igr1= 145, 146, 147,
&end
#
# 10 VAL QG2 147 ARG HA 5.80
&rst
ixpk= 0, nxpk= 0, iat= -1,2065, r1= 1.30, r2= 1.80, r3= 6.97, r4= 7.47,
igr1= 145, 146, 147,
&end
#
# 10 VAL QG2 147 ARG QD 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.16, r4= 8.66,
igr1= 145, 146, 147,
igr2=2073,2074,
&end
#
# 10 VAL QG2 147 ARG QD 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.16, r4= 8.66,
igr1= 145, 146, 147,
igr2=2073,2074,
&end
#
# 10 VAL QG2 147 ARG QD 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.16, r4= 8.66,
igr1= 145, 146, 147,
igr2=2073,2074,
&end
#
# 10 VAL QG2 148 TYR HN 5.46
&rst
ixpk= 0, nxpk= 0, iat= -1,2087, r1= 1.30, r2= 1.80, r3= 6.56, r4= 7.06,
igr1= 145, 146, 147,
&end
#
# 10 VAL QG2 148 TYR HN 5.46
&rst
ixpk= 0, nxpk= 0, iat= -1,2087, r1= 1.30, r2= 1.80, r3= 6.56, r4= 7.06,
igr1= 145, 146, 147,
&end
#
# 10 VAL QG2 148 TYR HN 5.46
&rst
ixpk= 0, nxpk= 0, iat= -1,2087, r1= 1.30, r2= 1.80, r3= 6.56, r4= 7.06,
igr1= 145, 146, 147,
&end
#
# 10 VAL QG2 148 TYR HA 5.33
&rst
ixpk= 0, nxpk= 0, iat= -1,2089, r1= 1.30, r2= 1.80, r3= 6.40, r4= 6.90,
igr1= 145, 146, 147,
&end
#
# 10 VAL QG2 148 TYR HA 5.33
&rst
ixpk= 0, nxpk= 0, iat= -1,2089, r1= 1.30, r2= 1.80, r3= 6.40, r4= 6.90,
igr1= 145, 146, 147,
&end
#
# 10 VAL QG2 148 TYR HA 5.33
&rst
ixpk= 0, nxpk= 0, iat= -1,2089, r1= 1.30, r2= 1.80, r3= 6.40, r4= 6.90,
igr1= 145, 146, 147,
&end
#
# 10 VAL QG2 149 ALA HN 4.88
&rst
ixpk= 0, nxpk= 0, iat= -1,2108, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
igr1= 145, 146, 147,
&end
#
# 10 VAL QG2 149 ALA HN 4.88
&rst
ixpk= 0, nxpk= 0, iat= -1,2108, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
igr1= 145, 146, 147,
&end
#
# 10 VAL QG2 149 ALA HN 4.88
&rst
ixpk= 0, nxpk= 0, iat= -1,2108, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
igr1= 145, 146, 147,
&end
#
# 10 VAL QG2 149 ALA HA 4.16
&rst
ixpk= 0, nxpk= 0, iat= -1,2110, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,
igr1= 145, 146, 147,
&end
#
# 10 VAL QG2 149 ALA HA 4.16
&rst
ixpk= 0, nxpk= 0, iat= -1,2110, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,
igr1= 145, 146, 147,
&end
#
# 10 VAL QG2 149 ALA HA 4.16
&rst
ixpk= 0, nxpk= 0, iat= -1,2110, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,
igr1= 145, 146, 147,
&end
#
# 10 VAL QG2 150 CYX HN 4.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2118, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1= 145, 146, 147,
&end
#
# 10 VAL QG2 150 CYX HN 4.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2118, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1= 145, 146, 147,
&end
#
# 10 VAL QG2 150 CYX HN 4.00
&rst
ixpk= 0, nxpk= 0, iat= -1,2118, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1= 145, 146, 147,
&end
#
# 10 VAL QG2 150 CYX HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,2120, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 145, 146, 147,
&end
#
# 10 VAL QG2 150 CYX HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,2120, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 145, 146, 147,
&end
#
# 10 VAL QG2 150 CYX HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,2120, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 145, 146, 147,
&end
#
# 10 VAL QG2 150 CYX HB2 4.76
&rst
ixpk= 0, nxpk= 0, iat= -1,2123, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
igr1= 145, 146, 147,
&end
#
# 10 VAL QG2 150 CYX HB2 4.76
&rst
ixpk= 0, nxpk= 0, iat= -1,2123, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
igr1= 145, 146, 147,
&end
#
# 10 VAL QG2 150 CYX HB2 4.76
&rst
ixpk= 0, nxpk= 0, iat= -1,2123, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
igr1= 145, 146, 147,
&end
#
# 10 VAL QG2 150 CYX HB3 5.29
&rst
ixpk= 0, nxpk= 0, iat= -1,2122, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
igr1= 145, 146, 147,
&end
#
# 10 VAL QG2 150 CYX HB3 5.29
&rst
ixpk= 0, nxpk= 0, iat= -1,2122, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
igr1= 145, 146, 147,
&end
#
# 10 VAL QG2 150 CYX HB3 5.29
&rst
ixpk= 0, nxpk= 0, iat= -1,2122, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
igr1= 145, 146, 147,
&end
#
# 11 THR HN 11 THR HA 3.78
&rst
ixpk= 0, nxpk= 0, iat= 151, 153, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28, &end
#
# 11 THR HN 11 THR QG2 3.97
&rst
ixpk= 0, nxpk= 0, iat= 151, -1, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
igr2= 157, 158, 159,
&end
#
# 11 THR HN 11 THR QG2 3.97
&rst
ixpk= 0, nxpk= 0, iat= 151, -1, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
igr2= 157, 158, 159,
&end
#
# 11 THR HN 11 THR QG2 3.97
&rst
ixpk= 0, nxpk= 0, iat= 151, -1, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
igr2= 157, 158, 159,
&end
#
# 11 THR HN 12 ALA HN 5.28
&rst
ixpk= 0, nxpk= 0, iat= 151, 165, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 11 THR HN 12 ALA HN 5.39
&rst
ixpk= 0, nxpk= 0, iat= 151, 165, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89, &end
#
# 11 THR HN 12 ALA HN 5.39
&rst
ixpk= 0, nxpk= 0, iat= 151, 165, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89, &end
#
# 11 THR HN 12 ALA HN 5.39
&rst
ixpk= 0, nxpk= 0, iat= 151, 165, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89, &end
#
# 11 THR HN 12 ALA HA 5.87
&rst
ixpk= 0, nxpk= 0, iat= 151, 167, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37, &end
#
# 11 THR HN 12 ALA HA 5.87
&rst
ixpk= 0, nxpk= 0, iat= 151, 167, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37, &end
#
# 11 THR HN 12 ALA HA 5.87
&rst
ixpk= 0, nxpk= 0, iat= 151, 167, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37, &end
#
# 11 THR HN 13 GLN HN 5.24
&rst
ixpk= 0, nxpk= 0, iat= 151, 175, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74, &end
#
# 11 THR HN 13 GLN HN 5.24
&rst
ixpk= 0, nxpk= 0, iat= 151, 175, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74, &end
#
# 11 THR HN 13 GLN HN 5.24
&rst
ixpk= 0, nxpk= 0, iat= 151, 175, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74, &end
#
# 11 THR HN 13 GLN HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 151, 180, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 11 THR HN 13 GLN HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 151, 180, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 11 THR HN 13 GLN HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 151, 180, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 11 THR HN 14 GLY HN 4.20
&rst
ixpk= 0, nxpk= 0, iat= 151, 192, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 11 THR HN 14 GLY HN 4.20
&rst
ixpk= 0, nxpk= 0, iat= 151, 192, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 11 THR HN 14 GLY HN 4.20
&rst
ixpk= 0, nxpk= 0, iat= 151, 192, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 11 THR HN 15 VAL HA 5.46
&rst
ixpk= 0, nxpk= 0, iat= 151, 201, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96, &end
#
# 11 THR HN 15 VAL HA 5.46
&rst
ixpk= 0, nxpk= 0, iat= 151, 201, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96, &end
#
# 11 THR HN 15 VAL HA 5.46
&rst
ixpk= 0, nxpk= 0, iat= 151, 201, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96, &end
#
# 11 THR HN 57 PRO HD3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 151, 806, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 11 THR HN 57 PRO HD3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 151, 806, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 11 THR HN 57 PRO HD3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 151, 806, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 11 THR HN 57 PRO QG 6.05
&rst
ixpk= 0, nxpk= 0, iat= 151, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2= 808, 809,
&end
#
# 11 THR HN 57 PRO QG 6.05
&rst
ixpk= 0, nxpk= 0, iat= 151, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2= 808, 809,
&end
#
# 11 THR HN 57 PRO QG 6.05
&rst
ixpk= 0, nxpk= 0, iat= 151, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2= 808, 809,
&end
#
# 11 THR HA 12 ALA HN 2.97
&rst
ixpk= 0, nxpk= 0, iat= 153, 165, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 11 THR HA 12 ALA HN 3.41
&rst
ixpk= 0, nxpk= 0, iat= 153, 165, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91, &end
#
# 11 THR HA 12 ALA HN 3.41
&rst
ixpk= 0, nxpk= 0, iat= 153, 165, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91, &end
#
# 11 THR HA 12 ALA HN 3.41
&rst
ixpk= 0, nxpk= 0, iat= 153, 165, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91, &end
#
# 11 THR HA 13 GLN HN 4.59
&rst
ixpk= 0, nxpk= 0, iat= 153, 175, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 11 THR HA 13 GLN HN 4.59
&rst
ixpk= 0, nxpk= 0, iat= 153, 175, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 11 THR HA 13 GLN HN 4.59
&rst
ixpk= 0, nxpk= 0, iat= 153, 175, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 11 THR HB 12 ALA HN 5.72
&rst
ixpk= 0, nxpk= 0, iat= 155, 165, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 11 THR HB 148 TYR HA 5.37
&rst
ixpk= 0, nxpk= 0, iat= 155,2089, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87, &end
#
# 11 THR HB 148 TYR HA 5.37
&rst
ixpk= 0, nxpk= 0, iat= 155,2089, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87, &end
#
# 11 THR HB 148 TYR HA 5.37
&rst
ixpk= 0, nxpk= 0, iat= 155,2089, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87, &end
#
# 11 THR QG2 11 THR HB 3.48
&rst
ixpk= 0, nxpk= 0, iat= -1, 155, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
igr1= 157, 158, 159,
&end
#
# 11 THR QG2 12 ALA HN 4.63
&rst
ixpk= 0, nxpk= 0, iat= -1, 165, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
igr1= 157, 158, 159,
&end
#
# 11 THR QG2 12 ALA HN 4.63
&rst
ixpk= 0, nxpk= 0, iat= -1, 165, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
igr1= 157, 158, 159,
&end
#
# 11 THR QG2 12 ALA HN 4.63
&rst
ixpk= 0, nxpk= 0, iat= -1, 165, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
igr1= 157, 158, 159,
&end
#
# 11 THR QG2 12 ALA QB 4.70
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.78, r4= 7.28,
igr1= 157, 158, 159,
igr2= 169, 170, 171,
&end
#
# 11 THR QG2 12 ALA QB 4.70
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.78, r4= 7.28,
igr1= 157, 158, 159,
igr2= 169, 170, 171,
&end
#
# 11 THR QG2 12 ALA QB 4.70
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.78, r4= 7.28,
igr1= 157, 158, 159,
igr2= 169, 170, 171,
&end
#
# 11 THR QG2 13 GLN HN 4.94
&rst
ixpk= 0, nxpk= 0, iat= -1, 175, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr1= 157, 158, 159,
&end
#
# 11 THR QG2 13 GLN HN 4.94
&rst
ixpk= 0, nxpk= 0, iat= -1, 175, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr1= 157, 158, 159,
&end
#
# 11 THR QG2 13 GLN HN 4.94
&rst
ixpk= 0, nxpk= 0, iat= -1, 175, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr1= 157, 158, 159,
&end
#
# 11 THR QG2 13 GLN HNE1 5.85
&rst
ixpk= 0, nxpk= 0, iat= -1, 187, r1= 1.30, r2= 1.80, r3= 7.03, r4= 7.53,
igr1= 157, 158, 159,
&end
#
# 11 THR QG2 13 GLN HNE1 5.85
&rst
ixpk= 0, nxpk= 0, iat= -1, 187, r1= 1.30, r2= 1.80, r3= 7.03, r4= 7.53,
igr1= 157, 158, 159,
&end
#
# 11 THR QG2 13 GLN HNE1 5.85
&rst
ixpk= 0, nxpk= 0, iat= -1, 187, r1= 1.30, r2= 1.80, r3= 7.03, r4= 7.53,
igr1= 157, 158, 159,
&end
#
# 11 THR QG2 14 GLY HN 5.14
&rst
ixpk= 0, nxpk= 0, iat= -1, 192, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 157, 158, 159,
&end
#
# 11 THR QG2 14 GLY HN 5.14
&rst
ixpk= 0, nxpk= 0, iat= -1, 192, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 157, 158, 159,
&end
#
# 11 THR QG2 14 GLY HN 5.14
&rst
ixpk= 0, nxpk= 0, iat= -1, 192, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 157, 158, 159,
&end
#
# 12 ALA HN 12 ALA QB 4.38
&rst
ixpk= 0, nxpk= 0, iat= 165, -1, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr2= 169, 170, 171,
&end
#
# 12 ALA HN 12 ALA QB 4.38
&rst
ixpk= 0, nxpk= 0, iat= 165, -1, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr2= 169, 170, 171,
&end
#
# 12 ALA HN 12 ALA QB 4.38
&rst
ixpk= 0, nxpk= 0, iat= 165, -1, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr2= 169, 170, 171,
&end
#
# 12 ALA HN 13 GLN HN 4.26
&rst
ixpk= 0, nxpk= 0, iat= 165, 175, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76, &end
#
# 12 ALA HN 13 GLN HN 4.26
&rst
ixpk= 0, nxpk= 0, iat= 165, 175, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76, &end
#
# 12 ALA HN 13 GLN HN 4.26
&rst
ixpk= 0, nxpk= 0, iat= 165, 175, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76, &end
#
# 12 ALA HN 13 GLN HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 165, 177, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 12 ALA HN 13 GLN HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 165, 177, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 12 ALA HN 13 GLN HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 165, 177, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 12 ALA HN 13 GLN HNE1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 165, 187, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 12 ALA HN 13 GLN HNE1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 165, 187, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 12 ALA HN 13 GLN HNE1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 165, 187, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 12 ALA HN 14 GLY HN 5.27
&rst
ixpk= 0, nxpk= 0, iat= 165, 192, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77, &end
#
# 12 ALA HN 14 GLY HN 5.27
&rst
ixpk= 0, nxpk= 0, iat= 165, 192, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77, &end
#
# 12 ALA HN 14 GLY HN 5.27
&rst
ixpk= 0, nxpk= 0, iat= 165, 192, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77, &end
#
# 12 ALA HN 57 PRO QG 6.05
&rst
ixpk= 0, nxpk= 0, iat= 165, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2= 808, 809,
&end
#
# 12 ALA HN 57 PRO QG 6.05
&rst
ixpk= 0, nxpk= 0, iat= 165, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2= 808, 809,
&end
#
# 12 ALA HN 57 PRO QG 6.05
&rst
ixpk= 0, nxpk= 0, iat= 165, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2= 808, 809,
&end
#
# 12 ALA HA 12 ALA QB 3.51
&rst
ixpk= 0, nxpk= 0, iat= 167, -1, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
igr2= 169, 170, 171,
&end
#
# 12 ALA HA 13 GLN HN 4.75
&rst
ixpk= 0, nxpk= 0, iat= 167, 175, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, &end
#
# 12 ALA HA 13 GLN HNE1 5.80
&rst
ixpk= 0, nxpk= 0, iat= 167, 187, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30, &end
#
# 12 ALA HA 13 GLN HNE1 5.80
&rst
ixpk= 0, nxpk= 0, iat= 167, 187, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30, &end
#
# 12 ALA HA 13 GLN HNE1 5.80
&rst
ixpk= 0, nxpk= 0, iat= 167, 187, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30, &end
#
# 12 ALA HA 14 GLY HN 4.94
&rst
ixpk= 0, nxpk= 0, iat= 167, 192, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44, &end
#
# 12 ALA HA 14 GLY HN 4.94
&rst
ixpk= 0, nxpk= 0, iat= 167, 192, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44, &end
#
# 12 ALA HA 14 GLY HN 4.94
&rst
ixpk= 0, nxpk= 0, iat= 167, 192, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44, &end
#
# 12 ALA HA 57 PRO HB2 4.58
&rst
ixpk= 0, nxpk= 0, iat= 167, 811, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08, &end
#
# 12 ALA HA 57 PRO HB2 4.58
&rst
ixpk= 0, nxpk= 0, iat= 167, 811, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08, &end
#
# 12 ALA HA 57 PRO HB2 4.58
&rst
ixpk= 0, nxpk= 0, iat= 167, 811, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08, &end
#
# 12 ALA HA 57 PRO HB3 4.75
&rst
ixpk= 0, nxpk= 0, iat= 167, 812, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, &end
#
# 12 ALA HA 57 PRO HB3 4.75
&rst
ixpk= 0, nxpk= 0, iat= 167, 812, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, &end
#
# 12 ALA HA 57 PRO HB3 4.75
&rst
ixpk= 0, nxpk= 0, iat= 167, 812, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, &end
#
# 12 ALA HA 57 PRO QG 5.31
&rst
ixpk= 0, nxpk= 0, iat= 167, -1, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
igr2= 808, 809,
&end
#
# 12 ALA HA 57 PRO QG 5.31
&rst
ixpk= 0, nxpk= 0, iat= 167, -1, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
igr2= 808, 809,
&end
#
# 12 ALA HA 57 PRO QG 5.31
&rst
ixpk= 0, nxpk= 0, iat= 167, -1, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
igr2= 808, 809,
&end
#
# 12 ALA HA 64 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 167, 905, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 12 ALA HA 64 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 167, 905, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 12 ALA HA 64 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 167, 905, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 12 ALA HA 64 ALA QB 3.64
&rst
ixpk= 0, nxpk= 0, iat= 167, -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
igr2= 909, 910, 911,
&end
#
# 12 ALA HA 64 ALA QB 3.64
&rst
ixpk= 0, nxpk= 0, iat= 167, -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
igr2= 909, 910, 911,
&end
#
# 12 ALA HA 64 ALA QB 3.64
&rst
ixpk= 0, nxpk= 0, iat= 167, -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
igr2= 909, 910, 911,
&end
#
# 12 ALA HA 66 ALA HN 4.63
&rst
ixpk= 0, nxpk= 0, iat= 167, 931, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, &end
#
# 12 ALA HA 66 ALA HN 4.63
&rst
ixpk= 0, nxpk= 0, iat= 167, 931, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, &end
#
# 12 ALA HA 66 ALA HN 4.63
&rst
ixpk= 0, nxpk= 0, iat= 167, 931, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, &end
#
# 12 ALA QB 13 GLN HN 4.27
&rst
ixpk= 0, nxpk= 0, iat= -1, 175, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
igr1= 169, 170, 171,
&end
#
# 12 ALA QB 13 GLN HN 4.27
&rst
ixpk= 0, nxpk= 0, iat= -1, 175, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
igr1= 169, 170, 171,
&end
#
# 12 ALA QB 13 GLN HN 4.27
&rst
ixpk= 0, nxpk= 0, iat= -1, 175, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
igr1= 169, 170, 171,
&end
#
# 12 ALA QB 13 GLN HA 4.32
&rst
ixpk= 0, nxpk= 0, iat= -1, 177, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
igr1= 169, 170, 171,
&end
#
# 12 ALA QB 13 GLN HA 4.32
&rst
ixpk= 0, nxpk= 0, iat= -1, 177, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
igr1= 169, 170, 171,
&end
#
# 12 ALA QB 13 GLN HA 4.32
&rst
ixpk= 0, nxpk= 0, iat= -1, 177, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
igr1= 169, 170, 171,
&end
#
# 12 ALA QB 13 GLN HNE1 4.71
&rst
ixpk= 0, nxpk= 0, iat= -1, 187, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr1= 169, 170, 171,
&end
#
# 12 ALA QB 13 GLN HNE1 4.71
&rst
ixpk= 0, nxpk= 0, iat= -1, 187, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr1= 169, 170, 171,
&end
#
# 12 ALA QB 13 GLN HNE1 4.71
&rst
ixpk= 0, nxpk= 0, iat= -1, 187, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr1= 169, 170, 171,
&end
#
# 12 ALA QB 13 GLN HNE2 5.17
&rst
ixpk= 0, nxpk= 0, iat= -1, 188, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,
igr1= 169, 170, 171,
&end
#
# 12 ALA QB 13 GLN HNE2 5.17
&rst
ixpk= 0, nxpk= 0, iat= -1, 188, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,
igr1= 169, 170, 171,
&end
#
# 12 ALA QB 13 GLN HNE2 5.17
&rst
ixpk= 0, nxpk= 0, iat= -1, 188, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,
igr1= 169, 170, 171,
&end
#
# 12 ALA QB 14 GLY HN 5.94
&rst
ixpk= 0, nxpk= 0, iat= -1, 192, r1= 1.30, r2= 1.80, r3= 7.13, r4= 7.63,
igr1= 169, 170, 171,
&end
#
# 12 ALA QB 14 GLY HN 5.94
&rst
ixpk= 0, nxpk= 0, iat= -1, 192, r1= 1.30, r2= 1.80, r3= 7.13, r4= 7.63,
igr1= 169, 170, 171,
&end
#
# 12 ALA QB 14 GLY HN 5.94
&rst
ixpk= 0, nxpk= 0, iat= -1, 192, r1= 1.30, r2= 1.80, r3= 7.13, r4= 7.63,
igr1= 169, 170, 171,
&end
#
# 12 ALA QB 66 ALA HN 4.61
&rst
ixpk= 0, nxpk= 0, iat= -1, 931, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
igr1= 169, 170, 171,
&end
#
# 12 ALA QB 66 ALA HN 4.61
&rst
ixpk= 0, nxpk= 0, iat= -1, 931, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
igr1= 169, 170, 171,
&end
#
# 12 ALA QB 66 ALA HN 4.61
&rst
ixpk= 0, nxpk= 0, iat= -1, 931, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
igr1= 169, 170, 171,
&end
#
# 13 GLN HN 13 GLN HA 3.89
&rst
ixpk= 0, nxpk= 0, iat= 175, 177, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39, &end
#
# 13 GLN HN 13 GLN HB2 3.78
&rst
ixpk= 0, nxpk= 0, iat= 175, 179, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28, &end
#
# 13 GLN HN 13 GLN HB2 3.78
&rst
ixpk= 0, nxpk= 0, iat= 175, 179, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28, &end
#
# 13 GLN HN 13 GLN HB2 3.78
&rst
ixpk= 0, nxpk= 0, iat= 175, 179, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28, &end
#
# 13 GLN HN 13 GLN HB3 4.16
&rst
ixpk= 0, nxpk= 0, iat= 175, 180, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66, &end
#
# 13 GLN HN 13 GLN HB3 4.16
&rst
ixpk= 0, nxpk= 0, iat= 175, 180, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66, &end
#
# 13 GLN HN 13 GLN HB3 4.16
&rst
ixpk= 0, nxpk= 0, iat= 175, 180, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66, &end
#
# 13 GLN HN 13 GLN HG2 4.96
&rst
ixpk= 0, nxpk= 0, iat= 175, 182, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46, &end
#
# 13 GLN HN 13 GLN HG2 4.96
&rst
ixpk= 0, nxpk= 0, iat= 175, 182, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46, &end
#
# 13 GLN HN 13 GLN HG2 4.96
&rst
ixpk= 0, nxpk= 0, iat= 175, 182, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46, &end
#
# 13 GLN HN 13 GLN HG3 4.52
&rst
ixpk= 0, nxpk= 0, iat= 175, 183, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02, &end
#
# 13 GLN HN 13 GLN HG3 4.52
&rst
ixpk= 0, nxpk= 0, iat= 175, 183, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02, &end
#
# 13 GLN HN 13 GLN HG3 4.52
&rst
ixpk= 0, nxpk= 0, iat= 175, 183, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02, &end
#
# 13 GLN HN 14 GLY HN 3.39
&rst
ixpk= 0, nxpk= 0, iat= 175, 192, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89, &end
#
# 13 GLN HN 14 GLY HN 3.39
&rst
ixpk= 0, nxpk= 0, iat= 175, 192, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89, &end
#
# 13 GLN HN 14 GLY HN 3.39
&rst
ixpk= 0, nxpk= 0, iat= 175, 192, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89, &end
#
# 13 GLN HN 14 GLY HA2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 175, 194, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 13 GLN HN 14 GLY HA2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 175, 194, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 13 GLN HN 14 GLY HA2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 175, 194, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 13 GLN HN 14 GLY HA3 5.87
&rst
ixpk= 0, nxpk= 0, iat= 175, 195, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37, &end
#
# 13 GLN HN 14 GLY HA3 5.87
&rst
ixpk= 0, nxpk= 0, iat= 175, 195, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37, &end
#
# 13 GLN HN 14 GLY HA3 5.87
&rst
ixpk= 0, nxpk= 0, iat= 175, 195, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37, &end
#
# 13 GLN HA 13 GLN HB2 4.29
&rst
ixpk= 0, nxpk= 0, iat= 177, 179, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79, &end
#
# 13 GLN HA 13 GLN HB3 3.71
&rst
ixpk= 0, nxpk= 0, iat= 177, 180, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21, &end
#
# 13 GLN HA 13 GLN HNE1 4.31
&rst
ixpk= 0, nxpk= 0, iat= 177, 187, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81, &end
#
# 13 GLN HA 13 GLN HNE1 4.31
&rst
ixpk= 0, nxpk= 0, iat= 177, 187, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81, &end
#
# 13 GLN HA 13 GLN HNE1 4.31
&rst
ixpk= 0, nxpk= 0, iat= 177, 187, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81, &end
#
# 13 GLN HA 13 GLN HNE2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 177, 188, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 13 GLN HA 13 GLN HNE2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 177, 188, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 13 GLN HA 13 GLN HNE2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 177, 188, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 13 GLN HA 13 GLN HG2 4.15
&rst
ixpk= 0, nxpk= 0, iat= 177, 182, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65, &end
#
# 13 GLN HA 13 GLN HG2 4.15
&rst
ixpk= 0, nxpk= 0, iat= 177, 182, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65, &end
#
# 13 GLN HA 13 GLN HG2 4.15
&rst
ixpk= 0, nxpk= 0, iat= 177, 182, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65, &end
#
# 13 GLN HA 13 GLN HG3 4.04
&rst
ixpk= 0, nxpk= 0, iat= 177, 183, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, &end
#
# 13 GLN HA 13 GLN HG3 4.04
&rst
ixpk= 0, nxpk= 0, iat= 177, 183, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, &end
#
# 13 GLN HA 13 GLN HG3 4.04
&rst
ixpk= 0, nxpk= 0, iat= 177, 183, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, &end
#
# 13 GLN HA 14 GLY HN 4.35
&rst
ixpk= 0, nxpk= 0, iat= 177, 192, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85, &end
#
# 13 GLN HA 57 PRO QG 5.46
&rst
ixpk= 0, nxpk= 0, iat= 177, -1, r1= 1.30, r2= 1.80, r3= 6.13, r4= 6.63,
igr2= 808, 809,
&end
#
# 13 GLN HA 57 PRO QG 5.46
&rst
ixpk= 0, nxpk= 0, iat= 177, -1, r1= 1.30, r2= 1.80, r3= 6.13, r4= 6.63,
igr2= 808, 809,
&end
#
# 13 GLN HA 57 PRO QG 5.46
&rst
ixpk= 0, nxpk= 0, iat= 177, -1, r1= 1.30, r2= 1.80, r3= 6.13, r4= 6.63,
igr2= 808, 809,
&end
#
# 13 GLN HB2 13 GLN HNE1 4.52
&rst
ixpk= 0, nxpk= 0, iat= 179, 187, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02, &end
#
# 13 GLN HB2 13 GLN HNE1 4.52
&rst
ixpk= 0, nxpk= 0, iat= 179, 187, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02, &end
#
# 13 GLN HB2 13 GLN HNE1 4.52
&rst
ixpk= 0, nxpk= 0, iat= 179, 187, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02, &end
#
# 13 GLN HB2 13 GLN HNE2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 179, 188, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 13 GLN HB2 13 GLN HNE2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 179, 188, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 13 GLN HB2 13 GLN HNE2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 179, 188, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 13 GLN HB3 13 GLN HB2 3.26
&rst
ixpk= 0, nxpk= 0, iat= 180, 179, r1= 1.30, r2= 1.80, r3= 3.26, r4= 3.76, &end
#
# 13 GLN HB3 13 GLN HNE1 4.82
&rst
ixpk= 0, nxpk= 0, iat= 180, 187, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32, &end
#
# 13 GLN HB3 13 GLN HNE1 4.82
&rst
ixpk= 0, nxpk= 0, iat= 180, 187, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32, &end
#
# 13 GLN HB3 13 GLN HNE1 4.82
&rst
ixpk= 0, nxpk= 0, iat= 180, 187, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32, &end
#
# 13 GLN HB3 14 GLY HN 4.95
&rst
ixpk= 0, nxpk= 0, iat= 180, 192, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45, &end
#
# 13 GLN HB3 14 GLY HN 4.95
&rst
ixpk= 0, nxpk= 0, iat= 180, 192, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45, &end
#
# 13 GLN HB3 14 GLY HN 4.95
&rst
ixpk= 0, nxpk= 0, iat= 180, 192, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45, &end
#
# 13 GLN HNE1 13 GLN HNE2 2.64
&rst
ixpk= 0, nxpk= 0, iat= 187, 188, r1= 1.30, r2= 1.80, r3= 2.64, r4= 3.14, &end
#
# 13 GLN HG2 13 GLN HNE1 4.50
&rst
ixpk= 0, nxpk= 0, iat= 182, 187, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 13 GLN HG2 13 GLN HNE1 4.50
&rst
ixpk= 0, nxpk= 0, iat= 182, 187, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 13 GLN HG2 13 GLN HNE1 4.50
&rst
ixpk= 0, nxpk= 0, iat= 182, 187, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 13 GLN HG2 13 GLN HNE2 5.48
&rst
ixpk= 0, nxpk= 0, iat= 182, 188, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98, &end
#
# 13 GLN HG2 14 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 182, 192, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 13 GLN HG2 14 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 182, 192, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 13 GLN HG2 14 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 182, 192, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 13 GLN HG3 13 GLN HNE1 4.46
&rst
ixpk= 0, nxpk= 0, iat= 183, 187, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, &end
#
# 13 GLN HG3 13 GLN HNE1 4.46
&rst
ixpk= 0, nxpk= 0, iat= 183, 187, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, &end
#
# 13 GLN HG3 13 GLN HNE1 4.46
&rst
ixpk= 0, nxpk= 0, iat= 183, 187, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, &end
#
# 13 GLN HG3 13 GLN HNE2 5.18
&rst
ixpk= 0, nxpk= 0, iat= 183, 188, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68, &end
#
# 13 GLN HG3 13 GLN HG2 3.07
&rst
ixpk= 0, nxpk= 0, iat= 183, 182, r1= 1.30, r2= 1.80, r3= 3.07, r4= 3.57, &end
#
# 14 GLY HN 14 GLY HA2 4.07
&rst
ixpk= 0, nxpk= 0, iat= 192, 194, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57, &end
#
# 14 GLY HN 14 GLY HA3 3.76
&rst
ixpk= 0, nxpk= 0, iat= 192, 195, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26, &end
#
# 14 GLY HN 15 VAL HN 4.67
&rst
ixpk= 0, nxpk= 0, iat= 192, 199, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, &end
#
# 14 GLY HN 15 VAL HN 4.67
&rst
ixpk= 0, nxpk= 0, iat= 192, 199, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, &end
#
# 14 GLY HN 15 VAL HN 4.67
&rst
ixpk= 0, nxpk= 0, iat= 192, 199, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, &end
#
# 14 GLY HN 57 PRO HD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 192, 805, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 14 GLY HN 57 PRO HD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 192, 805, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 14 GLY HN 57 PRO HD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 192, 805, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 14 GLY HN 57 PRO QG 4.19
&rst
ixpk= 0, nxpk= 0, iat= 192, -1, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
igr2= 808, 809,
&end
#
# 14 GLY HN 57 PRO QG 4.19
&rst
ixpk= 0, nxpk= 0, iat= 192, -1, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
igr2= 808, 809,
&end
#
# 14 GLY HN 57 PRO QG 4.19
&rst
ixpk= 0, nxpk= 0, iat= 192, -1, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
igr2= 808, 809,
&end
#
# 14 GLY HA2 14 GLY HA3 3.54
&rst
ixpk= 0, nxpk= 0, iat= 194, 195, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04, &end
#
# 14 GLY HA2 15 VAL HN 3.49
&rst
ixpk= 0, nxpk= 0, iat= 194, 199, r1= 1.30, r2= 1.80, r3= 3.49, r4= 3.99, &end
#
# 14 GLY HA2 15 VAL HN 3.49
&rst
ixpk= 0, nxpk= 0, iat= 194, 199, r1= 1.30, r2= 1.80, r3= 3.49, r4= 3.99, &end
#
# 14 GLY HA2 15 VAL HN 3.49
&rst
ixpk= 0, nxpk= 0, iat= 194, 199, r1= 1.30, r2= 1.80, r3= 3.49, r4= 3.99, &end
#
# 14 GLY HA2 15 VAL HA 5.86
&rst
ixpk= 0, nxpk= 0, iat= 194, 201, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36, &end
#
# 14 GLY HA2 15 VAL HA 5.86
&rst
ixpk= 0, nxpk= 0, iat= 194, 201, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36, &end
#
# 14 GLY HA2 15 VAL HA 5.86
&rst
ixpk= 0, nxpk= 0, iat= 194, 201, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36, &end
#
# 14 GLY HA2 15 VAL QG2 5.71
&rst
ixpk= 0, nxpk= 0, iat= 194, -1, r1= 1.30, r2= 1.80, r3= 6.86, r4= 7.36,
igr2= 209, 210, 211,
&end
#
# 14 GLY HA2 15 VAL QG2 5.71
&rst
ixpk= 0, nxpk= 0, iat= 194, -1, r1= 1.30, r2= 1.80, r3= 6.86, r4= 7.36,
igr2= 209, 210, 211,
&end
#
# 14 GLY HA2 15 VAL QG2 5.71
&rst
ixpk= 0, nxpk= 0, iat= 194, -1, r1= 1.30, r2= 1.80, r3= 6.86, r4= 7.36,
igr2= 209, 210, 211,
&end
#
# 14 GLY HA2 56 GLN HA 6.02
&rst
ixpk= 0, nxpk= 0, iat= 194, 789, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52, &end
#
# 14 GLY HA2 56 GLN HA 6.02
&rst
ixpk= 0, nxpk= 0, iat= 194, 789, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52, &end
#
# 14 GLY HA2 56 GLN HA 6.02
&rst
ixpk= 0, nxpk= 0, iat= 194, 789, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52, &end
#
# 14 GLY HA2 57 PRO HD3 3.65
&rst
ixpk= 0, nxpk= 0, iat= 194, 806, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15, &end
#
# 14 GLY HA2 57 PRO HD3 3.65
&rst
ixpk= 0, nxpk= 0, iat= 194, 806, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15, &end
#
# 14 GLY HA2 57 PRO HD3 3.65
&rst
ixpk= 0, nxpk= 0, iat= 194, 806, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15, &end
#
# 14 GLY HA2 57 PRO QG 4.87
&rst
ixpk= 0, nxpk= 0, iat= 194, -1, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,
igr2= 808, 809,
&end
#
# 14 GLY HA2 57 PRO QG 4.87
&rst
ixpk= 0, nxpk= 0, iat= 194, -1, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,
igr2= 808, 809,
&end
#
# 14 GLY HA2 57 PRO QG 4.87
&rst
ixpk= 0, nxpk= 0, iat= 194, -1, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,
igr2= 808, 809,
&end
#
# 14 GLY HA3 15 VAL HN 3.62
&rst
ixpk= 0, nxpk= 0, iat= 195, 199, r1= 1.30, r2= 1.80, r3= 3.62, r4= 4.12, &end
#
# 14 GLY HA3 15 VAL HN 3.62
&rst
ixpk= 0, nxpk= 0, iat= 195, 199, r1= 1.30, r2= 1.80, r3= 3.62, r4= 4.12, &end
#
# 14 GLY HA3 15 VAL HN 3.62
&rst
ixpk= 0, nxpk= 0, iat= 195, 199, r1= 1.30, r2= 1.80, r3= 3.62, r4= 4.12, &end
#
# 14 GLY HA3 15 VAL HA 5.87
&rst
ixpk= 0, nxpk= 0, iat= 195, 201, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37, &end
#
# 14 GLY HA3 15 VAL HA 5.87
&rst
ixpk= 0, nxpk= 0, iat= 195, 201, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37, &end
#
# 14 GLY HA3 15 VAL HA 5.87
&rst
ixpk= 0, nxpk= 0, iat= 195, 201, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37, &end
#
# 14 GLY HA3 15 VAL HB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 195, 203, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 14 GLY HA3 15 VAL HB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 195, 203, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 14 GLY HA3 15 VAL HB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 195, 203, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 14 GLY HA3 15 VAL QG2 4.67
&rst
ixpk= 0, nxpk= 0, iat= 195, -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr2= 209, 210, 211,
&end
#
# 14 GLY HA3 15 VAL QG2 4.67
&rst
ixpk= 0, nxpk= 0, iat= 195, -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr2= 209, 210, 211,
&end
#
# 14 GLY HA3 15 VAL QG2 4.67
&rst
ixpk= 0, nxpk= 0, iat= 195, -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr2= 209, 210, 211,
&end
#
# 15 VAL HN 15 VAL HA 4.55
&rst
ixpk= 0, nxpk= 0, iat= 199, 201, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05, &end
#
# 15 VAL HN 15 VAL HB 3.49
&rst
ixpk= 0, nxpk= 0, iat= 199, 203, r1= 1.30, r2= 1.80, r3= 3.49, r4= 3.99, &end
#
# 15 VAL HN 15 VAL HB 3.49
&rst
ixpk= 0, nxpk= 0, iat= 199, 203, r1= 1.30, r2= 1.80, r3= 3.49, r4= 3.99, &end
#
# 15 VAL HN 15 VAL HB 3.49
&rst
ixpk= 0, nxpk= 0, iat= 199, 203, r1= 1.30, r2= 1.80, r3= 3.49, r4= 3.99, &end
#
# 15 VAL HN 15 VAL QG1 4.58
&rst
ixpk= 0, nxpk= 0, iat= 199, -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
igr2= 205, 206, 207,
&end
#
# 15 VAL HN 15 VAL QG1 4.58
&rst
ixpk= 0, nxpk= 0, iat= 199, -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
igr2= 205, 206, 207,
&end
#
# 15 VAL HN 15 VAL QG1 4.58
&rst
ixpk= 0, nxpk= 0, iat= 199, -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
igr2= 205, 206, 207,
&end
#
# 15 VAL HN 15 VAL QG2 3.55
&rst
ixpk= 0, nxpk= 0, iat= 199, -1, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,
igr2= 209, 210, 211,
&end
#
# 15 VAL HN 15 VAL QG2 3.55
&rst
ixpk= 0, nxpk= 0, iat= 199, -1, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,
igr2= 209, 210, 211,
&end
#
# 15 VAL HN 15 VAL QG2 3.55
&rst
ixpk= 0, nxpk= 0, iat= 199, -1, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,
igr2= 209, 210, 211,
&end
#
# 15 VAL HN 16 GLY HN 5.92
&rst
ixpk= 0, nxpk= 0, iat= 199, 215, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42, &end
#
# 15 VAL HN 16 GLY HN 5.92
&rst
ixpk= 0, nxpk= 0, iat= 199, 215, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42, &end
#
# 15 VAL HN 16 GLY HN 5.92
&rst
ixpk= 0, nxpk= 0, iat= 199, 215, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42, &end
#
# 15 VAL HN 55 CYX HB2 5.21
&rst
ixpk= 0, nxpk= 0, iat= 199, 782, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71, &end
#
# 15 VAL HN 55 CYX HB2 5.21
&rst
ixpk= 0, nxpk= 0, iat= 199, 782, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71, &end
#
# 15 VAL HN 55 CYX HB2 5.21
&rst
ixpk= 0, nxpk= 0, iat= 199, 782, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71, &end
#
# 15 VAL HN 56 GLN HNE1 5.91
&rst
ixpk= 0, nxpk= 0, iat= 199, 799, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41, &end
#
# 15 VAL HN 56 GLN HNE1 5.91
&rst
ixpk= 0, nxpk= 0, iat= 199, 799, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41, &end
#
# 15 VAL HN 56 GLN HNE1 5.91
&rst
ixpk= 0, nxpk= 0, iat= 199, 799, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41, &end
#
# 15 VAL HN 56 GLN HNE2 6.01
&rst
ixpk= 0, nxpk= 0, iat= 199, 800, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51, &end
#
# 15 VAL HN 56 GLN HNE2 6.01
&rst
ixpk= 0, nxpk= 0, iat= 199, 800, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51, &end
#
# 15 VAL HN 56 GLN HNE2 6.01
&rst
ixpk= 0, nxpk= 0, iat= 199, 800, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51, &end
#
# 15 VAL HN 57 PRO HD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 199, 805, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 15 VAL HN 57 PRO HD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 199, 805, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 15 VAL HN 57 PRO HD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 199, 805, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 15 VAL HN 57 PRO HD3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 199, 806, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 15 VAL HN 57 PRO HD3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 199, 806, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 15 VAL HN 57 PRO HD3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 199, 806, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 15 VAL HA 15 VAL HB 4.37
&rst
ixpk= 0, nxpk= 0, iat= 201, 203, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87, &end
#
# 15 VAL HA 15 VAL QG1 3.96
&rst
ixpk= 0, nxpk= 0, iat= 201, -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
igr2= 205, 206, 207,
&end
#
# 15 VAL HA 15 VAL QG1 3.96
&rst
ixpk= 0, nxpk= 0, iat= 201, -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
igr2= 205, 206, 207,
&end
#
# 15 VAL HA 15 VAL QG1 3.96
&rst
ixpk= 0, nxpk= 0, iat= 201, -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
igr2= 205, 206, 207,
&end
#
# 15 VAL HA 15 VAL QG2 3.93
&rst
ixpk= 0, nxpk= 0, iat= 201, -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
igr2= 209, 210, 211,
&end
#
# 15 VAL HA 15 VAL QG2 3.93
&rst
ixpk= 0, nxpk= 0, iat= 201, -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
igr2= 209, 210, 211,
&end
#
# 15 VAL HA 15 VAL QG2 3.93
&rst
ixpk= 0, nxpk= 0, iat= 201, -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
igr2= 209, 210, 211,
&end
#
# 15 VAL HA 16 GLY HN 3.39
&rst
ixpk= 0, nxpk= 0, iat= 201, 215, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89, &end
#
# 15 VAL HA 16 GLY HN 3.39
&rst
ixpk= 0, nxpk= 0, iat= 201, 215, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89, &end
#
# 15 VAL HA 16 GLY HN 3.39
&rst
ixpk= 0, nxpk= 0, iat= 201, 215, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89, &end
#
# 15 VAL HA 16 GLY HA3 5.64
&rst
ixpk= 0, nxpk= 0, iat= 201, 218, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14, &end
#
# 15 VAL HA 16 GLY HA3 5.64
&rst
ixpk= 0, nxpk= 0, iat= 201, 218, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14, &end
#
# 15 VAL HA 16 GLY HA3 5.64
&rst
ixpk= 0, nxpk= 0, iat= 201, 218, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14, &end
#
# 15 VAL HB 16 GLY HN 5.53
&rst
ixpk= 0, nxpk= 0, iat= 203, 215, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03, &end
#
# 15 VAL HB 16 GLY HN 5.53
&rst
ixpk= 0, nxpk= 0, iat= 203, 215, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03, &end
#
# 15 VAL HB 16 GLY HN 5.53
&rst
ixpk= 0, nxpk= 0, iat= 203, 215, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03, &end
#
# 15 VAL HB 56 GLN HNE1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 203, 799, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 15 VAL HB 56 GLN HNE1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 203, 799, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 15 VAL HB 56 GLN HNE1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 203, 799, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 15 VAL HB 56 GLN HNE2 5.69
&rst
ixpk= 0, nxpk= 0, iat= 203, 800, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19, &end
#
# 15 VAL HB 56 GLN HNE2 5.69
&rst
ixpk= 0, nxpk= 0, iat= 203, 800, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19, &end
#
# 15 VAL HB 56 GLN HNE2 5.69
&rst
ixpk= 0, nxpk= 0, iat= 203, 800, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19, &end
#
# 15 VAL QG1 15 VAL HB 3.86
&rst
ixpk= 0, nxpk= 0, iat= -1, 203, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
igr1= 205, 206, 207,
&end
#
# 15 VAL QG1 16 GLY HN 4.09
&rst
ixpk= 0, nxpk= 0, iat= -1, 215, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
igr1= 205, 206, 207,
&end
#
# 15 VAL QG1 16 GLY HN 4.09
&rst
ixpk= 0, nxpk= 0, iat= -1, 215, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
igr1= 205, 206, 207,
&end
#
# 15 VAL QG1 16 GLY HN 4.09
&rst
ixpk= 0, nxpk= 0, iat= -1, 215, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
igr1= 205, 206, 207,
&end
#
# 15 VAL QG1 55 CYX HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 782, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 205, 206, 207,
&end
#
# 15 VAL QG1 55 CYX HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 782, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 205, 206, 207,
&end
#
# 15 VAL QG1 55 CYX HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 782, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 205, 206, 207,
&end
#
# 15 VAL QG1 56 GLN HNE1 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 799, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 205, 206, 207,
&end
#
# 15 VAL QG1 56 GLN HNE1 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 799, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 205, 206, 207,
&end
#
# 15 VAL QG1 56 GLN HNE1 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 799, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 205, 206, 207,
&end
#
# 15 VAL QG1 56 GLN HNE2 5.96
&rst
ixpk= 0, nxpk= 0, iat= -1, 800, r1= 1.30, r2= 1.80, r3= 7.16, r4= 7.66,
igr1= 205, 206, 207,
&end
#
# 15 VAL QG1 56 GLN HNE2 5.96
&rst
ixpk= 0, nxpk= 0, iat= -1, 800, r1= 1.30, r2= 1.80, r3= 7.16, r4= 7.66,
igr1= 205, 206, 207,
&end
#
# 15 VAL QG1 56 GLN HNE2 5.96
&rst
ixpk= 0, nxpk= 0, iat= -1, 800, r1= 1.30, r2= 1.80, r3= 7.16, r4= 7.66,
igr1= 205, 206, 207,
&end
#
# 15 VAL QG2 15 VAL HB 3.49
&rst
ixpk= 0, nxpk= 0, iat= -1, 203, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,
igr1= 209, 210, 211,
&end
#
# 15 VAL QG2 16 GLY HN 5.47
&rst
ixpk= 0, nxpk= 0, iat= -1, 215, r1= 1.30, r2= 1.80, r3= 6.57, r4= 7.07,
igr1= 209, 210, 211,
&end
#
# 15 VAL QG2 16 GLY HN 5.47
&rst
ixpk= 0, nxpk= 0, iat= -1, 215, r1= 1.30, r2= 1.80, r3= 6.57, r4= 7.07,
igr1= 209, 210, 211,
&end
#
# 15 VAL QG2 16 GLY HN 5.47
&rst
ixpk= 0, nxpk= 0, iat= -1, 215, r1= 1.30, r2= 1.80, r3= 6.57, r4= 7.07,
igr1= 209, 210, 211,
&end
#
# 15 VAL QG2 55 CYX HB2 4.54
&rst
ixpk= 0, nxpk= 0, iat= -1, 782, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,
igr1= 209, 210, 211,
&end
#
# 15 VAL QG2 55 CYX HB2 4.54
&rst
ixpk= 0, nxpk= 0, iat= -1, 782, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,
igr1= 209, 210, 211,
&end
#
# 15 VAL QG2 55 CYX HB2 4.54
&rst
ixpk= 0, nxpk= 0, iat= -1, 782, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,
igr1= 209, 210, 211,
&end
#
# 15 VAL QG2 55 CYX HB3 4.82
&rst
ixpk= 0, nxpk= 0, iat= -1, 781, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,
igr1= 209, 210, 211,
&end
#
# 15 VAL QG2 55 CYX HB3 4.82
&rst
ixpk= 0, nxpk= 0, iat= -1, 781, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,
igr1= 209, 210, 211,
&end
#
# 15 VAL QG2 55 CYX HB3 4.82
&rst
ixpk= 0, nxpk= 0, iat= -1, 781, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,
igr1= 209, 210, 211,
&end
#
# 15 VAL QG2 56 GLN HA 5.22
&rst
ixpk= 0, nxpk= 0, iat= -1, 789, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
igr1= 209, 210, 211,
&end
#
# 15 VAL QG2 56 GLN HA 5.22
&rst
ixpk= 0, nxpk= 0, iat= -1, 789, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
igr1= 209, 210, 211,
&end
#
# 15 VAL QG2 56 GLN HA 5.22
&rst
ixpk= 0, nxpk= 0, iat= -1, 789, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
igr1= 209, 210, 211,
&end
#
# 15 VAL QG2 56 GLN HNE1 4.40
&rst
ixpk= 0, nxpk= 0, iat= -1, 799, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
igr1= 209, 210, 211,
&end
#
# 15 VAL QG2 56 GLN HNE1 4.40
&rst
ixpk= 0, nxpk= 0, iat= -1, 799, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
igr1= 209, 210, 211,
&end
#
# 15 VAL QG2 56 GLN HNE1 4.40
&rst
ixpk= 0, nxpk= 0, iat= -1, 799, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
igr1= 209, 210, 211,
&end
#
# 15 VAL QG2 56 GLN HNE2 4.44
&rst
ixpk= 0, nxpk= 0, iat= -1, 800, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
igr1= 209, 210, 211,
&end
#
# 15 VAL QG2 56 GLN HNE2 4.44
&rst
ixpk= 0, nxpk= 0, iat= -1, 800, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
igr1= 209, 210, 211,
&end
#
# 15 VAL QG2 56 GLN HNE2 4.44
&rst
ixpk= 0, nxpk= 0, iat= -1, 800, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
igr1= 209, 210, 211,
&end
#
# 16 GLY HN 16 GLY HA2 3.95
&rst
ixpk= 0, nxpk= 0, iat= 215, 217, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45, &end
#
# 16 GLY HN 16 GLY HA3 4.14
&rst
ixpk= 0, nxpk= 0, iat= 215, 218, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64, &end
#
# 16 GLY HN 17 GLN HN 3.86
&rst
ixpk= 0, nxpk= 0, iat= 215, 222, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 16 GLY HN 17 GLN HN 3.86
&rst
ixpk= 0, nxpk= 0, iat= 215, 222, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 16 GLY HN 17 GLN HN 3.86
&rst
ixpk= 0, nxpk= 0, iat= 215, 222, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 16 GLY HA2 17 GLN HN 3.72
&rst
ixpk= 0, nxpk= 0, iat= 217, 222, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22, &end
#
# 16 GLY HA2 17 GLN HN 3.72
&rst
ixpk= 0, nxpk= 0, iat= 217, 222, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22, &end
#
# 16 GLY HA2 17 GLN HN 3.72
&rst
ixpk= 0, nxpk= 0, iat= 217, 222, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22, &end
#
# 16 GLY HA2 17 GLN QB 5.79
&rst
ixpk= 0, nxpk= 0, iat= 217, -1, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
igr2= 226, 227,
&end
#
# 16 GLY HA2 17 GLN QB 5.79
&rst
ixpk= 0, nxpk= 0, iat= 217, -1, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
igr2= 226, 227,
&end
#
# 16 GLY HA2 17 GLN QB 5.79
&rst
ixpk= 0, nxpk= 0, iat= 217, -1, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
igr2= 226, 227,
&end
#
# 16 GLY HA3 16 GLY HA2 3.22
&rst
ixpk= 0, nxpk= 0, iat= 218, 217, r1= 1.30, r2= 1.80, r3= 3.22, r4= 3.72, &end
#
# 16 GLY HA3 17 GLN HN 3.44
&rst
ixpk= 0, nxpk= 0, iat= 218, 222, r1= 1.30, r2= 1.80, r3= 3.44, r4= 3.94, &end
#
# 16 GLY HA3 17 GLN HN 3.44
&rst
ixpk= 0, nxpk= 0, iat= 218, 222, r1= 1.30, r2= 1.80, r3= 3.44, r4= 3.94, &end
#
# 16 GLY HA3 17 GLN HN 3.44
&rst
ixpk= 0, nxpk= 0, iat= 218, 222, r1= 1.30, r2= 1.80, r3= 3.44, r4= 3.94, &end
#
# 16 GLY HA3 17 GLN QB 4.86
&rst
ixpk= 0, nxpk= 0, iat= 218, -1, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
igr2= 226, 227,
&end
#
# 16 GLY HA3 17 GLN QB 4.86
&rst
ixpk= 0, nxpk= 0, iat= 218, -1, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
igr2= 226, 227,
&end
#
# 16 GLY HA3 17 GLN QB 4.86
&rst
ixpk= 0, nxpk= 0, iat= 218, -1, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
igr2= 226, 227,
&end
#
# 17 GLN HN 17 GLN HA 4.11
&rst
ixpk= 0, nxpk= 0, iat= 222, 224, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 17 GLN HN 17 GLN HG2 5.33
&rst
ixpk= 0, nxpk= 0, iat= 222, 229, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83, &end
#
# 17 GLN HN 17 GLN HG2 5.33
&rst
ixpk= 0, nxpk= 0, iat= 222, 229, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83, &end
#
# 17 GLN HN 17 GLN HG2 5.33
&rst
ixpk= 0, nxpk= 0, iat= 222, 229, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83, &end
#
# 17 GLN HN 17 GLN HG3 4.07
&rst
ixpk= 0, nxpk= 0, iat= 222, 230, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57, &end
#
# 17 GLN HN 17 GLN HG3 4.07
&rst
ixpk= 0, nxpk= 0, iat= 222, 230, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57, &end
#
# 17 GLN HN 17 GLN HG3 4.07
&rst
ixpk= 0, nxpk= 0, iat= 222, 230, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57, &end
#
# 17 GLN HN 17 GLN QB 3.44
&rst
ixpk= 0, nxpk= 0, iat= 222, -1, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,
igr2= 226, 227,
&end
#
# 17 GLN HN 17 GLN QB 3.44
&rst
ixpk= 0, nxpk= 0, iat= 222, -1, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,
igr2= 226, 227,
&end
#
# 17 GLN HN 17 GLN QB 3.44
&rst
ixpk= 0, nxpk= 0, iat= 222, -1, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36,
igr2= 226, 227,
&end
#
# 17 GLN HA 17 GLN HNE1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 224, 234, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 17 GLN HA 17 GLN HNE1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 224, 234, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 17 GLN HA 17 GLN HNE1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 224, 234, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 17 GLN HA 17 GLN HG2 5.05
&rst
ixpk= 0, nxpk= 0, iat= 224, 229, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55, &end
#
# 17 GLN HA 17 GLN HG3 4.95
&rst
ixpk= 0, nxpk= 0, iat= 224, 230, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45, &end
#
# 17 GLN HA 17 GLN QB 3.39
&rst
ixpk= 0, nxpk= 0, iat= 224, -1, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,
igr2= 226, 227,
&end
#
# 17 GLN HA 18 SER HN 2.82
&rst
ixpk= 0, nxpk= 0, iat= 224, 239, r1= 1.30, r2= 1.80, r3= 2.82, r4= 3.32, &end
#
# 17 GLN HA 18 SER HN 2.82
&rst
ixpk= 0, nxpk= 0, iat= 224, 239, r1= 1.30, r2= 1.80, r3= 2.82, r4= 3.32, &end
#
# 17 GLN HA 18 SER HN 2.82
&rst
ixpk= 0, nxpk= 0, iat= 224, 239, r1= 1.30, r2= 1.80, r3= 2.82, r4= 3.32, &end
#
# 17 GLN HA 18 SER HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 224, 241, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 17 GLN HA 18 SER HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 224, 241, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 17 GLN HA 18 SER HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 224, 241, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 17 GLN HA 18 SER HB3 4.80
&rst
ixpk= 0, nxpk= 0, iat= 224, 244, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30, &end
#
# 17 GLN HA 18 SER HB3 4.80
&rst
ixpk= 0, nxpk= 0, iat= 224, 244, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30, &end
#
# 17 GLN HA 18 SER HB3 4.80
&rst
ixpk= 0, nxpk= 0, iat= 224, 244, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30, &end
#
# 17 GLN HNE1 17 GLN HNE2 2.64
&rst
ixpk= 0, nxpk= 0, iat= 234, 235, r1= 1.30, r2= 1.80, r3= 2.64, r4= 3.14, &end
#
# 17 GLN HNE1 18 SER HA 5.78
&rst
ixpk= 0, nxpk= 0, iat= 234, 241, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28, &end
#
# 17 GLN HNE1 18 SER HA 5.78
&rst
ixpk= 0, nxpk= 0, iat= 234, 241, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28, &end
#
# 17 GLN HNE1 18 SER HA 5.78
&rst
ixpk= 0, nxpk= 0, iat= 234, 241, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28, &end
#
# 17 GLN HNE2 19 ILE QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 235, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 256, 257, 258,
&end
#
# 17 GLN HNE2 19 ILE QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 235, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 256, 257, 258,
&end
#
# 17 GLN HNE2 19 ILE QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 235, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 256, 257, 258,
&end
#
# 17 GLN HG2 17 GLN HNE1 5.14
&rst
ixpk= 0, nxpk= 0, iat= 229, 234, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64, &end
#
# 17 GLN HG2 17 GLN HNE2 4.97
&rst
ixpk= 0, nxpk= 0, iat= 229, 235, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 17 GLN HG3 17 GLN HNE1 5.36
&rst
ixpk= 0, nxpk= 0, iat= 230, 234, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86, &end
#
# 17 GLN HG3 17 GLN HNE2 5.84
&rst
ixpk= 0, nxpk= 0, iat= 230, 235, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34, &end
#
# 17 GLN HG3 17 GLN HG2 3.01
&rst
ixpk= 0, nxpk= 0, iat= 230, 229, r1= 1.30, r2= 1.80, r3= 3.01, r4= 3.51, &end
#
# 17 GLN HG3 18 SER HN 5.30
&rst
ixpk= 0, nxpk= 0, iat= 230, 239, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80, &end
#
# 17 GLN HG3 18 SER HN 5.30
&rst
ixpk= 0, nxpk= 0, iat= 230, 239, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80, &end
#
# 17 GLN HG3 18 SER HN 5.30
&rst
ixpk= 0, nxpk= 0, iat= 230, 239, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80, &end
#
# 17 GLN QB 17 GLN HNE1 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 234, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 226, 227,
&end
#
# 17 GLN QB 17 GLN HNE1 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 234, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 226, 227,
&end
#
# 17 GLN QB 17 GLN HNE1 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 234, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 226, 227,
&end
#
# 17 GLN QB 17 GLN HG3 3.60
&rst
ixpk= 0, nxpk= 0, iat= -1, 230, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
igr1= 226, 227,
&end
#
# 17 GLN QB 18 SER HN 3.82
&rst
ixpk= 0, nxpk= 0, iat= -1, 239, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,
igr1= 226, 227,
&end
#
# 17 GLN QB 18 SER HN 3.82
&rst
ixpk= 0, nxpk= 0, iat= -1, 239, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,
igr1= 226, 227,
&end
#
# 17 GLN QB 18 SER HN 3.82
&rst
ixpk= 0, nxpk= 0, iat= -1, 239, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79,
igr1= 226, 227,
&end
#
# 17 GLN QB 18 SER HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 241, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 226, 227,
&end
#
# 17 GLN QB 18 SER HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 241, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 226, 227,
&end
#
# 17 GLN QB 18 SER HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 241, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 226, 227,
&end
#
# 17 GLN QB 18 SER HB3 5.97
&rst
ixpk= 0, nxpk= 0, iat= -1, 244, r1= 1.30, r2= 1.80, r3= 6.70, r4= 7.20,
igr1= 226, 227,
&end
#
# 17 GLN QB 18 SER HB3 5.97
&rst
ixpk= 0, nxpk= 0, iat= -1, 244, r1= 1.30, r2= 1.80, r3= 6.70, r4= 7.20,
igr1= 226, 227,
&end
#
# 17 GLN QB 18 SER HB3 5.97
&rst
ixpk= 0, nxpk= 0, iat= -1, 244, r1= 1.30, r2= 1.80, r3= 6.70, r4= 7.20,
igr1= 226, 227,
&end
#
# 18 SER HN 18 SER HA 4.24
&rst
ixpk= 0, nxpk= 0, iat= 239, 241, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74, &end
#
# 18 SER HN 18 SER HB2 3.59
&rst
ixpk= 0, nxpk= 0, iat= 239, 243, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09, &end
#
# 18 SER HN 18 SER HB2 3.59
&rst
ixpk= 0, nxpk= 0, iat= 239, 243, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09, &end
#
# 18 SER HN 18 SER HB2 3.59
&rst
ixpk= 0, nxpk= 0, iat= 239, 243, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09, &end
#
# 18 SER HN 18 SER HB3 3.61
&rst
ixpk= 0, nxpk= 0, iat= 239, 244, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11, &end
#
# 18 SER HN 18 SER HB3 3.61
&rst
ixpk= 0, nxpk= 0, iat= 239, 244, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11, &end
#
# 18 SER HN 18 SER HB3 3.61
&rst
ixpk= 0, nxpk= 0, iat= 239, 244, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11, &end
#
# 18 SER HA 18 SER HB2 4.26
&rst
ixpk= 0, nxpk= 0, iat= 241, 243, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76, &end
#
# 18 SER HA 18 SER HB3 4.39
&rst
ixpk= 0, nxpk= 0, iat= 241, 244, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89, &end
#
# 18 SER HA 19 ILE HN 3.70
&rst
ixpk= 0, nxpk= 0, iat= 241, 250, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20, &end
#
# 18 SER HA 19 ILE HN 3.70
&rst
ixpk= 0, nxpk= 0, iat= 241, 250, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20, &end
#
# 18 SER HA 19 ILE HN 3.70
&rst
ixpk= 0, nxpk= 0, iat= 241, 250, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20, &end
#
# 18 SER HA 19 ILE HB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 241, 254, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 18 SER HA 19 ILE HB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 241, 254, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 18 SER HA 19 ILE HB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 241, 254, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 18 SER HA 19 ILE QG2 5.69
&rst
ixpk= 0, nxpk= 0, iat= 241, -1, r1= 1.30, r2= 1.80, r3= 6.83, r4= 7.33,
igr2= 256, 257, 258,
&end
#
# 18 SER HA 19 ILE QG2 5.69
&rst
ixpk= 0, nxpk= 0, iat= 241, -1, r1= 1.30, r2= 1.80, r3= 6.83, r4= 7.33,
igr2= 256, 257, 258,
&end
#
# 18 SER HA 19 ILE QG2 5.69
&rst
ixpk= 0, nxpk= 0, iat= 241, -1, r1= 1.30, r2= 1.80, r3= 6.83, r4= 7.33,
igr2= 256, 257, 258,
&end
#
# 18 SER HA 20 GLY HN 4.92
&rst
ixpk= 0, nxpk= 0, iat= 241, 269, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42, &end
#
# 18 SER HA 20 GLY HN 4.92
&rst
ixpk= 0, nxpk= 0, iat= 241, 269, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42, &end
#
# 18 SER HA 20 GLY HN 4.92
&rst
ixpk= 0, nxpk= 0, iat= 241, 269, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42, &end
#
# 18 SER HB2 18 SER HB3 3.34
&rst
ixpk= 0, nxpk= 0, iat= 243, 244, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84, &end
#
# 18 SER HB2 19 ILE HN 5.25
&rst
ixpk= 0, nxpk= 0, iat= 243, 250, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75, &end
#
# 18 SER HB2 19 ILE HN 5.25
&rst
ixpk= 0, nxpk= 0, iat= 243, 250, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75, &end
#
# 18 SER HB2 19 ILE HN 5.25
&rst
ixpk= 0, nxpk= 0, iat= 243, 250, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75, &end
#
# 18 SER HB2 20 GLY HN 5.49
&rst
ixpk= 0, nxpk= 0, iat= 243, 269, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99, &end
#
# 18 SER HB2 20 GLY HN 5.49
&rst
ixpk= 0, nxpk= 0, iat= 243, 269, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99, &end
#
# 18 SER HB2 20 GLY HN 5.49
&rst
ixpk= 0, nxpk= 0, iat= 243, 269, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99, &end
#
# 18 SER HB3 19 ILE HN 4.60
&rst
ixpk= 0, nxpk= 0, iat= 244, 250, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 18 SER HB3 19 ILE HN 4.60
&rst
ixpk= 0, nxpk= 0, iat= 244, 250, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 18 SER HB3 19 ILE HN 4.60
&rst
ixpk= 0, nxpk= 0, iat= 244, 250, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 19 ILE HN 19 ILE HA 4.84
&rst
ixpk= 0, nxpk= 0, iat= 250, 252, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34, &end
#
# 19 ILE HN 19 ILE HB 5.26
&rst
ixpk= 0, nxpk= 0, iat= 250, 254, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76, &end
#
# 19 ILE HN 19 ILE HG12 4.70
&rst
ixpk= 0, nxpk= 0, iat= 250, 260, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 19 ILE HN 19 ILE HG12 4.70
&rst
ixpk= 0, nxpk= 0, iat= 250, 260, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 19 ILE HN 19 ILE HG12 4.70
&rst
ixpk= 0, nxpk= 0, iat= 250, 260, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 19 ILE HN 19 ILE HG13 4.09
&rst
ixpk= 0, nxpk= 0, iat= 250, 261, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59, &end
#
# 19 ILE HN 19 ILE HG13 4.09
&rst
ixpk= 0, nxpk= 0, iat= 250, 261, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59, &end
#
# 19 ILE HN 19 ILE HG13 4.09
&rst
ixpk= 0, nxpk= 0, iat= 250, 261, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59, &end
#
# 19 ILE HN 19 ILE QD1 4.57
&rst
ixpk= 0, nxpk= 0, iat= 250, -1, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
igr2= 263, 264, 265,
&end
#
# 19 ILE HN 19 ILE QD1 4.57
&rst
ixpk= 0, nxpk= 0, iat= 250, -1, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
igr2= 263, 264, 265,
&end
#
# 19 ILE HN 19 ILE QD1 4.57
&rst
ixpk= 0, nxpk= 0, iat= 250, -1, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
igr2= 263, 264, 265,
&end
#
# 19 ILE HN 19 ILE QG2 4.41
&rst
ixpk= 0, nxpk= 0, iat= 250, -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr2= 256, 257, 258,
&end
#
# 19 ILE HN 19 ILE QG2 4.41
&rst
ixpk= 0, nxpk= 0, iat= 250, -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr2= 256, 257, 258,
&end
#
# 19 ILE HN 19 ILE QG2 4.41
&rst
ixpk= 0, nxpk= 0, iat= 250, -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr2= 256, 257, 258,
&end
#
# 19 ILE HN 20 GLY HN 3.71
&rst
ixpk= 0, nxpk= 0, iat= 250, 269, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21, &end
#
# 19 ILE HN 20 GLY HN 3.71
&rst
ixpk= 0, nxpk= 0, iat= 250, 269, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21, &end
#
# 19 ILE HN 20 GLY HN 3.71
&rst
ixpk= 0, nxpk= 0, iat= 250, 269, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21, &end
#
# 19 ILE HA 19 ILE HB 3.67
&rst
ixpk= 0, nxpk= 0, iat= 252, 254, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17, &end
#
# 19 ILE HA 19 ILE HG12 3.95
&rst
ixpk= 0, nxpk= 0, iat= 252, 260, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45, &end
#
# 19 ILE HA 19 ILE HG12 3.95
&rst
ixpk= 0, nxpk= 0, iat= 252, 260, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45, &end
#
# 19 ILE HA 19 ILE HG12 3.95
&rst
ixpk= 0, nxpk= 0, iat= 252, 260, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45, &end
#
# 19 ILE HA 19 ILE QD1 5.14
&rst
ixpk= 0, nxpk= 0, iat= 252, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 263, 264, 265,
&end
#
# 19 ILE HA 19 ILE QD1 5.14
&rst
ixpk= 0, nxpk= 0, iat= 252, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 263, 264, 265,
&end
#
# 19 ILE HA 19 ILE QD1 5.14
&rst
ixpk= 0, nxpk= 0, iat= 252, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 263, 264, 265,
&end
#
# 19 ILE HA 19 ILE QG2 4.04
&rst
ixpk= 0, nxpk= 0, iat= 252, -1, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
igr2= 256, 257, 258,
&end
#
# 19 ILE HA 19 ILE QG2 4.04
&rst
ixpk= 0, nxpk= 0, iat= 252, -1, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
igr2= 256, 257, 258,
&end
#
# 19 ILE HA 19 ILE QG2 4.04
&rst
ixpk= 0, nxpk= 0, iat= 252, -1, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
igr2= 256, 257, 258,
&end
#
# 19 ILE HA 20 GLY HN 4.59
&rst
ixpk= 0, nxpk= 0, iat= 252, 269, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 19 ILE HB 19 ILE HG12 4.20
&rst
ixpk= 0, nxpk= 0, iat= 254, 260, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 19 ILE HB 19 ILE HG13 4.28
&rst
ixpk= 0, nxpk= 0, iat= 254, 261, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78, &end
#
# 19 ILE HB 19 ILE QD1 4.20
&rst
ixpk= 0, nxpk= 0, iat= 254, -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr2= 263, 264, 265,
&end
#
# 19 ILE HB 19 ILE QD1 4.20
&rst
ixpk= 0, nxpk= 0, iat= 254, -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr2= 263, 264, 265,
&end
#
# 19 ILE HB 19 ILE QD1 4.20
&rst
ixpk= 0, nxpk= 0, iat= 254, -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr2= 263, 264, 265,
&end
#
# 19 ILE HB 20 GLY HN 5.28
&rst
ixpk= 0, nxpk= 0, iat= 254, 269, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 19 ILE HB 20 GLY HN 5.28
&rst
ixpk= 0, nxpk= 0, iat= 254, 269, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 19 ILE HB 20 GLY HN 5.28
&rst
ixpk= 0, nxpk= 0, iat= 254, 269, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 19 ILE HB 20 GLY HA2 5.55
&rst
ixpk= 0, nxpk= 0, iat= 254, 271, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05, &end
#
# 19 ILE HB 20 GLY HA2 5.55
&rst
ixpk= 0, nxpk= 0, iat= 254, 271, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05, &end
#
# 19 ILE HB 20 GLY HA2 5.55
&rst
ixpk= 0, nxpk= 0, iat= 254, 271, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05, &end
#
# 19 ILE HG12 19 ILE HG13 4.12
&rst
ixpk= 0, nxpk= 0, iat= 260, 261, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62, &end
#
# 19 ILE HG12 20 GLY HN 4.97
&rst
ixpk= 0, nxpk= 0, iat= 260, 269, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 19 ILE HG12 20 GLY HN 4.97
&rst
ixpk= 0, nxpk= 0, iat= 260, 269, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 19 ILE HG12 20 GLY HN 4.97
&rst
ixpk= 0, nxpk= 0, iat= 260, 269, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 19 ILE HG12 38 LYS HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 260, 536, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 19 ILE HG12 38 LYS HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 260, 536, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 19 ILE HG12 38 LYS HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 260, 536, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 19 ILE HG13 19 ILE QD1 3.17
&rst
ixpk= 0, nxpk= 0, iat= 261, -1, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,
igr2= 263, 264, 265,
&end
#
# 19 ILE QD1 19 ILE HG12 4.63
&rst
ixpk= 0, nxpk= 0, iat= -1, 260, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
igr1= 263, 264, 265,
&end
#
# 19 ILE QD1 20 GLY HN 5.85
&rst
ixpk= 0, nxpk= 0, iat= -1, 269, r1= 1.30, r2= 1.80, r3= 7.03, r4= 7.53,
igr1= 263, 264, 265,
&end
#
# 19 ILE QD1 20 GLY HN 5.85
&rst
ixpk= 0, nxpk= 0, iat= -1, 269, r1= 1.30, r2= 1.80, r3= 7.03, r4= 7.53,
igr1= 263, 264, 265,
&end
#
# 19 ILE QD1 20 GLY HN 5.85
&rst
ixpk= 0, nxpk= 0, iat= -1, 269, r1= 1.30, r2= 1.80, r3= 7.03, r4= 7.53,
igr1= 263, 264, 265,
&end
#
# 19 ILE QD1 20 GLY HA2 5.46
&rst
ixpk= 0, nxpk= 0, iat= -1, 271, r1= 1.30, r2= 1.80, r3= 6.56, r4= 7.06,
igr1= 263, 264, 265,
&end
#
# 19 ILE QD1 20 GLY HA2 5.46
&rst
ixpk= 0, nxpk= 0, iat= -1, 271, r1= 1.30, r2= 1.80, r3= 6.56, r4= 7.06,
igr1= 263, 264, 265,
&end
#
# 19 ILE QD1 20 GLY HA2 5.46
&rst
ixpk= 0, nxpk= 0, iat= -1, 271, r1= 1.30, r2= 1.80, r3= 6.56, r4= 7.06,
igr1= 263, 264, 265,
&end
#
# 19 ILE QD1 38 LYS HN 5.27
&rst
ixpk= 0, nxpk= 0, iat= -1, 536, r1= 1.30, r2= 1.80, r3= 6.33, r4= 6.83,
igr1= 263, 264, 265,
&end
#
# 19 ILE QD1 38 LYS HN 5.27
&rst
ixpk= 0, nxpk= 0, iat= -1, 536, r1= 1.30, r2= 1.80, r3= 6.33, r4= 6.83,
igr1= 263, 264, 265,
&end
#
# 19 ILE QD1 38 LYS HN 5.27
&rst
ixpk= 0, nxpk= 0, iat= -1, 536, r1= 1.30, r2= 1.80, r3= 6.33, r4= 6.83,
igr1= 263, 264, 265,
&end
#
# 19 ILE QG2 19 ILE HB 3.73
&rst
ixpk= 0, nxpk= 0, iat= -1, 254, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
igr1= 256, 257, 258,
&end
#
# 19 ILE QG2 19 ILE HG13 3.97
&rst
ixpk= 0, nxpk= 0, iat= -1, 261, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
igr1= 256, 257, 258,
&end
#
# 19 ILE QG2 19 ILE HG13 3.97
&rst
ixpk= 0, nxpk= 0, iat= -1, 261, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
igr1= 256, 257, 258,
&end
#
# 19 ILE QG2 19 ILE HG13 3.97
&rst
ixpk= 0, nxpk= 0, iat= -1, 261, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
igr1= 256, 257, 258,
&end
#
# 19 ILE QG2 19 ILE QD1 3.74
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr1= 256, 257, 258,
igr2= 263, 264, 265,
&end
#
# 19 ILE QG2 19 ILE QD1 3.74
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr1= 256, 257, 258,
igr2= 263, 264, 265,
&end
#
# 19 ILE QG2 19 ILE QD1 3.74
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr1= 256, 257, 258,
igr2= 263, 264, 265,
&end
#
# 19 ILE QG2 20 GLY HN 5.51
&rst
ixpk= 0, nxpk= 0, iat= -1, 269, r1= 1.30, r2= 1.80, r3= 6.62, r4= 7.12,
igr1= 256, 257, 258,
&end
#
# 19 ILE QG2 20 GLY HN 5.51
&rst
ixpk= 0, nxpk= 0, iat= -1, 269, r1= 1.30, r2= 1.80, r3= 6.62, r4= 7.12,
igr1= 256, 257, 258,
&end
#
# 19 ILE QG2 20 GLY HN 5.51
&rst
ixpk= 0, nxpk= 0, iat= -1, 269, r1= 1.30, r2= 1.80, r3= 6.62, r4= 7.12,
igr1= 256, 257, 258,
&end
#
# 20 GLY HN 20 GLY HA2 3.97
&rst
ixpk= 0, nxpk= 0, iat= 269, 271, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47, &end
#
# 20 GLY HN 20 GLY HA3 3.70
&rst
ixpk= 0, nxpk= 0, iat= 269, 272, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20, &end
#
# 20 GLY HN 21 THR HN 5.28
&rst
ixpk= 0, nxpk= 0, iat= 269, 276, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 20 GLY HN 37 LEU QD2 4.72
&rst
ixpk= 0, nxpk= 0, iat= 269, -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
igr2= 530, 531, 532,
&end
#
# 20 GLY HN 37 LEU QD2 4.72
&rst
ixpk= 0, nxpk= 0, iat= 269, -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
igr2= 530, 531, 532,
&end
#
# 20 GLY HN 37 LEU QD2 4.72
&rst
ixpk= 0, nxpk= 0, iat= 269, -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
igr2= 530, 531, 532,
&end
#
# 20 GLY HA2 21 THR HN 2.97
&rst
ixpk= 0, nxpk= 0, iat= 271, 276, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 20 GLY HA2 21 THR HN 3.58
&rst
ixpk= 0, nxpk= 0, iat= 271, 276, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08, &end
#
# 20 GLY HA2 21 THR HN 3.58
&rst
ixpk= 0, nxpk= 0, iat= 271, 276, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08, &end
#
# 20 GLY HA2 21 THR HN 3.58
&rst
ixpk= 0, nxpk= 0, iat= 271, 276, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08, &end
#
# 20 GLY HA2 21 THR QG2 5.65
&rst
ixpk= 0, nxpk= 0, iat= 271, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2= 282, 283, 284,
&end
#
# 20 GLY HA2 21 THR QG2 5.65
&rst
ixpk= 0, nxpk= 0, iat= 271, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2= 282, 283, 284,
&end
#
# 20 GLY HA2 21 THR QG2 5.65
&rst
ixpk= 0, nxpk= 0, iat= 271, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2= 282, 283, 284,
&end
#
# 20 GLY HA2 36 HID HD2 6.50
&rst
ixpk= 0, nxpk= 0, iat= 271, 513, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00, &end
#
# 20 GLY HA2 36 HID HE1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 271, 510, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 20 GLY HA2 36 HID HE1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 271, 510, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 20 GLY HA2 36 HID HE1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 271, 510, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 20 GLY HA2 37 LEU HB3 4.91
&rst
ixpk= 0, nxpk= 0, iat= 271, 522, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41, &end
#
# 20 GLY HA2 37 LEU HB3 4.91
&rst
ixpk= 0, nxpk= 0, iat= 271, 522, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41, &end
#
# 20 GLY HA2 37 LEU HB3 4.91
&rst
ixpk= 0, nxpk= 0, iat= 271, 522, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41, &end
#
# 20 GLY HA2 37 LEU HG 5.80
&rst
ixpk= 0, nxpk= 0, iat= 271, 524, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30, &end
#
# 20 GLY HA2 37 LEU HG 5.80
&rst
ixpk= 0, nxpk= 0, iat= 271, 524, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30, &end
#
# 20 GLY HA2 37 LEU HG 5.80
&rst
ixpk= 0, nxpk= 0, iat= 271, 524, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30, &end
#
# 20 GLY HA2 37 LEU QD1 5.35
&rst
ixpk= 0, nxpk= 0, iat= 271, -1, r1= 1.30, r2= 1.80, r3= 6.43, r4= 6.93,
igr2= 526, 527, 528,
&end
#
# 20 GLY HA2 37 LEU QD1 5.35
&rst
ixpk= 0, nxpk= 0, iat= 271, -1, r1= 1.30, r2= 1.80, r3= 6.43, r4= 6.93,
igr2= 526, 527, 528,
&end
#
# 20 GLY HA2 37 LEU QD1 5.35
&rst
ixpk= 0, nxpk= 0, iat= 271, -1, r1= 1.30, r2= 1.80, r3= 6.43, r4= 6.93,
igr2= 526, 527, 528,
&end
#
# 20 GLY HA2 37 LEU QD2 3.84
&rst
ixpk= 0, nxpk= 0, iat= 271, -1, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
igr2= 530, 531, 532,
&end
#
# 20 GLY HA2 37 LEU QD2 3.84
&rst
ixpk= 0, nxpk= 0, iat= 271, -1, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
igr2= 530, 531, 532,
&end
#
# 20 GLY HA2 37 LEU QD2 3.84
&rst
ixpk= 0, nxpk= 0, iat= 271, -1, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
igr2= 530, 531, 532,
&end
#
# 20 GLY HA2 38 LYS QE 6.05
&rst
ixpk= 0, nxpk= 0, iat= 271, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2= 549, 550,
&end
#
# 20 GLY HA2 38 LYS QE 6.05
&rst
ixpk= 0, nxpk= 0, iat= 271, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2= 549, 550,
&end
#
# 20 GLY HA2 38 LYS QE 6.05
&rst
ixpk= 0, nxpk= 0, iat= 271, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2= 549, 550,
&end
#
# 20 GLY HA3 20 GLY HA2 3.73
&rst
ixpk= 0, nxpk= 0, iat= 272, 271, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23, &end
#
# 20 GLY HA3 21 THR HN 3.64
&rst
ixpk= 0, nxpk= 0, iat= 272, 276, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14, &end
#
# 20 GLY HA3 21 THR HN 3.64
&rst
ixpk= 0, nxpk= 0, iat= 272, 276, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14, &end
#
# 20 GLY HA3 21 THR HN 3.64
&rst
ixpk= 0, nxpk= 0, iat= 272, 276, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14, &end
#
# 20 GLY HA3 21 THR QG2 5.73
&rst
ixpk= 0, nxpk= 0, iat= 272, -1, r1= 1.30, r2= 1.80, r3= 6.88, r4= 7.38,
igr2= 282, 283, 284,
&end
#
# 20 GLY HA3 21 THR QG2 5.73
&rst
ixpk= 0, nxpk= 0, iat= 272, -1, r1= 1.30, r2= 1.80, r3= 6.88, r4= 7.38,
igr2= 282, 283, 284,
&end
#
# 20 GLY HA3 21 THR QG2 5.73
&rst
ixpk= 0, nxpk= 0, iat= 272, -1, r1= 1.30, r2= 1.80, r3= 6.88, r4= 7.38,
igr2= 282, 283, 284,
&end
#
# 20 GLY HA3 37 LEU HA 5.16
&rst
ixpk= 0, nxpk= 0, iat= 272, 519, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66, &end
#
# 20 GLY HA3 37 LEU HA 5.16
&rst
ixpk= 0, nxpk= 0, iat= 272, 519, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66, &end
#
# 20 GLY HA3 37 LEU HA 5.16
&rst
ixpk= 0, nxpk= 0, iat= 272, 519, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66, &end
#
# 20 GLY HA3 37 LEU HG 6.05
&rst
ixpk= 0, nxpk= 0, iat= 272, 524, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 20 GLY HA3 37 LEU HG 6.05
&rst
ixpk= 0, nxpk= 0, iat= 272, 524, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 20 GLY HA3 37 LEU HG 6.05
&rst
ixpk= 0, nxpk= 0, iat= 272, 524, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 20 GLY HA3 37 LEU QD2 4.76
&rst
ixpk= 0, nxpk= 0, iat= 272, -1, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
igr2= 530, 531, 532,
&end
#
# 20 GLY HA3 37 LEU QD2 4.76
&rst
ixpk= 0, nxpk= 0, iat= 272, -1, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
igr2= 530, 531, 532,
&end
#
# 20 GLY HA3 37 LEU QD2 4.76
&rst
ixpk= 0, nxpk= 0, iat= 272, -1, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
igr2= 530, 531, 532,
&end
#
# 20 GLY HA3 38 LYS HN 5.73
&rst
ixpk= 0, nxpk= 0, iat= 272, 536, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23, &end
#
# 20 GLY HA3 38 LYS HN 5.73
&rst
ixpk= 0, nxpk= 0, iat= 272, 536, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23, &end
#
# 20 GLY HA3 38 LYS HN 5.73
&rst
ixpk= 0, nxpk= 0, iat= 272, 536, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23, &end
#
# 20 GLY HA3 38 LYS QE 5.91
&rst
ixpk= 0, nxpk= 0, iat= 272, -1, r1= 1.30, r2= 1.80, r3= 6.63, r4= 7.13,
igr2= 549, 550,
&end
#
# 20 GLY HA3 38 LYS QE 5.91
&rst
ixpk= 0, nxpk= 0, iat= 272, -1, r1= 1.30, r2= 1.80, r3= 6.63, r4= 7.13,
igr2= 549, 550,
&end
#
# 20 GLY HA3 38 LYS QE 5.91
&rst
ixpk= 0, nxpk= 0, iat= 272, -1, r1= 1.30, r2= 1.80, r3= 6.63, r4= 7.13,
igr2= 549, 550,
&end
#
# 21 THR HN 21 THR HA 4.24
&rst
ixpk= 0, nxpk= 0, iat= 276, 278, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74, &end
#
# 21 THR HN 21 THR HB 5.18
&rst
ixpk= 0, nxpk= 0, iat= 276, 280, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68, &end
#
# 21 THR HN 21 THR QG2 4.73
&rst
ixpk= 0, nxpk= 0, iat= 276, -1, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
igr2= 282, 283, 284,
&end
#
# 21 THR HN 21 THR QG2 4.73
&rst
ixpk= 0, nxpk= 0, iat= 276, -1, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
igr2= 282, 283, 284,
&end
#
# 21 THR HN 21 THR QG2 4.73
&rst
ixpk= 0, nxpk= 0, iat= 276, -1, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
igr2= 282, 283, 284,
&end
#
# 21 THR HN 22 VAL HN 5.28
&rst
ixpk= 0, nxpk= 0, iat= 276, 290, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 21 THR HN 22 VAL HN 5.33
&rst
ixpk= 0, nxpk= 0, iat= 276, 290, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83, &end
#
# 21 THR HN 22 VAL HN 5.33
&rst
ixpk= 0, nxpk= 0, iat= 276, 290, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83, &end
#
# 21 THR HN 22 VAL HN 5.33
&rst
ixpk= 0, nxpk= 0, iat= 276, 290, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83, &end
#
# 21 THR HN 22 VAL QQG 6.05
&rst
ixpk= 0, nxpk= 0, iat= 276, -1, r1= 1.30, r2= 1.80, r3= 8.16, r4= 8.66,
igr2= 296, 297, 298, 300, 301, 302,
&end
#
# 21 THR HN 22 VAL QQG 6.05
&rst
ixpk= 0, nxpk= 0, iat= 276, -1, r1= 1.30, r2= 1.80, r3= 8.16, r4= 8.66,
igr2= 296, 297, 298, 300, 301, 302,
&end
#
# 21 THR HN 22 VAL QQG 6.05
&rst
ixpk= 0, nxpk= 0, iat= 276, -1, r1= 1.30, r2= 1.80, r3= 8.16, r4= 8.66,
igr2= 296, 297, 298, 300, 301, 302,
&end
#
# 21 THR HN 36 HID HE1 4.47
&rst
ixpk= 0, nxpk= 0, iat= 276, 510, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97, &end
#
# 21 THR HN 36 HID HE1 4.47
&rst
ixpk= 0, nxpk= 0, iat= 276, 510, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97, &end
#
# 21 THR HN 36 HID HE1 4.47
&rst
ixpk= 0, nxpk= 0, iat= 276, 510, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97, &end
#
# 21 THR HN 37 LEU HG 5.68
&rst
ixpk= 0, nxpk= 0, iat= 276, 524, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18, &end
#
# 21 THR HN 37 LEU HG 5.68
&rst
ixpk= 0, nxpk= 0, iat= 276, 524, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18, &end
#
# 21 THR HN 37 LEU HG 5.68
&rst
ixpk= 0, nxpk= 0, iat= 276, 524, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18, &end
#
# 21 THR HN 37 LEU QD2 4.35
&rst
ixpk= 0, nxpk= 0, iat= 276, -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
igr2= 530, 531, 532,
&end
#
# 21 THR HN 37 LEU QD2 4.35
&rst
ixpk= 0, nxpk= 0, iat= 276, -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
igr2= 530, 531, 532,
&end
#
# 21 THR HN 37 LEU QD2 4.35
&rst
ixpk= 0, nxpk= 0, iat= 276, -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
igr2= 530, 531, 532,
&end
#
# 21 THR HA 21 THR HB 4.11
&rst
ixpk= 0, nxpk= 0, iat= 278, 280, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 21 THR HA 21 THR QG2 3.92
&rst
ixpk= 0, nxpk= 0, iat= 278, -1, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
igr2= 282, 283, 284,
&end
#
# 21 THR HA 21 THR QG2 3.92
&rst
ixpk= 0, nxpk= 0, iat= 278, -1, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
igr2= 282, 283, 284,
&end
#
# 21 THR HA 21 THR QG2 3.92
&rst
ixpk= 0, nxpk= 0, iat= 278, -1, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
igr2= 282, 283, 284,
&end
#
# 21 THR HA 22 VAL HN 2.97
&rst
ixpk= 0, nxpk= 0, iat= 278, 290, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 21 THR HA 22 VAL HN 3.40
&rst
ixpk= 0, nxpk= 0, iat= 278, 290, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90, &end
#
# 21 THR HA 22 VAL HN 3.40
&rst
ixpk= 0, nxpk= 0, iat= 278, 290, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90, &end
#
# 21 THR HA 22 VAL HN 3.40
&rst
ixpk= 0, nxpk= 0, iat= 278, 290, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90, &end
#
# 21 THR HA 22 VAL HB 6.03
&rst
ixpk= 0, nxpk= 0, iat= 278, 294, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53, &end
#
# 21 THR HA 22 VAL HB 6.03
&rst
ixpk= 0, nxpk= 0, iat= 278, 294, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53, &end
#
# 21 THR HA 22 VAL HB 6.03
&rst
ixpk= 0, nxpk= 0, iat= 278, 294, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53, &end
#
# 21 THR HA 22 VAL QQG 4.70
&rst
ixpk= 0, nxpk= 0, iat= 278, -1, r1= 1.30, r2= 1.80, r3= 6.34, r4= 6.84,
igr2= 296, 297, 298, 300, 301, 302,
&end
#
# 21 THR HA 22 VAL QQG 4.70
&rst
ixpk= 0, nxpk= 0, iat= 278, -1, r1= 1.30, r2= 1.80, r3= 6.34, r4= 6.84,
igr2= 296, 297, 298, 300, 301, 302,
&end
#
# 21 THR HA 22 VAL QQG 4.70
&rst
ixpk= 0, nxpk= 0, iat= 278, -1, r1= 1.30, r2= 1.80, r3= 6.34, r4= 6.84,
igr2= 296, 297, 298, 300, 301, 302,
&end
#
# 21 THR HA 37 LEU QD1 5.98
&rst
ixpk= 0, nxpk= 0, iat= 278, -1, r1= 1.30, r2= 1.80, r3= 7.18, r4= 7.68,
igr2= 526, 527, 528,
&end
#
# 21 THR HA 37 LEU QD1 5.98
&rst
ixpk= 0, nxpk= 0, iat= 278, -1, r1= 1.30, r2= 1.80, r3= 7.18, r4= 7.68,
igr2= 526, 527, 528,
&end
#
# 21 THR HA 37 LEU QD1 5.98
&rst
ixpk= 0, nxpk= 0, iat= 278, -1, r1= 1.30, r2= 1.80, r3= 7.18, r4= 7.68,
igr2= 526, 527, 528,
&end
#
# 21 THR HA 37 LEU QD2 5.31
&rst
ixpk= 0, nxpk= 0, iat= 278, -1, r1= 1.30, r2= 1.80, r3= 6.38, r4= 6.88,
igr2= 530, 531, 532,
&end
#
# 21 THR HA 37 LEU QD2 5.31
&rst
ixpk= 0, nxpk= 0, iat= 278, -1, r1= 1.30, r2= 1.80, r3= 6.38, r4= 6.88,
igr2= 530, 531, 532,
&end
#
# 21 THR HA 37 LEU QD2 5.31
&rst
ixpk= 0, nxpk= 0, iat= 278, -1, r1= 1.30, r2= 1.80, r3= 6.38, r4= 6.88,
igr2= 530, 531, 532,
&end
#
# 21 THR HB 22 VAL HN 3.90
&rst
ixpk= 0, nxpk= 0, iat= 280, 290, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40, &end
#
# 21 THR HB 22 VAL HN 3.90
&rst
ixpk= 0, nxpk= 0, iat= 280, 290, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40, &end
#
# 21 THR HB 22 VAL HN 3.90
&rst
ixpk= 0, nxpk= 0, iat= 280, 290, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40, &end
#
# 21 THR HB 22 VAL HN 5.72
&rst
ixpk= 0, nxpk= 0, iat= 280, 290, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 21 THR HB 22 VAL HA 5.87
&rst
ixpk= 0, nxpk= 0, iat= 280, 292, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37, &end
#
# 21 THR HB 22 VAL HA 5.87
&rst
ixpk= 0, nxpk= 0, iat= 280, 292, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37, &end
#
# 21 THR HB 22 VAL HA 5.87
&rst
ixpk= 0, nxpk= 0, iat= 280, 292, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37, &end
#
# 21 THR QG2 21 THR HB 3.49
&rst
ixpk= 0, nxpk= 0, iat= -1, 280, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,
igr1= 282, 283, 284,
&end
#
# 21 THR QG2 22 VAL HN 4.75
&rst
ixpk= 0, nxpk= 0, iat= -1, 290, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr1= 282, 283, 284,
&end
#
# 21 THR QG2 22 VAL HN 4.75
&rst
ixpk= 0, nxpk= 0, iat= -1, 290, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr1= 282, 283, 284,
&end
#
# 21 THR QG2 22 VAL HN 4.75
&rst
ixpk= 0, nxpk= 0, iat= -1, 290, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr1= 282, 283, 284,
&end
#
# 21 THR QG2 36 HID HD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 513, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 282, 283, 284,
&end
#
# 21 THR QG2 36 HID HD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 513, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 282, 283, 284,
&end
#
# 21 THR QG2 36 HID HD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 513, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 282, 283, 284,
&end
#
# 22 VAL HN 22 VAL HA 4.47
&rst
ixpk= 0, nxpk= 0, iat= 290, 292, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97, &end
#
# 22 VAL HN 22 VAL HB 3.96
&rst
ixpk= 0, nxpk= 0, iat= 290, 294, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46, &end
#
# 22 VAL HN 22 VAL HB 3.96
&rst
ixpk= 0, nxpk= 0, iat= 290, 294, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46, &end
#
# 22 VAL HN 22 VAL HB 3.96
&rst
ixpk= 0, nxpk= 0, iat= 290, 294, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46, &end
#
# 22 VAL HN 22 VAL QQG 3.96
&rst
ixpk= 0, nxpk= 0, iat= 290, -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr2= 296, 297, 298, 300, 301, 302,
&end
#
# 22 VAL HN 22 VAL QQG 3.96
&rst
ixpk= 0, nxpk= 0, iat= 290, -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr2= 296, 297, 298, 300, 301, 302,
&end
#
# 22 VAL HN 22 VAL QQG 3.96
&rst
ixpk= 0, nxpk= 0, iat= 290, -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr2= 296, 297, 298, 300, 301, 302,
&end
#
# 22 VAL HN 23 VAL HN 5.28
&rst
ixpk= 0, nxpk= 0, iat= 290, 306, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 22 VAL HN 23 VAL HN 5.67
&rst
ixpk= 0, nxpk= 0, iat= 290, 306, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17, &end
#
# 22 VAL HN 23 VAL HN 5.67
&rst
ixpk= 0, nxpk= 0, iat= 290, 306, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17, &end
#
# 22 VAL HN 23 VAL HN 5.67
&rst
ixpk= 0, nxpk= 0, iat= 290, 306, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17, &end
#
# 22 VAL HN 36 HID HD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 290, 513, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 22 VAL HN 36 HID HD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 290, 513, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 22 VAL HN 36 HID HD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 290, 513, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 22 VAL HN 37 LEU QD1 5.32
&rst
ixpk= 0, nxpk= 0, iat= 290, -1, r1= 1.30, r2= 1.80, r3= 6.39, r4= 6.89,
igr2= 526, 527, 528,
&end
#
# 22 VAL HN 37 LEU QD1 5.32
&rst
ixpk= 0, nxpk= 0, iat= 290, -1, r1= 1.30, r2= 1.80, r3= 6.39, r4= 6.89,
igr2= 526, 527, 528,
&end
#
# 22 VAL HN 37 LEU QD1 5.32
&rst
ixpk= 0, nxpk= 0, iat= 290, -1, r1= 1.30, r2= 1.80, r3= 6.39, r4= 6.89,
igr2= 526, 527, 528,
&end
#
# 22 VAL HA 22 VAL HB 4.90
&rst
ixpk= 0, nxpk= 0, iat= 292, 294, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40, &end
#
# 22 VAL HA 22 VAL QQG 3.90
&rst
ixpk= 0, nxpk= 0, iat= 292, -1, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr2= 296, 297, 298, 300, 301, 302,
&end
#
# 22 VAL HA 22 VAL QQG 3.90
&rst
ixpk= 0, nxpk= 0, iat= 292, -1, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr2= 296, 297, 298, 300, 301, 302,
&end
#
# 22 VAL HA 22 VAL QQG 3.90
&rst
ixpk= 0, nxpk= 0, iat= 292, -1, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr2= 296, 297, 298, 300, 301, 302,
&end
#
# 22 VAL HA 23 VAL HN 2.97
&rst
ixpk= 0, nxpk= 0, iat= 292, 306, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 22 VAL HA 23 VAL HN 3.71
&rst
ixpk= 0, nxpk= 0, iat= 292, 306, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21, &end
#
# 22 VAL HA 23 VAL HN 3.71
&rst
ixpk= 0, nxpk= 0, iat= 292, 306, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21, &end
#
# 22 VAL HA 23 VAL HN 3.71
&rst
ixpk= 0, nxpk= 0, iat= 292, 306, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21, &end
#
# 22 VAL HA 34 THR HN 5.39
&rst
ixpk= 0, nxpk= 0, iat= 292, 472, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89, &end
#
# 22 VAL HA 34 THR HN 5.39
&rst
ixpk= 0, nxpk= 0, iat= 292, 472, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89, &end
#
# 22 VAL HA 34 THR HN 5.39
&rst
ixpk= 0, nxpk= 0, iat= 292, 472, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89, &end
#
# 22 VAL HA 34 THR HB 5.47
&rst
ixpk= 0, nxpk= 0, iat= 292, 476, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97, &end
#
# 22 VAL HA 34 THR HB 5.47
&rst
ixpk= 0, nxpk= 0, iat= 292, 476, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97, &end
#
# 22 VAL HA 34 THR HB 5.47
&rst
ixpk= 0, nxpk= 0, iat= 292, 476, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97, &end
#
# 22 VAL HA 36 HID HD2 4.40
&rst
ixpk= 0, nxpk= 0, iat= 292, 513, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 22 VAL HA 36 HID HD2 4.40
&rst
ixpk= 0, nxpk= 0, iat= 292, 513, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 22 VAL HA 36 HID HD2 4.40
&rst
ixpk= 0, nxpk= 0, iat= 292, 513, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 22 VAL HA 37 LEU HG 5.61
&rst
ixpk= 0, nxpk= 0, iat= 292, 524, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11, &end
#
# 22 VAL HA 37 LEU HG 5.61
&rst
ixpk= 0, nxpk= 0, iat= 292, 524, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11, &end
#
# 22 VAL HA 37 LEU HG 5.61
&rst
ixpk= 0, nxpk= 0, iat= 292, 524, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11, &end
#
# 22 VAL HA 37 LEU QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 292, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 526, 527, 528,
&end
#
# 22 VAL HA 37 LEU QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 292, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 526, 527, 528,
&end
#
# 22 VAL HA 37 LEU QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 292, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 526, 527, 528,
&end
#
# 22 VAL HB 22 VAL QQG 3.76
&rst
ixpk= 0, nxpk= 0, iat= 294, -1, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
igr2= 296, 297, 298, 300, 301, 302,
&end
#
# 22 VAL HB 23 VAL HN 5.46
&rst
ixpk= 0, nxpk= 0, iat= 294, 306, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96, &end
#
# 22 VAL HB 23 VAL HN 5.46
&rst
ixpk= 0, nxpk= 0, iat= 294, 306, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96, &end
#
# 22 VAL HB 23 VAL HN 5.46
&rst
ixpk= 0, nxpk= 0, iat= 294, 306, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96, &end
#
# 22 VAL HB 23 VAL HN 5.72
&rst
ixpk= 0, nxpk= 0, iat= 294, 306, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 22 VAL HB 34 THR HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 294, 472, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 22 VAL HB 34 THR HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 294, 472, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 22 VAL HB 34 THR HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 294, 472, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 22 VAL QQG 23 VAL HN 3.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 306, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
igr1= 296, 297, 298, 300, 301, 302,
&end
#
# 22 VAL QQG 23 VAL HN 3.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 306, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
igr1= 296, 297, 298, 300, 301, 302,
&end
#
# 22 VAL QQG 23 VAL HN 3.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 306, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
igr1= 296, 297, 298, 300, 301, 302,
&end
#
# 22 VAL QQG 23 VAL HA 4.55
&rst
ixpk= 0, nxpk= 0, iat= -1, 308, r1= 1.30, r2= 1.80, r3= 6.13, r4= 6.63,
igr1= 296, 297, 298, 300, 301, 302,
&end
#
# 22 VAL QQG 23 VAL HA 4.55
&rst
ixpk= 0, nxpk= 0, iat= -1, 308, r1= 1.30, r2= 1.80, r3= 6.13, r4= 6.63,
igr1= 296, 297, 298, 300, 301, 302,
&end
#
# 22 VAL QQG 23 VAL HA 4.55
&rst
ixpk= 0, nxpk= 0, iat= -1, 308, r1= 1.30, r2= 1.80, r3= 6.13, r4= 6.63,
igr1= 296, 297, 298, 300, 301, 302,
&end
#
# 22 VAL QQG 24 ILE HN 5.07
&rst
ixpk= 0, nxpk= 0, iat= -1, 322, r1= 1.30, r2= 1.80, r3= 6.83, r4= 7.33,
igr1= 296, 297, 298, 300, 301, 302,
&end
#
# 22 VAL QQG 24 ILE HN 5.07
&rst
ixpk= 0, nxpk= 0, iat= -1, 322, r1= 1.30, r2= 1.80, r3= 6.83, r4= 7.33,
igr1= 296, 297, 298, 300, 301, 302,
&end
#
# 22 VAL QQG 24 ILE HN 5.07
&rst
ixpk= 0, nxpk= 0, iat= -1, 322, r1= 1.30, r2= 1.80, r3= 6.83, r4= 7.33,
igr1= 296, 297, 298, 300, 301, 302,
&end
#
# 22 VAL QQG 24 ILE HA 5.58
&rst
ixpk= 0, nxpk= 0, iat= -1, 324, r1= 1.30, r2= 1.80, r3= 7.52, r4= 8.02,
igr1= 296, 297, 298, 300, 301, 302,
&end
#
# 22 VAL QQG 24 ILE HA 5.58
&rst
ixpk= 0, nxpk= 0, iat= -1, 324, r1= 1.30, r2= 1.80, r3= 7.52, r4= 8.02,
igr1= 296, 297, 298, 300, 301, 302,
&end
#
# 22 VAL QQG 24 ILE HA 5.58
&rst
ixpk= 0, nxpk= 0, iat= -1, 324, r1= 1.30, r2= 1.80, r3= 7.52, r4= 8.02,
igr1= 296, 297, 298, 300, 301, 302,
&end
#
# 22 VAL QQG 33 PHE HN 5.57
&rst
ixpk= 0, nxpk= 0, iat= -1, 452, r1= 1.30, r2= 1.80, r3= 7.51, r4= 8.01,
igr1= 296, 297, 298, 300, 301, 302,
&end
#
# 22 VAL QQG 33 PHE HN 5.57
&rst
ixpk= 0, nxpk= 0, iat= -1, 452, r1= 1.30, r2= 1.80, r3= 7.51, r4= 8.01,
igr1= 296, 297, 298, 300, 301, 302,
&end
#
# 22 VAL QQG 33 PHE HN 5.57
&rst
ixpk= 0, nxpk= 0, iat= -1, 452, r1= 1.30, r2= 1.80, r3= 7.51, r4= 8.01,
igr1= 296, 297, 298, 300, 301, 302,
&end
#
# 22 VAL QQG 33 PHE HA 5.04
&rst
ixpk= 0, nxpk= 0, iat= -1, 454, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 296, 297, 298, 300, 301, 302,
&end
#
# 22 VAL QQG 33 PHE HA 5.04
&rst
ixpk= 0, nxpk= 0, iat= -1, 454, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 296, 297, 298, 300, 301, 302,
&end
#
# 22 VAL QQG 33 PHE HA 5.04
&rst
ixpk= 0, nxpk= 0, iat= -1, 454, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 296, 297, 298, 300, 301, 302,
&end
#
# 22 VAL QQG 33 PHE HB3 4.87
&rst
ixpk= 0, nxpk= 0, iat= -1, 457, r1= 1.30, r2= 1.80, r3= 6.56, r4= 7.06,
igr1= 296, 297, 298, 300, 301, 302,
&end
#
# 22 VAL QQG 33 PHE HB3 4.87
&rst
ixpk= 0, nxpk= 0, iat= -1, 457, r1= 1.30, r2= 1.80, r3= 6.56, r4= 7.06,
igr1= 296, 297, 298, 300, 301, 302,
&end
#
# 22 VAL QQG 33 PHE HB3 4.87
&rst
ixpk= 0, nxpk= 0, iat= -1, 457, r1= 1.30, r2= 1.80, r3= 6.56, r4= 7.06,
igr1= 296, 297, 298, 300, 301, 302,
&end
#
# 22 VAL QQG 33 PHE QD 4.09
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.19, r4= 6.69,
igr1= 296, 297, 298, 300, 301, 302,
igr2= 460, 468,
&end
#
# 22 VAL QQG 33 PHE QD 4.09
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.19, r4= 6.69,
igr1= 296, 297, 298, 300, 301, 302,
igr2= 460, 468,
&end
#
# 22 VAL QQG 33 PHE QD 4.09
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.19, r4= 6.69,
igr1= 296, 297, 298, 300, 301, 302,
igr2= 460, 468,
&end
#
# 22 VAL QQG 33 PHE HZ 4.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 464, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr1= 296, 297, 298, 300, 301, 302,
&end
#
# 22 VAL QQG 33 PHE HZ 4.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 464, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr1= 296, 297, 298, 300, 301, 302,
&end
#
# 22 VAL QQG 33 PHE HZ 4.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 464, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr1= 296, 297, 298, 300, 301, 302,
&end
#
# 22 VAL QQG 33 PHE QE 4.01
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
igr1= 296, 297, 298, 300, 301, 302,
igr2= 462, 466,
&end
#
# 22 VAL QQG 33 PHE QE 4.01
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
igr1= 296, 297, 298, 300, 301, 302,
igr2= 462, 466,
&end
#
# 22 VAL QQG 33 PHE QE 4.01
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
igr1= 296, 297, 298, 300, 301, 302,
igr2= 462, 466,
&end
#
# 22 VAL QQG 34 THR HN 4.24
&rst
ixpk= 0, nxpk= 0, iat= -1, 472, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
igr1= 296, 297, 298, 300, 301, 302,
&end
#
# 22 VAL QQG 34 THR HN 4.24
&rst
ixpk= 0, nxpk= 0, iat= -1, 472, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
igr1= 296, 297, 298, 300, 301, 302,
&end
#
# 22 VAL QQG 34 THR HN 4.24
&rst
ixpk= 0, nxpk= 0, iat= -1, 472, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
igr1= 296, 297, 298, 300, 301, 302,
&end
#
# 22 VAL QQG 34 THR HB 5.29
&rst
ixpk= 0, nxpk= 0, iat= -1, 476, r1= 1.30, r2= 1.80, r3= 7.13, r4= 7.63,
igr1= 296, 297, 298, 300, 301, 302,
&end
#
# 22 VAL QQG 34 THR HB 5.29
&rst
ixpk= 0, nxpk= 0, iat= -1, 476, r1= 1.30, r2= 1.80, r3= 7.13, r4= 7.63,
igr1= 296, 297, 298, 300, 301, 302,
&end
#
# 22 VAL QQG 34 THR HB 5.29
&rst
ixpk= 0, nxpk= 0, iat= -1, 476, r1= 1.30, r2= 1.80, r3= 7.13, r4= 7.63,
igr1= 296, 297, 298, 300, 301, 302,
&end
#
# 22 VAL QQG 35 PRO HA 3.59
&rst
ixpk= 0, nxpk= 0, iat= -1, 496, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
igr1= 296, 297, 298, 300, 301, 302,
&end
#
# 22 VAL QQG 35 PRO HA 3.59
&rst
ixpk= 0, nxpk= 0, iat= -1, 496, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
igr1= 296, 297, 298, 300, 301, 302,
&end
#
# 22 VAL QQG 35 PRO HA 3.59
&rst
ixpk= 0, nxpk= 0, iat= -1, 496, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
igr1= 296, 297, 298, 300, 301, 302,
&end
#
# 22 VAL QQG 36 HID HN 4.87
&rst
ixpk= 0, nxpk= 0, iat= -1, 500, r1= 1.30, r2= 1.80, r3= 6.56, r4= 7.06,
igr1= 296, 297, 298, 300, 301, 302,
&end
#
# 22 VAL QQG 36 HID HN 4.87
&rst
ixpk= 0, nxpk= 0, iat= -1, 500, r1= 1.30, r2= 1.80, r3= 6.56, r4= 7.06,
igr1= 296, 297, 298, 300, 301, 302,
&end
#
# 22 VAL QQG 36 HID HN 4.87
&rst
ixpk= 0, nxpk= 0, iat= -1, 500, r1= 1.30, r2= 1.80, r3= 6.56, r4= 7.06,
igr1= 296, 297, 298, 300, 301, 302,
&end
#
# 22 VAL QQG 36 HID HD2 4.06
&rst
ixpk= 0, nxpk= 0, iat= -1, 513, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,
igr1= 296, 297, 298, 300, 301, 302,
&end
#
# 22 VAL QQG 36 HID HD2 4.06
&rst
ixpk= 0, nxpk= 0, iat= -1, 513, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,
igr1= 296, 297, 298, 300, 301, 302,
&end
#
# 22 VAL QQG 36 HID HD2 4.06
&rst
ixpk= 0, nxpk= 0, iat= -1, 513, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97,
igr1= 296, 297, 298, 300, 301, 302,
&end
#
# 22 VAL QQG 37 LEU HA 5.91
&rst
ixpk= 0, nxpk= 0, iat= -1, 519, r1= 1.30, r2= 1.80, r3= 7.97, r4= 8.47,
igr1= 296, 297, 298, 300, 301, 302,
&end
#
# 22 VAL QQG 37 LEU HA 5.91
&rst
ixpk= 0, nxpk= 0, iat= -1, 519, r1= 1.30, r2= 1.80, r3= 7.97, r4= 8.47,
igr1= 296, 297, 298, 300, 301, 302,
&end
#
# 22 VAL QQG 37 LEU HA 5.91
&rst
ixpk= 0, nxpk= 0, iat= -1, 519, r1= 1.30, r2= 1.80, r3= 7.97, r4= 8.47,
igr1= 296, 297, 298, 300, 301, 302,
&end
#
# 22 VAL QQG 37 LEU HG 4.71
&rst
ixpk= 0, nxpk= 0, iat= -1, 524, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
igr1= 296, 297, 298, 300, 301, 302,
&end
#
# 22 VAL QQG 37 LEU HG 4.71
&rst
ixpk= 0, nxpk= 0, iat= -1, 524, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
igr1= 296, 297, 298, 300, 301, 302,
&end
#
# 22 VAL QQG 37 LEU HG 4.71
&rst
ixpk= 0, nxpk= 0, iat= -1, 524, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
igr1= 296, 297, 298, 300, 301, 302,
&end
#
# 22 VAL QQG 37 LEU QD1 4.01
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
igr1= 296, 297, 298, 300, 301, 302,
igr2= 526, 527, 528,
&end
#
# 22 VAL QQG 37 LEU QD1 4.01
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
igr1= 296, 297, 298, 300, 301, 302,
igr2= 526, 527, 528,
&end
#
# 22 VAL QQG 37 LEU QD1 4.01
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
igr1= 296, 297, 298, 300, 301, 302,
igr2= 526, 527, 528,
&end
#
# 22 VAL QQG 37 LEU QD2 4.53
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.33, r4= 7.83,
igr1= 296, 297, 298, 300, 301, 302,
igr2= 530, 531, 532,
&end
#
# 22 VAL QQG 37 LEU QD2 4.53
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.33, r4= 7.83,
igr1= 296, 297, 298, 300, 301, 302,
igr2= 530, 531, 532,
&end
#
# 22 VAL QQG 37 LEU QD2 4.53
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.33, r4= 7.83,
igr1= 296, 297, 298, 300, 301, 302,
igr2= 530, 531, 532,
&end
#
# 23 VAL HN 23 VAL HA 3.71
&rst
ixpk= 0, nxpk= 0, iat= 306, 308, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21, &end
#
# 23 VAL HN 23 VAL HB 3.86
&rst
ixpk= 0, nxpk= 0, iat= 306, 310, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 23 VAL HN 23 VAL HB 3.86
&rst
ixpk= 0, nxpk= 0, iat= 306, 310, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 23 VAL HN 23 VAL HB 3.86
&rst
ixpk= 0, nxpk= 0, iat= 306, 310, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 23 VAL HN 23 VAL QG2 5.36
&rst
ixpk= 0, nxpk= 0, iat= 306, -1, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,
igr2= 316, 317, 318,
&end
#
# 23 VAL HN 23 VAL QG2 5.36
&rst
ixpk= 0, nxpk= 0, iat= 306, -1, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,
igr2= 316, 317, 318,
&end
#
# 23 VAL HN 23 VAL QG2 5.36
&rst
ixpk= 0, nxpk= 0, iat= 306, -1, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,
igr2= 316, 317, 318,
&end
#
# 23 VAL HN 24 ILE HN 5.28
&rst
ixpk= 0, nxpk= 0, iat= 306, 322, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 23 VAL HN 24 ILE HN 5.94
&rst
ixpk= 0, nxpk= 0, iat= 306, 322, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44, &end
#
# 23 VAL HN 24 ILE HN 5.94
&rst
ixpk= 0, nxpk= 0, iat= 306, 322, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44, &end
#
# 23 VAL HN 24 ILE HN 5.94
&rst
ixpk= 0, nxpk= 0, iat= 306, 322, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44, &end
#
# 23 VAL HN 34 THR HN 4.11
&rst
ixpk= 0, nxpk= 0, iat= 306, 472, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 23 VAL HN 34 THR HN 4.11
&rst
ixpk= 0, nxpk= 0, iat= 306, 472, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 23 VAL HN 34 THR HN 4.11
&rst
ixpk= 0, nxpk= 0, iat= 306, 472, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 23 VAL HN 34 THR HB 4.97
&rst
ixpk= 0, nxpk= 0, iat= 306, 476, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 23 VAL HN 34 THR HB 4.97
&rst
ixpk= 0, nxpk= 0, iat= 306, 476, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 23 VAL HN 34 THR HB 4.97
&rst
ixpk= 0, nxpk= 0, iat= 306, 476, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 23 VAL HN 36 HID HD2 4.51
&rst
ixpk= 0, nxpk= 0, iat= 306, 513, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01, &end
#
# 23 VAL HN 36 HID HD2 4.51
&rst
ixpk= 0, nxpk= 0, iat= 306, 513, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01, &end
#
# 23 VAL HN 36 HID HD2 4.51
&rst
ixpk= 0, nxpk= 0, iat= 306, 513, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01, &end
#
# 23 VAL HA 23 VAL QG2 4.08
&rst
ixpk= 0, nxpk= 0, iat= 308, -1, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,
igr2= 316, 317, 318,
&end
#
# 23 VAL HA 23 VAL QG2 4.08
&rst
ixpk= 0, nxpk= 0, iat= 308, -1, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,
igr2= 316, 317, 318,
&end
#
# 23 VAL HA 23 VAL QG2 4.08
&rst
ixpk= 0, nxpk= 0, iat= 308, -1, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,
igr2= 316, 317, 318,
&end
#
# 23 VAL HA 24 ILE HN 2.97
&rst
ixpk= 0, nxpk= 0, iat= 308, 322, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 23 VAL HA 24 ILE HN 3.35
&rst
ixpk= 0, nxpk= 0, iat= 308, 322, r1= 1.30, r2= 1.80, r3= 3.35, r4= 3.85, &end
#
# 23 VAL HA 24 ILE HN 3.35
&rst
ixpk= 0, nxpk= 0, iat= 308, 322, r1= 1.30, r2= 1.80, r3= 3.35, r4= 3.85, &end
#
# 23 VAL HA 24 ILE HN 3.35
&rst
ixpk= 0, nxpk= 0, iat= 308, 322, r1= 1.30, r2= 1.80, r3= 3.35, r4= 3.85, &end
#
# 23 VAL HA 24 ILE HB 5.63
&rst
ixpk= 0, nxpk= 0, iat= 308, 326, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13, &end
#
# 23 VAL HA 24 ILE HB 5.63
&rst
ixpk= 0, nxpk= 0, iat= 308, 326, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13, &end
#
# 23 VAL HA 24 ILE HB 5.63
&rst
ixpk= 0, nxpk= 0, iat= 308, 326, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13, &end
#
# 23 VAL HA 24 ILE QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 308, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 328, 329, 330,
&end
#
# 23 VAL HA 24 ILE QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 308, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 328, 329, 330,
&end
#
# 23 VAL HA 24 ILE QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 308, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 328, 329, 330,
&end
#
# 23 VAL HB 23 VAL QG2 3.58
&rst
ixpk= 0, nxpk= 0, iat= 310, -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
igr2= 316, 317, 318,
&end
#
# 23 VAL HB 24 ILE HN 5.72
&rst
ixpk= 0, nxpk= 0, iat= 310, 322, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 23 VAL HB 24 ILE HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 310, 322, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 23 VAL HB 24 ILE HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 310, 322, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 23 VAL HB 24 ILE HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 310, 322, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 23 VAL HB 34 THR HN 4.86
&rst
ixpk= 0, nxpk= 0, iat= 310, 472, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36, &end
#
# 23 VAL HB 34 THR HN 4.86
&rst
ixpk= 0, nxpk= 0, iat= 310, 472, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36, &end
#
# 23 VAL HB 34 THR HN 4.86
&rst
ixpk= 0, nxpk= 0, iat= 310, 472, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36, &end
#
# 23 VAL HB 34 THR HB 4.27
&rst
ixpk= 0, nxpk= 0, iat= 310, 476, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77, &end
#
# 23 VAL HB 34 THR HB 4.27
&rst
ixpk= 0, nxpk= 0, iat= 310, 476, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77, &end
#
# 23 VAL HB 34 THR HB 4.27
&rst
ixpk= 0, nxpk= 0, iat= 310, 476, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77, &end
#
# 23 VAL HB 36 HID HD2 5.59
&rst
ixpk= 0, nxpk= 0, iat= 310, 513, r1= 1.30, r2= 1.80, r3= 5.59, r4= 6.09, &end
#
# 23 VAL HB 36 HID HD2 5.59
&rst
ixpk= 0, nxpk= 0, iat= 310, 513, r1= 1.30, r2= 1.80, r3= 5.59, r4= 6.09, &end
#
# 23 VAL HB 36 HID HD2 5.59
&rst
ixpk= 0, nxpk= 0, iat= 310, 513, r1= 1.30, r2= 1.80, r3= 5.59, r4= 6.09, &end
#
# 23 VAL QG1 36 HID HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 504, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 312, 313, 314,
&end
#
# 23 VAL QG1 36 HID HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 504, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 312, 313, 314,
&end
#
# 23 VAL QG1 36 HID HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 504, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 312, 313, 314,
&end
#
# 23 VAL QG1 36 HID HD2 5.41
&rst
ixpk= 0, nxpk= 0, iat= -1, 513, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
igr1= 312, 313, 314,
&end
#
# 23 VAL QG1 36 HID HD2 5.41
&rst
ixpk= 0, nxpk= 0, iat= -1, 513, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
igr1= 312, 313, 314,
&end
#
# 23 VAL QG1 36 HID HD2 5.41
&rst
ixpk= 0, nxpk= 0, iat= -1, 513, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
igr1= 312, 313, 314,
&end
#
# 23 VAL QG2 24 ILE HN 3.83
&rst
ixpk= 0, nxpk= 0, iat= -1, 322, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
igr1= 316, 317, 318,
&end
#
# 23 VAL QG2 24 ILE HN 3.83
&rst
ixpk= 0, nxpk= 0, iat= -1, 322, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
igr1= 316, 317, 318,
&end
#
# 23 VAL QG2 24 ILE HN 3.83
&rst
ixpk= 0, nxpk= 0, iat= -1, 322, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
igr1= 316, 317, 318,
&end
#
# 23 VAL QG2 24 ILE QG2 5.33
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.69, r4= 8.19,
igr1= 316, 317, 318,
igr2= 328, 329, 330,
&end
#
# 23 VAL QG2 24 ILE QG2 5.33
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.69, r4= 8.19,
igr1= 316, 317, 318,
igr2= 328, 329, 330,
&end
#
# 23 VAL QG2 24 ILE QG2 5.33
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.69, r4= 8.19,
igr1= 316, 317, 318,
igr2= 328, 329, 330,
&end
#
# 23 VAL QG2 34 THR HN 5.58
&rst
ixpk= 0, nxpk= 0, iat= -1, 472, r1= 1.30, r2= 1.80, r3= 6.70, r4= 7.20,
igr1= 316, 317, 318,
&end
#
# 23 VAL QG2 34 THR HN 5.58
&rst
ixpk= 0, nxpk= 0, iat= -1, 472, r1= 1.30, r2= 1.80, r3= 6.70, r4= 7.20,
igr1= 316, 317, 318,
&end
#
# 23 VAL QG2 34 THR HN 5.58
&rst
ixpk= 0, nxpk= 0, iat= -1, 472, r1= 1.30, r2= 1.80, r3= 6.70, r4= 7.20,
igr1= 316, 317, 318,
&end
#
# 24 ILE HN 24 ILE HA 5.52
&rst
ixpk= 0, nxpk= 0, iat= 322, 324, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02, &end
#
# 24 ILE HN 24 ILE HB 3.96
&rst
ixpk= 0, nxpk= 0, iat= 322, 326, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46, &end
#
# 24 ILE HN 24 ILE HB 3.96
&rst
ixpk= 0, nxpk= 0, iat= 322, 326, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46, &end
#
# 24 ILE HN 24 ILE HB 3.96
&rst
ixpk= 0, nxpk= 0, iat= 322, 326, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46, &end
#
# 24 ILE HN 24 ILE HG12 4.31
&rst
ixpk= 0, nxpk= 0, iat= 322, 332, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81, &end
#
# 24 ILE HN 24 ILE HG12 4.31
&rst
ixpk= 0, nxpk= 0, iat= 322, 332, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81, &end
#
# 24 ILE HN 24 ILE HG12 4.31
&rst
ixpk= 0, nxpk= 0, iat= 322, 332, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81, &end
#
# 24 ILE HN 24 ILE HG13 4.88
&rst
ixpk= 0, nxpk= 0, iat= 322, 333, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38, &end
#
# 24 ILE HN 24 ILE HG13 4.88
&rst
ixpk= 0, nxpk= 0, iat= 322, 333, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38, &end
#
# 24 ILE HN 24 ILE HG13 4.88
&rst
ixpk= 0, nxpk= 0, iat= 322, 333, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38, &end
#
# 24 ILE HN 24 ILE QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 322, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 335, 336, 337,
&end
#
# 24 ILE HN 24 ILE QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 322, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 335, 336, 337,
&end
#
# 24 ILE HN 24 ILE QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 322, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 335, 336, 337,
&end
#
# 24 ILE HN 24 ILE QG2 4.97
&rst
ixpk= 0, nxpk= 0, iat= 322, -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr2= 328, 329, 330,
&end
#
# 24 ILE HN 24 ILE QG2 4.97
&rst
ixpk= 0, nxpk= 0, iat= 322, -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr2= 328, 329, 330,
&end
#
# 24 ILE HN 24 ILE QG2 4.97
&rst
ixpk= 0, nxpk= 0, iat= 322, -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr2= 328, 329, 330,
&end
#
# 24 ILE HN 25 ASP HN 5.28
&rst
ixpk= 0, nxpk= 0, iat= 322, 341, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 24 ILE HN 25 ASP HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 322, 343, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 24 ILE HN 25 ASP HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 322, 343, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 24 ILE HN 25 ASP HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 322, 343, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 24 ILE HN 33 PHE QD 6.05
&rst
ixpk= 0, nxpk= 0, iat= 322, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2= 460, 468,
&end
#
# 24 ILE HN 33 PHE QD 6.05
&rst
ixpk= 0, nxpk= 0, iat= 322, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2= 460, 468,
&end
#
# 24 ILE HN 33 PHE QD 6.05
&rst
ixpk= 0, nxpk= 0, iat= 322, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2= 460, 468,
&end
#
# 24 ILE HN 34 THR HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 322, 472, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 24 ILE HN 34 THR HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 322, 472, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 24 ILE HN 34 THR HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 322, 472, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 24 ILE HN 117 LEU QD1 5.50
&rst
ixpk= 0, nxpk= 0, iat= 322, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2=1648,1649,1650,
&end
#
# 24 ILE HN 117 LEU QD1 5.50
&rst
ixpk= 0, nxpk= 0, iat= 322, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2=1648,1649,1650,
&end
#
# 24 ILE HN 117 LEU QD1 5.50
&rst
ixpk= 0, nxpk= 0, iat= 322, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2=1648,1649,1650,
&end
#
# 24 ILE HA 24 ILE HB 4.76
&rst
ixpk= 0, nxpk= 0, iat= 324, 326, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26, &end
#
# 24 ILE HA 24 ILE HG12 5.47
&rst
ixpk= 0, nxpk= 0, iat= 324, 332, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97, &end
#
# 24 ILE HA 24 ILE HG13 4.67
&rst
ixpk= 0, nxpk= 0, iat= 324, 333, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, &end
#
# 24 ILE HA 24 ILE HG13 4.67
&rst
ixpk= 0, nxpk= 0, iat= 324, 333, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, &end
#
# 24 ILE HA 24 ILE HG13 4.67
&rst
ixpk= 0, nxpk= 0, iat= 324, 333, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, &end
#
# 24 ILE HA 24 ILE QD1 5.36
&rst
ixpk= 0, nxpk= 0, iat= 324, -1, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,
igr2= 335, 336, 337,
&end
#
# 24 ILE HA 24 ILE QD1 5.36
&rst
ixpk= 0, nxpk= 0, iat= 324, -1, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,
igr2= 335, 336, 337,
&end
#
# 24 ILE HA 24 ILE QD1 5.36
&rst
ixpk= 0, nxpk= 0, iat= 324, -1, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,
igr2= 335, 336, 337,
&end
#
# 24 ILE HA 24 ILE QG2 4.18
&rst
ixpk= 0, nxpk= 0, iat= 324, -1, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
igr2= 328, 329, 330,
&end
#
# 24 ILE HA 24 ILE QG2 4.18
&rst
ixpk= 0, nxpk= 0, iat= 324, -1, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
igr2= 328, 329, 330,
&end
#
# 24 ILE HA 24 ILE QG2 4.18
&rst
ixpk= 0, nxpk= 0, iat= 324, -1, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
igr2= 328, 329, 330,
&end
#
# 24 ILE HA 25 ASP HN 2.97
&rst
ixpk= 0, nxpk= 0, iat= 324, 341, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 24 ILE HA 25 ASP HN 3.42
&rst
ixpk= 0, nxpk= 0, iat= 324, 341, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92, &end
#
# 24 ILE HA 25 ASP HN 3.42
&rst
ixpk= 0, nxpk= 0, iat= 324, 341, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92, &end
#
# 24 ILE HA 25 ASP HN 3.42
&rst
ixpk= 0, nxpk= 0, iat= 324, 341, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92, &end
#
# 24 ILE HA 25 ASP HA 4.99
&rst
ixpk= 0, nxpk= 0, iat= 324, 343, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49, &end
#
# 24 ILE HA 25 ASP HA 4.99
&rst
ixpk= 0, nxpk= 0, iat= 324, 343, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49, &end
#
# 24 ILE HA 25 ASP HA 4.99
&rst
ixpk= 0, nxpk= 0, iat= 324, 343, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49, &end
#
# 24 ILE HA 25 ASP HB2 6.02
&rst
ixpk= 0, nxpk= 0, iat= 324, 345, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52, &end
#
# 24 ILE HA 25 ASP HB2 6.02
&rst
ixpk= 0, nxpk= 0, iat= 324, 345, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52, &end
#
# 24 ILE HA 25 ASP HB2 6.02
&rst
ixpk= 0, nxpk= 0, iat= 324, 345, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52, &end
#
# 24 ILE HA 25 ASP HB3 5.60
&rst
ixpk= 0, nxpk= 0, iat= 324, 346, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10, &end
#
# 24 ILE HA 25 ASP HB3 5.60
&rst
ixpk= 0, nxpk= 0, iat= 324, 346, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10, &end
#
# 24 ILE HA 25 ASP HB3 5.60
&rst
ixpk= 0, nxpk= 0, iat= 324, 346, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10, &end
#
# 24 ILE HA 33 PHE HA 5.26
&rst
ixpk= 0, nxpk= 0, iat= 324, 454, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76, &end
#
# 24 ILE HA 33 PHE HA 5.26
&rst
ixpk= 0, nxpk= 0, iat= 324, 454, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76, &end
#
# 24 ILE HA 33 PHE HA 5.26
&rst
ixpk= 0, nxpk= 0, iat= 324, 454, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76, &end
#
# 24 ILE HB 24 ILE QD1 3.89
&rst
ixpk= 0, nxpk= 0, iat= 326, -1, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
igr2= 335, 336, 337,
&end
#
# 24 ILE HB 24 ILE QD1 3.89
&rst
ixpk= 0, nxpk= 0, iat= 326, -1, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
igr2= 335, 336, 337,
&end
#
# 24 ILE HB 24 ILE QD1 3.89
&rst
ixpk= 0, nxpk= 0, iat= 326, -1, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
igr2= 335, 336, 337,
&end
#
# 24 ILE HB 25 ASP HN 4.81
&rst
ixpk= 0, nxpk= 0, iat= 326, 341, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31, &end
#
# 24 ILE HB 25 ASP HN 4.81
&rst
ixpk= 0, nxpk= 0, iat= 326, 341, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31, &end
#
# 24 ILE HB 25 ASP HN 4.81
&rst
ixpk= 0, nxpk= 0, iat= 326, 341, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31, &end
#
# 24 ILE HB 25 ASP HN 5.72
&rst
ixpk= 0, nxpk= 0, iat= 326, 341, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 24 ILE HB 117 LEU QD2 4.82
&rst
ixpk= 0, nxpk= 0, iat= 326, -1, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,
igr2=1652,1653,1654,
&end
#
# 24 ILE HB 117 LEU QD2 4.82
&rst
ixpk= 0, nxpk= 0, iat= 326, -1, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,
igr2=1652,1653,1654,
&end
#
# 24 ILE HB 117 LEU QD2 4.82
&rst
ixpk= 0, nxpk= 0, iat= 326, -1, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,
igr2=1652,1653,1654,
&end
#
# 24 ILE HG13 24 ILE QD1 3.35
&rst
ixpk= 0, nxpk= 0, iat= 333, -1, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,
igr2= 335, 336, 337,
&end
#
# 24 ILE HG13 33 PHE QD 5.26
&rst
ixpk= 0, nxpk= 0, iat= 333, -1, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
igr2= 460, 468,
&end
#
# 24 ILE HG13 33 PHE QD 5.26
&rst
ixpk= 0, nxpk= 0, iat= 333, -1, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
igr2= 460, 468,
&end
#
# 24 ILE HG13 33 PHE QD 5.26
&rst
ixpk= 0, nxpk= 0, iat= 333, -1, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
igr2= 460, 468,
&end
#
# 24 ILE HG13 34 THR HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 333, 472, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 24 ILE HG13 34 THR HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 333, 472, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 24 ILE HG13 34 THR HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 333, 472, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 24 ILE HG13 47 PHE QE 5.60
&rst
ixpk= 0, nxpk= 0, iat= 333, -1, r1= 1.30, r2= 1.80, r3= 6.29, r4= 6.79,
igr2= 672, 676,
&end
#
# 24 ILE HG13 47 PHE QE 5.60
&rst
ixpk= 0, nxpk= 0, iat= 333, -1, r1= 1.30, r2= 1.80, r3= 6.29, r4= 6.79,
igr2= 672, 676,
&end
#
# 24 ILE HG13 47 PHE QE 5.60
&rst
ixpk= 0, nxpk= 0, iat= 333, -1, r1= 1.30, r2= 1.80, r3= 6.29, r4= 6.79,
igr2= 672, 676,
&end
#
# 24 ILE HG13 125 LEU QD2 4.31
&rst
ixpk= 0, nxpk= 0, iat= 333, -1, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
igr2=1780,1781,1782,
&end
#
# 24 ILE HG13 125 LEU QD2 4.31
&rst
ixpk= 0, nxpk= 0, iat= 333, -1, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
igr2=1780,1781,1782,
&end
#
# 24 ILE HG13 125 LEU QD2 4.31
&rst
ixpk= 0, nxpk= 0, iat= 333, -1, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
igr2=1780,1781,1782,
&end
#
# 24 ILE QD1 24 ILE HG12 4.81
&rst
ixpk= 0, nxpk= 0, iat= -1, 332, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr1= 335, 336, 337,
&end
#
# 24 ILE QD1 33 PHE QD 4.90
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 335, 336, 337,
igr2= 460, 468,
&end
#
# 24 ILE QD1 33 PHE QD 4.90
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 335, 336, 337,
igr2= 460, 468,
&end
#
# 24 ILE QD1 33 PHE QD 4.90
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 335, 336, 337,
igr2= 460, 468,
&end
#
# 24 ILE QD1 34 THR HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 472, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 335, 336, 337,
&end
#
# 24 ILE QD1 34 THR HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 472, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 335, 336, 337,
&end
#
# 24 ILE QD1 34 THR HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 472, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 335, 336, 337,
&end
#
# 24 ILE QD1 47 PHE HZ 4.82
&rst
ixpk= 0, nxpk= 0, iat= -1, 674, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,
igr1= 335, 336, 337,
&end
#
# 24 ILE QD1 47 PHE HZ 4.82
&rst
ixpk= 0, nxpk= 0, iat= -1, 674, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,
igr1= 335, 336, 337,
&end
#
# 24 ILE QD1 47 PHE HZ 4.82
&rst
ixpk= 0, nxpk= 0, iat= -1, 674, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,
igr1= 335, 336, 337,
&end
#
# 24 ILE QD1 47 PHE QE 4.72
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
igr1= 335, 336, 337,
igr2= 672, 676,
&end
#
# 24 ILE QD1 47 PHE QE 4.72
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
igr1= 335, 336, 337,
igr2= 672, 676,
&end
#
# 24 ILE QD1 47 PHE QE 4.72
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
igr1= 335, 336, 337,
igr2= 672, 676,
&end
#
# 24 ILE QD1 117 LEU QD1 3.37
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
igr1= 335, 336, 337,
igr2=1648,1649,1650,
&end
#
# 24 ILE QD1 117 LEU QD1 3.37
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
igr1= 335, 336, 337,
igr2=1648,1649,1650,
&end
#
# 24 ILE QD1 117 LEU QD1 3.37
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
igr1= 335, 336, 337,
igr2=1648,1649,1650,
&end
#
# 24 ILE QD1 125 LEU QD2 4.22
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.09, r4= 6.59,
igr1= 335, 336, 337,
igr2=1780,1781,1782,
&end
#
# 24 ILE QD1 125 LEU QD2 4.22
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.09, r4= 6.59,
igr1= 335, 336, 337,
igr2=1780,1781,1782,
&end
#
# 24 ILE QD1 125 LEU QD2 4.22
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.09, r4= 6.59,
igr1= 335, 336, 337,
igr2=1780,1781,1782,
&end
#
# 24 ILE QG2 24 ILE HB 3.87
&rst
ixpk= 0, nxpk= 0, iat= -1, 326, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 24 ILE HG12 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 332, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 24 ILE HG13 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 333, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 24 ILE QD1 4.48
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.46, r4= 6.96,
igr1= 328, 329, 330,
igr2= 335, 336, 337,
&end
#
# 24 ILE QG2 24 ILE QD1 4.48
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.46, r4= 6.96,
igr1= 328, 329, 330,
igr2= 335, 336, 337,
&end
#
# 24 ILE QG2 24 ILE QD1 4.48
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.46, r4= 6.96,
igr1= 328, 329, 330,
igr2= 335, 336, 337,
&end
#
# 24 ILE QG2 25 ASP HN 4.08
&rst
ixpk= 0, nxpk= 0, iat= -1, 341, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 25 ASP HN 4.08
&rst
ixpk= 0, nxpk= 0, iat= -1, 341, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 25 ASP HN 4.08
&rst
ixpk= 0, nxpk= 0, iat= -1, 341, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 25 ASP HA 5.82
&rst
ixpk= 0, nxpk= 0, iat= -1, 343, r1= 1.30, r2= 1.80, r3= 6.99, r4= 7.49,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 25 ASP HA 5.82
&rst
ixpk= 0, nxpk= 0, iat= -1, 343, r1= 1.30, r2= 1.80, r3= 6.99, r4= 7.49,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 25 ASP HA 5.82
&rst
ixpk= 0, nxpk= 0, iat= -1, 343, r1= 1.30, r2= 1.80, r3= 6.99, r4= 7.49,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 25 ASP HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 345, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 25 ASP HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 345, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 25 ASP HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 345, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 25 ASP HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 346, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 25 ASP HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 346, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 25 ASP HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 346, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 26 GLU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 353, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 26 GLU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 353, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 26 GLU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 353, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 26 GLU HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 355, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 26 GLU HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 355, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 26 GLU HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 355, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 27 THR HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 368, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 27 THR HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 368, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 27 THR HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 368, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 31 LEU HN 5.78
&rst
ixpk= 0, nxpk= 0, iat= -1, 411, r1= 1.30, r2= 1.80, r3= 6.94, r4= 7.44,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 31 LEU HN 5.78
&rst
ixpk= 0, nxpk= 0, iat= -1, 411, r1= 1.30, r2= 1.80, r3= 6.94, r4= 7.44,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 31 LEU HN 5.78
&rst
ixpk= 0, nxpk= 0, iat= -1, 411, r1= 1.30, r2= 1.80, r3= 6.94, r4= 7.44,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 31 LEU HA 5.41
&rst
ixpk= 0, nxpk= 0, iat= -1, 413, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 31 LEU HA 5.41
&rst
ixpk= 0, nxpk= 0, iat= -1, 413, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 31 LEU HA 5.41
&rst
ixpk= 0, nxpk= 0, iat= -1, 413, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 31 LEU HB2 5.27
&rst
ixpk= 0, nxpk= 0, iat= -1, 415, r1= 1.30, r2= 1.80, r3= 6.33, r4= 6.83,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 31 LEU HB2 5.27
&rst
ixpk= 0, nxpk= 0, iat= -1, 415, r1= 1.30, r2= 1.80, r3= 6.33, r4= 6.83,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 31 LEU HB2 5.27
&rst
ixpk= 0, nxpk= 0, iat= -1, 415, r1= 1.30, r2= 1.80, r3= 6.33, r4= 6.83,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 31 LEU HB3 3.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 416, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 31 LEU HB3 3.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 416, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 31 LEU HB3 3.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 416, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 31 LEU HG 5.69
&rst
ixpk= 0, nxpk= 0, iat= -1, 418, r1= 1.30, r2= 1.80, r3= 6.83, r4= 7.33,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 31 LEU HG 5.69
&rst
ixpk= 0, nxpk= 0, iat= -1, 418, r1= 1.30, r2= 1.80, r3= 6.83, r4= 7.33,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 31 LEU HG 5.69
&rst
ixpk= 0, nxpk= 0, iat= -1, 418, r1= 1.30, r2= 1.80, r3= 6.83, r4= 7.33,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 31 LEU QD1 4.77
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.88, r4= 7.38,
igr1= 328, 329, 330,
igr2= 420, 421, 422,
&end
#
# 24 ILE QG2 31 LEU QD1 4.77
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.88, r4= 7.38,
igr1= 328, 329, 330,
igr2= 420, 421, 422,
&end
#
# 24 ILE QG2 31 LEU QD1 4.77
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.88, r4= 7.38,
igr1= 328, 329, 330,
igr2= 420, 421, 422,
&end
#
# 24 ILE QG2 31 LEU QD2 4.41
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
igr1= 328, 329, 330,
igr2= 424, 425, 426,
&end
#
# 24 ILE QG2 31 LEU QD2 4.41
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
igr1= 328, 329, 330,
igr2= 424, 425, 426,
&end
#
# 24 ILE QG2 31 LEU QD2 4.41
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
igr1= 328, 329, 330,
igr2= 424, 425, 426,
&end
#
# 24 ILE QG2 32 LYS HN 5.02
&rst
ixpk= 0, nxpk= 0, iat= -1, 430, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 32 LYS HN 5.02
&rst
ixpk= 0, nxpk= 0, iat= -1, 430, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 32 LYS HN 5.02
&rst
ixpk= 0, nxpk= 0, iat= -1, 430, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 33 PHE HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 452, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 33 PHE HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 452, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 33 PHE HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 452, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 33 PHE HA 5.48
&rst
ixpk= 0, nxpk= 0, iat= -1, 454, r1= 1.30, r2= 1.80, r3= 6.58, r4= 7.08,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 33 PHE HA 5.48
&rst
ixpk= 0, nxpk= 0, iat= -1, 454, r1= 1.30, r2= 1.80, r3= 6.58, r4= 7.08,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 33 PHE HA 5.48
&rst
ixpk= 0, nxpk= 0, iat= -1, 454, r1= 1.30, r2= 1.80, r3= 6.58, r4= 7.08,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 33 PHE HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 456, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 33 PHE HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 456, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 33 PHE HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 456, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 33 PHE QD 5.47
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.37, r4= 7.87,
igr1= 328, 329, 330,
igr2= 460, 468,
&end
#
# 24 ILE QG2 33 PHE QD 5.47
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.37, r4= 7.87,
igr1= 328, 329, 330,
igr2= 460, 468,
&end
#
# 24 ILE QG2 33 PHE QD 5.47
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.37, r4= 7.87,
igr1= 328, 329, 330,
igr2= 460, 468,
&end
#
# 24 ILE QG2 34 THR HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 472, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 34 THR HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 472, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 34 THR HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 472, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 47 PHE HZ 5.62
&rst
ixpk= 0, nxpk= 0, iat= -1, 674, r1= 1.30, r2= 1.80, r3= 6.75, r4= 7.25,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 47 PHE HZ 5.62
&rst
ixpk= 0, nxpk= 0, iat= -1, 674, r1= 1.30, r2= 1.80, r3= 6.75, r4= 7.25,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 47 PHE HZ 5.62
&rst
ixpk= 0, nxpk= 0, iat= -1, 674, r1= 1.30, r2= 1.80, r3= 6.75, r4= 7.25,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 47 PHE QE 5.32
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.17, r4= 7.67,
igr1= 328, 329, 330,
igr2= 672, 676,
&end
#
# 24 ILE QG2 47 PHE QE 5.32
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.17, r4= 7.67,
igr1= 328, 329, 330,
igr2= 672, 676,
&end
#
# 24 ILE QG2 47 PHE QE 5.32
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.17, r4= 7.67,
igr1= 328, 329, 330,
igr2= 672, 676,
&end
#
# 24 ILE QG2 110 THR HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1527, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 110 THR HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1527, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 110 THR HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1527, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 111 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1539, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 111 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1539, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 111 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1539, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 117 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1639, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 117 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1639, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 117 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1639, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 117 LEU HA 6.03
&rst
ixpk= 0, nxpk= 0, iat= -1,1641, r1= 1.30, r2= 1.80, r3= 7.24, r4= 7.74,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 117 LEU HA 6.03
&rst
ixpk= 0, nxpk= 0, iat= -1,1641, r1= 1.30, r2= 1.80, r3= 7.24, r4= 7.74,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 117 LEU HA 6.03
&rst
ixpk= 0, nxpk= 0, iat= -1,1641, r1= 1.30, r2= 1.80, r3= 7.24, r4= 7.74,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 117 LEU HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1643, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 117 LEU HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1643, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 117 LEU HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1643, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 117 LEU HB3 5.52
&rst
ixpk= 0, nxpk= 0, iat= -1,1644, r1= 1.30, r2= 1.80, r3= 6.63, r4= 7.13,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 117 LEU HB3 5.52
&rst
ixpk= 0, nxpk= 0, iat= -1,1644, r1= 1.30, r2= 1.80, r3= 6.63, r4= 7.13,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 117 LEU HB3 5.52
&rst
ixpk= 0, nxpk= 0, iat= -1,1644, r1= 1.30, r2= 1.80, r3= 6.63, r4= 7.13,
igr1= 328, 329, 330,
&end
#
# 24 ILE QG2 117 LEU QD1 3.99
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
igr1= 328, 329, 330,
igr2=1648,1649,1650,
&end
#
# 24 ILE QG2 117 LEU QD1 3.99
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
igr1= 328, 329, 330,
igr2=1648,1649,1650,
&end
#
# 24 ILE QG2 117 LEU QD1 3.99
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
igr1= 328, 329, 330,
igr2=1648,1649,1650,
&end
#
# 25 ASP HN 25 ASP HA 4.54
&rst
ixpk= 0, nxpk= 0, iat= 341, 343, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 25 ASP HN 25 ASP HB2 4.64
&rst
ixpk= 0, nxpk= 0, iat= 341, 345, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14, &end
#
# 25 ASP HN 25 ASP HB3 4.12
&rst
ixpk= 0, nxpk= 0, iat= 341, 346, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62, &end
#
# 25 ASP HN 25 ASP HB3 4.12
&rst
ixpk= 0, nxpk= 0, iat= 341, 346, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62, &end
#
# 25 ASP HN 25 ASP HB3 4.12
&rst
ixpk= 0, nxpk= 0, iat= 341, 346, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62, &end
#
# 25 ASP HN 26 GLU HN 5.16
&rst
ixpk= 0, nxpk= 0, iat= 341, 353, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66, &end
#
# 25 ASP HN 26 GLU HN 5.16
&rst
ixpk= 0, nxpk= 0, iat= 341, 353, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66, &end
#
# 25 ASP HN 26 GLU HN 5.16
&rst
ixpk= 0, nxpk= 0, iat= 341, 353, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66, &end
#
# 25 ASP HN 26 GLU HN 5.28
&rst
ixpk= 0, nxpk= 0, iat= 341, 353, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 25 ASP HN 27 THR QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 341, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 374, 375, 376,
&end
#
# 25 ASP HN 27 THR QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 341, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 374, 375, 376,
&end
#
# 25 ASP HN 27 THR QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 341, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 374, 375, 376,
&end
#
# 25 ASP HN 31 LEU HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 341, 413, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 25 ASP HN 31 LEU HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 341, 413, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 25 ASP HN 31 LEU HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 341, 413, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 25 ASP HN 31 LEU HB3 5.21
&rst
ixpk= 0, nxpk= 0, iat= 341, 416, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71, &end
#
# 25 ASP HN 31 LEU HB3 5.21
&rst
ixpk= 0, nxpk= 0, iat= 341, 416, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71, &end
#
# 25 ASP HN 31 LEU HB3 5.21
&rst
ixpk= 0, nxpk= 0, iat= 341, 416, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71, &end
#
# 25 ASP HN 31 LEU QD2 5.54
&rst
ixpk= 0, nxpk= 0, iat= 341, -1, r1= 1.30, r2= 1.80, r3= 6.65, r4= 7.15,
igr2= 424, 425, 426,
&end
#
# 25 ASP HN 31 LEU QD2 5.54
&rst
ixpk= 0, nxpk= 0, iat= 341, -1, r1= 1.30, r2= 1.80, r3= 6.65, r4= 7.15,
igr2= 424, 425, 426,
&end
#
# 25 ASP HN 31 LEU QD2 5.54
&rst
ixpk= 0, nxpk= 0, iat= 341, -1, r1= 1.30, r2= 1.80, r3= 6.65, r4= 7.15,
igr2= 424, 425, 426,
&end
#
# 25 ASP HN 32 LYS HN 3.94
&rst
ixpk= 0, nxpk= 0, iat= 341, 430, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44, &end
#
# 25 ASP HN 32 LYS HN 3.94
&rst
ixpk= 0, nxpk= 0, iat= 341, 430, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44, &end
#
# 25 ASP HN 32 LYS HN 3.94
&rst
ixpk= 0, nxpk= 0, iat= 341, 430, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44, &end
#
# 25 ASP HN 32 LYS HB2 5.55
&rst
ixpk= 0, nxpk= 0, iat= 341, 434, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05, &end
#
# 25 ASP HN 32 LYS HB2 5.55
&rst
ixpk= 0, nxpk= 0, iat= 341, 434, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05, &end
#
# 25 ASP HN 32 LYS HB2 5.55
&rst
ixpk= 0, nxpk= 0, iat= 341, 434, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05, &end
#
# 25 ASP HN 33 PHE HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 341, 452, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 25 ASP HN 33 PHE HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 341, 452, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 25 ASP HN 33 PHE HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 341, 452, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 25 ASP HN 33 PHE QD 6.05
&rst
ixpk= 0, nxpk= 0, iat= 341, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2= 460, 468,
&end
#
# 25 ASP HN 33 PHE QD 6.05
&rst
ixpk= 0, nxpk= 0, iat= 341, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2= 460, 468,
&end
#
# 25 ASP HN 33 PHE QD 6.05
&rst
ixpk= 0, nxpk= 0, iat= 341, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2= 460, 468,
&end
#
# 25 ASP HN 34 THR HN 5.78
&rst
ixpk= 0, nxpk= 0, iat= 341, 472, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28, &end
#
# 25 ASP HN 34 THR HN 5.78
&rst
ixpk= 0, nxpk= 0, iat= 341, 472, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28, &end
#
# 25 ASP HN 34 THR HN 5.78
&rst
ixpk= 0, nxpk= 0, iat= 341, 472, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28, &end
#
# 25 ASP HA 25 ASP HB2 4.16
&rst
ixpk= 0, nxpk= 0, iat= 343, 345, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66, &end
#
# 25 ASP HA 25 ASP HB3 4.71
&rst
ixpk= 0, nxpk= 0, iat= 343, 346, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21, &end
#
# 25 ASP HA 26 GLU HN 2.97
&rst
ixpk= 0, nxpk= 0, iat= 343, 353, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 25 ASP HA 26 GLU HN 3.37
&rst
ixpk= 0, nxpk= 0, iat= 343, 353, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87, &end
#
# 25 ASP HA 26 GLU HN 3.37
&rst
ixpk= 0, nxpk= 0, iat= 343, 353, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87, &end
#
# 25 ASP HA 26 GLU HN 3.37
&rst
ixpk= 0, nxpk= 0, iat= 343, 353, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87, &end
#
# 25 ASP HA 26 GLU HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 343, 355, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 25 ASP HA 26 GLU HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 343, 355, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 25 ASP HA 26 GLU HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 343, 355, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 25 ASP HA 26 GLU HB3 5.16
&rst
ixpk= 0, nxpk= 0, iat= 343, 358, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66, &end
#
# 25 ASP HA 26 GLU HB3 5.16
&rst
ixpk= 0, nxpk= 0, iat= 343, 358, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66, &end
#
# 25 ASP HA 26 GLU HB3 5.16
&rst
ixpk= 0, nxpk= 0, iat= 343, 358, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66, &end
#
# 25 ASP HA 117 LEU QD1 5.67
&rst
ixpk= 0, nxpk= 0, iat= 343, -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
igr2=1648,1649,1650,
&end
#
# 25 ASP HA 117 LEU QD1 5.67
&rst
ixpk= 0, nxpk= 0, iat= 343, -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
igr2=1648,1649,1650,
&end
#
# 25 ASP HA 117 LEU QD1 5.67
&rst
ixpk= 0, nxpk= 0, iat= 343, -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
igr2=1648,1649,1650,
&end
#
# 25 ASP HA 117 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 343, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1652,1653,1654,
&end
#
# 25 ASP HA 117 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 343, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1652,1653,1654,
&end
#
# 25 ASP HA 117 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 343, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1652,1653,1654,
&end
#
# 25 ASP HB2 25 ASP HB3 3.41
&rst
ixpk= 0, nxpk= 0, iat= 345, 346, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91, &end
#
# 25 ASP HB2 26 GLU HN 4.24
&rst
ixpk= 0, nxpk= 0, iat= 345, 353, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74, &end
#
# 25 ASP HB2 26 GLU HN 4.24
&rst
ixpk= 0, nxpk= 0, iat= 345, 353, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74, &end
#
# 25 ASP HB2 26 GLU HN 4.24
&rst
ixpk= 0, nxpk= 0, iat= 345, 353, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74, &end
#
# 25 ASP HB2 26 GLU HN 5.72
&rst
ixpk= 0, nxpk= 0, iat= 345, 353, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 25 ASP HB2 32 LYS HN 5.86
&rst
ixpk= 0, nxpk= 0, iat= 345, 430, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36, &end
#
# 25 ASP HB2 32 LYS HN 5.86
&rst
ixpk= 0, nxpk= 0, iat= 345, 430, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36, &end
#
# 25 ASP HB2 32 LYS HN 5.86
&rst
ixpk= 0, nxpk= 0, iat= 345, 430, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36, &end
#
# 25 ASP HB2 32 LYS HB3 5.80
&rst
ixpk= 0, nxpk= 0, iat= 345, 435, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30, &end
#
# 25 ASP HB2 32 LYS HB3 5.80
&rst
ixpk= 0, nxpk= 0, iat= 345, 435, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30, &end
#
# 25 ASP HB2 32 LYS HB3 5.80
&rst
ixpk= 0, nxpk= 0, iat= 345, 435, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30, &end
#
# 25 ASP HB3 26 GLU HN 5.18
&rst
ixpk= 0, nxpk= 0, iat= 346, 353, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68, &end
#
# 25 ASP HB3 26 GLU HN 5.18
&rst
ixpk= 0, nxpk= 0, iat= 346, 353, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68, &end
#
# 25 ASP HB3 26 GLU HN 5.18
&rst
ixpk= 0, nxpk= 0, iat= 346, 353, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68, &end
#
# 25 ASP HB3 27 THR HB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 346, 372, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 25 ASP HB3 27 THR HB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 346, 372, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 25 ASP HB3 27 THR HB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 346, 372, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 25 ASP HB3 27 THR QG2 5.35
&rst
ixpk= 0, nxpk= 0, iat= 346, -1, r1= 1.30, r2= 1.80, r3= 6.43, r4= 6.93,
igr2= 374, 375, 376,
&end
#
# 25 ASP HB3 27 THR QG2 5.35
&rst
ixpk= 0, nxpk= 0, iat= 346, -1, r1= 1.30, r2= 1.80, r3= 6.43, r4= 6.93,
igr2= 374, 375, 376,
&end
#
# 25 ASP HB3 27 THR QG2 5.35
&rst
ixpk= 0, nxpk= 0, iat= 346, -1, r1= 1.30, r2= 1.80, r3= 6.43, r4= 6.93,
igr2= 374, 375, 376,
&end
#
# 25 ASP HB3 32 LYS HN 5.67
&rst
ixpk= 0, nxpk= 0, iat= 346, 430, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17, &end
#
# 25 ASP HB3 32 LYS HN 5.67
&rst
ixpk= 0, nxpk= 0, iat= 346, 430, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17, &end
#
# 25 ASP HB3 32 LYS HN 5.67
&rst
ixpk= 0, nxpk= 0, iat= 346, 430, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17, &end
#
# 25 ASP HB3 32 LYS HB2 5.35
&rst
ixpk= 0, nxpk= 0, iat= 346, 434, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85, &end
#
# 25 ASP HB3 32 LYS HB2 5.35
&rst
ixpk= 0, nxpk= 0, iat= 346, 434, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85, &end
#
# 25 ASP HB3 32 LYS HB2 5.35
&rst
ixpk= 0, nxpk= 0, iat= 346, 434, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85, &end
#
# 25 ASP HB3 32 LYS HB3 5.73
&rst
ixpk= 0, nxpk= 0, iat= 346, 435, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23, &end
#
# 25 ASP HB3 32 LYS HB3 5.73
&rst
ixpk= 0, nxpk= 0, iat= 346, 435, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23, &end
#
# 25 ASP HB3 32 LYS HB3 5.73
&rst
ixpk= 0, nxpk= 0, iat= 346, 435, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23, &end
#
# 25 ASP HB3 32 LYS HE3 5.49
&rst
ixpk= 0, nxpk= 0, iat= 346, 444, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99, &end
#
# 25 ASP HB3 32 LYS HE3 5.49
&rst
ixpk= 0, nxpk= 0, iat= 346, 444, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99, &end
#
# 25 ASP HB3 32 LYS HE3 5.49
&rst
ixpk= 0, nxpk= 0, iat= 346, 444, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99, &end
#
# 26 GLU HN 26 GLU HA 4.38
&rst
ixpk= 0, nxpk= 0, iat= 353, 355, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88, &end
#
# 26 GLU HN 26 GLU HB2 4.31
&rst
ixpk= 0, nxpk= 0, iat= 353, 357, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81, &end
#
# 26 GLU HN 26 GLU HB2 4.31
&rst
ixpk= 0, nxpk= 0, iat= 353, 357, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81, &end
#
# 26 GLU HN 26 GLU HB2 4.31
&rst
ixpk= 0, nxpk= 0, iat= 353, 357, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81, &end
#
# 26 GLU HN 26 GLU HB3 4.61
&rst
ixpk= 0, nxpk= 0, iat= 353, 358, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 26 GLU HN 26 GLU HB3 4.61
&rst
ixpk= 0, nxpk= 0, iat= 353, 358, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 26 GLU HN 26 GLU HB3 4.61
&rst
ixpk= 0, nxpk= 0, iat= 353, 358, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 26 GLU HN 26 GLU HG2 4.08
&rst
ixpk= 0, nxpk= 0, iat= 353, 360, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58, &end
#
# 26 GLU HN 26 GLU HG2 4.08
&rst
ixpk= 0, nxpk= 0, iat= 353, 360, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58, &end
#
# 26 GLU HN 26 GLU HG2 4.08
&rst
ixpk= 0, nxpk= 0, iat= 353, 360, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58, &end
#
# 26 GLU HN 26 GLU HG3 4.35
&rst
ixpk= 0, nxpk= 0, iat= 353, 361, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85, &end
#
# 26 GLU HN 26 GLU HG3 4.35
&rst
ixpk= 0, nxpk= 0, iat= 353, 361, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85, &end
#
# 26 GLU HN 26 GLU HG3 4.35
&rst
ixpk= 0, nxpk= 0, iat= 353, 361, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85, &end
#
# 26 GLU HN 27 THR HN 5.03
&rst
ixpk= 0, nxpk= 0, iat= 353, 368, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53, &end
#
# 26 GLU HN 27 THR HN 5.03
&rst
ixpk= 0, nxpk= 0, iat= 353, 368, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53, &end
#
# 26 GLU HN 27 THR HN 5.03
&rst
ixpk= 0, nxpk= 0, iat= 353, 368, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53, &end
#
# 26 GLU HN 27 THR QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 353, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 374, 375, 376,
&end
#
# 26 GLU HN 27 THR QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 353, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 374, 375, 376,
&end
#
# 26 GLU HN 27 THR QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 353, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 374, 375, 376,
&end
#
# 26 GLU HN 31 LEU QD2 5.26
&rst
ixpk= 0, nxpk= 0, iat= 353, -1, r1= 1.30, r2= 1.80, r3= 6.32, r4= 6.82,
igr2= 424, 425, 426,
&end
#
# 26 GLU HN 31 LEU QD2 5.26
&rst
ixpk= 0, nxpk= 0, iat= 353, -1, r1= 1.30, r2= 1.80, r3= 6.32, r4= 6.82,
igr2= 424, 425, 426,
&end
#
# 26 GLU HN 31 LEU QD2 5.26
&rst
ixpk= 0, nxpk= 0, iat= 353, -1, r1= 1.30, r2= 1.80, r3= 6.32, r4= 6.82,
igr2= 424, 425, 426,
&end
#
# 26 GLU HN 32 LYS HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 353, 430, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 26 GLU HN 32 LYS HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 353, 430, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 26 GLU HN 32 LYS HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 353, 430, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 26 GLU HN 117 LEU HN 5.97
&rst
ixpk= 0, nxpk= 0, iat= 353,1639, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47, &end
#
# 26 GLU HN 117 LEU HN 5.97
&rst
ixpk= 0, nxpk= 0, iat= 353,1639, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47, &end
#
# 26 GLU HN 117 LEU HN 5.97
&rst
ixpk= 0, nxpk= 0, iat= 353,1639, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47, &end
#
# 26 GLU HN 117 LEU QD2 5.06
&rst
ixpk= 0, nxpk= 0, iat= 353, -1, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
igr2=1652,1653,1654,
&end
#
# 26 GLU HN 117 LEU QD2 5.06
&rst
ixpk= 0, nxpk= 0, iat= 353, -1, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
igr2=1652,1653,1654,
&end
#
# 26 GLU HN 117 LEU QD2 5.06
&rst
ixpk= 0, nxpk= 0, iat= 353, -1, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
igr2=1652,1653,1654,
&end
#
# 26 GLU HA 26 GLU HB3 4.11
&rst
ixpk= 0, nxpk= 0, iat= 355, 358, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 26 GLU HA 26 GLU HG3 5.50
&rst
ixpk= 0, nxpk= 0, iat= 355, 361, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 26 GLU HA 27 THR HN 3.35
&rst
ixpk= 0, nxpk= 0, iat= 355, 368, r1= 1.30, r2= 1.80, r3= 3.35, r4= 3.85, &end
#
# 26 GLU HA 27 THR HN 3.35
&rst
ixpk= 0, nxpk= 0, iat= 355, 368, r1= 1.30, r2= 1.80, r3= 3.35, r4= 3.85, &end
#
# 26 GLU HA 27 THR HN 3.35
&rst
ixpk= 0, nxpk= 0, iat= 355, 368, r1= 1.30, r2= 1.80, r3= 3.35, r4= 3.85, &end
#
# 26 GLU HA 31 LEU HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 355, 416, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 26 GLU HA 31 LEU HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 355, 416, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 26 GLU HA 31 LEU HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 355, 416, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 26 GLU HA 31 LEU QD2 3.95
&rst
ixpk= 0, nxpk= 0, iat= 355, -1, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr2= 424, 425, 426,
&end
#
# 26 GLU HA 31 LEU QD2 3.95
&rst
ixpk= 0, nxpk= 0, iat= 355, -1, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr2= 424, 425, 426,
&end
#
# 26 GLU HA 31 LEU QD2 3.95
&rst
ixpk= 0, nxpk= 0, iat= 355, -1, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr2= 424, 425, 426,
&end
#
# 26 GLU HA 32 LYS HN 5.48
&rst
ixpk= 0, nxpk= 0, iat= 355, 430, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98, &end
#
# 26 GLU HA 32 LYS HN 5.48
&rst
ixpk= 0, nxpk= 0, iat= 355, 430, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98, &end
#
# 26 GLU HA 32 LYS HN 5.48
&rst
ixpk= 0, nxpk= 0, iat= 355, 430, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98, &end
#
# 26 GLU HA 117 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 355,1639, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 26 GLU HA 117 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 355,1639, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 26 GLU HA 117 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 355,1639, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 26 GLU HB2 27 THR HN 5.04
&rst
ixpk= 0, nxpk= 0, iat= 357, 368, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54, &end
#
# 26 GLU HB2 27 THR HN 5.04
&rst
ixpk= 0, nxpk= 0, iat= 357, 368, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54, &end
#
# 26 GLU HB2 27 THR HN 5.04
&rst
ixpk= 0, nxpk= 0, iat= 357, 368, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54, &end
#
# 26 GLU HB2 31 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 357, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 424, 425, 426,
&end
#
# 26 GLU HB2 31 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 357, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 424, 425, 426,
&end
#
# 26 GLU HB2 31 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 357, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 424, 425, 426,
&end
#
# 26 GLU HB2 116 SER HA 4.47
&rst
ixpk= 0, nxpk= 0, iat= 357,1630, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97, &end
#
# 26 GLU HB2 116 SER HA 4.47
&rst
ixpk= 0, nxpk= 0, iat= 357,1630, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97, &end
#
# 26 GLU HB2 116 SER HA 4.47
&rst
ixpk= 0, nxpk= 0, iat= 357,1630, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97, &end
#
# 26 GLU HB2 117 LEU HN 4.44
&rst
ixpk= 0, nxpk= 0, iat= 357,1639, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94, &end
#
# 26 GLU HB2 117 LEU HN 4.44
&rst
ixpk= 0, nxpk= 0, iat= 357,1639, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94, &end
#
# 26 GLU HB2 117 LEU HN 4.44
&rst
ixpk= 0, nxpk= 0, iat= 357,1639, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94, &end
#
# 26 GLU HB3 26 GLU HB2 2.85
&rst
ixpk= 0, nxpk= 0, iat= 358, 357, r1= 1.30, r2= 1.80, r3= 2.85, r4= 3.35, &end
#
# 26 GLU HB3 26 GLU HG3 3.61
&rst
ixpk= 0, nxpk= 0, iat= 358, 361, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11, &end
#
# 26 GLU HB3 27 THR HN 5.16
&rst
ixpk= 0, nxpk= 0, iat= 358, 368, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66, &end
#
# 26 GLU HB3 27 THR HN 5.16
&rst
ixpk= 0, nxpk= 0, iat= 358, 368, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66, &end
#
# 26 GLU HB3 27 THR HN 5.16
&rst
ixpk= 0, nxpk= 0, iat= 358, 368, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66, &end
#
# 26 GLU HB3 31 LEU HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 358, 413, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 26 GLU HB3 31 LEU HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 358, 413, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 26 GLU HB3 31 LEU HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 358, 413, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 26 GLU HB3 31 LEU QD2 4.46
&rst
ixpk= 0, nxpk= 0, iat= 358, -1, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
igr2= 424, 425, 426,
&end
#
# 26 GLU HB3 31 LEU QD2 4.46
&rst
ixpk= 0, nxpk= 0, iat= 358, -1, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
igr2= 424, 425, 426,
&end
#
# 26 GLU HB3 31 LEU QD2 4.46
&rst
ixpk= 0, nxpk= 0, iat= 358, -1, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
igr2= 424, 425, 426,
&end
#
# 26 GLU HB3 116 SER HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 358,1630, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 26 GLU HB3 116 SER HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 358,1630, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 26 GLU HB3 116 SER HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 358,1630, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 26 GLU HB3 117 LEU HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 358,1643, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 26 GLU HB3 117 LEU HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 358,1643, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 26 GLU HB3 117 LEU HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 358,1643, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 26 GLU HG2 27 THR HA 5.83
&rst
ixpk= 0, nxpk= 0, iat= 360, 370, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33, &end
#
# 26 GLU HG2 27 THR HA 5.83
&rst
ixpk= 0, nxpk= 0, iat= 360, 370, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33, &end
#
# 26 GLU HG2 27 THR HA 5.83
&rst
ixpk= 0, nxpk= 0, iat= 360, 370, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33, &end
#
# 26 GLU HG2 116 SER HA 5.10
&rst
ixpk= 0, nxpk= 0, iat= 360,1630, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, &end
#
# 26 GLU HG2 116 SER HA 5.10
&rst
ixpk= 0, nxpk= 0, iat= 360,1630, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, &end
#
# 26 GLU HG2 116 SER HA 5.10
&rst
ixpk= 0, nxpk= 0, iat= 360,1630, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, &end
#
# 26 GLU HG2 117 LEU HN 4.87
&rst
ixpk= 0, nxpk= 0, iat= 360,1639, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37, &end
#
# 26 GLU HG2 117 LEU HN 4.87
&rst
ixpk= 0, nxpk= 0, iat= 360,1639, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37, &end
#
# 26 GLU HG2 117 LEU HN 4.87
&rst
ixpk= 0, nxpk= 0, iat= 360,1639, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37, &end
#
# 26 GLU HG2 117 LEU HG 5.45
&rst
ixpk= 0, nxpk= 0, iat= 360,1646, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95, &end
#
# 26 GLU HG2 117 LEU HG 5.45
&rst
ixpk= 0, nxpk= 0, iat= 360,1646, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95, &end
#
# 26 GLU HG2 117 LEU HG 5.45
&rst
ixpk= 0, nxpk= 0, iat= 360,1646, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95, &end
#
# 26 GLU HG3 31 LEU QD2 5.33
&rst
ixpk= 0, nxpk= 0, iat= 361, -1, r1= 1.30, r2= 1.80, r3= 6.40, r4= 6.90,
igr2= 424, 425, 426,
&end
#
# 26 GLU HG3 31 LEU QD2 5.33
&rst
ixpk= 0, nxpk= 0, iat= 361, -1, r1= 1.30, r2= 1.80, r3= 6.40, r4= 6.90,
igr2= 424, 425, 426,
&end
#
# 26 GLU HG3 31 LEU QD2 5.33
&rst
ixpk= 0, nxpk= 0, iat= 361, -1, r1= 1.30, r2= 1.80, r3= 6.40, r4= 6.90,
igr2= 424, 425, 426,
&end
#
# 26 GLU HG3 116 SER HA 5.32
&rst
ixpk= 0, nxpk= 0, iat= 361,1630, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82, &end
#
# 26 GLU HG3 116 SER HA 5.32
&rst
ixpk= 0, nxpk= 0, iat= 361,1630, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82, &end
#
# 26 GLU HG3 116 SER HA 5.32
&rst
ixpk= 0, nxpk= 0, iat= 361,1630, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82, &end
#
# 26 GLU HG3 117 LEU QD2 5.78
&rst
ixpk= 0, nxpk= 0, iat= 361, -1, r1= 1.30, r2= 1.80, r3= 6.94, r4= 7.44,
igr2=1652,1653,1654,
&end
#
# 26 GLU HG3 117 LEU QD2 5.78
&rst
ixpk= 0, nxpk= 0, iat= 361, -1, r1= 1.30, r2= 1.80, r3= 6.94, r4= 7.44,
igr2=1652,1653,1654,
&end
#
# 26 GLU HG3 117 LEU QD2 5.78
&rst
ixpk= 0, nxpk= 0, iat= 361, -1, r1= 1.30, r2= 1.80, r3= 6.94, r4= 7.44,
igr2=1652,1653,1654,
&end
#
# 27 THR HN 27 THR HA 4.06
&rst
ixpk= 0, nxpk= 0, iat= 368, 370, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56, &end
#
# 27 THR HN 27 THR HB 4.41
&rst
ixpk= 0, nxpk= 0, iat= 368, 372, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, &end
#
# 27 THR HN 27 THR HB 4.41
&rst
ixpk= 0, nxpk= 0, iat= 368, 372, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, &end
#
# 27 THR HN 27 THR HB 4.41
&rst
ixpk= 0, nxpk= 0, iat= 368, 372, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, &end
#
# 27 THR HN 27 THR QG2 4.15
&rst
ixpk= 0, nxpk= 0, iat= 368, -1, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
igr2= 374, 375, 376,
&end
#
# 27 THR HN 27 THR QG2 4.15
&rst
ixpk= 0, nxpk= 0, iat= 368, -1, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
igr2= 374, 375, 376,
&end
#
# 27 THR HN 27 THR QG2 4.15
&rst
ixpk= 0, nxpk= 0, iat= 368, -1, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48,
igr2= 374, 375, 376,
&end
#
# 27 THR HN 28 GLU HN 5.54
&rst
ixpk= 0, nxpk= 0, iat= 368, 382, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04, &end
#
# 27 THR HN 28 GLU HN 5.54
&rst
ixpk= 0, nxpk= 0, iat= 368, 382, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04, &end
#
# 27 THR HN 28 GLU HN 5.54
&rst
ixpk= 0, nxpk= 0, iat= 368, 382, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04, &end
#
# 27 THR HN 29 GLY HN 5.53
&rst
ixpk= 0, nxpk= 0, iat= 368, 397, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03, &end
#
# 27 THR HN 29 GLY HN 5.53
&rst
ixpk= 0, nxpk= 0, iat= 368, 397, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03, &end
#
# 27 THR HN 29 GLY HN 5.53
&rst
ixpk= 0, nxpk= 0, iat= 368, 397, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03, &end
#
# 27 THR HN 30 GLY HN 4.37
&rst
ixpk= 0, nxpk= 0, iat= 368, 404, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87, &end
#
# 27 THR HN 30 GLY HN 4.37
&rst
ixpk= 0, nxpk= 0, iat= 368, 404, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87, &end
#
# 27 THR HN 30 GLY HN 4.37
&rst
ixpk= 0, nxpk= 0, iat= 368, 404, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87, &end
#
# 27 THR HN 30 GLY HA3 4.28
&rst
ixpk= 0, nxpk= 0, iat= 368, 407, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78, &end
#
# 27 THR HN 30 GLY HA3 4.28
&rst
ixpk= 0, nxpk= 0, iat= 368, 407, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78, &end
#
# 27 THR HN 30 GLY HA3 4.28
&rst
ixpk= 0, nxpk= 0, iat= 368, 407, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78, &end
#
# 27 THR HN 31 LEU HA 4.54
&rst
ixpk= 0, nxpk= 0, iat= 368, 413, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 27 THR HN 31 LEU HA 4.54
&rst
ixpk= 0, nxpk= 0, iat= 368, 413, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 27 THR HN 31 LEU HA 4.54
&rst
ixpk= 0, nxpk= 0, iat= 368, 413, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 27 THR HN 31 LEU QD2 4.59
&rst
ixpk= 0, nxpk= 0, iat= 368, -1, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
igr2= 424, 425, 426,
&end
#
# 27 THR HN 31 LEU QD2 4.59
&rst
ixpk= 0, nxpk= 0, iat= 368, -1, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
igr2= 424, 425, 426,
&end
#
# 27 THR HN 31 LEU QD2 4.59
&rst
ixpk= 0, nxpk= 0, iat= 368, -1, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
igr2= 424, 425, 426,
&end
#
# 27 THR HN 32 LYS HN 5.07
&rst
ixpk= 0, nxpk= 0, iat= 368, 430, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, &end
#
# 27 THR HN 32 LYS HN 5.07
&rst
ixpk= 0, nxpk= 0, iat= 368, 430, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, &end
#
# 27 THR HN 32 LYS HN 5.07
&rst
ixpk= 0, nxpk= 0, iat= 368, 430, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, &end
#
# 27 THR HA 27 THR HB 3.82
&rst
ixpk= 0, nxpk= 0, iat= 370, 372, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32, &end
#
# 27 THR HA 27 THR QG2 3.73
&rst
ixpk= 0, nxpk= 0, iat= 370, -1, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
igr2= 374, 375, 376,
&end
#
# 27 THR HA 27 THR QG2 3.73
&rst
ixpk= 0, nxpk= 0, iat= 370, -1, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
igr2= 374, 375, 376,
&end
#
# 27 THR HA 27 THR QG2 3.73
&rst
ixpk= 0, nxpk= 0, iat= 370, -1, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
igr2= 374, 375, 376,
&end
#
# 27 THR HA 28 GLU HN 3.77
&rst
ixpk= 0, nxpk= 0, iat= 370, 382, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27, &end
#
# 27 THR HA 28 GLU HN 3.77
&rst
ixpk= 0, nxpk= 0, iat= 370, 382, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27, &end
#
# 27 THR HA 28 GLU HN 3.77
&rst
ixpk= 0, nxpk= 0, iat= 370, 382, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27, &end
#
# 27 THR HA 28 GLU HB3 4.99
&rst
ixpk= 0, nxpk= 0, iat= 370, 387, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49, &end
#
# 27 THR HA 28 GLU HB3 4.99
&rst
ixpk= 0, nxpk= 0, iat= 370, 387, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49, &end
#
# 27 THR HA 28 GLU HB3 4.99
&rst
ixpk= 0, nxpk= 0, iat= 370, 387, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49, &end
#
# 27 THR HA 29 GLY HN 4.73
&rst
ixpk= 0, nxpk= 0, iat= 370, 397, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, &end
#
# 27 THR HA 29 GLY HN 4.73
&rst
ixpk= 0, nxpk= 0, iat= 370, 397, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, &end
#
# 27 THR HA 29 GLY HN 4.73
&rst
ixpk= 0, nxpk= 0, iat= 370, 397, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, &end
#
# 27 THR HA 30 GLY HN 5.93
&rst
ixpk= 0, nxpk= 0, iat= 370, 404, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43, &end
#
# 27 THR HA 30 GLY HN 5.93
&rst
ixpk= 0, nxpk= 0, iat= 370, 404, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43, &end
#
# 27 THR HA 30 GLY HN 5.93
&rst
ixpk= 0, nxpk= 0, iat= 370, 404, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43, &end
#
# 27 THR HB 27 THR QG2 3.50
&rst
ixpk= 0, nxpk= 0, iat= 372, -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
igr2= 374, 375, 376,
&end
#
# 27 THR HB 28 GLU HN 3.95
&rst
ixpk= 0, nxpk= 0, iat= 372, 382, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45, &end
#
# 27 THR HB 28 GLU HN 3.95
&rst
ixpk= 0, nxpk= 0, iat= 372, 382, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45, &end
#
# 27 THR HB 28 GLU HN 3.95
&rst
ixpk= 0, nxpk= 0, iat= 372, 382, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45, &end
#
# 27 THR HB 29 GLY HN 4.96
&rst
ixpk= 0, nxpk= 0, iat= 372, 397, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46, &end
#
# 27 THR HB 29 GLY HN 4.96
&rst
ixpk= 0, nxpk= 0, iat= 372, 397, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46, &end
#
# 27 THR HB 29 GLY HN 4.96
&rst
ixpk= 0, nxpk= 0, iat= 372, 397, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46, &end
#
# 27 THR HB 30 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 372, 404, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 27 THR HB 30 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 372, 404, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 27 THR HB 30 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 372, 404, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 27 THR HB 32 LYS HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 372, 430, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 27 THR HB 32 LYS HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 372, 430, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 27 THR HB 32 LYS HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 372, 430, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 27 THR QG2 28 GLU HN 4.81
&rst
ixpk= 0, nxpk= 0, iat= -1, 382, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr1= 374, 375, 376,
&end
#
# 27 THR QG2 28 GLU HN 4.81
&rst
ixpk= 0, nxpk= 0, iat= -1, 382, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr1= 374, 375, 376,
&end
#
# 27 THR QG2 28 GLU HN 4.81
&rst
ixpk= 0, nxpk= 0, iat= -1, 382, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr1= 374, 375, 376,
&end
#
# 27 THR QG2 29 GLY HN 5.14
&rst
ixpk= 0, nxpk= 0, iat= -1, 397, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 374, 375, 376,
&end
#
# 27 THR QG2 29 GLY HN 5.14
&rst
ixpk= 0, nxpk= 0, iat= -1, 397, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 374, 375, 376,
&end
#
# 27 THR QG2 29 GLY HN 5.14
&rst
ixpk= 0, nxpk= 0, iat= -1, 397, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 374, 375, 376,
&end
#
# 27 THR QG2 30 GLY HN 5.53
&rst
ixpk= 0, nxpk= 0, iat= -1, 404, r1= 1.30, r2= 1.80, r3= 6.64, r4= 7.14,
igr1= 374, 375, 376,
&end
#
# 27 THR QG2 30 GLY HN 5.53
&rst
ixpk= 0, nxpk= 0, iat= -1, 404, r1= 1.30, r2= 1.80, r3= 6.64, r4= 7.14,
igr1= 374, 375, 376,
&end
#
# 27 THR QG2 30 GLY HN 5.53
&rst
ixpk= 0, nxpk= 0, iat= -1, 404, r1= 1.30, r2= 1.80, r3= 6.64, r4= 7.14,
igr1= 374, 375, 376,
&end
#
# 27 THR QG2 32 LYS HN 5.18
&rst
ixpk= 0, nxpk= 0, iat= -1, 430, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
igr1= 374, 375, 376,
&end
#
# 27 THR QG2 32 LYS HN 5.18
&rst
ixpk= 0, nxpk= 0, iat= -1, 430, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
igr1= 374, 375, 376,
&end
#
# 27 THR QG2 32 LYS HN 5.18
&rst
ixpk= 0, nxpk= 0, iat= -1, 430, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
igr1= 374, 375, 376,
&end
#
# 27 THR QG2 32 LYS HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 432, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 374, 375, 376,
&end
#
# 27 THR QG2 32 LYS HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 432, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 374, 375, 376,
&end
#
# 27 THR QG2 32 LYS HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 432, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 374, 375, 376,
&end
#
# 27 THR QG2 32 LYS HE2 5.41
&rst
ixpk= 0, nxpk= 0, iat= -1, 443, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
igr1= 374, 375, 376,
&end
#
# 27 THR QG2 32 LYS HE2 5.41
&rst
ixpk= 0, nxpk= 0, iat= -1, 443, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
igr1= 374, 375, 376,
&end
#
# 27 THR QG2 32 LYS HE2 5.41
&rst
ixpk= 0, nxpk= 0, iat= -1, 443, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
igr1= 374, 375, 376,
&end
#
# 27 THR QG2 32 LYS QG 3.89
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr1= 374, 375, 376,
igr2= 437, 438,
&end
#
# 27 THR QG2 32 LYS QG 3.89
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr1= 374, 375, 376,
igr2= 437, 438,
&end
#
# 27 THR QG2 32 LYS QG 3.89
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr1= 374, 375, 376,
igr2= 437, 438,
&end
#
# 28 GLU HN 28 GLU HA 4.19
&rst
ixpk= 0, nxpk= 0, iat= 382, 384, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69, &end
#
# 28 GLU HN 28 GLU HB2 4.15
&rst
ixpk= 0, nxpk= 0, iat= 382, 386, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65, &end
#
# 28 GLU HN 28 GLU HB2 4.15
&rst
ixpk= 0, nxpk= 0, iat= 382, 386, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65, &end
#
# 28 GLU HN 28 GLU HB2 4.15
&rst
ixpk= 0, nxpk= 0, iat= 382, 386, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65, &end
#
# 28 GLU HN 28 GLU HB3 4.04
&rst
ixpk= 0, nxpk= 0, iat= 382, 387, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, &end
#
# 28 GLU HN 28 GLU HB3 4.04
&rst
ixpk= 0, nxpk= 0, iat= 382, 387, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, &end
#
# 28 GLU HN 28 GLU HB3 4.04
&rst
ixpk= 0, nxpk= 0, iat= 382, 387, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, &end
#
# 28 GLU HN 28 GLU HG2 4.61
&rst
ixpk= 0, nxpk= 0, iat= 382, 389, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 28 GLU HN 28 GLU HG2 4.61
&rst
ixpk= 0, nxpk= 0, iat= 382, 389, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 28 GLU HN 28 GLU HG2 4.61
&rst
ixpk= 0, nxpk= 0, iat= 382, 389, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 28 GLU HN 29 GLY HN 4.16
&rst
ixpk= 0, nxpk= 0, iat= 382, 397, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66, &end
#
# 28 GLU HN 29 GLY HN 4.16
&rst
ixpk= 0, nxpk= 0, iat= 382, 397, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66, &end
#
# 28 GLU HN 29 GLY HN 4.16
&rst
ixpk= 0, nxpk= 0, iat= 382, 397, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66, &end
#
# 28 GLU HN 29 GLY HN 5.28
&rst
ixpk= 0, nxpk= 0, iat= 382, 397, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 28 GLU HN 29 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 382, 400, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 28 GLU HN 29 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 382, 400, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 28 GLU HN 29 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 382, 400, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 28 GLU HN 30 GLY HN 5.35
&rst
ixpk= 0, nxpk= 0, iat= 382, 404, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85, &end
#
# 28 GLU HN 30 GLY HN 5.35
&rst
ixpk= 0, nxpk= 0, iat= 382, 404, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85, &end
#
# 28 GLU HN 30 GLY HN 5.35
&rst
ixpk= 0, nxpk= 0, iat= 382, 404, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85, &end
#
# 28 GLU HA 28 GLU HB2 3.61
&rst
ixpk= 0, nxpk= 0, iat= 384, 386, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11, &end
#
# 28 GLU HA 28 GLU HB3 3.26
&rst
ixpk= 0, nxpk= 0, iat= 384, 387, r1= 1.30, r2= 1.80, r3= 3.26, r4= 3.76, &end
#
# 28 GLU HA 28 GLU HB3 3.26
&rst
ixpk= 0, nxpk= 0, iat= 384, 387, r1= 1.30, r2= 1.80, r3= 3.26, r4= 3.76, &end
#
# 28 GLU HA 28 GLU HB3 3.26
&rst
ixpk= 0, nxpk= 0, iat= 384, 387, r1= 1.30, r2= 1.80, r3= 3.26, r4= 3.76, &end
#
# 28 GLU HA 28 GLU HG2 3.86
&rst
ixpk= 0, nxpk= 0, iat= 384, 389, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 28 GLU HA 28 GLU HG2 3.86
&rst
ixpk= 0, nxpk= 0, iat= 384, 389, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 28 GLU HA 28 GLU HG2 3.86
&rst
ixpk= 0, nxpk= 0, iat= 384, 389, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 28 GLU HA 28 GLU HG3 4.43
&rst
ixpk= 0, nxpk= 0, iat= 384, 390, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93, &end
#
# 28 GLU HA 28 GLU HG3 4.43
&rst
ixpk= 0, nxpk= 0, iat= 384, 390, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93, &end
#
# 28 GLU HA 28 GLU HG3 4.43
&rst
ixpk= 0, nxpk= 0, iat= 384, 390, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93, &end
#
# 28 GLU HA 29 GLY HN 3.50 (#)
&rst
ixpk= 0, nxpk= 0, iat= 384, 397, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 28 GLU HA 29 GLY HN 4.40
&rst
ixpk= 0, nxpk= 0, iat= 384, 397, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 28 GLU HA 30 GLY HN 4.77
&rst
ixpk= 0, nxpk= 0, iat= 384, 404, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27, &end
#
# 28 GLU HA 30 GLY HN 4.77
&rst
ixpk= 0, nxpk= 0, iat= 384, 404, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27, &end
#
# 28 GLU HA 30 GLY HN 4.77
&rst
ixpk= 0, nxpk= 0, iat= 384, 404, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27, &end
#
# 28 GLU HB2 28 GLU HG2 3.42
&rst
ixpk= 0, nxpk= 0, iat= 386, 389, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92, &end
#
# 28 GLU HB2 29 GLY HN 4.32
&rst
ixpk= 0, nxpk= 0, iat= 386, 397, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82, &end
#
# 28 GLU HB2 29 GLY HN 4.32
&rst
ixpk= 0, nxpk= 0, iat= 386, 397, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82, &end
#
# 28 GLU HB2 29 GLY HN 4.32
&rst
ixpk= 0, nxpk= 0, iat= 386, 397, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82, &end
#
# 28 GLU HB2 29 GLY HN 5.72
&rst
ixpk= 0, nxpk= 0, iat= 386, 397, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 28 GLU HB2 30 GLY HN 5.41
&rst
ixpk= 0, nxpk= 0, iat= 386, 404, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91, &end
#
# 28 GLU HB2 30 GLY HN 5.41
&rst
ixpk= 0, nxpk= 0, iat= 386, 404, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91, &end
#
# 28 GLU HB2 30 GLY HN 5.41
&rst
ixpk= 0, nxpk= 0, iat= 386, 404, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91, &end
#
# 28 GLU HB3 28 GLU HB2 2.84
&rst
ixpk= 0, nxpk= 0, iat= 387, 386, r1= 1.30, r2= 1.80, r3= 2.84, r4= 3.34, &end
#
# 28 GLU HB3 28 GLU HG2 3.20
&rst
ixpk= 0, nxpk= 0, iat= 387, 389, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 28 GLU HB3 28 GLU HG2 3.20
&rst
ixpk= 0, nxpk= 0, iat= 387, 389, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 28 GLU HB3 28 GLU HG2 3.20
&rst
ixpk= 0, nxpk= 0, iat= 387, 389, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 28 GLU HB3 29 GLY HN 4.57
&rst
ixpk= 0, nxpk= 0, iat= 387, 397, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07, &end
#
# 28 GLU HB3 29 GLY HN 4.57
&rst
ixpk= 0, nxpk= 0, iat= 387, 397, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07, &end
#
# 28 GLU HB3 29 GLY HN 4.57
&rst
ixpk= 0, nxpk= 0, iat= 387, 397, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07, &end
#
# 28 GLU HB3 29 GLY HA2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 387, 399, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 28 GLU HB3 29 GLY HA2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 387, 399, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 28 GLU HB3 29 GLY HA2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 387, 399, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 28 GLU HG2 29 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 389, 397, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 28 GLU HG2 29 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 389, 397, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 28 GLU HG2 29 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 389, 397, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 28 GLU HG2 30 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 389, 404, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 28 GLU HG2 30 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 389, 404, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 28 GLU HG2 30 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 389, 404, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 28 GLU HG3 29 GLY HN 5.04
&rst
ixpk= 0, nxpk= 0, iat= 390, 397, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54, &end
#
# 28 GLU HG3 29 GLY HN 5.04
&rst
ixpk= 0, nxpk= 0, iat= 390, 397, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54, &end
#
# 28 GLU HG3 29 GLY HN 5.04
&rst
ixpk= 0, nxpk= 0, iat= 390, 397, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54, &end
#
# 29 GLY HN 29 GLY HA2 3.63
&rst
ixpk= 0, nxpk= 0, iat= 397, 399, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13, &end
#
# 29 GLY HN 29 GLY HA3 3.32
&rst
ixpk= 0, nxpk= 0, iat= 397, 400, r1= 1.30, r2= 1.80, r3= 3.32, r4= 3.82, &end
#
# 29 GLY HN 30 GLY HN 3.55
&rst
ixpk= 0, nxpk= 0, iat= 397, 404, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05, &end
#
# 29 GLY HN 30 GLY HN 3.55
&rst
ixpk= 0, nxpk= 0, iat= 397, 404, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05, &end
#
# 29 GLY HN 30 GLY HN 3.55
&rst
ixpk= 0, nxpk= 0, iat= 397, 404, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05, &end
#
# 29 GLY HN 30 GLY HN 5.28
&rst
ixpk= 0, nxpk= 0, iat= 397, 404, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 29 GLY HN 110 THR QG2 4.82
&rst
ixpk= 0, nxpk= 0, iat= 397, -1, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,
igr2=1531,1532,1533,
&end
#
# 29 GLY HN 110 THR QG2 4.82
&rst
ixpk= 0, nxpk= 0, iat= 397, -1, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,
igr2=1531,1532,1533,
&end
#
# 29 GLY HN 110 THR QG2 4.82
&rst
ixpk= 0, nxpk= 0, iat= 397, -1, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,
igr2=1531,1532,1533,
&end
#
# 29 GLY HA2 29 GLY HA3 3.26
&rst
ixpk= 0, nxpk= 0, iat= 399, 400, r1= 1.30, r2= 1.80, r3= 3.26, r4= 3.76, &end
#
# 29 GLY HA2 30 GLY HN 2.97
&rst
ixpk= 0, nxpk= 0, iat= 399, 404, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 29 GLY HA2 30 GLY HN 4.48
&rst
ixpk= 0, nxpk= 0, iat= 399, 404, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98, &end
#
# 29 GLY HA2 110 THR QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 399, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1531,1532,1533,
&end
#
# 29 GLY HA2 110 THR QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 399, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1531,1532,1533,
&end
#
# 29 GLY HA2 110 THR QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 399, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1531,1532,1533,
&end
#
# 29 GLY HA2 112 PRO HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 399,1559, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 29 GLY HA2 112 PRO HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 399,1559, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 29 GLY HA2 112 PRO HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 399,1559, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 29 GLY HA3 30 GLY HN 4.36
&rst
ixpk= 0, nxpk= 0, iat= 400, 404, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86, &end
#
# 29 GLY HA3 110 THR QG2 5.85
&rst
ixpk= 0, nxpk= 0, iat= 400, -1, r1= 1.30, r2= 1.80, r3= 7.03, r4= 7.53,
igr2=1531,1532,1533,
&end
#
# 29 GLY HA3 110 THR QG2 5.85
&rst
ixpk= 0, nxpk= 0, iat= 400, -1, r1= 1.30, r2= 1.80, r3= 7.03, r4= 7.53,
igr2=1531,1532,1533,
&end
#
# 29 GLY HA3 110 THR QG2 5.85
&rst
ixpk= 0, nxpk= 0, iat= 400, -1, r1= 1.30, r2= 1.80, r3= 7.03, r4= 7.53,
igr2=1531,1532,1533,
&end
#
# 30 GLY HN 30 GLY HA2 4.73
&rst
ixpk= 0, nxpk= 0, iat= 404, 406, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, &end
#
# 30 GLY HN 30 GLY HA3 3.78
&rst
ixpk= 0, nxpk= 0, iat= 404, 407, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28, &end
#
# 30 GLY HN 31 LEU HN 5.03
&rst
ixpk= 0, nxpk= 0, iat= 404, 411, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53, &end
#
# 30 GLY HN 31 LEU HN 5.03
&rst
ixpk= 0, nxpk= 0, iat= 404, 411, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53, &end
#
# 30 GLY HN 31 LEU HN 5.03
&rst
ixpk= 0, nxpk= 0, iat= 404, 411, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53, &end
#
# 30 GLY HN 31 LEU HN 5.28
&rst
ixpk= 0, nxpk= 0, iat= 404, 411, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 30 GLY HN 31 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 404, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 424, 425, 426,
&end
#
# 30 GLY HN 31 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 404, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 424, 425, 426,
&end
#
# 30 GLY HN 31 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 404, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 424, 425, 426,
&end
#
# 30 GLY HN 110 THR QG2 4.28
&rst
ixpk= 0, nxpk= 0, iat= 404, -1, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
igr2=1531,1532,1533,
&end
#
# 30 GLY HN 110 THR QG2 4.28
&rst
ixpk= 0, nxpk= 0, iat= 404, -1, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
igr2=1531,1532,1533,
&end
#
# 30 GLY HN 110 THR QG2 4.28
&rst
ixpk= 0, nxpk= 0, iat= 404, -1, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
igr2=1531,1532,1533,
&end
#
# 30 GLY HN 112 PRO HA 5.97
&rst
ixpk= 0, nxpk= 0, iat= 404,1559, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47, &end
#
# 30 GLY HN 112 PRO HA 5.97
&rst
ixpk= 0, nxpk= 0, iat= 404,1559, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47, &end
#
# 30 GLY HN 112 PRO HA 5.97
&rst
ixpk= 0, nxpk= 0, iat= 404,1559, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47, &end
#
# 30 GLY HN 115 LYS QD 5.97
&rst
ixpk= 0, nxpk= 0, iat= 404, -1, r1= 1.30, r2= 1.80, r3= 6.70, r4= 7.20,
igr2=1616,1617,
&end
#
# 30 GLY HN 115 LYS QD 5.97
&rst
ixpk= 0, nxpk= 0, iat= 404, -1, r1= 1.30, r2= 1.80, r3= 6.70, r4= 7.20,
igr2=1616,1617,
&end
#
# 30 GLY HN 115 LYS QD 5.97
&rst
ixpk= 0, nxpk= 0, iat= 404, -1, r1= 1.30, r2= 1.80, r3= 6.70, r4= 7.20,
igr2=1616,1617,
&end
#
# 30 GLY HA2 31 LEU HN 2.97
&rst
ixpk= 0, nxpk= 0, iat= 406, 411, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 30 GLY HA2 31 LEU HN 3.86
&rst
ixpk= 0, nxpk= 0, iat= 406, 411, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 30 GLY HA2 31 LEU HN 3.86
&rst
ixpk= 0, nxpk= 0, iat= 406, 411, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 30 GLY HA2 31 LEU HN 3.86
&rst
ixpk= 0, nxpk= 0, iat= 406, 411, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 30 GLY HA2 110 THR QG2 5.55
&rst
ixpk= 0, nxpk= 0, iat= 406, -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
igr2=1531,1532,1533,
&end
#
# 30 GLY HA2 110 THR QG2 5.55
&rst
ixpk= 0, nxpk= 0, iat= 406, -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
igr2=1531,1532,1533,
&end
#
# 30 GLY HA2 110 THR QG2 5.55
&rst
ixpk= 0, nxpk= 0, iat= 406, -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
igr2=1531,1532,1533,
&end
#
# 30 GLY HA2 112 PRO HA 4.18
&rst
ixpk= 0, nxpk= 0, iat= 406,1559, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68, &end
#
# 30 GLY HA2 112 PRO HA 4.18
&rst
ixpk= 0, nxpk= 0, iat= 406,1559, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68, &end
#
# 30 GLY HA2 112 PRO HA 4.18
&rst
ixpk= 0, nxpk= 0, iat= 406,1559, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68, &end
#
# 30 GLY HA2 113 ARG HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 406,1563, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 30 GLY HA2 113 ARG HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 406,1563, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 30 GLY HA2 113 ARG HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 406,1563, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 30 GLY HA3 30 GLY HA2 3.77
&rst
ixpk= 0, nxpk= 0, iat= 407, 406, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27, &end
#
# 30 GLY HA3 31 LEU HN 3.78
&rst
ixpk= 0, nxpk= 0, iat= 407, 411, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28, &end
#
# 30 GLY HA3 31 LEU HN 3.78
&rst
ixpk= 0, nxpk= 0, iat= 407, 411, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28, &end
#
# 30 GLY HA3 31 LEU HN 3.78
&rst
ixpk= 0, nxpk= 0, iat= 407, 411, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28, &end
#
# 30 GLY HA3 110 THR QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 407, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1531,1532,1533,
&end
#
# 30 GLY HA3 110 THR QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 407, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1531,1532,1533,
&end
#
# 30 GLY HA3 110 THR QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 407, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1531,1532,1533,
&end
#
# 30 GLY HA3 111 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 407,1539, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 30 GLY HA3 111 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 407,1539, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 30 GLY HA3 111 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 407,1539, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 30 GLY HA3 115 LYS QD 5.46
&rst
ixpk= 0, nxpk= 0, iat= 407, -1, r1= 1.30, r2= 1.80, r3= 6.13, r4= 6.63,
igr2=1616,1617,
&end
#
# 30 GLY HA3 115 LYS QD 5.46
&rst
ixpk= 0, nxpk= 0, iat= 407, -1, r1= 1.30, r2= 1.80, r3= 6.13, r4= 6.63,
igr2=1616,1617,
&end
#
# 30 GLY HA3 115 LYS QD 5.46
&rst
ixpk= 0, nxpk= 0, iat= 407, -1, r1= 1.30, r2= 1.80, r3= 6.13, r4= 6.63,
igr2=1616,1617,
&end
#
# 30 GLY HA3 116 SER HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 407,1628, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 30 GLY HA3 116 SER HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 407,1628, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 30 GLY HA3 116 SER HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 407,1628, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 31 LEU HN 31 LEU HA 4.33
&rst
ixpk= 0, nxpk= 0, iat= 411, 413, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83, &end
#
# 31 LEU HN 31 LEU HB2 3.82
&rst
ixpk= 0, nxpk= 0, iat= 411, 415, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32, &end
#
# 31 LEU HN 31 LEU HB2 3.82
&rst
ixpk= 0, nxpk= 0, iat= 411, 415, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32, &end
#
# 31 LEU HN 31 LEU HB2 3.82
&rst
ixpk= 0, nxpk= 0, iat= 411, 415, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32, &end
#
# 31 LEU HN 31 LEU HB3 3.98
&rst
ixpk= 0, nxpk= 0, iat= 411, 416, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48, &end
#
# 31 LEU HN 31 LEU HB3 3.98
&rst
ixpk= 0, nxpk= 0, iat= 411, 416, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48, &end
#
# 31 LEU HN 31 LEU HB3 3.98
&rst
ixpk= 0, nxpk= 0, iat= 411, 416, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48, &end
#
# 31 LEU HN 31 LEU QD1 4.63
&rst
ixpk= 0, nxpk= 0, iat= 411, -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
igr2= 420, 421, 422,
&end
#
# 31 LEU HN 31 LEU QD1 4.63
&rst
ixpk= 0, nxpk= 0, iat= 411, -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
igr2= 420, 421, 422,
&end
#
# 31 LEU HN 31 LEU QD1 4.63
&rst
ixpk= 0, nxpk= 0, iat= 411, -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
igr2= 420, 421, 422,
&end
#
# 31 LEU HN 31 LEU QD2 4.49
&rst
ixpk= 0, nxpk= 0, iat= 411, -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr2= 424, 425, 426,
&end
#
# 31 LEU HN 31 LEU QD2 4.49
&rst
ixpk= 0, nxpk= 0, iat= 411, -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr2= 424, 425, 426,
&end
#
# 31 LEU HN 31 LEU QD2 4.49
&rst
ixpk= 0, nxpk= 0, iat= 411, -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr2= 424, 425, 426,
&end
#
# 31 LEU HN 32 LYS HN 5.28
&rst
ixpk= 0, nxpk= 0, iat= 411, 430, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 31 LEU HN 110 THR HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 411,1527, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 31 LEU HN 110 THR HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 411,1527, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 31 LEU HN 110 THR HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 411,1527, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 31 LEU HN 110 THR QG2 4.77
&rst
ixpk= 0, nxpk= 0, iat= 411, -1, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23,
igr2=1531,1532,1533,
&end
#
# 31 LEU HN 110 THR QG2 4.77
&rst
ixpk= 0, nxpk= 0, iat= 411, -1, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23,
igr2=1531,1532,1533,
&end
#
# 31 LEU HN 110 THR QG2 4.77
&rst
ixpk= 0, nxpk= 0, iat= 411, -1, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23,
igr2=1531,1532,1533,
&end
#
# 31 LEU HN 111 ALA HN 4.81
&rst
ixpk= 0, nxpk= 0, iat= 411,1539, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31, &end
#
# 31 LEU HN 111 ALA HN 4.81
&rst
ixpk= 0, nxpk= 0, iat= 411,1539, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31, &end
#
# 31 LEU HN 111 ALA HN 4.81
&rst
ixpk= 0, nxpk= 0, iat= 411,1539, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31, &end
#
# 31 LEU HN 111 ALA QB 4.64
&rst
ixpk= 0, nxpk= 0, iat= 411, -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
igr2=1543,1544,1545,
&end
#
# 31 LEU HN 111 ALA QB 4.64
&rst
ixpk= 0, nxpk= 0, iat= 411, -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
igr2=1543,1544,1545,
&end
#
# 31 LEU HN 111 ALA QB 4.64
&rst
ixpk= 0, nxpk= 0, iat= 411, -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07,
igr2=1543,1544,1545,
&end
#
# 31 LEU HN 113 ARG HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 411,1563, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 31 LEU HN 113 ARG HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 411,1563, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 31 LEU HN 113 ARG HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 411,1563, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 31 LEU HN 114 LEU HB2 5.36
&rst
ixpk= 0, nxpk= 0, iat= 411,1591, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86, &end
#
# 31 LEU HN 114 LEU HB2 5.36
&rst
ixpk= 0, nxpk= 0, iat= 411,1591, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86, &end
#
# 31 LEU HN 114 LEU HB2 5.36
&rst
ixpk= 0, nxpk= 0, iat= 411,1591, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86, &end
#
# 31 LEU HN 114 LEU HB3 5.22
&rst
ixpk= 0, nxpk= 0, iat= 411,1592, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72, &end
#
# 31 LEU HN 114 LEU HB3 5.22
&rst
ixpk= 0, nxpk= 0, iat= 411,1592, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72, &end
#
# 31 LEU HN 114 LEU HB3 5.22
&rst
ixpk= 0, nxpk= 0, iat= 411,1592, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72, &end
#
# 31 LEU HN 115 LYS HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 411,1606, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 31 LEU HN 115 LYS HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 411,1606, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 31 LEU HN 115 LYS HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 411,1606, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 31 LEU HA 31 LEU HB2 3.88
&rst
ixpk= 0, nxpk= 0, iat= 413, 415, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38, &end
#
# 31 LEU HA 31 LEU HB3 5.08
&rst
ixpk= 0, nxpk= 0, iat= 413, 416, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58, &end
#
# 31 LEU HA 31 LEU QD1 4.61
&rst
ixpk= 0, nxpk= 0, iat= 413, -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
igr2= 420, 421, 422,
&end
#
# 31 LEU HA 31 LEU QD1 4.61
&rst
ixpk= 0, nxpk= 0, iat= 413, -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
igr2= 420, 421, 422,
&end
#
# 31 LEU HA 31 LEU QD1 4.61
&rst
ixpk= 0, nxpk= 0, iat= 413, -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
igr2= 420, 421, 422,
&end
#
# 31 LEU HA 31 LEU QD2 3.98
&rst
ixpk= 0, nxpk= 0, iat= 413, -1, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
igr2= 424, 425, 426,
&end
#
# 31 LEU HA 31 LEU QD2 3.98
&rst
ixpk= 0, nxpk= 0, iat= 413, -1, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
igr2= 424, 425, 426,
&end
#
# 31 LEU HA 31 LEU QD2 3.98
&rst
ixpk= 0, nxpk= 0, iat= 413, -1, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
igr2= 424, 425, 426,
&end
#
# 31 LEU HA 32 LYS HN 2.97
&rst
ixpk= 0, nxpk= 0, iat= 413, 430, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 31 LEU HA 32 LYS HN 3.17
&rst
ixpk= 0, nxpk= 0, iat= 413, 430, r1= 1.30, r2= 1.80, r3= 3.17, r4= 3.67, &end
#
# 31 LEU HA 32 LYS HN 3.17
&rst
ixpk= 0, nxpk= 0, iat= 413, 430, r1= 1.30, r2= 1.80, r3= 3.17, r4= 3.67, &end
#
# 31 LEU HA 32 LYS HN 3.17
&rst
ixpk= 0, nxpk= 0, iat= 413, 430, r1= 1.30, r2= 1.80, r3= 3.17, r4= 3.67, &end
#
# 31 LEU HA 33 PHE HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 413, 452, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 31 LEU HA 33 PHE HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 413, 452, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 31 LEU HA 33 PHE HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 413, 452, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 31 LEU HA 111 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 413,1539, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 31 LEU HA 111 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 413,1539, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 31 LEU HA 111 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 413,1539, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 31 LEU HB2 31 LEU HB3 4.36
&rst
ixpk= 0, nxpk= 0, iat= 415, 416, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86, &end
#
# 31 LEU HB2 31 LEU QD1 4.39
&rst
ixpk= 0, nxpk= 0, iat= 415, -1, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77,
igr2= 420, 421, 422,
&end
#
# 31 LEU HB2 31 LEU QD1 4.39
&rst
ixpk= 0, nxpk= 0, iat= 415, -1, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77,
igr2= 420, 421, 422,
&end
#
# 31 LEU HB2 31 LEU QD1 4.39
&rst
ixpk= 0, nxpk= 0, iat= 415, -1, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77,
igr2= 420, 421, 422,
&end
#
# 31 LEU HB2 32 LYS HN 5.72
&rst
ixpk= 0, nxpk= 0, iat= 415, 430, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 31 LEU HB2 32 LYS HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 415, 432, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 31 LEU HB2 32 LYS HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 415, 432, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 31 LEU HB2 32 LYS HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 415, 432, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 31 LEU HB2 47 PHE HZ 6.05
&rst
ixpk= 0, nxpk= 0, iat= 415, 674, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 31 LEU HB2 47 PHE HZ 6.05
&rst
ixpk= 0, nxpk= 0, iat= 415, 674, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 31 LEU HB2 47 PHE HZ 6.05
&rst
ixpk= 0, nxpk= 0, iat= 415, 674, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 31 LEU HB2 47 PHE QE 5.50
&rst
ixpk= 0, nxpk= 0, iat= 415, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 672, 676,
&end
#
# 31 LEU HB3 31 LEU QD1 4.36
&rst
ixpk= 0, nxpk= 0, iat= 416, -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr2= 420, 421, 422,
&end
#
# 31 LEU HB3 31 LEU QD1 4.36
&rst
ixpk= 0, nxpk= 0, iat= 416, -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr2= 420, 421, 422,
&end
#
# 31 LEU HB3 31 LEU QD1 4.36
&rst
ixpk= 0, nxpk= 0, iat= 416, -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr2= 420, 421, 422,
&end
#
# 31 LEU HB3 31 LEU QD2 5.39
&rst
ixpk= 0, nxpk= 0, iat= 416, -1, r1= 1.30, r2= 1.80, r3= 6.47, r4= 6.97,
igr2= 424, 425, 426,
&end
#
# 31 LEU HB3 32 LYS HN 4.77
&rst
ixpk= 0, nxpk= 0, iat= 416, 430, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27, &end
#
# 31 LEU HB3 32 LYS HN 4.77
&rst
ixpk= 0, nxpk= 0, iat= 416, 430, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27, &end
#
# 31 LEU HB3 32 LYS HN 4.77
&rst
ixpk= 0, nxpk= 0, iat= 416, 430, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27, &end
#
# 31 LEU HB3 33 PHE HN 5.96
&rst
ixpk= 0, nxpk= 0, iat= 416, 452, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46, &end
#
# 31 LEU HB3 33 PHE HN 5.96
&rst
ixpk= 0, nxpk= 0, iat= 416, 452, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46, &end
#
# 31 LEU HB3 33 PHE HN 5.96
&rst
ixpk= 0, nxpk= 0, iat= 416, 452, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46, &end
#
# 31 LEU HB3 33 PHE QD 4.41
&rst
ixpk= 0, nxpk= 0, iat= 416, -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr2= 460, 468,
&end
#
# 31 LEU HB3 33 PHE QD 4.41
&rst
ixpk= 0, nxpk= 0, iat= 416, -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr2= 460, 468,
&end
#
# 31 LEU HB3 33 PHE QD 4.41
&rst
ixpk= 0, nxpk= 0, iat= 416, -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr2= 460, 468,
&end
#
# 31 LEU HB3 47 PHE HZ 6.05
&rst
ixpk= 0, nxpk= 0, iat= 416, 674, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 31 LEU HB3 47 PHE HZ 6.05
&rst
ixpk= 0, nxpk= 0, iat= 416, 674, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 31 LEU HB3 47 PHE HZ 6.05
&rst
ixpk= 0, nxpk= 0, iat= 416, 674, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 31 LEU HB3 47 PHE QE 5.29
&rst
ixpk= 0, nxpk= 0, iat= 416, -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
igr2= 672, 676,
&end
#
# 31 LEU HB3 47 PHE QE 5.29
&rst
ixpk= 0, nxpk= 0, iat= 416, -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
igr2= 672, 676,
&end
#
# 31 LEU HB3 47 PHE QE 5.29
&rst
ixpk= 0, nxpk= 0, iat= 416, -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
igr2= 672, 676,
&end
#
# 31 LEU HB3 111 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 416,1539, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 31 LEU HB3 111 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 416,1539, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 31 LEU HB3 111 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 416,1539, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 31 LEU HG 114 LEU HB2 5.27
&rst
ixpk= 0, nxpk= 0, iat= 418,1591, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77, &end
#
# 31 LEU HG 114 LEU HB2 5.27
&rst
ixpk= 0, nxpk= 0, iat= 418,1591, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77, &end
#
# 31 LEU HG 114 LEU HB2 5.27
&rst
ixpk= 0, nxpk= 0, iat= 418,1591, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77, &end
#
# 31 LEU QD1 33 PHE QD 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.16, r4= 8.66,
igr1= 420, 421, 422,
igr2= 460, 468,
&end
#
# 31 LEU QD1 33 PHE QD 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.16, r4= 8.66,
igr1= 420, 421, 422,
igr2= 460, 468,
&end
#
# 31 LEU QD1 33 PHE QD 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.16, r4= 8.66,
igr1= 420, 421, 422,
igr2= 460, 468,
&end
#
# 31 LEU QD1 47 PHE HZ 4.69
&rst
ixpk= 0, nxpk= 0, iat= -1, 674, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr1= 420, 421, 422,
&end
#
# 31 LEU QD1 47 PHE HZ 4.69
&rst
ixpk= 0, nxpk= 0, iat= -1, 674, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr1= 420, 421, 422,
&end
#
# 31 LEU QD1 47 PHE HZ 4.69
&rst
ixpk= 0, nxpk= 0, iat= -1, 674, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr1= 420, 421, 422,
&end
#
# 31 LEU QD1 47 PHE QE 5.55
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.48, r4= 7.98,
igr1= 420, 421, 422,
igr2= 672, 676,
&end
#
# 31 LEU QD1 47 PHE QE 5.55
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.48, r4= 7.98,
igr1= 420, 421, 422,
igr2= 672, 676,
&end
#
# 31 LEU QD1 47 PHE QE 5.55
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.48, r4= 7.98,
igr1= 420, 421, 422,
igr2= 672, 676,
&end
#
# 31 LEU QD1 111 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1539, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 420, 421, 422,
&end
#
# 31 LEU QD1 111 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1539, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 420, 421, 422,
&end
#
# 31 LEU QD1 111 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1539, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 420, 421, 422,
&end
#
# 31 LEU QD1 114 LEU HB2 4.81
&rst
ixpk= 0, nxpk= 0, iat= -1,1591, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr1= 420, 421, 422,
&end
#
# 31 LEU QD1 114 LEU HB2 4.81
&rst
ixpk= 0, nxpk= 0, iat= -1,1591, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr1= 420, 421, 422,
&end
#
# 31 LEU QD1 114 LEU HB2 4.81
&rst
ixpk= 0, nxpk= 0, iat= -1,1591, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr1= 420, 421, 422,
&end
#
# 31 LEU QD1 114 LEU HB3 4.52
&rst
ixpk= 0, nxpk= 0, iat= -1,1592, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
igr1= 420, 421, 422,
&end
#
# 31 LEU QD1 114 LEU HB3 4.52
&rst
ixpk= 0, nxpk= 0, iat= -1,1592, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
igr1= 420, 421, 422,
&end
#
# 31 LEU QD1 114 LEU HB3 4.52
&rst
ixpk= 0, nxpk= 0, iat= -1,1592, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
igr1= 420, 421, 422,
&end
#
# 31 LEU QD1 114 LEU QD1 3.37
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
igr1= 420, 421, 422,
igr2=1596,1597,1598,
&end
#
# 31 LEU QD1 114 LEU QD1 3.37
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
igr1= 420, 421, 422,
igr2=1596,1597,1598,
&end
#
# 31 LEU QD1 114 LEU QD1 3.37
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
igr1= 420, 421, 422,
igr2=1596,1597,1598,
&end
#
# 31 LEU QD1 114 LEU QD2 3.54
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,
igr1= 420, 421, 422,
igr2=1600,1601,1602,
&end
#
# 31 LEU QD1 114 LEU QD2 3.54
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,
igr1= 420, 421, 422,
igr2=1600,1601,1602,
&end
#
# 31 LEU QD1 114 LEU QD2 3.54
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,
igr1= 420, 421, 422,
igr2=1600,1601,1602,
&end
#
# 31 LEU QD1 115 LYS HN 5.92
&rst
ixpk= 0, nxpk= 0, iat= -1,1606, r1= 1.30, r2= 1.80, r3= 7.11, r4= 7.61,
igr1= 420, 421, 422,
&end
#
# 31 LEU QD1 115 LYS HN 5.92
&rst
ixpk= 0, nxpk= 0, iat= -1,1606, r1= 1.30, r2= 1.80, r3= 7.11, r4= 7.61,
igr1= 420, 421, 422,
&end
#
# 31 LEU QD1 115 LYS HN 5.92
&rst
ixpk= 0, nxpk= 0, iat= -1,1606, r1= 1.30, r2= 1.80, r3= 7.11, r4= 7.61,
igr1= 420, 421, 422,
&end
#
# 31 LEU QD1 116 SER HN 5.25
&rst
ixpk= 0, nxpk= 0, iat= -1,1628, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
igr1= 420, 421, 422,
&end
#
# 31 LEU QD1 116 SER HN 5.25
&rst
ixpk= 0, nxpk= 0, iat= -1,1628, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
igr1= 420, 421, 422,
&end
#
# 31 LEU QD1 116 SER HN 5.25
&rst
ixpk= 0, nxpk= 0, iat= -1,1628, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
igr1= 420, 421, 422,
&end
#
# 31 LEU QD1 120 VAL HN 5.57
&rst
ixpk= 0, nxpk= 0, iat= -1,1685, r1= 1.30, r2= 1.80, r3= 6.69, r4= 7.19,
igr1= 420, 421, 422,
&end
#
# 31 LEU QD1 120 VAL HN 5.57
&rst
ixpk= 0, nxpk= 0, iat= -1,1685, r1= 1.30, r2= 1.80, r3= 6.69, r4= 7.19,
igr1= 420, 421, 422,
&end
#
# 31 LEU QD1 120 VAL HN 5.57
&rst
ixpk= 0, nxpk= 0, iat= -1,1685, r1= 1.30, r2= 1.80, r3= 6.69, r4= 7.19,
igr1= 420, 421, 422,
&end
#
# 31 LEU QD1 120 VAL HB 4.94
&rst
ixpk= 0, nxpk= 0, iat= -1,1689, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr1= 420, 421, 422,
&end
#
# 31 LEU QD1 120 VAL HB 4.94
&rst
ixpk= 0, nxpk= 0, iat= -1,1689, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr1= 420, 421, 422,
&end
#
# 31 LEU QD1 120 VAL HB 4.94
&rst
ixpk= 0, nxpk= 0, iat= -1,1689, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr1= 420, 421, 422,
&end
#
# 31 LEU QD1 120 VAL QG1 3.35
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
igr1= 420, 421, 422,
igr2=1691,1692,1693,
&end
#
# 31 LEU QD1 120 VAL QG1 3.35
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
igr1= 420, 421, 422,
igr2=1691,1692,1693,
&end
#
# 31 LEU QD1 120 VAL QG1 3.35
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
igr1= 420, 421, 422,
igr2=1691,1692,1693,
&end
#
# 31 LEU QD1 120 VAL QG2 3.32
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
igr1= 420, 421, 422,
igr2=1695,1696,1697,
&end
#
# 31 LEU QD1 120 VAL QG2 3.32
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
igr1= 420, 421, 422,
igr2=1695,1696,1697,
&end
#
# 31 LEU QD1 120 VAL QG2 3.32
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
igr1= 420, 421, 422,
igr2=1695,1696,1697,
&end
#
# 31 LEU QD2 32 LYS HN 4.32
&rst
ixpk= 0, nxpk= 0, iat= -1, 430, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
igr1= 424, 425, 426,
&end
#
# 31 LEU QD2 32 LYS HN 4.32
&rst
ixpk= 0, nxpk= 0, iat= -1, 430, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
igr1= 424, 425, 426,
&end
#
# 31 LEU QD2 32 LYS HN 4.32
&rst
ixpk= 0, nxpk= 0, iat= -1, 430, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
igr1= 424, 425, 426,
&end
#
# 31 LEU QD2 33 PHE QD 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.16, r4= 8.66,
igr1= 424, 425, 426,
igr2= 460, 468,
&end
#
# 31 LEU QD2 33 PHE QD 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.16, r4= 8.66,
igr1= 424, 425, 426,
igr2= 460, 468,
&end
#
# 31 LEU QD2 33 PHE QD 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.16, r4= 8.66,
igr1= 424, 425, 426,
igr2= 460, 468,
&end
#
# 31 LEU QD2 47 PHE HZ 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 674, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 424, 425, 426,
&end
#
# 31 LEU QD2 47 PHE HZ 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 674, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 424, 425, 426,
&end
#
# 31 LEU QD2 47 PHE HZ 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 674, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 424, 425, 426,
&end
#
# 31 LEU QD2 111 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1539, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 424, 425, 426,
&end
#
# 31 LEU QD2 111 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1539, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 424, 425, 426,
&end
#
# 31 LEU QD2 111 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1539, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 424, 425, 426,
&end
#
# 31 LEU QD2 115 LYS HN 5.95
&rst
ixpk= 0, nxpk= 0, iat= -1,1606, r1= 1.30, r2= 1.80, r3= 7.15, r4= 7.65,
igr1= 424, 425, 426,
&end
#
# 31 LEU QD2 115 LYS HN 5.95
&rst
ixpk= 0, nxpk= 0, iat= -1,1606, r1= 1.30, r2= 1.80, r3= 7.15, r4= 7.65,
igr1= 424, 425, 426,
&end
#
# 31 LEU QD2 115 LYS HN 5.95
&rst
ixpk= 0, nxpk= 0, iat= -1,1606, r1= 1.30, r2= 1.80, r3= 7.15, r4= 7.65,
igr1= 424, 425, 426,
&end
#
# 31 LEU QD2 115 LYS HA 5.70
&rst
ixpk= 0, nxpk= 0, iat= -1,1608, r1= 1.30, r2= 1.80, r3= 6.85, r4= 7.35,
igr1= 424, 425, 426,
&end
#
# 31 LEU QD2 115 LYS HA 5.70
&rst
ixpk= 0, nxpk= 0, iat= -1,1608, r1= 1.30, r2= 1.80, r3= 6.85, r4= 7.35,
igr1= 424, 425, 426,
&end
#
# 31 LEU QD2 115 LYS HA 5.70
&rst
ixpk= 0, nxpk= 0, iat= -1,1608, r1= 1.30, r2= 1.80, r3= 6.85, r4= 7.35,
igr1= 424, 425, 426,
&end
#
# 31 LEU QD2 116 SER HN 5.47
&rst
ixpk= 0, nxpk= 0, iat= -1,1628, r1= 1.30, r2= 1.80, r3= 6.57, r4= 7.07,
igr1= 424, 425, 426,
&end
#
# 31 LEU QD2 116 SER HN 5.47
&rst
ixpk= 0, nxpk= 0, iat= -1,1628, r1= 1.30, r2= 1.80, r3= 6.57, r4= 7.07,
igr1= 424, 425, 426,
&end
#
# 31 LEU QD2 116 SER HN 5.47
&rst
ixpk= 0, nxpk= 0, iat= -1,1628, r1= 1.30, r2= 1.80, r3= 6.57, r4= 7.07,
igr1= 424, 425, 426,
&end
#
# 31 LEU QD2 116 SER HA 4.67
&rst
ixpk= 0, nxpk= 0, iat= -1,1630, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr1= 424, 425, 426,
&end
#
# 31 LEU QD2 116 SER HA 4.67
&rst
ixpk= 0, nxpk= 0, iat= -1,1630, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr1= 424, 425, 426,
&end
#
# 31 LEU QD2 116 SER HA 4.67
&rst
ixpk= 0, nxpk= 0, iat= -1,1630, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr1= 424, 425, 426,
&end
#
# 31 LEU QD2 116 SER HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1632, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 424, 425, 426,
&end
#
# 31 LEU QD2 116 SER HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1632, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 424, 425, 426,
&end
#
# 31 LEU QD2 116 SER HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1632, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 424, 425, 426,
&end
#
# 31 LEU QD2 117 LEU HN 4.67
&rst
ixpk= 0, nxpk= 0, iat= -1,1639, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr1= 424, 425, 426,
&end
#
# 31 LEU QD2 117 LEU HN 4.67
&rst
ixpk= 0, nxpk= 0, iat= -1,1639, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr1= 424, 425, 426,
&end
#
# 31 LEU QD2 117 LEU HN 4.67
&rst
ixpk= 0, nxpk= 0, iat= -1,1639, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr1= 424, 425, 426,
&end
#
# 31 LEU QD2 117 LEU HA 4.75
&rst
ixpk= 0, nxpk= 0, iat= -1,1641, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr1= 424, 425, 426,
&end
#
# 31 LEU QD2 117 LEU HA 4.75
&rst
ixpk= 0, nxpk= 0, iat= -1,1641, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr1= 424, 425, 426,
&end
#
# 31 LEU QD2 117 LEU HA 4.75
&rst
ixpk= 0, nxpk= 0, iat= -1,1641, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr1= 424, 425, 426,
&end
#
# 31 LEU QD2 118 ASP HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1658, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 424, 425, 426,
&end
#
# 31 LEU QD2 118 ASP HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1658, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 424, 425, 426,
&end
#
# 31 LEU QD2 118 ASP HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1658, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 424, 425, 426,
&end
#
# 31 LEU QD2 119 GLU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1670, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 424, 425, 426,
&end
#
# 31 LEU QD2 119 GLU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1670, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 424, 425, 426,
&end
#
# 31 LEU QD2 119 GLU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1670, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 424, 425, 426,
&end
#
# 31 LEU QD2 120 VAL HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1685, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 424, 425, 426,
&end
#
# 31 LEU QD2 120 VAL HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1685, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 424, 425, 426,
&end
#
# 31 LEU QD2 120 VAL HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1685, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 424, 425, 426,
&end
#
# 31 LEU QD2 120 VAL HB 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1689, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 424, 425, 426,
&end
#
# 31 LEU QD2 120 VAL HB 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1689, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 424, 425, 426,
&end
#
# 31 LEU QD2 120 VAL HB 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1689, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 424, 425, 426,
&end
#
# 32 LYS HN 32 LYS HA 4.30
&rst
ixpk= 0, nxpk= 0, iat= 430, 432, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80, &end
#
# 32 LYS HN 32 LYS HB2 3.82
&rst
ixpk= 0, nxpk= 0, iat= 430, 434, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32, &end
#
# 32 LYS HN 32 LYS HB2 3.82
&rst
ixpk= 0, nxpk= 0, iat= 430, 434, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32, &end
#
# 32 LYS HN 32 LYS HB2 3.82
&rst
ixpk= 0, nxpk= 0, iat= 430, 434, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32, &end
#
# 32 LYS HN 32 LYS HE3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 430, 444, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 32 LYS HN 32 LYS HE3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 430, 444, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 32 LYS HN 32 LYS HE3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 430, 444, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 32 LYS HN 32 LYS QG 5.15
&rst
ixpk= 0, nxpk= 0, iat= 430, -1, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr2= 437, 438,
&end
#
# 32 LYS HN 32 LYS QG 5.15
&rst
ixpk= 0, nxpk= 0, iat= 430, -1, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr2= 437, 438,
&end
#
# 32 LYS HN 32 LYS QG 5.15
&rst
ixpk= 0, nxpk= 0, iat= 430, -1, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr2= 437, 438,
&end
#
# 32 LYS HN 33 PHE HN 5.20
&rst
ixpk= 0, nxpk= 0, iat= 430, 452, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70, &end
#
# 32 LYS HN 33 PHE HN 5.20
&rst
ixpk= 0, nxpk= 0, iat= 430, 452, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70, &end
#
# 32 LYS HN 33 PHE HN 5.20
&rst
ixpk= 0, nxpk= 0, iat= 430, 452, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70, &end
#
# 32 LYS HN 33 PHE HN 5.28
&rst
ixpk= 0, nxpk= 0, iat= 430, 452, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 32 LYS HN 33 PHE HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 430, 454, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 32 LYS HN 33 PHE HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 430, 454, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 32 LYS HN 33 PHE HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 430, 454, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 32 LYS HN 33 PHE QD 6.05
&rst
ixpk= 0, nxpk= 0, iat= 430, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2= 460, 468,
&end
#
# 32 LYS HN 33 PHE QD 6.05
&rst
ixpk= 0, nxpk= 0, iat= 430, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2= 460, 468,
&end
#
# 32 LYS HN 33 PHE QD 6.05
&rst
ixpk= 0, nxpk= 0, iat= 430, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2= 460, 468,
&end
#
# 32 LYS HN 110 THR HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= 430,1527, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 32 LYS HN 110 THR HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= 430,1527, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 32 LYS HN 110 THR HA 5.50
&rst
ixpk= 0, nxpk= 0, iat= 430,1527, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 32 LYS HN 110 THR QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 430, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1531,1532,1533,
&end
#
# 32 LYS HN 110 THR QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 430, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1531,1532,1533,
&end
#
# 32 LYS HN 110 THR QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 430, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1531,1532,1533,
&end
#
# 32 LYS HN 111 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 430,1539, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 32 LYS HN 111 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 430,1539, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 32 LYS HN 111 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 430,1539, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 32 LYS HA 32 LYS HB2 4.80
&rst
ixpk= 0, nxpk= 0, iat= 432, 434, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30, &end
#
# 32 LYS HA 32 LYS HB3 4.58
&rst
ixpk= 0, nxpk= 0, iat= 432, 435, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08, &end
#
# 32 LYS HA 32 LYS QD 4.69
&rst
ixpk= 0, nxpk= 0, iat= 432, -1, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr2= 440, 441,
&end
#
# 32 LYS HA 32 LYS QD 4.69
&rst
ixpk= 0, nxpk= 0, iat= 432, -1, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr2= 440, 441,
&end
#
# 32 LYS HA 32 LYS QD 4.69
&rst
ixpk= 0, nxpk= 0, iat= 432, -1, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr2= 440, 441,
&end
#
# 32 LYS HA 32 LYS QG 4.49
&rst
ixpk= 0, nxpk= 0, iat= 432, -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr2= 437, 438,
&end
#
# 32 LYS HA 32 LYS QG 4.49
&rst
ixpk= 0, nxpk= 0, iat= 432, -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr2= 437, 438,
&end
#
# 32 LYS HA 32 LYS QG 4.49
&rst
ixpk= 0, nxpk= 0, iat= 432, -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr2= 437, 438,
&end
#
# 32 LYS HA 33 PHE HN 2.97
&rst
ixpk= 0, nxpk= 0, iat= 432, 452, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 32 LYS HA 33 PHE HN 3.62
&rst
ixpk= 0, nxpk= 0, iat= 432, 452, r1= 1.30, r2= 1.80, r3= 3.62, r4= 4.12, &end
#
# 32 LYS HA 33 PHE HN 3.62
&rst
ixpk= 0, nxpk= 0, iat= 432, 452, r1= 1.30, r2= 1.80, r3= 3.62, r4= 4.12, &end
#
# 32 LYS HA 33 PHE HN 3.62
&rst
ixpk= 0, nxpk= 0, iat= 432, 452, r1= 1.30, r2= 1.80, r3= 3.62, r4= 4.12, &end
#
# 32 LYS HA 33 PHE HB2 5.82
&rst
ixpk= 0, nxpk= 0, iat= 432, 456, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32, &end
#
# 32 LYS HA 33 PHE HB2 5.82
&rst
ixpk= 0, nxpk= 0, iat= 432, 456, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32, &end
#
# 32 LYS HA 33 PHE HB2 5.82
&rst
ixpk= 0, nxpk= 0, iat= 432, 456, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32, &end
#
# 32 LYS HA 109 VAL HN 5.91
&rst
ixpk= 0, nxpk= 0, iat= 432,1509, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41, &end
#
# 32 LYS HA 109 VAL HN 5.91
&rst
ixpk= 0, nxpk= 0, iat= 432,1509, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41, &end
#
# 32 LYS HA 109 VAL HN 5.91
&rst
ixpk= 0, nxpk= 0, iat= 432,1509, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41, &end
#
# 32 LYS HA 110 THR HA 4.50
&rst
ixpk= 0, nxpk= 0, iat= 432,1527, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 32 LYS HA 110 THR HA 4.50
&rst
ixpk= 0, nxpk= 0, iat= 432,1527, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 32 LYS HA 110 THR HA 4.50
&rst
ixpk= 0, nxpk= 0, iat= 432,1527, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 32 LYS HA 110 THR HB 5.78
&rst
ixpk= 0, nxpk= 0, iat= 432,1529, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28, &end
#
# 32 LYS HA 110 THR HB 5.78
&rst
ixpk= 0, nxpk= 0, iat= 432,1529, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28, &end
#
# 32 LYS HA 110 THR HB 5.78
&rst
ixpk= 0, nxpk= 0, iat= 432,1529, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28, &end
#
# 32 LYS HA 110 THR QG2 5.05
&rst
ixpk= 0, nxpk= 0, iat= 432, -1, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
igr2=1531,1532,1533,
&end
#
# 32 LYS HA 110 THR QG2 5.05
&rst
ixpk= 0, nxpk= 0, iat= 432, -1, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
igr2=1531,1532,1533,
&end
#
# 32 LYS HA 110 THR QG2 5.05
&rst
ixpk= 0, nxpk= 0, iat= 432, -1, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
igr2=1531,1532,1533,
&end
#
# 32 LYS HA 111 ALA HN 5.13
&rst
ixpk= 0, nxpk= 0, iat= 432,1539, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63, &end
#
# 32 LYS HA 111 ALA HN 5.13
&rst
ixpk= 0, nxpk= 0, iat= 432,1539, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63, &end
#
# 32 LYS HA 111 ALA HN 5.13
&rst
ixpk= 0, nxpk= 0, iat= 432,1539, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63, &end
#
# 32 LYS HB2 32 LYS QD 2.87
&rst
ixpk= 0, nxpk= 0, iat= 434, -1, r1= 1.30, r2= 1.80, r3= 3.22, r4= 3.72,
igr2= 440, 441,
&end
#
# 32 LYS HB2 32 LYS QD 2.87
&rst
ixpk= 0, nxpk= 0, iat= 434, -1, r1= 1.30, r2= 1.80, r3= 3.22, r4= 3.72,
igr2= 440, 441,
&end
#
# 32 LYS HB2 32 LYS QD 2.87
&rst
ixpk= 0, nxpk= 0, iat= 434, -1, r1= 1.30, r2= 1.80, r3= 3.22, r4= 3.72,
igr2= 440, 441,
&end
#
# 32 LYS HB2 33 PHE HN 5.19
&rst
ixpk= 0, nxpk= 0, iat= 434, 452, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69, &end
#
# 32 LYS HB2 33 PHE HN 5.19
&rst
ixpk= 0, nxpk= 0, iat= 434, 452, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69, &end
#
# 32 LYS HB2 33 PHE HN 5.19
&rst
ixpk= 0, nxpk= 0, iat= 434, 452, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69, &end
#
# 32 LYS HB2 33 PHE HN 5.72
&rst
ixpk= 0, nxpk= 0, iat= 434, 452, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 32 LYS HB2 111 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 434,1539, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 32 LYS HB2 111 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 434,1539, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 32 LYS HB2 111 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 434,1539, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 32 LYS HB3 32 LYS QD 2.92
&rst
ixpk= 0, nxpk= 0, iat= 435, -1, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78,
igr2= 440, 441,
&end
#
# 32 LYS HB3 32 LYS QD 2.92
&rst
ixpk= 0, nxpk= 0, iat= 435, -1, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78,
igr2= 440, 441,
&end
#
# 32 LYS HB3 32 LYS QD 2.92
&rst
ixpk= 0, nxpk= 0, iat= 435, -1, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78,
igr2= 440, 441,
&end
#
# 32 LYS HB3 33 PHE HN 5.63
&rst
ixpk= 0, nxpk= 0, iat= 435, 452, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13, &end
#
# 32 LYS HB3 33 PHE HN 5.63
&rst
ixpk= 0, nxpk= 0, iat= 435, 452, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13, &end
#
# 32 LYS HB3 33 PHE HN 5.63
&rst
ixpk= 0, nxpk= 0, iat= 435, 452, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13, &end
#
# 32 LYS HB3 34 THR HN 5.83
&rst
ixpk= 0, nxpk= 0, iat= 435, 472, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33, &end
#
# 32 LYS HB3 34 THR HN 5.83
&rst
ixpk= 0, nxpk= 0, iat= 435, 472, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33, &end
#
# 32 LYS HB3 34 THR HN 5.83
&rst
ixpk= 0, nxpk= 0, iat= 435, 472, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33, &end
#
# 32 LYS HB3 110 THR QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 435, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1531,1532,1533,
&end
#
# 32 LYS HB3 110 THR QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 435, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1531,1532,1533,
&end
#
# 32 LYS HB3 110 THR QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 435, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1531,1532,1533,
&end
#
# 32 LYS HE2 34 THR QG2 5.37
&rst
ixpk= 0, nxpk= 0, iat= 443, -1, r1= 1.30, r2= 1.80, r3= 6.45, r4= 6.95,
igr2= 478, 479, 480,
&end
#
# 32 LYS HE2 34 THR QG2 5.37
&rst
ixpk= 0, nxpk= 0, iat= 443, -1, r1= 1.30, r2= 1.80, r3= 6.45, r4= 6.95,
igr2= 478, 479, 480,
&end
#
# 32 LYS HE2 34 THR QG2 5.37
&rst
ixpk= 0, nxpk= 0, iat= 443, -1, r1= 1.30, r2= 1.80, r3= 6.45, r4= 6.95,
igr2= 478, 479, 480,
&end
#
# 32 LYS HE3 32 LYS HE2 3.04
&rst
ixpk= 0, nxpk= 0, iat= 444, 443, r1= 1.30, r2= 1.80, r3= 3.04, r4= 3.54, &end
#
# 32 LYS HE3 33 PHE HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 444, 452, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 32 LYS HE3 33 PHE HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 444, 452, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 32 LYS HE3 33 PHE HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 444, 452, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 32 LYS HE3 33 PHE HA 6.01
&rst
ixpk= 0, nxpk= 0, iat= 444, 454, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51, &end
#
# 32 LYS HE3 33 PHE HA 6.01
&rst
ixpk= 0, nxpk= 0, iat= 444, 454, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51, &end
#
# 32 LYS HE3 33 PHE HA 6.01
&rst
ixpk= 0, nxpk= 0, iat= 444, 454, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51, &end
#
# 32 LYS HE3 108 PRO HA 5.55
&rst
ixpk= 0, nxpk= 0, iat= 444,1505, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05, &end
#
# 32 LYS HE3 108 PRO HA 5.55
&rst
ixpk= 0, nxpk= 0, iat= 444,1505, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05, &end
#
# 32 LYS HE3 108 PRO HA 5.55
&rst
ixpk= 0, nxpk= 0, iat= 444,1505, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05, &end
#
# 32 LYS HE3 108 PRO HB2 5.81
&rst
ixpk= 0, nxpk= 0, iat= 444,1502, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31, &end
#
# 32 LYS HE3 108 PRO HB2 5.81
&rst
ixpk= 0, nxpk= 0, iat= 444,1502, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31, &end
#
# 32 LYS HE3 108 PRO HB2 5.81
&rst
ixpk= 0, nxpk= 0, iat= 444,1502, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31, &end
#
# 32 LYS HE3 109 VAL HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 444,1509, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 32 LYS HE3 109 VAL HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 444,1509, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 32 LYS HE3 109 VAL HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 444,1509, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 32 LYS QD 32 LYS HE2 3.28
&rst
ixpk= 0, nxpk= 0, iat= -1, 443, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18,
igr1= 440, 441,
&end
#
# 32 LYS QD 32 LYS HE2 3.28
&rst
ixpk= 0, nxpk= 0, iat= -1, 443, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18,
igr1= 440, 441,
&end
#
# 32 LYS QD 32 LYS HE2 3.28
&rst
ixpk= 0, nxpk= 0, iat= -1, 443, r1= 1.30, r2= 1.80, r3= 3.68, r4= 4.18,
igr1= 440, 441,
&end
#
# 32 LYS QD 32 LYS HE3 3.99
&rst
ixpk= 0, nxpk= 0, iat= -1, 444, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
igr1= 440, 441,
&end
#
# 32 LYS QD 33 PHE HN 5.19
&rst
ixpk= 0, nxpk= 0, iat= -1, 452, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33,
igr1= 440, 441,
&end
#
# 32 LYS QD 33 PHE HN 5.19
&rst
ixpk= 0, nxpk= 0, iat= -1, 452, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33,
igr1= 440, 441,
&end
#
# 32 LYS QD 33 PHE HN 5.19
&rst
ixpk= 0, nxpk= 0, iat= -1, 452, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33,
igr1= 440, 441,
&end
#
# 32 LYS QG 32 LYS HE2 4.15
&rst
ixpk= 0, nxpk= 0, iat= -1, 443, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
igr1= 437, 438,
&end
#
# 32 LYS QG 32 LYS HE2 4.15
&rst
ixpk= 0, nxpk= 0, iat= -1, 443, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
igr1= 437, 438,
&end
#
# 32 LYS QG 32 LYS HE2 4.15
&rst
ixpk= 0, nxpk= 0, iat= -1, 443, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
igr1= 437, 438,
&end
#
# 32 LYS QG 33 PHE HN 4.57
&rst
ixpk= 0, nxpk= 0, iat= -1, 452, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
igr1= 437, 438,
&end
#
# 32 LYS QG 33 PHE HN 4.57
&rst
ixpk= 0, nxpk= 0, iat= -1, 452, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
igr1= 437, 438,
&end
#
# 32 LYS QG 33 PHE HN 4.57
&rst
ixpk= 0, nxpk= 0, iat= -1, 452, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
igr1= 437, 438,
&end
#
# 32 LYS QG 34 THR HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 472, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 437, 438,
&end
#
# 32 LYS QG 34 THR HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 472, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 437, 438,
&end
#
# 32 LYS QG 34 THR HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 472, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 437, 438,
&end
#
# 32 LYS QG 108 PRO HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1505, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 437, 438,
&end
#
# 32 LYS QG 108 PRO HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1505, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 437, 438,
&end
#
# 32 LYS QG 108 PRO HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1505, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 437, 438,
&end
#
# 32 LYS QG 109 VAL HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1509, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 437, 438,
&end
#
# 32 LYS QG 109 VAL HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1509, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 437, 438,
&end
#
# 32 LYS QG 109 VAL HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1509, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 437, 438,
&end
#
# 32 LYS QG 110 THR HA 5.38
&rst
ixpk= 0, nxpk= 0, iat= -1,1527, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54,
igr1= 437, 438,
&end
#
# 32 LYS QG 110 THR HA 5.38
&rst
ixpk= 0, nxpk= 0, iat= -1,1527, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54,
igr1= 437, 438,
&end
#
# 32 LYS QG 110 THR HA 5.38
&rst
ixpk= 0, nxpk= 0, iat= -1,1527, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54,
igr1= 437, 438,
&end
#
# 32 LYS QG 111 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1539, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 437, 438,
&end
#
# 32 LYS QG 111 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1539, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 437, 438,
&end
#
# 32 LYS QG 111 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1539, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 437, 438,
&end
#
# 33 PHE HN 33 PHE HA 4.54
&rst
ixpk= 0, nxpk= 0, iat= 452, 454, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 33 PHE HN 33 PHE HB2 4.26
&rst
ixpk= 0, nxpk= 0, iat= 452, 456, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76, &end
#
# 33 PHE HN 33 PHE HB2 4.26
&rst
ixpk= 0, nxpk= 0, iat= 452, 456, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76, &end
#
# 33 PHE HN 33 PHE HB2 4.26
&rst
ixpk= 0, nxpk= 0, iat= 452, 456, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76, &end
#
# 33 PHE HN 33 PHE HB3 4.51
&rst
ixpk= 0, nxpk= 0, iat= 452, 457, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01, &end
#
# 33 PHE HN 33 PHE HB3 4.51
&rst
ixpk= 0, nxpk= 0, iat= 452, 457, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01, &end
#
# 33 PHE HN 33 PHE HB3 4.51
&rst
ixpk= 0, nxpk= 0, iat= 452, 457, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01, &end
#
# 33 PHE HN 33 PHE QD 4.06
&rst
ixpk= 0, nxpk= 0, iat= 452, -1, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
igr2= 460, 468,
&end
#
# 33 PHE HN 33 PHE QD 4.06
&rst
ixpk= 0, nxpk= 0, iat= 452, -1, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
igr2= 460, 468,
&end
#
# 33 PHE HN 33 PHE QD 4.06
&rst
ixpk= 0, nxpk= 0, iat= 452, -1, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
igr2= 460, 468,
&end
#
# 33 PHE HN 34 THR HN 5.28
&rst
ixpk= 0, nxpk= 0, iat= 452, 472, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 33 PHE HN 47 PHE QE 5.20
&rst
ixpk= 0, nxpk= 0, iat= 452, -1, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
igr2= 672, 676,
&end
#
# 33 PHE HN 47 PHE QE 5.20
&rst
ixpk= 0, nxpk= 0, iat= 452, -1, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
igr2= 672, 676,
&end
#
# 33 PHE HN 47 PHE QE 5.20
&rst
ixpk= 0, nxpk= 0, iat= 452, -1, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
igr2= 672, 676,
&end
#
# 33 PHE HN 108 PRO HA 5.73
&rst
ixpk= 0, nxpk= 0, iat= 452,1505, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23, &end
#
# 33 PHE HN 108 PRO HA 5.73
&rst
ixpk= 0, nxpk= 0, iat= 452,1505, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23, &end
#
# 33 PHE HN 108 PRO HA 5.73
&rst
ixpk= 0, nxpk= 0, iat= 452,1505, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23, &end
#
# 33 PHE HN 109 VAL HN 4.32
&rst
ixpk= 0, nxpk= 0, iat= 452,1509, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82, &end
#
# 33 PHE HN 109 VAL HN 4.32
&rst
ixpk= 0, nxpk= 0, iat= 452,1509, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82, &end
#
# 33 PHE HN 109 VAL HN 4.32
&rst
ixpk= 0, nxpk= 0, iat= 452,1509, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82, &end
#
# 33 PHE HN 109 VAL HB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 452,1513, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 33 PHE HN 109 VAL HB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 452,1513, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 33 PHE HN 109 VAL HB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 452,1513, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 33 PHE HN 109 VAL QG2 4.69
&rst
ixpk= 0, nxpk= 0, iat= 452, -1, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr2=1519,1520,1521,
&end
#
# 33 PHE HN 109 VAL QG2 4.69
&rst
ixpk= 0, nxpk= 0, iat= 452, -1, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr2=1519,1520,1521,
&end
#
# 33 PHE HN 109 VAL QG2 4.69
&rst
ixpk= 0, nxpk= 0, iat= 452, -1, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr2=1519,1520,1521,
&end
#
# 33 PHE HN 110 THR HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 452,1525, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 33 PHE HN 110 THR HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 452,1525, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 33 PHE HN 110 THR HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 452,1525, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 33 PHE HN 110 THR HA 4.39
&rst
ixpk= 0, nxpk= 0, iat= 452,1527, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89, &end
#
# 33 PHE HN 110 THR HA 4.39
&rst
ixpk= 0, nxpk= 0, iat= 452,1527, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89, &end
#
# 33 PHE HN 110 THR HA 4.39
&rst
ixpk= 0, nxpk= 0, iat= 452,1527, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89, &end
#
# 33 PHE HN 110 THR HB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 452,1529, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 33 PHE HN 110 THR HB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 452,1529, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 33 PHE HN 110 THR HB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 452,1529, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 33 PHE HN 110 THR QG2 5.79
&rst
ixpk= 0, nxpk= 0, iat= 452, -1, r1= 1.30, r2= 1.80, r3= 6.95, r4= 7.45,
igr2=1531,1532,1533,
&end
#
# 33 PHE HN 110 THR QG2 5.79
&rst
ixpk= 0, nxpk= 0, iat= 452, -1, r1= 1.30, r2= 1.80, r3= 6.95, r4= 7.45,
igr2=1531,1532,1533,
&end
#
# 33 PHE HN 110 THR QG2 5.79
&rst
ixpk= 0, nxpk= 0, iat= 452, -1, r1= 1.30, r2= 1.80, r3= 6.95, r4= 7.45,
igr2=1531,1532,1533,
&end
#
# 33 PHE HN 111 ALA HN 5.30
&rst
ixpk= 0, nxpk= 0, iat= 452,1539, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80, &end
#
# 33 PHE HN 111 ALA HN 5.30
&rst
ixpk= 0, nxpk= 0, iat= 452,1539, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80, &end
#
# 33 PHE HN 111 ALA HN 5.30
&rst
ixpk= 0, nxpk= 0, iat= 452,1539, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80, &end
#
# 33 PHE HN 111 ALA QB 6.02
&rst
ixpk= 0, nxpk= 0, iat= 452, -1, r1= 1.30, r2= 1.80, r3= 7.23, r4= 7.73,
igr2=1543,1544,1545,
&end
#
# 33 PHE HN 111 ALA QB 6.02
&rst
ixpk= 0, nxpk= 0, iat= 452, -1, r1= 1.30, r2= 1.80, r3= 7.23, r4= 7.73,
igr2=1543,1544,1545,
&end
#
# 33 PHE HN 111 ALA QB 6.02
&rst
ixpk= 0, nxpk= 0, iat= 452, -1, r1= 1.30, r2= 1.80, r3= 7.23, r4= 7.73,
igr2=1543,1544,1545,
&end
#
# 33 PHE HA 33 PHE HB2 4.29
&rst
ixpk= 0, nxpk= 0, iat= 454, 456, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79, &end
#
# 33 PHE HA 33 PHE HB3 4.59
&rst
ixpk= 0, nxpk= 0, iat= 454, 457, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 33 PHE HA 33 PHE QD 5.15
&rst
ixpk= 0, nxpk= 0, iat= 454, -1, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr2= 460, 468,
&end
#
# 33 PHE HA 33 PHE QD 5.15
&rst
ixpk= 0, nxpk= 0, iat= 454, -1, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr2= 460, 468,
&end
#
# 33 PHE HA 33 PHE QD 5.15
&rst
ixpk= 0, nxpk= 0, iat= 454, -1, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr2= 460, 468,
&end
#
# 33 PHE HA 34 THR HN 2.97
&rst
ixpk= 0, nxpk= 0, iat= 454, 472, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 33 PHE HA 34 THR HN 3.46
&rst
ixpk= 0, nxpk= 0, iat= 454, 472, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96, &end
#
# 33 PHE HA 34 THR HN 3.46
&rst
ixpk= 0, nxpk= 0, iat= 454, 472, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96, &end
#
# 33 PHE HA 34 THR HN 3.46
&rst
ixpk= 0, nxpk= 0, iat= 454, 472, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96, &end
#
# 33 PHE HA 47 PHE QE 5.92
&rst
ixpk= 0, nxpk= 0, iat= 454, -1, r1= 1.30, r2= 1.80, r3= 6.64, r4= 7.14,
igr2= 672, 676,
&end
#
# 33 PHE HA 47 PHE QE 5.92
&rst
ixpk= 0, nxpk= 0, iat= 454, -1, r1= 1.30, r2= 1.80, r3= 6.64, r4= 7.14,
igr2= 672, 676,
&end
#
# 33 PHE HA 47 PHE QE 5.92
&rst
ixpk= 0, nxpk= 0, iat= 454, -1, r1= 1.30, r2= 1.80, r3= 6.64, r4= 7.14,
igr2= 672, 676,
&end
#
# 33 PHE HA 108 PRO HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 454,1505, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 33 PHE HA 108 PRO HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 454,1505, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 33 PHE HA 108 PRO HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 454,1505, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 33 PHE HA 125 LEU QD2 5.94
&rst
ixpk= 0, nxpk= 0, iat= 454, -1, r1= 1.30, r2= 1.80, r3= 7.13, r4= 7.63,
igr2=1780,1781,1782,
&end
#
# 33 PHE HA 125 LEU QD2 5.94
&rst
ixpk= 0, nxpk= 0, iat= 454, -1, r1= 1.30, r2= 1.80, r3= 7.13, r4= 7.63,
igr2=1780,1781,1782,
&end
#
# 33 PHE HA 125 LEU QD2 5.94
&rst
ixpk= 0, nxpk= 0, iat= 454, -1, r1= 1.30, r2= 1.80, r3= 7.13, r4= 7.63,
igr2=1780,1781,1782,
&end
#
# 33 PHE HB2 33 PHE QD 4.32
&rst
ixpk= 0, nxpk= 0, iat= 456, -1, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
igr2= 460, 468,
&end
#
# 33 PHE HB2 33 PHE HZ 6.05
&rst
ixpk= 0, nxpk= 0, iat= 456, 464, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 33 PHE HB2 33 PHE HZ 6.05
&rst
ixpk= 0, nxpk= 0, iat= 456, 464, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 33 PHE HB2 33 PHE HZ 6.05
&rst
ixpk= 0, nxpk= 0, iat= 456, 464, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 33 PHE HB2 34 THR HN 4.95
&rst
ixpk= 0, nxpk= 0, iat= 456, 472, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45, &end
#
# 33 PHE HB2 34 THR HN 4.95
&rst
ixpk= 0, nxpk= 0, iat= 456, 472, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45, &end
#
# 33 PHE HB2 34 THR HN 4.95
&rst
ixpk= 0, nxpk= 0, iat= 456, 472, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45, &end
#
# 33 PHE HB2 34 THR HN 5.72
&rst
ixpk= 0, nxpk= 0, iat= 456, 472, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 33 PHE HB2 47 PHE QE 5.38
&rst
ixpk= 0, nxpk= 0, iat= 456, -1, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54,
igr2= 672, 676,
&end
#
# 33 PHE HB2 47 PHE QE 5.38
&rst
ixpk= 0, nxpk= 0, iat= 456, -1, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54,
igr2= 672, 676,
&end
#
# 33 PHE HB2 47 PHE QE 5.38
&rst
ixpk= 0, nxpk= 0, iat= 456, -1, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54,
igr2= 672, 676,
&end
#
# 33 PHE HB2 94 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 456, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1303,1304,1305,
&end
#
# 33 PHE HB2 94 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 456, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1303,1304,1305,
&end
#
# 33 PHE HB2 94 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 456, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1303,1304,1305,
&end
#
# 33 PHE HB2 109 VAL HN 4.62
&rst
ixpk= 0, nxpk= 0, iat= 456,1509, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12, &end
#
# 33 PHE HB2 109 VAL HN 4.62
&rst
ixpk= 0, nxpk= 0, iat= 456,1509, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12, &end
#
# 33 PHE HB2 109 VAL HN 4.62
&rst
ixpk= 0, nxpk= 0, iat= 456,1509, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12, &end
#
# 33 PHE HB2 109 VAL QG2 4.22
&rst
ixpk= 0, nxpk= 0, iat= 456, -1, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
igr2=1519,1520,1521,
&end
#
# 33 PHE HB2 109 VAL QG2 4.22
&rst
ixpk= 0, nxpk= 0, iat= 456, -1, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
igr2=1519,1520,1521,
&end
#
# 33 PHE HB2 109 VAL QG2 4.22
&rst
ixpk= 0, nxpk= 0, iat= 456, -1, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
igr2=1519,1520,1521,
&end
#
# 33 PHE HB2 110 THR HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 456,1527, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 33 PHE HB2 110 THR HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 456,1527, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 33 PHE HB2 110 THR HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 456,1527, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 33 PHE HB3 33 PHE HB2 4.03
&rst
ixpk= 0, nxpk= 0, iat= 457, 456, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53, &end
#
# 33 PHE HB3 33 PHE QD 4.20
&rst
ixpk= 0, nxpk= 0, iat= 457, -1, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
igr2= 460, 468,
&end
#
# 33 PHE HB3 34 THR HN 4.96
&rst
ixpk= 0, nxpk= 0, iat= 457, 472, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46, &end
#
# 33 PHE HB3 34 THR HN 4.96
&rst
ixpk= 0, nxpk= 0, iat= 457, 472, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46, &end
#
# 33 PHE HB3 34 THR HN 4.96
&rst
ixpk= 0, nxpk= 0, iat= 457, 472, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46, &end
#
# 33 PHE HB3 47 PHE QE 5.50
&rst
ixpk= 0, nxpk= 0, iat= 457, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 672, 676,
&end
#
# 33 PHE HB3 47 PHE QE 5.50
&rst
ixpk= 0, nxpk= 0, iat= 457, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 672, 676,
&end
#
# 33 PHE HB3 47 PHE QE 5.50
&rst
ixpk= 0, nxpk= 0, iat= 457, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 672, 676,
&end
#
# 33 PHE HB3 97 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 457, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1352,1353,1354,
&end
#
# 33 PHE HB3 97 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 457, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1352,1353,1354,
&end
#
# 33 PHE HB3 97 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 457, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1352,1353,1354,
&end
#
# 33 PHE HB3 109 VAL HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 457,1509, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 33 PHE HB3 109 VAL HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 457,1509, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 33 PHE HB3 109 VAL HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 457,1509, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 33 PHE HB3 109 VAL QG2 4.92
&rst
ixpk= 0, nxpk= 0, iat= 457, -1, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41,
igr2=1519,1520,1521,
&end
#
# 33 PHE HB3 109 VAL QG2 4.92
&rst
ixpk= 0, nxpk= 0, iat= 457, -1, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41,
igr2=1519,1520,1521,
&end
#
# 33 PHE HB3 109 VAL QG2 4.92
&rst
ixpk= 0, nxpk= 0, iat= 457, -1, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41,
igr2=1519,1520,1521,
&end
#
# 33 PHE QD 34 THR HN 5.37
&rst
ixpk= 0, nxpk= 0, iat= -1, 472, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
igr1= 460, 468,
&end
#
# 33 PHE QD 34 THR HN 5.37
&rst
ixpk= 0, nxpk= 0, iat= -1, 472, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
igr1= 460, 468,
&end
#
# 33 PHE QD 34 THR HN 5.37
&rst
ixpk= 0, nxpk= 0, iat= -1, 472, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
igr1= 460, 468,
&end
#
# 33 PHE QD 94 LEU QD2 5.43
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.32, r4= 7.82,
igr1= 460, 468,
igr2=1303,1304,1305,
&end
#
# 33 PHE QD 94 LEU QD2 5.43
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.32, r4= 7.82,
igr1= 460, 468,
igr2=1303,1304,1305,
&end
#
# 33 PHE QD 94 LEU QD2 5.43
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.32, r4= 7.82,
igr1= 460, 468,
igr2=1303,1304,1305,
&end
#
# 33 PHE QD 109 VAL QG2 5.05
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
igr1= 460, 468,
igr2=1519,1520,1521,
&end
#
# 33 PHE QD 109 VAL QG2 5.05
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
igr1= 460, 468,
igr2=1519,1520,1521,
&end
#
# 33 PHE QD 109 VAL QG2 5.05
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
igr1= 460, 468,
igr2=1519,1520,1521,
&end
#
# 33 PHE QD 111 ALA QB 5.67
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
igr1= 460, 468,
igr2=1543,1544,1545,
&end
#
# 33 PHE QD 111 ALA QB 5.67
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
igr1= 460, 468,
igr2=1543,1544,1545,
&end
#
# 33 PHE QD 111 ALA QB 5.67
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
igr1= 460, 468,
igr2=1543,1544,1545,
&end
#
# 33 PHE QD 125 LEU QD2 5.14
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
igr1= 460, 468,
igr2=1780,1781,1782,
&end
#
# 33 PHE QD 125 LEU QD2 5.14
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
igr1= 460, 468,
igr2=1780,1781,1782,
&end
#
# 33 PHE QD 125 LEU QD2 5.14
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
igr1= 460, 468,
igr2=1780,1781,1782,
&end
#
# 33 PHE HZ 47 PHE QD 4.42
&rst
ixpk= 0, nxpk= 0, iat= 464, -1, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
igr2= 670, 678,
&end
#
# 33 PHE HZ 47 PHE QD 4.42
&rst
ixpk= 0, nxpk= 0, iat= 464, -1, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
igr2= 670, 678,
&end
#
# 33 PHE HZ 47 PHE QD 4.42
&rst
ixpk= 0, nxpk= 0, iat= 464, -1, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46,
igr2= 670, 678,
&end
#
# 33 PHE HZ 94 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 464, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1303,1304,1305,
&end
#
# 33 PHE HZ 94 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 464, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1303,1304,1305,
&end
#
# 33 PHE HZ 94 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 464, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1303,1304,1305,
&end
#
# 33 PHE HZ 97 LEU QD2 5.59
&rst
ixpk= 0, nxpk= 0, iat= 464, -1, r1= 1.30, r2= 1.80, r3= 6.71, r4= 7.21,
igr2=1352,1353,1354,
&end
#
# 33 PHE HZ 97 LEU QD2 5.59
&rst
ixpk= 0, nxpk= 0, iat= 464, -1, r1= 1.30, r2= 1.80, r3= 6.71, r4= 7.21,
igr2=1352,1353,1354,
&end
#
# 33 PHE HZ 97 LEU QD2 5.59
&rst
ixpk= 0, nxpk= 0, iat= 464, -1, r1= 1.30, r2= 1.80, r3= 6.71, r4= 7.21,
igr2=1352,1353,1354,
&end
#
# 33 PHE HZ 125 LEU HG 6.05
&rst
ixpk= 0, nxpk= 0, iat= 464,1774, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 33 PHE HZ 125 LEU HG 6.05
&rst
ixpk= 0, nxpk= 0, iat= 464,1774, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 33 PHE HZ 125 LEU HG 6.05
&rst
ixpk= 0, nxpk= 0, iat= 464,1774, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 33 PHE HZ 125 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 464, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1780,1781,1782,
&end
#
# 33 PHE HZ 125 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 464, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1780,1781,1782,
&end
#
# 33 PHE HZ 125 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 464, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1780,1781,1782,
&end
#
# 33 PHE HZ 127 ILE QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 464, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1816,1817,1818,
&end
#
# 33 PHE HZ 127 ILE QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 464, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1816,1817,1818,
&end
#
# 33 PHE HZ 127 ILE QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 464, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1816,1817,1818,
&end
#
# 33 PHE QE 33 PHE HB2 5.21
&rst
ixpk= 0, nxpk= 0, iat= -1, 456, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
igr1= 462, 466,
&end
#
# 33 PHE QE 33 PHE HB3 5.07
&rst
ixpk= 0, nxpk= 0, iat= -1, 457, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
igr1= 462, 466,
&end
#
# 33 PHE QE 33 PHE HZ 4.35
&rst
ixpk= 0, nxpk= 0, iat= -1, 464, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
igr1= 462, 466,
&end
#
# 33 PHE QE 34 THR HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 472, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 462, 466,
&end
#
# 33 PHE QE 34 THR HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 472, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 462, 466,
&end
#
# 33 PHE QE 34 THR HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 472, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 462, 466,
&end
#
# 33 PHE QE 47 PHE HA 5.94
&rst
ixpk= 0, nxpk= 0, iat= -1, 664, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
igr1= 462, 466,
&end
#
# 33 PHE QE 47 PHE HA 5.94
&rst
ixpk= 0, nxpk= 0, iat= -1, 664, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
igr1= 462, 466,
&end
#
# 33 PHE QE 47 PHE HA 5.94
&rst
ixpk= 0, nxpk= 0, iat= -1, 664, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
igr1= 462, 466,
&end
#
# 33 PHE QE 47 PHE HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 666, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 462, 466,
&end
#
# 33 PHE QE 47 PHE HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 666, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 462, 466,
&end
#
# 33 PHE QE 47 PHE HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 666, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 462, 466,
&end
#
# 33 PHE QE 47 PHE HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 667, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 462, 466,
&end
#
# 33 PHE QE 47 PHE HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 667, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 462, 466,
&end
#
# 33 PHE QE 47 PHE HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 667, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 462, 466,
&end
#
# 33 PHE QE 47 PHE QD 3.75
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
igr1= 462, 466,
igr2= 670, 678,
&end
#
# 33 PHE QE 47 PHE QD 3.75
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
igr1= 462, 466,
igr2= 670, 678,
&end
#
# 33 PHE QE 47 PHE QD 3.75
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
igr1= 462, 466,
igr2= 670, 678,
&end
#
# 33 PHE QE 94 LEU QD2 5.18
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.98, r4= 7.48,
igr1= 462, 466,
igr2=1303,1304,1305,
&end
#
# 33 PHE QE 94 LEU QD2 5.18
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.98, r4= 7.48,
igr1= 462, 466,
igr2=1303,1304,1305,
&end
#
# 33 PHE QE 94 LEU QD2 5.18
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.98, r4= 7.48,
igr1= 462, 466,
igr2=1303,1304,1305,
&end
#
# 33 PHE QE 97 LEU HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1344, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 462, 466,
&end
#
# 33 PHE QE 97 LEU HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1344, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 462, 466,
&end
#
# 33 PHE QE 97 LEU HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1344, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 462, 466,
&end
#
# 33 PHE QE 97 LEU QD1 4.84
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
igr1= 462, 466,
igr2=1348,1349,1350,
&end
#
# 33 PHE QE 97 LEU QD1 4.84
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
igr1= 462, 466,
igr2=1348,1349,1350,
&end
#
# 33 PHE QE 97 LEU QD1 4.84
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
igr1= 462, 466,
igr2=1348,1349,1350,
&end
#
# 33 PHE QE 97 LEU QD2 4.67
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
igr1= 462, 466,
igr2=1352,1353,1354,
&end
#
# 33 PHE QE 97 LEU QD2 4.67
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
igr1= 462, 466,
igr2=1352,1353,1354,
&end
#
# 33 PHE QE 97 LEU QD2 4.67
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
igr1= 462, 466,
igr2=1352,1353,1354,
&end
#
# 33 PHE QE 125 LEU HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1771, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 462, 466,
&end
#
# 33 PHE QE 125 LEU HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1771, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 462, 466,
&end
#
# 33 PHE QE 125 LEU HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1771, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 462, 466,
&end
#
# 33 PHE QE 125 LEU HB3 5.94
&rst
ixpk= 0, nxpk= 0, iat= -1,1772, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
igr1= 462, 466,
&end
#
# 33 PHE QE 125 LEU HB3 5.94
&rst
ixpk= 0, nxpk= 0, iat= -1,1772, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
igr1= 462, 466,
&end
#
# 33 PHE QE 125 LEU HB3 5.94
&rst
ixpk= 0, nxpk= 0, iat= -1,1772, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
igr1= 462, 466,
&end
#
# 33 PHE QE 125 LEU HG 5.07
&rst
ixpk= 0, nxpk= 0, iat= -1,1774, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
igr1= 462, 466,
&end
#
# 33 PHE QE 125 LEU HG 5.07
&rst
ixpk= 0, nxpk= 0, iat= -1,1774, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
igr1= 462, 466,
&end
#
# 33 PHE QE 125 LEU HG 5.07
&rst
ixpk= 0, nxpk= 0, iat= -1,1774, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
igr1= 462, 466,
&end
#
# 33 PHE QE 125 LEU QD1 4.44
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1= 462, 466,
igr2=1776,1777,1778,
&end
#
# 33 PHE QE 125 LEU QD1 4.44
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1= 462, 466,
igr2=1776,1777,1778,
&end
#
# 33 PHE QE 125 LEU QD1 4.44
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1= 462, 466,
igr2=1776,1777,1778,
&end
#
# 33 PHE QE 125 LEU QD2 4.58
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 462, 466,
igr2=1780,1781,1782,
&end
#
# 33 PHE QE 125 LEU QD2 4.58
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 462, 466,
igr2=1780,1781,1782,
&end
#
# 33 PHE QE 125 LEU QD2 4.58
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 462, 466,
igr2=1780,1781,1782,
&end
#
# 33 PHE QE 127 ILE HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1805, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 462, 466,
&end
#
# 33 PHE QE 127 ILE HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1805, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 462, 466,
&end
#
# 33 PHE QE 127 ILE HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1805, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 462, 466,
&end
#
# 33 PHE QE 127 ILE HG12 6.02
&rst
ixpk= 0, nxpk= 0, iat= -1,1813, r1= 1.30, r2= 1.80, r3= 6.76, r4= 7.26,
igr1= 462, 466,
&end
#
# 33 PHE QE 127 ILE HG12 6.02
&rst
ixpk= 0, nxpk= 0, iat= -1,1813, r1= 1.30, r2= 1.80, r3= 6.76, r4= 7.26,
igr1= 462, 466,
&end
#
# 33 PHE QE 127 ILE HG12 6.02
&rst
ixpk= 0, nxpk= 0, iat= -1,1813, r1= 1.30, r2= 1.80, r3= 6.76, r4= 7.26,
igr1= 462, 466,
&end
#
# 33 PHE QE 127 ILE HG13 6.02
&rst
ixpk= 0, nxpk= 0, iat= -1,1814, r1= 1.30, r2= 1.80, r3= 6.76, r4= 7.26,
igr1= 462, 466,
&end
#
# 33 PHE QE 127 ILE HG13 6.02
&rst
ixpk= 0, nxpk= 0, iat= -1,1814, r1= 1.30, r2= 1.80, r3= 6.76, r4= 7.26,
igr1= 462, 466,
&end
#
# 33 PHE QE 127 ILE HG13 6.02
&rst
ixpk= 0, nxpk= 0, iat= -1,1814, r1= 1.30, r2= 1.80, r3= 6.76, r4= 7.26,
igr1= 462, 466,
&end
#
# 33 PHE QE 127 ILE QD1 5.05
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
igr1= 462, 466,
igr2=1816,1817,1818,
&end
#
# 33 PHE QE 127 ILE QD1 5.05
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
igr1= 462, 466,
igr2=1816,1817,1818,
&end
#
# 33 PHE QE 127 ILE QD1 5.05
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
igr1= 462, 466,
igr2=1816,1817,1818,
&end
#
# 34 THR HN 34 THR HA 4.64
&rst
ixpk= 0, nxpk= 0, iat= 472, 474, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14, &end
#
# 34 THR HN 34 THR HB 4.03
&rst
ixpk= 0, nxpk= 0, iat= 472, 476, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53, &end
#
# 34 THR HN 34 THR HB 4.03
&rst
ixpk= 0, nxpk= 0, iat= 472, 476, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53, &end
#
# 34 THR HN 34 THR HB 4.03
&rst
ixpk= 0, nxpk= 0, iat= 472, 476, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53, &end
#
# 34 THR HN 34 THR QG2 4.83
&rst
ixpk= 0, nxpk= 0, iat= 472, -1, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
igr2= 478, 479, 480,
&end
#
# 34 THR HN 34 THR QG2 4.83
&rst
ixpk= 0, nxpk= 0, iat= 472, -1, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
igr2= 478, 479, 480,
&end
#
# 34 THR HN 34 THR QG2 4.83
&rst
ixpk= 0, nxpk= 0, iat= 472, -1, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
igr2= 478, 479, 480,
&end
#
# 34 THR HN 35 PRO HD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 472, 487, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 34 THR HN 35 PRO HD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 472, 487, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 34 THR HN 35 PRO HD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 472, 487, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 34 THR HN 35 PRO HD3 5.16
&rst
ixpk= 0, nxpk= 0, iat= 472, 488, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66, &end
#
# 34 THR HN 35 PRO HD3 5.16
&rst
ixpk= 0, nxpk= 0, iat= 472, 488, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66, &end
#
# 34 THR HN 35 PRO HD3 5.16
&rst
ixpk= 0, nxpk= 0, iat= 472, 488, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66, &end
#
# 34 THR HN 108 PRO HA 6.03
&rst
ixpk= 0, nxpk= 0, iat= 472,1505, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53, &end
#
# 34 THR HN 108 PRO HA 6.03
&rst
ixpk= 0, nxpk= 0, iat= 472,1505, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53, &end
#
# 34 THR HN 108 PRO HA 6.03
&rst
ixpk= 0, nxpk= 0, iat= 472,1505, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53, &end
#
# 34 THR HN 109 VAL HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 472,1509, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 34 THR HN 109 VAL HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 472,1509, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 34 THR HN 109 VAL HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 472,1509, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 34 THR HA 34 THR HB 3.06
&rst
ixpk= 0, nxpk= 0, iat= 474, 476, r1= 1.30, r2= 1.80, r3= 3.06, r4= 3.56, &end
#
# 34 THR HA 34 THR HB 3.06
&rst
ixpk= 0, nxpk= 0, iat= 474, 476, r1= 1.30, r2= 1.80, r3= 3.06, r4= 3.56, &end
#
# 34 THR HA 34 THR HB 3.06
&rst
ixpk= 0, nxpk= 0, iat= 474, 476, r1= 1.30, r2= 1.80, r3= 3.06, r4= 3.56, &end
#
# 34 THR HA 34 THR QG2 3.65
&rst
ixpk= 0, nxpk= 0, iat= 474, -1, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
igr2= 478, 479, 480,
&end
#
# 34 THR HA 34 THR QG2 3.65
&rst
ixpk= 0, nxpk= 0, iat= 474, -1, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
igr2= 478, 479, 480,
&end
#
# 34 THR HA 34 THR QG2 3.65
&rst
ixpk= 0, nxpk= 0, iat= 474, -1, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
igr2= 478, 479, 480,
&end
#
# 34 THR HA 35 PRO HD2 3.93
&rst
ixpk= 0, nxpk= 0, iat= 474, 487, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43, &end
#
# 34 THR HA 35 PRO HD2 3.93
&rst
ixpk= 0, nxpk= 0, iat= 474, 487, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43, &end
#
# 34 THR HA 35 PRO HD2 3.93
&rst
ixpk= 0, nxpk= 0, iat= 474, 487, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43, &end
#
# 34 THR HA 35 PRO HD3 4.37
&rst
ixpk= 0, nxpk= 0, iat= 474, 488, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87, &end
#
# 34 THR HA 35 PRO HD3 4.37
&rst
ixpk= 0, nxpk= 0, iat= 474, 488, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87, &end
#
# 34 THR HA 35 PRO HD3 4.37
&rst
ixpk= 0, nxpk= 0, iat= 474, 488, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87, &end
#
# 34 THR HA 108 PRO HA 4.38
&rst
ixpk= 0, nxpk= 0, iat= 474,1505, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88, &end
#
# 34 THR HA 108 PRO HA 4.38
&rst
ixpk= 0, nxpk= 0, iat= 474,1505, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88, &end
#
# 34 THR HA 108 PRO HA 4.38
&rst
ixpk= 0, nxpk= 0, iat= 474,1505, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88, &end
#
# 34 THR HA 108 PRO HB2 5.15
&rst
ixpk= 0, nxpk= 0, iat= 474,1502, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65, &end
#
# 34 THR HA 108 PRO HB2 5.15
&rst
ixpk= 0, nxpk= 0, iat= 474,1502, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65, &end
#
# 34 THR HA 108 PRO HB2 5.15
&rst
ixpk= 0, nxpk= 0, iat= 474,1502, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65, &end
#
# 34 THR HA 109 VAL HN 5.36
&rst
ixpk= 0, nxpk= 0, iat= 474,1509, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86, &end
#
# 34 THR HA 109 VAL HN 5.36
&rst
ixpk= 0, nxpk= 0, iat= 474,1509, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86, &end
#
# 34 THR HA 109 VAL HN 5.36
&rst
ixpk= 0, nxpk= 0, iat= 474,1509, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86, &end
#
# 34 THR QG2 34 THR HB 3.90
&rst
ixpk= 0, nxpk= 0, iat= -1, 476, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
igr1= 478, 479, 480,
&end
#
# 34 THR QG2 35 PRO HD3 4.66
&rst
ixpk= 0, nxpk= 0, iat= -1, 488, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
igr1= 478, 479, 480,
&end
#
# 34 THR QG2 35 PRO HD3 4.66
&rst
ixpk= 0, nxpk= 0, iat= -1, 488, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
igr1= 478, 479, 480,
&end
#
# 34 THR QG2 35 PRO HD3 4.66
&rst
ixpk= 0, nxpk= 0, iat= -1, 488, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
igr1= 478, 479, 480,
&end
#
# 34 THR QG2 108 PRO HA 4.78
&rst
ixpk= 0, nxpk= 0, iat= -1,1505, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
igr1= 478, 479, 480,
&end
#
# 34 THR QG2 108 PRO HA 4.78
&rst
ixpk= 0, nxpk= 0, iat= -1,1505, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
igr1= 478, 479, 480,
&end
#
# 34 THR QG2 108 PRO HA 4.78
&rst
ixpk= 0, nxpk= 0, iat= -1,1505, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
igr1= 478, 479, 480,
&end
#
# 34 THR QG2 108 PRO HD2 5.71
&rst
ixpk= 0, nxpk= 0, iat= -1,1496, r1= 1.30, r2= 1.80, r3= 6.86, r4= 7.36,
igr1= 478, 479, 480,
&end
#
# 34 THR QG2 108 PRO HD2 5.71
&rst
ixpk= 0, nxpk= 0, iat= -1,1496, r1= 1.30, r2= 1.80, r3= 6.86, r4= 7.36,
igr1= 478, 479, 480,
&end
#
# 34 THR QG2 108 PRO HD3 5.71
&rst
ixpk= 0, nxpk= 0, iat= -1,1497, r1= 1.30, r2= 1.80, r3= 6.86, r4= 7.36,
igr1= 478, 479, 480,
&end
#
# 35 PRO HA 35 PRO HB2 4.57
&rst
ixpk= 0, nxpk= 0, iat= 496, 493, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07, &end
#
# 35 PRO HA 35 PRO HG3 5.30
&rst
ixpk= 0, nxpk= 0, iat= 496, 491, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80, &end
#
# 35 PRO HA 36 HID HN 3.80
&rst
ixpk= 0, nxpk= 0, iat= 496, 500, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30, &end
#
# 35 PRO HA 36 HID HN 3.80
&rst
ixpk= 0, nxpk= 0, iat= 496, 500, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30, &end
#
# 35 PRO HA 36 HID HN 3.80
&rst
ixpk= 0, nxpk= 0, iat= 496, 500, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30, &end
#
# 35 PRO HA 36 HID HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 496, 504, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 35 PRO HA 36 HID HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 496, 504, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 35 PRO HA 36 HID HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 496, 504, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 35 PRO HA 36 HID HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 496, 505, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 35 PRO HA 36 HID HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 496, 505, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 35 PRO HA 36 HID HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 496, 505, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 35 PRO HA 37 LEU HN 5.80
&rst
ixpk= 0, nxpk= 0, iat= 496, 517, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30, &end
#
# 35 PRO HA 37 LEU HN 5.80
&rst
ixpk= 0, nxpk= 0, iat= 496, 517, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30, &end
#
# 35 PRO HA 37 LEU HN 5.80
&rst
ixpk= 0, nxpk= 0, iat= 496, 517, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30, &end
#
# 35 PRO HA 37 LEU QD1 5.31
&rst
ixpk= 0, nxpk= 0, iat= 496, -1, r1= 1.30, r2= 1.80, r3= 6.38, r4= 6.88,
igr2= 526, 527, 528,
&end
#
# 35 PRO HA 37 LEU QD1 5.31
&rst
ixpk= 0, nxpk= 0, iat= 496, -1, r1= 1.30, r2= 1.80, r3= 6.38, r4= 6.88,
igr2= 526, 527, 528,
&end
#
# 35 PRO HA 37 LEU QD1 5.31
&rst
ixpk= 0, nxpk= 0, iat= 496, -1, r1= 1.30, r2= 1.80, r3= 6.38, r4= 6.88,
igr2= 526, 527, 528,
&end
#
# 35 PRO HA 97 LEU QD1 5.75
&rst
ixpk= 0, nxpk= 0, iat= 496, -1, r1= 1.30, r2= 1.80, r3= 6.91, r4= 7.41,
igr2=1348,1349,1350,
&end
#
# 35 PRO HA 97 LEU QD1 5.75
&rst
ixpk= 0, nxpk= 0, iat= 496, -1, r1= 1.30, r2= 1.80, r3= 6.91, r4= 7.41,
igr2=1348,1349,1350,
&end
#
# 35 PRO HA 97 LEU QD1 5.75
&rst
ixpk= 0, nxpk= 0, iat= 496, -1, r1= 1.30, r2= 1.80, r3= 6.91, r4= 7.41,
igr2=1348,1349,1350,
&end
#
# 35 PRO HA 105 ALA QB 4.88
&rst
ixpk= 0, nxpk= 0, iat= 496, -1, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
igr2=1460,1461,1462,
&end
#
# 35 PRO HA 105 ALA QB 4.88
&rst
ixpk= 0, nxpk= 0, iat= 496, -1, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
igr2=1460,1461,1462,
&end
#
# 35 PRO HA 105 ALA QB 4.88
&rst
ixpk= 0, nxpk= 0, iat= 496, -1, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
igr2=1460,1461,1462,
&end
#
# 35 PRO HB2 36 HID HN 4.75
&rst
ixpk= 0, nxpk= 0, iat= 493, 500, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, &end
#
# 35 PRO HB2 36 HID HN 4.75
&rst
ixpk= 0, nxpk= 0, iat= 493, 500, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, &end
#
# 35 PRO HB2 36 HID HN 4.75
&rst
ixpk= 0, nxpk= 0, iat= 493, 500, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, &end
#
# 35 PRO HB2 37 LEU HN 4.85
&rst
ixpk= 0, nxpk= 0, iat= 493, 517, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35, &end
#
# 35 PRO HB2 37 LEU HN 4.85
&rst
ixpk= 0, nxpk= 0, iat= 493, 517, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35, &end
#
# 35 PRO HB2 37 LEU HN 4.85
&rst
ixpk= 0, nxpk= 0, iat= 493, 517, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35, &end
#
# 35 PRO HB2 37 LEU QD1 5.45
&rst
ixpk= 0, nxpk= 0, iat= 493, -1, r1= 1.30, r2= 1.80, r3= 6.55, r4= 7.05,
igr2= 526, 527, 528,
&end
#
# 35 PRO HB2 37 LEU QD1 5.45
&rst
ixpk= 0, nxpk= 0, iat= 493, -1, r1= 1.30, r2= 1.80, r3= 6.55, r4= 7.05,
igr2= 526, 527, 528,
&end
#
# 35 PRO HB2 37 LEU QD1 5.45
&rst
ixpk= 0, nxpk= 0, iat= 493, -1, r1= 1.30, r2= 1.80, r3= 6.55, r4= 7.05,
igr2= 526, 527, 528,
&end
#
# 35 PRO HB2 97 LEU QD1 4.47
&rst
ixpk= 0, nxpk= 0, iat= 493, -1, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr2=1348,1349,1350,
&end
#
# 35 PRO HB2 97 LEU QD1 4.47
&rst
ixpk= 0, nxpk= 0, iat= 493, -1, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr2=1348,1349,1350,
&end
#
# 35 PRO HB2 97 LEU QD1 4.47
&rst
ixpk= 0, nxpk= 0, iat= 493, -1, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr2=1348,1349,1350,
&end
#
# 35 PRO HB2 106 THR HB 5.76
&rst
ixpk= 0, nxpk= 0, iat= 493,1470, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26, &end
#
# 35 PRO HB2 106 THR HB 5.76
&rst
ixpk= 0, nxpk= 0, iat= 493,1470, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26, &end
#
# 35 PRO HB2 106 THR HB 5.76
&rst
ixpk= 0, nxpk= 0, iat= 493,1470, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26, &end
#
# 35 PRO HB3 35 PRO HA 4.21
&rst
ixpk= 0, nxpk= 0, iat= 494, 496, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71, &end
#
# 35 PRO HB3 37 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 494, 517, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 35 PRO HB3 37 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 494, 517, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 35 PRO HB3 37 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 494, 517, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 35 PRO HB3 37 LEU QD1 5.81
&rst
ixpk= 0, nxpk= 0, iat= 494, -1, r1= 1.30, r2= 1.80, r3= 6.98, r4= 7.48,
igr2= 526, 527, 528,
&end
#
# 35 PRO HB3 37 LEU QD1 5.81
&rst
ixpk= 0, nxpk= 0, iat= 494, -1, r1= 1.30, r2= 1.80, r3= 6.98, r4= 7.48,
igr2= 526, 527, 528,
&end
#
# 35 PRO HB3 37 LEU QD1 5.81
&rst
ixpk= 0, nxpk= 0, iat= 494, -1, r1= 1.30, r2= 1.80, r3= 6.98, r4= 7.48,
igr2= 526, 527, 528,
&end
#
# 35 PRO HB3 97 LEU QD1 5.78
&rst
ixpk= 0, nxpk= 0, iat= 494, -1, r1= 1.30, r2= 1.80, r3= 6.94, r4= 7.44,
igr2=1348,1349,1350,
&end
#
# 35 PRO HB3 97 LEU QD1 5.78
&rst
ixpk= 0, nxpk= 0, iat= 494, -1, r1= 1.30, r2= 1.80, r3= 6.94, r4= 7.44,
igr2=1348,1349,1350,
&end
#
# 35 PRO HB3 97 LEU QD1 5.78
&rst
ixpk= 0, nxpk= 0, iat= 494, -1, r1= 1.30, r2= 1.80, r3= 6.94, r4= 7.44,
igr2=1348,1349,1350,
&end
#
# 35 PRO HB3 107 GLU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 494,1480, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 35 PRO HB3 107 GLU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 494,1480, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 35 PRO HB3 107 GLU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 494,1480, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 35 PRO HD2 35 PRO HD3 4.39
&rst
ixpk= 0, nxpk= 0, iat= 487, 488, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89, &end
#
# 35 PRO HD2 35 PRO HG3 5.21
&rst
ixpk= 0, nxpk= 0, iat= 487, 491, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71, &end
#
# 35 PRO HD2 97 LEU QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 487, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1348,1349,1350,
&end
#
# 35 PRO HD2 97 LEU QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 487, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1348,1349,1350,
&end
#
# 35 PRO HD2 97 LEU QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 487, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1348,1349,1350,
&end
#
# 35 PRO HD2 106 THR HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 487,1468, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 35 PRO HD2 106 THR HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 487,1468, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 35 PRO HD2 106 THR HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 487,1468, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 35 PRO HD2 107 GLU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 487,1480, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 35 PRO HD2 107 GLU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 487,1480, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 35 PRO HD2 107 GLU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 487,1480, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 35 PRO HD2 107 GLU HA 5.49
&rst
ixpk= 0, nxpk= 0, iat= 487,1482, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99, &end
#
# 35 PRO HD2 107 GLU HA 5.49
&rst
ixpk= 0, nxpk= 0, iat= 487,1482, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99, &end
#
# 35 PRO HD2 107 GLU HA 5.49
&rst
ixpk= 0, nxpk= 0, iat= 487,1482, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99, &end
#
# 35 PRO HD2 108 PRO HA 4.62
&rst
ixpk= 0, nxpk= 0, iat= 487,1505, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12, &end
#
# 35 PRO HD2 108 PRO HA 4.62
&rst
ixpk= 0, nxpk= 0, iat= 487,1505, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12, &end
#
# 35 PRO HD2 108 PRO HA 4.62
&rst
ixpk= 0, nxpk= 0, iat= 487,1505, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12, &end
#
# 35 PRO HD2 108 PRO HD2 5.15
&rst
ixpk= 0, nxpk= 0, iat= 487,1496, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65, &end
#
# 35 PRO HD2 108 PRO HD2 5.15
&rst
ixpk= 0, nxpk= 0, iat= 487,1496, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65, &end
#
# 35 PRO HD2 108 PRO HD3 5.15
&rst
ixpk= 0, nxpk= 0, iat= 487,1497, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65, &end
#
# 35 PRO HD2 109 VAL HN 5.82
&rst
ixpk= 0, nxpk= 0, iat= 487,1509, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32, &end
#
# 35 PRO HD2 109 VAL HN 5.82
&rst
ixpk= 0, nxpk= 0, iat= 487,1509, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32, &end
#
# 35 PRO HD2 109 VAL HN 5.82
&rst
ixpk= 0, nxpk= 0, iat= 487,1509, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32, &end
#
# 35 PRO HD3 35 PRO HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 488, 493, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 35 PRO HD3 35 PRO HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 488, 494, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 35 PRO HD3 97 LEU QD1 5.65
&rst
ixpk= 0, nxpk= 0, iat= 488, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2=1348,1349,1350,
&end
#
# 35 PRO HD3 97 LEU QD1 5.65
&rst
ixpk= 0, nxpk= 0, iat= 488, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2=1348,1349,1350,
&end
#
# 35 PRO HD3 97 LEU QD1 5.65
&rst
ixpk= 0, nxpk= 0, iat= 488, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2=1348,1349,1350,
&end
#
# 35 PRO HD3 106 THR HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 488,1468, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 35 PRO HD3 106 THR HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 488,1468, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 35 PRO HD3 106 THR HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 488,1468, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 35 PRO HD3 107 GLU HN 5.95
&rst
ixpk= 0, nxpk= 0, iat= 488,1480, r1= 1.30, r2= 1.80, r3= 5.95, r4= 6.45, &end
#
# 35 PRO HD3 107 GLU HN 5.95
&rst
ixpk= 0, nxpk= 0, iat= 488,1480, r1= 1.30, r2= 1.80, r3= 5.95, r4= 6.45, &end
#
# 35 PRO HD3 107 GLU HN 5.95
&rst
ixpk= 0, nxpk= 0, iat= 488,1480, r1= 1.30, r2= 1.80, r3= 5.95, r4= 6.45, &end
#
# 35 PRO HD3 108 PRO HA 4.54
&rst
ixpk= 0, nxpk= 0, iat= 488,1505, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 35 PRO HD3 108 PRO HA 4.54
&rst
ixpk= 0, nxpk= 0, iat= 488,1505, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 35 PRO HD3 108 PRO HA 4.54
&rst
ixpk= 0, nxpk= 0, iat= 488,1505, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 35 PRO HD3 109 VAL HN 5.73
&rst
ixpk= 0, nxpk= 0, iat= 488,1509, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23, &end
#
# 35 PRO HD3 109 VAL HN 5.73
&rst
ixpk= 0, nxpk= 0, iat= 488,1509, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23, &end
#
# 35 PRO HD3 109 VAL HN 5.73
&rst
ixpk= 0, nxpk= 0, iat= 488,1509, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23, &end
#
# 35 PRO HG2 35 PRO HA 4.37
&rst
ixpk= 0, nxpk= 0, iat= 490, 496, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87, &end
#
# 35 PRO HG2 35 PRO HD2 4.31
&rst
ixpk= 0, nxpk= 0, iat= 490, 487, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81, &end
#
# 35 PRO HG2 35 PRO HD3 4.29
&rst
ixpk= 0, nxpk= 0, iat= 490, 488, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79, &end
#
# 35 PRO HG2 35 PRO HG3 3.71
&rst
ixpk= 0, nxpk= 0, iat= 490, 491, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21, &end
#
# 35 PRO HG2 106 THR HA 4.32
&rst
ixpk= 0, nxpk= 0, iat= 490,1468, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82, &end
#
# 35 PRO HG2 106 THR HA 4.32
&rst
ixpk= 0, nxpk= 0, iat= 490,1468, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82, &end
#
# 35 PRO HG2 106 THR HA 4.32
&rst
ixpk= 0, nxpk= 0, iat= 490,1468, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82, &end
#
# 35 PRO HG2 106 THR HB 5.73
&rst
ixpk= 0, nxpk= 0, iat= 490,1470, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23, &end
#
# 35 PRO HG2 106 THR HB 5.73
&rst
ixpk= 0, nxpk= 0, iat= 490,1470, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23, &end
#
# 35 PRO HG2 106 THR HB 5.73
&rst
ixpk= 0, nxpk= 0, iat= 490,1470, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23, &end
#
# 35 PRO HG2 107 GLU HN 4.88
&rst
ixpk= 0, nxpk= 0, iat= 490,1480, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38, &end
#
# 35 PRO HG2 107 GLU HN 4.88
&rst
ixpk= 0, nxpk= 0, iat= 490,1480, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38, &end
#
# 35 PRO HG2 107 GLU HN 4.88
&rst
ixpk= 0, nxpk= 0, iat= 490,1480, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38, &end
#
# 35 PRO HG3 35 PRO HD3 4.65
&rst
ixpk= 0, nxpk= 0, iat= 491, 488, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15, &end
#
# 35 PRO HG3 97 LEU QD1 4.36
&rst
ixpk= 0, nxpk= 0, iat= 491, -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr2=1348,1349,1350,
&end
#
# 35 PRO HG3 97 LEU QD1 4.36
&rst
ixpk= 0, nxpk= 0, iat= 491, -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr2=1348,1349,1350,
&end
#
# 35 PRO HG3 97 LEU QD1 4.36
&rst
ixpk= 0, nxpk= 0, iat= 491, -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr2=1348,1349,1350,
&end
#
# 35 PRO HG3 105 ALA QB 5.68
&rst
ixpk= 0, nxpk= 0, iat= 491, -1, r1= 1.30, r2= 1.80, r3= 6.82, r4= 7.32,
igr2=1460,1461,1462,
&end
#
# 35 PRO HG3 105 ALA QB 5.68
&rst
ixpk= 0, nxpk= 0, iat= 491, -1, r1= 1.30, r2= 1.80, r3= 6.82, r4= 7.32,
igr2=1460,1461,1462,
&end
#
# 35 PRO HG3 105 ALA QB 5.68
&rst
ixpk= 0, nxpk= 0, iat= 491, -1, r1= 1.30, r2= 1.80, r3= 6.82, r4= 7.32,
igr2=1460,1461,1462,
&end
#
# 35 PRO HG3 106 THR HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 491,1466, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 35 PRO HG3 106 THR HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 491,1466, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 35 PRO HG3 106 THR HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 491,1466, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 35 PRO HG3 106 THR HA 5.02
&rst
ixpk= 0, nxpk= 0, iat= 491,1468, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52, &end
#
# 35 PRO HG3 106 THR HA 5.02
&rst
ixpk= 0, nxpk= 0, iat= 491,1468, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52, &end
#
# 35 PRO HG3 106 THR HA 5.02
&rst
ixpk= 0, nxpk= 0, iat= 491,1468, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52, &end
#
# 35 PRO HG3 107 GLU HN 5.05
&rst
ixpk= 0, nxpk= 0, iat= 491,1480, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55, &end
#
# 35 PRO HG3 107 GLU HN 5.05
&rst
ixpk= 0, nxpk= 0, iat= 491,1480, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55, &end
#
# 35 PRO HG3 107 GLU HN 5.05
&rst
ixpk= 0, nxpk= 0, iat= 491,1480, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55, &end
#
# 36 HID HN 36 HID HA 4.22
&rst
ixpk= 0, nxpk= 0, iat= 500, 502, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 36 HID HN 36 HID HB2 4.31
&rst
ixpk= 0, nxpk= 0, iat= 500, 504, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81, &end
#
# 36 HID HN 36 HID HB2 4.31
&rst
ixpk= 0, nxpk= 0, iat= 500, 504, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81, &end
#
# 36 HID HN 36 HID HB2 4.31
&rst
ixpk= 0, nxpk= 0, iat= 500, 504, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81, &end
#
# 36 HID HN 36 HID HB3 4.49
&rst
ixpk= 0, nxpk= 0, iat= 500, 505, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99, &end
#
# 36 HID HN 36 HID HB3 4.49
&rst
ixpk= 0, nxpk= 0, iat= 500, 505, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99, &end
#
# 36 HID HN 36 HID HB3 4.49
&rst
ixpk= 0, nxpk= 0, iat= 500, 505, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99, &end
#
# 36 HID HN 36 HID HD2 4.58
&rst
ixpk= 0, nxpk= 0, iat= 500, 513, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08, &end
#
# 36 HID HN 36 HID HD2 4.58
&rst
ixpk= 0, nxpk= 0, iat= 500, 513, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08, &end
#
# 36 HID HN 36 HID HD2 4.58
&rst
ixpk= 0, nxpk= 0, iat= 500, 513, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08, &end
#
# 36 HID HN 37 LEU HN 4.17
&rst
ixpk= 0, nxpk= 0, iat= 500, 517, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67, &end
#
# 36 HID HN 37 LEU HN 4.17
&rst
ixpk= 0, nxpk= 0, iat= 500, 517, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67, &end
#
# 36 HID HN 37 LEU HN 4.17
&rst
ixpk= 0, nxpk= 0, iat= 500, 517, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67, &end
#
# 36 HID HN 37 LEU HN 5.28
&rst
ixpk= 0, nxpk= 0, iat= 500, 517, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 36 HID HN 37 LEU HA 5.86
&rst
ixpk= 0, nxpk= 0, iat= 500, 519, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36, &end
#
# 36 HID HN 37 LEU HA 5.86
&rst
ixpk= 0, nxpk= 0, iat= 500, 519, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36, &end
#
# 36 HID HN 37 LEU HA 5.86
&rst
ixpk= 0, nxpk= 0, iat= 500, 519, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36, &end
#
# 36 HID HN 37 LEU HB2 5.37
&rst
ixpk= 0, nxpk= 0, iat= 500, 521, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87, &end
#
# 36 HID HN 37 LEU HB2 5.37
&rst
ixpk= 0, nxpk= 0, iat= 500, 521, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87, &end
#
# 36 HID HN 37 LEU HB2 5.37
&rst
ixpk= 0, nxpk= 0, iat= 500, 521, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87, &end
#
# 36 HID HN 37 LEU HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 500, 522, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 36 HID HN 37 LEU HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 500, 522, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 36 HID HN 37 LEU HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 500, 522, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 36 HID HN 37 LEU HG 4.28
&rst
ixpk= 0, nxpk= 0, iat= 500, 524, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78, &end
#
# 36 HID HN 37 LEU HG 4.28
&rst
ixpk= 0, nxpk= 0, iat= 500, 524, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78, &end
#
# 36 HID HN 37 LEU HG 4.28
&rst
ixpk= 0, nxpk= 0, iat= 500, 524, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78, &end
#
# 36 HID HN 37 LEU QD1 4.38
&rst
ixpk= 0, nxpk= 0, iat= 500, -1, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr2= 526, 527, 528,
&end
#
# 36 HID HN 37 LEU QD1 4.38
&rst
ixpk= 0, nxpk= 0, iat= 500, -1, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr2= 526, 527, 528,
&end
#
# 36 HID HN 37 LEU QD1 4.38
&rst
ixpk= 0, nxpk= 0, iat= 500, -1, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr2= 526, 527, 528,
&end
#
# 36 HID HN 97 LEU QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 500, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1348,1349,1350,
&end
#
# 36 HID HN 97 LEU QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 500, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1348,1349,1350,
&end
#
# 36 HID HN 97 LEU QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 500, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1348,1349,1350,
&end
#
# 36 HID HN 105 ALA QB 4.33
&rst
ixpk= 0, nxpk= 0, iat= 500, -1, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
igr2=1460,1461,1462,
&end
#
# 36 HID HN 105 ALA QB 4.33
&rst
ixpk= 0, nxpk= 0, iat= 500, -1, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
igr2=1460,1461,1462,
&end
#
# 36 HID HN 105 ALA QB 4.33
&rst
ixpk= 0, nxpk= 0, iat= 500, -1, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
igr2=1460,1461,1462,
&end
#
# 36 HID HA 36 HID HB2 4.47
&rst
ixpk= 0, nxpk= 0, iat= 502, 504, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97, &end
#
# 36 HID HA 36 HID HB3 4.16
&rst
ixpk= 0, nxpk= 0, iat= 502, 505, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66, &end
#
# 36 HID HA 36 HID HD2 5.79
&rst
ixpk= 0, nxpk= 0, iat= 502, 513, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29, &end
#
# 36 HID HA 36 HID HD2 5.79
&rst
ixpk= 0, nxpk= 0, iat= 502, 513, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29, &end
#
# 36 HID HA 36 HID HD2 5.79
&rst
ixpk= 0, nxpk= 0, iat= 502, 513, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29, &end
#
# 36 HID HA 37 LEU HN 2.97
&rst
ixpk= 0, nxpk= 0, iat= 502, 517, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 36 HID HA 37 LEU HN 3.46
&rst
ixpk= 0, nxpk= 0, iat= 502, 517, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96, &end
#
# 36 HID HA 37 LEU HN 3.46
&rst
ixpk= 0, nxpk= 0, iat= 502, 517, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96, &end
#
# 36 HID HA 37 LEU HN 3.46
&rst
ixpk= 0, nxpk= 0, iat= 502, 517, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96, &end
#
# 36 HID HA 37 LEU HA 5.62
&rst
ixpk= 0, nxpk= 0, iat= 502, 519, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12, &end
#
# 36 HID HA 37 LEU HA 5.62
&rst
ixpk= 0, nxpk= 0, iat= 502, 519, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12, &end
#
# 36 HID HA 37 LEU HA 5.62
&rst
ixpk= 0, nxpk= 0, iat= 502, 519, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12, &end
#
# 36 HID HA 37 LEU HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 502, 521, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 36 HID HA 37 LEU HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 502, 521, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 36 HID HA 37 LEU HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 502, 521, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 36 HID HA 38 LYS QE 5.57
&rst
ixpk= 0, nxpk= 0, iat= 502, -1, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75,
igr2= 549, 550,
&end
#
# 36 HID HA 38 LYS QE 5.57
&rst
ixpk= 0, nxpk= 0, iat= 502, -1, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75,
igr2= 549, 550,
&end
#
# 36 HID HA 38 LYS QE 5.57
&rst
ixpk= 0, nxpk= 0, iat= 502, -1, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75,
igr2= 549, 550,
&end
#
# 36 HID HA 105 ALA HN 6.01
&rst
ixpk= 0, nxpk= 0, iat= 502,1456, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51, &end
#
# 36 HID HA 105 ALA HN 6.01
&rst
ixpk= 0, nxpk= 0, iat= 502,1456, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51, &end
#
# 36 HID HA 105 ALA HN 6.01
&rst
ixpk= 0, nxpk= 0, iat= 502,1456, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51, &end
#
# 36 HID HB2 36 HID HD2 4.73
&rst
ixpk= 0, nxpk= 0, iat= 504, 513, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, &end
#
# 36 HID HB2 36 HID HE1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 504, 510, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 36 HID HB2 37 LEU HN 4.72
&rst
ixpk= 0, nxpk= 0, iat= 504, 517, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22, &end
#
# 36 HID HB2 37 LEU HN 4.72
&rst
ixpk= 0, nxpk= 0, iat= 504, 517, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22, &end
#
# 36 HID HB2 37 LEU HN 4.72
&rst
ixpk= 0, nxpk= 0, iat= 504, 517, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22, &end
#
# 36 HID HB2 37 LEU HN 5.72
&rst
ixpk= 0, nxpk= 0, iat= 504, 517, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 36 HID HB2 37 LEU QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 504, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 526, 527, 528,
&end
#
# 36 HID HB2 37 LEU QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 504, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 526, 527, 528,
&end
#
# 36 HID HB2 37 LEU QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 504, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 526, 527, 528,
&end
#
# 36 HID HB3 36 HID HB2 3.21
&rst
ixpk= 0, nxpk= 0, iat= 505, 504, r1= 1.30, r2= 1.80, r3= 3.21, r4= 3.71, &end
#
# 36 HID HB3 36 HID HD2 5.05
&rst
ixpk= 0, nxpk= 0, iat= 505, 513, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55, &end
#
# 36 HID HB3 36 HID HE1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 505, 510, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 36 HID HB3 37 LEU HN 5.06
&rst
ixpk= 0, nxpk= 0, iat= 505, 517, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56, &end
#
# 36 HID HB3 37 LEU HN 5.06
&rst
ixpk= 0, nxpk= 0, iat= 505, 517, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56, &end
#
# 36 HID HB3 37 LEU HN 5.06
&rst
ixpk= 0, nxpk= 0, iat= 505, 517, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56, &end
#
# 36 HID HB3 37 LEU QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 505, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 526, 527, 528,
&end
#
# 36 HID HB3 37 LEU QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 505, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 526, 527, 528,
&end
#
# 36 HID HB3 37 LEU QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 505, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 526, 527, 528,
&end
#
# 36 HID HD2 37 LEU QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 513, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 526, 527, 528,
&end
#
# 36 HID HD2 37 LEU QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 513, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 526, 527, 528,
&end
#
# 36 HID HD2 37 LEU QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 513, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 526, 527, 528,
&end
#
# 36 HID HE1 36 HID HD2 5.75
&rst
ixpk= 0, nxpk= 0, iat= 510, 513, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25, &end
#
# 37 LEU HN 37 LEU HA 4.49
&rst
ixpk= 0, nxpk= 0, iat= 517, 519, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99, &end
#
# 37 LEU HN 37 LEU HB2 4.08
&rst
ixpk= 0, nxpk= 0, iat= 517, 521, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58, &end
#
# 37 LEU HN 37 LEU HB2 4.08
&rst
ixpk= 0, nxpk= 0, iat= 517, 521, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58, &end
#
# 37 LEU HN 37 LEU HB2 4.08
&rst
ixpk= 0, nxpk= 0, iat= 517, 521, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58, &end
#
# 37 LEU HN 37 LEU HB3 3.93
&rst
ixpk= 0, nxpk= 0, iat= 517, 522, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43, &end
#
# 37 LEU HN 37 LEU HB3 3.93
&rst
ixpk= 0, nxpk= 0, iat= 517, 522, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43, &end
#
# 37 LEU HN 37 LEU HB3 3.93
&rst
ixpk= 0, nxpk= 0, iat= 517, 522, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43, &end
#
# 37 LEU HN 37 LEU HG 4.19
&rst
ixpk= 0, nxpk= 0, iat= 517, 524, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69, &end
#
# 37 LEU HN 37 LEU HG 4.19
&rst
ixpk= 0, nxpk= 0, iat= 517, 524, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69, &end
#
# 37 LEU HN 37 LEU HG 4.19
&rst
ixpk= 0, nxpk= 0, iat= 517, 524, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69, &end
#
# 37 LEU HN 37 LEU QD1 3.86
&rst
ixpk= 0, nxpk= 0, iat= 517, -1, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
igr2= 526, 527, 528,
&end
#
# 37 LEU HN 37 LEU QD1 3.86
&rst
ixpk= 0, nxpk= 0, iat= 517, -1, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
igr2= 526, 527, 528,
&end
#
# 37 LEU HN 37 LEU QD1 3.86
&rst
ixpk= 0, nxpk= 0, iat= 517, -1, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
igr2= 526, 527, 528,
&end
#
# 37 LEU HN 37 LEU QD2 4.30
&rst
ixpk= 0, nxpk= 0, iat= 517, -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
igr2= 530, 531, 532,
&end
#
# 37 LEU HN 37 LEU QD2 4.30
&rst
ixpk= 0, nxpk= 0, iat= 517, -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
igr2= 530, 531, 532,
&end
#
# 37 LEU HN 37 LEU QD2 4.30
&rst
ixpk= 0, nxpk= 0, iat= 517, -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
igr2= 530, 531, 532,
&end
#
# 37 LEU HN 38 LYS HN 5.28
&rst
ixpk= 0, nxpk= 0, iat= 517, 536, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 37 LEU HN 38 LYS HN 5.46
&rst
ixpk= 0, nxpk= 0, iat= 517, 536, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96, &end
#
# 37 LEU HN 38 LYS HN 5.46
&rst
ixpk= 0, nxpk= 0, iat= 517, 536, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96, &end
#
# 37 LEU HN 38 LYS HN 5.46
&rst
ixpk= 0, nxpk= 0, iat= 517, 536, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96, &end
#
# 37 LEU HN 38 LYS QE 6.05
&rst
ixpk= 0, nxpk= 0, iat= 517, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2= 549, 550,
&end
#
# 37 LEU HN 38 LYS QE 6.05
&rst
ixpk= 0, nxpk= 0, iat= 517, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2= 549, 550,
&end
#
# 37 LEU HN 38 LYS QE 6.05
&rst
ixpk= 0, nxpk= 0, iat= 517, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2= 549, 550,
&end
#
# 37 LEU HN 97 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 517, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1352,1353,1354,
&end
#
# 37 LEU HN 97 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 517, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1352,1353,1354,
&end
#
# 37 LEU HN 97 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 517, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1352,1353,1354,
&end
#
# 37 LEU HN 105 ALA HN 4.78
&rst
ixpk= 0, nxpk= 0, iat= 517,1456, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, &end
#
# 37 LEU HN 105 ALA HN 4.78
&rst
ixpk= 0, nxpk= 0, iat= 517,1456, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, &end
#
# 37 LEU HN 105 ALA HN 4.78
&rst
ixpk= 0, nxpk= 0, iat= 517,1456, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, &end
#
# 37 LEU HN 105 ALA QB 4.80
&rst
ixpk= 0, nxpk= 0, iat= 517, -1, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
igr2=1460,1461,1462,
&end
#
# 37 LEU HN 105 ALA QB 4.80
&rst
ixpk= 0, nxpk= 0, iat= 517, -1, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
igr2=1460,1461,1462,
&end
#
# 37 LEU HN 105 ALA QB 4.80
&rst
ixpk= 0, nxpk= 0, iat= 517, -1, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
igr2=1460,1461,1462,
&end
#
# 37 LEU HA 37 LEU HB2 4.87
&rst
ixpk= 0, nxpk= 0, iat= 519, 521, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37, &end
#
# 37 LEU HA 37 LEU HB3 4.53
&rst
ixpk= 0, nxpk= 0, iat= 519, 522, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03, &end
#
# 37 LEU HA 37 LEU HG 4.65
&rst
ixpk= 0, nxpk= 0, iat= 519, 524, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15, &end
#
# 37 LEU HA 37 LEU HG 4.65
&rst
ixpk= 0, nxpk= 0, iat= 519, 524, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15, &end
#
# 37 LEU HA 37 LEU HG 4.65
&rst
ixpk= 0, nxpk= 0, iat= 519, 524, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15, &end
#
# 37 LEU HA 37 LEU QD1 4.21
&rst
ixpk= 0, nxpk= 0, iat= 519, -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
igr2= 526, 527, 528,
&end
#
# 37 LEU HA 37 LEU QD1 4.21
&rst
ixpk= 0, nxpk= 0, iat= 519, -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
igr2= 526, 527, 528,
&end
#
# 37 LEU HA 37 LEU QD1 4.21
&rst
ixpk= 0, nxpk= 0, iat= 519, -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
igr2= 526, 527, 528,
&end
#
# 37 LEU HA 37 LEU QD2 3.76
&rst
ixpk= 0, nxpk= 0, iat= 519, -1, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
igr2= 530, 531, 532,
&end
#
# 37 LEU HA 37 LEU QD2 3.76
&rst
ixpk= 0, nxpk= 0, iat= 519, -1, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
igr2= 530, 531, 532,
&end
#
# 37 LEU HA 37 LEU QD2 3.76
&rst
ixpk= 0, nxpk= 0, iat= 519, -1, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
igr2= 530, 531, 532,
&end
#
# 37 LEU HA 38 LYS HN 2.97
&rst
ixpk= 0, nxpk= 0, iat= 519, 536, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 37 LEU HA 38 LYS HN 3.48
&rst
ixpk= 0, nxpk= 0, iat= 519, 536, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98, &end
#
# 37 LEU HA 38 LYS HN 3.48
&rst
ixpk= 0, nxpk= 0, iat= 519, 536, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98, &end
#
# 37 LEU HA 38 LYS HN 3.48
&rst
ixpk= 0, nxpk= 0, iat= 519, 536, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98, &end
#
# 37 LEU HA 38 LYS QE 5.95
&rst
ixpk= 0, nxpk= 0, iat= 519, -1, r1= 1.30, r2= 1.80, r3= 6.68, r4= 7.18,
igr2= 549, 550,
&end
#
# 37 LEU HA 38 LYS QE 5.95
&rst
ixpk= 0, nxpk= 0, iat= 519, -1, r1= 1.30, r2= 1.80, r3= 6.68, r4= 7.18,
igr2= 549, 550,
&end
#
# 37 LEU HA 38 LYS QE 5.95
&rst
ixpk= 0, nxpk= 0, iat= 519, -1, r1= 1.30, r2= 1.80, r3= 6.68, r4= 7.18,
igr2= 549, 550,
&end
#
# 37 LEU HA 39 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 519, 558, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 37 LEU HA 39 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 519, 558, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 37 LEU HA 39 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 519, 558, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 37 LEU HA 39 ALA QB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 519, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 562, 563, 564,
&end
#
# 37 LEU HA 39 ALA QB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 519, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 562, 563, 564,
&end
#
# 37 LEU HA 39 ALA QB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 519, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 562, 563, 564,
&end
#
# 37 LEU HA 40 LEU QD1 5.59
&rst
ixpk= 0, nxpk= 0, iat= 519, -1, r1= 1.30, r2= 1.80, r3= 6.71, r4= 7.21,
igr2= 577, 578, 579,
&end
#
# 37 LEU HA 40 LEU QD1 5.59
&rst
ixpk= 0, nxpk= 0, iat= 519, -1, r1= 1.30, r2= 1.80, r3= 6.71, r4= 7.21,
igr2= 577, 578, 579,
&end
#
# 37 LEU HA 40 LEU QD1 5.59
&rst
ixpk= 0, nxpk= 0, iat= 519, -1, r1= 1.30, r2= 1.80, r3= 6.71, r4= 7.21,
igr2= 577, 578, 579,
&end
#
# 37 LEU HA 105 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 519,1456, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 37 LEU HA 105 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 519,1456, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 37 LEU HA 105 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 519,1456, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 37 LEU HB2 37 LEU QD1 4.46
&rst
ixpk= 0, nxpk= 0, iat= 521, -1, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
igr2= 526, 527, 528,
&end
#
# 37 LEU HB2 37 LEU QD1 4.46
&rst
ixpk= 0, nxpk= 0, iat= 521, -1, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
igr2= 526, 527, 528,
&end
#
# 37 LEU HB2 37 LEU QD1 4.46
&rst
ixpk= 0, nxpk= 0, iat= 521, -1, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
igr2= 526, 527, 528,
&end
#
# 37 LEU HB2 38 LYS HN 5.54
&rst
ixpk= 0, nxpk= 0, iat= 521, 536, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04, &end
#
# 37 LEU HB2 38 LYS HN 5.54
&rst
ixpk= 0, nxpk= 0, iat= 521, 536, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04, &end
#
# 37 LEU HB2 38 LYS HN 5.54
&rst
ixpk= 0, nxpk= 0, iat= 521, 536, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04, &end
#
# 37 LEU HB2 38 LYS HN 5.72
&rst
ixpk= 0, nxpk= 0, iat= 521, 536, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 37 LEU HB2 97 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 521, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1352,1353,1354,
&end
#
# 37 LEU HB2 97 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 521, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1352,1353,1354,
&end
#
# 37 LEU HB2 97 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 521, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1352,1353,1354,
&end
#
# 37 LEU HB2 105 ALA HN 4.75
&rst
ixpk= 0, nxpk= 0, iat= 521,1456, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, &end
#
# 37 LEU HB2 105 ALA HN 4.75
&rst
ixpk= 0, nxpk= 0, iat= 521,1456, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, &end
#
# 37 LEU HB2 105 ALA HN 4.75
&rst
ixpk= 0, nxpk= 0, iat= 521,1456, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, &end
#
# 37 LEU HB2 105 ALA QB 5.49
&rst
ixpk= 0, nxpk= 0, iat= 521, -1, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
igr2=1460,1461,1462,
&end
#
# 37 LEU HB2 105 ALA QB 5.49
&rst
ixpk= 0, nxpk= 0, iat= 521, -1, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
igr2=1460,1461,1462,
&end
#
# 37 LEU HB2 105 ALA QB 5.49
&rst
ixpk= 0, nxpk= 0, iat= 521, -1, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
igr2=1460,1461,1462,
&end
#
# 37 LEU HB3 37 LEU HB2 4.33
&rst
ixpk= 0, nxpk= 0, iat= 522, 521, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83, &end
#
# 37 LEU HB3 37 LEU QD1 4.38
&rst
ixpk= 0, nxpk= 0, iat= 522, -1, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr2= 526, 527, 528,
&end
#
# 37 LEU HB3 37 LEU QD1 4.38
&rst
ixpk= 0, nxpk= 0, iat= 522, -1, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr2= 526, 527, 528,
&end
#
# 37 LEU HB3 37 LEU QD1 4.38
&rst
ixpk= 0, nxpk= 0, iat= 522, -1, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr2= 526, 527, 528,
&end
#
# 37 LEU HB3 37 LEU QD2 3.98
&rst
ixpk= 0, nxpk= 0, iat= 522, -1, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
igr2= 530, 531, 532,
&end
#
# 37 LEU HB3 37 LEU QD2 3.98
&rst
ixpk= 0, nxpk= 0, iat= 522, -1, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
igr2= 530, 531, 532,
&end
#
# 37 LEU HB3 37 LEU QD2 3.98
&rst
ixpk= 0, nxpk= 0, iat= 522, -1, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
igr2= 530, 531, 532,
&end
#
# 37 LEU HB3 105 ALA QB 5.84
&rst
ixpk= 0, nxpk= 0, iat= 522, -1, r1= 1.30, r2= 1.80, r3= 7.01, r4= 7.51,
igr2=1460,1461,1462,
&end
#
# 37 LEU HB3 105 ALA QB 5.84
&rst
ixpk= 0, nxpk= 0, iat= 522, -1, r1= 1.30, r2= 1.80, r3= 7.01, r4= 7.51,
igr2=1460,1461,1462,
&end
#
# 37 LEU HB3 105 ALA QB 5.84
&rst
ixpk= 0, nxpk= 0, iat= 522, -1, r1= 1.30, r2= 1.80, r3= 7.01, r4= 7.51,
igr2=1460,1461,1462,
&end
#
# 37 LEU HG 37 LEU QD2 4.28
&rst
ixpk= 0, nxpk= 0, iat= 524, -1, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
igr2= 530, 531, 532,
&end
#
# 37 LEU HG 38 LYS HN 4.77
&rst
ixpk= 0, nxpk= 0, iat= 524, 536, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27, &end
#
# 37 LEU HG 38 LYS HN 4.77
&rst
ixpk= 0, nxpk= 0, iat= 524, 536, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27, &end
#
# 37 LEU HG 38 LYS HN 4.77
&rst
ixpk= 0, nxpk= 0, iat= 524, 536, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27, &end
#
# 37 LEU QD1 37 LEU HG 4.03
&rst
ixpk= 0, nxpk= 0, iat= -1, 524, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
igr1= 526, 527, 528,
&end
#
# 37 LEU QD1 37 LEU QD2 3.31
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
igr1= 526, 527, 528,
igr2= 530, 531, 532,
&end
#
# 37 LEU QD1 105 ALA QB 4.74
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.84, r4= 7.34,
igr1= 526, 527, 528,
igr2=1460,1461,1462,
&end
#
# 37 LEU QD1 105 ALA QB 4.74
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.84, r4= 7.34,
igr1= 526, 527, 528,
igr2=1460,1461,1462,
&end
#
# 37 LEU QD1 105 ALA QB 4.74
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.84, r4= 7.34,
igr1= 526, 527, 528,
igr2=1460,1461,1462,
&end
#
# 37 LEU QD2 38 LYS HN 4.31
&rst
ixpk= 0, nxpk= 0, iat= -1, 536, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
igr1= 530, 531, 532,
&end
#
# 37 LEU QD2 38 LYS HN 4.31
&rst
ixpk= 0, nxpk= 0, iat= -1, 536, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
igr1= 530, 531, 532,
&end
#
# 37 LEU QD2 38 LYS HN 4.31
&rst
ixpk= 0, nxpk= 0, iat= -1, 536, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
igr1= 530, 531, 532,
&end
#
# 37 LEU QD2 38 LYS QE 5.85
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.89, r4= 8.39,
igr1= 530, 531, 532,
igr2= 549, 550,
&end
#
# 37 LEU QD2 38 LYS QE 5.85
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.89, r4= 8.39,
igr1= 530, 531, 532,
igr2= 549, 550,
&end
#
# 37 LEU QD2 38 LYS QE 5.85
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.89, r4= 8.39,
igr1= 530, 531, 532,
igr2= 549, 550,
&end
#
# 37 LEU QD2 39 ALA QB 5.46
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.87, r4= 8.37,
igr1= 530, 531, 532,
igr2= 562, 563, 564,
&end
#
# 37 LEU QD2 39 ALA QB 5.46
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.87, r4= 8.37,
igr1= 530, 531, 532,
igr2= 562, 563, 564,
&end
#
# 37 LEU QD2 39 ALA QB 5.46
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.87, r4= 8.37,
igr1= 530, 531, 532,
igr2= 562, 563, 564,
&end
#
# 37 LEU QD2 149 ALA QB 4.21
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
igr1= 530, 531, 532,
igr2=2112,2113,2114,
&end
#
# 37 LEU QD2 149 ALA QB 4.21
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
igr1= 530, 531, 532,
igr2=2112,2113,2114,
&end
#
# 37 LEU QD2 149 ALA QB 4.21
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
igr1= 530, 531, 532,
igr2=2112,2113,2114,
&end
#
# 38 LYS HN 38 LYS HA 4.32
&rst
ixpk= 0, nxpk= 0, iat= 536, 538, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82, &end
#
# 38 LYS HN 38 LYS HG2 4.28
&rst
ixpk= 0, nxpk= 0, iat= 536, 543, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78, &end
#
# 38 LYS HN 38 LYS HG2 4.28
&rst
ixpk= 0, nxpk= 0, iat= 536, 543, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78, &end
#
# 38 LYS HN 38 LYS HG2 4.28
&rst
ixpk= 0, nxpk= 0, iat= 536, 543, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78, &end
#
# 38 LYS HN 38 LYS HG3 4.78
&rst
ixpk= 0, nxpk= 0, iat= 536, 544, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, &end
#
# 38 LYS HN 38 LYS HG3 4.78
&rst
ixpk= 0, nxpk= 0, iat= 536, 544, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, &end
#
# 38 LYS HN 38 LYS HG3 4.78
&rst
ixpk= 0, nxpk= 0, iat= 536, 544, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, &end
#
# 38 LYS HN 38 LYS QB 4.22
&rst
ixpk= 0, nxpk= 0, iat= 536, -1, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr2= 540, 541,
&end
#
# 38 LYS HN 38 LYS QB 4.22
&rst
ixpk= 0, nxpk= 0, iat= 536, -1, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr2= 540, 541,
&end
#
# 38 LYS HN 38 LYS QB 4.22
&rst
ixpk= 0, nxpk= 0, iat= 536, -1, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr2= 540, 541,
&end
#
# 38 LYS HN 38 LYS QD 4.58
&rst
ixpk= 0, nxpk= 0, iat= 536, -1, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
igr2= 546, 547,
&end
#
# 38 LYS HN 38 LYS QD 4.58
&rst
ixpk= 0, nxpk= 0, iat= 536, -1, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
igr2= 546, 547,
&end
#
# 38 LYS HN 38 LYS QD 4.58
&rst
ixpk= 0, nxpk= 0, iat= 536, -1, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
igr2= 546, 547,
&end
#
# 38 LYS HN 38 LYS QE 4.12
&rst
ixpk= 0, nxpk= 0, iat= 536, -1, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
igr2= 549, 550,
&end
#
# 38 LYS HN 38 LYS QE 4.12
&rst
ixpk= 0, nxpk= 0, iat= 536, -1, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
igr2= 549, 550,
&end
#
# 38 LYS HN 38 LYS QE 4.12
&rst
ixpk= 0, nxpk= 0, iat= 536, -1, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
igr2= 549, 550,
&end
#
# 38 LYS HN 39 ALA HN 5.28
&rst
ixpk= 0, nxpk= 0, iat= 536, 558, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 38 LYS HN 39 ALA HN 5.74
&rst
ixpk= 0, nxpk= 0, iat= 536, 558, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24, &end
#
# 38 LYS HN 39 ALA HN 5.74
&rst
ixpk= 0, nxpk= 0, iat= 536, 558, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24, &end
#
# 38 LYS HN 39 ALA HN 5.74
&rst
ixpk= 0, nxpk= 0, iat= 536, 558, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24, &end
#
# 38 LYS HN 39 ALA QB 5.17
&rst
ixpk= 0, nxpk= 0, iat= 536, -1, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,
igr2= 562, 563, 564,
&end
#
# 38 LYS HN 39 ALA QB 5.17
&rst
ixpk= 0, nxpk= 0, iat= 536, -1, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,
igr2= 562, 563, 564,
&end
#
# 38 LYS HN 39 ALA QB 5.17
&rst
ixpk= 0, nxpk= 0, iat= 536, -1, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,
igr2= 562, 563, 564,
&end
#
# 38 LYS HN 40 LEU QD1 5.25
&rst
ixpk= 0, nxpk= 0, iat= 536, -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
igr2= 577, 578, 579,
&end
#
# 38 LYS HN 40 LEU QD1 5.25
&rst
ixpk= 0, nxpk= 0, iat= 536, -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
igr2= 577, 578, 579,
&end
#
# 38 LYS HN 40 LEU QD1 5.25
&rst
ixpk= 0, nxpk= 0, iat= 536, -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
igr2= 577, 578, 579,
&end
#
# 38 LYS HN 104 ILE HA 5.60
&rst
ixpk= 0, nxpk= 0, iat= 536,1439, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10, &end
#
# 38 LYS HN 104 ILE HA 5.60
&rst
ixpk= 0, nxpk= 0, iat= 536,1439, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10, &end
#
# 38 LYS HN 104 ILE HA 5.60
&rst
ixpk= 0, nxpk= 0, iat= 536,1439, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10, &end
#
# 38 LYS HN 104 ILE QG2 5.61
&rst
ixpk= 0, nxpk= 0, iat= 536, -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
igr2=1443,1444,1445,
&end
#
# 38 LYS HN 104 ILE QG2 5.61
&rst
ixpk= 0, nxpk= 0, iat= 536, -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
igr2=1443,1444,1445,
&end
#
# 38 LYS HN 104 ILE QG2 5.61
&rst
ixpk= 0, nxpk= 0, iat= 536, -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
igr2=1443,1444,1445,
&end
#
# 38 LYS HA 38 LYS QB 3.64
&rst
ixpk= 0, nxpk= 0, iat= 538, -1, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59,
igr2= 540, 541,
&end
#
# 38 LYS HA 38 LYS QD 5.90
&rst
ixpk= 0, nxpk= 0, iat= 538, -1, r1= 1.30, r2= 1.80, r3= 6.62, r4= 7.12,
igr2= 546, 547,
&end
#
# 38 LYS HA 38 LYS QD 5.90
&rst
ixpk= 0, nxpk= 0, iat= 538, -1, r1= 1.30, r2= 1.80, r3= 6.62, r4= 7.12,
igr2= 546, 547,
&end
#
# 38 LYS HA 38 LYS QD 5.90
&rst
ixpk= 0, nxpk= 0, iat= 538, -1, r1= 1.30, r2= 1.80, r3= 6.62, r4= 7.12,
igr2= 546, 547,
&end
#
# 38 LYS HA 38 LYS QE 6.05
&rst
ixpk= 0, nxpk= 0, iat= 538, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2= 549, 550,
&end
#
# 38 LYS HA 38 LYS QE 6.05
&rst
ixpk= 0, nxpk= 0, iat= 538, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2= 549, 550,
&end
#
# 38 LYS HA 38 LYS QE 6.05
&rst
ixpk= 0, nxpk= 0, iat= 538, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2= 549, 550,
&end
#
# 38 LYS HA 39 ALA HN 2.97
&rst
ixpk= 0, nxpk= 0, iat= 538, 558, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 38 LYS HA 39 ALA HN 3.63
&rst
ixpk= 0, nxpk= 0, iat= 538, 558, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13, &end
#
# 38 LYS HA 39 ALA HN 3.63
&rst
ixpk= 0, nxpk= 0, iat= 538, 558, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13, &end
#
# 38 LYS HA 39 ALA HN 3.63
&rst
ixpk= 0, nxpk= 0, iat= 538, 558, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13, &end
#
# 38 LYS HA 39 ALA HA 5.20
&rst
ixpk= 0, nxpk= 0, iat= 538, 560, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70, &end
#
# 38 LYS HA 39 ALA HA 5.20
&rst
ixpk= 0, nxpk= 0, iat= 538, 560, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70, &end
#
# 38 LYS HA 39 ALA HA 5.20
&rst
ixpk= 0, nxpk= 0, iat= 538, 560, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70, &end
#
# 38 LYS HA 39 ALA QB 5.58
&rst
ixpk= 0, nxpk= 0, iat= 538, -1, r1= 1.30, r2= 1.80, r3= 6.70, r4= 7.20,
igr2= 562, 563, 564,
&end
#
# 38 LYS HA 39 ALA QB 5.58
&rst
ixpk= 0, nxpk= 0, iat= 538, -1, r1= 1.30, r2= 1.80, r3= 6.70, r4= 7.20,
igr2= 562, 563, 564,
&end
#
# 38 LYS HA 39 ALA QB 5.58
&rst
ixpk= 0, nxpk= 0, iat= 538, -1, r1= 1.30, r2= 1.80, r3= 6.70, r4= 7.20,
igr2= 562, 563, 564,
&end
#
# 38 LYS HA 40 LEU HN 5.42
&rst
ixpk= 0, nxpk= 0, iat= 538, 568, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92, &end
#
# 38 LYS HA 40 LEU HN 5.42
&rst
ixpk= 0, nxpk= 0, iat= 538, 568, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92, &end
#
# 38 LYS HA 40 LEU HN 5.42
&rst
ixpk= 0, nxpk= 0, iat= 538, 568, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92, &end
#
# 38 LYS HA 40 LEU QD1 6.04
&rst
ixpk= 0, nxpk= 0, iat= 538, -1, r1= 1.30, r2= 1.80, r3= 7.25, r4= 7.75,
igr2= 577, 578, 579,
&end
#
# 38 LYS HA 40 LEU QD1 6.04
&rst
ixpk= 0, nxpk= 0, iat= 538, -1, r1= 1.30, r2= 1.80, r3= 7.25, r4= 7.75,
igr2= 577, 578, 579,
&end
#
# 38 LYS HA 40 LEU QD1 6.04
&rst
ixpk= 0, nxpk= 0, iat= 538, -1, r1= 1.30, r2= 1.80, r3= 7.25, r4= 7.75,
igr2= 577, 578, 579,
&end
#
# 38 LYS HA 40 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 538, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 581, 582, 583,
&end
#
# 38 LYS HA 40 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 538, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 581, 582, 583,
&end
#
# 38 LYS HA 40 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 538, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 581, 582, 583,
&end
#
# 38 LYS HA 104 ILE HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 538,1437, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 38 LYS HA 104 ILE HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 538,1437, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 38 LYS HA 104 ILE HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 538,1437, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 38 LYS HA 104 ILE HA 3.94
&rst
ixpk= 0, nxpk= 0, iat= 538,1439, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44, &end
#
# 38 LYS HA 104 ILE HA 3.94
&rst
ixpk= 0, nxpk= 0, iat= 538,1439, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44, &end
#
# 38 LYS HA 104 ILE HA 3.94
&rst
ixpk= 0, nxpk= 0, iat= 538,1439, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44, &end
#
# 38 LYS HA 104 ILE HB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 538,1441, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 38 LYS HA 104 ILE HB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 538,1441, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 38 LYS HA 104 ILE HB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 538,1441, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 38 LYS HA 104 ILE HG12 4.58
&rst
ixpk= 0, nxpk= 0, iat= 538,1447, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08, &end
#
# 38 LYS HA 104 ILE HG12 4.58
&rst
ixpk= 0, nxpk= 0, iat= 538,1447, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08, &end
#
# 38 LYS HA 104 ILE HG12 4.58
&rst
ixpk= 0, nxpk= 0, iat= 538,1447, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08, &end
#
# 38 LYS HA 104 ILE HG13 5.51
&rst
ixpk= 0, nxpk= 0, iat= 538,1448, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01, &end
#
# 38 LYS HA 104 ILE HG13 5.51
&rst
ixpk= 0, nxpk= 0, iat= 538,1448, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01, &end
#
# 38 LYS HA 104 ILE HG13 5.51
&rst
ixpk= 0, nxpk= 0, iat= 538,1448, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01, &end
#
# 38 LYS HA 104 ILE QD1 4.67
&rst
ixpk= 0, nxpk= 0, iat= 538, -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr2=1450,1451,1452,
&end
#
# 38 LYS HA 104 ILE QD1 4.67
&rst
ixpk= 0, nxpk= 0, iat= 538, -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr2=1450,1451,1452,
&end
#
# 38 LYS HA 104 ILE QD1 4.67
&rst
ixpk= 0, nxpk= 0, iat= 538, -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr2=1450,1451,1452,
&end
#
# 38 LYS HA 104 ILE QG2 5.16
&rst
ixpk= 0, nxpk= 0, iat= 538, -1, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
igr2=1443,1444,1445,
&end
#
# 38 LYS HA 104 ILE QG2 5.16
&rst
ixpk= 0, nxpk= 0, iat= 538, -1, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
igr2=1443,1444,1445,
&end
#
# 38 LYS HA 104 ILE QG2 5.16
&rst
ixpk= 0, nxpk= 0, iat= 538, -1, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
igr2=1443,1444,1445,
&end
#
# 38 LYS HA 105 ALA HN 4.57
&rst
ixpk= 0, nxpk= 0, iat= 538,1456, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07, &end
#
# 38 LYS HA 105 ALA HN 4.57
&rst
ixpk= 0, nxpk= 0, iat= 538,1456, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07, &end
#
# 38 LYS HA 105 ALA HN 4.57
&rst
ixpk= 0, nxpk= 0, iat= 538,1456, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07, &end
#
# 38 LYS HB2 39 ALA HN 5.72
&rst
ixpk= 0, nxpk= 0, iat= 540, 558, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 38 LYS HG2 38 LYS HG3 3.71
&rst
ixpk= 0, nxpk= 0, iat= 543, 544, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21, &end
#
# 38 LYS HG2 38 LYS QE 4.41
&rst
ixpk= 0, nxpk= 0, iat= 543, -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr2= 549, 550,
&end
#
# 38 LYS HG2 38 LYS QE 4.41
&rst
ixpk= 0, nxpk= 0, iat= 543, -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr2= 549, 550,
&end
#
# 38 LYS HG2 38 LYS QE 4.41
&rst
ixpk= 0, nxpk= 0, iat= 543, -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr2= 549, 550,
&end
#
# 38 LYS HG2 39 ALA HN 6.03
&rst
ixpk= 0, nxpk= 0, iat= 543, 558, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53, &end
#
# 38 LYS HG2 39 ALA HN 6.03
&rst
ixpk= 0, nxpk= 0, iat= 543, 558, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53, &end
#
# 38 LYS HG2 39 ALA HN 6.03
&rst
ixpk= 0, nxpk= 0, iat= 543, 558, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53, &end
#
# 38 LYS HG3 38 LYS QD 3.55
&rst
ixpk= 0, nxpk= 0, iat= 544, -1, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48,
igr2= 546, 547,
&end
#
# 38 LYS HG3 38 LYS QE 3.83
&rst
ixpk= 0, nxpk= 0, iat= 544, -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
igr2= 549, 550,
&end
#
# 38 LYS HG3 38 LYS QE 3.83
&rst
ixpk= 0, nxpk= 0, iat= 544, -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
igr2= 549, 550,
&end
#
# 38 LYS HG3 38 LYS QE 3.83
&rst
ixpk= 0, nxpk= 0, iat= 544, -1, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80,
igr2= 549, 550,
&end
#
# 38 LYS HG3 39 ALA HN 5.15
&rst
ixpk= 0, nxpk= 0, iat= 544, 558, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65, &end
#
# 38 LYS HG3 39 ALA HN 5.15
&rst
ixpk= 0, nxpk= 0, iat= 544, 558, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65, &end
#
# 38 LYS HG3 39 ALA HN 5.15
&rst
ixpk= 0, nxpk= 0, iat= 544, 558, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65, &end
#
# 38 LYS QB 38 LYS HG3 4.38
&rst
ixpk= 0, nxpk= 0, iat= -1, 544, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
igr1= 540, 541,
&end
#
# 38 LYS QB 38 LYS QE 4.96
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75,
igr1= 540, 541,
igr2= 549, 550,
&end
#
# 38 LYS QB 38 LYS QE 4.96
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75,
igr1= 540, 541,
igr2= 549, 550,
&end
#
# 38 LYS QB 38 LYS QE 4.96
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75,
igr1= 540, 541,
igr2= 549, 550,
&end
#
# 38 LYS QB 39 ALA HN 4.52
&rst
ixpk= 0, nxpk= 0, iat= -1, 558, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
igr1= 540, 541,
&end
#
# 38 LYS QB 39 ALA HN 4.52
&rst
ixpk= 0, nxpk= 0, iat= -1, 558, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
igr1= 540, 541,
&end
#
# 38 LYS QB 39 ALA HN 4.52
&rst
ixpk= 0, nxpk= 0, iat= -1, 558, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
igr1= 540, 541,
&end
#
# 38 LYS QB 40 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 568, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 540, 541,
&end
#
# 38 LYS QB 40 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 568, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 540, 541,
&end
#
# 38 LYS QB 40 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 568, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 540, 541,
&end
#
# 38 LYS QB 104 ILE HG13 4.36
&rst
ixpk= 0, nxpk= 0, iat= -1,1448, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
igr1= 540, 541,
&end
#
# 38 LYS QB 104 ILE HG13 4.36
&rst
ixpk= 0, nxpk= 0, iat= -1,1448, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
igr1= 540, 541,
&end
#
# 38 LYS QB 104 ILE HG13 4.36
&rst
ixpk= 0, nxpk= 0, iat= -1,1448, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
igr1= 540, 541,
&end
#
# 38 LYS QB 104 ILE QD1 3.97
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,
igr1= 540, 541,
igr2=1450,1451,1452,
&end
#
# 38 LYS QB 104 ILE QD1 3.97
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,
igr1= 540, 541,
igr2=1450,1451,1452,
&end
#
# 38 LYS QB 104 ILE QD1 3.97
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85,
igr1= 540, 541,
igr2=1450,1451,1452,
&end
#
# 38 LYS QB 104 ILE QG2 3.78
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
igr1= 540, 541,
igr2=1443,1444,1445,
&end
#
# 38 LYS QB 104 ILE QG2 3.78
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
igr1= 540, 541,
igr2=1443,1444,1445,
&end
#
# 38 LYS QB 104 ILE QG2 3.78
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
igr1= 540, 541,
igr2=1443,1444,1445,
&end
#
# 38 LYS QD 38 LYS QE 3.55
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
igr1= 546, 547,
igr2= 549, 550,
&end
#
# 38 LYS QD 39 ALA HN 5.90
&rst
ixpk= 0, nxpk= 0, iat= -1, 558, r1= 1.30, r2= 1.80, r3= 6.62, r4= 7.12,
igr1= 546, 547,
&end
#
# 38 LYS QD 39 ALA HN 5.90
&rst
ixpk= 0, nxpk= 0, iat= -1, 558, r1= 1.30, r2= 1.80, r3= 6.62, r4= 7.12,
igr1= 546, 547,
&end
#
# 38 LYS QD 39 ALA HN 5.90
&rst
ixpk= 0, nxpk= 0, iat= -1, 558, r1= 1.30, r2= 1.80, r3= 6.62, r4= 7.12,
igr1= 546, 547,
&end
#
# 38 LYS QE 39 ALA HN 5.86
&rst
ixpk= 0, nxpk= 0, iat= -1, 558, r1= 1.30, r2= 1.80, r3= 6.58, r4= 7.08,
igr1= 549, 550,
&end
#
# 38 LYS QE 39 ALA HN 5.86
&rst
ixpk= 0, nxpk= 0, iat= -1, 558, r1= 1.30, r2= 1.80, r3= 6.58, r4= 7.08,
igr1= 549, 550,
&end
#
# 38 LYS QE 39 ALA HN 5.86
&rst
ixpk= 0, nxpk= 0, iat= -1, 558, r1= 1.30, r2= 1.80, r3= 6.58, r4= 7.08,
igr1= 549, 550,
&end
#
# 38 LYS QE 39 ALA QB 4.99
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1= 549, 550,
igr2= 562, 563, 564,
&end
#
# 38 LYS QE 39 ALA QB 4.99
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1= 549, 550,
igr2= 562, 563, 564,
&end
#
# 38 LYS QE 39 ALA QB 4.99
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1= 549, 550,
igr2= 562, 563, 564,
&end
#
# 38 LYS QE 40 LEU QD1 5.88
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
igr1= 549, 550,
igr2= 577, 578, 579,
&end
#
# 38 LYS QE 40 LEU QD1 5.88
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
igr1= 549, 550,
igr2= 577, 578, 579,
&end
#
# 38 LYS QE 40 LEU QD1 5.88
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
igr1= 549, 550,
igr2= 577, 578, 579,
&end
#
# 38 LYS QE 104 ILE HG13 5.91
&rst
ixpk= 0, nxpk= 0, iat= -1,1448, r1= 1.30, r2= 1.80, r3= 6.63, r4= 7.13,
igr1= 549, 550,
&end
#
# 38 LYS QE 104 ILE HG13 5.91
&rst
ixpk= 0, nxpk= 0, iat= -1,1448, r1= 1.30, r2= 1.80, r3= 6.63, r4= 7.13,
igr1= 549, 550,
&end
#
# 38 LYS QE 104 ILE HG13 5.91
&rst
ixpk= 0, nxpk= 0, iat= -1,1448, r1= 1.30, r2= 1.80, r3= 6.63, r4= 7.13,
igr1= 549, 550,
&end
#
# 39 ALA HN 39 ALA HA 3.22
&rst
ixpk= 0, nxpk= 0, iat= 558, 560, r1= 1.30, r2= 1.80, r3= 3.22, r4= 3.72, &end
#
# 39 ALA HN 39 ALA HA 3.22
&rst
ixpk= 0, nxpk= 0, iat= 558, 560, r1= 1.30, r2= 1.80, r3= 3.22, r4= 3.72, &end
#
# 39 ALA HN 39 ALA HA 3.22
&rst
ixpk= 0, nxpk= 0, iat= 558, 560, r1= 1.30, r2= 1.80, r3= 3.22, r4= 3.72, &end
#
# 39 ALA HN 39 ALA QB 3.93
&rst
ixpk= 0, nxpk= 0, iat= 558, -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
igr2= 562, 563, 564,
&end
#
# 39 ALA HN 39 ALA QB 3.93
&rst
ixpk= 0, nxpk= 0, iat= 558, -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
igr2= 562, 563, 564,
&end
#
# 39 ALA HN 39 ALA QB 3.93
&rst
ixpk= 0, nxpk= 0, iat= 558, -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
igr2= 562, 563, 564,
&end
#
# 39 ALA HN 40 LEU HN 3.86
&rst
ixpk= 0, nxpk= 0, iat= 558, 568, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 39 ALA HN 40 LEU HN 3.86
&rst
ixpk= 0, nxpk= 0, iat= 558, 568, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 39 ALA HN 40 LEU HN 3.86
&rst
ixpk= 0, nxpk= 0, iat= 558, 568, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 39 ALA HN 40 LEU HN 5.28
&rst
ixpk= 0, nxpk= 0, iat= 558, 568, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 39 ALA HN 40 LEU HG 4.97
&rst
ixpk= 0, nxpk= 0, iat= 558, 575, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 39 ALA HN 40 LEU HG 4.97
&rst
ixpk= 0, nxpk= 0, iat= 558, 575, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 39 ALA HN 40 LEU HG 4.97
&rst
ixpk= 0, nxpk= 0, iat= 558, 575, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 39 ALA HN 40 LEU QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 558, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 577, 578, 579,
&end
#
# 39 ALA HN 40 LEU QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 558, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 577, 578, 579,
&end
#
# 39 ALA HN 40 LEU QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 558, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 577, 578, 579,
&end
#
# 39 ALA HN 40 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 558, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 581, 582, 583,
&end
#
# 39 ALA HN 40 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 558, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 581, 582, 583,
&end
#
# 39 ALA HN 40 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 558, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 581, 582, 583,
&end
#
# 39 ALA HN 104 ILE HA 5.03
&rst
ixpk= 0, nxpk= 0, iat= 558,1439, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53, &end
#
# 39 ALA HN 104 ILE HA 5.03
&rst
ixpk= 0, nxpk= 0, iat= 558,1439, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53, &end
#
# 39 ALA HN 104 ILE HA 5.03
&rst
ixpk= 0, nxpk= 0, iat= 558,1439, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53, &end
#
# 39 ALA HN 104 ILE HG13 6.05
&rst
ixpk= 0, nxpk= 0, iat= 558,1448, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 39 ALA HN 104 ILE HG13 6.05
&rst
ixpk= 0, nxpk= 0, iat= 558,1448, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 39 ALA HN 104 ILE HG13 6.05
&rst
ixpk= 0, nxpk= 0, iat= 558,1448, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 39 ALA HA 40 LEU HN 2.97
&rst
ixpk= 0, nxpk= 0, iat= 560, 568, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 39 ALA HA 40 LEU HN 3.63
&rst
ixpk= 0, nxpk= 0, iat= 560, 568, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13, &end
#
# 39 ALA HA 40 LEU HN 3.63
&rst
ixpk= 0, nxpk= 0, iat= 560, 568, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13, &end
#
# 39 ALA HA 40 LEU HN 3.63
&rst
ixpk= 0, nxpk= 0, iat= 560, 568, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13, &end
#
# 39 ALA QB 40 LEU HN 5.72
&rst
ixpk= 0, nxpk= 0, iat= -1, 568, r1= 1.30, r2= 1.80, r3= 6.87, r4= 7.37,
igr1= 562, 563, 564,
&end
#
# 39 ALA QB 39 ALA HA 3.39
&rst
ixpk= 0, nxpk= 0, iat= -1, 560, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57,
igr1= 562, 563, 564,
&end
#
# 39 ALA QB 40 LEU HN 4.37
&rst
ixpk= 0, nxpk= 0, iat= -1, 568, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
igr1= 562, 563, 564,
&end
#
# 39 ALA QB 40 LEU HN 4.37
&rst
ixpk= 0, nxpk= 0, iat= -1, 568, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
igr1= 562, 563, 564,
&end
#
# 39 ALA QB 40 LEU HN 4.37
&rst
ixpk= 0, nxpk= 0, iat= -1, 568, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
igr1= 562, 563, 564,
&end
#
# 39 ALA QB 148 TYR QD 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.16, r4= 8.66,
igr1= 562, 563, 564,
igr2=2095,2104,
&end
#
# 39 ALA QB 148 TYR QD 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.16, r4= 8.66,
igr1= 562, 563, 564,
igr2=2095,2104,
&end
#
# 39 ALA QB 148 TYR QD 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.16, r4= 8.66,
igr1= 562, 563, 564,
igr2=2095,2104,
&end
#
# 40 LEU HN 40 LEU HA 4.07
&rst
ixpk= 0, nxpk= 0, iat= 568, 570, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57, &end
#
# 40 LEU HN 40 LEU HB2 4.06
&rst
ixpk= 0, nxpk= 0, iat= 568, 572, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56, &end
#
# 40 LEU HN 40 LEU HB2 4.06
&rst
ixpk= 0, nxpk= 0, iat= 568, 572, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56, &end
#
# 40 LEU HN 40 LEU HB2 4.06
&rst
ixpk= 0, nxpk= 0, iat= 568, 572, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56, &end
#
# 40 LEU HN 40 LEU HB3 4.00
&rst
ixpk= 0, nxpk= 0, iat= 568, 573, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 40 LEU HN 40 LEU HB3 4.00
&rst
ixpk= 0, nxpk= 0, iat= 568, 573, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 40 LEU HN 40 LEU HB3 4.00
&rst
ixpk= 0, nxpk= 0, iat= 568, 573, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 40 LEU HN 40 LEU HG 4.52
&rst
ixpk= 0, nxpk= 0, iat= 568, 575, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02, &end
#
# 40 LEU HN 40 LEU HG 4.52
&rst
ixpk= 0, nxpk= 0, iat= 568, 575, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02, &end
#
# 40 LEU HN 40 LEU HG 4.52
&rst
ixpk= 0, nxpk= 0, iat= 568, 575, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02, &end
#
# 40 LEU HN 40 LEU QD1 4.30
&rst
ixpk= 0, nxpk= 0, iat= 568, -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
igr2= 577, 578, 579,
&end
#
# 40 LEU HN 40 LEU QD1 4.30
&rst
ixpk= 0, nxpk= 0, iat= 568, -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
igr2= 577, 578, 579,
&end
#
# 40 LEU HN 40 LEU QD1 4.30
&rst
ixpk= 0, nxpk= 0, iat= 568, -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
igr2= 577, 578, 579,
&end
#
# 40 LEU HN 40 LEU QD2 4.49
&rst
ixpk= 0, nxpk= 0, iat= 568, -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr2= 581, 582, 583,
&end
#
# 40 LEU HN 40 LEU QD2 4.49
&rst
ixpk= 0, nxpk= 0, iat= 568, -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr2= 581, 582, 583,
&end
#
# 40 LEU HN 40 LEU QD2 4.49
&rst
ixpk= 0, nxpk= 0, iat= 568, -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr2= 581, 582, 583,
&end
#
# 40 LEU HN 41 PRO HD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 568, 588, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 40 LEU HN 41 PRO HD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 568, 588, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 40 LEU HN 41 PRO HD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 568, 588, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 40 LEU HN 41 PRO HD3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 568, 589, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 40 LEU HN 41 PRO HD3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 568, 589, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 40 LEU HN 41 PRO HD3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 568, 589, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 40 LEU HN 103 GLY HA2 4.51
&rst
ixpk= 0, nxpk= 0, iat= 568,1432, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01, &end
#
# 40 LEU HN 103 GLY HA2 4.51
&rst
ixpk= 0, nxpk= 0, iat= 568,1432, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01, &end
#
# 40 LEU HN 103 GLY HA2 4.51
&rst
ixpk= 0, nxpk= 0, iat= 568,1432, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01, &end
#
# 40 LEU HN 104 ILE HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 568,1437, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 40 LEU HN 104 ILE HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 568,1437, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 40 LEU HN 104 ILE HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 568,1437, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 40 LEU HN 148 TYR QE 5.33
&rst
ixpk= 0, nxpk= 0, iat= 568, -1, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
igr2=2097,2102,
&end
#
# 40 LEU HN 148 TYR QE 5.33
&rst
ixpk= 0, nxpk= 0, iat= 568, -1, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
igr2=2097,2102,
&end
#
# 40 LEU HN 148 TYR QE 5.33
&rst
ixpk= 0, nxpk= 0, iat= 568, -1, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
igr2=2097,2102,
&end
#
# 40 LEU HA 40 LEU QD2 4.00
&rst
ixpk= 0, nxpk= 0, iat= 570, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2= 581, 582, 583,
&end
#
# 40 LEU HA 40 LEU QD2 4.00
&rst
ixpk= 0, nxpk= 0, iat= 570, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2= 581, 582, 583,
&end
#
# 40 LEU HA 40 LEU QD2 4.00
&rst
ixpk= 0, nxpk= 0, iat= 570, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2= 581, 582, 583,
&end
#
# 40 LEU HA 41 PRO HD2 3.60
&rst
ixpk= 0, nxpk= 0, iat= 570, 588, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10, &end
#
# 40 LEU HA 41 PRO HD2 3.60
&rst
ixpk= 0, nxpk= 0, iat= 570, 588, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10, &end
#
# 40 LEU HA 41 PRO HD2 3.60
&rst
ixpk= 0, nxpk= 0, iat= 570, 588, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10, &end
#
# 40 LEU HA 148 TYR QD 4.88
&rst
ixpk= 0, nxpk= 0, iat= 570, -1, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
igr2=2095,2104,
&end
#
# 40 LEU HA 148 TYR QD 4.88
&rst
ixpk= 0, nxpk= 0, iat= 570, -1, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
igr2=2095,2104,
&end
#
# 40 LEU HA 148 TYR QD 4.88
&rst
ixpk= 0, nxpk= 0, iat= 570, -1, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98,
igr2=2095,2104,
&end
#
# 40 LEU HA 148 TYR QE 3.84
&rst
ixpk= 0, nxpk= 0, iat= 570, -1, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,
igr2=2097,2102,
&end
#
# 40 LEU HA 148 TYR QE 3.84
&rst
ixpk= 0, nxpk= 0, iat= 570, -1, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,
igr2=2097,2102,
&end
#
# 40 LEU HA 148 TYR QE 3.84
&rst
ixpk= 0, nxpk= 0, iat= 570, -1, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,
igr2=2097,2102,
&end
#
# 40 LEU HB2 40 LEU QD1 4.11
&rst
ixpk= 0, nxpk= 0, iat= 572, -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
igr2= 577, 578, 579,
&end
#
# 40 LEU HB2 40 LEU QD1 4.11
&rst
ixpk= 0, nxpk= 0, iat= 572, -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
igr2= 577, 578, 579,
&end
#
# 40 LEU HB2 40 LEU QD1 4.11
&rst
ixpk= 0, nxpk= 0, iat= 572, -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
igr2= 577, 578, 579,
&end
#
# 40 LEU HB2 41 PRO HD2 5.63
&rst
ixpk= 0, nxpk= 0, iat= 572, 588, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13, &end
#
# 40 LEU HB2 41 PRO HD2 5.63
&rst
ixpk= 0, nxpk= 0, iat= 572, 588, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13, &end
#
# 40 LEU HB2 41 PRO HD2 5.63
&rst
ixpk= 0, nxpk= 0, iat= 572, 588, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13, &end
#
# 40 LEU HB2 41 PRO HD3 5.58
&rst
ixpk= 0, nxpk= 0, iat= 572, 589, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08, &end
#
# 40 LEU HB2 41 PRO HD3 5.58
&rst
ixpk= 0, nxpk= 0, iat= 572, 589, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08, &end
#
# 40 LEU HB2 41 PRO HD3 5.58
&rst
ixpk= 0, nxpk= 0, iat= 572, 589, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08, &end
#
# 40 LEU HB2 45 HIP HNE 6.05
&rst
ixpk= 0, nxpk= 0, iat= 572, 649, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 40 LEU HB2 45 HIP HNE 6.05
&rst
ixpk= 0, nxpk= 0, iat= 572, 649, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 40 LEU HB2 45 HIP HNE 6.05
&rst
ixpk= 0, nxpk= 0, iat= 572, 649, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 40 LEU HB2 148 TYR HB3 5.48
&rst
ixpk= 0, nxpk= 0, iat= 572,2092, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98, &end
#
# 40 LEU HB2 148 TYR HB3 5.48
&rst
ixpk= 0, nxpk= 0, iat= 572,2092, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98, &end
#
# 40 LEU HB2 148 TYR HB3 5.48
&rst
ixpk= 0, nxpk= 0, iat= 572,2092, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98, &end
#
# 40 LEU HB2 148 TYR QD 6.05
&rst
ixpk= 0, nxpk= 0, iat= 572, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2=2095,2104,
&end
#
# 40 LEU HB2 148 TYR QD 6.05
&rst
ixpk= 0, nxpk= 0, iat= 572, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2=2095,2104,
&end
#
# 40 LEU HB2 148 TYR QD 6.05
&rst
ixpk= 0, nxpk= 0, iat= 572, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2=2095,2104,
&end
#
# 40 LEU HB2 148 TYR QE 5.47
&rst
ixpk= 0, nxpk= 0, iat= 572, -1, r1= 1.30, r2= 1.80, r3= 6.14, r4= 6.64,
igr2=2097,2102,
&end
#
# 40 LEU HB2 148 TYR QE 5.47
&rst
ixpk= 0, nxpk= 0, iat= 572, -1, r1= 1.30, r2= 1.80, r3= 6.14, r4= 6.64,
igr2=2097,2102,
&end
#
# 40 LEU HB2 148 TYR QE 5.47
&rst
ixpk= 0, nxpk= 0, iat= 572, -1, r1= 1.30, r2= 1.80, r3= 6.14, r4= 6.64,
igr2=2097,2102,
&end
#
# 40 LEU HB3 40 LEU HB2 3.74
&rst
ixpk= 0, nxpk= 0, iat= 573, 572, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24, &end
#
# 40 LEU HB3 40 LEU HG 4.04
&rst
ixpk= 0, nxpk= 0, iat= 573, 575, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, &end
#
# 40 LEU HB3 41 PRO HA 5.07
&rst
ixpk= 0, nxpk= 0, iat= 573, 597, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, &end
#
# 40 LEU HB3 41 PRO HA 5.07
&rst
ixpk= 0, nxpk= 0, iat= 573, 597, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, &end
#
# 40 LEU HB3 41 PRO HA 5.07
&rst
ixpk= 0, nxpk= 0, iat= 573, 597, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, &end
#
# 40 LEU HB3 41 PRO HD2 5.71
&rst
ixpk= 0, nxpk= 0, iat= 573, 588, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21, &end
#
# 40 LEU HB3 41 PRO HD2 5.71
&rst
ixpk= 0, nxpk= 0, iat= 573, 588, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21, &end
#
# 40 LEU HB3 41 PRO HD2 5.71
&rst
ixpk= 0, nxpk= 0, iat= 573, 588, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21, &end
#
# 40 LEU HB3 99 VAL QG1 4.04
&rst
ixpk= 0, nxpk= 0, iat= 573, -1, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
igr2=1380,1381,1382,
&end
#
# 40 LEU HB3 99 VAL QG1 4.04
&rst
ixpk= 0, nxpk= 0, iat= 573, -1, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
igr2=1380,1381,1382,
&end
#
# 40 LEU HB3 99 VAL QG1 4.04
&rst
ixpk= 0, nxpk= 0, iat= 573, -1, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
igr2=1380,1381,1382,
&end
#
# 40 LEU HB3 148 TYR QD 6.05
&rst
ixpk= 0, nxpk= 0, iat= 573, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2=2095,2104,
&end
#
# 40 LEU HB3 148 TYR QD 6.05
&rst
ixpk= 0, nxpk= 0, iat= 573, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2=2095,2104,
&end
#
# 40 LEU HB3 148 TYR QD 6.05
&rst
ixpk= 0, nxpk= 0, iat= 573, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2=2095,2104,
&end
#
# 40 LEU HG 40 LEU QD1 4.18
&rst
ixpk= 0, nxpk= 0, iat= 575, -1, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
igr2= 577, 578, 579,
&end
#
# 40 LEU HG 41 PRO HD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 575, 588, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 40 LEU HG 41 PRO HD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 575, 588, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 40 LEU HG 41 PRO HD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 575, 588, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 40 LEU HG 104 ILE HA 5.14
&rst
ixpk= 0, nxpk= 0, iat= 575,1439, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64, &end
#
# 40 LEU HG 104 ILE HA 5.14
&rst
ixpk= 0, nxpk= 0, iat= 575,1439, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64, &end
#
# 40 LEU HG 104 ILE HA 5.14
&rst
ixpk= 0, nxpk= 0, iat= 575,1439, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64, &end
#
# 40 LEU HG 105 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 575,1456, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 40 LEU HG 105 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 575,1456, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 40 LEU HG 105 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 575,1456, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 40 LEU HG 148 TYR QD 5.42
&rst
ixpk= 0, nxpk= 0, iat= 575, -1, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
igr2=2095,2104,
&end
#
# 40 LEU HG 148 TYR QD 5.42
&rst
ixpk= 0, nxpk= 0, iat= 575, -1, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
igr2=2095,2104,
&end
#
# 40 LEU HG 148 TYR QD 5.42
&rst
ixpk= 0, nxpk= 0, iat= 575, -1, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
igr2=2095,2104,
&end
#
# 40 LEU QD1 41 PRO HD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 588, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 577, 578, 579,
&end
#
# 40 LEU QD1 41 PRO HD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 588, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 577, 578, 579,
&end
#
# 40 LEU QD1 41 PRO HD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 588, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 577, 578, 579,
&end
#
# 40 LEU QD1 43 GLY HN 5.95
&rst
ixpk= 0, nxpk= 0, iat= -1, 615, r1= 1.30, r2= 1.80, r3= 7.15, r4= 7.65,
igr1= 577, 578, 579,
&end
#
# 40 LEU QD1 43 GLY HN 5.95
&rst
ixpk= 0, nxpk= 0, iat= -1, 615, r1= 1.30, r2= 1.80, r3= 7.15, r4= 7.65,
igr1= 577, 578, 579,
&end
#
# 40 LEU QD1 43 GLY HN 5.95
&rst
ixpk= 0, nxpk= 0, iat= -1, 615, r1= 1.30, r2= 1.80, r3= 7.15, r4= 7.65,
igr1= 577, 578, 579,
&end
#
# 40 LEU QD1 45 HIP HNE 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 649, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 577, 578, 579,
&end
#
# 40 LEU QD1 45 HIP HNE 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 649, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 577, 578, 579,
&end
#
# 40 LEU QD1 45 HIP HNE 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 649, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 577, 578, 579,
&end
#
# 40 LEU QD1 99 VAL HB 5.67
&rst
ixpk= 0, nxpk= 0, iat= -1,1378, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
igr1= 577, 578, 579,
&end
#
# 40 LEU QD1 99 VAL HB 5.67
&rst
ixpk= 0, nxpk= 0, iat= -1,1378, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
igr1= 577, 578, 579,
&end
#
# 40 LEU QD1 99 VAL HB 5.67
&rst
ixpk= 0, nxpk= 0, iat= -1,1378, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
igr1= 577, 578, 579,
&end
#
# 40 LEU QD1 100 ASN HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1390, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 577, 578, 579,
&end
#
# 40 LEU QD1 100 ASN HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1390, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 577, 578, 579,
&end
#
# 40 LEU QD1 100 ASN HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1390, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 577, 578, 579,
&end
#
# 40 LEU QD1 104 ILE HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1437, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 577, 578, 579,
&end
#
# 40 LEU QD1 104 ILE HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1437, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 577, 578, 579,
&end
#
# 40 LEU QD1 104 ILE HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1437, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 577, 578, 579,
&end
#
# 40 LEU QD1 104 ILE HA 4.37
&rst
ixpk= 0, nxpk= 0, iat= -1,1439, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
igr1= 577, 578, 579,
&end
#
# 40 LEU QD1 104 ILE HA 4.37
&rst
ixpk= 0, nxpk= 0, iat= -1,1439, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
igr1= 577, 578, 579,
&end
#
# 40 LEU QD1 104 ILE HA 4.37
&rst
ixpk= 0, nxpk= 0, iat= -1,1439, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
igr1= 577, 578, 579,
&end
#
# 40 LEU QD1 105 ALA HN 5.91
&rst
ixpk= 0, nxpk= 0, iat= -1,1456, r1= 1.30, r2= 1.80, r3= 7.10, r4= 7.60,
igr1= 577, 578, 579,
&end
#
# 40 LEU QD1 105 ALA HN 5.91
&rst
ixpk= 0, nxpk= 0, iat= -1,1456, r1= 1.30, r2= 1.80, r3= 7.10, r4= 7.60,
igr1= 577, 578, 579,
&end
#
# 40 LEU QD1 105 ALA HN 5.91
&rst
ixpk= 0, nxpk= 0, iat= -1,1456, r1= 1.30, r2= 1.80, r3= 7.10, r4= 7.60,
igr1= 577, 578, 579,
&end
#
# 40 LEU QD1 105 ALA QB 5.04
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 577, 578, 579,
igr2=1460,1461,1462,
&end
#
# 40 LEU QD1 105 ALA QB 5.04
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 577, 578, 579,
igr2=1460,1461,1462,
&end
#
# 40 LEU QD1 105 ALA QB 5.04
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 577, 578, 579,
igr2=1460,1461,1462,
&end
#
# 40 LEU QD1 148 TYR QD 6.04
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.14, r4= 8.64,
igr1= 577, 578, 579,
igr2=2095,2104,
&end
#
# 40 LEU QD1 148 TYR QD 6.04
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.14, r4= 8.64,
igr1= 577, 578, 579,
igr2=2095,2104,
&end
#
# 40 LEU QD1 148 TYR QD 6.04
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.14, r4= 8.64,
igr1= 577, 578, 579,
igr2=2095,2104,
&end
#
# 40 LEU QD2 40 LEU QD1 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,
igr1= 581, 582, 583,
igr2= 577, 578, 579,
&end
#
# 40 LEU QD2 41 PRO HD2 4.75
&rst
ixpk= 0, nxpk= 0, iat= -1, 588, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr1= 581, 582, 583,
&end
#
# 40 LEU QD2 41 PRO HD2 4.75
&rst
ixpk= 0, nxpk= 0, iat= -1, 588, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr1= 581, 582, 583,
&end
#
# 40 LEU QD2 41 PRO HD2 4.75
&rst
ixpk= 0, nxpk= 0, iat= -1, 588, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr1= 581, 582, 583,
&end
#
# 40 LEU QD2 41 PRO HD3 5.87
&rst
ixpk= 0, nxpk= 0, iat= -1, 589, r1= 1.30, r2= 1.80, r3= 7.05, r4= 7.55,
igr1= 581, 582, 583,
&end
#
# 40 LEU QD2 41 PRO HD3 5.87
&rst
ixpk= 0, nxpk= 0, iat= -1, 589, r1= 1.30, r2= 1.80, r3= 7.05, r4= 7.55,
igr1= 581, 582, 583,
&end
#
# 40 LEU QD2 41 PRO HD3 5.87
&rst
ixpk= 0, nxpk= 0, iat= -1, 589, r1= 1.30, r2= 1.80, r3= 7.05, r4= 7.55,
igr1= 581, 582, 583,
&end
#
# 40 LEU QD2 45 HIP HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 641, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 581, 582, 583,
&end
#
# 40 LEU QD2 45 HIP HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 641, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 581, 582, 583,
&end
#
# 40 LEU QD2 45 HIP HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 641, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 581, 582, 583,
&end
#
# 40 LEU QD2 45 HIP HD2 5.78
&rst
ixpk= 0, nxpk= 0, iat= -1, 651, r1= 1.30, r2= 1.80, r3= 6.94, r4= 7.44,
igr1= 581, 582, 583,
&end
#
# 40 LEU QD2 45 HIP HD2 5.78
&rst
ixpk= 0, nxpk= 0, iat= -1, 651, r1= 1.30, r2= 1.80, r3= 6.94, r4= 7.44,
igr1= 581, 582, 583,
&end
#
# 40 LEU QD2 45 HIP HD2 5.78
&rst
ixpk= 0, nxpk= 0, iat= -1, 651, r1= 1.30, r2= 1.80, r3= 6.94, r4= 7.44,
igr1= 581, 582, 583,
&end
#
# 40 LEU QD2 45 HIP HNE 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 649, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 581, 582, 583,
&end
#
# 40 LEU QD2 45 HIP HNE 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 649, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 581, 582, 583,
&end
#
# 40 LEU QD2 45 HIP HNE 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 649, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 581, 582, 583,
&end
#
# 40 LEU QD2 99 VAL QG1 3.31
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
igr1= 581, 582, 583,
igr2=1380,1381,1382,
&end
#
# 40 LEU QD2 99 VAL QG1 3.31
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
igr1= 581, 582, 583,
igr2=1380,1381,1382,
&end
#
# 40 LEU QD2 99 VAL QG1 3.31
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
igr1= 581, 582, 583,
igr2=1380,1381,1382,
&end
#
# 40 LEU QD2 105 ALA HN 4.90
&rst
ixpk= 0, nxpk= 0, iat= -1,1456, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
igr1= 581, 582, 583,
&end
#
# 40 LEU QD2 105 ALA HN 4.90
&rst
ixpk= 0, nxpk= 0, iat= -1,1456, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
igr1= 581, 582, 583,
&end
#
# 40 LEU QD2 105 ALA HN 4.90
&rst
ixpk= 0, nxpk= 0, iat= -1,1456, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
igr1= 581, 582, 583,
&end
#
# 40 LEU QD2 148 TYR QD 3.64
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
igr1= 581, 582, 583,
igr2=2095,2104,
&end
#
# 40 LEU QD2 148 TYR QD 3.64
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
igr1= 581, 582, 583,
igr2=2095,2104,
&end
#
# 40 LEU QD2 148 TYR QD 3.64
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
igr1= 581, 582, 583,
igr2=2095,2104,
&end
#
# 40 LEU QD2 148 TYR QE 3.94
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
igr1= 581, 582, 583,
igr2=2097,2102,
&end
#
# 40 LEU QD2 148 TYR QE 3.94
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
igr1= 581, 582, 583,
igr2=2097,2102,
&end
#
# 40 LEU QD2 148 TYR QE 3.94
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
igr1= 581, 582, 583,
igr2=2097,2102,
&end
#
# 41 PRO HA 41 PRO HD2 4.51
&rst
ixpk= 0, nxpk= 0, iat= 597, 588, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01, &end
#
# 41 PRO HA 41 PRO HD3 4.37
&rst
ixpk= 0, nxpk= 0, iat= 597, 589, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87, &end
#
# 41 PRO HA 41 PRO HG3 4.27
&rst
ixpk= 0, nxpk= 0, iat= 597, 592, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77, &end
#
# 41 PRO HA 42 PRO HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 597, 611, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 41 PRO HA 42 PRO HD2 4.08
&rst
ixpk= 0, nxpk= 0, iat= 597, 602, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58, &end
#
# 41 PRO HA 42 PRO HD2 4.08
&rst
ixpk= 0, nxpk= 0, iat= 597, 602, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58, &end
#
# 41 PRO HA 42 PRO HD2 4.08
&rst
ixpk= 0, nxpk= 0, iat= 597, 602, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58, &end
#
# 41 PRO HA 42 PRO HD3 3.39
&rst
ixpk= 0, nxpk= 0, iat= 597, 603, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89, &end
#
# 41 PRO HA 42 PRO HD3 3.39
&rst
ixpk= 0, nxpk= 0, iat= 597, 603, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89, &end
#
# 41 PRO HA 42 PRO HD3 3.39
&rst
ixpk= 0, nxpk= 0, iat= 597, 603, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89, &end
#
# 41 PRO HA 42 PRO HG2 4.93
&rst
ixpk= 0, nxpk= 0, iat= 597, 605, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43, &end
#
# 41 PRO HA 42 PRO HG2 4.93
&rst
ixpk= 0, nxpk= 0, iat= 597, 605, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43, &end
#
# 41 PRO HA 42 PRO HG2 4.93
&rst
ixpk= 0, nxpk= 0, iat= 597, 605, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43, &end
#
# 41 PRO HA 42 PRO HG3 5.90
&rst
ixpk= 0, nxpk= 0, iat= 597, 606, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40, &end
#
# 41 PRO HA 42 PRO HG3 5.90
&rst
ixpk= 0, nxpk= 0, iat= 597, 606, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40, &end
#
# 41 PRO HA 42 PRO HG3 5.90
&rst
ixpk= 0, nxpk= 0, iat= 597, 606, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40, &end
#
# 41 PRO HA 43 GLY HN 6.10
&rst
ixpk= 0, nxpk= 0, iat= 597, 615, r1= 1.30, r2= 1.80, r3= 6.10, r4= 6.60, &end
#
# 41 PRO HA 103 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 597,1433, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 41 PRO HA 103 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 597,1433, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 41 PRO HA 103 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 597,1433, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 41 PRO HB2 41 PRO HA 4.17
&rst
ixpk= 0, nxpk= 0, iat= 594, 597, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67, &end
#
# 41 PRO HB2 41 PRO HD3 3.64
&rst
ixpk= 0, nxpk= 0, iat= 594, 589, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14, &end
#
# 41 PRO HB2 41 PRO HG3 3.96
&rst
ixpk= 0, nxpk= 0, iat= 594, 592, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46, &end
#
# 41 PRO HB2 42 PRO HD2 4.92
&rst
ixpk= 0, nxpk= 0, iat= 594, 602, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42, &end
#
# 41 PRO HB2 42 PRO HD2 4.92
&rst
ixpk= 0, nxpk= 0, iat= 594, 602, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42, &end
#
# 41 PRO HB2 42 PRO HD2 4.92
&rst
ixpk= 0, nxpk= 0, iat= 594, 602, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42, &end
#
# 41 PRO HB2 45 HIP HE1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 594, 647, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 41 PRO HB2 45 HIP HE1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 594, 647, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 41 PRO HB2 45 HIP HE1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 594, 647, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 41 PRO HB3 41 PRO HB2 3.56
&rst
ixpk= 0, nxpk= 0, iat= 595, 594, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06, &end
#
# 41 PRO HB3 41 PRO HD3 4.59
&rst
ixpk= 0, nxpk= 0, iat= 595, 589, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 41 PRO HB3 41 PRO HG2 2.93
&rst
ixpk= 0, nxpk= 0, iat= 595, 591, r1= 1.30, r2= 1.80, r3= 2.93, r4= 3.43, &end
#
# 41 PRO HB3 43 GLY HN 5.22
&rst
ixpk= 0, nxpk= 0, iat= 595, 615, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72, &end
#
# 41 PRO HB3 43 GLY HN 5.22
&rst
ixpk= 0, nxpk= 0, iat= 595, 615, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72, &end
#
# 41 PRO HB3 43 GLY HN 5.22
&rst
ixpk= 0, nxpk= 0, iat= 595, 615, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72, &end
#
# 41 PRO HB3 45 HIP HE1 5.96
&rst
ixpk= 0, nxpk= 0, iat= 595, 647, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46, &end
#
# 41 PRO HB3 45 HIP HE1 5.96
&rst
ixpk= 0, nxpk= 0, iat= 595, 647, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46, &end
#
# 41 PRO HB3 45 HIP HE1 5.96
&rst
ixpk= 0, nxpk= 0, iat= 595, 647, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46, &end
#
# 41 PRO HB3 45 HIP HNE 6.05
&rst
ixpk= 0, nxpk= 0, iat= 595, 649, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 41 PRO HB3 45 HIP HNE 6.05
&rst
ixpk= 0, nxpk= 0, iat= 595, 649, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 41 PRO HB3 45 HIP HNE 6.05
&rst
ixpk= 0, nxpk= 0, iat= 595, 649, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 41 PRO HD2 41 PRO HD3 4.05
&rst
ixpk= 0, nxpk= 0, iat= 588, 589, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55, &end
#
# 41 PRO HD2 45 HIP HE1 5.25
&rst
ixpk= 0, nxpk= 0, iat= 588, 647, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75, &end
#
# 41 PRO HD2 45 HIP HE1 5.25
&rst
ixpk= 0, nxpk= 0, iat= 588, 647, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75, &end
#
# 41 PRO HD2 45 HIP HE1 5.25
&rst
ixpk= 0, nxpk= 0, iat= 588, 647, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75, &end
#
# 41 PRO HD2 45 HIP HNE 6.05
&rst
ixpk= 0, nxpk= 0, iat= 588, 649, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 41 PRO HD2 45 HIP HNE 6.05
&rst
ixpk= 0, nxpk= 0, iat= 588, 649, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 41 PRO HD2 45 HIP HNE 6.05
&rst
ixpk= 0, nxpk= 0, iat= 588, 649, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 41 PRO HD2 99 VAL QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 588, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1384,1385,1386,
&end
#
# 41 PRO HD2 99 VAL QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 588, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1384,1385,1386,
&end
#
# 41 PRO HD2 99 VAL QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 588, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1384,1385,1386,
&end
#
# 41 PRO HD2 148 TYR QD 5.26
&rst
ixpk= 0, nxpk= 0, iat= 588, -1, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
igr2=2095,2104,
&end
#
# 41 PRO HD2 148 TYR QD 5.26
&rst
ixpk= 0, nxpk= 0, iat= 588, -1, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
igr2=2095,2104,
&end
#
# 41 PRO HD2 148 TYR QD 5.26
&rst
ixpk= 0, nxpk= 0, iat= 588, -1, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
igr2=2095,2104,
&end
#
# 41 PRO HD2 148 TYR QE 4.75
&rst
ixpk= 0, nxpk= 0, iat= 588, -1, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
igr2=2097,2102,
&end
#
# 41 PRO HD2 148 TYR QE 4.75
&rst
ixpk= 0, nxpk= 0, iat= 588, -1, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
igr2=2097,2102,
&end
#
# 41 PRO HD2 148 TYR QE 4.75
&rst
ixpk= 0, nxpk= 0, iat= 588, -1, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
igr2=2097,2102,
&end
#
# 41 PRO HD3 148 TYR QD 5.46
&rst
ixpk= 0, nxpk= 0, iat= 589, -1, r1= 1.30, r2= 1.80, r3= 6.13, r4= 6.63,
igr2=2095,2104,
&end
#
# 41 PRO HD3 148 TYR QD 5.46
&rst
ixpk= 0, nxpk= 0, iat= 589, -1, r1= 1.30, r2= 1.80, r3= 6.13, r4= 6.63,
igr2=2095,2104,
&end
#
# 41 PRO HD3 148 TYR QD 5.46
&rst
ixpk= 0, nxpk= 0, iat= 589, -1, r1= 1.30, r2= 1.80, r3= 6.13, r4= 6.63,
igr2=2095,2104,
&end
#
# 41 PRO HG2 41 PRO HA 4.43
&rst
ixpk= 0, nxpk= 0, iat= 591, 597, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93, &end
#
# 41 PRO HG2 41 PRO HD2 4.72
&rst
ixpk= 0, nxpk= 0, iat= 591, 588, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22, &end
#
# 41 PRO HG3 41 PRO HB3 2.94
&rst
ixpk= 0, nxpk= 0, iat= 592, 595, r1= 1.30, r2= 1.80, r3= 2.94, r4= 3.44, &end
#
# 41 PRO HG3 41 PRO HD2 4.51
&rst
ixpk= 0, nxpk= 0, iat= 592, 588, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01, &end
#
# 41 PRO HG3 41 PRO HD3 4.66
&rst
ixpk= 0, nxpk= 0, iat= 592, 589, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16, &end
#
# 41 PRO HG3 41 PRO HG2 3.05
&rst
ixpk= 0, nxpk= 0, iat= 592, 591, r1= 1.30, r2= 1.80, r3= 3.05, r4= 3.55, &end
#
# 41 PRO HG3 43 GLY HN 5.92
&rst
ixpk= 0, nxpk= 0, iat= 592, 615, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42, &end
#
# 41 PRO HG3 43 GLY HN 5.92
&rst
ixpk= 0, nxpk= 0, iat= 592, 615, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42, &end
#
# 41 PRO HG3 43 GLY HN 5.92
&rst
ixpk= 0, nxpk= 0, iat= 592, 615, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42, &end
#
# 41 PRO HG3 45 HIP HE1 4.41
&rst
ixpk= 0, nxpk= 0, iat= 592, 647, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, &end
#
# 41 PRO HG3 45 HIP HE1 4.41
&rst
ixpk= 0, nxpk= 0, iat= 592, 647, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, &end
#
# 41 PRO HG3 45 HIP HE1 4.41
&rst
ixpk= 0, nxpk= 0, iat= 592, 647, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, &end
#
# 41 PRO HG3 45 HIP HNE 5.92
&rst
ixpk= 0, nxpk= 0, iat= 592, 649, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42, &end
#
# 41 PRO HG3 45 HIP HNE 5.92
&rst
ixpk= 0, nxpk= 0, iat= 592, 649, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42, &end
#
# 41 PRO HG3 45 HIP HNE 5.92
&rst
ixpk= 0, nxpk= 0, iat= 592, 649, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42, &end
#
# 42 PRO HA 42 PRO HG3 4.71
&rst
ixpk= 0, nxpk= 0, iat= 611, 606, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21, &end
#
# 42 PRO HA 43 GLY HN 2.97
&rst
ixpk= 0, nxpk= 0, iat= 611, 615, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 42 PRO HA 43 GLY HN 3.35
&rst
ixpk= 0, nxpk= 0, iat= 611, 615, r1= 1.30, r2= 1.80, r3= 3.35, r4= 3.85, &end
#
# 42 PRO HA 43 GLY HN 3.35
&rst
ixpk= 0, nxpk= 0, iat= 611, 615, r1= 1.30, r2= 1.80, r3= 3.35, r4= 3.85, &end
#
# 42 PRO HA 43 GLY HN 3.35
&rst
ixpk= 0, nxpk= 0, iat= 611, 615, r1= 1.30, r2= 1.80, r3= 3.35, r4= 3.85, &end
#
# 42 PRO HA 45 HIP HNE 6.02
&rst
ixpk= 0, nxpk= 0, iat= 611, 649, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52, &end
#
# 42 PRO HA 45 HIP HNE 6.02
&rst
ixpk= 0, nxpk= 0, iat= 611, 649, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52, &end
#
# 42 PRO HA 45 HIP HNE 6.02
&rst
ixpk= 0, nxpk= 0, iat= 611, 649, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52, &end
#
# 42 PRO HA 99 VAL HN 5.69
&rst
ixpk= 0, nxpk= 0, iat= 611,1374, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19, &end
#
# 42 PRO HA 99 VAL HN 5.69
&rst
ixpk= 0, nxpk= 0, iat= 611,1374, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19, &end
#
# 42 PRO HA 99 VAL HN 5.69
&rst
ixpk= 0, nxpk= 0, iat= 611,1374, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19, &end
#
# 42 PRO HA 99 VAL QG2 3.76
&rst
ixpk= 0, nxpk= 0, iat= 611, -1, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
igr2=1384,1385,1386,
&end
#
# 42 PRO HA 99 VAL QG2 3.76
&rst
ixpk= 0, nxpk= 0, iat= 611, -1, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
igr2=1384,1385,1386,
&end
#
# 42 PRO HA 99 VAL QG2 3.76
&rst
ixpk= 0, nxpk= 0, iat= 611, -1, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
igr2=1384,1385,1386,
&end
#
# 42 PRO HA 100 ASN HN 4.97
&rst
ixpk= 0, nxpk= 0, iat= 611,1390, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 42 PRO HA 100 ASN HN 4.97
&rst
ixpk= 0, nxpk= 0, iat= 611,1390, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 42 PRO HA 100 ASN HN 4.97
&rst
ixpk= 0, nxpk= 0, iat= 611,1390, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 42 PRO HA 101 ASN HA 5.41
&rst
ixpk= 0, nxpk= 0, iat= 611,1406, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91, &end
#
# 42 PRO HA 101 ASN HA 5.41
&rst
ixpk= 0, nxpk= 0, iat= 611,1406, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91, &end
#
# 42 PRO HA 101 ASN HA 5.41
&rst
ixpk= 0, nxpk= 0, iat= 611,1406, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91, &end
#
# 42 PRO HB2 42 PRO HA 4.25
&rst
ixpk= 0, nxpk= 0, iat= 608, 611, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75, &end
#
# 42 PRO HB2 43 GLY HN 5.07
&rst
ixpk= 0, nxpk= 0, iat= 608, 615, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, &end
#
# 42 PRO HB2 43 GLY HN 5.07
&rst
ixpk= 0, nxpk= 0, iat= 608, 615, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, &end
#
# 42 PRO HB2 43 GLY HN 5.07
&rst
ixpk= 0, nxpk= 0, iat= 608, 615, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, &end
#
# 42 PRO HB2 43 GLY HN 5.72
&rst
ixpk= 0, nxpk= 0, iat= 608, 615, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 42 PRO HB2 101 ASN HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 608,1404, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 42 PRO HB2 101 ASN HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 608,1404, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 42 PRO HB2 101 ASN HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 608,1404, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 42 PRO HB2 101 ASN HA 4.05
&rst
ixpk= 0, nxpk= 0, iat= 608,1406, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55, &end
#
# 42 PRO HB2 101 ASN HA 4.05
&rst
ixpk= 0, nxpk= 0, iat= 608,1406, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55, &end
#
# 42 PRO HB2 101 ASN HA 4.05
&rst
ixpk= 0, nxpk= 0, iat= 608,1406, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55, &end
#
# 42 PRO HB2 101 ASN HD21 6.05
&rst
ixpk= 0, nxpk= 0, iat= 608,1413, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 42 PRO HB2 101 ASN HD21 6.05
&rst
ixpk= 0, nxpk= 0, iat= 608,1413, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 42 PRO HB2 101 ASN HD21 6.05
&rst
ixpk= 0, nxpk= 0, iat= 608,1413, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 42 PRO HB3 42 PRO HA 4.52
&rst
ixpk= 0, nxpk= 0, iat= 609, 611, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02, &end
#
# 42 PRO HB3 42 PRO HD2 4.77
&rst
ixpk= 0, nxpk= 0, iat= 609, 602, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27, &end
#
# 42 PRO HB3 43 GLY HN 4.54
&rst
ixpk= 0, nxpk= 0, iat= 609, 615, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 42 PRO HB3 43 GLY HN 4.54
&rst
ixpk= 0, nxpk= 0, iat= 609, 615, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 42 PRO HB3 43 GLY HN 4.54
&rst
ixpk= 0, nxpk= 0, iat= 609, 615, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 42 PRO HB3 103 GLY HN 5.39
&rst
ixpk= 0, nxpk= 0, iat= 609,1430, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89, &end
#
# 42 PRO HB3 103 GLY HN 5.39
&rst
ixpk= 0, nxpk= 0, iat= 609,1430, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89, &end
#
# 42 PRO HB3 103 GLY HN 5.39
&rst
ixpk= 0, nxpk= 0, iat= 609,1430, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89, &end
#
# 42 PRO HD2 43 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 602, 615, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 42 PRO HD2 43 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 602, 615, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 42 PRO HD2 43 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 602, 615, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 42 PRO HD2 99 VAL QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 602, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1384,1385,1386,
&end
#
# 42 PRO HD2 99 VAL QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 602, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1384,1385,1386,
&end
#
# 42 PRO HD2 99 VAL QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 602, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1384,1385,1386,
&end
#
# 42 PRO HD3 42 PRO HD2 3.86
&rst
ixpk= 0, nxpk= 0, iat= 603, 602, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 42 PRO HD3 42 PRO HG3 5.09
&rst
ixpk= 0, nxpk= 0, iat= 603, 606, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59, &end
#
# 42 PRO HD3 43 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 603, 615, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 42 PRO HD3 43 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 603, 615, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 42 PRO HD3 43 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 603, 615, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 42 PRO HD3 103 GLY HN 5.83
&rst
ixpk= 0, nxpk= 0, iat= 603,1430, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33, &end
#
# 42 PRO HD3 103 GLY HN 5.83
&rst
ixpk= 0, nxpk= 0, iat= 603,1430, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33, &end
#
# 42 PRO HD3 103 GLY HN 5.83
&rst
ixpk= 0, nxpk= 0, iat= 603,1430, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33, &end
#
# 42 PRO HG2 101 ASN HA 4.32
&rst
ixpk= 0, nxpk= 0, iat= 605,1406, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82, &end
#
# 42 PRO HG2 101 ASN HA 4.32
&rst
ixpk= 0, nxpk= 0, iat= 605,1406, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82, &end
#
# 42 PRO HG2 101 ASN HA 4.32
&rst
ixpk= 0, nxpk= 0, iat= 605,1406, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82, &end
#
# 42 PRO HG2 102 ASP HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 605,1418, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 42 PRO HG2 102 ASP HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 605,1418, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 42 PRO HG2 102 ASP HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 605,1418, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 42 PRO HG2 103 GLY HN 5.95
&rst
ixpk= 0, nxpk= 0, iat= 605,1430, r1= 1.30, r2= 1.80, r3= 5.95, r4= 6.45, &end
#
# 42 PRO HG2 103 GLY HN 5.95
&rst
ixpk= 0, nxpk= 0, iat= 605,1430, r1= 1.30, r2= 1.80, r3= 5.95, r4= 6.45, &end
#
# 42 PRO HG2 103 GLY HN 5.95
&rst
ixpk= 0, nxpk= 0, iat= 605,1430, r1= 1.30, r2= 1.80, r3= 5.95, r4= 6.45, &end
#
# 42 PRO HG3 42 PRO HD2 5.14
&rst
ixpk= 0, nxpk= 0, iat= 606, 602, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64, &end
#
# 42 PRO HG3 42 PRO HG2 3.16
&rst
ixpk= 0, nxpk= 0, iat= 606, 605, r1= 1.30, r2= 1.80, r3= 3.16, r4= 3.66, &end
#
# 42 PRO HG3 43 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 606, 615, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 42 PRO HG3 43 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 606, 615, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 42 PRO HG3 43 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 606, 615, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 42 PRO HG3 43 GLY HA2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 606, 617, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 42 PRO HG3 43 GLY HA2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 606, 617, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 42 PRO HG3 43 GLY HA2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 606, 617, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 42 PRO HG3 101 ASN HA 4.80
&rst
ixpk= 0, nxpk= 0, iat= 606,1406, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30, &end
#
# 42 PRO HG3 101 ASN HA 4.80
&rst
ixpk= 0, nxpk= 0, iat= 606,1406, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30, &end
#
# 42 PRO HG3 101 ASN HA 4.80
&rst
ixpk= 0, nxpk= 0, iat= 606,1406, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30, &end
#
# 42 PRO HG3 101 ASN HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 606,1408, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 42 PRO HG3 101 ASN HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 606,1408, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 42 PRO HG3 101 ASN HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 606,1408, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 42 PRO HG3 103 GLY HN 5.28
&rst
ixpk= 0, nxpk= 0, iat= 606,1430, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 42 PRO HG3 103 GLY HN 5.28
&rst
ixpk= 0, nxpk= 0, iat= 606,1430, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 42 PRO HG3 103 GLY HN 5.28
&rst
ixpk= 0, nxpk= 0, iat= 606,1430, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 43 GLY HN 43 GLY HA2 3.97
&rst
ixpk= 0, nxpk= 0, iat= 615, 617, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47, &end
#
# 43 GLY HN 43 GLY HA3 3.85
&rst
ixpk= 0, nxpk= 0, iat= 615, 618, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35, &end
#
# 43 GLY HN 44 GLU HN 4.28
&rst
ixpk= 0, nxpk= 0, iat= 615, 622, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78, &end
#
# 43 GLY HN 44 GLU HN 4.28
&rst
ixpk= 0, nxpk= 0, iat= 615, 622, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78, &end
#
# 43 GLY HN 44 GLU HN 4.28
&rst
ixpk= 0, nxpk= 0, iat= 615, 622, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78, &end
#
# 43 GLY HN 44 GLU HN 5.28
&rst
ixpk= 0, nxpk= 0, iat= 615, 622, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 43 GLY HN 45 HIP HD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 615, 651, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 43 GLY HN 45 HIP HD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 615, 651, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 43 GLY HN 45 HIP HD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 615, 651, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 43 GLY HN 99 VAL HN 5.49
&rst
ixpk= 0, nxpk= 0, iat= 615,1374, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99, &end
#
# 43 GLY HN 99 VAL HN 5.49
&rst
ixpk= 0, nxpk= 0, iat= 615,1374, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99, &end
#
# 43 GLY HN 99 VAL HN 5.49
&rst
ixpk= 0, nxpk= 0, iat= 615,1374, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99, &end
#
# 43 GLY HN 99 VAL QG1 4.71
&rst
ixpk= 0, nxpk= 0, iat= 615, -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr2=1380,1381,1382,
&end
#
# 43 GLY HN 99 VAL QG1 4.71
&rst
ixpk= 0, nxpk= 0, iat= 615, -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr2=1380,1381,1382,
&end
#
# 43 GLY HN 99 VAL QG1 4.71
&rst
ixpk= 0, nxpk= 0, iat= 615, -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr2=1380,1381,1382,
&end
#
# 43 GLY HN 99 VAL QG2 4.20
&rst
ixpk= 0, nxpk= 0, iat= 615, -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr2=1384,1385,1386,
&end
#
# 43 GLY HN 99 VAL QG2 4.20
&rst
ixpk= 0, nxpk= 0, iat= 615, -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr2=1384,1385,1386,
&end
#
# 43 GLY HN 99 VAL QG2 4.20
&rst
ixpk= 0, nxpk= 0, iat= 615, -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr2=1384,1385,1386,
&end
#
# 43 GLY HA2 43 GLY HA3 3.59
&rst
ixpk= 0, nxpk= 0, iat= 617, 618, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09, &end
#
# 43 GLY HA2 44 GLU HN 2.97
&rst
ixpk= 0, nxpk= 0, iat= 617, 622, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 43 GLY HA2 44 GLU HN 3.53
&rst
ixpk= 0, nxpk= 0, iat= 617, 622, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03, &end
#
# 43 GLY HA2 44 GLU HN 3.53
&rst
ixpk= 0, nxpk= 0, iat= 617, 622, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03, &end
#
# 43 GLY HA2 44 GLU HN 3.53
&rst
ixpk= 0, nxpk= 0, iat= 617, 622, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03, &end
#
# 43 GLY HA2 45 HIP HD2 5.92
&rst
ixpk= 0, nxpk= 0, iat= 617, 651, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42, &end
#
# 43 GLY HA2 45 HIP HD2 5.92
&rst
ixpk= 0, nxpk= 0, iat= 617, 651, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42, &end
#
# 43 GLY HA2 45 HIP HD2 5.92
&rst
ixpk= 0, nxpk= 0, iat= 617, 651, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42, &end
#
# 43 GLY HA3 44 GLU HN 3.28
&rst
ixpk= 0, nxpk= 0, iat= 618, 622, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78, &end
#
# 43 GLY HA3 44 GLU HN 3.28
&rst
ixpk= 0, nxpk= 0, iat= 618, 622, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78, &end
#
# 43 GLY HA3 44 GLU HN 3.28
&rst
ixpk= 0, nxpk= 0, iat= 618, 622, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78, &end
#
# 43 GLY HA3 44 GLU HG3 5.60
&rst
ixpk= 0, nxpk= 0, iat= 618, 630, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10, &end
#
# 43 GLY HA3 44 GLU HG3 5.60
&rst
ixpk= 0, nxpk= 0, iat= 618, 630, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10, &end
#
# 43 GLY HA3 44 GLU HG3 5.60
&rst
ixpk= 0, nxpk= 0, iat= 618, 630, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10, &end
#
# 43 GLY HA3 99 VAL QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 618, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1384,1385,1386,
&end
#
# 43 GLY HA3 99 VAL QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 618, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1384,1385,1386,
&end
#
# 43 GLY HA3 99 VAL QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 618, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1384,1385,1386,
&end
#
# 44 GLU HN 44 GLU HA 4.09
&rst
ixpk= 0, nxpk= 0, iat= 622, 624, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59, &end
#
# 44 GLU HN 44 GLU HB2 3.92
&rst
ixpk= 0, nxpk= 0, iat= 622, 626, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42, &end
#
# 44 GLU HN 44 GLU HB2 3.92
&rst
ixpk= 0, nxpk= 0, iat= 622, 626, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42, &end
#
# 44 GLU HN 44 GLU HB2 3.92
&rst
ixpk= 0, nxpk= 0, iat= 622, 626, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42, &end
#
# 44 GLU HN 44 GLU HB3 4.14
&rst
ixpk= 0, nxpk= 0, iat= 622, 627, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64, &end
#
# 44 GLU HN 44 GLU HB3 4.14
&rst
ixpk= 0, nxpk= 0, iat= 622, 627, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64, &end
#
# 44 GLU HN 44 GLU HB3 4.14
&rst
ixpk= 0, nxpk= 0, iat= 622, 627, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64, &end
#
# 44 GLU HN 44 GLU HG2 4.44
&rst
ixpk= 0, nxpk= 0, iat= 622, 629, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94, &end
#
# 44 GLU HN 44 GLU HG2 4.44
&rst
ixpk= 0, nxpk= 0, iat= 622, 629, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94, &end
#
# 44 GLU HN 44 GLU HG2 4.44
&rst
ixpk= 0, nxpk= 0, iat= 622, 629, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94, &end
#
# 44 GLU HN 44 GLU HG3 3.92
&rst
ixpk= 0, nxpk= 0, iat= 622, 630, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42, &end
#
# 44 GLU HN 44 GLU HG3 3.92
&rst
ixpk= 0, nxpk= 0, iat= 622, 630, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42, &end
#
# 44 GLU HN 44 GLU HG3 3.92
&rst
ixpk= 0, nxpk= 0, iat= 622, 630, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42, &end
#
# 44 GLU HN 45 HIP HN 5.28
&rst
ixpk= 0, nxpk= 0, iat= 622, 637, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 44 GLU HN 45 HIP HN 5.60
&rst
ixpk= 0, nxpk= 0, iat= 622, 637, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10, &end
#
# 44 GLU HN 45 HIP HN 5.60
&rst
ixpk= 0, nxpk= 0, iat= 622, 637, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10, &end
#
# 44 GLU HN 45 HIP HN 5.60
&rst
ixpk= 0, nxpk= 0, iat= 622, 637, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10, &end
#
# 44 GLU HN 45 HIP HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 622, 639, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 44 GLU HN 45 HIP HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 622, 639, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 44 GLU HN 45 HIP HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 622, 639, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 44 GLU HN 45 HIP HD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 622, 651, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 44 GLU HN 45 HIP HD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 622, 651, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 44 GLU HN 45 HIP HD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 622, 651, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 44 GLU HN 45 HIP HNE 6.05
&rst
ixpk= 0, nxpk= 0, iat= 622, 649, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 44 GLU HN 45 HIP HNE 6.05
&rst
ixpk= 0, nxpk= 0, iat= 622, 649, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 44 GLU HN 45 HIP HNE 6.05
&rst
ixpk= 0, nxpk= 0, iat= 622, 649, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 44 GLU HN 98 VAL HA 5.91
&rst
ixpk= 0, nxpk= 0, iat= 622,1360, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41, &end
#
# 44 GLU HN 98 VAL HA 5.91
&rst
ixpk= 0, nxpk= 0, iat= 622,1360, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41, &end
#
# 44 GLU HN 98 VAL HA 5.91
&rst
ixpk= 0, nxpk= 0, iat= 622,1360, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41, &end
#
# 44 GLU HN 98 VAL QG1 5.83
&rst
ixpk= 0, nxpk= 0, iat= 622, -1, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,
igr2=1364,1365,1366,
&end
#
# 44 GLU HN 98 VAL QG1 5.83
&rst
ixpk= 0, nxpk= 0, iat= 622, -1, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,
igr2=1364,1365,1366,
&end
#
# 44 GLU HN 98 VAL QG1 5.83
&rst
ixpk= 0, nxpk= 0, iat= 622, -1, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,
igr2=1364,1365,1366,
&end
#
# 44 GLU HN 98 VAL QG2 5.76
&rst
ixpk= 0, nxpk= 0, iat= 622, -1, r1= 1.30, r2= 1.80, r3= 6.92, r4= 7.42,
igr2=1368,1369,1370,
&end
#
# 44 GLU HN 98 VAL QG2 5.76
&rst
ixpk= 0, nxpk= 0, iat= 622, -1, r1= 1.30, r2= 1.80, r3= 6.92, r4= 7.42,
igr2=1368,1369,1370,
&end
#
# 44 GLU HN 98 VAL QG2 5.76
&rst
ixpk= 0, nxpk= 0, iat= 622, -1, r1= 1.30, r2= 1.80, r3= 6.92, r4= 7.42,
igr2=1368,1369,1370,
&end
#
# 44 GLU HN 99 VAL HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 622,1374, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 44 GLU HN 99 VAL HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 622,1374, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 44 GLU HN 99 VAL HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 622,1374, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 44 GLU HN 99 VAL QG1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 622, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1380,1381,1382,
&end
#
# 44 GLU HN 99 VAL QG1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 622, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1380,1381,1382,
&end
#
# 44 GLU HN 99 VAL QG1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 622, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1380,1381,1382,
&end
#
# 44 GLU HA 44 GLU HB3 4.32
&rst
ixpk= 0, nxpk= 0, iat= 624, 627, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82, &end
#
# 44 GLU HA 44 GLU HG2 4.73
&rst
ixpk= 0, nxpk= 0, iat= 624, 629, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, &end
#
# 44 GLU HA 44 GLU HG3 4.93
&rst
ixpk= 0, nxpk= 0, iat= 624, 630, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43, &end
#
# 44 GLU HA 45 HIP HN 2.97
&rst
ixpk= 0, nxpk= 0, iat= 624, 637, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 44 GLU HA 45 HIP HN 3.33
&rst
ixpk= 0, nxpk= 0, iat= 624, 637, r1= 1.30, r2= 1.80, r3= 3.33, r4= 3.83, &end
#
# 44 GLU HA 45 HIP HN 3.33
&rst
ixpk= 0, nxpk= 0, iat= 624, 637, r1= 1.30, r2= 1.80, r3= 3.33, r4= 3.83, &end
#
# 44 GLU HA 45 HIP HN 3.33
&rst
ixpk= 0, nxpk= 0, iat= 624, 637, r1= 1.30, r2= 1.80, r3= 3.33, r4= 3.83, &end
#
# 44 GLU HA 45 HIP HD2 5.92
&rst
ixpk= 0, nxpk= 0, iat= 624, 651, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42, &end
#
# 44 GLU HA 45 HIP HD2 5.92
&rst
ixpk= 0, nxpk= 0, iat= 624, 651, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42, &end
#
# 44 GLU HA 45 HIP HD2 5.92
&rst
ixpk= 0, nxpk= 0, iat= 624, 651, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42, &end
#
# 44 GLU HA 97 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 624,1339, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 44 GLU HA 97 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 624,1339, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 44 GLU HA 97 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 624,1339, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 44 GLU HA 98 VAL HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 624,1358, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 44 GLU HA 98 VAL HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 624,1358, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 44 GLU HA 98 VAL HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 624,1358, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 44 GLU HA 98 VAL HA 4.39
&rst
ixpk= 0, nxpk= 0, iat= 624,1360, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89, &end
#
# 44 GLU HA 98 VAL HA 4.39
&rst
ixpk= 0, nxpk= 0, iat= 624,1360, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89, &end
#
# 44 GLU HA 98 VAL HA 4.39
&rst
ixpk= 0, nxpk= 0, iat= 624,1360, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89, &end
#
# 44 GLU HA 98 VAL QG1 5.05
&rst
ixpk= 0, nxpk= 0, iat= 624, -1, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
igr2=1364,1365,1366,
&end
#
# 44 GLU HA 98 VAL QG1 5.05
&rst
ixpk= 0, nxpk= 0, iat= 624, -1, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
igr2=1364,1365,1366,
&end
#
# 44 GLU HA 98 VAL QG1 5.05
&rst
ixpk= 0, nxpk= 0, iat= 624, -1, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
igr2=1364,1365,1366,
&end
#
# 44 GLU HA 98 VAL QG2 4.74
&rst
ixpk= 0, nxpk= 0, iat= 624, -1, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
igr2=1368,1369,1370,
&end
#
# 44 GLU HA 98 VAL QG2 4.74
&rst
ixpk= 0, nxpk= 0, iat= 624, -1, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
igr2=1368,1369,1370,
&end
#
# 44 GLU HA 98 VAL QG2 4.74
&rst
ixpk= 0, nxpk= 0, iat= 624, -1, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
igr2=1368,1369,1370,
&end
#
# 44 GLU HA 99 VAL HN 4.38
&rst
ixpk= 0, nxpk= 0, iat= 624,1374, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88, &end
#
# 44 GLU HA 99 VAL HN 4.38
&rst
ixpk= 0, nxpk= 0, iat= 624,1374, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88, &end
#
# 44 GLU HA 99 VAL HN 4.38
&rst
ixpk= 0, nxpk= 0, iat= 624,1374, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88, &end
#
# 44 GLU HA 99 VAL QG1 5.57
&rst
ixpk= 0, nxpk= 0, iat= 624, -1, r1= 1.30, r2= 1.80, r3= 6.69, r4= 7.19,
igr2=1380,1381,1382,
&end
#
# 44 GLU HA 99 VAL QG1 5.57
&rst
ixpk= 0, nxpk= 0, iat= 624, -1, r1= 1.30, r2= 1.80, r3= 6.69, r4= 7.19,
igr2=1380,1381,1382,
&end
#
# 44 GLU HA 99 VAL QG1 5.57
&rst
ixpk= 0, nxpk= 0, iat= 624, -1, r1= 1.30, r2= 1.80, r3= 6.69, r4= 7.19,
igr2=1380,1381,1382,
&end
#
# 44 GLU HB2 45 HIP HN 4.08
&rst
ixpk= 0, nxpk= 0, iat= 626, 637, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58, &end
#
# 44 GLU HB2 45 HIP HN 4.08
&rst
ixpk= 0, nxpk= 0, iat= 626, 637, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58, &end
#
# 44 GLU HB2 45 HIP HN 4.08
&rst
ixpk= 0, nxpk= 0, iat= 626, 637, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58, &end
#
# 44 GLU HB2 45 HIP HN 5.72
&rst
ixpk= 0, nxpk= 0, iat= 626, 637, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 44 GLU HB3 44 GLU HG2 4.39
&rst
ixpk= 0, nxpk= 0, iat= 627, 629, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89, &end
#
# 44 GLU HB3 45 HIP HN 5.15
&rst
ixpk= 0, nxpk= 0, iat= 627, 637, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65, &end
#
# 44 GLU HB3 45 HIP HN 5.15
&rst
ixpk= 0, nxpk= 0, iat= 627, 637, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65, &end
#
# 44 GLU HB3 45 HIP HN 5.15
&rst
ixpk= 0, nxpk= 0, iat= 627, 637, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65, &end
#
# 44 GLU HB3 96 VAL QG2 5.29
&rst
ixpk= 0, nxpk= 0, iat= 627, -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
igr2=1333,1334,1335,
&end
#
# 44 GLU HB3 96 VAL QG2 5.29
&rst
ixpk= 0, nxpk= 0, iat= 627, -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
igr2=1333,1334,1335,
&end
#
# 44 GLU HB3 96 VAL QG2 5.29
&rst
ixpk= 0, nxpk= 0, iat= 627, -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
igr2=1333,1334,1335,
&end
#
# 44 GLU HG2 44 GLU HG3 3.43
&rst
ixpk= 0, nxpk= 0, iat= 629, 630, r1= 1.30, r2= 1.80, r3= 3.43, r4= 3.93, &end
#
# 44 GLU HG2 45 HIP HN 5.15
&rst
ixpk= 0, nxpk= 0, iat= 629, 637, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65, &end
#
# 44 GLU HG2 45 HIP HN 5.15
&rst
ixpk= 0, nxpk= 0, iat= 629, 637, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65, &end
#
# 44 GLU HG2 45 HIP HN 5.15
&rst
ixpk= 0, nxpk= 0, iat= 629, 637, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65, &end
#
# 44 GLU HG2 98 VAL HA 5.60
&rst
ixpk= 0, nxpk= 0, iat= 629,1360, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10, &end
#
# 44 GLU HG2 98 VAL HA 5.60
&rst
ixpk= 0, nxpk= 0, iat= 629,1360, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10, &end
#
# 44 GLU HG2 98 VAL HA 5.60
&rst
ixpk= 0, nxpk= 0, iat= 629,1360, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10, &end
#
# 44 GLU HG3 45 HIP HN 6.02
&rst
ixpk= 0, nxpk= 0, iat= 630, 637, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52, &end
#
# 44 GLU HG3 45 HIP HN 6.02
&rst
ixpk= 0, nxpk= 0, iat= 630, 637, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52, &end
#
# 44 GLU HG3 45 HIP HN 6.02
&rst
ixpk= 0, nxpk= 0, iat= 630, 637, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52, &end
#
# 44 GLU HG3 98 VAL HA 4.92
&rst
ixpk= 0, nxpk= 0, iat= 630,1360, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42, &end
#
# 44 GLU HG3 98 VAL HA 4.92
&rst
ixpk= 0, nxpk= 0, iat= 630,1360, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42, &end
#
# 44 GLU HG3 98 VAL HA 4.92
&rst
ixpk= 0, nxpk= 0, iat= 630,1360, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42, &end
#
# 44 GLU HG3 98 VAL QG2 4.80
&rst
ixpk= 0, nxpk= 0, iat= 630, -1, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
igr2=1368,1369,1370,
&end
#
# 44 GLU HG3 98 VAL QG2 4.80
&rst
ixpk= 0, nxpk= 0, iat= 630, -1, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
igr2=1368,1369,1370,
&end
#
# 44 GLU HG3 98 VAL QG2 4.80
&rst
ixpk= 0, nxpk= 0, iat= 630, -1, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
igr2=1368,1369,1370,
&end
#
# 45 HIP HN 45 HIP HA 4.99
&rst
ixpk= 0, nxpk= 0, iat= 637, 639, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49, &end
#
# 45 HIP HN 45 HIP HB2 4.57
&rst
ixpk= 0, nxpk= 0, iat= 637, 641, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07, &end
#
# 45 HIP HN 45 HIP HB2 4.57
&rst
ixpk= 0, nxpk= 0, iat= 637, 641, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07, &end
#
# 45 HIP HN 45 HIP HB2 4.57
&rst
ixpk= 0, nxpk= 0, iat= 637, 641, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07, &end
#
# 45 HIP HN 45 HIP HB3 4.36
&rst
ixpk= 0, nxpk= 0, iat= 637, 642, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86, &end
#
# 45 HIP HN 45 HIP HB3 4.36
&rst
ixpk= 0, nxpk= 0, iat= 637, 642, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86, &end
#
# 45 HIP HN 45 HIP HB3 4.36
&rst
ixpk= 0, nxpk= 0, iat= 637, 642, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86, &end
#
# 45 HIP HN 45 HIP HD2 4.61
&rst
ixpk= 0, nxpk= 0, iat= 637, 651, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 45 HIP HN 45 HIP HD2 4.61
&rst
ixpk= 0, nxpk= 0, iat= 637, 651, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 45 HIP HN 45 HIP HD2 4.61
&rst
ixpk= 0, nxpk= 0, iat= 637, 651, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 45 HIP HN 45 HIP HNE 6.05
&rst
ixpk= 0, nxpk= 0, iat= 637, 649, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 45 HIP HN 45 HIP HNE 6.05
&rst
ixpk= 0, nxpk= 0, iat= 637, 649, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 45 HIP HN 45 HIP HNE 6.05
&rst
ixpk= 0, nxpk= 0, iat= 637, 649, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 45 HIP HN 46 GLY HN 5.28
&rst
ixpk= 0, nxpk= 0, iat= 637, 655, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 45 HIP HN 46 GLY HN 5.31
&rst
ixpk= 0, nxpk= 0, iat= 637, 655, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81, &end
#
# 45 HIP HN 46 GLY HN 5.31
&rst
ixpk= 0, nxpk= 0, iat= 637, 655, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81, &end
#
# 45 HIP HN 46 GLY HN 5.31
&rst
ixpk= 0, nxpk= 0, iat= 637, 655, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81, &end
#
# 45 HIP HN 96 VAL QG1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 637, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1329,1330,1331,
&end
#
# 45 HIP HN 96 VAL QG1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 637, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1329,1330,1331,
&end
#
# 45 HIP HN 96 VAL QG1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 637, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1329,1330,1331,
&end
#
# 45 HIP HN 96 VAL QG2 5.43
&rst
ixpk= 0, nxpk= 0, iat= 637, -1, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
igr2=1333,1334,1335,
&end
#
# 45 HIP HN 96 VAL QG2 5.43
&rst
ixpk= 0, nxpk= 0, iat= 637, -1, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
igr2=1333,1334,1335,
&end
#
# 45 HIP HN 96 VAL QG2 5.43
&rst
ixpk= 0, nxpk= 0, iat= 637, -1, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
igr2=1333,1334,1335,
&end
#
# 45 HIP HN 97 LEU HN 4.60
&rst
ixpk= 0, nxpk= 0, iat= 637,1339, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 45 HIP HN 97 LEU HN 4.60
&rst
ixpk= 0, nxpk= 0, iat= 637,1339, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 45 HIP HN 97 LEU HN 4.60
&rst
ixpk= 0, nxpk= 0, iat= 637,1339, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 45 HIP HN 97 LEU HA 5.82
&rst
ixpk= 0, nxpk= 0, iat= 637,1341, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32, &end
#
# 45 HIP HN 97 LEU HA 5.82
&rst
ixpk= 0, nxpk= 0, iat= 637,1341, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32, &end
#
# 45 HIP HN 97 LEU HA 5.82
&rst
ixpk= 0, nxpk= 0, iat= 637,1341, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32, &end
#
# 45 HIP HN 97 LEU HB2 5.39
&rst
ixpk= 0, nxpk= 0, iat= 637,1343, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89, &end
#
# 45 HIP HN 97 LEU HB2 5.39
&rst
ixpk= 0, nxpk= 0, iat= 637,1343, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89, &end
#
# 45 HIP HN 97 LEU HB2 5.39
&rst
ixpk= 0, nxpk= 0, iat= 637,1343, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89, &end
#
# 45 HIP HN 97 LEU HB3 5.47
&rst
ixpk= 0, nxpk= 0, iat= 637,1344, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97, &end
#
# 45 HIP HN 97 LEU HB3 5.47
&rst
ixpk= 0, nxpk= 0, iat= 637,1344, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97, &end
#
# 45 HIP HN 97 LEU HB3 5.47
&rst
ixpk= 0, nxpk= 0, iat= 637,1344, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97, &end
#
# 45 HIP HN 97 LEU QD1 5.92
&rst
ixpk= 0, nxpk= 0, iat= 637, -1, r1= 1.30, r2= 1.80, r3= 7.11, r4= 7.61,
igr2=1348,1349,1350,
&end
#
# 45 HIP HN 97 LEU QD1 5.92
&rst
ixpk= 0, nxpk= 0, iat= 637, -1, r1= 1.30, r2= 1.80, r3= 7.11, r4= 7.61,
igr2=1348,1349,1350,
&end
#
# 45 HIP HN 97 LEU QD1 5.92
&rst
ixpk= 0, nxpk= 0, iat= 637, -1, r1= 1.30, r2= 1.80, r3= 7.11, r4= 7.61,
igr2=1348,1349,1350,
&end
#
# 45 HIP HN 98 VAL HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 637,1358, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 45 HIP HN 98 VAL HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 637,1358, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 45 HIP HN 98 VAL HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 637,1358, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 45 HIP HN 98 VAL HA 4.46
&rst
ixpk= 0, nxpk= 0, iat= 637,1360, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, &end
#
# 45 HIP HN 98 VAL HA 4.46
&rst
ixpk= 0, nxpk= 0, iat= 637,1360, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, &end
#
# 45 HIP HN 98 VAL HA 4.46
&rst
ixpk= 0, nxpk= 0, iat= 637,1360, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, &end
#
# 45 HIP HN 98 VAL QG1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 637, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1364,1365,1366,
&end
#
# 45 HIP HN 98 VAL QG1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 637, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1364,1365,1366,
&end
#
# 45 HIP HN 98 VAL QG1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 637, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1364,1365,1366,
&end
#
# 45 HIP HN 98 VAL QG2 5.02
&rst
ixpk= 0, nxpk= 0, iat= 637, -1, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
igr2=1368,1369,1370,
&end
#
# 45 HIP HN 98 VAL QG2 5.02
&rst
ixpk= 0, nxpk= 0, iat= 637, -1, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
igr2=1368,1369,1370,
&end
#
# 45 HIP HN 98 VAL QG2 5.02
&rst
ixpk= 0, nxpk= 0, iat= 637, -1, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
igr2=1368,1369,1370,
&end
#
# 45 HIP HN 99 VAL HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 637,1374, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 45 HIP HN 99 VAL HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 637,1374, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 45 HIP HN 99 VAL HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 637,1374, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 45 HIP HN 99 VAL QG1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 637, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1380,1381,1382,
&end
#
# 45 HIP HN 99 VAL QG1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 637, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1380,1381,1382,
&end
#
# 45 HIP HN 99 VAL QG1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 637, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1380,1381,1382,
&end
#
# 45 HIP HN 127 ILE QG2 5.61
&rst
ixpk= 0, nxpk= 0, iat= 637, -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
igr2=1809,1810,1811,
&end
#
# 45 HIP HN 127 ILE QG2 5.61
&rst
ixpk= 0, nxpk= 0, iat= 637, -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
igr2=1809,1810,1811,
&end
#
# 45 HIP HN 127 ILE QG2 5.61
&rst
ixpk= 0, nxpk= 0, iat= 637, -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
igr2=1809,1810,1811,
&end
#
# 45 HIP HA 45 HIP HB2 4.29
&rst
ixpk= 0, nxpk= 0, iat= 639, 641, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79, &end
#
# 45 HIP HA 45 HIP HB3 4.94
&rst
ixpk= 0, nxpk= 0, iat= 639, 642, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44, &end
#
# 45 HIP HA 45 HIP HD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 639, 651, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 45 HIP HA 45 HIP HD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 639, 651, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 45 HIP HA 45 HIP HD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 639, 651, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 45 HIP HA 45 HIP HE1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 639, 647, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 45 HIP HA 45 HIP HE1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 639, 647, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 45 HIP HA 45 HIP HE1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 639, 647, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 45 HIP HA 46 GLY HN 2.97
&rst
ixpk= 0, nxpk= 0, iat= 639, 655, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 45 HIP HA 46 GLY HN 3.65
&rst
ixpk= 0, nxpk= 0, iat= 639, 655, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15, &end
#
# 45 HIP HA 46 GLY HN 3.65
&rst
ixpk= 0, nxpk= 0, iat= 639, 655, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15, &end
#
# 45 HIP HA 46 GLY HN 3.65
&rst
ixpk= 0, nxpk= 0, iat= 639, 655, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15, &end
#
# 45 HIP HA 97 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 639,1339, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 45 HIP HA 97 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 639,1339, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 45 HIP HA 97 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 639,1339, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 45 HIP HA 127 ILE QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 639, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1809,1810,1811,
&end
#
# 45 HIP HA 127 ILE QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 639, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1809,1810,1811,
&end
#
# 45 HIP HA 127 ILE QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 639, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1809,1810,1811,
&end
#
# 45 HIP HA 131 GLY HN 5.33
&rst
ixpk= 0, nxpk= 0, iat= 639,1862, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83, &end
#
# 45 HIP HA 131 GLY HN 5.33
&rst
ixpk= 0, nxpk= 0, iat= 639,1862, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83, &end
#
# 45 HIP HA 131 GLY HN 5.33
&rst
ixpk= 0, nxpk= 0, iat= 639,1862, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83, &end
#
# 45 HIP HA 131 GLY HA3 4.74
&rst
ixpk= 0, nxpk= 0, iat= 639,1865, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24, &end
#
# 45 HIP HA 131 GLY HA3 4.74
&rst
ixpk= 0, nxpk= 0, iat= 639,1865, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24, &end
#
# 45 HIP HA 131 GLY HA3 4.74
&rst
ixpk= 0, nxpk= 0, iat= 639,1865, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24, &end
#
# 45 HIP HB2 45 HIP HB3 3.99
&rst
ixpk= 0, nxpk= 0, iat= 641, 642, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49, &end
#
# 45 HIP HB2 45 HIP HD1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 641, 645, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 45 HIP HB2 45 HIP HD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 641, 651, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 45 HIP HB2 45 HIP HNE 6.05
&rst
ixpk= 0, nxpk= 0, iat= 641, 649, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 45 HIP HB2 46 GLY HN 4.48
&rst
ixpk= 0, nxpk= 0, iat= 641, 655, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98, &end
#
# 45 HIP HB2 46 GLY HN 4.48
&rst
ixpk= 0, nxpk= 0, iat= 641, 655, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98, &end
#
# 45 HIP HB2 46 GLY HN 4.48
&rst
ixpk= 0, nxpk= 0, iat= 641, 655, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98, &end
#
# 45 HIP HB2 46 GLY HN 5.72
&rst
ixpk= 0, nxpk= 0, iat= 641, 655, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 45 HIP HB2 97 LEU HB3 5.57
&rst
ixpk= 0, nxpk= 0, iat= 641,1344, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07, &end
#
# 45 HIP HB2 97 LEU HB3 5.57
&rst
ixpk= 0, nxpk= 0, iat= 641,1344, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07, &end
#
# 45 HIP HB2 97 LEU HB3 5.57
&rst
ixpk= 0, nxpk= 0, iat= 641,1344, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07, &end
#
# 45 HIP HB2 97 LEU QD2 5.57
&rst
ixpk= 0, nxpk= 0, iat= 641, -1, r1= 1.30, r2= 1.80, r3= 6.69, r4= 7.19,
igr2=1352,1353,1354,
&end
#
# 45 HIP HB2 97 LEU QD2 5.57
&rst
ixpk= 0, nxpk= 0, iat= 641, -1, r1= 1.30, r2= 1.80, r3= 6.69, r4= 7.19,
igr2=1352,1353,1354,
&end
#
# 45 HIP HB2 97 LEU QD2 5.57
&rst
ixpk= 0, nxpk= 0, iat= 641, -1, r1= 1.30, r2= 1.80, r3= 6.69, r4= 7.19,
igr2=1352,1353,1354,
&end
#
# 45 HIP HB2 127 ILE HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 641,1805, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 45 HIP HB2 127 ILE HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 641,1805, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 45 HIP HB2 127 ILE HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 641,1805, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 45 HIP HB2 127 ILE QG2 4.50
&rst
ixpk= 0, nxpk= 0, iat= 641, -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr2=1809,1810,1811,
&end
#
# 45 HIP HB2 127 ILE QG2 4.50
&rst
ixpk= 0, nxpk= 0, iat= 641, -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr2=1809,1810,1811,
&end
#
# 45 HIP HB2 127 ILE QG2 4.50
&rst
ixpk= 0, nxpk= 0, iat= 641, -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr2=1809,1810,1811,
&end
#
# 45 HIP HB3 45 HIP HD1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 642, 645, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 45 HIP HB3 45 HIP HD2 5.28
&rst
ixpk= 0, nxpk= 0, iat= 642, 651, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 45 HIP HB3 46 GLY HN 5.36
&rst
ixpk= 0, nxpk= 0, iat= 642, 655, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86, &end
#
# 45 HIP HB3 46 GLY HN 5.36
&rst
ixpk= 0, nxpk= 0, iat= 642, 655, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86, &end
#
# 45 HIP HB3 46 GLY HN 5.36
&rst
ixpk= 0, nxpk= 0, iat= 642, 655, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86, &end
#
# 45 HIP HB3 97 LEU HN 4.49
&rst
ixpk= 0, nxpk= 0, iat= 642,1339, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99, &end
#
# 45 HIP HB3 97 LEU HN 4.49
&rst
ixpk= 0, nxpk= 0, iat= 642,1339, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99, &end
#
# 45 HIP HB3 97 LEU HN 4.49
&rst
ixpk= 0, nxpk= 0, iat= 642,1339, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99, &end
#
# 45 HIP HB3 97 LEU HB2 4.76
&rst
ixpk= 0, nxpk= 0, iat= 642,1343, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26, &end
#
# 45 HIP HB3 97 LEU HB2 4.76
&rst
ixpk= 0, nxpk= 0, iat= 642,1343, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26, &end
#
# 45 HIP HB3 97 LEU HB2 4.76
&rst
ixpk= 0, nxpk= 0, iat= 642,1343, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26, &end
#
# 45 HIP HB3 97 LEU HB3 4.90
&rst
ixpk= 0, nxpk= 0, iat= 642,1344, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40, &end
#
# 45 HIP HB3 97 LEU HB3 4.90
&rst
ixpk= 0, nxpk= 0, iat= 642,1344, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40, &end
#
# 45 HIP HB3 97 LEU HB3 4.90
&rst
ixpk= 0, nxpk= 0, iat= 642,1344, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40, &end
#
# 45 HIP HB3 97 LEU QD1 5.88
&rst
ixpk= 0, nxpk= 0, iat= 642, -1, r1= 1.30, r2= 1.80, r3= 7.06, r4= 7.56,
igr2=1348,1349,1350,
&end
#
# 45 HIP HB3 97 LEU QD1 5.88
&rst
ixpk= 0, nxpk= 0, iat= 642, -1, r1= 1.30, r2= 1.80, r3= 7.06, r4= 7.56,
igr2=1348,1349,1350,
&end
#
# 45 HIP HB3 97 LEU QD1 5.88
&rst
ixpk= 0, nxpk= 0, iat= 642, -1, r1= 1.30, r2= 1.80, r3= 7.06, r4= 7.56,
igr2=1348,1349,1350,
&end
#
# 45 HIP HB3 97 LEU QD2 5.04
&rst
ixpk= 0, nxpk= 0, iat= 642, -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
igr2=1352,1353,1354,
&end
#
# 45 HIP HB3 97 LEU QD2 5.04
&rst
ixpk= 0, nxpk= 0, iat= 642, -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
igr2=1352,1353,1354,
&end
#
# 45 HIP HB3 97 LEU QD2 5.04
&rst
ixpk= 0, nxpk= 0, iat= 642, -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
igr2=1352,1353,1354,
&end
#
# 45 HIP HB3 127 ILE QG2 4.71
&rst
ixpk= 0, nxpk= 0, iat= 642, -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr2=1809,1810,1811,
&end
#
# 45 HIP HB3 127 ILE QG2 4.71
&rst
ixpk= 0, nxpk= 0, iat= 642, -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr2=1809,1810,1811,
&end
#
# 45 HIP HB3 127 ILE QG2 4.71
&rst
ixpk= 0, nxpk= 0, iat= 642, -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr2=1809,1810,1811,
&end
#
# 45 HIP HD1 45 HIP HE1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 645, 647, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 45 HIP HD2 97 LEU HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 651,1343, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 45 HIP HD2 97 LEU HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 651,1343, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 45 HIP HD2 97 LEU HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 651,1343, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 45 HIP HD2 97 LEU HB3 5.38
&rst
ixpk= 0, nxpk= 0, iat= 651,1344, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88, &end
#
# 45 HIP HD2 97 LEU HB3 5.38
&rst
ixpk= 0, nxpk= 0, iat= 651,1344, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88, &end
#
# 45 HIP HD2 97 LEU HB3 5.38
&rst
ixpk= 0, nxpk= 0, iat= 651,1344, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88, &end
#
# 45 HIP HD2 97 LEU QD1 5.72
&rst
ixpk= 0, nxpk= 0, iat= 651, -1, r1= 1.30, r2= 1.80, r3= 6.87, r4= 7.37,
igr2=1348,1349,1350,
&end
#
# 45 HIP HD2 97 LEU QD1 5.72
&rst
ixpk= 0, nxpk= 0, iat= 651, -1, r1= 1.30, r2= 1.80, r3= 6.87, r4= 7.37,
igr2=1348,1349,1350,
&end
#
# 45 HIP HD2 97 LEU QD1 5.72
&rst
ixpk= 0, nxpk= 0, iat= 651, -1, r1= 1.30, r2= 1.80, r3= 6.87, r4= 7.37,
igr2=1348,1349,1350,
&end
#
# 45 HIP HD2 98 VAL HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 651,1360, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 45 HIP HD2 98 VAL HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 651,1360, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 45 HIP HD2 98 VAL HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 651,1360, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 45 HIP HD2 99 VAL HN 4.76
&rst
ixpk= 0, nxpk= 0, iat= 651,1374, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26, &end
#
# 45 HIP HD2 99 VAL HN 4.76
&rst
ixpk= 0, nxpk= 0, iat= 651,1374, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26, &end
#
# 45 HIP HD2 99 VAL HN 4.76
&rst
ixpk= 0, nxpk= 0, iat= 651,1374, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26, &end
#
# 45 HIP HD2 99 VAL HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 651,1376, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 45 HIP HD2 99 VAL HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 651,1376, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 45 HIP HD2 99 VAL HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 651,1376, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 45 HIP HD2 99 VAL HB 5.10
&rst
ixpk= 0, nxpk= 0, iat= 651,1378, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, &end
#
# 45 HIP HD2 99 VAL HB 5.10
&rst
ixpk= 0, nxpk= 0, iat= 651,1378, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, &end
#
# 45 HIP HD2 99 VAL HB 5.10
&rst
ixpk= 0, nxpk= 0, iat= 651,1378, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, &end
#
# 45 HIP HD2 99 VAL QG1 3.87
&rst
ixpk= 0, nxpk= 0, iat= 651, -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
igr2=1380,1381,1382,
&end
#
# 45 HIP HD2 99 VAL QG1 3.87
&rst
ixpk= 0, nxpk= 0, iat= 651, -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
igr2=1380,1381,1382,
&end
#
# 45 HIP HD2 99 VAL QG1 3.87
&rst
ixpk= 0, nxpk= 0, iat= 651, -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
igr2=1380,1381,1382,
&end
#
# 45 HIP HD2 105 ALA QB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 651, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1460,1461,1462,
&end
#
# 45 HIP HD2 105 ALA QB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 651, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1460,1461,1462,
&end
#
# 45 HIP HD2 105 ALA QB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 651, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1460,1461,1462,
&end
#
# 45 HIP HE1 45 HIP HD2 5.45
&rst
ixpk= 0, nxpk= 0, iat= 647, 651, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95, &end
#
# 45 HIP HE1 129 VAL HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 647,1841, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 45 HIP HE1 129 VAL HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 647,1841, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 45 HIP HE1 129 VAL HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 647,1841, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 45 HIP HE1 129 VAL QG1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 647, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1845,1846,1847,
&end
#
# 45 HIP HE1 129 VAL QG1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 647, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1845,1846,1847,
&end
#
# 45 HIP HE1 129 VAL QG1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 647, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1845,1846,1847,
&end
#
# 45 HIP HNE 45 HIP HD2 4.10
&rst
ixpk= 0, nxpk= 0, iat= 649, 651, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60, &end
#
# 45 HIP HNE 45 HIP HE1 4.16
&rst
ixpk= 0, nxpk= 0, iat= 649, 647, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66, &end
#
# 45 HIP HNE 99 VAL HN 6.03
&rst
ixpk= 0, nxpk= 0, iat= 649,1374, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53, &end
#
# 45 HIP HNE 99 VAL HN 6.03
&rst
ixpk= 0, nxpk= 0, iat= 649,1374, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53, &end
#
# 45 HIP HNE 99 VAL HN 6.03
&rst
ixpk= 0, nxpk= 0, iat= 649,1374, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53, &end
#
# 45 HIP HNE 99 VAL HB 4.59
&rst
ixpk= 0, nxpk= 0, iat= 649,1378, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 45 HIP HNE 99 VAL HB 4.59
&rst
ixpk= 0, nxpk= 0, iat= 649,1378, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 45 HIP HNE 99 VAL HB 4.59
&rst
ixpk= 0, nxpk= 0, iat= 649,1378, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 45 HIP HNE 99 VAL QG1 4.88
&rst
ixpk= 0, nxpk= 0, iat= 649, -1, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
igr2=1380,1381,1382,
&end
#
# 45 HIP HNE 99 VAL QG1 4.88
&rst
ixpk= 0, nxpk= 0, iat= 649, -1, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
igr2=1380,1381,1382,
&end
#
# 45 HIP HNE 99 VAL QG1 4.88
&rst
ixpk= 0, nxpk= 0, iat= 649, -1, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
igr2=1380,1381,1382,
&end
#
# 45 HIP HNE 99 VAL QG2 5.78
&rst
ixpk= 0, nxpk= 0, iat= 649, -1, r1= 1.30, r2= 1.80, r3= 6.94, r4= 7.44,
igr2=1384,1385,1386,
&end
#
# 45 HIP HNE 99 VAL QG2 5.78
&rst
ixpk= 0, nxpk= 0, iat= 649, -1, r1= 1.30, r2= 1.80, r3= 6.94, r4= 7.44,
igr2=1384,1385,1386,
&end
#
# 45 HIP HNE 99 VAL QG2 5.78
&rst
ixpk= 0, nxpk= 0, iat= 649, -1, r1= 1.30, r2= 1.80, r3= 6.94, r4= 7.44,
igr2=1384,1385,1386,
&end
#
# 46 GLY HN 46 GLY HA2 4.55
&rst
ixpk= 0, nxpk= 0, iat= 655, 657, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05, &end
#
# 46 GLY HN 46 GLY HA3 4.25
&rst
ixpk= 0, nxpk= 0, iat= 655, 658, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75, &end
#
# 46 GLY HN 47 PHE HN 5.28
&rst
ixpk= 0, nxpk= 0, iat= 655, 662, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 46 GLY HN 96 VAL HB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 655,1327, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 46 GLY HN 96 VAL HB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 655,1327, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 46 GLY HN 96 VAL HB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 655,1327, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 46 GLY HN 96 VAL QG1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 655, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1329,1330,1331,
&end
#
# 46 GLY HN 96 VAL QG1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 655, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1329,1330,1331,
&end
#
# 46 GLY HN 96 VAL QG1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 655, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1329,1330,1331,
&end
#
# 46 GLY HN 96 VAL QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 655, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1333,1334,1335,
&end
#
# 46 GLY HN 96 VAL QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 655, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1333,1334,1335,
&end
#
# 46 GLY HN 96 VAL QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 655, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1333,1334,1335,
&end
#
# 46 GLY HN 97 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 655,1339, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 46 GLY HN 97 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 655,1339, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 46 GLY HN 97 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 655,1339, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 46 GLY HN 127 ILE HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 655,1805, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 46 GLY HN 127 ILE HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 655,1805, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 46 GLY HN 127 ILE HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 655,1805, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 46 GLY HN 127 ILE QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 655, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1809,1810,1811,
&end
#
# 46 GLY HN 127 ILE QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 655, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1809,1810,1811,
&end
#
# 46 GLY HN 127 ILE QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 655, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1809,1810,1811,
&end
#
# 46 GLY HN 128 HID HN 5.54
&rst
ixpk= 0, nxpk= 0, iat= 655,1822, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04, &end
#
# 46 GLY HN 128 HID HN 5.54
&rst
ixpk= 0, nxpk= 0, iat= 655,1822, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04, &end
#
# 46 GLY HN 128 HID HN 5.54
&rst
ixpk= 0, nxpk= 0, iat= 655,1822, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04, &end
#
# 46 GLY HN 129 VAL HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 655,1841, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 46 GLY HN 129 VAL HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 655,1841, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 46 GLY HN 129 VAL HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 655,1841, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 46 GLY HN 130 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 655,1855, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 46 GLY HN 130 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 655,1855, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 46 GLY HN 130 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 655,1855, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 46 GLY HN 131 GLY HN 5.31
&rst
ixpk= 0, nxpk= 0, iat= 655,1862, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81, &end
#
# 46 GLY HN 131 GLY HN 5.31
&rst
ixpk= 0, nxpk= 0, iat= 655,1862, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81, &end
#
# 46 GLY HN 131 GLY HN 5.31
&rst
ixpk= 0, nxpk= 0, iat= 655,1862, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81, &end
#
# 46 GLY HN 131 GLY HA3 4.25
&rst
ixpk= 0, nxpk= 0, iat= 655,1865, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75, &end
#
# 46 GLY HN 131 GLY HA3 4.25
&rst
ixpk= 0, nxpk= 0, iat= 655,1865, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75, &end
#
# 46 GLY HN 131 GLY HA3 4.25
&rst
ixpk= 0, nxpk= 0, iat= 655,1865, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75, &end
#
# 46 GLY HN 132 ASP HN 5.10
&rst
ixpk= 0, nxpk= 0, iat= 655,1869, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, &end
#
# 46 GLY HN 132 ASP HN 5.10
&rst
ixpk= 0, nxpk= 0, iat= 655,1869, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, &end
#
# 46 GLY HN 132 ASP HN 5.10
&rst
ixpk= 0, nxpk= 0, iat= 655,1869, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, &end
#
# 46 GLY HN 132 ASP HB3 5.73
&rst
ixpk= 0, nxpk= 0, iat= 655,1874, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23, &end
#
# 46 GLY HN 132 ASP HB3 5.73
&rst
ixpk= 0, nxpk= 0, iat= 655,1874, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23, &end
#
# 46 GLY HN 132 ASP HB3 5.73
&rst
ixpk= 0, nxpk= 0, iat= 655,1874, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23, &end
#
# 46 GLY HA2 46 GLY HA3 4.58
&rst
ixpk= 0, nxpk= 0, iat= 657, 658, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08, &end
#
# 46 GLY HA2 47 PHE HN 2.97
&rst
ixpk= 0, nxpk= 0, iat= 657, 662, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 46 GLY HA2 47 PHE HN 4.21
&rst
ixpk= 0, nxpk= 0, iat= 657, 662, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71, &end
#
# 46 GLY HA2 97 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 657,1339, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 46 GLY HA2 97 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 657,1339, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 46 GLY HA2 97 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 657,1339, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 46 GLY HA2 131 GLY HN 5.38
&rst
ixpk= 0, nxpk= 0, iat= 657,1862, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88, &end
#
# 46 GLY HA2 131 GLY HN 5.38
&rst
ixpk= 0, nxpk= 0, iat= 657,1862, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88, &end
#
# 46 GLY HA2 131 GLY HN 5.38
&rst
ixpk= 0, nxpk= 0, iat= 657,1862, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88, &end
#
# 46 GLY HA2 132 ASP HN 5.24
&rst
ixpk= 0, nxpk= 0, iat= 657,1869, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74, &end
#
# 46 GLY HA2 132 ASP HN 5.24
&rst
ixpk= 0, nxpk= 0, iat= 657,1869, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74, &end
#
# 46 GLY HA2 132 ASP HN 5.24
&rst
ixpk= 0, nxpk= 0, iat= 657,1869, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74, &end
#
# 46 GLY HA2 132 ASP HA 6.03
&rst
ixpk= 0, nxpk= 0, iat= 657,1871, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53, &end
#
# 46 GLY HA2 132 ASP HA 6.03
&rst
ixpk= 0, nxpk= 0, iat= 657,1871, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53, &end
#
# 46 GLY HA2 132 ASP HA 6.03
&rst
ixpk= 0, nxpk= 0, iat= 657,1871, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53, &end
#
# 46 GLY HA2 132 ASP HB2 5.79
&rst
ixpk= 0, nxpk= 0, iat= 657,1873, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29, &end
#
# 46 GLY HA2 132 ASP HB2 5.79
&rst
ixpk= 0, nxpk= 0, iat= 657,1873, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29, &end
#
# 46 GLY HA2 132 ASP HB2 5.79
&rst
ixpk= 0, nxpk= 0, iat= 657,1873, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29, &end
#
# 46 GLY HA2 132 ASP HB3 5.58
&rst
ixpk= 0, nxpk= 0, iat= 657,1874, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08, &end
#
# 46 GLY HA2 132 ASP HB3 5.58
&rst
ixpk= 0, nxpk= 0, iat= 657,1874, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08, &end
#
# 46 GLY HA2 132 ASP HB3 5.58
&rst
ixpk= 0, nxpk= 0, iat= 657,1874, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08, &end
#
# 46 GLY HA3 47 PHE HN 4.39
&rst
ixpk= 0, nxpk= 0, iat= 658, 662, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89, &end
#
# 46 GLY HA3 96 VAL QG1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 658, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1329,1330,1331,
&end
#
# 46 GLY HA3 96 VAL QG1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 658, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1329,1330,1331,
&end
#
# 46 GLY HA3 96 VAL QG1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 658, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1329,1330,1331,
&end
#
# 46 GLY HA3 131 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 658,1862, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 46 GLY HA3 131 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 658,1862, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 46 GLY HA3 131 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 658,1862, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 47 PHE HN 47 PHE HA 4.96
&rst
ixpk= 0, nxpk= 0, iat= 662, 664, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46, &end
#
# 47 PHE HN 47 PHE HB2 4.84
&rst
ixpk= 0, nxpk= 0, iat= 662, 666, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34, &end
#
# 47 PHE HN 47 PHE HB3 4.78
&rst
ixpk= 0, nxpk= 0, iat= 662, 667, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, &end
#
# 47 PHE HN 47 PHE QD 5.13
&rst
ixpk= 0, nxpk= 0, iat= 662, -1, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
igr2= 670, 678,
&end
#
# 47 PHE HN 47 PHE QD 5.13
&rst
ixpk= 0, nxpk= 0, iat= 662, -1, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
igr2= 670, 678,
&end
#
# 47 PHE HN 47 PHE QD 5.13
&rst
ixpk= 0, nxpk= 0, iat= 662, -1, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
igr2= 670, 678,
&end
#
# 47 PHE HN 48 HIE HN 5.28
&rst
ixpk= 0, nxpk= 0, iat= 662, 682, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 47 PHE HN 48 HIE HN 5.79
&rst
ixpk= 0, nxpk= 0, iat= 662, 682, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29, &end
#
# 47 PHE HN 48 HIE HN 5.79
&rst
ixpk= 0, nxpk= 0, iat= 662, 682, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29, &end
#
# 47 PHE HN 48 HIE HN 5.79
&rst
ixpk= 0, nxpk= 0, iat= 662, 682, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29, &end
#
# 47 PHE HN 94 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 662, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1303,1304,1305,
&end
#
# 47 PHE HN 94 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 662, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1303,1304,1305,
&end
#
# 47 PHE HN 94 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 662, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1303,1304,1305,
&end
#
# 47 PHE HN 95 PRO HD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 662,1310, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 47 PHE HN 95 PRO HD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 662,1310, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 47 PHE HN 95 PRO HD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 662,1310, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 47 PHE HN 96 VAL HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 662,1323, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 47 PHE HN 96 VAL HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 662,1323, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 47 PHE HN 96 VAL HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 662,1323, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 47 PHE HN 96 VAL HA 5.12
&rst
ixpk= 0, nxpk= 0, iat= 662,1325, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, &end
#
# 47 PHE HN 96 VAL HA 5.12
&rst
ixpk= 0, nxpk= 0, iat= 662,1325, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, &end
#
# 47 PHE HN 96 VAL HA 5.12
&rst
ixpk= 0, nxpk= 0, iat= 662,1325, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, &end
#
# 47 PHE HN 96 VAL QG1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 662, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1329,1330,1331,
&end
#
# 47 PHE HN 96 VAL QG1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 662, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1329,1330,1331,
&end
#
# 47 PHE HN 96 VAL QG1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 662, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1329,1330,1331,
&end
#
# 47 PHE HN 96 VAL QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 662, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1333,1334,1335,
&end
#
# 47 PHE HN 96 VAL QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 662, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1333,1334,1335,
&end
#
# 47 PHE HN 96 VAL QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 662, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1333,1334,1335,
&end
#
# 47 PHE HN 97 LEU HN 5.71
&rst
ixpk= 0, nxpk= 0, iat= 662,1339, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21, &end
#
# 47 PHE HN 97 LEU HN 5.71
&rst
ixpk= 0, nxpk= 0, iat= 662,1339, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21, &end
#
# 47 PHE HN 97 LEU HN 5.71
&rst
ixpk= 0, nxpk= 0, iat= 662,1339, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21, &end
#
# 47 PHE HN 97 LEU HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 662,1344, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 47 PHE HN 97 LEU HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 662,1344, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 47 PHE HN 97 LEU HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 662,1344, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 47 PHE HN 127 ILE HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 662,1805, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 47 PHE HN 127 ILE HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 662,1805, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 47 PHE HN 127 ILE HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 662,1805, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 47 PHE HN 128 HID HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 662,1827, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 47 PHE HA 47 PHE HB2 5.06
&rst
ixpk= 0, nxpk= 0, iat= 664, 666, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56, &end
#
# 47 PHE HA 47 PHE HB3 4.80
&rst
ixpk= 0, nxpk= 0, iat= 664, 667, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30, &end
#
# 47 PHE HA 47 PHE QD 4.00
&rst
ixpk= 0, nxpk= 0, iat= 664, -1, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
igr2= 670, 678,
&end
#
# 47 PHE HA 47 PHE QD 4.00
&rst
ixpk= 0, nxpk= 0, iat= 664, -1, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
igr2= 670, 678,
&end
#
# 47 PHE HA 47 PHE QD 4.00
&rst
ixpk= 0, nxpk= 0, iat= 664, -1, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
igr2= 670, 678,
&end
#
# 47 PHE HA 48 HIE HN 2.97
&rst
ixpk= 0, nxpk= 0, iat= 664, 682, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 47 PHE HA 48 HIE HN 3.62
&rst
ixpk= 0, nxpk= 0, iat= 664, 682, r1= 1.30, r2= 1.80, r3= 3.62, r4= 4.12, &end
#
# 47 PHE HA 48 HIE HN 3.62
&rst
ixpk= 0, nxpk= 0, iat= 664, 682, r1= 1.30, r2= 1.80, r3= 3.62, r4= 4.12, &end
#
# 47 PHE HA 48 HIE HN 3.62
&rst
ixpk= 0, nxpk= 0, iat= 664, 682, r1= 1.30, r2= 1.80, r3= 3.62, r4= 4.12, &end
#
# 47 PHE HA 94 LEU HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 664,1295, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 47 PHE HA 94 LEU HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 664,1295, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 47 PHE HA 94 LEU HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 664,1295, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 47 PHE HA 94 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 664, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1303,1304,1305,
&end
#
# 47 PHE HA 94 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 664, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1303,1304,1305,
&end
#
# 47 PHE HA 94 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 664, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1303,1304,1305,
&end
#
# 47 PHE HA 96 VAL HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 664,1325, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 47 PHE HA 96 VAL HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 664,1325, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 47 PHE HA 96 VAL HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 664,1325, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 47 PHE HA 97 LEU HN 5.53
&rst
ixpk= 0, nxpk= 0, iat= 664,1339, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03, &end
#
# 47 PHE HA 97 LEU HN 5.53
&rst
ixpk= 0, nxpk= 0, iat= 664,1339, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03, &end
#
# 47 PHE HA 97 LEU HN 5.53
&rst
ixpk= 0, nxpk= 0, iat= 664,1339, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03, &end
#
# 47 PHE HA 97 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 664, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1352,1353,1354,
&end
#
# 47 PHE HA 97 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 664, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1352,1353,1354,
&end
#
# 47 PHE HA 97 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 664, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1352,1353,1354,
&end
#
# 47 PHE HA 126 MET HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 664,1786, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 47 PHE HA 126 MET HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 664,1786, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 47 PHE HA 126 MET HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 664,1786, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 47 PHE HA 127 ILE HA 4.97
&rst
ixpk= 0, nxpk= 0, iat= 664,1805, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 47 PHE HA 127 ILE HA 4.97
&rst
ixpk= 0, nxpk= 0, iat= 664,1805, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 47 PHE HA 127 ILE HA 4.97
&rst
ixpk= 0, nxpk= 0, iat= 664,1805, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 47 PHE HA 127 ILE HG12 6.05
&rst
ixpk= 0, nxpk= 0, iat= 664,1813, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 47 PHE HA 127 ILE HG12 6.05
&rst
ixpk= 0, nxpk= 0, iat= 664,1813, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 47 PHE HA 127 ILE HG12 6.05
&rst
ixpk= 0, nxpk= 0, iat= 664,1813, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 47 PHE HA 127 ILE HG13 6.05
&rst
ixpk= 0, nxpk= 0, iat= 664,1814, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 47 PHE HA 127 ILE HG13 6.05
&rst
ixpk= 0, nxpk= 0, iat= 664,1814, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 47 PHE HA 127 ILE HG13 6.05
&rst
ixpk= 0, nxpk= 0, iat= 664,1814, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 47 PHE HA 127 ILE QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 664, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1816,1817,1818,
&end
#
# 47 PHE HA 127 ILE QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 664, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1816,1817,1818,
&end
#
# 47 PHE HA 127 ILE QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 664, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1816,1817,1818,
&end
#
# 47 PHE HA 127 ILE QG2 5.73
&rst
ixpk= 0, nxpk= 0, iat= 664, -1, r1= 1.30, r2= 1.80, r3= 6.88, r4= 7.38,
igr2=1809,1810,1811,
&end
#
# 47 PHE HA 127 ILE QG2 5.73
&rst
ixpk= 0, nxpk= 0, iat= 664, -1, r1= 1.30, r2= 1.80, r3= 6.88, r4= 7.38,
igr2=1809,1810,1811,
&end
#
# 47 PHE HA 127 ILE QG2 5.73
&rst
ixpk= 0, nxpk= 0, iat= 664, -1, r1= 1.30, r2= 1.80, r3= 6.88, r4= 7.38,
igr2=1809,1810,1811,
&end
#
# 47 PHE HA 128 HID HN 5.07
&rst
ixpk= 0, nxpk= 0, iat= 664,1822, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, &end
#
# 47 PHE HA 128 HID HN 5.07
&rst
ixpk= 0, nxpk= 0, iat= 664,1822, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, &end
#
# 47 PHE HA 128 HID HN 5.07
&rst
ixpk= 0, nxpk= 0, iat= 664,1822, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, &end
#
# 47 PHE HB2 47 PHE HB3 4.28
&rst
ixpk= 0, nxpk= 0, iat= 666, 667, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78, &end
#
# 47 PHE HB2 48 HIE HN 5.53
&rst
ixpk= 0, nxpk= 0, iat= 666, 682, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03, &end
#
# 47 PHE HB2 48 HIE HN 5.53
&rst
ixpk= 0, nxpk= 0, iat= 666, 682, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03, &end
#
# 47 PHE HB2 48 HIE HN 5.53
&rst
ixpk= 0, nxpk= 0, iat= 666, 682, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03, &end
#
# 47 PHE HB2 48 HIE HN 5.72
&rst
ixpk= 0, nxpk= 0, iat= 666, 682, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 47 PHE HB2 94 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 666, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1303,1304,1305,
&end
#
# 47 PHE HB2 94 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 666, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1303,1304,1305,
&end
#
# 47 PHE HB2 94 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 666, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1303,1304,1305,
&end
#
# 47 PHE HB2 96 VAL HA 5.59
&rst
ixpk= 0, nxpk= 0, iat= 666,1325, r1= 1.30, r2= 1.80, r3= 5.59, r4= 6.09, &end
#
# 47 PHE HB2 96 VAL HA 5.59
&rst
ixpk= 0, nxpk= 0, iat= 666,1325, r1= 1.30, r2= 1.80, r3= 5.59, r4= 6.09, &end
#
# 47 PHE HB2 96 VAL HA 5.59
&rst
ixpk= 0, nxpk= 0, iat= 666,1325, r1= 1.30, r2= 1.80, r3= 5.59, r4= 6.09, &end
#
# 47 PHE HB2 97 LEU HN 4.93
&rst
ixpk= 0, nxpk= 0, iat= 666,1339, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43, &end
#
# 47 PHE HB2 97 LEU HN 4.93
&rst
ixpk= 0, nxpk= 0, iat= 666,1339, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43, &end
#
# 47 PHE HB2 97 LEU HN 4.93
&rst
ixpk= 0, nxpk= 0, iat= 666,1339, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43, &end
#
# 47 PHE HB2 97 LEU HA 5.58
&rst
ixpk= 0, nxpk= 0, iat= 666,1341, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08, &end
#
# 47 PHE HB2 97 LEU HA 5.58
&rst
ixpk= 0, nxpk= 0, iat= 666,1341, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08, &end
#
# 47 PHE HB2 97 LEU HA 5.58
&rst
ixpk= 0, nxpk= 0, iat= 666,1341, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08, &end
#
# 47 PHE HB2 97 LEU HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 666,1343, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 47 PHE HB2 97 LEU HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 666,1343, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 47 PHE HB2 97 LEU HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 666,1343, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 47 PHE HB2 97 LEU HB3 5.65
&rst
ixpk= 0, nxpk= 0, iat= 666,1344, r1= 1.30, r2= 1.80, r3= 5.65, r4= 6.15, &end
#
# 47 PHE HB2 97 LEU HB3 5.65
&rst
ixpk= 0, nxpk= 0, iat= 666,1344, r1= 1.30, r2= 1.80, r3= 5.65, r4= 6.15, &end
#
# 47 PHE HB2 97 LEU HB3 5.65
&rst
ixpk= 0, nxpk= 0, iat= 666,1344, r1= 1.30, r2= 1.80, r3= 5.65, r4= 6.15, &end
#
# 47 PHE HB2 97 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 666, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1352,1353,1354,
&end
#
# 47 PHE HB2 97 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 666, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1352,1353,1354,
&end
#
# 47 PHE HB2 97 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 666, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1352,1353,1354,
&end
#
# 47 PHE HB2 127 ILE HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 666,1805, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 47 PHE HB2 127 ILE HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 666,1805, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 47 PHE HB2 127 ILE HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 666,1805, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 47 PHE HB3 48 HIE HN 5.47
&rst
ixpk= 0, nxpk= 0, iat= 667, 682, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97, &end
#
# 47 PHE HB3 48 HIE HN 5.47
&rst
ixpk= 0, nxpk= 0, iat= 667, 682, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97, &end
#
# 47 PHE HB3 48 HIE HN 5.47
&rst
ixpk= 0, nxpk= 0, iat= 667, 682, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97, &end
#
# 47 PHE HB3 94 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 667, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1303,1304,1305,
&end
#
# 47 PHE HB3 94 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 667, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1303,1304,1305,
&end
#
# 47 PHE HB3 94 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 667, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1303,1304,1305,
&end
#
# 47 PHE HB3 97 LEU HN 4.63
&rst
ixpk= 0, nxpk= 0, iat= 667,1339, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, &end
#
# 47 PHE HB3 97 LEU HN 4.63
&rst
ixpk= 0, nxpk= 0, iat= 667,1339, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, &end
#
# 47 PHE HB3 97 LEU HN 4.63
&rst
ixpk= 0, nxpk= 0, iat= 667,1339, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, &end
#
# 47 PHE HB3 97 LEU HB3 5.14
&rst
ixpk= 0, nxpk= 0, iat= 667,1344, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64, &end
#
# 47 PHE HB3 97 LEU HB3 5.14
&rst
ixpk= 0, nxpk= 0, iat= 667,1344, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64, &end
#
# 47 PHE HB3 97 LEU HB3 5.14
&rst
ixpk= 0, nxpk= 0, iat= 667,1344, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64, &end
#
# 47 PHE HB3 97 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 667, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1352,1353,1354,
&end
#
# 47 PHE HB3 97 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 667, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1352,1353,1354,
&end
#
# 47 PHE HB3 97 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 667, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1352,1353,1354,
&end
#
# 47 PHE HZ 49 ILE HG12 6.05
&rst
ixpk= 0, nxpk= 0, iat= 674, 709, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 47 PHE HZ 49 ILE HG12 6.05
&rst
ixpk= 0, nxpk= 0, iat= 674, 709, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 47 PHE HZ 49 ILE HG12 6.05
&rst
ixpk= 0, nxpk= 0, iat= 674, 709, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 47 PHE HZ 49 ILE HG13 5.17
&rst
ixpk= 0, nxpk= 0, iat= 674, 710, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67, &end
#
# 47 PHE HZ 49 ILE HG13 5.17
&rst
ixpk= 0, nxpk= 0, iat= 674, 710, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67, &end
#
# 47 PHE HZ 49 ILE HG13 5.17
&rst
ixpk= 0, nxpk= 0, iat= 674, 710, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67, &end
#
# 47 PHE HZ 49 ILE QD1 4.22
&rst
ixpk= 0, nxpk= 0, iat= 674, -1, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
igr2= 712, 713, 714,
&end
#
# 47 PHE HZ 49 ILE QD1 4.22
&rst
ixpk= 0, nxpk= 0, iat= 674, -1, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
igr2= 712, 713, 714,
&end
#
# 47 PHE HZ 49 ILE QD1 4.22
&rst
ixpk= 0, nxpk= 0, iat= 674, -1, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57,
igr2= 712, 713, 714,
&end
#
# 47 PHE HZ 94 LEU HB3 4.99
&rst
ixpk= 0, nxpk= 0, iat= 674,1295, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49, &end
#
# 47 PHE HZ 94 LEU HB3 4.99
&rst
ixpk= 0, nxpk= 0, iat= 674,1295, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49, &end
#
# 47 PHE HZ 94 LEU HB3 4.99
&rst
ixpk= 0, nxpk= 0, iat= 674,1295, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49, &end
#
# 47 PHE HZ 94 LEU QD1 5.47
&rst
ixpk= 0, nxpk= 0, iat= 674, -1, r1= 1.30, r2= 1.80, r3= 6.57, r4= 7.07,
igr2=1299,1300,1301,
&end
#
# 47 PHE HZ 94 LEU QD1 5.47
&rst
ixpk= 0, nxpk= 0, iat= 674, -1, r1= 1.30, r2= 1.80, r3= 6.57, r4= 7.07,
igr2=1299,1300,1301,
&end
#
# 47 PHE HZ 94 LEU QD1 5.47
&rst
ixpk= 0, nxpk= 0, iat= 674, -1, r1= 1.30, r2= 1.80, r3= 6.57, r4= 7.07,
igr2=1299,1300,1301,
&end
#
# 47 PHE HZ 94 LEU QD2 5.46
&rst
ixpk= 0, nxpk= 0, iat= 674, -1, r1= 1.30, r2= 1.80, r3= 6.56, r4= 7.06,
igr2=1303,1304,1305,
&end
#
# 47 PHE HZ 94 LEU QD2 5.46
&rst
ixpk= 0, nxpk= 0, iat= 674, -1, r1= 1.30, r2= 1.80, r3= 6.56, r4= 7.06,
igr2=1303,1304,1305,
&end
#
# 47 PHE HZ 94 LEU QD2 5.46
&rst
ixpk= 0, nxpk= 0, iat= 674, -1, r1= 1.30, r2= 1.80, r3= 6.56, r4= 7.06,
igr2=1303,1304,1305,
&end
#
# 47 PHE HZ 111 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 674,1539, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 47 PHE HZ 111 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 674,1539, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 47 PHE HZ 111 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 674,1539, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 47 PHE HZ 111 ALA QB 4.98
&rst
ixpk= 0, nxpk= 0, iat= 674, -1, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
igr2=1543,1544,1545,
&end
#
# 47 PHE HZ 111 ALA QB 4.98
&rst
ixpk= 0, nxpk= 0, iat= 674, -1, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
igr2=1543,1544,1545,
&end
#
# 47 PHE HZ 111 ALA QB 4.98
&rst
ixpk= 0, nxpk= 0, iat= 674, -1, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
igr2=1543,1544,1545,
&end
#
# 47 PHE HZ 125 LEU QD2 5.88
&rst
ixpk= 0, nxpk= 0, iat= 674, -1, r1= 1.30, r2= 1.80, r3= 7.06, r4= 7.56,
igr2=1780,1781,1782,
&end
#
# 47 PHE HZ 125 LEU QD2 5.88
&rst
ixpk= 0, nxpk= 0, iat= 674, -1, r1= 1.30, r2= 1.80, r3= 7.06, r4= 7.56,
igr2=1780,1781,1782,
&end
#
# 47 PHE HZ 125 LEU QD2 5.88
&rst
ixpk= 0, nxpk= 0, iat= 674, -1, r1= 1.30, r2= 1.80, r3= 7.06, r4= 7.56,
igr2=1780,1781,1782,
&end
#
# 47 PHE QD 47 PHE HB2 4.85
&rst
ixpk= 0, nxpk= 0, iat= -1, 666, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
igr1= 670, 678,
&end
#
# 47 PHE QD 47 PHE HB3 4.59
&rst
ixpk= 0, nxpk= 0, iat= -1, 667, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
igr1= 670, 678,
&end
#
# 47 PHE QD 47 PHE QE 4.63
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33,
igr1= 670, 678,
igr2= 672, 676,
&end
#
# 47 PHE QD 48 HIE HN 4.17
&rst
ixpk= 0, nxpk= 0, iat= -1, 682, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
igr1= 670, 678,
&end
#
# 47 PHE QD 48 HIE HN 4.17
&rst
ixpk= 0, nxpk= 0, iat= -1, 682, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
igr1= 670, 678,
&end
#
# 47 PHE QD 48 HIE HN 4.17
&rst
ixpk= 0, nxpk= 0, iat= -1, 682, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
igr1= 670, 678,
&end
#
# 47 PHE QD 49 ILE HG13 5.31
&rst
ixpk= 0, nxpk= 0, iat= -1, 710, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
igr1= 670, 678,
&end
#
# 47 PHE QD 49 ILE HG13 5.31
&rst
ixpk= 0, nxpk= 0, iat= -1, 710, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
igr1= 670, 678,
&end
#
# 47 PHE QD 49 ILE HG13 5.31
&rst
ixpk= 0, nxpk= 0, iat= -1, 710, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
igr1= 670, 678,
&end
#
# 47 PHE QD 94 LEU HB2 5.90
&rst
ixpk= 0, nxpk= 0, iat= -1,1294, r1= 1.30, r2= 1.80, r3= 6.62, r4= 7.12,
igr1= 670, 678,
&end
#
# 47 PHE QD 94 LEU HB2 5.90
&rst
ixpk= 0, nxpk= 0, iat= -1,1294, r1= 1.30, r2= 1.80, r3= 6.62, r4= 7.12,
igr1= 670, 678,
&end
#
# 47 PHE QD 94 LEU HB2 5.90
&rst
ixpk= 0, nxpk= 0, iat= -1,1294, r1= 1.30, r2= 1.80, r3= 6.62, r4= 7.12,
igr1= 670, 678,
&end
#
# 47 PHE QD 94 LEU HB3 5.12
&rst
ixpk= 0, nxpk= 0, iat= -1,1295, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
igr1= 670, 678,
&end
#
# 47 PHE QD 94 LEU HB3 5.12
&rst
ixpk= 0, nxpk= 0, iat= -1,1295, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
igr1= 670, 678,
&end
#
# 47 PHE QD 94 LEU HB3 5.12
&rst
ixpk= 0, nxpk= 0, iat= -1,1295, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
igr1= 670, 678,
&end
#
# 47 PHE QD 94 LEU QD2 4.99
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1= 670, 678,
igr2=1303,1304,1305,
&end
#
# 47 PHE QD 94 LEU QD2 4.99
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1= 670, 678,
igr2=1303,1304,1305,
&end
#
# 47 PHE QD 94 LEU QD2 4.99
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr1= 670, 678,
igr2=1303,1304,1305,
&end
#
# 47 PHE QD 95 PRO HD3 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1311, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 670, 678,
&end
#
# 47 PHE QD 95 PRO HD3 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1311, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 670, 678,
&end
#
# 47 PHE QD 95 PRO HD3 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1311, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 670, 678,
&end
#
# 47 PHE QD 97 LEU HN 5.86
&rst
ixpk= 0, nxpk= 0, iat= -1,1339, r1= 1.30, r2= 1.80, r3= 6.58, r4= 7.08,
igr1= 670, 678,
&end
#
# 47 PHE QD 97 LEU HN 5.86
&rst
ixpk= 0, nxpk= 0, iat= -1,1339, r1= 1.30, r2= 1.80, r3= 6.58, r4= 7.08,
igr1= 670, 678,
&end
#
# 47 PHE QD 97 LEU HN 5.86
&rst
ixpk= 0, nxpk= 0, iat= -1,1339, r1= 1.30, r2= 1.80, r3= 6.58, r4= 7.08,
igr1= 670, 678,
&end
#
# 47 PHE QD 97 LEU HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1343, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 670, 678,
&end
#
# 47 PHE QD 97 LEU HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1343, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 670, 678,
&end
#
# 47 PHE QD 97 LEU HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1343, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 670, 678,
&end
#
# 47 PHE QD 97 LEU HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1344, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 670, 678,
&end
#
# 47 PHE QD 97 LEU HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1344, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 670, 678,
&end
#
# 47 PHE QD 97 LEU HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1344, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 670, 678,
&end
#
# 47 PHE QD 97 LEU HG 5.87
&rst
ixpk= 0, nxpk= 0, iat= -1,1346, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
igr1= 670, 678,
&end
#
# 47 PHE QD 97 LEU HG 5.87
&rst
ixpk= 0, nxpk= 0, iat= -1,1346, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
igr1= 670, 678,
&end
#
# 47 PHE QD 97 LEU HG 5.87
&rst
ixpk= 0, nxpk= 0, iat= -1,1346, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
igr1= 670, 678,
&end
#
# 47 PHE QD 97 LEU QD1 5.61
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
igr1= 670, 678,
igr2=1348,1349,1350,
&end
#
# 47 PHE QD 97 LEU QD1 5.61
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
igr1= 670, 678,
igr2=1348,1349,1350,
&end
#
# 47 PHE QD 97 LEU QD1 5.61
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
igr1= 670, 678,
igr2=1348,1349,1350,
&end
#
# 47 PHE QD 97 LEU QD2 4.96
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.69, r4= 7.19,
igr1= 670, 678,
igr2=1352,1353,1354,
&end
#
# 47 PHE QD 97 LEU QD2 4.96
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.69, r4= 7.19,
igr1= 670, 678,
igr2=1352,1353,1354,
&end
#
# 47 PHE QD 97 LEU QD2 4.96
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.69, r4= 7.19,
igr1= 670, 678,
igr2=1352,1353,1354,
&end
#
# 47 PHE QD 109 VAL QG2 4.43
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr1= 670, 678,
igr2=1519,1520,1521,
&end
#
# 47 PHE QD 109 VAL QG2 4.43
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr1= 670, 678,
igr2=1519,1520,1521,
&end
#
# 47 PHE QD 109 VAL QG2 4.43
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr1= 670, 678,
igr2=1519,1520,1521,
&end
#
# 47 PHE QD 125 LEU QD2 5.41
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.29, r4= 7.79,
igr1= 670, 678,
igr2=1780,1781,1782,
&end
#
# 47 PHE QD 125 LEU QD2 5.41
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.29, r4= 7.79,
igr1= 670, 678,
igr2=1780,1781,1782,
&end
#
# 47 PHE QD 125 LEU QD2 5.41
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.29, r4= 7.79,
igr1= 670, 678,
igr2=1780,1781,1782,
&end
#
# 47 PHE QD 126 MET HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1786, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 670, 678,
&end
#
# 47 PHE QD 126 MET HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1786, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 670, 678,
&end
#
# 47 PHE QD 126 MET HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1786, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 670, 678,
&end
#
# 47 PHE QD 127 ILE HA 5.19
&rst
ixpk= 0, nxpk= 0, iat= -1,1805, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33,
igr1= 670, 678,
&end
#
# 47 PHE QD 127 ILE HA 5.19
&rst
ixpk= 0, nxpk= 0, iat= -1,1805, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33,
igr1= 670, 678,
&end
#
# 47 PHE QD 127 ILE HA 5.19
&rst
ixpk= 0, nxpk= 0, iat= -1,1805, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33,
igr1= 670, 678,
&end
#
# 47 PHE QD 127 ILE HG12 5.48
&rst
ixpk= 0, nxpk= 0, iat= -1,1813, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
igr1= 670, 678,
&end
#
# 47 PHE QD 127 ILE HG12 5.48
&rst
ixpk= 0, nxpk= 0, iat= -1,1813, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
igr1= 670, 678,
&end
#
# 47 PHE QD 127 ILE HG12 5.48
&rst
ixpk= 0, nxpk= 0, iat= -1,1813, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
igr1= 670, 678,
&end
#
# 47 PHE QD 127 ILE HG13 5.52
&rst
ixpk= 0, nxpk= 0, iat= -1,1814, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
igr1= 670, 678,
&end
#
# 47 PHE QD 127 ILE HG13 5.52
&rst
ixpk= 0, nxpk= 0, iat= -1,1814, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
igr1= 670, 678,
&end
#
# 47 PHE QD 127 ILE HG13 5.52
&rst
ixpk= 0, nxpk= 0, iat= -1,1814, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
igr1= 670, 678,
&end
#
# 47 PHE QD 127 ILE QD1 5.37
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.24, r4= 7.74,
igr1= 670, 678,
igr2=1816,1817,1818,
&end
#
# 47 PHE QD 127 ILE QD1 5.37
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.24, r4= 7.74,
igr1= 670, 678,
igr2=1816,1817,1818,
&end
#
# 47 PHE QD 127 ILE QD1 5.37
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.24, r4= 7.74,
igr1= 670, 678,
igr2=1816,1817,1818,
&end
#
# 47 PHE QD 127 ILE QG2 5.93
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.99, r4= 8.49,
igr1= 670, 678,
igr2=1809,1810,1811,
&end
#
# 47 PHE QD 127 ILE QG2 5.93
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.99, r4= 8.49,
igr1= 670, 678,
igr2=1809,1810,1811,
&end
#
# 47 PHE QD 127 ILE QG2 5.93
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.99, r4= 8.49,
igr1= 670, 678,
igr2=1809,1810,1811,
&end
#
# 47 PHE QD 128 HID HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1822, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 670, 678,
&end
#
# 47 PHE QD 128 HID HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1822, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 670, 678,
&end
#
# 47 PHE QD 128 HID HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1822, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1= 670, 678,
&end
#
# 47 PHE QE 47 PHE HZ 5.48
&rst
ixpk= 0, nxpk= 0, iat= -1, 674, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
igr1= 672, 676,
&end
#
# 47 PHE QE 48 HIE HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 682, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 672, 676,
&end
#
# 47 PHE QE 48 HIE HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 682, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 672, 676,
&end
#
# 47 PHE QE 48 HIE HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 682, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 672, 676,
&end
#
# 47 PHE QE 49 ILE HG12 5.86
&rst
ixpk= 0, nxpk= 0, iat= -1, 709, r1= 1.30, r2= 1.80, r3= 6.58, r4= 7.08,
igr1= 672, 676,
&end
#
# 47 PHE QE 49 ILE HG12 5.86
&rst
ixpk= 0, nxpk= 0, iat= -1, 709, r1= 1.30, r2= 1.80, r3= 6.58, r4= 7.08,
igr1= 672, 676,
&end
#
# 47 PHE QE 49 ILE HG12 5.86
&rst
ixpk= 0, nxpk= 0, iat= -1, 709, r1= 1.30, r2= 1.80, r3= 6.58, r4= 7.08,
igr1= 672, 676,
&end
#
# 47 PHE QE 49 ILE HG13 4.36
&rst
ixpk= 0, nxpk= 0, iat= -1, 710, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
igr1= 672, 676,
&end
#
# 47 PHE QE 49 ILE HG13 4.36
&rst
ixpk= 0, nxpk= 0, iat= -1, 710, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
igr1= 672, 676,
&end
#
# 47 PHE QE 49 ILE HG13 4.36
&rst
ixpk= 0, nxpk= 0, iat= -1, 710, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
igr1= 672, 676,
&end
#
# 47 PHE QE 49 ILE QD1 4.43
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr1= 672, 676,
igr2= 712, 713, 714,
&end
#
# 47 PHE QE 49 ILE QD1 4.43
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr1= 672, 676,
igr2= 712, 713, 714,
&end
#
# 47 PHE QE 49 ILE QD1 4.43
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr1= 672, 676,
igr2= 712, 713, 714,
&end
#
# 47 PHE QE 94 LEU QD1 4.82
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
igr1= 672, 676,
igr2=1299,1300,1301,
&end
#
# 47 PHE QE 94 LEU QD1 4.82
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
igr1= 672, 676,
igr2=1299,1300,1301,
&end
#
# 47 PHE QE 94 LEU QD1 4.82
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
igr1= 672, 676,
igr2=1299,1300,1301,
&end
#
# 47 PHE QE 94 LEU QD2 5.17
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.97, r4= 7.47,
igr1= 672, 676,
igr2=1303,1304,1305,
&end
#
# 47 PHE QE 94 LEU QD2 5.17
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.97, r4= 7.47,
igr1= 672, 676,
igr2=1303,1304,1305,
&end
#
# 47 PHE QE 94 LEU QD2 5.17
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.97, r4= 7.47,
igr1= 672, 676,
igr2=1303,1304,1305,
&end
#
# 47 PHE QE 109 VAL QG2 5.82
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.85, r4= 8.35,
igr1= 672, 676,
igr2=1519,1520,1521,
&end
#
# 47 PHE QE 109 VAL QG2 5.82
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.85, r4= 8.35,
igr1= 672, 676,
igr2=1519,1520,1521,
&end
#
# 47 PHE QE 109 VAL QG2 5.82
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.85, r4= 8.35,
igr1= 672, 676,
igr2=1519,1520,1521,
&end
#
# 47 PHE QE 110 THR HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1525, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 672, 676,
&end
#
# 47 PHE QE 110 THR HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1525, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 672, 676,
&end
#
# 47 PHE QE 110 THR HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1525, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 672, 676,
&end
#
# 47 PHE QE 110 THR HA 5.10
&rst
ixpk= 0, nxpk= 0, iat= -1,1527, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
igr1= 672, 676,
&end
#
# 47 PHE QE 110 THR HA 5.10
&rst
ixpk= 0, nxpk= 0, iat= -1,1527, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
igr1= 672, 676,
&end
#
# 47 PHE QE 110 THR HA 5.10
&rst
ixpk= 0, nxpk= 0, iat= -1,1527, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
igr1= 672, 676,
&end
#
# 47 PHE QE 111 ALA HN 5.16
&rst
ixpk= 0, nxpk= 0, iat= -1,1539, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,
igr1= 672, 676,
&end
#
# 47 PHE QE 111 ALA HN 5.16
&rst
ixpk= 0, nxpk= 0, iat= -1,1539, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,
igr1= 672, 676,
&end
#
# 47 PHE QE 111 ALA HN 5.16
&rst
ixpk= 0, nxpk= 0, iat= -1,1539, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,
igr1= 672, 676,
&end
#
# 47 PHE QE 111 ALA HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1541, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 672, 676,
&end
#
# 47 PHE QE 111 ALA HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1541, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 672, 676,
&end
#
# 47 PHE QE 111 ALA HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1541, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 672, 676,
&end
#
# 47 PHE QE 111 ALA QB 4.29
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr1= 672, 676,
igr2=1543,1544,1545,
&end
#
# 47 PHE QE 111 ALA QB 4.29
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr1= 672, 676,
igr2=1543,1544,1545,
&end
#
# 47 PHE QE 111 ALA QB 4.29
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr1= 672, 676,
igr2=1543,1544,1545,
&end
#
# 47 PHE QE 125 LEU HA 3.97
&rst
ixpk= 0, nxpk= 0, iat= -1,1769, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
igr1= 672, 676,
&end
#
# 47 PHE QE 125 LEU HA 3.97
&rst
ixpk= 0, nxpk= 0, iat= -1,1769, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
igr1= 672, 676,
&end
#
# 47 PHE QE 125 LEU HA 3.97
&rst
ixpk= 0, nxpk= 0, iat= -1,1769, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
igr1= 672, 676,
&end
#
# 47 PHE QE 125 LEU HG 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1774, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 672, 676,
&end
#
# 47 PHE QE 125 LEU HG 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1774, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 672, 676,
&end
#
# 47 PHE QE 125 LEU HG 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1774, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 672, 676,
&end
#
# 47 PHE QE 125 LEU QD1 4.86
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.55, r4= 7.05,
igr1= 672, 676,
igr2=1776,1777,1778,
&end
#
# 47 PHE QE 125 LEU QD1 4.86
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.55, r4= 7.05,
igr1= 672, 676,
igr2=1776,1777,1778,
&end
#
# 47 PHE QE 125 LEU QD1 4.86
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.55, r4= 7.05,
igr1= 672, 676,
igr2=1776,1777,1778,
&end
#
# 47 PHE QE 125 LEU QD2 4.78
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,
igr1= 672, 676,
igr2=1780,1781,1782,
&end
#
# 47 PHE QE 125 LEU QD2 4.78
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,
igr1= 672, 676,
igr2=1780,1781,1782,
&end
#
# 47 PHE QE 125 LEU QD2 4.78
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.44, r4= 6.94,
igr1= 672, 676,
igr2=1780,1781,1782,
&end
#
# 48 HIE HN 48 HIE HA 4.73
&rst
ixpk= 0, nxpk= 0, iat= 682, 684, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, &end
#
# 48 HIE HN 49 ILE HN 5.28
&rst
ixpk= 0, nxpk= 0, iat= 682, 699, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 48 HIE HN 49 ILE HN 5.64
&rst
ixpk= 0, nxpk= 0, iat= 682, 699, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14, &end
#
# 48 HIE HN 49 ILE HN 5.64
&rst
ixpk= 0, nxpk= 0, iat= 682, 699, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14, &end
#
# 48 HIE HN 49 ILE HN 5.64
&rst
ixpk= 0, nxpk= 0, iat= 682, 699, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14, &end
#
# 48 HIE HN 50 HID HD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 682, 731, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 48 HIE HN 94 LEU QD2 5.52
&rst
ixpk= 0, nxpk= 0, iat= 682, -1, r1= 1.30, r2= 1.80, r3= 6.63, r4= 7.13,
igr2=1303,1304,1305,
&end
#
# 48 HIE HN 94 LEU QD2 5.52
&rst
ixpk= 0, nxpk= 0, iat= 682, -1, r1= 1.30, r2= 1.80, r3= 6.63, r4= 7.13,
igr2=1303,1304,1305,
&end
#
# 48 HIE HN 94 LEU QD2 5.52
&rst
ixpk= 0, nxpk= 0, iat= 682, -1, r1= 1.30, r2= 1.80, r3= 6.63, r4= 7.13,
igr2=1303,1304,1305,
&end
#
# 48 HIE HN 125 LEU QD2 5.91
&rst
ixpk= 0, nxpk= 0, iat= 682, -1, r1= 1.30, r2= 1.80, r3= 7.10, r4= 7.60,
igr2=1780,1781,1782,
&end
#
# 48 HIE HN 125 LEU QD2 5.91
&rst
ixpk= 0, nxpk= 0, iat= 682, -1, r1= 1.30, r2= 1.80, r3= 7.10, r4= 7.60,
igr2=1780,1781,1782,
&end
#
# 48 HIE HN 125 LEU QD2 5.91
&rst
ixpk= 0, nxpk= 0, iat= 682, -1, r1= 1.30, r2= 1.80, r3= 7.10, r4= 7.60,
igr2=1780,1781,1782,
&end
#
# 48 HIE HN 126 MET HN 4.49
&rst
ixpk= 0, nxpk= 0, iat= 682,1786, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99, &end
#
# 48 HIE HN 126 MET HN 4.49
&rst
ixpk= 0, nxpk= 0, iat= 682,1786, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99, &end
#
# 48 HIE HN 126 MET HN 4.49
&rst
ixpk= 0, nxpk= 0, iat= 682,1786, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99, &end
#
# 48 HIE HN 126 MET HB3 5.58
&rst
ixpk= 0, nxpk= 0, iat= 682,1791, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08, &end
#
# 48 HIE HN 126 MET HB3 5.58
&rst
ixpk= 0, nxpk= 0, iat= 682,1791, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08, &end
#
# 48 HIE HN 126 MET HB3 5.58
&rst
ixpk= 0, nxpk= 0, iat= 682,1791, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08, &end
#
# 48 HIE HN 127 ILE HA 4.95
&rst
ixpk= 0, nxpk= 0, iat= 682,1805, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45, &end
#
# 48 HIE HN 127 ILE HA 4.95
&rst
ixpk= 0, nxpk= 0, iat= 682,1805, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45, &end
#
# 48 HIE HN 127 ILE HA 4.95
&rst
ixpk= 0, nxpk= 0, iat= 682,1805, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45, &end
#
# 48 HIE HN 128 HID HN 5.75
&rst
ixpk= 0, nxpk= 0, iat= 682,1822, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25, &end
#
# 48 HIE HN 128 HID HN 5.75
&rst
ixpk= 0, nxpk= 0, iat= 682,1822, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25, &end
#
# 48 HIE HN 128 HID HN 5.75
&rst
ixpk= 0, nxpk= 0, iat= 682,1822, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25, &end
#
# 48 HIE HN 128 HID HB3 5.53
&rst
ixpk= 0, nxpk= 0, iat= 682,1827, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03, &end
#
# 48 HIE HA 49 ILE HN 2.97
&rst
ixpk= 0, nxpk= 0, iat= 684, 699, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 48 HIE HA 49 ILE HN 3.98
&rst
ixpk= 0, nxpk= 0, iat= 684, 699, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48, &end
#
# 48 HIE HA 49 ILE HA 5.17
&rst
ixpk= 0, nxpk= 0, iat= 684, 701, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67, &end
#
# 48 HIE HA 49 ILE HA 5.17
&rst
ixpk= 0, nxpk= 0, iat= 684, 701, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67, &end
#
# 48 HIE HA 49 ILE HA 5.17
&rst
ixpk= 0, nxpk= 0, iat= 684, 701, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67, &end
#
# 48 HIE HA 49 ILE HB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 684, 703, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 48 HIE HA 49 ILE HB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 684, 703, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 48 HIE HA 49 ILE HB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 684, 703, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 48 HIE HA 94 LEU HN 4.46
&rst
ixpk= 0, nxpk= 0, iat= 684,1290, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, &end
#
# 48 HIE HA 94 LEU HN 4.46
&rst
ixpk= 0, nxpk= 0, iat= 684,1290, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, &end
#
# 48 HIE HA 94 LEU HN 4.46
&rst
ixpk= 0, nxpk= 0, iat= 684,1290, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, &end
#
# 48 HIE HA 94 LEU HG 4.44
&rst
ixpk= 0, nxpk= 0, iat= 684,1297, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94, &end
#
# 48 HIE HA 94 LEU HG 4.44
&rst
ixpk= 0, nxpk= 0, iat= 684,1297, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94, &end
#
# 48 HIE HA 94 LEU HG 4.44
&rst
ixpk= 0, nxpk= 0, iat= 684,1297, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94, &end
#
# 48 HIE HA 94 LEU QD1 5.68
&rst
ixpk= 0, nxpk= 0, iat= 684, -1, r1= 1.30, r2= 1.80, r3= 6.82, r4= 7.32,
igr2=1299,1300,1301,
&end
#
# 48 HIE HA 94 LEU QD1 5.68
&rst
ixpk= 0, nxpk= 0, iat= 684, -1, r1= 1.30, r2= 1.80, r3= 6.82, r4= 7.32,
igr2=1299,1300,1301,
&end
#
# 48 HIE HA 94 LEU QD1 5.68
&rst
ixpk= 0, nxpk= 0, iat= 684, -1, r1= 1.30, r2= 1.80, r3= 6.82, r4= 7.32,
igr2=1299,1300,1301,
&end
#
# 48 HIE HA 94 LEU QD2 4.96
&rst
ixpk= 0, nxpk= 0, iat= 684, -1, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
igr2=1303,1304,1305,
&end
#
# 48 HIE HA 94 LEU QD2 4.96
&rst
ixpk= 0, nxpk= 0, iat= 684, -1, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
igr2=1303,1304,1305,
&end
#
# 48 HIE HA 94 LEU QD2 4.96
&rst
ixpk= 0, nxpk= 0, iat= 684, -1, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
igr2=1303,1304,1305,
&end
#
# 48 HIE HB2 93 ASM HA 5.20
&rst
ixpk= 0, nxpk= 0, iat= 686,1280, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70, &end
#
# 48 HIE HB2 93 ASM HA 5.20
&rst
ixpk= 0, nxpk= 0, iat= 686,1280, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70, &end
#
# 48 HIE HB2 93 ASM HA 5.20
&rst
ixpk= 0, nxpk= 0, iat= 686,1280, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70, &end
#
# 48 HIE HB3 49 ILE HN 4.98
&rst
ixpk= 0, nxpk= 0, iat= 687, 699, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48, &end
#
# 48 HIE HB3 49 ILE HB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 687, 703, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 48 HIE HB3 50 HID HD2 5.37
&rst
ixpk= 0, nxpk= 0, iat= 687, 731, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87, &end
#
# 48 HIE HB3 50 HID HD2 5.37
&rst
ixpk= 0, nxpk= 0, iat= 687, 731, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87, &end
#
# 48 HIE HB3 50 HID HD2 5.37
&rst
ixpk= 0, nxpk= 0, iat= 687, 731, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87, &end
#
# 48 HIE HD2 82 HIF HNE 6.05
&rst
ixpk= 0, nxpk= 0, iat= 695,1147, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 48 HIE HD2 82 HIF HNE 6.05
&rst
ixpk= 0, nxpk= 0, iat= 695,1147, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 48 HIE HD2 82 HIF HNE 6.05
&rst
ixpk= 0, nxpk= 0, iat= 695,1147, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 48 HIE HNE 82 HIF HE 4.40
&rst
ixpk= 0, nxpk= 0, iat= 693,1145, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 48 HIE HNE 82 HIF HE 4.40
&rst
ixpk= 0, nxpk= 0, iat= 693,1145, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 48 HIE HNE 82 HIF HE 4.40
&rst
ixpk= 0, nxpk= 0, iat= 693,1145, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 48 HIE HNE 82 HIF HNE 6.05
&rst
ixpk= 0, nxpk= 0, iat= 693,1147, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 48 HIE HNE 82 HIF HNE 6.05
&rst
ixpk= 0, nxpk= 0, iat= 693,1147, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 48 HIE HNE 82 HIF HNE 6.05
&rst
ixpk= 0, nxpk= 0, iat= 693,1147, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 49 ILE HN 49 ILE HB 4.20
&rst
ixpk= 0, nxpk= 0, iat= 699, 703, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 49 ILE HN 49 ILE HB 4.20
&rst
ixpk= 0, nxpk= 0, iat= 699, 703, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 49 ILE HN 49 ILE HB 4.20
&rst
ixpk= 0, nxpk= 0, iat= 699, 703, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 49 ILE HN 49 ILE HG12 5.31
&rst
ixpk= 0, nxpk= 0, iat= 699, 709, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81, &end
#
# 49 ILE HN 49 ILE HG12 5.31
&rst
ixpk= 0, nxpk= 0, iat= 699, 709, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81, &end
#
# 49 ILE HN 49 ILE HG12 5.31
&rst
ixpk= 0, nxpk= 0, iat= 699, 709, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81, &end
#
# 49 ILE HN 49 ILE HG13 5.73
&rst
ixpk= 0, nxpk= 0, iat= 699, 710, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23, &end
#
# 49 ILE HN 49 ILE HG13 5.73
&rst
ixpk= 0, nxpk= 0, iat= 699, 710, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23, &end
#
# 49 ILE HN 49 ILE HG13 5.73
&rst
ixpk= 0, nxpk= 0, iat= 699, 710, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23, &end
#
# 49 ILE HN 49 ILE QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 699, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 712, 713, 714,
&end
#
# 49 ILE HN 49 ILE QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 699, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 712, 713, 714,
&end
#
# 49 ILE HN 49 ILE QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 699, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 712, 713, 714,
&end
#
# 49 ILE HN 49 ILE QG2 4.83
&rst
ixpk= 0, nxpk= 0, iat= 699, -1, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
igr2= 705, 706, 707,
&end
#
# 49 ILE HN 49 ILE QG2 4.83
&rst
ixpk= 0, nxpk= 0, iat= 699, -1, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
igr2= 705, 706, 707,
&end
#
# 49 ILE HN 49 ILE QG2 4.83
&rst
ixpk= 0, nxpk= 0, iat= 699, -1, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
igr2= 705, 706, 707,
&end
#
# 49 ILE HN 50 HID HN 5.43
&rst
ixpk= 0, nxpk= 0, iat= 699, 718, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93, &end
#
# 49 ILE HN 50 HID HN 5.43
&rst
ixpk= 0, nxpk= 0, iat= 699, 718, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93, &end
#
# 49 ILE HN 50 HID HN 5.43
&rst
ixpk= 0, nxpk= 0, iat= 699, 718, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93, &end
#
# 49 ILE HN 92 GLY HN 6.00 (##)
&rst
ixpk= 0, nxpk= 0, iat= 699,1271, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 49 ILE HN 92 GLY HA2 4.90
&rst
ixpk= 0, nxpk= 0, iat= 699,1273, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40, &end
#
# 49 ILE HN 92 GLY HA2 4.90
&rst
ixpk= 0, nxpk= 0, iat= 699,1273, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40, &end
#
# 49 ILE HN 92 GLY HA2 4.90
&rst
ixpk= 0, nxpk= 0, iat= 699,1273, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40, &end
#
# 49 ILE HN 92 GLY HA3 4.96
&rst
ixpk= 0, nxpk= 0, iat= 699,1274, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46, &end
#
# 49 ILE HN 92 GLY HA3 4.96
&rst
ixpk= 0, nxpk= 0, iat= 699,1274, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46, &end
#
# 49 ILE HN 92 GLY HA3 4.96
&rst
ixpk= 0, nxpk= 0, iat= 699,1274, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46, &end
#
# 49 ILE HN 94 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 699,1290, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 49 ILE HN 94 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 699,1290, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 49 ILE HN 94 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 699,1290, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 49 ILE HN 94 LEU HG 5.41
&rst
ixpk= 0, nxpk= 0, iat= 699,1297, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91, &end
#
# 49 ILE HN 94 LEU HG 5.41
&rst
ixpk= 0, nxpk= 0, iat= 699,1297, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91, &end
#
# 49 ILE HN 94 LEU HG 5.41
&rst
ixpk= 0, nxpk= 0, iat= 699,1297, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91, &end
#
# 49 ILE HN 94 LEU QD1 5.60
&rst
ixpk= 0, nxpk= 0, iat= 699, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=1299,1300,1301,
&end
#
# 49 ILE HN 94 LEU QD1 5.60
&rst
ixpk= 0, nxpk= 0, iat= 699, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=1299,1300,1301,
&end
#
# 49 ILE HN 94 LEU QD1 5.60
&rst
ixpk= 0, nxpk= 0, iat= 699, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=1299,1300,1301,
&end
#
# 49 ILE HN 94 LEU QD2 5.29
&rst
ixpk= 0, nxpk= 0, iat= 699, -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
igr2=1303,1304,1305,
&end
#
# 49 ILE HN 94 LEU QD2 5.29
&rst
ixpk= 0, nxpk= 0, iat= 699, -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
igr2=1303,1304,1305,
&end
#
# 49 ILE HN 94 LEU QD2 5.29
&rst
ixpk= 0, nxpk= 0, iat= 699, -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
igr2=1303,1304,1305,
&end
#
# 49 ILE HN 125 LEU QD2 5.93
&rst
ixpk= 0, nxpk= 0, iat= 699, -1, r1= 1.30, r2= 1.80, r3= 7.12, r4= 7.62,
igr2=1780,1781,1782,
&end
#
# 49 ILE HN 125 LEU QD2 5.93
&rst
ixpk= 0, nxpk= 0, iat= 699, -1, r1= 1.30, r2= 1.80, r3= 7.12, r4= 7.62,
igr2=1780,1781,1782,
&end
#
# 49 ILE HN 125 LEU QD2 5.93
&rst
ixpk= 0, nxpk= 0, iat= 699, -1, r1= 1.30, r2= 1.80, r3= 7.12, r4= 7.62,
igr2=1780,1781,1782,
&end
#
# 49 ILE HA 49 ILE HB 5.20
&rst
ixpk= 0, nxpk= 0, iat= 701, 703, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70, &end
#
# 49 ILE HA 49 ILE HG12 5.29
&rst
ixpk= 0, nxpk= 0, iat= 701, 709, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79, &end
#
# 49 ILE HA 49 ILE HG13 5.32
&rst
ixpk= 0, nxpk= 0, iat= 701, 710, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82, &end
#
# 49 ILE HA 49 ILE QG2 4.49
&rst
ixpk= 0, nxpk= 0, iat= 701, -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr2= 705, 706, 707,
&end
#
# 49 ILE HA 49 ILE QG2 4.49
&rst
ixpk= 0, nxpk= 0, iat= 701, -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr2= 705, 706, 707,
&end
#
# 49 ILE HA 49 ILE QG2 4.49
&rst
ixpk= 0, nxpk= 0, iat= 701, -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr2= 705, 706, 707,
&end
#
# 49 ILE HA 50 HID HN 3.60
&rst
ixpk= 0, nxpk= 0, iat= 701, 718, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10, &end
#
# 49 ILE HA 50 HID HN 3.60
&rst
ixpk= 0, nxpk= 0, iat= 701, 718, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10, &end
#
# 49 ILE HA 50 HID HN 3.60
&rst
ixpk= 0, nxpk= 0, iat= 701, 718, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10, &end
#
# 49 ILE HA 74 LEU HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 701,1022, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 49 ILE HA 74 LEU HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 701,1022, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 49 ILE HA 74 LEU HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 701,1022, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 49 ILE HA 94 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 701, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1303,1304,1305,
&end
#
# 49 ILE HA 94 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 701, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1303,1304,1305,
&end
#
# 49 ILE HA 94 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 701, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1303,1304,1305,
&end
#
# 49 ILE HA 124 ALA HN 5.75
&rst
ixpk= 0, nxpk= 0, iat= 701,1757, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25, &end
#
# 49 ILE HA 124 ALA HN 5.75
&rst
ixpk= 0, nxpk= 0, iat= 701,1757, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25, &end
#
# 49 ILE HA 124 ALA HN 5.75
&rst
ixpk= 0, nxpk= 0, iat= 701,1757, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25, &end
#
# 49 ILE HA 125 LEU QD2 4.98
&rst
ixpk= 0, nxpk= 0, iat= 701, -1, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
igr2=1780,1781,1782,
&end
#
# 49 ILE HA 125 LEU QD2 4.98
&rst
ixpk= 0, nxpk= 0, iat= 701, -1, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
igr2=1780,1781,1782,
&end
#
# 49 ILE HA 125 LEU QD2 4.98
&rst
ixpk= 0, nxpk= 0, iat= 701, -1, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
igr2=1780,1781,1782,
&end
#
# 49 ILE HA 126 MET HN 4.92
&rst
ixpk= 0, nxpk= 0, iat= 701,1786, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42, &end
#
# 49 ILE HA 126 MET HN 4.92
&rst
ixpk= 0, nxpk= 0, iat= 701,1786, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42, &end
#
# 49 ILE HA 126 MET HN 4.92
&rst
ixpk= 0, nxpk= 0, iat= 701,1786, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42, &end
#
# 49 ILE HA 153 ILE QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 701, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=2164,2165,2166,
&end
#
# 49 ILE HA 153 ILE QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 701, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=2164,2165,2166,
&end
#
# 49 ILE HA 153 ILE QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 701, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=2164,2165,2166,
&end
#
# 49 ILE HB 49 ILE QG2 4.26
&rst
ixpk= 0, nxpk= 0, iat= 703, -1, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62,
igr2= 705, 706, 707,
&end
#
# 49 ILE HB 50 HID HN 5.47
&rst
ixpk= 0, nxpk= 0, iat= 703, 718, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97, &end
#
# 49 ILE HB 50 HID HN 5.47
&rst
ixpk= 0, nxpk= 0, iat= 703, 718, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97, &end
#
# 49 ILE HB 50 HID HN 5.47
&rst
ixpk= 0, nxpk= 0, iat= 703, 718, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97, &end
#
# 49 ILE HB 74 LEU HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 703,1022, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 49 ILE HB 74 LEU HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 703,1022, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 49 ILE HB 74 LEU HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 703,1022, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 49 ILE HB 92 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 703,1271, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 49 ILE HB 92 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 703,1271, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 49 ILE HB 92 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 703,1271, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 49 ILE HB 92 GLY HA2 4.11
&rst
ixpk= 0, nxpk= 0, iat= 703,1273, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 49 ILE HB 92 GLY HA2 4.11
&rst
ixpk= 0, nxpk= 0, iat= 703,1273, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 49 ILE HB 92 GLY HA2 4.11
&rst
ixpk= 0, nxpk= 0, iat= 703,1273, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 49 ILE HB 92 GLY HA3 4.91
&rst
ixpk= 0, nxpk= 0, iat= 703,1274, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41, &end
#
# 49 ILE HB 92 GLY HA3 4.91
&rst
ixpk= 0, nxpk= 0, iat= 703,1274, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41, &end
#
# 49 ILE HB 92 GLY HA3 4.91
&rst
ixpk= 0, nxpk= 0, iat= 703,1274, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41, &end
#
# 49 ILE HB 94 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 703, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1303,1304,1305,
&end
#
# 49 ILE HB 94 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 703, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1303,1304,1305,
&end
#
# 49 ILE HB 94 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 703, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1303,1304,1305,
&end
#
# 49 ILE HG12 50 HID HN 5.68
&rst
ixpk= 0, nxpk= 0, iat= 709, 718, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18, &end
#
# 49 ILE HG12 50 HID HN 5.68
&rst
ixpk= 0, nxpk= 0, iat= 709, 718, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18, &end
#
# 49 ILE HG12 50 HID HN 5.68
&rst
ixpk= 0, nxpk= 0, iat= 709, 718, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18, &end
#
# 49 ILE HG12 94 LEU QD2 4.67
&rst
ixpk= 0, nxpk= 0, iat= 709, -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr2=1303,1304,1305,
&end
#
# 49 ILE HG12 94 LEU QD2 4.67
&rst
ixpk= 0, nxpk= 0, iat= 709, -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr2=1303,1304,1305,
&end
#
# 49 ILE HG12 94 LEU QD2 4.67
&rst
ixpk= 0, nxpk= 0, iat= 709, -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr2=1303,1304,1305,
&end
#
# 49 ILE HG13 49 ILE HG12 4.04
&rst
ixpk= 0, nxpk= 0, iat= 710, 709, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, &end
#
# 49 ILE HG13 92 GLY HA2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 710,1273, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 49 ILE HG13 92 GLY HA2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 710,1273, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 49 ILE HG13 92 GLY HA2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 710,1273, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 49 ILE HG13 94 LEU QD2 4.73
&rst
ixpk= 0, nxpk= 0, iat= 710, -1, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
igr2=1303,1304,1305,
&end
#
# 49 ILE HG13 94 LEU QD2 4.73
&rst
ixpk= 0, nxpk= 0, iat= 710, -1, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
igr2=1303,1304,1305,
&end
#
# 49 ILE HG13 94 LEU QD2 4.73
&rst
ixpk= 0, nxpk= 0, iat= 710, -1, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
igr2=1303,1304,1305,
&end
#
# 49 ILE HG13 125 LEU QD2 3.65
&rst
ixpk= 0, nxpk= 0, iat= 710, -1, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
igr2=1780,1781,1782,
&end
#
# 49 ILE HG13 125 LEU QD2 3.65
&rst
ixpk= 0, nxpk= 0, iat= 710, -1, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
igr2=1780,1781,1782,
&end
#
# 49 ILE HG13 125 LEU QD2 3.65
&rst
ixpk= 0, nxpk= 0, iat= 710, -1, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
igr2=1780,1781,1782,
&end
#
# 49 ILE QD1 49 ILE HG12 4.21
&rst
ixpk= 0, nxpk= 0, iat= -1, 709, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
igr1= 712, 713, 714,
&end
#
# 49 ILE QD1 50 HID HN 5.80
&rst
ixpk= 0, nxpk= 0, iat= -1, 718, r1= 1.30, r2= 1.80, r3= 6.97, r4= 7.47,
igr1= 712, 713, 714,
&end
#
# 49 ILE QD1 50 HID HN 5.80
&rst
ixpk= 0, nxpk= 0, iat= -1, 718, r1= 1.30, r2= 1.80, r3= 6.97, r4= 7.47,
igr1= 712, 713, 714,
&end
#
# 49 ILE QD1 50 HID HN 5.80
&rst
ixpk= 0, nxpk= 0, iat= -1, 718, r1= 1.30, r2= 1.80, r3= 6.97, r4= 7.47,
igr1= 712, 713, 714,
&end
#
# 49 ILE QD1 92 GLY HA2 5.68
&rst
ixpk= 0, nxpk= 0, iat= -1,1273, r1= 1.30, r2= 1.80, r3= 6.82, r4= 7.32,
igr1= 712, 713, 714,
&end
#
# 49 ILE QD1 92 GLY HA2 5.68
&rst
ixpk= 0, nxpk= 0, iat= -1,1273, r1= 1.30, r2= 1.80, r3= 6.82, r4= 7.32,
igr1= 712, 713, 714,
&end
#
# 49 ILE QD1 92 GLY HA2 5.68
&rst
ixpk= 0, nxpk= 0, iat= -1,1273, r1= 1.30, r2= 1.80, r3= 6.82, r4= 7.32,
igr1= 712, 713, 714,
&end
#
# 49 ILE QD1 94 LEU QD1 4.48
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.46, r4= 6.96,
igr1= 712, 713, 714,
igr2=1299,1300,1301,
&end
#
# 49 ILE QD1 94 LEU QD1 4.48
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.46, r4= 6.96,
igr1= 712, 713, 714,
igr2=1299,1300,1301,
&end
#
# 49 ILE QD1 94 LEU QD1 4.48
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.46, r4= 6.96,
igr1= 712, 713, 714,
igr2=1299,1300,1301,
&end
#
# 49 ILE QD1 94 LEU QD2 4.25
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.13, r4= 6.63,
igr1= 712, 713, 714,
igr2=1303,1304,1305,
&end
#
# 49 ILE QD1 94 LEU QD2 4.25
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.13, r4= 6.63,
igr1= 712, 713, 714,
igr2=1303,1304,1305,
&end
#
# 49 ILE QD1 94 LEU QD2 4.25
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.13, r4= 6.63,
igr1= 712, 713, 714,
igr2=1303,1304,1305,
&end
#
# 49 ILE QD1 114 LEU QD2 3.38
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,
igr1= 712, 713, 714,
igr2=1600,1601,1602,
&end
#
# 49 ILE QD1 114 LEU QD2 3.38
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,
igr1= 712, 713, 714,
igr2=1600,1601,1602,
&end
#
# 49 ILE QD1 114 LEU QD2 3.38
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,
igr1= 712, 713, 714,
igr2=1600,1601,1602,
&end
#
# 49 ILE QD1 120 VAL HB 4.66
&rst
ixpk= 0, nxpk= 0, iat= -1,1689, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
igr1= 712, 713, 714,
&end
#
# 49 ILE QD1 120 VAL HB 4.66
&rst
ixpk= 0, nxpk= 0, iat= -1,1689, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
igr1= 712, 713, 714,
&end
#
# 49 ILE QD1 120 VAL HB 4.66
&rst
ixpk= 0, nxpk= 0, iat= -1,1689, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
igr1= 712, 713, 714,
&end
#
# 49 ILE QD1 120 VAL QG1 3.41
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
igr1= 712, 713, 714,
igr2=1691,1692,1693,
&end
#
# 49 ILE QD1 120 VAL QG1 3.41
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
igr1= 712, 713, 714,
igr2=1691,1692,1693,
&end
#
# 49 ILE QD1 120 VAL QG1 3.41
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
igr1= 712, 713, 714,
igr2=1691,1692,1693,
&end
#
# 49 ILE QD1 123 LYS HB2 5.83
&rst
ixpk= 0, nxpk= 0, iat= -1,1739, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,
igr1= 712, 713, 714,
&end
#
# 49 ILE QD1 123 LYS HB2 5.83
&rst
ixpk= 0, nxpk= 0, iat= -1,1739, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,
igr1= 712, 713, 714,
&end
#
# 49 ILE QD1 123 LYS HB2 5.83
&rst
ixpk= 0, nxpk= 0, iat= -1,1739, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,
igr1= 712, 713, 714,
&end
#
# 49 ILE QD1 125 LEU QD2 4.03
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
igr1= 712, 713, 714,
igr2=1780,1781,1782,
&end
#
# 49 ILE QD1 125 LEU QD2 4.03
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
igr1= 712, 713, 714,
igr2=1780,1781,1782,
&end
#
# 49 ILE QD1 125 LEU QD2 4.03
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
igr1= 712, 713, 714,
igr2=1780,1781,1782,
&end
#
# 49 ILE QG2 49 ILE QD1 3.81
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
igr1= 705, 706, 707,
igr2= 712, 713, 714,
&end
#
# 49 ILE QG2 49 ILE QD1 3.81
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
igr1= 705, 706, 707,
igr2= 712, 713, 714,
&end
#
# 49 ILE QG2 49 ILE QD1 3.81
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
igr1= 705, 706, 707,
igr2= 712, 713, 714,
&end
#
# 49 ILE QG2 50 HID HN 4.24
&rst
ixpk= 0, nxpk= 0, iat= -1, 718, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
igr1= 705, 706, 707,
&end
#
# 49 ILE QG2 50 HID HN 4.24
&rst
ixpk= 0, nxpk= 0, iat= -1, 718, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
igr1= 705, 706, 707,
&end
#
# 49 ILE QG2 50 HID HN 4.24
&rst
ixpk= 0, nxpk= 0, iat= -1, 718, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
igr1= 705, 706, 707,
&end
#
# 49 ILE QG2 51 ALA HN 4.96
&rst
ixpk= 0, nxpk= 0, iat= -1, 735, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
igr1= 705, 706, 707,
&end
#
# 49 ILE QG2 51 ALA HN 4.96
&rst
ixpk= 0, nxpk= 0, iat= -1, 735, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
igr1= 705, 706, 707,
&end
#
# 49 ILE QG2 51 ALA HN 4.96
&rst
ixpk= 0, nxpk= 0, iat= -1, 735, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
igr1= 705, 706, 707,
&end
#
# 49 ILE QG2 74 LEU HB3 4.69
&rst
ixpk= 0, nxpk= 0, iat= -1,1022, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr1= 705, 706, 707,
&end
#
# 49 ILE QG2 74 LEU HB3 4.69
&rst
ixpk= 0, nxpk= 0, iat= -1,1022, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr1= 705, 706, 707,
&end
#
# 49 ILE QG2 74 LEU HB3 4.69
&rst
ixpk= 0, nxpk= 0, iat= -1,1022, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr1= 705, 706, 707,
&end
#
# 49 ILE QG2 74 LEU QD1 4.07
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,
igr1= 705, 706, 707,
igr2=1026,1027,1028,
&end
#
# 49 ILE QG2 74 LEU QD1 4.07
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,
igr1= 705, 706, 707,
igr2=1026,1027,1028,
&end
#
# 49 ILE QG2 74 LEU QD1 4.07
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,
igr1= 705, 706, 707,
igr2=1026,1027,1028,
&end
#
# 49 ILE QG2 74 LEU QD2 3.40
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,
igr1= 705, 706, 707,
igr2=1030,1031,1032,
&end
#
# 49 ILE QG2 74 LEU QD2 3.40
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,
igr1= 705, 706, 707,
igr2=1030,1031,1032,
&end
#
# 49 ILE QG2 74 LEU QD2 3.40
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,
igr1= 705, 706, 707,
igr2=1030,1031,1032,
&end
#
# 49 ILE QG2 92 GLY HA2 5.53
&rst
ixpk= 0, nxpk= 0, iat= -1,1273, r1= 1.30, r2= 1.80, r3= 6.64, r4= 7.14,
igr1= 705, 706, 707,
&end
#
# 49 ILE QG2 92 GLY HA2 5.53
&rst
ixpk= 0, nxpk= 0, iat= -1,1273, r1= 1.30, r2= 1.80, r3= 6.64, r4= 7.14,
igr1= 705, 706, 707,
&end
#
# 49 ILE QG2 92 GLY HA2 5.53
&rst
ixpk= 0, nxpk= 0, iat= -1,1273, r1= 1.30, r2= 1.80, r3= 6.64, r4= 7.14,
igr1= 705, 706, 707,
&end
#
# 49 ILE QG2 92 GLY HA3 5.41
&rst
ixpk= 0, nxpk= 0, iat= -1,1274, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
igr1= 705, 706, 707,
&end
#
# 49 ILE QG2 92 GLY HA3 5.41
&rst
ixpk= 0, nxpk= 0, iat= -1,1274, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
igr1= 705, 706, 707,
&end
#
# 49 ILE QG2 92 GLY HA3 5.41
&rst
ixpk= 0, nxpk= 0, iat= -1,1274, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
igr1= 705, 706, 707,
&end
#
# 49 ILE QG2 94 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
igr1= 705, 706, 707,
igr2=1303,1304,1305,
&end
#
# 49 ILE QG2 94 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
igr1= 705, 706, 707,
igr2=1303,1304,1305,
&end
#
# 49 ILE QG2 94 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
igr1= 705, 706, 707,
igr2=1303,1304,1305,
&end
#
# 49 ILE QG2 120 VAL HB 5.17
&rst
ixpk= 0, nxpk= 0, iat= -1,1689, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,
igr1= 705, 706, 707,
&end
#
# 49 ILE QG2 120 VAL HB 5.17
&rst
ixpk= 0, nxpk= 0, iat= -1,1689, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,
igr1= 705, 706, 707,
&end
#
# 49 ILE QG2 120 VAL HB 5.17
&rst
ixpk= 0, nxpk= 0, iat= -1,1689, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,
igr1= 705, 706, 707,
&end
#
# 49 ILE QG2 123 LYS HB2 4.47
&rst
ixpk= 0, nxpk= 0, iat= -1,1739, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr1= 705, 706, 707,
&end
#
# 49 ILE QG2 123 LYS HB2 4.47
&rst
ixpk= 0, nxpk= 0, iat= -1,1739, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr1= 705, 706, 707,
&end
#
# 49 ILE QG2 123 LYS HB2 4.47
&rst
ixpk= 0, nxpk= 0, iat= -1,1739, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr1= 705, 706, 707,
&end
#
# 49 ILE QG2 124 ALA HN 4.74
&rst
ixpk= 0, nxpk= 0, iat= -1,1757, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
igr1= 705, 706, 707,
&end
#
# 49 ILE QG2 124 ALA HN 4.74
&rst
ixpk= 0, nxpk= 0, iat= -1,1757, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
igr1= 705, 706, 707,
&end
#
# 49 ILE QG2 124 ALA HN 4.74
&rst
ixpk= 0, nxpk= 0, iat= -1,1757, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
igr1= 705, 706, 707,
&end
#
# 49 ILE QG2 125 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1767, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 705, 706, 707,
&end
#
# 49 ILE QG2 125 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1767, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 705, 706, 707,
&end
#
# 49 ILE QG2 125 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1767, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 705, 706, 707,
&end
#
# 49 ILE QG2 153 ILE QD1 3.62
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
igr1= 705, 706, 707,
igr2=2164,2165,2166,
&end
#
# 49 ILE QG2 153 ILE QD1 3.62
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
igr1= 705, 706, 707,
igr2=2164,2165,2166,
&end
#
# 49 ILE QG2 153 ILE QD1 3.62
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
igr1= 705, 706, 707,
igr2=2164,2165,2166,
&end
#
# 50 HID HN 51 ALA HN 5.09
&rst
ixpk= 0, nxpk= 0, iat= 718, 735, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59, &end
#
# 50 HID HN 51 ALA HN 5.09
&rst
ixpk= 0, nxpk= 0, iat= 718, 735, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59, &end
#
# 50 HID HN 51 ALA HN 5.09
&rst
ixpk= 0, nxpk= 0, iat= 718, 735, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59, &end
#
# 50 HID HN 73 HIC HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 718,1002, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 50 HID HN 73 HIC HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 718,1002, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 50 HID HN 73 HIC HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 718,1002, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 50 HID HN 74 LEU HB3 6.04
&rst
ixpk= 0, nxpk= 0, iat= 718,1022, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54, &end
#
# 50 HID HN 74 LEU HB3 6.04
&rst
ixpk= 0, nxpk= 0, iat= 718,1022, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54, &end
#
# 50 HID HN 74 LEU HB3 6.04
&rst
ixpk= 0, nxpk= 0, iat= 718,1022, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54, &end
#
# 50 HID HN 123 LYS HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 718,1737, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 50 HID HN 123 LYS HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 718,1737, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 50 HID HN 123 LYS HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 718,1737, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 50 HID HN 123 LYS HB2 5.83
&rst
ixpk= 0, nxpk= 0, iat= 718,1739, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33, &end
#
# 50 HID HN 123 LYS HB2 5.83
&rst
ixpk= 0, nxpk= 0, iat= 718,1739, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33, &end
#
# 50 HID HN 123 LYS HB2 5.83
&rst
ixpk= 0, nxpk= 0, iat= 718,1739, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33, &end
#
# 50 HID HN 123 LYS HB3 5.81
&rst
ixpk= 0, nxpk= 0, iat= 718,1740, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31, &end
#
# 50 HID HN 123 LYS HB3 5.81
&rst
ixpk= 0, nxpk= 0, iat= 718,1740, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31, &end
#
# 50 HID HN 123 LYS HB3 5.81
&rst
ixpk= 0, nxpk= 0, iat= 718,1740, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31, &end
#
# 50 HID HN 123 LYS HE2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 718,1748, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 50 HID HN 123 LYS HE2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 718,1748, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 50 HID HN 123 LYS HE2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 718,1748, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 50 HID HN 123 LYS QD 5.35
&rst
ixpk= 0, nxpk= 0, iat= 718, -1, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51,
igr2=1745,1746,
&end
#
# 50 HID HN 123 LYS QD 5.35
&rst
ixpk= 0, nxpk= 0, iat= 718, -1, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51,
igr2=1745,1746,
&end
#
# 50 HID HN 123 LYS QD 5.35
&rst
ixpk= 0, nxpk= 0, iat= 718, -1, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51,
igr2=1745,1746,
&end
#
# 50 HID HN 124 ALA HN 4.70
&rst
ixpk= 0, nxpk= 0, iat= 718,1757, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 50 HID HN 124 ALA HN 4.70
&rst
ixpk= 0, nxpk= 0, iat= 718,1757, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 50 HID HN 124 ALA HN 4.70
&rst
ixpk= 0, nxpk= 0, iat= 718,1757, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 50 HID HN 124 ALA QB 4.78
&rst
ixpk= 0, nxpk= 0, iat= 718, -1, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
igr2=1761,1762,1763,
&end
#
# 50 HID HN 124 ALA QB 4.78
&rst
ixpk= 0, nxpk= 0, iat= 718, -1, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
igr2=1761,1762,1763,
&end
#
# 50 HID HN 124 ALA QB 4.78
&rst
ixpk= 0, nxpk= 0, iat= 718, -1, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
igr2=1761,1762,1763,
&end
#
# 50 HID HN 125 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 718,1767, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 50 HID HN 125 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 718,1767, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 50 HID HN 125 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 718,1767, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 50 HID HN 125 LEU HA 5.41
&rst
ixpk= 0, nxpk= 0, iat= 718,1769, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91, &end
#
# 50 HID HN 125 LEU HA 5.41
&rst
ixpk= 0, nxpk= 0, iat= 718,1769, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91, &end
#
# 50 HID HN 125 LEU HA 5.41
&rst
ixpk= 0, nxpk= 0, iat= 718,1769, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91, &end
#
# 50 HID HN 125 LEU QD2 5.93
&rst
ixpk= 0, nxpk= 0, iat= 718, -1, r1= 1.30, r2= 1.80, r3= 7.12, r4= 7.62,
igr2=1780,1781,1782,
&end
#
# 50 HID HN 125 LEU QD2 5.93
&rst
ixpk= 0, nxpk= 0, iat= 718, -1, r1= 1.30, r2= 1.80, r3= 7.12, r4= 7.62,
igr2=1780,1781,1782,
&end
#
# 50 HID HN 125 LEU QD2 5.93
&rst
ixpk= 0, nxpk= 0, iat= 718, -1, r1= 1.30, r2= 1.80, r3= 7.12, r4= 7.62,
igr2=1780,1781,1782,
&end
#
# 50 HID HN 126 MET HN 5.27
&rst
ixpk= 0, nxpk= 0, iat= 718,1786, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77, &end
#
# 50 HID HN 126 MET HN 5.27
&rst
ixpk= 0, nxpk= 0, iat= 718,1786, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77, &end
#
# 50 HID HN 126 MET HN 5.27
&rst
ixpk= 0, nxpk= 0, iat= 718,1786, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77, &end
#
# 50 HID HN 126 MET QE 5.73
&rst
ixpk= 0, nxpk= 0, iat= 718, -1, r1= 1.30, r2= 1.80, r3= 6.88, r4= 7.38,
igr2=1797,1798,1799,
&end
#
# 50 HID HN 126 MET QE 5.73
&rst
ixpk= 0, nxpk= 0, iat= 718, -1, r1= 1.30, r2= 1.80, r3= 6.88, r4= 7.38,
igr2=1797,1798,1799,
&end
#
# 50 HID HN 126 MET QE 5.73
&rst
ixpk= 0, nxpk= 0, iat= 718, -1, r1= 1.30, r2= 1.80, r3= 6.88, r4= 7.38,
igr2=1797,1798,1799,
&end
#
# 50 HID HA 51 ALA HN 3.76
&rst
ixpk= 0, nxpk= 0, iat= 720, 735, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26, &end
#
# 50 HID HA 51 ALA HN 3.76
&rst
ixpk= 0, nxpk= 0, iat= 720, 735, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26, &end
#
# 50 HID HA 51 ALA HN 3.76
&rst
ixpk= 0, nxpk= 0, iat= 720, 735, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26, &end
#
# 50 HID HA 51 ALA HA 5.54
&rst
ixpk= 0, nxpk= 0, iat= 720, 737, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04, &end
#
# 50 HID HA 51 ALA HA 5.54
&rst
ixpk= 0, nxpk= 0, iat= 720, 737, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04, &end
#
# 50 HID HA 51 ALA HA 5.54
&rst
ixpk= 0, nxpk= 0, iat= 720, 737, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04, &end
#
# 50 HID HA 51 ALA QB 5.52
&rst
ixpk= 0, nxpk= 0, iat= 720, -1, r1= 1.30, r2= 1.80, r3= 6.63, r4= 7.13,
igr2= 739, 740, 741,
&end
#
# 50 HID HA 51 ALA QB 5.52
&rst
ixpk= 0, nxpk= 0, iat= 720, -1, r1= 1.30, r2= 1.80, r3= 6.63, r4= 7.13,
igr2= 739, 740, 741,
&end
#
# 50 HID HA 51 ALA QB 5.52
&rst
ixpk= 0, nxpk= 0, iat= 720, -1, r1= 1.30, r2= 1.80, r3= 6.63, r4= 7.13,
igr2= 739, 740, 741,
&end
#
# 50 HID HA 52 ASN HN 5.53
&rst
ixpk= 0, nxpk= 0, iat= 720, 745, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03, &end
#
# 50 HID HA 52 ASN HN 5.53
&rst
ixpk= 0, nxpk= 0, iat= 720, 745, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03, &end
#
# 50 HID HA 73 HIC HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 720,1005, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 50 HID HA 73 HIC HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 720,1005, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 50 HID HA 73 HIC HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 720,1005, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 50 HID HA 74 LEU HN 4.87
&rst
ixpk= 0, nxpk= 0, iat= 720,1017, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37, &end
#
# 50 HID HA 74 LEU HN 4.87
&rst
ixpk= 0, nxpk= 0, iat= 720,1017, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37, &end
#
# 50 HID HA 74 LEU HN 4.87
&rst
ixpk= 0, nxpk= 0, iat= 720,1017, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37, &end
#
# 50 HID HA 74 LEU HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 720,1022, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 50 HID HE1 73 HIC HD2 4.61
&rst
ixpk= 0, nxpk= 0, iat= 728,1013, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 50 HID HE1 73 HIC HD2 4.61
&rst
ixpk= 0, nxpk= 0, iat= 728,1013, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 50 HID HE1 73 HIC HD2 4.61
&rst
ixpk= 0, nxpk= 0, iat= 728,1013, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 51 ALA HN 51 ALA HA 3.89
&rst
ixpk= 0, nxpk= 0, iat= 735, 737, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39, &end
#
# 51 ALA HN 51 ALA QB 3.40
&rst
ixpk= 0, nxpk= 0, iat= 735, -1, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,
igr2= 739, 740, 741,
&end
#
# 51 ALA HN 51 ALA QB 3.40
&rst
ixpk= 0, nxpk= 0, iat= 735, -1, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,
igr2= 739, 740, 741,
&end
#
# 51 ALA HN 51 ALA QB 3.40
&rst
ixpk= 0, nxpk= 0, iat= 735, -1, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58,
igr2= 739, 740, 741,
&end
#
# 51 ALA HN 52 ASN HN 3.95
&rst
ixpk= 0, nxpk= 0, iat= 735, 745, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45, &end
#
# 51 ALA HN 52 ASN HN 3.95
&rst
ixpk= 0, nxpk= 0, iat= 735, 745, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45, &end
#
# 51 ALA HN 52 ASN HN 3.95
&rst
ixpk= 0, nxpk= 0, iat= 735, 745, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45, &end
#
# 51 ALA HN 52 ASN HN 5.28
&rst
ixpk= 0, nxpk= 0, iat= 735, 745, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 51 ALA HN 52 ASN HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 735, 747, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 51 ALA HN 52 ASN HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 735, 747, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 51 ALA HN 52 ASN HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 735, 747, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 51 ALA HN 52 ASN HD21 6.03
&rst
ixpk= 0, nxpk= 0, iat= 735, 754, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53, &end
#
# 51 ALA HN 52 ASN HD21 6.03
&rst
ixpk= 0, nxpk= 0, iat= 735, 754, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53, &end
#
# 51 ALA HN 52 ASN HD21 6.03
&rst
ixpk= 0, nxpk= 0, iat= 735, 754, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53, &end
#
# 51 ALA HN 70 ALA HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 735, 978, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 51 ALA HN 70 ALA HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 735, 978, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 51 ALA HN 70 ALA HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 735, 978, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 51 ALA HN 70 ALA QB 5.19
&rst
ixpk= 0, nxpk= 0, iat= 735, -1, r1= 1.30, r2= 1.80, r3= 6.23, r4= 6.73,
igr2= 980, 981, 982,
&end
#
# 51 ALA HN 70 ALA QB 5.19
&rst
ixpk= 0, nxpk= 0, iat= 735, -1, r1= 1.30, r2= 1.80, r3= 6.23, r4= 6.73,
igr2= 980, 981, 982,
&end
#
# 51 ALA HN 70 ALA QB 5.19
&rst
ixpk= 0, nxpk= 0, iat= 735, -1, r1= 1.30, r2= 1.80, r3= 6.23, r4= 6.73,
igr2= 980, 981, 982,
&end
#
# 51 ALA HN 71 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 735, 986, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 51 ALA HN 71 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 735, 986, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 51 ALA HN 71 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 735, 986, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 51 ALA HN 72 GLY HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 735, 993, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 51 ALA HN 72 GLY HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 735, 993, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 51 ALA HN 72 GLY HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= 735, 993, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 51 ALA HN 74 LEU HN 4.85
&rst
ixpk= 0, nxpk= 0, iat= 735,1017, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35, &end
#
# 51 ALA HN 74 LEU HN 4.85
&rst
ixpk= 0, nxpk= 0, iat= 735,1017, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35, &end
#
# 51 ALA HN 74 LEU HN 4.85
&rst
ixpk= 0, nxpk= 0, iat= 735,1017, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35, &end
#
# 51 ALA HN 74 LEU HA 5.93
&rst
ixpk= 0, nxpk= 0, iat= 735,1019, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43, &end
#
# 51 ALA HN 74 LEU HA 5.93
&rst
ixpk= 0, nxpk= 0, iat= 735,1019, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43, &end
#
# 51 ALA HN 74 LEU HA 5.93
&rst
ixpk= 0, nxpk= 0, iat= 735,1019, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43, &end
#
# 51 ALA HN 74 LEU QD2 5.70
&rst
ixpk= 0, nxpk= 0, iat= 735, -1, r1= 1.30, r2= 1.80, r3= 6.85, r4= 7.35,
igr2=1030,1031,1032,
&end
#
# 51 ALA HN 74 LEU QD2 5.70
&rst
ixpk= 0, nxpk= 0, iat= 735, -1, r1= 1.30, r2= 1.80, r3= 6.85, r4= 7.35,
igr2=1030,1031,1032,
&end
#
# 51 ALA HN 74 LEU QD2 5.70
&rst
ixpk= 0, nxpk= 0, iat= 735, -1, r1= 1.30, r2= 1.80, r3= 6.85, r4= 7.35,
igr2=1030,1031,1032,
&end
#
# 51 ALA HN 75 ASP HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 735,1036, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 51 ALA HN 75 ASP HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 735,1036, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 51 ALA HN 75 ASP HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 735,1036, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 51 ALA HN 124 ALA HN 5.70
&rst
ixpk= 0, nxpk= 0, iat= 735,1757, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20, &end
#
# 51 ALA HN 124 ALA HN 5.70
&rst
ixpk= 0, nxpk= 0, iat= 735,1757, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20, &end
#
# 51 ALA HN 124 ALA HN 5.70
&rst
ixpk= 0, nxpk= 0, iat= 735,1757, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20, &end
#
# 51 ALA HN 124 ALA QB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 735, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1761,1762,1763,
&end
#
# 51 ALA HN 124 ALA QB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 735, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1761,1762,1763,
&end
#
# 51 ALA HN 124 ALA QB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 735, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1761,1762,1763,
&end
#
# 51 ALA HA 52 ASN HN 3.50 (#)
&rst
ixpk= 0, nxpk= 0, iat= 737, 745, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 51 ALA HA 52 ASN HN 4.83
&rst
ixpk= 0, nxpk= 0, iat= 737, 745, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33, &end
#
# 51 ALA HA 52 ASN HA 4.99
&rst
ixpk= 0, nxpk= 0, iat= 737, 747, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49, &end
#
# 51 ALA HA 52 ASN HA 4.99
&rst
ixpk= 0, nxpk= 0, iat= 737, 747, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49, &end
#
# 51 ALA HA 52 ASN HA 4.99
&rst
ixpk= 0, nxpk= 0, iat= 737, 747, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49, &end
#
# 51 ALA HA 74 LEU QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 737, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1026,1027,1028,
&end
#
# 51 ALA HA 74 LEU QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 737, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1026,1027,1028,
&end
#
# 51 ALA HA 74 LEU QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 737, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1026,1027,1028,
&end
#
# 51 ALA HA 74 LEU QD2 4.27
&rst
ixpk= 0, nxpk= 0, iat= 737, -1, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
igr2=1030,1031,1032,
&end
#
# 51 ALA HA 74 LEU QD2 4.27
&rst
ixpk= 0, nxpk= 0, iat= 737, -1, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
igr2=1030,1031,1032,
&end
#
# 51 ALA HA 74 LEU QD2 4.27
&rst
ixpk= 0, nxpk= 0, iat= 737, -1, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
igr2=1030,1031,1032,
&end
#
# 51 ALA HA 123 LYS HB3 4.64
&rst
ixpk= 0, nxpk= 0, iat= 737,1740, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14, &end
#
# 51 ALA HA 123 LYS HB3 4.64
&rst
ixpk= 0, nxpk= 0, iat= 737,1740, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14, &end
#
# 51 ALA HA 123 LYS HB3 4.64
&rst
ixpk= 0, nxpk= 0, iat= 737,1740, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14, &end
#
# 51 ALA HA 123 LYS HE2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 737,1748, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 51 ALA HA 123 LYS HE2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 737,1748, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 51 ALA HA 123 LYS HE2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 737,1748, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 51 ALA HA 123 LYS HE3 5.84
&rst
ixpk= 0, nxpk= 0, iat= 737,1749, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34, &end
#
# 51 ALA HA 123 LYS HE3 5.84
&rst
ixpk= 0, nxpk= 0, iat= 737,1749, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34, &end
#
# 51 ALA HA 123 LYS HE3 5.84
&rst
ixpk= 0, nxpk= 0, iat= 737,1749, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34, &end
#
# 51 ALA HA 124 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 737,1757, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 51 ALA HA 124 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 737,1757, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 51 ALA HA 124 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 737,1757, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 51 ALA QB 52 ASN HN 5.72
&rst
ixpk= 0, nxpk= 0, iat= -1, 745, r1= 1.30, r2= 1.80, r3= 6.87, r4= 7.37,
igr1= 739, 740, 741,
&end
#
# 51 ALA QB 51 ALA HA 3.61
&rst
ixpk= 0, nxpk= 0, iat= -1, 737, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,
igr1= 739, 740, 741,
&end
#
# 51 ALA QB 52 ASN HN 3.97
&rst
ixpk= 0, nxpk= 0, iat= -1, 745, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
igr1= 739, 740, 741,
&end
#
# 51 ALA QB 52 ASN HN 3.97
&rst
ixpk= 0, nxpk= 0, iat= -1, 745, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
igr1= 739, 740, 741,
&end
#
# 51 ALA QB 52 ASN HN 3.97
&rst
ixpk= 0, nxpk= 0, iat= -1, 745, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
igr1= 739, 740, 741,
&end
#
# 51 ALA QB 52 ASN HD21 5.51
&rst
ixpk= 0, nxpk= 0, iat= -1, 754, r1= 1.30, r2= 1.80, r3= 6.62, r4= 7.12,
igr1= 739, 740, 741,
&end
#
# 51 ALA QB 52 ASN HD21 5.51
&rst
ixpk= 0, nxpk= 0, iat= -1, 754, r1= 1.30, r2= 1.80, r3= 6.62, r4= 7.12,
igr1= 739, 740, 741,
&end
#
# 51 ALA QB 52 ASN HD21 5.51
&rst
ixpk= 0, nxpk= 0, iat= -1, 754, r1= 1.30, r2= 1.80, r3= 6.62, r4= 7.12,
igr1= 739, 740, 741,
&end
#
# 51 ALA QB 52 ASN HD22 5.61
&rst
ixpk= 0, nxpk= 0, iat= -1, 755, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
igr1= 739, 740, 741,
&end
#
# 51 ALA QB 52 ASN HD22 5.61
&rst
ixpk= 0, nxpk= 0, iat= -1, 755, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
igr1= 739, 740, 741,
&end
#
# 51 ALA QB 52 ASN HD22 5.61
&rst
ixpk= 0, nxpk= 0, iat= -1, 755, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
igr1= 739, 740, 741,
&end
#
# 51 ALA QB 71 GLY HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 986, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 739, 740, 741,
&end
#
# 51 ALA QB 71 GLY HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 986, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 739, 740, 741,
&end
#
# 51 ALA QB 71 GLY HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1, 986, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 739, 740, 741,
&end
#
# 51 ALA QB 71 GLY HA3 5.21
&rst
ixpk= 0, nxpk= 0, iat= -1, 989, r1= 1.30, r2= 1.80, r3= 6.26, r4= 6.76,
igr1= 739, 740, 741,
&end
#
# 51 ALA QB 71 GLY HA3 5.21
&rst
ixpk= 0, nxpk= 0, iat= -1, 989, r1= 1.30, r2= 1.80, r3= 6.26, r4= 6.76,
igr1= 739, 740, 741,
&end
#
# 51 ALA QB 71 GLY HA3 5.21
&rst
ixpk= 0, nxpk= 0, iat= -1, 989, r1= 1.30, r2= 1.80, r3= 6.26, r4= 6.76,
igr1= 739, 740, 741,
&end
#
# 51 ALA QB 72 GLY HN 4.70
&rst
ixpk= 0, nxpk= 0, iat= -1, 993, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14,
igr1= 739, 740, 741,
&end
#
# 51 ALA QB 72 GLY HN 4.70
&rst
ixpk= 0, nxpk= 0, iat= -1, 993, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14,
igr1= 739, 740, 741,
&end
#
# 51 ALA QB 72 GLY HN 4.70
&rst
ixpk= 0, nxpk= 0, iat= -1, 993, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14,
igr1= 739, 740, 741,
&end
#
# 51 ALA QB 74 LEU HN 5.49
&rst
ixpk= 0, nxpk= 0, iat= -1,1017, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
igr1= 739, 740, 741,
&end
#
# 51 ALA QB 74 LEU HN 5.49
&rst
ixpk= 0, nxpk= 0, iat= -1,1017, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
igr1= 739, 740, 741,
&end
#
# 51 ALA QB 74 LEU HN 5.49
&rst
ixpk= 0, nxpk= 0, iat= -1,1017, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
igr1= 739, 740, 741,
&end
#
# 51 ALA QB 74 LEU HA 3.60
&rst
ixpk= 0, nxpk= 0, iat= -1,1019, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,
igr1= 739, 740, 741,
&end
#
# 51 ALA QB 74 LEU HA 3.60
&rst
ixpk= 0, nxpk= 0, iat= -1,1019, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,
igr1= 739, 740, 741,
&end
#
# 51 ALA QB 74 LEU HA 3.60
&rst
ixpk= 0, nxpk= 0, iat= -1,1019, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,
igr1= 739, 740, 741,
&end
#
# 51 ALA QB 124 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1757, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 739, 740, 741,
&end
#
# 51 ALA QB 124 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1757, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 739, 740, 741,
&end
#
# 51 ALA QB 124 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1757, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 739, 740, 741,
&end
#
# 52 ASN HN 52 ASN HA 3.56
&rst
ixpk= 0, nxpk= 0, iat= 745, 747, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06, &end
#
# 52 ASN HN 52 ASN HB2 4.04
&rst
ixpk= 0, nxpk= 0, iat= 745, 749, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, &end
#
# 52 ASN HN 52 ASN HB2 4.04
&rst
ixpk= 0, nxpk= 0, iat= 745, 749, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, &end
#
# 52 ASN HN 52 ASN HB2 4.04
&rst
ixpk= 0, nxpk= 0, iat= 745, 749, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, &end
#
# 52 ASN HN 52 ASN HB3 3.88
&rst
ixpk= 0, nxpk= 0, iat= 745, 750, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38, &end
#
# 52 ASN HN 52 ASN HB3 3.88
&rst
ixpk= 0, nxpk= 0, iat= 745, 750, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38, &end
#
# 52 ASN HN 52 ASN HB3 3.88
&rst
ixpk= 0, nxpk= 0, iat= 745, 750, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38, &end
#
# 52 ASN HN 52 ASN HD21 5.37
&rst
ixpk= 0, nxpk= 0, iat= 745, 754, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87, &end
#
# 52 ASN HN 52 ASN HD21 5.37
&rst
ixpk= 0, nxpk= 0, iat= 745, 754, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87, &end
#
# 52 ASN HN 52 ASN HD21 5.37
&rst
ixpk= 0, nxpk= 0, iat= 745, 754, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87, &end
#
# 52 ASN HN 52 ASN HD22 4.63
&rst
ixpk= 0, nxpk= 0, iat= 745, 755, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, &end
#
# 52 ASN HN 52 ASN HD22 4.63
&rst
ixpk= 0, nxpk= 0, iat= 745, 755, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, &end
#
# 52 ASN HN 52 ASN HD22 4.63
&rst
ixpk= 0, nxpk= 0, iat= 745, 755, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, &end
#
# 52 ASN HN 53 GLY HN 5.28
&rst
ixpk= 0, nxpk= 0, iat= 745, 759, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 52 ASN HN 70 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 745, 976, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 52 ASN HN 70 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 745, 976, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 52 ASN HN 70 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 745, 976, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 52 ASN HN 70 ALA HA 4.20
&rst
ixpk= 0, nxpk= 0, iat= 745, 978, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 52 ASN HN 70 ALA HA 4.20
&rst
ixpk= 0, nxpk= 0, iat= 745, 978, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 52 ASN HN 70 ALA HA 4.20
&rst
ixpk= 0, nxpk= 0, iat= 745, 978, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 52 ASN HN 70 ALA QB 4.88
&rst
ixpk= 0, nxpk= 0, iat= 745, -1, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
igr2= 980, 981, 982,
&end
#
# 52 ASN HN 70 ALA QB 4.88
&rst
ixpk= 0, nxpk= 0, iat= 745, -1, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
igr2= 980, 981, 982,
&end
#
# 52 ASN HN 70 ALA QB 4.88
&rst
ixpk= 0, nxpk= 0, iat= 745, -1, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
igr2= 980, 981, 982,
&end
#
# 52 ASN HN 71 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 745, 986, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 52 ASN HN 71 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 745, 986, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 52 ASN HN 71 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 745, 986, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 52 ASN HN 71 GLY HA2 4.42
&rst
ixpk= 0, nxpk= 0, iat= 745, 988, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92, &end
#
# 52 ASN HN 71 GLY HA2 4.42
&rst
ixpk= 0, nxpk= 0, iat= 745, 988, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92, &end
#
# 52 ASN HN 71 GLY HA2 4.42
&rst
ixpk= 0, nxpk= 0, iat= 745, 988, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92, &end
#
# 52 ASN HN 71 GLY HA3 5.40
&rst
ixpk= 0, nxpk= 0, iat= 745, 989, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90, &end
#
# 52 ASN HN 71 GLY HA3 5.40
&rst
ixpk= 0, nxpk= 0, iat= 745, 989, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90, &end
#
# 52 ASN HN 71 GLY HA3 5.40
&rst
ixpk= 0, nxpk= 0, iat= 745, 989, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90, &end
#
# 52 ASN HN 72 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 745, 993, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 52 ASN HN 72 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 745, 993, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 52 ASN HN 72 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 745, 993, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 52 ASN HN 74 LEU QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 745, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1026,1027,1028,
&end
#
# 52 ASN HN 74 LEU QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 745, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1026,1027,1028,
&end
#
# 52 ASN HN 74 LEU QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 745, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1026,1027,1028,
&end
#
# 52 ASN HN 124 ALA HN 4.97
&rst
ixpk= 0, nxpk= 0, iat= 745,1757, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 52 ASN HN 124 ALA HN 4.97
&rst
ixpk= 0, nxpk= 0, iat= 745,1757, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 52 ASN HN 124 ALA HN 4.97
&rst
ixpk= 0, nxpk= 0, iat= 745,1757, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 52 ASN HN 124 ALA QB 5.64
&rst
ixpk= 0, nxpk= 0, iat= 745, -1, r1= 1.30, r2= 1.80, r3= 6.77, r4= 7.27,
igr2=1761,1762,1763,
&end
#
# 52 ASN HN 124 ALA QB 5.64
&rst
ixpk= 0, nxpk= 0, iat= 745, -1, r1= 1.30, r2= 1.80, r3= 6.77, r4= 7.27,
igr2=1761,1762,1763,
&end
#
# 52 ASN HN 124 ALA QB 5.64
&rst
ixpk= 0, nxpk= 0, iat= 745, -1, r1= 1.30, r2= 1.80, r3= 6.77, r4= 7.27,
igr2=1761,1762,1763,
&end
#
# 52 ASN HA 52 ASN HB2 4.48
&rst
ixpk= 0, nxpk= 0, iat= 747, 749, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98, &end
#
# 52 ASN HA 52 ASN HB3 4.01
&rst
ixpk= 0, nxpk= 0, iat= 747, 750, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51, &end
#
# 52 ASN HA 52 ASN HD22 5.61
&rst
ixpk= 0, nxpk= 0, iat= 747, 755, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11, &end
#
# 52 ASN HA 52 ASN HD22 5.61
&rst
ixpk= 0, nxpk= 0, iat= 747, 755, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11, &end
#
# 52 ASN HA 52 ASN HD22 5.61
&rst
ixpk= 0, nxpk= 0, iat= 747, 755, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11, &end
#
# 52 ASN HA 53 GLY HN 2.97
&rst
ixpk= 0, nxpk= 0, iat= 747, 759, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 52 ASN HA 53 GLY HN 3.30
&rst
ixpk= 0, nxpk= 0, iat= 747, 759, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80, &end
#
# 52 ASN HA 53 GLY HN 3.30
&rst
ixpk= 0, nxpk= 0, iat= 747, 759, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80, &end
#
# 52 ASN HA 53 GLY HN 3.30
&rst
ixpk= 0, nxpk= 0, iat= 747, 759, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80, &end
#
# 52 ASN HA 53 GLY HA3 5.43
&rst
ixpk= 0, nxpk= 0, iat= 747, 762, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93, &end
#
# 52 ASN HA 53 GLY HA3 5.43
&rst
ixpk= 0, nxpk= 0, iat= 747, 762, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93, &end
#
# 52 ASN HA 53 GLY HA3 5.43
&rst
ixpk= 0, nxpk= 0, iat= 747, 762, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93, &end
#
# 52 ASN HA 54 SER HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 747, 766, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 52 ASN HA 54 SER HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 747, 766, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 52 ASN HA 54 SER HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 747, 766, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 52 ASN HA 70 ALA HA 5.57
&rst
ixpk= 0, nxpk= 0, iat= 747, 978, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07, &end
#
# 52 ASN HA 70 ALA HA 5.57
&rst
ixpk= 0, nxpk= 0, iat= 747, 978, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07, &end
#
# 52 ASN HA 70 ALA HA 5.57
&rst
ixpk= 0, nxpk= 0, iat= 747, 978, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07, &end
#
# 52 ASN HA 70 ALA QB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 747, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 980, 981, 982,
&end
#
# 52 ASN HA 70 ALA QB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 747, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 980, 981, 982,
&end
#
# 52 ASN HA 70 ALA QB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 747, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 980, 981, 982,
&end
#
# 52 ASN HA 123 LYS HA 4.98
&rst
ixpk= 0, nxpk= 0, iat= 747,1737, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48, &end
#
# 52 ASN HA 123 LYS HA 4.98
&rst
ixpk= 0, nxpk= 0, iat= 747,1737, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48, &end
#
# 52 ASN HA 123 LYS HA 4.98
&rst
ixpk= 0, nxpk= 0, iat= 747,1737, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48, &end
#
# 52 ASN HA 124 ALA HN 5.68
&rst
ixpk= 0, nxpk= 0, iat= 747,1757, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18, &end
#
# 52 ASN HA 124 ALA HN 5.68
&rst
ixpk= 0, nxpk= 0, iat= 747,1757, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18, &end
#
# 52 ASN HA 124 ALA HN 5.68
&rst
ixpk= 0, nxpk= 0, iat= 747,1757, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18, &end
#
# 52 ASN HB2 52 ASN HD21 4.88
&rst
ixpk= 0, nxpk= 0, iat= 749, 754, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38, &end
#
# 52 ASN HB2 52 ASN HD22 4.28
&rst
ixpk= 0, nxpk= 0, iat= 749, 755, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78, &end
#
# 52 ASN HB2 52 ASN HD22 4.28
&rst
ixpk= 0, nxpk= 0, iat= 749, 755, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78, &end
#
# 52 ASN HB2 52 ASN HD22 4.28
&rst
ixpk= 0, nxpk= 0, iat= 749, 755, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78, &end
#
# 52 ASN HB2 53 GLY HN 3.93
&rst
ixpk= 0, nxpk= 0, iat= 749, 759, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43, &end
#
# 52 ASN HB2 53 GLY HN 3.93
&rst
ixpk= 0, nxpk= 0, iat= 749, 759, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43, &end
#
# 52 ASN HB2 53 GLY HN 3.93
&rst
ixpk= 0, nxpk= 0, iat= 749, 759, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43, &end
#
# 52 ASN HB2 53 GLY HN 5.72
&rst
ixpk= 0, nxpk= 0, iat= 749, 759, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 52 ASN HB2 54 SER HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 749, 766, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 52 ASN HB2 54 SER HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 749, 766, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 52 ASN HB2 54 SER HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 749, 766, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 52 ASN HB2 71 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 749, 986, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 52 ASN HB2 71 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 749, 986, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 52 ASN HB2 71 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 749, 986, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 52 ASN HB3 52 ASN HD21 4.99
&rst
ixpk= 0, nxpk= 0, iat= 750, 754, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49, &end
#
# 52 ASN HB3 52 ASN HD22 4.65
&rst
ixpk= 0, nxpk= 0, iat= 750, 755, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15, &end
#
# 52 ASN HB3 53 GLY HN 4.25
&rst
ixpk= 0, nxpk= 0, iat= 750, 759, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75, &end
#
# 52 ASN HB3 53 GLY HN 4.25
&rst
ixpk= 0, nxpk= 0, iat= 750, 759, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75, &end
#
# 52 ASN HB3 53 GLY HN 4.25
&rst
ixpk= 0, nxpk= 0, iat= 750, 759, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75, &end
#
# 52 ASN HB3 54 SER HN 6.01
&rst
ixpk= 0, nxpk= 0, iat= 750, 766, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51, &end
#
# 52 ASN HB3 54 SER HN 6.01
&rst
ixpk= 0, nxpk= 0, iat= 750, 766, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51, &end
#
# 52 ASN HB3 54 SER HN 6.01
&rst
ixpk= 0, nxpk= 0, iat= 750, 766, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51, &end
#
# 52 ASN HB3 70 ALA HN 5.97
&rst
ixpk= 0, nxpk= 0, iat= 750, 976, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47, &end
#
# 52 ASN HB3 70 ALA HN 5.97
&rst
ixpk= 0, nxpk= 0, iat= 750, 976, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47, &end
#
# 52 ASN HB3 70 ALA HN 5.97
&rst
ixpk= 0, nxpk= 0, iat= 750, 976, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47, &end
#
# 52 ASN HB3 70 ALA HA 4.30
&rst
ixpk= 0, nxpk= 0, iat= 750, 978, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80, &end
#
# 52 ASN HB3 70 ALA HA 4.30
&rst
ixpk= 0, nxpk= 0, iat= 750, 978, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80, &end
#
# 52 ASN HB3 70 ALA HA 4.30
&rst
ixpk= 0, nxpk= 0, iat= 750, 978, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80, &end
#
# 52 ASN HB3 70 ALA QB 6.03
&rst
ixpk= 0, nxpk= 0, iat= 750, -1, r1= 1.30, r2= 1.80, r3= 7.24, r4= 7.74,
igr2= 980, 981, 982,
&end
#
# 52 ASN HB3 70 ALA QB 6.03
&rst
ixpk= 0, nxpk= 0, iat= 750, -1, r1= 1.30, r2= 1.80, r3= 7.24, r4= 7.74,
igr2= 980, 981, 982,
&end
#
# 52 ASN HB3 70 ALA QB 6.03
&rst
ixpk= 0, nxpk= 0, iat= 750, -1, r1= 1.30, r2= 1.80, r3= 7.24, r4= 7.74,
igr2= 980, 981, 982,
&end
#
# 52 ASN HB3 71 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 750, 986, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 52 ASN HB3 71 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 750, 986, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 52 ASN HB3 71 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 750, 986, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 52 ASN HD21 52 ASN HD22 3.00
&rst
ixpk= 0, nxpk= 0, iat= 754, 755, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 52 ASN HD21 70 ALA HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 754, 978, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 52 ASN HD21 70 ALA HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 754, 978, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 52 ASN HD21 70 ALA HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 754, 978, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 52 ASN HD21 71 GLY HN 5.73
&rst
ixpk= 0, nxpk= 0, iat= 754, 986, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23, &end
#
# 52 ASN HD21 71 GLY HN 5.73
&rst
ixpk= 0, nxpk= 0, iat= 754, 986, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23, &end
#
# 52 ASN HD21 71 GLY HN 5.73
&rst
ixpk= 0, nxpk= 0, iat= 754, 986, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23, &end
#
# 52 ASN HD21 71 GLY HA2 5.02
&rst
ixpk= 0, nxpk= 0, iat= 754, 988, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52, &end
#
# 52 ASN HD21 71 GLY HA2 5.02
&rst
ixpk= 0, nxpk= 0, iat= 754, 988, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52, &end
#
# 52 ASN HD21 71 GLY HA2 5.02
&rst
ixpk= 0, nxpk= 0, iat= 754, 988, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52, &end
#
# 52 ASN HD21 71 GLY HA3 5.19
&rst
ixpk= 0, nxpk= 0, iat= 754, 989, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69, &end
#
# 52 ASN HD21 71 GLY HA3 5.19
&rst
ixpk= 0, nxpk= 0, iat= 754, 989, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69, &end
#
# 52 ASN HD21 71 GLY HA3 5.19
&rst
ixpk= 0, nxpk= 0, iat= 754, 989, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69, &end
#
# 52 ASN HD21 72 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 754, 993, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 52 ASN HD21 72 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 754, 993, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 52 ASN HD21 72 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 754, 993, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 52 ASN HD22 70 ALA HA 5.06
&rst
ixpk= 0, nxpk= 0, iat= 755, 978, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56, &end
#
# 52 ASN HD22 70 ALA HA 5.06
&rst
ixpk= 0, nxpk= 0, iat= 755, 978, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56, &end
#
# 52 ASN HD22 70 ALA HA 5.06
&rst
ixpk= 0, nxpk= 0, iat= 755, 978, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56, &end
#
# 52 ASN HD22 71 GLY HN 4.64
&rst
ixpk= 0, nxpk= 0, iat= 755, 986, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14, &end
#
# 52 ASN HD22 71 GLY HN 4.64
&rst
ixpk= 0, nxpk= 0, iat= 755, 986, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14, &end
#
# 52 ASN HD22 71 GLY HN 4.64
&rst
ixpk= 0, nxpk= 0, iat= 755, 986, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14, &end
#
# 52 ASN HD22 71 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 755, 989, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 52 ASN HD22 71 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 755, 989, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 52 ASN HD22 71 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 755, 989, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 52 ASN HD22 72 GLY HN 5.98
&rst
ixpk= 0, nxpk= 0, iat= 755, 993, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48, &end
#
# 52 ASN HD22 72 GLY HN 5.98
&rst
ixpk= 0, nxpk= 0, iat= 755, 993, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48, &end
#
# 52 ASN HD22 72 GLY HN 5.98
&rst
ixpk= 0, nxpk= 0, iat= 755, 993, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48, &end
#
# 53 GLY HN 53 GLY HA2 3.88
&rst
ixpk= 0, nxpk= 0, iat= 759, 761, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38, &end
#
# 53 GLY HN 53 GLY HA3 3.72
&rst
ixpk= 0, nxpk= 0, iat= 759, 762, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22, &end
#
# 53 GLY HN 54 SER HN 4.72
&rst
ixpk= 0, nxpk= 0, iat= 759, 766, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22, &end
#
# 53 GLY HN 54 SER HN 4.72
&rst
ixpk= 0, nxpk= 0, iat= 759, 766, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22, &end
#
# 53 GLY HN 54 SER HN 4.72
&rst
ixpk= 0, nxpk= 0, iat= 759, 766, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22, &end
#
# 53 GLY HN 54 SER HN 5.28
&rst
ixpk= 0, nxpk= 0, iat= 759, 766, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 53 GLY HN 54 SER HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 759, 771, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 53 GLY HN 54 SER HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 759, 771, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 53 GLY HN 54 SER HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 759, 771, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 53 GLY HN 122 ASP HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 759,1723, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 53 GLY HN 122 ASP HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 759,1723, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 53 GLY HN 122 ASP HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 759,1723, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 53 GLY HN 123 LYS HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 759,1735, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 53 GLY HN 123 LYS HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 759,1735, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 53 GLY HN 123 LYS HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 759,1735, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 53 GLY HN 123 LYS HA 4.83
&rst
ixpk= 0, nxpk= 0, iat= 759,1737, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33, &end
#
# 53 GLY HN 123 LYS HA 4.83
&rst
ixpk= 0, nxpk= 0, iat= 759,1737, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33, &end
#
# 53 GLY HN 123 LYS HA 4.83
&rst
ixpk= 0, nxpk= 0, iat= 759,1737, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33, &end
#
# 53 GLY HN 123 LYS HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 759,1740, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 53 GLY HN 123 LYS HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 759,1740, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 53 GLY HN 123 LYS HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 759,1740, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 53 GLY HN 124 ALA HN 4.75
&rst
ixpk= 0, nxpk= 0, iat= 759,1757, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, &end
#
# 53 GLY HN 124 ALA HN 4.75
&rst
ixpk= 0, nxpk= 0, iat= 759,1757, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, &end
#
# 53 GLY HN 124 ALA HN 4.75
&rst
ixpk= 0, nxpk= 0, iat= 759,1757, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, &end
#
# 53 GLY HN 124 ALA QB 5.53
&rst
ixpk= 0, nxpk= 0, iat= 759, -1, r1= 1.30, r2= 1.80, r3= 6.64, r4= 7.14,
igr2=1761,1762,1763,
&end
#
# 53 GLY HN 124 ALA QB 5.53
&rst
ixpk= 0, nxpk= 0, iat= 759, -1, r1= 1.30, r2= 1.80, r3= 6.64, r4= 7.14,
igr2=1761,1762,1763,
&end
#
# 53 GLY HN 124 ALA QB 5.53
&rst
ixpk= 0, nxpk= 0, iat= 759, -1, r1= 1.30, r2= 1.80, r3= 6.64, r4= 7.14,
igr2=1761,1762,1763,
&end
#
# 53 GLY HN 152 VAL QG1 4.09
&rst
ixpk= 0, nxpk= 0, iat= 759, -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
igr2=2141,2142,2143,
&end
#
# 53 GLY HN 152 VAL QG1 4.09
&rst
ixpk= 0, nxpk= 0, iat= 759, -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
igr2=2141,2142,2143,
&end
#
# 53 GLY HN 152 VAL QG1 4.09
&rst
ixpk= 0, nxpk= 0, iat= 759, -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
igr2=2141,2142,2143,
&end
#
# 53 GLY HN 152 VAL QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 759, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=2145,2146,2147,
&end
#
# 53 GLY HN 152 VAL QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 759, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=2145,2146,2147,
&end
#
# 53 GLY HN 152 VAL QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 759, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=2145,2146,2147,
&end
#
# 53 GLY HA2 53 GLY HA3 3.55
&rst
ixpk= 0, nxpk= 0, iat= 761, 762, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05, &end
#
# 53 GLY HA2 54 SER HN 2.97
&rst
ixpk= 0, nxpk= 0, iat= 761, 766, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 53 GLY HA2 54 SER HN 3.97
&rst
ixpk= 0, nxpk= 0, iat= 761, 766, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47, &end
#
# 53 GLY HA2 124 ALA HN 4.54
&rst
ixpk= 0, nxpk= 0, iat= 761,1757, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 53 GLY HA2 124 ALA HN 4.54
&rst
ixpk= 0, nxpk= 0, iat= 761,1757, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 53 GLY HA2 124 ALA HN 4.54
&rst
ixpk= 0, nxpk= 0, iat= 761,1757, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 53 GLY HA2 124 ALA HA 5.92
&rst
ixpk= 0, nxpk= 0, iat= 761,1759, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42, &end
#
# 53 GLY HA2 124 ALA HA 5.92
&rst
ixpk= 0, nxpk= 0, iat= 761,1759, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42, &end
#
# 53 GLY HA2 124 ALA HA 5.92
&rst
ixpk= 0, nxpk= 0, iat= 761,1759, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42, &end
#
# 53 GLY HA2 124 ALA QB 4.93
&rst
ixpk= 0, nxpk= 0, iat= 761, -1, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
igr2=1761,1762,1763,
&end
#
# 53 GLY HA2 124 ALA QB 4.93
&rst
ixpk= 0, nxpk= 0, iat= 761, -1, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
igr2=1761,1762,1763,
&end
#
# 53 GLY HA2 124 ALA QB 4.93
&rst
ixpk= 0, nxpk= 0, iat= 761, -1, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
igr2=1761,1762,1763,
&end
#
# 53 GLY HA2 152 VAL HA 4.83
&rst
ixpk= 0, nxpk= 0, iat= 761,2137, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33, &end
#
# 53 GLY HA2 152 VAL HA 4.83
&rst
ixpk= 0, nxpk= 0, iat= 761,2137, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33, &end
#
# 53 GLY HA2 152 VAL HA 4.83
&rst
ixpk= 0, nxpk= 0, iat= 761,2137, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33, &end
#
# 53 GLY HA2 152 VAL QG1 4.55
&rst
ixpk= 0, nxpk= 0, iat= 761, -1, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
igr2=2141,2142,2143,
&end
#
# 53 GLY HA2 152 VAL QG1 4.55
&rst
ixpk= 0, nxpk= 0, iat= 761, -1, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
igr2=2141,2142,2143,
&end
#
# 53 GLY HA2 152 VAL QG1 4.55
&rst
ixpk= 0, nxpk= 0, iat= 761, -1, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
igr2=2141,2142,2143,
&end
#
# 53 GLY HA3 54 SER HN 4.43
&rst
ixpk= 0, nxpk= 0, iat= 762, 766, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93, &end
#
# 53 GLY HA3 54 SER HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 762, 770, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 53 GLY HA3 54 SER HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 762, 770, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 53 GLY HA3 54 SER HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 762, 770, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 53 GLY HA3 123 LYS HN 5.91
&rst
ixpk= 0, nxpk= 0, iat= 762,1735, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41, &end
#
# 53 GLY HA3 123 LYS HN 5.91
&rst
ixpk= 0, nxpk= 0, iat= 762,1735, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41, &end
#
# 53 GLY HA3 123 LYS HN 5.91
&rst
ixpk= 0, nxpk= 0, iat= 762,1735, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41, &end
#
# 53 GLY HA3 123 LYS HA 5.79
&rst
ixpk= 0, nxpk= 0, iat= 762,1737, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29, &end
#
# 53 GLY HA3 123 LYS HA 5.79
&rst
ixpk= 0, nxpk= 0, iat= 762,1737, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29, &end
#
# 53 GLY HA3 123 LYS HA 5.79
&rst
ixpk= 0, nxpk= 0, iat= 762,1737, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29, &end
#
# 53 GLY HA3 124 ALA HN 4.86
&rst
ixpk= 0, nxpk= 0, iat= 762,1757, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36, &end
#
# 53 GLY HA3 124 ALA HN 4.86
&rst
ixpk= 0, nxpk= 0, iat= 762,1757, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36, &end
#
# 53 GLY HA3 124 ALA HN 4.86
&rst
ixpk= 0, nxpk= 0, iat= 762,1757, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36, &end
#
# 53 GLY HA3 124 ALA HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 762,1759, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 53 GLY HA3 124 ALA HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 762,1759, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 53 GLY HA3 124 ALA HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 762,1759, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 53 GLY HA3 124 ALA QB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 762, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1761,1762,1763,
&end
#
# 53 GLY HA3 124 ALA QB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 762, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1761,1762,1763,
&end
#
# 53 GLY HA3 124 ALA QB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 762, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1761,1762,1763,
&end
#
# 53 GLY HA3 152 VAL QG1 4.63
&rst
ixpk= 0, nxpk= 0, iat= 762, -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
igr2=2141,2142,2143,
&end
#
# 53 GLY HA3 152 VAL QG1 4.63
&rst
ixpk= 0, nxpk= 0, iat= 762, -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
igr2=2141,2142,2143,
&end
#
# 53 GLY HA3 152 VAL QG1 4.63
&rst
ixpk= 0, nxpk= 0, iat= 762, -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
igr2=2141,2142,2143,
&end
#
# 53 GLY HA3 153 ILE HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 762,2151, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 53 GLY HA3 153 ILE HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 762,2151, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 53 GLY HA3 153 ILE HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 762,2151, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 54 SER HN 54 SER HA 3.84
&rst
ixpk= 0, nxpk= 0, iat= 766, 768, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34, &end
#
# 54 SER HN 54 SER HB2 4.22
&rst
ixpk= 0, nxpk= 0, iat= 766, 770, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 54 SER HN 54 SER HB2 4.22
&rst
ixpk= 0, nxpk= 0, iat= 766, 770, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 54 SER HN 54 SER HB2 4.22
&rst
ixpk= 0, nxpk= 0, iat= 766, 770, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 54 SER HN 54 SER HB3 4.44
&rst
ixpk= 0, nxpk= 0, iat= 766, 771, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94, &end
#
# 54 SER HN 54 SER HB3 4.44
&rst
ixpk= 0, nxpk= 0, iat= 766, 771, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94, &end
#
# 54 SER HN 54 SER HB3 4.44
&rst
ixpk= 0, nxpk= 0, iat= 766, 771, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94, &end
#
# 54 SER HN 55 CYX HN 5.06
&rst
ixpk= 0, nxpk= 0, iat= 766, 777, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56, &end
#
# 54 SER HN 55 CYX HN 5.06
&rst
ixpk= 0, nxpk= 0, iat= 766, 777, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56, &end
#
# 54 SER HN 55 CYX HN 5.06
&rst
ixpk= 0, nxpk= 0, iat= 766, 777, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56, &end
#
# 54 SER HN 55 CYX HN 5.28
&rst
ixpk= 0, nxpk= 0, iat= 766, 777, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 54 SER HN 55 CYX HA 5.92
&rst
ixpk= 0, nxpk= 0, iat= 766, 779, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42, &end
#
# 54 SER HN 55 CYX HA 5.92
&rst
ixpk= 0, nxpk= 0, iat= 766, 779, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42, &end
#
# 54 SER HN 55 CYX HA 5.92
&rst
ixpk= 0, nxpk= 0, iat= 766, 779, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42, &end
#
# 54 SER HN 69 ALA QB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 766, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 970, 971, 972,
&end
#
# 54 SER HN 69 ALA QB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 766, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 970, 971, 972,
&end
#
# 54 SER HN 69 ALA QB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 766, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 970, 971, 972,
&end
#
# 54 SER HN 70 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 766, 976, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 54 SER HN 70 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 766, 976, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 54 SER HN 70 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 766, 976, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 54 SER HN 70 ALA HA 4.87
&rst
ixpk= 0, nxpk= 0, iat= 766, 978, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37, &end
#
# 54 SER HN 70 ALA HA 4.87
&rst
ixpk= 0, nxpk= 0, iat= 766, 978, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37, &end
#
# 54 SER HN 70 ALA HA 4.87
&rst
ixpk= 0, nxpk= 0, iat= 766, 978, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37, &end
#
# 54 SER HN 70 ALA QB 5.06
&rst
ixpk= 0, nxpk= 0, iat= 766, -1, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
igr2= 980, 981, 982,
&end
#
# 54 SER HN 70 ALA QB 5.06
&rst
ixpk= 0, nxpk= 0, iat= 766, -1, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
igr2= 980, 981, 982,
&end
#
# 54 SER HN 70 ALA QB 5.06
&rst
ixpk= 0, nxpk= 0, iat= 766, -1, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
igr2= 980, 981, 982,
&end
#
# 54 SER HN 124 ALA HN 5.02
&rst
ixpk= 0, nxpk= 0, iat= 766,1757, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52, &end
#
# 54 SER HN 124 ALA HN 5.02
&rst
ixpk= 0, nxpk= 0, iat= 766,1757, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52, &end
#
# 54 SER HN 124 ALA HN 5.02
&rst
ixpk= 0, nxpk= 0, iat= 766,1757, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52, &end
#
# 54 SER HN 124 ALA HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 766,1759, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 54 SER HN 124 ALA HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 766,1759, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 54 SER HN 124 ALA HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 766,1759, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 54 SER HN 124 ALA QB 4.07
&rst
ixpk= 0, nxpk= 0, iat= 766, -1, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
igr2=1761,1762,1763,
&end
#
# 54 SER HN 124 ALA QB 4.07
&rst
ixpk= 0, nxpk= 0, iat= 766, -1, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
igr2=1761,1762,1763,
&end
#
# 54 SER HN 124 ALA QB 4.07
&rst
ixpk= 0, nxpk= 0, iat= 766, -1, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
igr2=1761,1762,1763,
&end
#
# 54 SER HN 152 VAL QG1 5.26
&rst
ixpk= 0, nxpk= 0, iat= 766, -1, r1= 1.30, r2= 1.80, r3= 6.32, r4= 6.82,
igr2=2141,2142,2143,
&end
#
# 54 SER HN 152 VAL QG1 5.26
&rst
ixpk= 0, nxpk= 0, iat= 766, -1, r1= 1.30, r2= 1.80, r3= 6.32, r4= 6.82,
igr2=2141,2142,2143,
&end
#
# 54 SER HN 152 VAL QG1 5.26
&rst
ixpk= 0, nxpk= 0, iat= 766, -1, r1= 1.30, r2= 1.80, r3= 6.32, r4= 6.82,
igr2=2141,2142,2143,
&end
#
# 54 SER HN 152 VAL QG2 4.62
&rst
ixpk= 0, nxpk= 0, iat= 766, -1, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,
igr2=2145,2146,2147,
&end
#
# 54 SER HN 152 VAL QG2 4.62
&rst
ixpk= 0, nxpk= 0, iat= 766, -1, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,
igr2=2145,2146,2147,
&end
#
# 54 SER HN 152 VAL QG2 4.62
&rst
ixpk= 0, nxpk= 0, iat= 766, -1, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,
igr2=2145,2146,2147,
&end
#
# 54 SER HA 54 SER HB2 4.60
&rst
ixpk= 0, nxpk= 0, iat= 768, 770, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 54 SER HA 54 SER HB3 4.44
&rst
ixpk= 0, nxpk= 0, iat= 768, 771, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94, &end
#
# 54 SER HA 55 CYX HN 2.97
&rst
ixpk= 0, nxpk= 0, iat= 768, 777, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 54 SER HA 55 CYX HN 3.37
&rst
ixpk= 0, nxpk= 0, iat= 768, 777, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87, &end
#
# 54 SER HA 55 CYX HN 3.37
&rst
ixpk= 0, nxpk= 0, iat= 768, 777, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87, &end
#
# 54 SER HA 55 CYX HN 3.37
&rst
ixpk= 0, nxpk= 0, iat= 768, 777, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87, &end
#
# 54 SER HA 55 CYX HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 768, 782, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 54 SER HA 55 CYX HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 768, 782, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 54 SER HA 55 CYX HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 768, 782, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 54 SER HA 55 CYX HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 768, 781, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 54 SER HA 55 CYX HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 768, 781, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 54 SER HA 55 CYX HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 768, 781, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 54 SER HA 56 GLN HN 4.51
&rst
ixpk= 0, nxpk= 0, iat= 768, 787, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01, &end
#
# 54 SER HA 56 GLN HN 4.51
&rst
ixpk= 0, nxpk= 0, iat= 768, 787, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01, &end
#
# 54 SER HA 56 GLN HN 4.51
&rst
ixpk= 0, nxpk= 0, iat= 768, 787, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01, &end
#
# 54 SER HA 69 ALA QB 5.80
&rst
ixpk= 0, nxpk= 0, iat= 768, -1, r1= 1.30, r2= 1.80, r3= 6.97, r4= 7.47,
igr2= 970, 971, 972,
&end
#
# 54 SER HA 69 ALA QB 5.80
&rst
ixpk= 0, nxpk= 0, iat= 768, -1, r1= 1.30, r2= 1.80, r3= 6.97, r4= 7.47,
igr2= 970, 971, 972,
&end
#
# 54 SER HA 69 ALA QB 5.80
&rst
ixpk= 0, nxpk= 0, iat= 768, -1, r1= 1.30, r2= 1.80, r3= 6.97, r4= 7.47,
igr2= 970, 971, 972,
&end
#
# 54 SER HB2 54 SER HB3 3.69
&rst
ixpk= 0, nxpk= 0, iat= 770, 771, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19, &end
#
# 54 SER HB2 55 CYX HN 4.71
&rst
ixpk= 0, nxpk= 0, iat= 770, 777, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21, &end
#
# 54 SER HB2 55 CYX HN 4.71
&rst
ixpk= 0, nxpk= 0, iat= 770, 777, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21, &end
#
# 54 SER HB2 55 CYX HN 4.71
&rst
ixpk= 0, nxpk= 0, iat= 770, 777, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21, &end
#
# 54 SER HB2 56 GLN HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 770, 787, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 54 SER HB2 56 GLN HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 770, 787, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 54 SER HB2 56 GLN HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 770, 787, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 54 SER HB2 69 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 770, 966, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 54 SER HB2 69 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 770, 966, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 54 SER HB2 69 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 770, 966, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 54 SER HB2 69 ALA QB 4.24
&rst
ixpk= 0, nxpk= 0, iat= 770, -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
igr2= 970, 971, 972,
&end
#
# 54 SER HB2 69 ALA QB 4.24
&rst
ixpk= 0, nxpk= 0, iat= 770, -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
igr2= 970, 971, 972,
&end
#
# 54 SER HB2 69 ALA QB 4.24
&rst
ixpk= 0, nxpk= 0, iat= 770, -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
igr2= 970, 971, 972,
&end
#
# 54 SER HB2 70 ALA HN 4.72
&rst
ixpk= 0, nxpk= 0, iat= 770, 976, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22, &end
#
# 54 SER HB2 70 ALA HN 4.72
&rst
ixpk= 0, nxpk= 0, iat= 770, 976, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22, &end
#
# 54 SER HB2 70 ALA HN 4.72
&rst
ixpk= 0, nxpk= 0, iat= 770, 976, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22, &end
#
# 54 SER HB2 70 ALA HA 3.93
&rst
ixpk= 0, nxpk= 0, iat= 770, 978, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43, &end
#
# 54 SER HB2 70 ALA HA 3.93
&rst
ixpk= 0, nxpk= 0, iat= 770, 978, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43, &end
#
# 54 SER HB2 70 ALA HA 3.93
&rst
ixpk= 0, nxpk= 0, iat= 770, 978, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43, &end
#
# 54 SER HB2 70 ALA QB 4.30
&rst
ixpk= 0, nxpk= 0, iat= 770, -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
igr2= 980, 981, 982,
&end
#
# 54 SER HB2 70 ALA QB 4.30
&rst
ixpk= 0, nxpk= 0, iat= 770, -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
igr2= 980, 981, 982,
&end
#
# 54 SER HB2 70 ALA QB 4.30
&rst
ixpk= 0, nxpk= 0, iat= 770, -1, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66,
igr2= 980, 981, 982,
&end
#
# 54 SER HB2 152 VAL QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 770, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=2145,2146,2147,
&end
#
# 54 SER HB2 152 VAL QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 770, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=2145,2146,2147,
&end
#
# 54 SER HB2 152 VAL QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 770, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=2145,2146,2147,
&end
#
# 54 SER HB3 55 CYX HN 5.12
&rst
ixpk= 0, nxpk= 0, iat= 771, 777, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, &end
#
# 54 SER HB3 55 CYX HN 5.12
&rst
ixpk= 0, nxpk= 0, iat= 771, 777, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, &end
#
# 54 SER HB3 55 CYX HN 5.12
&rst
ixpk= 0, nxpk= 0, iat= 771, 777, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, &end
#
# 54 SER HB3 55 CYX HN 5.72
&rst
ixpk= 0, nxpk= 0, iat= 771, 777, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 54 SER HB3 56 GLN HN 5.20
&rst
ixpk= 0, nxpk= 0, iat= 771, 787, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70, &end
#
# 54 SER HB3 56 GLN HN 5.20
&rst
ixpk= 0, nxpk= 0, iat= 771, 787, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70, &end
#
# 54 SER HB3 56 GLN HN 5.20
&rst
ixpk= 0, nxpk= 0, iat= 771, 787, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70, &end
#
# 54 SER HB3 69 ALA QB 4.60
&rst
ixpk= 0, nxpk= 0, iat= 771, -1, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
igr2= 970, 971, 972,
&end
#
# 54 SER HB3 69 ALA QB 4.60
&rst
ixpk= 0, nxpk= 0, iat= 771, -1, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
igr2= 970, 971, 972,
&end
#
# 54 SER HB3 69 ALA QB 4.60
&rst
ixpk= 0, nxpk= 0, iat= 771, -1, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
igr2= 970, 971, 972,
&end
#
# 55 CYX HN 55 CYX HA 5.59
&rst
ixpk= 0, nxpk= 0, iat= 777, 779, r1= 1.30, r2= 1.80, r3= 5.59, r4= 6.09, &end
#
# 55 CYX HN 55 CYX HB2 4.66
&rst
ixpk= 0, nxpk= 0, iat= 777, 782, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16, &end
#
# 55 CYX HN 55 CYX HB3 3.39
&rst
ixpk= 0, nxpk= 0, iat= 777, 781, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89, &end
#
# 55 CYX HN 55 CYX HB3 3.39
&rst
ixpk= 0, nxpk= 0, iat= 777, 781, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89, &end
#
# 55 CYX HN 55 CYX HB3 3.39
&rst
ixpk= 0, nxpk= 0, iat= 777, 781, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89, &end
#
# 55 CYX HN 56 GLN HN 3.77
&rst
ixpk= 0, nxpk= 0, iat= 777, 787, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27, &end
#
# 55 CYX HN 56 GLN HN 3.77
&rst
ixpk= 0, nxpk= 0, iat= 777, 787, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27, &end
#
# 55 CYX HN 56 GLN HN 3.77
&rst
ixpk= 0, nxpk= 0, iat= 777, 787, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27, &end
#
# 55 CYX HN 56 GLN HN 5.28
&rst
ixpk= 0, nxpk= 0, iat= 777, 787, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 55 CYX HN 56 GLN HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 777, 789, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 55 CYX HN 56 GLN HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 777, 789, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 55 CYX HN 56 GLN HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 777, 789, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 55 CYX HN 56 GLN HNE1 5.65
&rst
ixpk= 0, nxpk= 0, iat= 777, 799, r1= 1.30, r2= 1.80, r3= 5.65, r4= 6.15, &end
#
# 55 CYX HN 56 GLN HNE1 5.65
&rst
ixpk= 0, nxpk= 0, iat= 777, 799, r1= 1.30, r2= 1.80, r3= 5.65, r4= 6.15, &end
#
# 55 CYX HN 56 GLN HNE1 5.65
&rst
ixpk= 0, nxpk= 0, iat= 777, 799, r1= 1.30, r2= 1.80, r3= 5.65, r4= 6.15, &end
#
# 55 CYX HN 56 GLN HNE2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 777, 800, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 55 CYX HN 56 GLN HNE2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 777, 800, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 55 CYX HN 56 GLN HNE2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 777, 800, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 55 CYX HN 69 ALA QB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 777, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 970, 971, 972,
&end
#
# 55 CYX HN 69 ALA QB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 777, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 970, 971, 972,
&end
#
# 55 CYX HN 69 ALA QB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 777, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 970, 971, 972,
&end
#
# 55 CYX HN 70 ALA QB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 777, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 980, 981, 982,
&end
#
# 55 CYX HN 70 ALA QB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 777, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 980, 981, 982,
&end
#
# 55 CYX HN 70 ALA QB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 777, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 980, 981, 982,
&end
#
# 55 CYX HN 152 VAL QG1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 777, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=2141,2142,2143,
&end
#
# 55 CYX HN 152 VAL QG1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 777, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=2141,2142,2143,
&end
#
# 55 CYX HN 152 VAL QG1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 777, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=2141,2142,2143,
&end
#
# 55 CYX HN 152 VAL QG2 4.76
&rst
ixpk= 0, nxpk= 0, iat= 777, -1, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
igr2=2145,2146,2147,
&end
#
# 55 CYX HN 152 VAL QG2 4.76
&rst
ixpk= 0, nxpk= 0, iat= 777, -1, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
igr2=2145,2146,2147,
&end
#
# 55 CYX HN 152 VAL QG2 4.76
&rst
ixpk= 0, nxpk= 0, iat= 777, -1, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
igr2=2145,2146,2147,
&end
#
# 55 CYX HA 55 CYX HB2 3.96
&rst
ixpk= 0, nxpk= 0, iat= 779, 782, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46, &end
#
# 55 CYX HA 55 CYX HB3 4.22
&rst
ixpk= 0, nxpk= 0, iat= 779, 781, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 55 CYX HA 56 GLN HN 2.97
&rst
ixpk= 0, nxpk= 0, iat= 779, 787, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 55 CYX HA 56 GLN HNE2 5.92
&rst
ixpk= 0, nxpk= 0, iat= 779, 800, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42, &end
#
# 55 CYX HA 56 GLN HNE2 5.92
&rst
ixpk= 0, nxpk= 0, iat= 779, 800, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42, &end
#
# 55 CYX HA 56 GLN HNE2 5.92
&rst
ixpk= 0, nxpk= 0, iat= 779, 800, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42, &end
#
# 55 CYX HA 67 ALA HA 5.32
&rst
ixpk= 0, nxpk= 0, iat= 779, 943, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82, &end
#
# 55 CYX HA 67 ALA HA 5.32
&rst
ixpk= 0, nxpk= 0, iat= 779, 943, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82, &end
#
# 55 CYX HA 67 ALA HA 5.32
&rst
ixpk= 0, nxpk= 0, iat= 779, 943, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82, &end
#
# 55 CYX HA 67 ALA QB 4.96
&rst
ixpk= 0, nxpk= 0, iat= 779, -1, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
igr2= 945, 946, 947,
&end
#
# 55 CYX HA 67 ALA QB 4.96
&rst
ixpk= 0, nxpk= 0, iat= 779, -1, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
igr2= 945, 946, 947,
&end
#
# 55 CYX HA 67 ALA QB 4.96
&rst
ixpk= 0, nxpk= 0, iat= 779, -1, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46,
igr2= 945, 946, 947,
&end
#
# 55 CYX HA 69 ALA QB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 779, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 970, 971, 972,
&end
#
# 55 CYX HA 69 ALA QB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 779, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 970, 971, 972,
&end
#
# 55 CYX HA 69 ALA QB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 779, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 970, 971, 972,
&end
#
# 55 CYX HA 70 ALA QB 5.73
&rst
ixpk= 0, nxpk= 0, iat= 779, -1, r1= 1.30, r2= 1.80, r3= 6.88, r4= 7.38,
igr2= 980, 981, 982,
&end
#
# 55 CYX HA 70 ALA QB 5.73
&rst
ixpk= 0, nxpk= 0, iat= 779, -1, r1= 1.30, r2= 1.80, r3= 6.88, r4= 7.38,
igr2= 980, 981, 982,
&end
#
# 55 CYX HA 70 ALA QB 5.73
&rst
ixpk= 0, nxpk= 0, iat= 779, -1, r1= 1.30, r2= 1.80, r3= 6.88, r4= 7.38,
igr2= 980, 981, 982,
&end
#
# 55 CYX HA 150 CYX HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 779,2122, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 55 CYX HA 150 CYX HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 779,2122, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 55 CYX HA 150 CYX HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 779,2122, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 55 CYX HB2 55 CYX HB3 3.85
&rst
ixpk= 0, nxpk= 0, iat= 782, 781, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35, &end
#
# 55 CYX HB2 56 GLN HN 5.72
&rst
ixpk= 0, nxpk= 0, iat= 782, 787, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 55 CYX HB2 56 GLN HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 782, 787, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 55 CYX HB2 56 GLN HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 782, 787, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 55 CYX HB2 56 GLN HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 782, 787, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 55 CYX HB2 56 GLN HNE1 5.65
&rst
ixpk= 0, nxpk= 0, iat= 782, 799, r1= 1.30, r2= 1.80, r3= 5.65, r4= 6.15, &end
#
# 55 CYX HB2 56 GLN HNE1 5.65
&rst
ixpk= 0, nxpk= 0, iat= 782, 799, r1= 1.30, r2= 1.80, r3= 5.65, r4= 6.15, &end
#
# 55 CYX HB2 56 GLN HNE1 5.65
&rst
ixpk= 0, nxpk= 0, iat= 782, 799, r1= 1.30, r2= 1.80, r3= 5.65, r4= 6.15, &end
#
# 55 CYX HB2 150 CYX HB3 3.89
&rst
ixpk= 0, nxpk= 0, iat= 782,2122, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39, &end
#
# 55 CYX HB2 150 CYX HB3 3.89
&rst
ixpk= 0, nxpk= 0, iat= 782,2122, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39, &end
#
# 55 CYX HB2 150 CYX HB3 3.89
&rst
ixpk= 0, nxpk= 0, iat= 782,2122, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39, &end
#
# 55 CYX HB3 56 GLN HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 781, 787, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 55 CYX HB3 56 GLN HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 781, 787, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 55 CYX HB3 56 GLN HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 781, 787, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 56 GLN HN 56 GLN HA 4.33
&rst
ixpk= 0, nxpk= 0, iat= 787, 789, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83, &end
#
# 56 GLN HN 56 GLN HB2 4.41
&rst
ixpk= 0, nxpk= 0, iat= 787, 791, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, &end
#
# 56 GLN HN 56 GLN HB2 4.41
&rst
ixpk= 0, nxpk= 0, iat= 787, 791, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, &end
#
# 56 GLN HN 56 GLN HB2 4.41
&rst
ixpk= 0, nxpk= 0, iat= 787, 791, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, &end
#
# 56 GLN HN 56 GLN HB3 4.10
&rst
ixpk= 0, nxpk= 0, iat= 787, 792, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60, &end
#
# 56 GLN HN 56 GLN HB3 4.10
&rst
ixpk= 0, nxpk= 0, iat= 787, 792, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60, &end
#
# 56 GLN HN 56 GLN HB3 4.10
&rst
ixpk= 0, nxpk= 0, iat= 787, 792, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60, &end
#
# 56 GLN HN 56 GLN HG2 4.41
&rst
ixpk= 0, nxpk= 0, iat= 787, 794, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, &end
#
# 56 GLN HN 56 GLN HG2 4.41
&rst
ixpk= 0, nxpk= 0, iat= 787, 794, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, &end
#
# 56 GLN HN 56 GLN HG2 4.41
&rst
ixpk= 0, nxpk= 0, iat= 787, 794, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, &end
#
# 56 GLN HN 56 GLN HG3 4.54
&rst
ixpk= 0, nxpk= 0, iat= 787, 795, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 56 GLN HN 56 GLN HG3 4.54
&rst
ixpk= 0, nxpk= 0, iat= 787, 795, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 56 GLN HN 56 GLN HG3 4.54
&rst
ixpk= 0, nxpk= 0, iat= 787, 795, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 56 GLN HN 57 PRO HD2 4.88
&rst
ixpk= 0, nxpk= 0, iat= 787, 805, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38, &end
#
# 56 GLN HN 57 PRO HD2 4.88
&rst
ixpk= 0, nxpk= 0, iat= 787, 805, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38, &end
#
# 56 GLN HN 57 PRO HD2 4.88
&rst
ixpk= 0, nxpk= 0, iat= 787, 805, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38, &end
#
# 56 GLN HN 67 ALA QB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 787, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 945, 946, 947,
&end
#
# 56 GLN HN 67 ALA QB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 787, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 945, 946, 947,
&end
#
# 56 GLN HN 67 ALA QB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 787, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 945, 946, 947,
&end
#
# 56 GLN HN 69 ALA QB 4.21
&rst
ixpk= 0, nxpk= 0, iat= 787, -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
igr2= 970, 971, 972,
&end
#
# 56 GLN HN 69 ALA QB 4.21
&rst
ixpk= 0, nxpk= 0, iat= 787, -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
igr2= 970, 971, 972,
&end
#
# 56 GLN HN 69 ALA QB 4.21
&rst
ixpk= 0, nxpk= 0, iat= 787, -1, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56,
igr2= 970, 971, 972,
&end
#
# 56 GLN HA 56 GLN HB2 4.48
&rst
ixpk= 0, nxpk= 0, iat= 789, 791, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98, &end
#
# 56 GLN HA 56 GLN HB3 5.08
&rst
ixpk= 0, nxpk= 0, iat= 789, 792, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58, &end
#
# 56 GLN HA 56 GLN HNE2 5.35
&rst
ixpk= 0, nxpk= 0, iat= 789, 800, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85, &end
#
# 56 GLN HA 56 GLN HNE2 5.35
&rst
ixpk= 0, nxpk= 0, iat= 789, 800, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85, &end
#
# 56 GLN HA 56 GLN HNE2 5.35
&rst
ixpk= 0, nxpk= 0, iat= 789, 800, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85, &end
#
# 56 GLN HA 56 GLN HG2 5.12
&rst
ixpk= 0, nxpk= 0, iat= 789, 794, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, &end
#
# 56 GLN HA 56 GLN HG3 4.83
&rst
ixpk= 0, nxpk= 0, iat= 789, 795, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33, &end
#
# 56 GLN HA 57 PRO HD3 3.89
&rst
ixpk= 0, nxpk= 0, iat= 789, 806, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39, &end
#
# 56 GLN HA 57 PRO HD3 3.89
&rst
ixpk= 0, nxpk= 0, iat= 789, 806, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39, &end
#
# 56 GLN HA 57 PRO HD3 3.89
&rst
ixpk= 0, nxpk= 0, iat= 789, 806, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39, &end
#
# 56 GLN HA 57 PRO QG 5.84
&rst
ixpk= 0, nxpk= 0, iat= 789, -1, r1= 1.30, r2= 1.80, r3= 6.56, r4= 7.06,
igr2= 808, 809,
&end
#
# 56 GLN HA 57 PRO QG 5.84
&rst
ixpk= 0, nxpk= 0, iat= 789, -1, r1= 1.30, r2= 1.80, r3= 6.56, r4= 7.06,
igr2= 808, 809,
&end
#
# 56 GLN HA 57 PRO QG 5.84
&rst
ixpk= 0, nxpk= 0, iat= 789, -1, r1= 1.30, r2= 1.80, r3= 6.56, r4= 7.06,
igr2= 808, 809,
&end
#
# 56 GLN HB2 56 GLN HNE2 5.80
&rst
ixpk= 0, nxpk= 0, iat= 791, 800, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30, &end
#
# 56 GLN HB2 56 GLN HNE2 5.80
&rst
ixpk= 0, nxpk= 0, iat= 791, 800, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30, &end
#
# 56 GLN HB2 56 GLN HNE2 5.80
&rst
ixpk= 0, nxpk= 0, iat= 791, 800, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30, &end
#
# 56 GLN HB2 57 PRO HD2 5.85
&rst
ixpk= 0, nxpk= 0, iat= 791, 805, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35, &end
#
# 56 GLN HB2 57 PRO HD2 5.85
&rst
ixpk= 0, nxpk= 0, iat= 791, 805, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35, &end
#
# 56 GLN HB2 57 PRO HD2 5.85
&rst
ixpk= 0, nxpk= 0, iat= 791, 805, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35, &end
#
# 56 GLN HB2 69 ALA QB 4.50
&rst
ixpk= 0, nxpk= 0, iat= 791, -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr2= 970, 971, 972,
&end
#
# 56 GLN HB2 69 ALA QB 4.50
&rst
ixpk= 0, nxpk= 0, iat= 791, -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr2= 970, 971, 972,
&end
#
# 56 GLN HB2 69 ALA QB 4.50
&rst
ixpk= 0, nxpk= 0, iat= 791, -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr2= 970, 971, 972,
&end
#
# 56 GLN HB3 56 GLN HB2 4.77
&rst
ixpk= 0, nxpk= 0, iat= 792, 791, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27, &end
#
# 56 GLN HB3 56 GLN HNE2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 792, 800, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 56 GLN HB3 56 GLN HNE2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 792, 800, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 56 GLN HB3 56 GLN HNE2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 792, 800, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 56 GLN HB3 56 GLN HG3 4.42
&rst
ixpk= 0, nxpk= 0, iat= 792, 795, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92, &end
#
# 56 GLN HB3 57 PRO HD3 5.48
&rst
ixpk= 0, nxpk= 0, iat= 792, 806, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98, &end
#
# 56 GLN HB3 57 PRO HD3 5.48
&rst
ixpk= 0, nxpk= 0, iat= 792, 806, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98, &end
#
# 56 GLN HB3 57 PRO HD3 5.48
&rst
ixpk= 0, nxpk= 0, iat= 792, 806, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98, &end
#
# 56 GLN HNE2 56 GLN HNE1 3.02
&rst
ixpk= 0, nxpk= 0, iat= 800, 799, r1= 1.30, r2= 1.80, r3= 3.02, r4= 3.52, &end
#
# 56 GLN HG2 56 GLN HNE1 4.90
&rst
ixpk= 0, nxpk= 0, iat= 794, 799, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40, &end
#
# 56 GLN HG2 56 GLN HNE2 4.85
&rst
ixpk= 0, nxpk= 0, iat= 794, 800, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35, &end
#
# 56 GLN HG3 56 GLN HNE1 4.52
&rst
ixpk= 0, nxpk= 0, iat= 795, 799, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02, &end
#
# 56 GLN HG3 56 GLN HNE2 4.80
&rst
ixpk= 0, nxpk= 0, iat= 795, 800, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30, &end
#
# 56 GLN HG3 56 GLN HG2 3.10
&rst
ixpk= 0, nxpk= 0, iat= 795, 794, r1= 1.30, r2= 1.80, r3= 3.10, r4= 3.60, &end
#
# 56 GLN HG3 69 ALA QB 5.45
&rst
ixpk= 0, nxpk= 0, iat= 795, -1, r1= 1.30, r2= 1.80, r3= 6.55, r4= 7.05,
igr2= 970, 971, 972,
&end
#
# 56 GLN HG3 69 ALA QB 5.45
&rst
ixpk= 0, nxpk= 0, iat= 795, -1, r1= 1.30, r2= 1.80, r3= 6.55, r4= 7.05,
igr2= 970, 971, 972,
&end
#
# 56 GLN HG3 69 ALA QB 5.45
&rst
ixpk= 0, nxpk= 0, iat= 795, -1, r1= 1.30, r2= 1.80, r3= 6.55, r4= 7.05,
igr2= 970, 971, 972,
&end
#
# 57 PRO HA 58 ALA HN 2.97
&rst
ixpk= 0, nxpk= 0, iat= 814, 818, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 57 PRO HA 58 ALA HN 3.59
&rst
ixpk= 0, nxpk= 0, iat= 814, 818, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09, &end
#
# 57 PRO HA 58 ALA HN 3.59
&rst
ixpk= 0, nxpk= 0, iat= 814, 818, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09, &end
#
# 57 PRO HA 58 ALA HN 3.59
&rst
ixpk= 0, nxpk= 0, iat= 814, 818, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09, &end
#
# 57 PRO HA 64 ALA QB 6.04
&rst
ixpk= 0, nxpk= 0, iat= 814, -1, r1= 1.30, r2= 1.80, r3= 7.25, r4= 7.75,
igr2= 909, 910, 911,
&end
#
# 57 PRO HA 64 ALA QB 6.04
&rst
ixpk= 0, nxpk= 0, iat= 814, -1, r1= 1.30, r2= 1.80, r3= 7.25, r4= 7.75,
igr2= 909, 910, 911,
&end
#
# 57 PRO HA 64 ALA QB 6.04
&rst
ixpk= 0, nxpk= 0, iat= 814, -1, r1= 1.30, r2= 1.80, r3= 7.25, r4= 7.75,
igr2= 909, 910, 911,
&end
#
# 57 PRO HA 65 VAL HN 5.97
&rst
ixpk= 0, nxpk= 0, iat= 814, 915, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47, &end
#
# 57 PRO HA 65 VAL HN 5.97
&rst
ixpk= 0, nxpk= 0, iat= 814, 915, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47, &end
#
# 57 PRO HA 65 VAL HN 5.97
&rst
ixpk= 0, nxpk= 0, iat= 814, 915, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47, &end
#
# 57 PRO HA 67 ALA HN 4.77
&rst
ixpk= 0, nxpk= 0, iat= 814, 941, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27, &end
#
# 57 PRO HA 67 ALA HN 4.77
&rst
ixpk= 0, nxpk= 0, iat= 814, 941, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27, &end
#
# 57 PRO HA 67 ALA HN 4.77
&rst
ixpk= 0, nxpk= 0, iat= 814, 941, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27, &end
#
# 57 PRO HA 67 ALA HA 4.32
&rst
ixpk= 0, nxpk= 0, iat= 814, 943, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82, &end
#
# 57 PRO HA 67 ALA HA 4.32
&rst
ixpk= 0, nxpk= 0, iat= 814, 943, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82, &end
#
# 57 PRO HA 67 ALA HA 4.32
&rst
ixpk= 0, nxpk= 0, iat= 814, 943, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82, &end
#
# 57 PRO HA 67 ALA QB 5.22
&rst
ixpk= 0, nxpk= 0, iat= 814, -1, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
igr2= 945, 946, 947,
&end
#
# 57 PRO HA 67 ALA QB 5.22
&rst
ixpk= 0, nxpk= 0, iat= 814, -1, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
igr2= 945, 946, 947,
&end
#
# 57 PRO HA 67 ALA QB 5.22
&rst
ixpk= 0, nxpk= 0, iat= 814, -1, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
igr2= 945, 946, 947,
&end
#
# 57 PRO HA 68 GLU HN 3.83
&rst
ixpk= 0, nxpk= 0, iat= 814, 951, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33, &end
#
# 57 PRO HA 68 GLU HN 3.83
&rst
ixpk= 0, nxpk= 0, iat= 814, 951, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33, &end
#
# 57 PRO HA 68 GLU HN 3.83
&rst
ixpk= 0, nxpk= 0, iat= 814, 951, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33, &end
#
# 57 PRO HA 68 GLU HA 5.68
&rst
ixpk= 0, nxpk= 0, iat= 814, 953, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18, &end
#
# 57 PRO HA 68 GLU HA 5.68
&rst
ixpk= 0, nxpk= 0, iat= 814, 953, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18, &end
#
# 57 PRO HA 68 GLU HA 5.68
&rst
ixpk= 0, nxpk= 0, iat= 814, 953, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18, &end
#
# 57 PRO HA 68 GLU HB2 5.68
&rst
ixpk= 0, nxpk= 0, iat= 814, 955, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18, &end
#
# 57 PRO HA 68 GLU HB2 5.68
&rst
ixpk= 0, nxpk= 0, iat= 814, 955, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18, &end
#
# 57 PRO HA 68 GLU HB2 5.68
&rst
ixpk= 0, nxpk= 0, iat= 814, 955, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18, &end
#
# 57 PRO HA 69 ALA HN 5.06
&rst
ixpk= 0, nxpk= 0, iat= 814, 966, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56, &end
#
# 57 PRO HA 69 ALA HN 5.06
&rst
ixpk= 0, nxpk= 0, iat= 814, 966, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56, &end
#
# 57 PRO HA 69 ALA HN 5.06
&rst
ixpk= 0, nxpk= 0, iat= 814, 966, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56, &end
#
# 57 PRO HB2 57 PRO HA 4.07
&rst
ixpk= 0, nxpk= 0, iat= 811, 814, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57, &end
#
# 57 PRO HB2 58 ALA HN 4.21
&rst
ixpk= 0, nxpk= 0, iat= 811, 818, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71, &end
#
# 57 PRO HB2 58 ALA HN 4.21
&rst
ixpk= 0, nxpk= 0, iat= 811, 818, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71, &end
#
# 57 PRO HB2 58 ALA HN 4.21
&rst
ixpk= 0, nxpk= 0, iat= 811, 818, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71, &end
#
# 57 PRO HB2 58 ALA HN 5.72
&rst
ixpk= 0, nxpk= 0, iat= 811, 818, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 57 PRO HB2 64 ALA QB 4.91
&rst
ixpk= 0, nxpk= 0, iat= 811, -1, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
igr2= 909, 910, 911,
&end
#
# 57 PRO HB2 64 ALA QB 4.91
&rst
ixpk= 0, nxpk= 0, iat= 811, -1, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
igr2= 909, 910, 911,
&end
#
# 57 PRO HB2 64 ALA QB 4.91
&rst
ixpk= 0, nxpk= 0, iat= 811, -1, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40,
igr2= 909, 910, 911,
&end
#
# 57 PRO HB2 66 ALA HA 4.69
&rst
ixpk= 0, nxpk= 0, iat= 811, 933, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, &end
#
# 57 PRO HB2 66 ALA HA 4.69
&rst
ixpk= 0, nxpk= 0, iat= 811, 933, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, &end
#
# 57 PRO HB2 66 ALA HA 4.69
&rst
ixpk= 0, nxpk= 0, iat= 811, 933, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, &end
#
# 57 PRO HB2 67 ALA HN 4.59
&rst
ixpk= 0, nxpk= 0, iat= 811, 941, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 57 PRO HB2 67 ALA HN 4.59
&rst
ixpk= 0, nxpk= 0, iat= 811, 941, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 57 PRO HB2 67 ALA HN 4.59
&rst
ixpk= 0, nxpk= 0, iat= 811, 941, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 57 PRO HB2 67 ALA HA 4.57
&rst
ixpk= 0, nxpk= 0, iat= 811, 943, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07, &end
#
# 57 PRO HB2 67 ALA HA 4.57
&rst
ixpk= 0, nxpk= 0, iat= 811, 943, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07, &end
#
# 57 PRO HB2 67 ALA HA 4.57
&rst
ixpk= 0, nxpk= 0, iat= 811, 943, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07, &end
#
# 57 PRO HB2 68 GLU HN 4.88
&rst
ixpk= 0, nxpk= 0, iat= 811, 951, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38, &end
#
# 57 PRO HB2 68 GLU HN 4.88
&rst
ixpk= 0, nxpk= 0, iat= 811, 951, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38, &end
#
# 57 PRO HB2 68 GLU HN 4.88
&rst
ixpk= 0, nxpk= 0, iat= 811, 951, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38, &end
#
# 57 PRO HB3 57 PRO HA 4.07
&rst
ixpk= 0, nxpk= 0, iat= 812, 814, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57, &end
#
# 57 PRO HB3 57 PRO HB2 3.38
&rst
ixpk= 0, nxpk= 0, iat= 812, 811, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88, &end
#
# 57 PRO HB3 58 ALA HN 4.04
&rst
ixpk= 0, nxpk= 0, iat= 812, 818, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, &end
#
# 57 PRO HB3 58 ALA HN 4.04
&rst
ixpk= 0, nxpk= 0, iat= 812, 818, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, &end
#
# 57 PRO HB3 58 ALA HN 4.04
&rst
ixpk= 0, nxpk= 0, iat= 812, 818, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, &end
#
# 57 PRO HB3 65 VAL HN 5.36
&rst
ixpk= 0, nxpk= 0, iat= 812, 915, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86, &end
#
# 57 PRO HB3 65 VAL HN 5.36
&rst
ixpk= 0, nxpk= 0, iat= 812, 915, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86, &end
#
# 57 PRO HB3 65 VAL HN 5.36
&rst
ixpk= 0, nxpk= 0, iat= 812, 915, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86, &end
#
# 57 PRO HB3 66 ALA HA 5.05
&rst
ixpk= 0, nxpk= 0, iat= 812, 933, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55, &end
#
# 57 PRO HB3 66 ALA HA 5.05
&rst
ixpk= 0, nxpk= 0, iat= 812, 933, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55, &end
#
# 57 PRO HB3 66 ALA HA 5.05
&rst
ixpk= 0, nxpk= 0, iat= 812, 933, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55, &end
#
# 57 PRO HB3 67 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 812, 941, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 57 PRO HB3 67 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 812, 941, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 57 PRO HB3 67 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 812, 941, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 57 PRO HB3 68 GLU HN 5.27
&rst
ixpk= 0, nxpk= 0, iat= 812, 951, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77, &end
#
# 57 PRO HB3 68 GLU HN 5.27
&rst
ixpk= 0, nxpk= 0, iat= 812, 951, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77, &end
#
# 57 PRO HB3 68 GLU HN 5.27
&rst
ixpk= 0, nxpk= 0, iat= 812, 951, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77, &end
#
# 57 PRO HD2 57 PRO HD3 2.64
&rst
ixpk= 0, nxpk= 0, iat= 805, 806, r1= 1.30, r2= 1.80, r3= 2.64, r4= 3.14, &end
#
# 57 PRO HD2 67 ALA QB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 805, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 945, 946, 947,
&end
#
# 57 PRO HD2 67 ALA QB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 805, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 945, 946, 947,
&end
#
# 57 PRO HD2 67 ALA QB 6.05
&rst
ixpk= 0, nxpk= 0, iat= 805, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 945, 946, 947,
&end
#
# 57 PRO HD3 57 PRO HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= 806, 814, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 57 PRO HD3 57 PRO QG 4.33
&rst
ixpk= 0, nxpk= 0, iat= 806, -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
igr2= 808, 809,
&end
#
# 57 PRO QG 58 ALA HN 5.13
&rst
ixpk= 0, nxpk= 0, iat= -1, 818, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
igr1= 808, 809,
&end
#
# 57 PRO QG 58 ALA HN 5.13
&rst
ixpk= 0, nxpk= 0, iat= -1, 818, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
igr1= 808, 809,
&end
#
# 57 PRO QG 58 ALA HN 5.13
&rst
ixpk= 0, nxpk= 0, iat= -1, 818, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
igr1= 808, 809,
&end
#
# 57 PRO QG 64 ALA QB 5.81
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.83, r4= 8.33,
igr1= 808, 809,
igr2= 909, 910, 911,
&end
#
# 57 PRO QG 64 ALA QB 5.81
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.83, r4= 8.33,
igr1= 808, 809,
igr2= 909, 910, 911,
&end
#
# 57 PRO QG 64 ALA QB 5.81
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.83, r4= 8.33,
igr1= 808, 809,
igr2= 909, 910, 911,
&end
#
# 57 PRO QG 66 ALA HA 5.42
&rst
ixpk= 0, nxpk= 0, iat= -1, 933, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
igr1= 808, 809,
&end
#
# 57 PRO QG 66 ALA HA 5.42
&rst
ixpk= 0, nxpk= 0, iat= -1, 933, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
igr1= 808, 809,
&end
#
# 57 PRO QG 66 ALA HA 5.42
&rst
ixpk= 0, nxpk= 0, iat= -1, 933, r1= 1.30, r2= 1.80, r3= 6.08, r4= 6.58,
igr1= 808, 809,
&end
#
# 58 ALA HN 58 ALA HA 4.12
&rst
ixpk= 0, nxpk= 0, iat= 818, 820, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62, &end
#
# 58 ALA HN 58 ALA QB 4.07
&rst
ixpk= 0, nxpk= 0, iat= 818, -1, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
igr2= 822, 823, 824,
&end
#
# 58 ALA HN 58 ALA QB 4.07
&rst
ixpk= 0, nxpk= 0, iat= 818, -1, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
igr2= 822, 823, 824,
&end
#
# 58 ALA HN 58 ALA QB 4.07
&rst
ixpk= 0, nxpk= 0, iat= 818, -1, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
igr2= 822, 823, 824,
&end
#
# 58 ALA HN 59 ILE HN 5.28
&rst
ixpk= 0, nxpk= 0, iat= 818, 828, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 58 ALA HN 59 ILE HN 5.62
&rst
ixpk= 0, nxpk= 0, iat= 818, 828, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12, &end
#
# 58 ALA HN 59 ILE HN 5.62
&rst
ixpk= 0, nxpk= 0, iat= 818, 828, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12, &end
#
# 58 ALA HN 59 ILE HN 5.62
&rst
ixpk= 0, nxpk= 0, iat= 818, 828, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12, &end
#
# 58 ALA HN 59 ILE QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 818, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 841, 842, 843,
&end
#
# 58 ALA HN 59 ILE QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 818, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 841, 842, 843,
&end
#
# 58 ALA HN 59 ILE QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 818, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 841, 842, 843,
&end
#
# 58 ALA HN 60 LYS HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 818, 847, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 58 ALA HN 60 LYS HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 818, 847, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 58 ALA HN 60 LYS HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 818, 847, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 58 ALA HN 64 ALA HA 4.61
&rst
ixpk= 0, nxpk= 0, iat= 818, 907, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 58 ALA HN 64 ALA HA 4.61
&rst
ixpk= 0, nxpk= 0, iat= 818, 907, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 58 ALA HN 64 ALA HA 4.61
&rst
ixpk= 0, nxpk= 0, iat= 818, 907, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 58 ALA HN 64 ALA QB 5.16
&rst
ixpk= 0, nxpk= 0, iat= 818, -1, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
igr2= 909, 910, 911,
&end
#
# 58 ALA HN 64 ALA QB 5.16
&rst
ixpk= 0, nxpk= 0, iat= 818, -1, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
igr2= 909, 910, 911,
&end
#
# 58 ALA HN 64 ALA QB 5.16
&rst
ixpk= 0, nxpk= 0, iat= 818, -1, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
igr2= 909, 910, 911,
&end
#
# 58 ALA HN 65 VAL HN 3.84
&rst
ixpk= 0, nxpk= 0, iat= 818, 915, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34, &end
#
# 58 ALA HN 65 VAL HN 3.84
&rst
ixpk= 0, nxpk= 0, iat= 818, 915, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34, &end
#
# 58 ALA HN 65 VAL HN 3.84
&rst
ixpk= 0, nxpk= 0, iat= 818, 915, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34, &end
#
# 58 ALA HN 65 VAL HB 4.57
&rst
ixpk= 0, nxpk= 0, iat= 818, 919, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07, &end
#
# 58 ALA HN 65 VAL HB 4.57
&rst
ixpk= 0, nxpk= 0, iat= 818, 919, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07, &end
#
# 58 ALA HN 65 VAL HB 4.57
&rst
ixpk= 0, nxpk= 0, iat= 818, 919, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07, &end
#
# 58 ALA HN 65 VAL QG2 4.85
&rst
ixpk= 0, nxpk= 0, iat= 818, -1, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32,
igr2= 925, 926, 927,
&end
#
# 58 ALA HN 65 VAL QG2 4.85
&rst
ixpk= 0, nxpk= 0, iat= 818, -1, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32,
igr2= 925, 926, 927,
&end
#
# 58 ALA HN 65 VAL QG2 4.85
&rst
ixpk= 0, nxpk= 0, iat= 818, -1, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32,
igr2= 925, 926, 927,
&end
#
# 58 ALA HN 66 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 818, 931, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 58 ALA HN 66 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 818, 931, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 58 ALA HN 66 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 818, 931, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 58 ALA HN 67 ALA HN 5.37
&rst
ixpk= 0, nxpk= 0, iat= 818, 941, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87, &end
#
# 58 ALA HN 67 ALA HN 5.37
&rst
ixpk= 0, nxpk= 0, iat= 818, 941, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87, &end
#
# 58 ALA HN 67 ALA HN 5.37
&rst
ixpk= 0, nxpk= 0, iat= 818, 941, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87, &end
#
# 58 ALA HN 67 ALA HA 4.51
&rst
ixpk= 0, nxpk= 0, iat= 818, 943, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01, &end
#
# 58 ALA HN 67 ALA HA 4.51
&rst
ixpk= 0, nxpk= 0, iat= 818, 943, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01, &end
#
# 58 ALA HN 67 ALA HA 4.51
&rst
ixpk= 0, nxpk= 0, iat= 818, 943, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01, &end
#
# 58 ALA HN 68 GLU HN 4.19
&rst
ixpk= 0, nxpk= 0, iat= 818, 951, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69, &end
#
# 58 ALA HN 68 GLU HN 4.19
&rst
ixpk= 0, nxpk= 0, iat= 818, 951, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69, &end
#
# 58 ALA HN 68 GLU HN 4.19
&rst
ixpk= 0, nxpk= 0, iat= 818, 951, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69, &end
#
# 58 ALA HN 68 GLU HA 4.81
&rst
ixpk= 0, nxpk= 0, iat= 818, 953, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31, &end
#
# 58 ALA HN 68 GLU HA 4.81
&rst
ixpk= 0, nxpk= 0, iat= 818, 953, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31, &end
#
# 58 ALA HN 68 GLU HA 4.81
&rst
ixpk= 0, nxpk= 0, iat= 818, 953, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31, &end
#
# 58 ALA HN 68 GLU HB2 4.04
&rst
ixpk= 0, nxpk= 0, iat= 818, 955, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, &end
#
# 58 ALA HN 68 GLU HB2 4.04
&rst
ixpk= 0, nxpk= 0, iat= 818, 955, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, &end
#
# 58 ALA HN 68 GLU HB2 4.04
&rst
ixpk= 0, nxpk= 0, iat= 818, 955, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, &end
#
# 58 ALA HN 68 GLU HB3 3.93
&rst
ixpk= 0, nxpk= 0, iat= 818, 956, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43, &end
#
# 58 ALA HN 68 GLU HB3 3.93
&rst
ixpk= 0, nxpk= 0, iat= 818, 956, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43, &end
#
# 58 ALA HN 68 GLU HB3 3.93
&rst
ixpk= 0, nxpk= 0, iat= 818, 956, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43, &end
#
# 58 ALA HN 68 GLU HG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 818, 958, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 58 ALA HN 68 GLU HG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 818, 958, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 58 ALA HN 68 GLU HG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 818, 958, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 58 ALA HN 68 GLU HG3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 818, 959, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 58 ALA HN 68 GLU HG3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 818, 959, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 58 ALA HN 68 GLU HG3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 818, 959, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 58 ALA HN 69 ALA HN 5.40
&rst
ixpk= 0, nxpk= 0, iat= 818, 966, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90, &end
#
# 58 ALA HN 69 ALA HN 5.40
&rst
ixpk= 0, nxpk= 0, iat= 818, 966, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90, &end
#
# 58 ALA HN 69 ALA HN 5.40
&rst
ixpk= 0, nxpk= 0, iat= 818, 966, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90, &end
#
# 58 ALA HA 59 ILE HN 2.97
&rst
ixpk= 0, nxpk= 0, iat= 820, 828, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 58 ALA HA 59 ILE HN 3.28
&rst
ixpk= 0, nxpk= 0, iat= 820, 828, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78, &end
#
# 58 ALA HA 59 ILE HN 3.28
&rst
ixpk= 0, nxpk= 0, iat= 820, 828, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78, &end
#
# 58 ALA HA 59 ILE HN 3.28
&rst
ixpk= 0, nxpk= 0, iat= 820, 828, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78, &end
#
# 58 ALA HA 59 ILE HG13 5.47
&rst
ixpk= 0, nxpk= 0, iat= 820, 839, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97, &end
#
# 58 ALA HA 59 ILE HG13 5.47
&rst
ixpk= 0, nxpk= 0, iat= 820, 839, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97, &end
#
# 58 ALA HA 59 ILE HG13 5.47
&rst
ixpk= 0, nxpk= 0, iat= 820, 839, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97, &end
#
# 58 ALA HA 59 ILE QD1 5.53
&rst
ixpk= 0, nxpk= 0, iat= 820, -1, r1= 1.30, r2= 1.80, r3= 6.64, r4= 7.14,
igr2= 841, 842, 843,
&end
#
# 58 ALA HA 59 ILE QD1 5.53
&rst
ixpk= 0, nxpk= 0, iat= 820, -1, r1= 1.30, r2= 1.80, r3= 6.64, r4= 7.14,
igr2= 841, 842, 843,
&end
#
# 58 ALA HA 59 ILE QD1 5.53
&rst
ixpk= 0, nxpk= 0, iat= 820, -1, r1= 1.30, r2= 1.80, r3= 6.64, r4= 7.14,
igr2= 841, 842, 843,
&end
#
# 58 ALA HA 64 ALA QB 5.47
&rst
ixpk= 0, nxpk= 0, iat= 820, -1, r1= 1.30, r2= 1.80, r3= 6.57, r4= 7.07,
igr2= 909, 910, 911,
&end
#
# 58 ALA HA 64 ALA QB 5.47
&rst
ixpk= 0, nxpk= 0, iat= 820, -1, r1= 1.30, r2= 1.80, r3= 6.57, r4= 7.07,
igr2= 909, 910, 911,
&end
#
# 58 ALA HA 64 ALA QB 5.47
&rst
ixpk= 0, nxpk= 0, iat= 820, -1, r1= 1.30, r2= 1.80, r3= 6.57, r4= 7.07,
igr2= 909, 910, 911,
&end
#
# 58 ALA QB 59 ILE HN 5.72
&rst
ixpk= 0, nxpk= 0, iat= -1, 828, r1= 1.30, r2= 1.80, r3= 6.87, r4= 7.37,
igr1= 822, 823, 824,
&end
#
# 58 ALA QB 58 ALA HA 3.45
&rst
ixpk= 0, nxpk= 0, iat= -1, 820, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,
igr1= 822, 823, 824,
&end
#
# 58 ALA QB 59 ILE HN 3.49
&rst
ixpk= 0, nxpk= 0, iat= -1, 828, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,
igr1= 822, 823, 824,
&end
#
# 58 ALA QB 59 ILE HN 3.49
&rst
ixpk= 0, nxpk= 0, iat= -1, 828, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,
igr1= 822, 823, 824,
&end
#
# 58 ALA QB 59 ILE HN 3.49
&rst
ixpk= 0, nxpk= 0, iat= -1, 828, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,
igr1= 822, 823, 824,
&end
#
# 58 ALA QB 60 LYS HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 847, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 822, 823, 824,
&end
#
# 58 ALA QB 60 LYS HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 847, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 822, 823, 824,
&end
#
# 58 ALA QB 60 LYS HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 847, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 822, 823, 824,
&end
#
# 58 ALA QB 68 GLU HN 4.63
&rst
ixpk= 0, nxpk= 0, iat= -1, 951, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
igr1= 822, 823, 824,
&end
#
# 58 ALA QB 68 GLU HN 4.63
&rst
ixpk= 0, nxpk= 0, iat= -1, 951, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
igr1= 822, 823, 824,
&end
#
# 58 ALA QB 68 GLU HN 4.63
&rst
ixpk= 0, nxpk= 0, iat= -1, 951, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
igr1= 822, 823, 824,
&end
#
# 58 ALA QB 68 GLU HB3 4.93
&rst
ixpk= 0, nxpk= 0, iat= -1, 956, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
igr1= 822, 823, 824,
&end
#
# 58 ALA QB 68 GLU HB3 4.93
&rst
ixpk= 0, nxpk= 0, iat= -1, 956, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
igr1= 822, 823, 824,
&end
#
# 58 ALA QB 68 GLU HB3 4.93
&rst
ixpk= 0, nxpk= 0, iat= -1, 956, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
igr1= 822, 823, 824,
&end
#
# 59 ILE HN 59 ILE HA 3.90
&rst
ixpk= 0, nxpk= 0, iat= 828, 830, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40, &end
#
# 59 ILE HN 59 ILE HB 3.21
&rst
ixpk= 0, nxpk= 0, iat= 828, 832, r1= 1.30, r2= 1.80, r3= 3.21, r4= 3.71, &end
#
# 59 ILE HN 59 ILE HB 3.21
&rst
ixpk= 0, nxpk= 0, iat= 828, 832, r1= 1.30, r2= 1.80, r3= 3.21, r4= 3.71, &end
#
# 59 ILE HN 59 ILE HB 3.21
&rst
ixpk= 0, nxpk= 0, iat= 828, 832, r1= 1.30, r2= 1.80, r3= 3.21, r4= 3.71, &end
#
# 59 ILE HN 59 ILE HG12 3.86
&rst
ixpk= 0, nxpk= 0, iat= 828, 838, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 59 ILE HN 59 ILE HG12 3.86
&rst
ixpk= 0, nxpk= 0, iat= 828, 838, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 59 ILE HN 59 ILE HG12 3.86
&rst
ixpk= 0, nxpk= 0, iat= 828, 838, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 59 ILE HN 59 ILE HG13 4.58
&rst
ixpk= 0, nxpk= 0, iat= 828, 839, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08, &end
#
# 59 ILE HN 59 ILE HG13 4.58
&rst
ixpk= 0, nxpk= 0, iat= 828, 839, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08, &end
#
# 59 ILE HN 59 ILE HG13 4.58
&rst
ixpk= 0, nxpk= 0, iat= 828, 839, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08, &end
#
# 59 ILE HN 59 ILE QD1 3.97
&rst
ixpk= 0, nxpk= 0, iat= 828, -1, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
igr2= 841, 842, 843,
&end
#
# 59 ILE HN 59 ILE QD1 3.97
&rst
ixpk= 0, nxpk= 0, iat= 828, -1, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
igr2= 841, 842, 843,
&end
#
# 59 ILE HN 59 ILE QD1 3.97
&rst
ixpk= 0, nxpk= 0, iat= 828, -1, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
igr2= 841, 842, 843,
&end
#
# 59 ILE HN 59 ILE QG2 5.25
&rst
ixpk= 0, nxpk= 0, iat= 828, -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
igr2= 834, 835, 836,
&end
#
# 59 ILE HN 59 ILE QG2 5.25
&rst
ixpk= 0, nxpk= 0, iat= 828, -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
igr2= 834, 835, 836,
&end
#
# 59 ILE HN 59 ILE QG2 5.25
&rst
ixpk= 0, nxpk= 0, iat= 828, -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
igr2= 834, 835, 836,
&end
#
# 59 ILE HN 60 LYS HN 5.20
&rst
ixpk= 0, nxpk= 0, iat= 828, 847, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70, &end
#
# 59 ILE HN 60 LYS HN 5.20
&rst
ixpk= 0, nxpk= 0, iat= 828, 847, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70, &end
#
# 59 ILE HN 60 LYS HN 5.20
&rst
ixpk= 0, nxpk= 0, iat= 828, 847, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70, &end
#
# 59 ILE HN 65 VAL HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 828, 915, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 59 ILE HN 65 VAL HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 828, 915, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 59 ILE HN 65 VAL HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 828, 915, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 59 ILE HA 59 ILE HB 4.40
&rst
ixpk= 0, nxpk= 0, iat= 830, 832, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 59 ILE HA 59 ILE QD1 3.52
&rst
ixpk= 0, nxpk= 0, iat= 830, -1, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,
igr2= 841, 842, 843,
&end
#
# 59 ILE HA 59 ILE QD1 3.52
&rst
ixpk= 0, nxpk= 0, iat= 830, -1, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,
igr2= 841, 842, 843,
&end
#
# 59 ILE HA 59 ILE QD1 3.52
&rst
ixpk= 0, nxpk= 0, iat= 830, -1, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,
igr2= 841, 842, 843,
&end
#
# 59 ILE HA 59 ILE QG2 3.87
&rst
ixpk= 0, nxpk= 0, iat= 830, -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
igr2= 834, 835, 836,
&end
#
# 59 ILE HA 59 ILE QG2 3.87
&rst
ixpk= 0, nxpk= 0, iat= 830, -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
igr2= 834, 835, 836,
&end
#
# 59 ILE HA 59 ILE QG2 3.87
&rst
ixpk= 0, nxpk= 0, iat= 830, -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
igr2= 834, 835, 836,
&end
#
# 59 ILE HA 60 LYS HN 2.87
&rst
ixpk= 0, nxpk= 0, iat= 830, 847, r1= 1.30, r2= 1.80, r3= 2.87, r4= 3.37, &end
#
# 59 ILE HA 60 LYS HN 2.87
&rst
ixpk= 0, nxpk= 0, iat= 830, 847, r1= 1.30, r2= 1.80, r3= 2.87, r4= 3.37, &end
#
# 59 ILE HA 60 LYS HN 2.87
&rst
ixpk= 0, nxpk= 0, iat= 830, 847, r1= 1.30, r2= 1.80, r3= 2.87, r4= 3.37, &end
#
# 59 ILE HA 60 LYS HB3 5.19
&rst
ixpk= 0, nxpk= 0, iat= 830, 852, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69, &end
#
# 59 ILE HA 60 LYS HB3 5.19
&rst
ixpk= 0, nxpk= 0, iat= 830, 852, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69, &end
#
# 59 ILE HA 60 LYS HB3 5.19
&rst
ixpk= 0, nxpk= 0, iat= 830, 852, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69, &end
#
# 59 ILE HA 62 GLY HN 5.40
&rst
ixpk= 0, nxpk= 0, iat= 830, 881, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90, &end
#
# 59 ILE HA 62 GLY HN 5.40
&rst
ixpk= 0, nxpk= 0, iat= 830, 881, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90, &end
#
# 59 ILE HA 62 GLY HN 5.40
&rst
ixpk= 0, nxpk= 0, iat= 830, 881, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90, &end
#
# 59 ILE HA 63 GLN HN 4.70
&rst
ixpk= 0, nxpk= 0, iat= 830, 888, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 59 ILE HA 63 GLN HN 4.70
&rst
ixpk= 0, nxpk= 0, iat= 830, 888, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 59 ILE HA 63 GLN HN 4.70
&rst
ixpk= 0, nxpk= 0, iat= 830, 888, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 59 ILE HA 64 ALA HA 2.80
&rst
ixpk= 0, nxpk= 0, iat= 830, 907, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30, &end
#
# 59 ILE HA 64 ALA HA 2.80
&rst
ixpk= 0, nxpk= 0, iat= 830, 907, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30, &end
#
# 59 ILE HA 64 ALA HA 2.80
&rst
ixpk= 0, nxpk= 0, iat= 830, 907, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30, &end
#
# 59 ILE HA 64 ALA QB 4.67
&rst
ixpk= 0, nxpk= 0, iat= 830, -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr2= 909, 910, 911,
&end
#
# 59 ILE HA 64 ALA QB 4.67
&rst
ixpk= 0, nxpk= 0, iat= 830, -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr2= 909, 910, 911,
&end
#
# 59 ILE HA 64 ALA QB 4.67
&rst
ixpk= 0, nxpk= 0, iat= 830, -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr2= 909, 910, 911,
&end
#
# 59 ILE HA 65 VAL HN 4.39
&rst
ixpk= 0, nxpk= 0, iat= 830, 915, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89, &end
#
# 59 ILE HA 65 VAL HN 4.39
&rst
ixpk= 0, nxpk= 0, iat= 830, 915, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89, &end
#
# 59 ILE HA 65 VAL HN 4.39
&rst
ixpk= 0, nxpk= 0, iat= 830, 915, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89, &end
#
# 59 ILE HB 59 ILE HG12 4.18
&rst
ixpk= 0, nxpk= 0, iat= 832, 838, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68, &end
#
# 59 ILE HB 59 ILE QD1 4.75
&rst
ixpk= 0, nxpk= 0, iat= 832, -1, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr2= 841, 842, 843,
&end
#
# 59 ILE HB 59 ILE QG2 3.73
&rst
ixpk= 0, nxpk= 0, iat= 832, -1, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
igr2= 834, 835, 836,
&end
#
# 59 ILE HB 63 GLN HN 5.30
&rst
ixpk= 0, nxpk= 0, iat= 832, 888, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80, &end
#
# 59 ILE HB 63 GLN HN 5.30
&rst
ixpk= 0, nxpk= 0, iat= 832, 888, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80, &end
#
# 59 ILE HB 63 GLN HN 5.30
&rst
ixpk= 0, nxpk= 0, iat= 832, 888, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80, &end
#
# 59 ILE HG12 59 ILE HG13 3.15
&rst
ixpk= 0, nxpk= 0, iat= 838, 839, r1= 1.30, r2= 1.80, r3= 3.15, r4= 3.65, &end
#
# 59 ILE HG13 64 ALA HA 4.77
&rst
ixpk= 0, nxpk= 0, iat= 839, 907, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27, &end
#
# 59 ILE HG13 64 ALA HA 4.77
&rst
ixpk= 0, nxpk= 0, iat= 839, 907, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27, &end
#
# 59 ILE HG13 64 ALA HA 4.77
&rst
ixpk= 0, nxpk= 0, iat= 839, 907, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27, &end
#
# 59 ILE QD1 59 ILE HG13 3.80
&rst
ixpk= 0, nxpk= 0, iat= -1, 839, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
igr1= 841, 842, 843,
&end
#
# 59 ILE QD1 62 GLY HA3 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 884, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr1= 841, 842, 843,
&end
#
# 59 ILE QD1 62 GLY HA3 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 884, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr1= 841, 842, 843,
&end
#
# 59 ILE QD1 62 GLY HA3 6.00
&rst
ixpk= 0, nxpk= 0, iat= -1, 884, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr1= 841, 842, 843,
&end
#
# 59 ILE QD1 63 GLN HN 3.88
&rst
ixpk= 0, nxpk= 0, iat= -1, 888, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
igr1= 841, 842, 843,
&end
#
# 59 ILE QD1 63 GLN HN 3.88
&rst
ixpk= 0, nxpk= 0, iat= -1, 888, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
igr1= 841, 842, 843,
&end
#
# 59 ILE QD1 63 GLN HN 3.88
&rst
ixpk= 0, nxpk= 0, iat= -1, 888, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
igr1= 841, 842, 843,
&end
#
# 59 ILE QD1 63 GLN HA 4.71
&rst
ixpk= 0, nxpk= 0, iat= -1, 890, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr1= 841, 842, 843,
&end
#
# 59 ILE QD1 63 GLN HA 4.71
&rst
ixpk= 0, nxpk= 0, iat= -1, 890, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr1= 841, 842, 843,
&end
#
# 59 ILE QD1 63 GLN HA 4.71
&rst
ixpk= 0, nxpk= 0, iat= -1, 890, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr1= 841, 842, 843,
&end
#
# 59 ILE QD1 64 ALA HN 4.17
&rst
ixpk= 0, nxpk= 0, iat= -1, 905, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
igr1= 841, 842, 843,
&end
#
# 59 ILE QD1 64 ALA HN 4.17
&rst
ixpk= 0, nxpk= 0, iat= -1, 905, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
igr1= 841, 842, 843,
&end
#
# 59 ILE QD1 64 ALA HN 4.17
&rst
ixpk= 0, nxpk= 0, iat= -1, 905, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
igr1= 841, 842, 843,
&end
#
# 59 ILE QD1 64 ALA HA 3.81
&rst
ixpk= 0, nxpk= 0, iat= -1, 907, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
igr1= 841, 842, 843,
&end
#
# 59 ILE QD1 64 ALA HA 3.81
&rst
ixpk= 0, nxpk= 0, iat= -1, 907, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
igr1= 841, 842, 843,
&end
#
# 59 ILE QD1 64 ALA HA 3.81
&rst
ixpk= 0, nxpk= 0, iat= -1, 907, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
igr1= 841, 842, 843,
&end
#
# 59 ILE QD1 64 ALA QB 4.37
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
igr1= 841, 842, 843,
igr2= 909, 910, 911,
&end
#
# 59 ILE QD1 64 ALA QB 4.37
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
igr1= 841, 842, 843,
igr2= 909, 910, 911,
&end
#
# 59 ILE QD1 64 ALA QB 4.37
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
igr1= 841, 842, 843,
igr2= 909, 910, 911,
&end
#
# 59 ILE QD1 65 VAL HN 4.69
&rst
ixpk= 0, nxpk= 0, iat= -1, 915, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr1= 841, 842, 843,
&end
#
# 59 ILE QD1 65 VAL HN 4.69
&rst
ixpk= 0, nxpk= 0, iat= -1, 915, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr1= 841, 842, 843,
&end
#
# 59 ILE QD1 65 VAL HN 4.69
&rst
ixpk= 0, nxpk= 0, iat= -1, 915, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr1= 841, 842, 843,
&end
#
# 59 ILE QG2 59 ILE HG12 3.90
&rst
ixpk= 0, nxpk= 0, iat= -1, 838, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
igr1= 834, 835, 836,
&end
#
# 59 ILE QG2 59 ILE HG12 3.90
&rst
ixpk= 0, nxpk= 0, iat= -1, 838, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
igr1= 834, 835, 836,
&end
#
# 59 ILE QG2 59 ILE HG12 3.90
&rst
ixpk= 0, nxpk= 0, iat= -1, 838, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
igr1= 834, 835, 836,
&end
#
# 59 ILE QG2 60 LYS HN 4.38
&rst
ixpk= 0, nxpk= 0, iat= -1, 847, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr1= 834, 835, 836,
&end
#
# 59 ILE QG2 60 LYS HN 4.38
&rst
ixpk= 0, nxpk= 0, iat= -1, 847, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr1= 834, 835, 836,
&end
#
# 59 ILE QG2 60 LYS HN 4.38
&rst
ixpk= 0, nxpk= 0, iat= -1, 847, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr1= 834, 835, 836,
&end
#
# 59 ILE QG2 60 LYS HA 4.28
&rst
ixpk= 0, nxpk= 0, iat= -1, 849, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
igr1= 834, 835, 836,
&end
#
# 59 ILE QG2 60 LYS HA 4.28
&rst
ixpk= 0, nxpk= 0, iat= -1, 849, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
igr1= 834, 835, 836,
&end
#
# 59 ILE QG2 60 LYS HA 4.28
&rst
ixpk= 0, nxpk= 0, iat= -1, 849, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
igr1= 834, 835, 836,
&end
#
# 59 ILE QG2 60 LYS HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 852, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 834, 835, 836,
&end
#
# 59 ILE QG2 60 LYS HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 852, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 834, 835, 836,
&end
#
# 59 ILE QG2 60 LYS HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 852, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 834, 835, 836,
&end
#
# 59 ILE QG2 61 ASP HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 869, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 834, 835, 836,
&end
#
# 59 ILE QG2 61 ASP HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 869, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 834, 835, 836,
&end
#
# 59 ILE QG2 61 ASP HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 869, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 834, 835, 836,
&end
#
# 59 ILE QG2 62 GLY HN 4.03
&rst
ixpk= 0, nxpk= 0, iat= -1, 881, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
igr1= 834, 835, 836,
&end
#
# 59 ILE QG2 62 GLY HN 4.03
&rst
ixpk= 0, nxpk= 0, iat= -1, 881, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
igr1= 834, 835, 836,
&end
#
# 59 ILE QG2 62 GLY HN 4.03
&rst
ixpk= 0, nxpk= 0, iat= -1, 881, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
igr1= 834, 835, 836,
&end
#
# 59 ILE QG2 62 GLY HA2 4.76
&rst
ixpk= 0, nxpk= 0, iat= -1, 883, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
igr1= 834, 835, 836,
&end
#
# 59 ILE QG2 62 GLY HA2 4.76
&rst
ixpk= 0, nxpk= 0, iat= -1, 883, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
igr1= 834, 835, 836,
&end
#
# 59 ILE QG2 62 GLY HA2 4.76
&rst
ixpk= 0, nxpk= 0, iat= -1, 883, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
igr1= 834, 835, 836,
&end
#
# 59 ILE QG2 62 GLY HA3 4.60
&rst
ixpk= 0, nxpk= 0, iat= -1, 884, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
igr1= 834, 835, 836,
&end
#
# 59 ILE QG2 62 GLY HA3 4.60
&rst
ixpk= 0, nxpk= 0, iat= -1, 884, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
igr1= 834, 835, 836,
&end
#
# 59 ILE QG2 62 GLY HA3 4.60
&rst
ixpk= 0, nxpk= 0, iat= -1, 884, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
igr1= 834, 835, 836,
&end
#
# 59 ILE QG2 63 GLN HN 3.92
&rst
ixpk= 0, nxpk= 0, iat= -1, 888, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
igr1= 834, 835, 836,
&end
#
# 59 ILE QG2 63 GLN HN 3.92
&rst
ixpk= 0, nxpk= 0, iat= -1, 888, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
igr1= 834, 835, 836,
&end
#
# 59 ILE QG2 63 GLN HN 3.92
&rst
ixpk= 0, nxpk= 0, iat= -1, 888, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
igr1= 834, 835, 836,
&end
#
# 60 LYS HN 60 LYS HA 4.15
&rst
ixpk= 0, nxpk= 0, iat= 847, 849, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65, &end
#
# 60 LYS HN 60 LYS HB2 3.80
&rst
ixpk= 0, nxpk= 0, iat= 847, 851, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30, &end
#
# 60 LYS HN 60 LYS HB2 3.80
&rst
ixpk= 0, nxpk= 0, iat= 847, 851, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30, &end
#
# 60 LYS HN 60 LYS HB2 3.80
&rst
ixpk= 0, nxpk= 0, iat= 847, 851, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30, &end
#
# 60 LYS HN 60 LYS HB3 3.97
&rst
ixpk= 0, nxpk= 0, iat= 847, 852, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47, &end
#
# 60 LYS HN 60 LYS HB3 3.97
&rst
ixpk= 0, nxpk= 0, iat= 847, 852, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47, &end
#
# 60 LYS HN 60 LYS HB3 3.97
&rst
ixpk= 0, nxpk= 0, iat= 847, 852, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47, &end
#
# 60 LYS HN 60 LYS HG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 847, 854, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 60 LYS HN 60 LYS HG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 847, 854, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 60 LYS HN 60 LYS HG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 847, 854, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 60 LYS HN 60 LYS HG3 5.28
&rst
ixpk= 0, nxpk= 0, iat= 847, 855, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 60 LYS HN 60 LYS HG3 5.28
&rst
ixpk= 0, nxpk= 0, iat= 847, 855, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 60 LYS HN 60 LYS HG3 5.28
&rst
ixpk= 0, nxpk= 0, iat= 847, 855, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 60 LYS HN 61 ASP HN 5.83
&rst
ixpk= 0, nxpk= 0, iat= 847, 869, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33, &end
#
# 60 LYS HN 61 ASP HN 5.83
&rst
ixpk= 0, nxpk= 0, iat= 847, 869, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33, &end
#
# 60 LYS HN 61 ASP HN 5.83
&rst
ixpk= 0, nxpk= 0, iat= 847, 869, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33, &end
#
# 60 LYS HN 62 GLY HN 5.55
&rst
ixpk= 0, nxpk= 0, iat= 847, 881, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05, &end
#
# 60 LYS HN 62 GLY HN 5.55
&rst
ixpk= 0, nxpk= 0, iat= 847, 881, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05, &end
#
# 60 LYS HN 62 GLY HN 5.55
&rst
ixpk= 0, nxpk= 0, iat= 847, 881, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05, &end
#
# 60 LYS HN 63 GLN HN 3.69
&rst
ixpk= 0, nxpk= 0, iat= 847, 888, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19, &end
#
# 60 LYS HN 63 GLN HN 3.69
&rst
ixpk= 0, nxpk= 0, iat= 847, 888, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19, &end
#
# 60 LYS HN 63 GLN HN 3.69
&rst
ixpk= 0, nxpk= 0, iat= 847, 888, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19, &end
#
# 60 LYS HN 63 GLN HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 847, 892, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 60 LYS HN 63 GLN HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 847, 892, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 60 LYS HN 63 GLN HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 847, 892, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 60 LYS HN 63 GLN QG 4.72
&rst
ixpk= 0, nxpk= 0, iat= 847, -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr2= 895, 896,
&end
#
# 60 LYS HN 63 GLN QG 4.72
&rst
ixpk= 0, nxpk= 0, iat= 847, -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr2= 895, 896,
&end
#
# 60 LYS HN 63 GLN QG 4.72
&rst
ixpk= 0, nxpk= 0, iat= 847, -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr2= 895, 896,
&end
#
# 60 LYS HN 64 ALA HN 5.88
&rst
ixpk= 0, nxpk= 0, iat= 847, 905, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38, &end
#
# 60 LYS HN 64 ALA HN 5.88
&rst
ixpk= 0, nxpk= 0, iat= 847, 905, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38, &end
#
# 60 LYS HN 64 ALA HN 5.88
&rst
ixpk= 0, nxpk= 0, iat= 847, 905, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38, &end
#
# 60 LYS HN 65 VAL HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 847, 915, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 60 LYS HN 65 VAL HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 847, 915, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 60 LYS HN 65 VAL HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 847, 915, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 60 LYS HN 65 VAL QG2 4.83
&rst
ixpk= 0, nxpk= 0, iat= 847, -1, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
igr2= 925, 926, 927,
&end
#
# 60 LYS HN 65 VAL QG2 4.83
&rst
ixpk= 0, nxpk= 0, iat= 847, -1, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
igr2= 925, 926, 927,
&end
#
# 60 LYS HN 65 VAL QG2 4.83
&rst
ixpk= 0, nxpk= 0, iat= 847, -1, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
igr2= 925, 926, 927,
&end
#
# 60 LYS HA 60 LYS HB2 4.60
&rst
ixpk= 0, nxpk= 0, iat= 849, 851, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 60 LYS HA 60 LYS HB3 3.74
&rst
ixpk= 0, nxpk= 0, iat= 849, 852, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24, &end
#
# 60 LYS HA 60 LYS HG3 4.04
&rst
ixpk= 0, nxpk= 0, iat= 849, 855, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, &end
#
# 60 LYS HA 60 LYS HG3 4.04
&rst
ixpk= 0, nxpk= 0, iat= 849, 855, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, &end
#
# 60 LYS HA 60 LYS HG3 4.04
&rst
ixpk= 0, nxpk= 0, iat= 849, 855, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, &end
#
# 60 LYS HA 61 ASP HN 3.53
&rst
ixpk= 0, nxpk= 0, iat= 849, 869, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03, &end
#
# 60 LYS HA 61 ASP HN 3.53
&rst
ixpk= 0, nxpk= 0, iat= 849, 869, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03, &end
#
# 60 LYS HA 61 ASP HN 3.53
&rst
ixpk= 0, nxpk= 0, iat= 849, 869, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03, &end
#
# 60 LYS HA 61 ASP HB2 5.70
&rst
ixpk= 0, nxpk= 0, iat= 849, 873, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20, &end
#
# 60 LYS HA 61 ASP HB2 5.70
&rst
ixpk= 0, nxpk= 0, iat= 849, 873, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20, &end
#
# 60 LYS HA 61 ASP HB2 5.70
&rst
ixpk= 0, nxpk= 0, iat= 849, 873, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20, &end
#
# 60 LYS HA 61 ASP HB3 5.71
&rst
ixpk= 0, nxpk= 0, iat= 849, 874, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21, &end
#
# 60 LYS HA 61 ASP HB3 5.71
&rst
ixpk= 0, nxpk= 0, iat= 849, 874, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21, &end
#
# 60 LYS HA 61 ASP HB3 5.71
&rst
ixpk= 0, nxpk= 0, iat= 849, 874, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21, &end
#
# 60 LYS HA 62 GLY HN 4.90
&rst
ixpk= 0, nxpk= 0, iat= 849, 881, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40, &end
#
# 60 LYS HA 62 GLY HN 4.90
&rst
ixpk= 0, nxpk= 0, iat= 849, 881, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40, &end
#
# 60 LYS HA 62 GLY HN 4.90
&rst
ixpk= 0, nxpk= 0, iat= 849, 881, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40, &end
#
# 60 LYS HA 63 GLN HN 5.73
&rst
ixpk= 0, nxpk= 0, iat= 849, 888, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23, &end
#
# 60 LYS HA 63 GLN HN 5.73
&rst
ixpk= 0, nxpk= 0, iat= 849, 888, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23, &end
#
# 60 LYS HA 63 GLN HN 5.73
&rst
ixpk= 0, nxpk= 0, iat= 849, 888, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23, &end
#
# 60 LYS HA 63 GLN QG 5.63
&rst
ixpk= 0, nxpk= 0, iat= 849, -1, r1= 1.30, r2= 1.80, r3= 6.32, r4= 6.82,
igr2= 895, 896,
&end
#
# 60 LYS HA 63 GLN QG 5.63
&rst
ixpk= 0, nxpk= 0, iat= 849, -1, r1= 1.30, r2= 1.80, r3= 6.32, r4= 6.82,
igr2= 895, 896,
&end
#
# 60 LYS HA 63 GLN QG 5.63
&rst
ixpk= 0, nxpk= 0, iat= 849, -1, r1= 1.30, r2= 1.80, r3= 6.32, r4= 6.82,
igr2= 895, 896,
&end
#
# 60 LYS HB2 61 ASP HN 5.20
&rst
ixpk= 0, nxpk= 0, iat= 851, 869, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70, &end
#
# 60 LYS HB2 61 ASP HN 5.20
&rst
ixpk= 0, nxpk= 0, iat= 851, 869, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70, &end
#
# 60 LYS HB2 61 ASP HN 5.20
&rst
ixpk= 0, nxpk= 0, iat= 851, 869, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70, &end
#
# 60 LYS HB2 62 GLY HN 6.00
&rst
ixpk= 0, nxpk= 0, iat= 851, 881, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 60 LYS HB2 62 GLY HN 6.00
&rst
ixpk= 0, nxpk= 0, iat= 851, 881, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 60 LYS HB2 62 GLY HN 6.00
&rst
ixpk= 0, nxpk= 0, iat= 851, 881, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 60 LYS HB3 60 LYS HB2 3.42
&rst
ixpk= 0, nxpk= 0, iat= 852, 851, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92, &end
#
# 60 LYS HB3 61 ASP HN 5.06
&rst
ixpk= 0, nxpk= 0, iat= 852, 869, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56, &end
#
# 60 LYS HB3 61 ASP HN 5.06
&rst
ixpk= 0, nxpk= 0, iat= 852, 869, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56, &end
#
# 60 LYS HB3 61 ASP HN 5.06
&rst
ixpk= 0, nxpk= 0, iat= 852, 869, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56, &end
#
# 60 LYS HB3 61 ASP HB2 5.79
&rst
ixpk= 0, nxpk= 0, iat= 852, 873, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29, &end
#
# 60 LYS HB3 61 ASP HB2 5.79
&rst
ixpk= 0, nxpk= 0, iat= 852, 873, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29, &end
#
# 60 LYS HB3 61 ASP HB2 5.79
&rst
ixpk= 0, nxpk= 0, iat= 852, 873, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29, &end
#
# 60 LYS HB3 62 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 852, 881, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 60 LYS HB3 62 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 852, 881, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 60 LYS HB3 62 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 852, 881, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 60 LYS HB3 64 ALA HA 5.74
&rst
ixpk= 0, nxpk= 0, iat= 852, 907, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24, &end
#
# 60 LYS HB3 64 ALA HA 5.74
&rst
ixpk= 0, nxpk= 0, iat= 852, 907, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24, &end
#
# 60 LYS HB3 64 ALA HA 5.74
&rst
ixpk= 0, nxpk= 0, iat= 852, 907, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24, &end
#
# 60 LYS HB3 65 VAL QG2 4.78
&rst
ixpk= 0, nxpk= 0, iat= 852, -1, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
igr2= 925, 926, 927,
&end
#
# 60 LYS HB3 65 VAL QG2 4.78
&rst
ixpk= 0, nxpk= 0, iat= 852, -1, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
igr2= 925, 926, 927,
&end
#
# 60 LYS HB3 65 VAL QG2 4.78
&rst
ixpk= 0, nxpk= 0, iat= 852, -1, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
igr2= 925, 926, 927,
&end
#
# 60 LYS HG2 61 ASP HN 5.07
&rst
ixpk= 0, nxpk= 0, iat= 854, 869, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, &end
#
# 60 LYS HG2 61 ASP HN 5.07
&rst
ixpk= 0, nxpk= 0, iat= 854, 869, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, &end
#
# 60 LYS HG2 61 ASP HN 5.07
&rst
ixpk= 0, nxpk= 0, iat= 854, 869, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, &end
#
# 60 LYS HG2 61 ASP HB2 4.48
&rst
ixpk= 0, nxpk= 0, iat= 854, 873, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98, &end
#
# 60 LYS HG2 61 ASP HB2 4.48
&rst
ixpk= 0, nxpk= 0, iat= 854, 873, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98, &end
#
# 60 LYS HG2 61 ASP HB2 4.48
&rst
ixpk= 0, nxpk= 0, iat= 854, 873, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98, &end
#
# 60 LYS HG2 61 ASP HB3 6.01
&rst
ixpk= 0, nxpk= 0, iat= 854, 874, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51, &end
#
# 60 LYS HG2 61 ASP HB3 6.01
&rst
ixpk= 0, nxpk= 0, iat= 854, 874, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51, &end
#
# 60 LYS HG2 61 ASP HB3 6.01
&rst
ixpk= 0, nxpk= 0, iat= 854, 874, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51, &end
#
# 60 LYS HG3 61 ASP HN 5.10
&rst
ixpk= 0, nxpk= 0, iat= 855, 869, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, &end
#
# 60 LYS HG3 61 ASP HN 5.10
&rst
ixpk= 0, nxpk= 0, iat= 855, 869, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, &end
#
# 60 LYS HG3 61 ASP HN 5.10
&rst
ixpk= 0, nxpk= 0, iat= 855, 869, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, &end
#
# 60 LYS HG3 61 ASP HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 855, 874, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 60 LYS HG3 61 ASP HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 855, 874, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 60 LYS HG3 61 ASP HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 855, 874, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 60 LYS HG3 62 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 855, 881, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 60 LYS HG3 62 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 855, 881, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 60 LYS HG3 62 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 855, 881, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 61 ASP HN 61 ASP HA 3.49
&rst
ixpk= 0, nxpk= 0, iat= 869, 871, r1= 1.30, r2= 1.80, r3= 3.49, r4= 3.99, &end
#
# 61 ASP HN 61 ASP HB2 5.04
&rst
ixpk= 0, nxpk= 0, iat= 869, 873, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54, &end
#
# 61 ASP HN 61 ASP HB3 4.96
&rst
ixpk= 0, nxpk= 0, iat= 869, 874, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46, &end
#
# 61 ASP HN 62 GLY HN 4.15
&rst
ixpk= 0, nxpk= 0, iat= 869, 881, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65, &end
#
# 61 ASP HN 62 GLY HN 4.15
&rst
ixpk= 0, nxpk= 0, iat= 869, 881, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65, &end
#
# 61 ASP HN 62 GLY HN 4.15
&rst
ixpk= 0, nxpk= 0, iat= 869, 881, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65, &end
#
# 61 ASP HN 62 GLY HN 5.28
&rst
ixpk= 0, nxpk= 0, iat= 869, 881, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 61 ASP HN 62 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 869, 884, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 61 ASP HN 62 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 869, 884, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 61 ASP HN 62 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 869, 884, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 61 ASP HN 63 GLN HN 5.25
&rst
ixpk= 0, nxpk= 0, iat= 869, 888, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75, &end
#
# 61 ASP HN 63 GLN HN 5.25
&rst
ixpk= 0, nxpk= 0, iat= 869, 888, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75, &end
#
# 61 ASP HN 63 GLN HN 5.25
&rst
ixpk= 0, nxpk= 0, iat= 869, 888, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75, &end
#
# 61 ASP HA 61 ASP HB2 3.77
&rst
ixpk= 0, nxpk= 0, iat= 871, 873, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27, &end
#
# 61 ASP HA 61 ASP HB3 4.22
&rst
ixpk= 0, nxpk= 0, iat= 871, 874, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 61 ASP HA 62 GLY HN 2.97
&rst
ixpk= 0, nxpk= 0, iat= 871, 881, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 61 ASP HA 62 GLY HN 3.74
&rst
ixpk= 0, nxpk= 0, iat= 871, 881, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24, &end
#
# 61 ASP HA 62 GLY HN 3.74
&rst
ixpk= 0, nxpk= 0, iat= 871, 881, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24, &end
#
# 61 ASP HA 62 GLY HN 3.74
&rst
ixpk= 0, nxpk= 0, iat= 871, 881, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24, &end
#
# 61 ASP HA 63 GLN HN 5.35
&rst
ixpk= 0, nxpk= 0, iat= 871, 888, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85, &end
#
# 61 ASP HA 63 GLN HN 5.35
&rst
ixpk= 0, nxpk= 0, iat= 871, 888, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85, &end
#
# 61 ASP HA 63 GLN HN 5.35
&rst
ixpk= 0, nxpk= 0, iat= 871, 888, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85, &end
#
# 61 ASP HB2 61 ASP HB3 2.98
&rst
ixpk= 0, nxpk= 0, iat= 873, 874, r1= 1.30, r2= 1.80, r3= 2.98, r4= 3.48, &end
#
# 61 ASP HB2 62 GLY HN 5.13
&rst
ixpk= 0, nxpk= 0, iat= 873, 881, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63, &end
#
# 61 ASP HB2 62 GLY HN 5.13
&rst
ixpk= 0, nxpk= 0, iat= 873, 881, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63, &end
#
# 61 ASP HB2 62 GLY HN 5.13
&rst
ixpk= 0, nxpk= 0, iat= 873, 881, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63, &end
#
# 61 ASP HB2 62 GLY HN 5.72
&rst
ixpk= 0, nxpk= 0, iat= 873, 881, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 61 ASP HB2 63 GLN HN 6.03
&rst
ixpk= 0, nxpk= 0, iat= 873, 888, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53, &end
#
# 61 ASP HB2 63 GLN HN 6.03
&rst
ixpk= 0, nxpk= 0, iat= 873, 888, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53, &end
#
# 61 ASP HB2 63 GLN HN 6.03
&rst
ixpk= 0, nxpk= 0, iat= 873, 888, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53, &end
#
# 61 ASP HB2 63 GLN HNE2 4.96
&rst
ixpk= 0, nxpk= 0, iat= 873, 901, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46, &end
#
# 61 ASP HB2 63 GLN HNE2 4.96
&rst
ixpk= 0, nxpk= 0, iat= 873, 901, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46, &end
#
# 61 ASP HB2 63 GLN HNE2 4.96
&rst
ixpk= 0, nxpk= 0, iat= 873, 901, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46, &end
#
# 61 ASP HB3 62 GLY HN 5.52
&rst
ixpk= 0, nxpk= 0, iat= 874, 881, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02, &end
#
# 61 ASP HB3 62 GLY HN 5.52
&rst
ixpk= 0, nxpk= 0, iat= 874, 881, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02, &end
#
# 61 ASP HB3 62 GLY HN 5.52
&rst
ixpk= 0, nxpk= 0, iat= 874, 881, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02, &end
#
# 61 ASP HB3 63 GLN HN 5.78
&rst
ixpk= 0, nxpk= 0, iat= 874, 888, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28, &end
#
# 61 ASP HB3 63 GLN HN 5.78
&rst
ixpk= 0, nxpk= 0, iat= 874, 888, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28, &end
#
# 61 ASP HB3 63 GLN HN 5.78
&rst
ixpk= 0, nxpk= 0, iat= 874, 888, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28, &end
#
# 61 ASP HB3 63 GLN HNE1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 874, 900, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 61 ASP HB3 63 GLN HNE1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 874, 900, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 61 ASP HB3 63 GLN HNE1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 874, 900, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 62 GLY HN 62 GLY HA2 3.72
&rst
ixpk= 0, nxpk= 0, iat= 881, 883, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22, &end
#
# 62 GLY HN 62 GLY HA3 3.44
&rst
ixpk= 0, nxpk= 0, iat= 881, 884, r1= 1.30, r2= 1.80, r3= 3.44, r4= 3.94, &end
#
# 62 GLY HN 63 GLN HN 3.83
&rst
ixpk= 0, nxpk= 0, iat= 881, 888, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33, &end
#
# 62 GLY HN 63 GLN HN 3.83
&rst
ixpk= 0, nxpk= 0, iat= 881, 888, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33, &end
#
# 62 GLY HN 63 GLN HN 3.83
&rst
ixpk= 0, nxpk= 0, iat= 881, 888, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33, &end
#
# 62 GLY HN 63 GLN HN 5.28
&rst
ixpk= 0, nxpk= 0, iat= 881, 888, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 62 GLY HN 63 GLN HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 881, 893, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 62 GLY HN 63 GLN HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 881, 893, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 62 GLY HN 63 GLN HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= 881, 893, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 62 GLY HN 63 GLN HNE1 4.21
&rst
ixpk= 0, nxpk= 0, iat= 881, 900, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71, &end
#
# 62 GLY HN 63 GLN HNE1 4.21
&rst
ixpk= 0, nxpk= 0, iat= 881, 900, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71, &end
#
# 62 GLY HN 63 GLN HNE1 4.21
&rst
ixpk= 0, nxpk= 0, iat= 881, 900, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71, &end
#
# 62 GLY HN 63 GLN HNE2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 881, 901, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 62 GLY HN 63 GLN HNE2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 881, 901, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 62 GLY HN 63 GLN HNE2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 881, 901, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 62 GLY HN 63 GLN QG 6.05
&rst
ixpk= 0, nxpk= 0, iat= 881, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2= 895, 896,
&end
#
# 62 GLY HN 63 GLN QG 6.05
&rst
ixpk= 0, nxpk= 0, iat= 881, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2= 895, 896,
&end
#
# 62 GLY HN 63 GLN QG 6.05
&rst
ixpk= 0, nxpk= 0, iat= 881, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2= 895, 896,
&end
#
# 62 GLY HA2 62 GLY HA3 3.29
&rst
ixpk= 0, nxpk= 0, iat= 883, 884, r1= 1.30, r2= 1.80, r3= 3.29, r4= 3.79, &end
#
# 62 GLY HA2 63 GLN HN 2.97
&rst
ixpk= 0, nxpk= 0, iat= 883, 888, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 62 GLY HA2 63 GLN HN 4.36
&rst
ixpk= 0, nxpk= 0, iat= 883, 888, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86, &end
#
# 62 GLY HA2 63 GLN QG 6.05
&rst
ixpk= 0, nxpk= 0, iat= 883, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2= 895, 896,
&end
#
# 62 GLY HA2 63 GLN QG 6.05
&rst
ixpk= 0, nxpk= 0, iat= 883, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2= 895, 896,
&end
#
# 62 GLY HA2 63 GLN QG 6.05
&rst
ixpk= 0, nxpk= 0, iat= 883, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2= 895, 896,
&end
#
# 62 GLY HA3 63 GLN HN 4.28
&rst
ixpk= 0, nxpk= 0, iat= 884, 888, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78, &end
#
# 62 GLY HA3 63 GLN HNE1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 884, 900, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 62 GLY HA3 63 GLN HNE1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 884, 900, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 62 GLY HA3 63 GLN HNE1 6.05
&rst
ixpk= 0, nxpk= 0, iat= 884, 900, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 63 GLN HN 63 GLN HA 3.64
&rst
ixpk= 0, nxpk= 0, iat= 888, 890, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14, &end
#
# 63 GLN HN 63 GLN HB3 3.78
&rst
ixpk= 0, nxpk= 0, iat= 888, 893, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28, &end
#
# 63 GLN HN 63 GLN HB3 3.78
&rst
ixpk= 0, nxpk= 0, iat= 888, 893, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28, &end
#
# 63 GLN HN 63 GLN HB3 3.78
&rst
ixpk= 0, nxpk= 0, iat= 888, 893, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28, &end
#
# 63 GLN HN 63 GLN HNE1 3.21
&rst
ixpk= 0, nxpk= 0, iat= 888, 900, r1= 1.30, r2= 1.80, r3= 3.21, r4= 3.71, &end
#
# 63 GLN HN 63 GLN HNE1 3.21
&rst
ixpk= 0, nxpk= 0, iat= 888, 900, r1= 1.30, r2= 1.80, r3= 3.21, r4= 3.71, &end
#
# 63 GLN HN 63 GLN HNE1 3.21
&rst
ixpk= 0, nxpk= 0, iat= 888, 900, r1= 1.30, r2= 1.80, r3= 3.21, r4= 3.71, &end
#
# 63 GLN HN 63 GLN QG 3.97
&rst
ixpk= 0, nxpk= 0, iat= 888, -1, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
igr2= 895, 896,
&end
#
# 63 GLN HN 63 GLN QG 3.97
&rst
ixpk= 0, nxpk= 0, iat= 888, -1, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
igr2= 895, 896,
&end
#
# 63 GLN HN 63 GLN QG 3.97
&rst
ixpk= 0, nxpk= 0, iat= 888, -1, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
igr2= 895, 896,
&end
#
# 63 GLN HN 64 ALA HN 4.67
&rst
ixpk= 0, nxpk= 0, iat= 888, 905, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, &end
#
# 63 GLN HN 64 ALA HN 4.67
&rst
ixpk= 0, nxpk= 0, iat= 888, 905, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, &end
#
# 63 GLN HN 64 ALA HN 4.67
&rst
ixpk= 0, nxpk= 0, iat= 888, 905, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, &end
#
# 63 GLN HN 64 ALA HN 5.28
&rst
ixpk= 0, nxpk= 0, iat= 888, 905, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 63 GLN HN 65 VAL QG2 5.48
&rst
ixpk= 0, nxpk= 0, iat= 888, -1, r1= 1.30, r2= 1.80, r3= 6.58, r4= 7.08,
igr2= 925, 926, 927,
&end
#
# 63 GLN HN 65 VAL QG2 5.48
&rst
ixpk= 0, nxpk= 0, iat= 888, -1, r1= 1.30, r2= 1.80, r3= 6.58, r4= 7.08,
igr2= 925, 926, 927,
&end
#
# 63 GLN HN 65 VAL QG2 5.48
&rst
ixpk= 0, nxpk= 0, iat= 888, -1, r1= 1.30, r2= 1.80, r3= 6.58, r4= 7.08,
igr2= 925, 926, 927,
&end
#
# 63 GLN HA 63 GLN HB2 3.81
&rst
ixpk= 0, nxpk= 0, iat= 890, 892, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31, &end
#
# 63 GLN HA 63 GLN HB3 4.10
&rst
ixpk= 0, nxpk= 0, iat= 890, 893, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60, &end
#
# 63 GLN HA 63 GLN QG 4.17
&rst
ixpk= 0, nxpk= 0, iat= 890, -1, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
igr2= 895, 896,
&end
#
# 63 GLN HA 63 GLN QG 4.17
&rst
ixpk= 0, nxpk= 0, iat= 890, -1, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
igr2= 895, 896,
&end
#
# 63 GLN HA 63 GLN QG 4.17
&rst
ixpk= 0, nxpk= 0, iat= 890, -1, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
igr2= 895, 896,
&end
#
# 63 GLN HA 64 ALA HN 2.97
&rst
ixpk= 0, nxpk= 0, iat= 890, 905, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 63 GLN HA 64 ALA HN 2.98
&rst
ixpk= 0, nxpk= 0, iat= 890, 905, r1= 1.30, r2= 1.80, r3= 2.98, r4= 3.48, &end
#
# 63 GLN HA 64 ALA HN 2.98
&rst
ixpk= 0, nxpk= 0, iat= 890, 905, r1= 1.30, r2= 1.80, r3= 2.98, r4= 3.48, &end
#
# 63 GLN HA 64 ALA HN 2.98
&rst
ixpk= 0, nxpk= 0, iat= 890, 905, r1= 1.30, r2= 1.80, r3= 2.98, r4= 3.48, &end
#
# 63 GLN HA 64 ALA QB 4.84
&rst
ixpk= 0, nxpk= 0, iat= 890, -1, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
igr2= 909, 910, 911,
&end
#
# 63 GLN HA 64 ALA QB 4.84
&rst
ixpk= 0, nxpk= 0, iat= 890, -1, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
igr2= 909, 910, 911,
&end
#
# 63 GLN HA 64 ALA QB 4.84
&rst
ixpk= 0, nxpk= 0, iat= 890, -1, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
igr2= 909, 910, 911,
&end
#
# 63 GLN HB2 63 GLN HNE1 4.77
&rst
ixpk= 0, nxpk= 0, iat= 892, 900, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27, &end
#
# 63 GLN HB2 63 GLN HNE1 4.77
&rst
ixpk= 0, nxpk= 0, iat= 892, 900, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27, &end
#
# 63 GLN HB2 63 GLN HNE1 4.77
&rst
ixpk= 0, nxpk= 0, iat= 892, 900, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27, &end
#
# 63 GLN HB2 63 GLN HNE2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 892, 901, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 63 GLN HB2 63 GLN HNE2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 892, 901, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 63 GLN HB2 63 GLN HNE2 5.50
&rst
ixpk= 0, nxpk= 0, iat= 892, 901, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 63 GLN HB2 64 ALA HN 3.74
&rst
ixpk= 0, nxpk= 0, iat= 892, 905, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24, &end
#
# 63 GLN HB2 64 ALA HN 3.74
&rst
ixpk= 0, nxpk= 0, iat= 892, 905, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24, &end
#
# 63 GLN HB2 64 ALA HN 3.74
&rst
ixpk= 0, nxpk= 0, iat= 892, 905, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24, &end
#
# 63 GLN HB2 64 ALA HN 5.72
&rst
ixpk= 0, nxpk= 0, iat= 892, 905, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 63 GLN HB3 63 GLN HB2 3.04
&rst
ixpk= 0, nxpk= 0, iat= 893, 892, r1= 1.30, r2= 1.80, r3= 3.04, r4= 3.54, &end
#
# 63 GLN HB3 63 GLN HNE1 4.61
&rst
ixpk= 0, nxpk= 0, iat= 893, 900, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 63 GLN HB3 63 GLN HNE1 4.61
&rst
ixpk= 0, nxpk= 0, iat= 893, 900, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 63 GLN HB3 63 GLN HNE1 4.61
&rst
ixpk= 0, nxpk= 0, iat= 893, 900, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 63 GLN HB3 63 GLN HNE2 5.95
&rst
ixpk= 0, nxpk= 0, iat= 893, 901, r1= 1.30, r2= 1.80, r3= 5.95, r4= 6.45, &end
#
# 63 GLN HB3 63 GLN HNE2 5.95
&rst
ixpk= 0, nxpk= 0, iat= 893, 901, r1= 1.30, r2= 1.80, r3= 5.95, r4= 6.45, &end
#
# 63 GLN HB3 63 GLN HNE2 5.95
&rst
ixpk= 0, nxpk= 0, iat= 893, 901, r1= 1.30, r2= 1.80, r3= 5.95, r4= 6.45, &end
#
# 63 GLN HB3 63 GLN QG 3.51
&rst
ixpk= 0, nxpk= 0, iat= 893, -1, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,
igr2= 895, 896,
&end
#
# 63 GLN HB3 64 ALA HN 4.57
&rst
ixpk= 0, nxpk= 0, iat= 893, 905, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07, &end
#
# 63 GLN HB3 64 ALA HN 4.57
&rst
ixpk= 0, nxpk= 0, iat= 893, 905, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07, &end
#
# 63 GLN HB3 64 ALA HN 4.57
&rst
ixpk= 0, nxpk= 0, iat= 893, 905, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07, &end
#
# 63 GLN HNE2 63 GLN HNE1 2.64
&rst
ixpk= 0, nxpk= 0, iat= 901, 900, r1= 1.30, r2= 1.80, r3= 2.64, r4= 3.14, &end
#
# 63 GLN QG 63 GLN HNE1 4.14
&rst
ixpk= 0, nxpk= 0, iat= -1, 900, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
igr1= 895, 896,
&end
#
# 63 GLN QG 63 GLN HNE1 4.14
&rst
ixpk= 0, nxpk= 0, iat= -1, 900, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
igr1= 895, 896,
&end
#
# 63 GLN QG 63 GLN HNE1 4.14
&rst
ixpk= 0, nxpk= 0, iat= -1, 900, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
igr1= 895, 896,
&end
#
# 63 GLN QG 63 GLN HNE2 5.07
&rst
ixpk= 0, nxpk= 0, iat= -1, 901, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19,
igr1= 895, 896,
&end
#
# 63 GLN QG 64 ALA HN 4.33
&rst
ixpk= 0, nxpk= 0, iat= -1, 905, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
igr1= 895, 896,
&end
#
# 63 GLN QG 64 ALA HN 4.33
&rst
ixpk= 0, nxpk= 0, iat= -1, 905, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
igr1= 895, 896,
&end
#
# 63 GLN QG 64 ALA HN 4.33
&rst
ixpk= 0, nxpk= 0, iat= -1, 905, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
igr1= 895, 896,
&end
#
# 63 GLN QG 65 VAL HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 917, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 895, 896,
&end
#
# 63 GLN QG 65 VAL HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 917, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 895, 896,
&end
#
# 63 GLN QG 65 VAL HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 917, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 895, 896,
&end
#
# 64 ALA HN 64 ALA HA 4.21
&rst
ixpk= 0, nxpk= 0, iat= 905, 907, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71, &end
#
# 64 ALA HN 64 ALA QB 3.27
&rst
ixpk= 0, nxpk= 0, iat= 905, -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
igr2= 909, 910, 911,
&end
#
# 64 ALA HN 64 ALA QB 3.27
&rst
ixpk= 0, nxpk= 0, iat= 905, -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
igr2= 909, 910, 911,
&end
#
# 64 ALA HN 64 ALA QB 3.27
&rst
ixpk= 0, nxpk= 0, iat= 905, -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
igr2= 909, 910, 911,
&end
#
# 64 ALA HN 65 VAL QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 905, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 925, 926, 927,
&end
#
# 64 ALA HN 65 VAL QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 905, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 925, 926, 927,
&end
#
# 64 ALA HN 65 VAL QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 905, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2= 925, 926, 927,
&end
#
# 64 ALA HN 66 ALA HN 5.61
&rst
ixpk= 0, nxpk= 0, iat= 905, 931, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11, &end
#
# 64 ALA HN 66 ALA HN 5.61
&rst
ixpk= 0, nxpk= 0, iat= 905, 931, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11, &end
#
# 64 ALA HN 66 ALA HN 5.61
&rst
ixpk= 0, nxpk= 0, iat= 905, 931, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11, &end
#
# 64 ALA HA 65 VAL HN 3.20
&rst
ixpk= 0, nxpk= 0, iat= 907, 915, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 64 ALA HA 65 VAL HN 3.20
&rst
ixpk= 0, nxpk= 0, iat= 907, 915, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 64 ALA HA 65 VAL HN 3.20
&rst
ixpk= 0, nxpk= 0, iat= 907, 915, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 64 ALA QB 64 ALA HA 3.89
&rst
ixpk= 0, nxpk= 0, iat= -1, 907, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17,
igr1= 909, 910, 911,
&end
#
# 64 ALA QB 65 VAL HN 3.65
&rst
ixpk= 0, nxpk= 0, iat= -1, 915, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
igr1= 909, 910, 911,
&end
#
# 64 ALA QB 65 VAL HN 3.65
&rst
ixpk= 0, nxpk= 0, iat= -1, 915, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
igr1= 909, 910, 911,
&end
#
# 64 ALA QB 65 VAL HN 3.65
&rst
ixpk= 0, nxpk= 0, iat= -1, 915, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
igr1= 909, 910, 911,
&end
#
# 64 ALA QB 65 VAL HA 4.65
&rst
ixpk= 0, nxpk= 0, iat= -1, 917, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr1= 909, 910, 911,
&end
#
# 64 ALA QB 65 VAL HA 4.65
&rst
ixpk= 0, nxpk= 0, iat= -1, 917, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr1= 909, 910, 911,
&end
#
# 64 ALA QB 65 VAL HA 4.65
&rst
ixpk= 0, nxpk= 0, iat= -1, 917, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr1= 909, 910, 911,
&end
#
# 64 ALA QB 66 ALA HN 4.95
&rst
ixpk= 0, nxpk= 0, iat= -1, 931, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
igr1= 909, 910, 911,
&end
#
# 64 ALA QB 66 ALA HN 4.95
&rst
ixpk= 0, nxpk= 0, iat= -1, 931, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
igr1= 909, 910, 911,
&end
#
# 64 ALA QB 66 ALA HN 4.95
&rst
ixpk= 0, nxpk= 0, iat= -1, 931, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
igr1= 909, 910, 911,
&end
#
# 64 ALA QB 68 GLU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 951, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 909, 910, 911,
&end
#
# 64 ALA QB 68 GLU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 951, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 909, 910, 911,
&end
#
# 64 ALA QB 68 GLU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, 951, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 909, 910, 911,
&end
#
# 65 VAL HN 65 VAL HA 4.11
&rst
ixpk= 0, nxpk= 0, iat= 915, 917, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 65 VAL HN 65 VAL HB 4.07
&rst
ixpk= 0, nxpk= 0, iat= 915, 919, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57, &end
#
# 65 VAL HN 65 VAL HB 4.07
&rst
ixpk= 0, nxpk= 0, iat= 915, 919, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57, &end
#
# 65 VAL HN 65 VAL HB 4.07
&rst
ixpk= 0, nxpk= 0, iat= 915, 919, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57, &end
#
# 65 VAL HN 65 VAL QG2 4.06
&rst
ixpk= 0, nxpk= 0, iat= 915, -1, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
igr2= 925, 926, 927,
&end
#
# 65 VAL HN 65 VAL QG2 4.06
&rst
ixpk= 0, nxpk= 0, iat= 915, -1, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
igr2= 925, 926, 927,
&end
#
# 65 VAL HN 65 VAL QG2 4.06
&rst
ixpk= 0, nxpk= 0, iat= 915, -1, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
igr2= 925, 926, 927,
&end
#
# 65 VAL HN 66 ALA HN 3.99
&rst
ixpk= 0, nxpk= 0, iat= 915, 931, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49, &end
#
# 65 VAL HN 66 ALA HN 3.99
&rst
ixpk= 0, nxpk= 0, iat= 915, 931, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49, &end
#
# 65 VAL HN 66 ALA HN 3.99
&rst
ixpk= 0, nxpk= 0, iat= 915, 931, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49, &end
#
# 65 VAL HN 67 ALA HN 5.48
&rst
ixpk= 0, nxpk= 0, iat= 915, 941, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98, &end
#
# 65 VAL HN 67 ALA HN 5.48
&rst
ixpk= 0, nxpk= 0, iat= 915, 941, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98, &end
#
# 65 VAL HN 67 ALA HN 5.48
&rst
ixpk= 0, nxpk= 0, iat= 915, 941, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98, &end
#
# 65 VAL HN 68 GLU HN 5.55
&rst
ixpk= 0, nxpk= 0, iat= 915, 951, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05, &end
#
# 65 VAL HN 68 GLU HN 5.55
&rst
ixpk= 0, nxpk= 0, iat= 915, 951, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05, &end
#
# 65 VAL HN 68 GLU HN 5.55
&rst
ixpk= 0, nxpk= 0, iat= 915, 951, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05, &end
#
# 65 VAL HN 68 GLU HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 915, 955, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 65 VAL HN 68 GLU HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 915, 955, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 65 VAL HN 68 GLU HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= 915, 955, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 65 VAL HA 65 VAL HB 4.26
&rst
ixpk= 0, nxpk= 0, iat= 917, 919, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76, &end
#
# 65 VAL HA 65 VAL QG2 3.59
&rst
ixpk= 0, nxpk= 0, iat= 917, -1, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,
igr2= 925, 926, 927,
&end
#
# 65 VAL HA 65 VAL QG2 3.59
&rst
ixpk= 0, nxpk= 0, iat= 917, -1, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,
igr2= 925, 926, 927,
&end
#
# 65 VAL HA 65 VAL QG2 3.59
&rst
ixpk= 0, nxpk= 0, iat= 917, -1, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,
igr2= 925, 926, 927,
&end
#
# 65 VAL HA 66 ALA HN 3.04
&rst
ixpk= 0, nxpk= 0, iat= 917, 931, r1= 1.30, r2= 1.80, r3= 3.04, r4= 3.54, &end
#
# 65 VAL HA 66 ALA HN 3.04
&rst
ixpk= 0, nxpk= 0, iat= 917, 931, r1= 1.30, r2= 1.80, r3= 3.04, r4= 3.54, &end
#
# 65 VAL HA 66 ALA HN 3.04
&rst
ixpk= 0, nxpk= 0, iat= 917, 931, r1= 1.30, r2= 1.80, r3= 3.04, r4= 3.54, &end
#
# 65 VAL HA 66 ALA HA 5.51
&rst
ixpk= 0, nxpk= 0, iat= 917, 933, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01, &end
#
# 65 VAL HA 66 ALA HA 5.51
&rst
ixpk= 0, nxpk= 0, iat= 917, 933, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01, &end
#
# 65 VAL HA 66 ALA HA 5.51
&rst
ixpk= 0, nxpk= 0, iat= 917, 933, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01, &end
#
# 65 VAL HA 66 ALA QB 5.14
&rst
ixpk= 0, nxpk= 0, iat= 917, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 935, 936, 937,
&end
#
# 65 VAL HA 66 ALA QB 5.14
&rst
ixpk= 0, nxpk= 0, iat= 917, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 935, 936, 937,
&end
#
# 65 VAL HA 66 ALA QB 5.14
&rst
ixpk= 0, nxpk= 0, iat= 917, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2= 935, 936, 937,
&end
#
# 65 VAL HB 66 ALA HN 5.83
&rst
ixpk= 0, nxpk= 0, iat= 919, 931, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33, &end
#
# 65 VAL HB 66 ALA HN 5.83
&rst
ixpk= 0, nxpk= 0, iat= 919, 931, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33, &end
#
# 65 VAL HB 66 ALA HN 5.83
&rst
ixpk= 0, nxpk= 0, iat= 919, 931, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33, &end
#
# 65 VAL HB 68 GLU HN 4.49
&rst
ixpk= 0, nxpk= 0, iat= 919, 951, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99, &end
#
# 65 VAL HB 68 GLU HN 4.49
&rst
ixpk= 0, nxpk= 0, iat= 919, 951, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99, &end
#
# 65 VAL HB 68 GLU HN 4.49
&rst
ixpk= 0, nxpk= 0, iat= 919, 951, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99, &end
#
# 65 VAL QG1 66 ALA HN 4.18
&rst
ixpk= 0, nxpk= 0, iat= -1, 931, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
igr1= 921, 922, 923,
&end
#
# 65 VAL QG1 66 ALA HN 4.18
&rst
ixpk= 0, nxpk= 0, iat= -1, 931, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
igr1= 921, 922, 923,
&end
#
# 65 VAL QG1 66 ALA HN 4.18
&rst
ixpk= 0, nxpk= 0, iat= -1, 931, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
igr1= 921, 922, 923,
&end
#
# 65 VAL QG1 67 ALA HN 4.48
&rst
ixpk= 0, nxpk= 0, iat= -1, 941, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
igr1= 921, 922, 923,
&end
#
# 65 VAL QG1 67 ALA HN 4.48
&rst
ixpk= 0, nxpk= 0, iat= -1, 941, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
igr1= 921, 922, 923,
&end
#
# 65 VAL QG1 67 ALA HN 4.48
&rst
ixpk= 0, nxpk= 0, iat= -1, 941, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
igr1= 921, 922, 923,
&end
#
# 65 VAL QG1 68 GLU HN 5.45
&rst
ixpk= 0, nxpk= 0, iat= -1, 951, r1= 1.30, r2= 1.80, r3= 6.55, r4= 7.05,
igr1= 921, 922, 923,
&end
#
# 65 VAL QG1 68 GLU HN 5.45
&rst
ixpk= 0, nxpk= 0, iat= -1, 951, r1= 1.30, r2= 1.80, r3= 6.55, r4= 7.05,
igr1= 921, 922, 923,
&end
#
# 65 VAL QG1 68 GLU HN 5.45
&rst
ixpk= 0, nxpk= 0, iat= -1, 951, r1= 1.30, r2= 1.80, r3= 6.55, r4= 7.05,
igr1= 921, 922, 923,
&end
#
# 65 VAL QG2 68 GLU HB2 4.77
&rst
ixpk= 0, nxpk= 0, iat= -1, 955, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23,
igr1= 925, 926, 927,
&end
#
# 65 VAL QG2 68 GLU HB2 4.77
&rst
ixpk= 0, nxpk= 0, iat= -1, 955, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23,
igr1= 925, 926, 927,
&end
#
# 65 VAL QG2 68 GLU HB2 4.77
&rst
ixpk= 0, nxpk= 0, iat= -1, 955, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23,
igr1= 925, 926, 927,
&end
#
# 66 ALA HN 66 ALA HA 3.97
&rst
ixpk= 0, nxpk= 0, iat= 931, 933, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47, &end
#
# 66 ALA HN 66 ALA QB 3.23
&rst
ixpk= 0, nxpk= 0, iat= 931, -1, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,
igr2= 935, 936, 937,
&end
#
# 66 ALA HN 66 ALA QB 3.23
&rst
ixpk= 0, nxpk= 0, iat= 931, -1, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,
igr2= 935, 936, 937,
&end
#
# 66 ALA HN 66 ALA QB 3.23
&rst
ixpk= 0, nxpk= 0, iat= 931, -1, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38,
igr2= 935, 936, 937,
&end
#
# 66 ALA HN 68 GLU HN 5.81
&rst
ixpk= 0, nxpk= 0, iat= 931, 951, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31, &end
#
# 66 ALA HN 68 GLU HN 5.81
&rst
ixpk= 0, nxpk= 0, iat= 931, 951, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31, &end
#
# 66 ALA HN 68 GLU HN 5.81
&rst
ixpk= 0, nxpk= 0, iat= 931, 951, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31, &end
#
# 66 ALA HA 67 ALA HN 3.93
&rst
ixpk= 0, nxpk= 0, iat= 933, 941, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43, &end
#
# 66 ALA HA 67 ALA HN 3.93
&rst
ixpk= 0, nxpk= 0, iat= 933, 941, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43, &end
#
# 66 ALA HA 67 ALA HN 3.93
&rst
ixpk= 0, nxpk= 0, iat= 933, 941, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43, &end
#
# 66 ALA QB 66 ALA HA 3.84
&rst
ixpk= 0, nxpk= 0, iat= -1, 933, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
igr1= 935, 936, 937,
&end
#
# 66 ALA QB 67 ALA HN 4.04
&rst
ixpk= 0, nxpk= 0, iat= -1, 941, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
igr1= 935, 936, 937,
&end
#
# 66 ALA QB 67 ALA HN 4.04
&rst
ixpk= 0, nxpk= 0, iat= -1, 941, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
igr1= 935, 936, 937,
&end
#
# 66 ALA QB 67 ALA HN 4.04
&rst
ixpk= 0, nxpk= 0, iat= -1, 941, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
igr1= 935, 936, 937,
&end
#
# 66 ALA QB 146 THR HA 5.31
&rst
ixpk= 0, nxpk= 0, iat= -1,2051, r1= 1.30, r2= 1.80, r3= 6.38, r4= 6.88,
igr1= 935, 936, 937,
&end
#
# 66 ALA QB 146 THR HA 5.31
&rst
ixpk= 0, nxpk= 0, iat= -1,2051, r1= 1.30, r2= 1.80, r3= 6.38, r4= 6.88,
igr1= 935, 936, 937,
&end
#
# 66 ALA QB 146 THR HA 5.31
&rst
ixpk= 0, nxpk= 0, iat= -1,2051, r1= 1.30, r2= 1.80, r3= 6.38, r4= 6.88,
igr1= 935, 936, 937,
&end
#
# 66 ALA QB 147 ARG HN 4.67
&rst
ixpk= 0, nxpk= 0, iat= -1,2063, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr1= 935, 936, 937,
&end
#
# 66 ALA QB 147 ARG HN 4.67
&rst
ixpk= 0, nxpk= 0, iat= -1,2063, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr1= 935, 936, 937,
&end
#
# 66 ALA QB 147 ARG HN 4.67
&rst
ixpk= 0, nxpk= 0, iat= -1,2063, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr1= 935, 936, 937,
&end
#
# 66 ALA QB 147 ARG HA 5.78
&rst
ixpk= 0, nxpk= 0, iat= -1,2065, r1= 1.30, r2= 1.80, r3= 6.94, r4= 7.44,
igr1= 935, 936, 937,
&end
#
# 66 ALA QB 147 ARG HA 5.78
&rst
ixpk= 0, nxpk= 0, iat= -1,2065, r1= 1.30, r2= 1.80, r3= 6.94, r4= 7.44,
igr1= 935, 936, 937,
&end
#
# 66 ALA QB 147 ARG HA 5.78
&rst
ixpk= 0, nxpk= 0, iat= -1,2065, r1= 1.30, r2= 1.80, r3= 6.94, r4= 7.44,
igr1= 935, 936, 937,
&end
#
# 66 ALA QB 147 ARG QD 5.18
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.98, r4= 7.48,
igr1= 935, 936, 937,
igr2=2073,2074,
&end
#
# 66 ALA QB 147 ARG QD 5.18
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.98, r4= 7.48,
igr1= 935, 936, 937,
igr2=2073,2074,
&end
#
# 66 ALA QB 147 ARG QD 5.18
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.98, r4= 7.48,
igr1= 935, 936, 937,
igr2=2073,2074,
&end
#
# 66 ALA QB 147 ARG QG 3.23
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,
igr1= 935, 936, 937,
igr2=2070,2071,
&end
#
# 66 ALA QB 147 ARG QG 3.23
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,
igr1= 935, 936, 937,
igr2=2070,2071,
&end
#
# 66 ALA QB 147 ARG QG 3.23
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85,
igr1= 935, 936, 937,
igr2=2070,2071,
&end
#
# 67 ALA HN 67 ALA HA 3.52
&rst
ixpk= 0, nxpk= 0, iat= 941, 943, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02, &end
#
# 67 ALA HN 67 ALA QB 4.44
&rst
ixpk= 0, nxpk= 0, iat= 941, -1, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
igr2= 945, 946, 947,
&end
#
# 67 ALA HN 67 ALA QB 4.44
&rst
ixpk= 0, nxpk= 0, iat= 941, -1, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
igr2= 945, 946, 947,
&end
#
# 67 ALA HN 67 ALA QB 4.44
&rst
ixpk= 0, nxpk= 0, iat= 941, -1, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
igr2= 945, 946, 947,
&end
#
# 67 ALA HN 68 GLU HN 4.51
&rst
ixpk= 0, nxpk= 0, iat= 941, 951, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01, &end
#
# 67 ALA HN 68 GLU HN 4.51
&rst
ixpk= 0, nxpk= 0, iat= 941, 951, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01, &end
#
# 67 ALA HN 68 GLU HN 4.51
&rst
ixpk= 0, nxpk= 0, iat= 941, 951, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01, &end
#
# 67 ALA HN 68 GLU HA 4.69
&rst
ixpk= 0, nxpk= 0, iat= 941, 953, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, &end
#
# 67 ALA HN 68 GLU HA 4.69
&rst
ixpk= 0, nxpk= 0, iat= 941, 953, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, &end
#
# 67 ALA HN 68 GLU HA 4.69
&rst
ixpk= 0, nxpk= 0, iat= 941, 953, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, &end
#
# 67 ALA HN 68 GLU HB2 5.92
&rst
ixpk= 0, nxpk= 0, iat= 941, 955, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42, &end
#
# 67 ALA HN 68 GLU HB2 5.92
&rst
ixpk= 0, nxpk= 0, iat= 941, 955, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42, &end
#
# 67 ALA HN 68 GLU HB2 5.92
&rst
ixpk= 0, nxpk= 0, iat= 941, 955, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42, &end
#
# 67 ALA HN 69 ALA HN 5.61
&rst
ixpk= 0, nxpk= 0, iat= 941, 966, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11, &end
#
# 67 ALA HN 69 ALA HN 5.61
&rst
ixpk= 0, nxpk= 0, iat= 941, 966, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11, &end
#
# 67 ALA HN 69 ALA HN 5.61
&rst
ixpk= 0, nxpk= 0, iat= 941, 966, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11, &end
#
# 67 ALA HN 147 ARG HE 6.05
&rst
ixpk= 0, nxpk= 0, iat= 941,2076, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 67 ALA HN 147 ARG HE 6.05
&rst
ixpk= 0, nxpk= 0, iat= 941,2076, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 67 ALA HN 147 ARG HE 6.05
&rst
ixpk= 0, nxpk= 0, iat= 941,2076, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 67 ALA HA 68 GLU HN 3.96
&rst
ixpk= 0, nxpk= 0, iat= 943, 951, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46, &end
#
# 67 ALA HA 69 ALA HN 4.55
&rst
ixpk= 0, nxpk= 0, iat= 943, 966, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05, &end
#
# 67 ALA HA 69 ALA HN 4.55
&rst
ixpk= 0, nxpk= 0, iat= 943, 966, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05, &end
#
# 67 ALA HA 69 ALA HN 4.55
&rst
ixpk= 0, nxpk= 0, iat= 943, 966, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05, &end
#
# 67 ALA HA 70 ALA HN 5.68
&rst
ixpk= 0, nxpk= 0, iat= 943, 976, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18, &end
#
# 67 ALA HA 70 ALA HN 5.68
&rst
ixpk= 0, nxpk= 0, iat= 943, 976, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18, &end
#
# 67 ALA HA 70 ALA HN 5.68
&rst
ixpk= 0, nxpk= 0, iat= 943, 976, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18, &end
#
# 67 ALA QB 67 ALA HA 3.63
&rst
ixpk= 0, nxpk= 0, iat= -1, 943, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86,
igr1= 945, 946, 947,
&end
#
# 67 ALA QB 68 GLU HN 5.10
&rst
ixpk= 0, nxpk= 0, iat= -1, 951, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,
igr1= 945, 946, 947,
&end
#
# 67 ALA QB 68 GLU HN 5.10
&rst
ixpk= 0, nxpk= 0, iat= -1, 951, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,
igr1= 945, 946, 947,
&end
#
# 67 ALA QB 68 GLU HN 5.10
&rst
ixpk= 0, nxpk= 0, iat= -1, 951, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,
igr1= 945, 946, 947,
&end
#
# 67 ALA QB 68 GLU HA 5.16
&rst
ixpk= 0, nxpk= 0, iat= -1, 953, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
igr1= 945, 946, 947,
&end
#
# 67 ALA QB 68 GLU HA 5.16
&rst
ixpk= 0, nxpk= 0, iat= -1, 953, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
igr1= 945, 946, 947,
&end
#
# 67 ALA QB 68 GLU HA 5.16
&rst
ixpk= 0, nxpk= 0, iat= -1, 953, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
igr1= 945, 946, 947,
&end
#
# 67 ALA QB 70 ALA HN 5.61
&rst
ixpk= 0, nxpk= 0, iat= -1, 976, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
igr1= 945, 946, 947,
&end
#
# 67 ALA QB 70 ALA HN 5.61
&rst
ixpk= 0, nxpk= 0, iat= -1, 976, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
igr1= 945, 946, 947,
&end
#
# 67 ALA QB 70 ALA HN 5.61
&rst
ixpk= 0, nxpk= 0, iat= -1, 976, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
igr1= 945, 946, 947,
&end
#
# 68 GLU HN 68 GLU HA 4.11
&rst
ixpk= 0, nxpk= 0, iat= 951, 953, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 68 GLU HN 68 GLU HB2 3.78
&rst
ixpk= 0, nxpk= 0, iat= 951, 955, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28, &end
#
# 68 GLU HN 68 GLU HB2 3.78
&rst
ixpk= 0, nxpk= 0, iat= 951, 955, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28, &end
#
# 68 GLU HN 68 GLU HB2 3.78
&rst
ixpk= 0, nxpk= 0, iat= 951, 955, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28, &end
#
# 68 GLU HN 68 GLU HB3 3.96
&rst
ixpk= 0, nxpk= 0, iat= 951, 956, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46, &end
#
# 68 GLU HN 68 GLU HB3 3.96
&rst
ixpk= 0, nxpk= 0, iat= 951, 956, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46, &end
#
# 68 GLU HN 68 GLU HB3 3.96
&rst
ixpk= 0, nxpk= 0, iat= 951, 956, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46, &end
#
# 68 GLU HN 68 GLU HG2 5.75
&rst
ixpk= 0, nxpk= 0, iat= 951, 958, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25, &end
#
# 68 GLU HN 68 GLU HG2 5.75
&rst
ixpk= 0, nxpk= 0, iat= 951, 958, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25, &end
#
# 68 GLU HN 68 GLU HG2 5.75
&rst
ixpk= 0, nxpk= 0, iat= 951, 958, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25, &end
#
# 68 GLU HN 68 GLU HG3 5.52
&rst
ixpk= 0, nxpk= 0, iat= 951, 959, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02, &end
#
# 68 GLU HN 68 GLU HG3 5.52
&rst
ixpk= 0, nxpk= 0, iat= 951, 959, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02, &end
#
# 68 GLU HN 68 GLU HG3 5.52
&rst
ixpk= 0, nxpk= 0, iat= 951, 959, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02, &end
#
# 68 GLU HN 69 ALA HN 4.11
&rst
ixpk= 0, nxpk= 0, iat= 951, 966, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 68 GLU HN 69 ALA HN 4.11
&rst
ixpk= 0, nxpk= 0, iat= 951, 966, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 68 GLU HN 69 ALA HN 4.11
&rst
ixpk= 0, nxpk= 0, iat= 951, 966, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 68 GLU HN 69 ALA HA 5.81
&rst
ixpk= 0, nxpk= 0, iat= 951, 968, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31, &end
#
# 68 GLU HN 69 ALA HA 5.81
&rst
ixpk= 0, nxpk= 0, iat= 951, 968, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31, &end
#
# 68 GLU HN 69 ALA HA 5.81
&rst
ixpk= 0, nxpk= 0, iat= 951, 968, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31, &end
#
# 68 GLU HN 69 ALA QB 4.70
&rst
ixpk= 0, nxpk= 0, iat= 951, -1, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14,
igr2= 970, 971, 972,
&end
#
# 68 GLU HN 69 ALA QB 4.70
&rst
ixpk= 0, nxpk= 0, iat= 951, -1, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14,
igr2= 970, 971, 972,
&end
#
# 68 GLU HN 69 ALA QB 4.70
&rst
ixpk= 0, nxpk= 0, iat= 951, -1, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14,
igr2= 970, 971, 972,
&end
#
# 68 GLU HN 70 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 951, 976, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 68 GLU HN 70 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 951, 976, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 68 GLU HN 70 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 951, 976, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 68 GLU HA 68 GLU HG2 4.00
&rst
ixpk= 0, nxpk= 0, iat= 953, 958, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 68 GLU HA 68 GLU HG2 4.00
&rst
ixpk= 0, nxpk= 0, iat= 953, 958, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 68 GLU HA 68 GLU HG2 4.00
&rst
ixpk= 0, nxpk= 0, iat= 953, 958, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 68 GLU HA 69 ALA HN 4.52
&rst
ixpk= 0, nxpk= 0, iat= 953, 966, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02, &end
#
# 68 GLU HA 71 GLY HN 5.75
&rst
ixpk= 0, nxpk= 0, iat= 953, 986, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25, &end
#
# 68 GLU HA 71 GLY HN 5.75
&rst
ixpk= 0, nxpk= 0, iat= 953, 986, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25, &end
#
# 68 GLU HA 71 GLY HN 5.75
&rst
ixpk= 0, nxpk= 0, iat= 953, 986, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25, &end
#
# 68 GLU HB2 69 ALA HN 5.81
&rst
ixpk= 0, nxpk= 0, iat= 955, 966, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31, &end
#
# 68 GLU HB2 69 ALA HN 5.81
&rst
ixpk= 0, nxpk= 0, iat= 955, 966, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31, &end
#
# 68 GLU HB2 69 ALA HN 5.81
&rst
ixpk= 0, nxpk= 0, iat= 955, 966, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31, &end
#
# 68 GLU HB3 68 GLU HG3 4.08
&rst
ixpk= 0, nxpk= 0, iat= 956, 959, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58, &end
#
# 68 GLU HG2 68 GLU HG3 3.30
&rst
ixpk= 0, nxpk= 0, iat= 958, 959, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80, &end
#
# 68 GLU HG3 69 ALA HN 5.58
&rst
ixpk= 0, nxpk= 0, iat= 959, 966, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08, &end
#
# 68 GLU HG3 69 ALA HN 5.58
&rst
ixpk= 0, nxpk= 0, iat= 959, 966, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08, &end
#
# 68 GLU HG3 69 ALA HN 5.58
&rst
ixpk= 0, nxpk= 0, iat= 959, 966, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08, &end
#
# 68 GLU HG3 70 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 959, 976, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 68 GLU HG3 70 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 959, 976, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 68 GLU HG3 70 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 959, 976, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 68 GLU HG3 71 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 959, 986, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 68 GLU HG3 71 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 959, 986, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 68 GLU HG3 71 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= 959, 986, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 69 ALA HN 69 ALA HA 3.63
&rst
ixpk= 0, nxpk= 0, iat= 966, 968, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13, &end
#
# 69 ALA HN 69 ALA QB 3.35
&rst
ixpk= 0, nxpk= 0, iat= 966, -1, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,
igr2= 970, 971, 972,
&end
#
# 69 ALA HN 69 ALA QB 3.35
&rst
ixpk= 0, nxpk= 0, iat= 966, -1, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,
igr2= 970, 971, 972,
&end
#
# 69 ALA HN 69 ALA QB 3.35
&rst
ixpk= 0, nxpk= 0, iat= 966, -1, r1= 1.30, r2= 1.80, r3= 4.02, r4= 4.52,
igr2= 970, 971, 972,
&end
#
# 69 ALA HN 70 ALA HN 3.64
&rst
ixpk= 0, nxpk= 0, iat= 966, 976, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14, &end
#
# 69 ALA HN 70 ALA HN 3.64
&rst
ixpk= 0, nxpk= 0, iat= 966, 976, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14, &end
#
# 69 ALA HN 70 ALA HN 3.64
&rst
ixpk= 0, nxpk= 0, iat= 966, 976, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14, &end
#
# 69 ALA HN 71 GLY HN 5.72
&rst
ixpk= 0, nxpk= 0, iat= 966, 986, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 69 ALA HN 71 GLY HN 5.72
&rst
ixpk= 0, nxpk= 0, iat= 966, 986, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 69 ALA HN 71 GLY HN 5.72
&rst
ixpk= 0, nxpk= 0, iat= 966, 986, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 69 ALA HA 70 ALA HN 4.37
&rst
ixpk= 0, nxpk= 0, iat= 968, 976, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87, &end
#
# 69 ALA QB 69 ALA HA 3.38
&rst
ixpk= 0, nxpk= 0, iat= -1, 968, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56,
igr1= 970, 971, 972,
&end
#
# 69 ALA QB 70 ALA HN 4.42
&rst
ixpk= 0, nxpk= 0, iat= -1, 976, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
igr1= 970, 971, 972,
&end
#
# 69 ALA QB 70 ALA HN 4.42
&rst
ixpk= 0, nxpk= 0, iat= -1, 976, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
igr1= 970, 971, 972,
&end
#
# 69 ALA QB 70 ALA HN 4.42
&rst
ixpk= 0, nxpk= 0, iat= -1, 976, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
igr1= 970, 971, 972,
&end
#
# 69 ALA QB 71 GLY HN 5.15
&rst
ixpk= 0, nxpk= 0, iat= -1, 986, r1= 1.30, r2= 1.80, r3= 6.18, r4= 6.68,
igr1= 970, 971, 972,
&end
#
# 69 ALA QB 71 GLY HN 5.15
&rst
ixpk= 0, nxpk= 0, iat= -1, 986, r1= 1.30, r2= 1.80, r3= 6.18, r4= 6.68,
igr1= 970, 971, 972,
&end
#
# 69 ALA QB 71 GLY HN 5.15
&rst
ixpk= 0, nxpk= 0, iat= -1, 986, r1= 1.30, r2= 1.80, r3= 6.18, r4= 6.68,
igr1= 970, 971, 972,
&end
#
# 70 ALA HN 70 ALA HA 4.01
&rst
ixpk= 0, nxpk= 0, iat= 976, 978, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51, &end
#
# 70 ALA HN 70 ALA QB 3.75
&rst
ixpk= 0, nxpk= 0, iat= 976, -1, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
igr2= 980, 981, 982,
&end
#
# 70 ALA HN 70 ALA QB 3.75
&rst
ixpk= 0, nxpk= 0, iat= 976, -1, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
igr2= 980, 981, 982,
&end
#
# 70 ALA HN 70 ALA QB 3.75
&rst
ixpk= 0, nxpk= 0, iat= 976, -1, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
igr2= 980, 981, 982,
&end
#
# 70 ALA HN 71 GLY HN 3.98
&rst
ixpk= 0, nxpk= 0, iat= 976, 986, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48, &end
#
# 70 ALA HN 71 GLY HN 3.98
&rst
ixpk= 0, nxpk= 0, iat= 976, 986, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48, &end
#
# 70 ALA HN 71 GLY HN 3.98
&rst
ixpk= 0, nxpk= 0, iat= 976, 986, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48, &end
#
# 70 ALA HA 71 GLY HN 4.71
&rst
ixpk= 0, nxpk= 0, iat= 978, 986, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21, &end
#
# 70 ALA QB 70 ALA HA 3.85
&rst
ixpk= 0, nxpk= 0, iat= -1, 978, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
igr1= 980, 981, 982,
&end
#
# 70 ALA QB 71 GLY HN 4.70
&rst
ixpk= 0, nxpk= 0, iat= -1, 986, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14,
igr1= 980, 981, 982,
&end
#
# 70 ALA QB 71 GLY HN 4.70
&rst
ixpk= 0, nxpk= 0, iat= -1, 986, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14,
igr1= 980, 981, 982,
&end
#
# 70 ALA QB 71 GLY HN 4.70
&rst
ixpk= 0, nxpk= 0, iat= -1, 986, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14,
igr1= 980, 981, 982,
&end
#
# 70 ALA QB 124 ALA HN 5.58
&rst
ixpk= 0, nxpk= 0, iat= -1,1757, r1= 1.30, r2= 1.80, r3= 6.70, r4= 7.20,
igr1= 980, 981, 982,
&end
#
# 70 ALA QB 124 ALA HN 5.58
&rst
ixpk= 0, nxpk= 0, iat= -1,1757, r1= 1.30, r2= 1.80, r3= 6.70, r4= 7.20,
igr1= 980, 981, 982,
&end
#
# 70 ALA QB 124 ALA HN 5.58
&rst
ixpk= 0, nxpk= 0, iat= -1,1757, r1= 1.30, r2= 1.80, r3= 6.70, r4= 7.20,
igr1= 980, 981, 982,
&end
#
# 70 ALA QB 126 MET QE 3.81
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
igr1= 980, 981, 982,
igr2=1797,1798,1799,
&end
#
# 70 ALA QB 126 MET QE 3.81
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
igr1= 980, 981, 982,
igr2=1797,1798,1799,
&end
#
# 70 ALA QB 126 MET QE 3.81
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
igr1= 980, 981, 982,
igr2=1797,1798,1799,
&end
#
# 71 GLY HN 71 GLY HA2 3.83
&rst
ixpk= 0, nxpk= 0, iat= 986, 988, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33, &end
#
# 71 GLY HN 71 GLY HA3 3.63
&rst
ixpk= 0, nxpk= 0, iat= 986, 989, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13, &end
#
# 71 GLY HN 72 GLY HN 4.78
&rst
ixpk= 0, nxpk= 0, iat= 986, 993, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, &end
#
# 71 GLY HN 72 GLY HN 4.78
&rst
ixpk= 0, nxpk= 0, iat= 986, 993, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, &end
#
# 71 GLY HN 72 GLY HN 4.78
&rst
ixpk= 0, nxpk= 0, iat= 986, 993, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, &end
#
# 71 GLY HA2 72 GLY HN 3.71
&rst
ixpk= 0, nxpk= 0, iat= 988, 993, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21, &end
#
# 71 GLY HA2 72 GLY HN 3.71
&rst
ixpk= 0, nxpk= 0, iat= 988, 993, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21, &end
#
# 71 GLY HA2 72 GLY HN 3.71
&rst
ixpk= 0, nxpk= 0, iat= 988, 993, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21, &end
#
# 71 GLY HA3 72 GLY HN 4.00
&rst
ixpk= 0, nxpk= 0, iat= 989, 993, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 72 GLY HN 72 GLY QA 3.90
&rst
ixpk= 0, nxpk= 0, iat= 993, -1, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
igr2= 995, 996,
&end
#
# 72 GLY HN 73 HIC HN 4.86
&rst
ixpk= 0, nxpk= 0, iat= 993,1000, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36, &end
#
# 72 GLY HN 73 HIC HN 4.86
&rst
ixpk= 0, nxpk= 0, iat= 993,1000, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36, &end
#
# 72 GLY HN 73 HIC HN 4.86
&rst
ixpk= 0, nxpk= 0, iat= 993,1000, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36, &end
#
# 72 GLY QA 73 HIC HN 3.86
&rst
ixpk= 0, nxpk= 0, iat= -1,1000, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,
igr1= 995, 996,
&end
#
# 72 GLY QA 73 HIC HN 3.86
&rst
ixpk= 0, nxpk= 0, iat= -1,1000, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,
igr1= 995, 996,
&end
#
# 72 GLY QA 73 HIC HN 3.86
&rst
ixpk= 0, nxpk= 0, iat= -1,1000, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,
igr1= 995, 996,
&end
#
# 72 GLY QA 141 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.16, r4= 8.66,
igr1= 995, 996,
igr2=2015,2016,2017,
&end
#
# 72 GLY QA 141 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.16, r4= 8.66,
igr1= 995, 996,
igr2=2015,2016,2017,
&end
#
# 72 GLY QA 141 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.16, r4= 8.66,
igr1= 995, 996,
igr2=2015,2016,2017,
&end
#
# 73 HIC HN 73 HIC HA 3.61
&rst
ixpk= 0, nxpk= 0, iat=1000,1002, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11, &end
#
# 73 HIC HN 74 LEU HN 5.37
&rst
ixpk= 0, nxpk= 0, iat=1000,1017, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87, &end
#
# 73 HIC HN 74 LEU HN 5.37
&rst
ixpk= 0, nxpk= 0, iat=1000,1017, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87, &end
#
# 73 HIC HN 74 LEU HN 5.37
&rst
ixpk= 0, nxpk= 0, iat=1000,1017, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87, &end
#
# 73 HIC HA 74 LEU HN 4.72
&rst
ixpk= 0, nxpk= 0, iat=1002,1017, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22, &end
#
# 74 LEU HN 74 LEU HA 4.20
&rst
ixpk= 0, nxpk= 0, iat=1017,1019, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 74 LEU HN 74 LEU HB2 4.18
&rst
ixpk= 0, nxpk= 0, iat=1017,1021, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68, &end
#
# 74 LEU HN 74 LEU HB2 4.18
&rst
ixpk= 0, nxpk= 0, iat=1017,1021, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68, &end
#
# 74 LEU HN 74 LEU HB2 4.18
&rst
ixpk= 0, nxpk= 0, iat=1017,1021, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68, &end
#
# 74 LEU HN 74 LEU HB3 4.51
&rst
ixpk= 0, nxpk= 0, iat=1017,1022, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01, &end
#
# 74 LEU HN 74 LEU HB3 4.51
&rst
ixpk= 0, nxpk= 0, iat=1017,1022, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01, &end
#
# 74 LEU HN 74 LEU HB3 4.51
&rst
ixpk= 0, nxpk= 0, iat=1017,1022, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01, &end
#
# 74 LEU HN 74 LEU QD1 5.24
&rst
ixpk= 0, nxpk= 0, iat=1017, -1, r1= 1.30, r2= 1.80, r3= 6.29, r4= 6.79,
igr2=1026,1027,1028,
&end
#
# 74 LEU HN 74 LEU QD1 5.24
&rst
ixpk= 0, nxpk= 0, iat=1017, -1, r1= 1.30, r2= 1.80, r3= 6.29, r4= 6.79,
igr2=1026,1027,1028,
&end
#
# 74 LEU HN 74 LEU QD1 5.24
&rst
ixpk= 0, nxpk= 0, iat=1017, -1, r1= 1.30, r2= 1.80, r3= 6.29, r4= 6.79,
igr2=1026,1027,1028,
&end
#
# 74 LEU HN 75 ASP HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1017,1036, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 74 LEU HN 75 ASP HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1017,1036, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 74 LEU HN 75 ASP HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1017,1036, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 74 LEU HA 74 LEU HB3 4.98
&rst
ixpk= 0, nxpk= 0, iat=1019,1022, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48, &end
#
# 74 LEU HA 74 LEU QD1 5.37
&rst
ixpk= 0, nxpk= 0, iat=1019, -1, r1= 1.30, r2= 1.80, r3= 6.45, r4= 6.95,
igr2=1026,1027,1028,
&end
#
# 74 LEU HA 74 LEU QD1 5.37
&rst
ixpk= 0, nxpk= 0, iat=1019, -1, r1= 1.30, r2= 1.80, r3= 6.45, r4= 6.95,
igr2=1026,1027,1028,
&end
#
# 74 LEU HA 74 LEU QD1 5.37
&rst
ixpk= 0, nxpk= 0, iat=1019, -1, r1= 1.30, r2= 1.80, r3= 6.45, r4= 6.95,
igr2=1026,1027,1028,
&end
#
# 74 LEU HA 74 LEU QD2 4.18
&rst
ixpk= 0, nxpk= 0, iat=1019, -1, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
igr2=1030,1031,1032,
&end
#
# 74 LEU HA 74 LEU QD2 4.18
&rst
ixpk= 0, nxpk= 0, iat=1019, -1, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
igr2=1030,1031,1032,
&end
#
# 74 LEU HA 74 LEU QD2 4.18
&rst
ixpk= 0, nxpk= 0, iat=1019, -1, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
igr2=1030,1031,1032,
&end
#
# 74 LEU HA 75 ASP HN 3.59
&rst
ixpk= 0, nxpk= 0, iat=1019,1036, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09, &end
#
# 74 LEU HA 75 ASP HN 3.59
&rst
ixpk= 0, nxpk= 0, iat=1019,1036, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09, &end
#
# 74 LEU HA 75 ASP HN 3.59
&rst
ixpk= 0, nxpk= 0, iat=1019,1036, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09, &end
#
# 74 LEU HA 75 ASP HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1019,1041, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 74 LEU HA 75 ASP HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1019,1041, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 74 LEU HA 75 ASP HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1019,1041, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 74 LEU HA 76 PRO HD3 3.72
&rst
ixpk= 0, nxpk= 0, iat=1019,1050, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22, &end
#
# 74 LEU HA 76 PRO HD3 3.72
&rst
ixpk= 0, nxpk= 0, iat=1019,1050, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22, &end
#
# 74 LEU HA 76 PRO HD3 3.72
&rst
ixpk= 0, nxpk= 0, iat=1019,1050, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22, &end
#
# 74 LEU HA 92 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1019,1271, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 74 LEU HA 92 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1019,1271, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 74 LEU HA 92 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1019,1271, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 74 LEU HB2 92 GLY HN 4.98
&rst
ixpk= 0, nxpk= 0, iat=1021,1271, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48, &end
#
# 74 LEU HB2 92 GLY HN 4.98
&rst
ixpk= 0, nxpk= 0, iat=1021,1271, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48, &end
#
# 74 LEU HB2 92 GLY HN 4.98
&rst
ixpk= 0, nxpk= 0, iat=1021,1271, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48, &end
#
# 74 LEU HB2 92 GLY HA2 4.11
&rst
ixpk= 0, nxpk= 0, iat=1021,1273, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 74 LEU HB2 92 GLY HA2 4.11
&rst
ixpk= 0, nxpk= 0, iat=1021,1273, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 74 LEU HB2 92 GLY HA2 4.11
&rst
ixpk= 0, nxpk= 0, iat=1021,1273, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 74 LEU HB2 92 GLY HA3 4.70
&rst
ixpk= 0, nxpk= 0, iat=1021,1274, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 74 LEU HB2 92 GLY HA3 4.70
&rst
ixpk= 0, nxpk= 0, iat=1021,1274, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 74 LEU HB2 92 GLY HA3 4.70
&rst
ixpk= 0, nxpk= 0, iat=1021,1274, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 74 LEU HB3 74 LEU HB2 2.87
&rst
ixpk= 0, nxpk= 0, iat=1022,1021, r1= 1.30, r2= 1.80, r3= 2.87, r4= 3.37, &end
#
# 74 LEU HB3 74 LEU QD1 5.21
&rst
ixpk= 0, nxpk= 0, iat=1022, -1, r1= 1.30, r2= 1.80, r3= 6.26, r4= 6.76,
igr2=1026,1027,1028,
&end
#
# 74 LEU HB3 75 ASP HN 5.16
&rst
ixpk= 0, nxpk= 0, iat=1022,1036, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66, &end
#
# 74 LEU HB3 75 ASP HN 5.16
&rst
ixpk= 0, nxpk= 0, iat=1022,1036, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66, &end
#
# 74 LEU HB3 75 ASP HN 5.16
&rst
ixpk= 0, nxpk= 0, iat=1022,1036, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66, &end
#
# 74 LEU HB3 92 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1022,1271, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 74 LEU HB3 92 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1022,1271, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 74 LEU HB3 92 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1022,1271, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 74 LEU HG 76 PRO HD3 5.07
&rst
ixpk= 0, nxpk= 0, iat=1024,1050, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, &end
#
# 74 LEU HG 76 PRO HD3 5.07
&rst
ixpk= 0, nxpk= 0, iat=1024,1050, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, &end
#
# 74 LEU HG 76 PRO HD3 5.07
&rst
ixpk= 0, nxpk= 0, iat=1024,1050, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, &end
#
# 74 LEU HG 91 LEU QD1 4.12
&rst
ixpk= 0, nxpk= 0, iat=1024, -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr2=1261,1262,1263,
&end
#
# 74 LEU HG 91 LEU QD1 4.12
&rst
ixpk= 0, nxpk= 0, iat=1024, -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr2=1261,1262,1263,
&end
#
# 74 LEU HG 91 LEU QD1 4.12
&rst
ixpk= 0, nxpk= 0, iat=1024, -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr2=1261,1262,1263,
&end
#
# 74 LEU QD1 75 ASP HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1036, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1026,1027,1028,
&end
#
# 74 LEU QD1 75 ASP HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1036, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1026,1027,1028,
&end
#
# 74 LEU QD1 75 ASP HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1036, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1026,1027,1028,
&end
#
# 74 LEU QD1 76 PRO HD2 4.95
&rst
ixpk= 0, nxpk= 0, iat= -1,1049, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
igr1=1026,1027,1028,
&end
#
# 74 LEU QD1 76 PRO HD2 4.95
&rst
ixpk= 0, nxpk= 0, iat= -1,1049, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
igr1=1026,1027,1028,
&end
#
# 74 LEU QD1 76 PRO HD2 4.95
&rst
ixpk= 0, nxpk= 0, iat= -1,1049, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
igr1=1026,1027,1028,
&end
#
# 74 LEU QD1 76 PRO HD3 4.99
&rst
ixpk= 0, nxpk= 0, iat= -1,1050, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1=1026,1027,1028,
&end
#
# 74 LEU QD1 76 PRO HD3 4.99
&rst
ixpk= 0, nxpk= 0, iat= -1,1050, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1=1026,1027,1028,
&end
#
# 74 LEU QD1 76 PRO HD3 4.99
&rst
ixpk= 0, nxpk= 0, iat= -1,1050, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
igr1=1026,1027,1028,
&end
#
# 74 LEU QD1 91 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1252, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1026,1027,1028,
&end
#
# 74 LEU QD1 91 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1252, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1026,1027,1028,
&end
#
# 74 LEU QD1 91 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1252, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1026,1027,1028,
&end
#
# 74 LEU QD1 91 LEU QD1 3.37
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
igr1=1026,1027,1028,
igr2=1261,1262,1263,
&end
#
# 74 LEU QD1 91 LEU QD1 3.37
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
igr1=1026,1027,1028,
igr2=1261,1262,1263,
&end
#
# 74 LEU QD1 91 LEU QD1 3.37
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
igr1=1026,1027,1028,
igr2=1261,1262,1263,
&end
#
# 74 LEU QD1 91 LEU QD2 3.42
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,
igr1=1026,1027,1028,
igr2=1265,1266,1267,
&end
#
# 74 LEU QD1 91 LEU QD2 3.42
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,
igr1=1026,1027,1028,
igr2=1265,1266,1267,
&end
#
# 74 LEU QD1 91 LEU QD2 3.42
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,
igr1=1026,1027,1028,
igr2=1265,1266,1267,
&end
#
# 74 LEU QD1 92 GLY HN 5.16
&rst
ixpk= 0, nxpk= 0, iat= -1,1271, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
igr1=1026,1027,1028,
&end
#
# 74 LEU QD1 92 GLY HN 5.16
&rst
ixpk= 0, nxpk= 0, iat= -1,1271, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
igr1=1026,1027,1028,
&end
#
# 74 LEU QD1 92 GLY HN 5.16
&rst
ixpk= 0, nxpk= 0, iat= -1,1271, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
igr1=1026,1027,1028,
&end
#
# 74 LEU QD1 123 LYS HE3 5.71
&rst
ixpk= 0, nxpk= 0, iat= -1,1749, r1= 1.30, r2= 1.80, r3= 6.86, r4= 7.36,
igr1=1026,1027,1028,
&end
#
# 74 LEU QD1 123 LYS HE3 5.71
&rst
ixpk= 0, nxpk= 0, iat= -1,1749, r1= 1.30, r2= 1.80, r3= 6.86, r4= 7.36,
igr1=1026,1027,1028,
&end
#
# 74 LEU QD1 123 LYS HE3 5.71
&rst
ixpk= 0, nxpk= 0, iat= -1,1749, r1= 1.30, r2= 1.80, r3= 6.86, r4= 7.36,
igr1=1026,1027,1028,
&end
#
# 74 LEU QD2 74 LEU HG 4.80
&rst
ixpk= 0, nxpk= 0, iat= -1,1024, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
igr1=1030,1031,1032,
&end
#
# 74 LEU QD2 74 LEU QD1 3.76
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr1=1030,1031,1032,
igr2=1026,1027,1028,
&end
#
# 74 LEU QD2 76 PRO HD3 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1050, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1030,1031,1032,
&end
#
# 74 LEU QD2 76 PRO HD3 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1050, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1030,1031,1032,
&end
#
# 74 LEU QD2 76 PRO HD3 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1050, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1030,1031,1032,
&end
#
# 74 LEU QD2 91 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1252, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1030,1031,1032,
&end
#
# 74 LEU QD2 91 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1252, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1030,1031,1032,
&end
#
# 74 LEU QD2 91 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1252, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1030,1031,1032,
&end
#
# 74 LEU QD2 91 LEU QD2 3.42
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,
igr1=1030,1031,1032,
igr2=1265,1266,1267,
&end
#
# 74 LEU QD2 91 LEU QD2 3.42
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,
igr1=1030,1031,1032,
igr2=1265,1266,1267,
&end
#
# 74 LEU QD2 91 LEU QD2 3.42
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,
igr1=1030,1031,1032,
igr2=1265,1266,1267,
&end
#
# 74 LEU QD2 92 GLY HN 5.37
&rst
ixpk= 0, nxpk= 0, iat= -1,1271, r1= 1.30, r2= 1.80, r3= 6.45, r4= 6.95,
igr1=1030,1031,1032,
&end
#
# 74 LEU QD2 92 GLY HN 5.37
&rst
ixpk= 0, nxpk= 0, iat= -1,1271, r1= 1.30, r2= 1.80, r3= 6.45, r4= 6.95,
igr1=1030,1031,1032,
&end
#
# 74 LEU QD2 92 GLY HN 5.37
&rst
ixpk= 0, nxpk= 0, iat= -1,1271, r1= 1.30, r2= 1.80, r3= 6.45, r4= 6.95,
igr1=1030,1031,1032,
&end
#
# 74 LEU QD2 92 GLY HA2 5.41
&rst
ixpk= 0, nxpk= 0, iat= -1,1273, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
igr1=1030,1031,1032,
&end
#
# 74 LEU QD2 92 GLY HA2 5.41
&rst
ixpk= 0, nxpk= 0, iat= -1,1273, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
igr1=1030,1031,1032,
&end
#
# 74 LEU QD2 92 GLY HA2 5.41
&rst
ixpk= 0, nxpk= 0, iat= -1,1273, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
igr1=1030,1031,1032,
&end
#
# 74 LEU QD2 123 LYS HE2 4.47
&rst
ixpk= 0, nxpk= 0, iat= -1,1748, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr1=1030,1031,1032,
&end
#
# 74 LEU QD2 123 LYS HE2 4.47
&rst
ixpk= 0, nxpk= 0, iat= -1,1748, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr1=1030,1031,1032,
&end
#
# 74 LEU QD2 123 LYS HE2 4.47
&rst
ixpk= 0, nxpk= 0, iat= -1,1748, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr1=1030,1031,1032,
&end
#
# 74 LEU QD2 123 LYS HE3 4.28
&rst
ixpk= 0, nxpk= 0, iat= -1,1749, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
igr1=1030,1031,1032,
&end
#
# 74 LEU QD2 123 LYS HE3 4.28
&rst
ixpk= 0, nxpk= 0, iat= -1,1749, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
igr1=1030,1031,1032,
&end
#
# 74 LEU QD2 123 LYS HE3 4.28
&rst
ixpk= 0, nxpk= 0, iat= -1,1749, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
igr1=1030,1031,1032,
&end
#
# 75 ASP HN 75 ASP HA 5.04
&rst
ixpk= 0, nxpk= 0, iat=1036,1038, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54, &end
#
# 75 ASP HN 75 ASP HB2 4.66
&rst
ixpk= 0, nxpk= 0, iat=1036,1040, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16, &end
#
# 75 ASP HN 75 ASP HB3 4.96
&rst
ixpk= 0, nxpk= 0, iat=1036,1041, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46, &end
#
# 75 ASP HN 76 PRO HD2 5.51
&rst
ixpk= 0, nxpk= 0, iat=1036,1049, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01, &end
#
# 75 ASP HN 76 PRO HD2 5.51
&rst
ixpk= 0, nxpk= 0, iat=1036,1049, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01, &end
#
# 75 ASP HN 76 PRO HD2 5.51
&rst
ixpk= 0, nxpk= 0, iat=1036,1049, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01, &end
#
# 75 ASP HN 76 PRO HD3 5.10
&rst
ixpk= 0, nxpk= 0, iat=1036,1050, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, &end
#
# 75 ASP HN 76 PRO HD3 5.10
&rst
ixpk= 0, nxpk= 0, iat=1036,1050, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, &end
#
# 75 ASP HN 76 PRO HD3 5.10
&rst
ixpk= 0, nxpk= 0, iat=1036,1050, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, &end
#
# 75 ASP HN 76 PRO HG2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1036,1052, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 75 ASP HN 76 PRO HG2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1036,1052, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 75 ASP HN 76 PRO HG2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1036,1052, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 75 ASP HN 76 PRO HG3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1036,1053, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 75 ASP HN 76 PRO HG3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1036,1053, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 75 ASP HN 76 PRO HG3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1036,1053, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 75 ASP HN 78 ASN HD22 6.05
&rst
ixpk= 0, nxpk= 0, iat=1036,1089, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 75 ASP HN 78 ASN HD22 6.05
&rst
ixpk= 0, nxpk= 0, iat=1036,1089, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 75 ASP HN 78 ASN HD22 6.05
&rst
ixpk= 0, nxpk= 0, iat=1036,1089, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 75 ASP HN 91 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1036,1252, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 75 ASP HN 91 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1036,1252, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 75 ASP HN 91 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1036,1252, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 75 ASP HA 75 ASP HB2 5.12
&rst
ixpk= 0, nxpk= 0, iat=1038,1040, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, &end
#
# 75 ASP HA 75 ASP HB3 4.80
&rst
ixpk= 0, nxpk= 0, iat=1038,1041, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30, &end
#
# 75 ASP HA 76 PRO HD2 4.58
&rst
ixpk= 0, nxpk= 0, iat=1038,1049, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08, &end
#
# 75 ASP HA 76 PRO HD3 4.78
&rst
ixpk= 0, nxpk= 0, iat=1038,1050, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, &end
#
# 75 ASP HA 76 PRO HG2 5.79
&rst
ixpk= 0, nxpk= 0, iat=1038,1052, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29, &end
#
# 75 ASP HA 76 PRO HG2 5.79
&rst
ixpk= 0, nxpk= 0, iat=1038,1052, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29, &end
#
# 75 ASP HA 76 PRO HG2 5.79
&rst
ixpk= 0, nxpk= 0, iat=1038,1052, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29, &end
#
# 75 ASP HA 76 PRO HG3 5.76
&rst
ixpk= 0, nxpk= 0, iat=1038,1053, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26, &end
#
# 75 ASP HA 76 PRO HG3 5.76
&rst
ixpk= 0, nxpk= 0, iat=1038,1053, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26, &end
#
# 75 ASP HA 76 PRO HG3 5.76
&rst
ixpk= 0, nxpk= 0, iat=1038,1053, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26, &end
#
# 75 ASP HA 77 GLN HN 5.42
&rst
ixpk= 0, nxpk= 0, iat=1038,1062, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92, &end
#
# 75 ASP HA 77 GLN HN 5.42
&rst
ixpk= 0, nxpk= 0, iat=1038,1062, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92, &end
#
# 75 ASP HA 77 GLN HN 5.42
&rst
ixpk= 0, nxpk= 0, iat=1038,1062, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92, &end
#
# 75 ASP HA 78 ASN HN 5.75
&rst
ixpk= 0, nxpk= 0, iat=1038,1079, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25, &end
#
# 75 ASP HA 78 ASN HN 5.75
&rst
ixpk= 0, nxpk= 0, iat=1038,1079, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25, &end
#
# 75 ASP HA 78 ASN HN 5.75
&rst
ixpk= 0, nxpk= 0, iat=1038,1079, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25, &end
#
# 75 ASP HA 78 ASN HD22 6.05
&rst
ixpk= 0, nxpk= 0, iat=1038,1089, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 75 ASP HA 78 ASN HD22 6.05
&rst
ixpk= 0, nxpk= 0, iat=1038,1089, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 75 ASP HA 78 ASN HD22 6.05
&rst
ixpk= 0, nxpk= 0, iat=1038,1089, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 75 ASP HA 90 HIG HA 5.27
&rst
ixpk= 0, nxpk= 0, iat=1038,1237, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77, &end
#
# 75 ASP HA 90 HIG HA 5.27
&rst
ixpk= 0, nxpk= 0, iat=1038,1237, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77, &end
#
# 75 ASP HA 90 HIG HA 5.27
&rst
ixpk= 0, nxpk= 0, iat=1038,1237, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77, &end
#
# 75 ASP HA 91 LEU HN 4.12
&rst
ixpk= 0, nxpk= 0, iat=1038,1252, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62, &end
#
# 75 ASP HA 91 LEU HN 4.12
&rst
ixpk= 0, nxpk= 0, iat=1038,1252, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62, &end
#
# 75 ASP HA 91 LEU HN 4.12
&rst
ixpk= 0, nxpk= 0, iat=1038,1252, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62, &end
#
# 75 ASP HA 91 LEU HB2 5.14
&rst
ixpk= 0, nxpk= 0, iat=1038,1256, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64, &end
#
# 75 ASP HA 91 LEU HB2 5.14
&rst
ixpk= 0, nxpk= 0, iat=1038,1256, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64, &end
#
# 75 ASP HA 91 LEU HB2 5.14
&rst
ixpk= 0, nxpk= 0, iat=1038,1256, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64, &end
#
# 75 ASP HA 91 LEU QD1 5.13
&rst
ixpk= 0, nxpk= 0, iat=1038, -1, r1= 1.30, r2= 1.80, r3= 6.16, r4= 6.66,
igr2=1261,1262,1263,
&end
#
# 75 ASP HA 91 LEU QD1 5.13
&rst
ixpk= 0, nxpk= 0, iat=1038, -1, r1= 1.30, r2= 1.80, r3= 6.16, r4= 6.66,
igr2=1261,1262,1263,
&end
#
# 75 ASP HA 91 LEU QD1 5.13
&rst
ixpk= 0, nxpk= 0, iat=1038, -1, r1= 1.30, r2= 1.80, r3= 6.16, r4= 6.66,
igr2=1261,1262,1263,
&end
#
# 75 ASP HA 92 GLY HN 6.01
&rst
ixpk= 0, nxpk= 0, iat=1038,1271, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51, &end
#
# 75 ASP HA 92 GLY HN 6.01
&rst
ixpk= 0, nxpk= 0, iat=1038,1271, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51, &end
#
# 75 ASP HA 92 GLY HN 6.01
&rst
ixpk= 0, nxpk= 0, iat=1038,1271, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51, &end
#
# 75 ASP HB2 76 PRO HD3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1040,1050, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 75 ASP HB2 76 PRO HD3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1040,1050, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 75 ASP HB2 76 PRO HD3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1040,1050, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 75 ASP HB2 77 GLN HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1040,1062, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 75 ASP HB2 77 GLN HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1040,1062, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 75 ASP HB2 77 GLN HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1040,1062, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 75 ASP HB2 78 ASN HN 5.91
&rst
ixpk= 0, nxpk= 0, iat=1040,1079, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41, &end
#
# 75 ASP HB2 78 ASN HN 5.91
&rst
ixpk= 0, nxpk= 0, iat=1040,1079, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41, &end
#
# 75 ASP HB2 78 ASN HN 5.91
&rst
ixpk= 0, nxpk= 0, iat=1040,1079, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41, &end
#
# 75 ASP HB2 78 ASN HD22 6.05
&rst
ixpk= 0, nxpk= 0, iat=1040,1089, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 75 ASP HB2 78 ASN HD22 6.05
&rst
ixpk= 0, nxpk= 0, iat=1040,1089, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 75 ASP HB2 78 ASN HD22 6.05
&rst
ixpk= 0, nxpk= 0, iat=1040,1089, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 75 ASP HB2 79 THR HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1040,1093, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 75 ASP HB2 79 THR HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1040,1093, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 75 ASP HB2 79 THR HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1040,1093, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 75 ASP HB2 91 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1040,1252, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 75 ASP HB2 91 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1040,1252, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 75 ASP HB2 91 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1040,1252, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 75 ASP HB3 75 ASP HB2 4.03
&rst
ixpk= 0, nxpk= 0, iat=1041,1040, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53, &end
#
# 75 ASP HB3 91 LEU HN 6.01
&rst
ixpk= 0, nxpk= 0, iat=1041,1252, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51, &end
#
# 75 ASP HB3 91 LEU HN 6.01
&rst
ixpk= 0, nxpk= 0, iat=1041,1252, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51, &end
#
# 75 ASP HB3 91 LEU HN 6.01
&rst
ixpk= 0, nxpk= 0, iat=1041,1252, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51, &end
#
# 76 PRO HA 77 GLN HN 5.00
&rst
ixpk= 0, nxpk= 0, iat=1058,1062, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 76 PRO HA 77 GLN HNE1 6.05
&rst
ixpk= 0, nxpk= 0, iat=1058,1074, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 76 PRO HA 77 GLN HNE1 6.05
&rst
ixpk= 0, nxpk= 0, iat=1058,1074, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 76 PRO HA 77 GLN HNE1 6.05
&rst
ixpk= 0, nxpk= 0, iat=1058,1074, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 76 PRO HA 91 LEU QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat=1058, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1261,1262,1263,
&end
#
# 76 PRO HA 91 LEU QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat=1058, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1261,1262,1263,
&end
#
# 76 PRO HA 91 LEU QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat=1058, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1261,1262,1263,
&end
#
# 76 PRO HB2 76 PRO HA 3.44
&rst
ixpk= 0, nxpk= 0, iat=1055,1058, r1= 1.30, r2= 1.80, r3= 3.44, r4= 3.94, &end
#
# 76 PRO HB2 77 GLN HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1055,1062, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 76 PRO HB2 77 GLN HNE1 6.05
&rst
ixpk= 0, nxpk= 0, iat=1055,1074, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 76 PRO HB2 77 GLN HNE1 6.05
&rst
ixpk= 0, nxpk= 0, iat=1055,1074, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 76 PRO HB2 77 GLN HNE1 6.05
&rst
ixpk= 0, nxpk= 0, iat=1055,1074, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 76 PRO HB3 76 PRO HA 3.54
&rst
ixpk= 0, nxpk= 0, iat=1056,1058, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04, &end
#
# 76 PRO HB3 76 PRO HB2 3.12
&rst
ixpk= 0, nxpk= 0, iat=1056,1055, r1= 1.30, r2= 1.80, r3= 3.12, r4= 3.62, &end
#
# 76 PRO HB3 77 GLN HN 5.67
&rst
ixpk= 0, nxpk= 0, iat=1056,1062, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17, &end
#
# 76 PRO HB3 77 GLN QG 3.33
&rst
ixpk= 0, nxpk= 0, iat=1056, -1, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24,
igr2=1069,1070,
&end
#
# 76 PRO HB3 77 GLN QG 3.33
&rst
ixpk= 0, nxpk= 0, iat=1056, -1, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24,
igr2=1069,1070,
&end
#
# 76 PRO HB3 77 GLN QG 3.33
&rst
ixpk= 0, nxpk= 0, iat=1056, -1, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24,
igr2=1069,1070,
&end
#
# 76 PRO HD2 76 PRO HB3 5.37
&rst
ixpk= 0, nxpk= 0, iat=1049,1056, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87, &end
#
# 76 PRO HD2 78 ASN HD22 6.05
&rst
ixpk= 0, nxpk= 0, iat=1049,1089, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 76 PRO HD2 78 ASN HD22 6.05
&rst
ixpk= 0, nxpk= 0, iat=1049,1089, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 76 PRO HD2 78 ASN HD22 6.05
&rst
ixpk= 0, nxpk= 0, iat=1049,1089, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 76 PRO HD2 91 LEU HN 4.65
&rst
ixpk= 0, nxpk= 0, iat=1049,1252, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15, &end
#
# 76 PRO HD2 91 LEU HN 4.65
&rst
ixpk= 0, nxpk= 0, iat=1049,1252, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15, &end
#
# 76 PRO HD2 91 LEU HN 4.65
&rst
ixpk= 0, nxpk= 0, iat=1049,1252, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15, &end
#
# 76 PRO HD2 91 LEU HB2 4.33
&rst
ixpk= 0, nxpk= 0, iat=1049,1256, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83, &end
#
# 76 PRO HD2 91 LEU HB2 4.33
&rst
ixpk= 0, nxpk= 0, iat=1049,1256, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83, &end
#
# 76 PRO HD2 91 LEU HB2 4.33
&rst
ixpk= 0, nxpk= 0, iat=1049,1256, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83, &end
#
# 76 PRO HD2 91 LEU QD1 4.88
&rst
ixpk= 0, nxpk= 0, iat=1049, -1, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
igr2=1261,1262,1263,
&end
#
# 76 PRO HD2 91 LEU QD1 4.88
&rst
ixpk= 0, nxpk= 0, iat=1049, -1, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
igr2=1261,1262,1263,
&end
#
# 76 PRO HD2 91 LEU QD1 4.88
&rst
ixpk= 0, nxpk= 0, iat=1049, -1, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
igr2=1261,1262,1263,
&end
#
# 76 PRO HD3 76 PRO HA 5.00
&rst
ixpk= 0, nxpk= 0, iat=1050,1058, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 76 PRO HD3 76 PRO HB3 5.19
&rst
ixpk= 0, nxpk= 0, iat=1050,1056, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69, &end
#
# 76 PRO HD3 76 PRO HD2 3.65
&rst
ixpk= 0, nxpk= 0, iat=1050,1049, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15, &end
#
# 76 PRO HD3 76 PRO HG2 3.97
&rst
ixpk= 0, nxpk= 0, iat=1050,1052, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47, &end
#
# 76 PRO HD3 77 GLN HN 5.20
&rst
ixpk= 0, nxpk= 0, iat=1050,1062, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70, &end
#
# 76 PRO HD3 77 GLN HN 5.20
&rst
ixpk= 0, nxpk= 0, iat=1050,1062, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70, &end
#
# 76 PRO HD3 77 GLN HN 5.20
&rst
ixpk= 0, nxpk= 0, iat=1050,1062, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70, &end
#
# 76 PRO HD3 78 ASN HD21 6.05
&rst
ixpk= 0, nxpk= 0, iat=1050,1088, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 76 PRO HD3 78 ASN HD21 6.05
&rst
ixpk= 0, nxpk= 0, iat=1050,1088, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 76 PRO HD3 78 ASN HD21 6.05
&rst
ixpk= 0, nxpk= 0, iat=1050,1088, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 76 PRO HD3 78 ASN HD22 6.05
&rst
ixpk= 0, nxpk= 0, iat=1050,1089, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 76 PRO HD3 78 ASN HD22 6.05
&rst
ixpk= 0, nxpk= 0, iat=1050,1089, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 76 PRO HD3 78 ASN HD22 6.05
&rst
ixpk= 0, nxpk= 0, iat=1050,1089, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 76 PRO HD3 91 LEU HN 5.26
&rst
ixpk= 0, nxpk= 0, iat=1050,1252, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76, &end
#
# 76 PRO HD3 91 LEU HN 5.26
&rst
ixpk= 0, nxpk= 0, iat=1050,1252, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76, &end
#
# 76 PRO HD3 91 LEU HN 5.26
&rst
ixpk= 0, nxpk= 0, iat=1050,1252, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76, &end
#
# 76 PRO HD3 91 LEU HB2 5.49
&rst
ixpk= 0, nxpk= 0, iat=1050,1256, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99, &end
#
# 76 PRO HD3 91 LEU HB2 5.49
&rst
ixpk= 0, nxpk= 0, iat=1050,1256, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99, &end
#
# 76 PRO HD3 91 LEU HB2 5.49
&rst
ixpk= 0, nxpk= 0, iat=1050,1256, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99, &end
#
# 76 PRO HD3 91 LEU QD1 4.62
&rst
ixpk= 0, nxpk= 0, iat=1050, -1, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,
igr2=1261,1262,1263,
&end
#
# 76 PRO HD3 91 LEU QD1 4.62
&rst
ixpk= 0, nxpk= 0, iat=1050, -1, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,
igr2=1261,1262,1263,
&end
#
# 76 PRO HD3 91 LEU QD1 4.62
&rst
ixpk= 0, nxpk= 0, iat=1050, -1, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05,
igr2=1261,1262,1263,
&end
#
# 76 PRO HG2 77 GLN HN 4.26
&rst
ixpk= 0, nxpk= 0, iat=1052,1062, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76, &end
#
# 76 PRO HG2 77 GLN HN 4.26
&rst
ixpk= 0, nxpk= 0, iat=1052,1062, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76, &end
#
# 76 PRO HG2 77 GLN HN 4.26
&rst
ixpk= 0, nxpk= 0, iat=1052,1062, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76, &end
#
# 76 PRO HG2 91 LEU QD1 5.02
&rst
ixpk= 0, nxpk= 0, iat=1052, -1, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
igr2=1261,1262,1263,
&end
#
# 76 PRO HG2 91 LEU QD1 5.02
&rst
ixpk= 0, nxpk= 0, iat=1052, -1, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
igr2=1261,1262,1263,
&end
#
# 76 PRO HG2 91 LEU QD1 5.02
&rst
ixpk= 0, nxpk= 0, iat=1052, -1, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
igr2=1261,1262,1263,
&end
#
# 76 PRO HG3 76 PRO HD2 3.88
&rst
ixpk= 0, nxpk= 0, iat=1053,1049, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38, &end
#
# 76 PRO HG3 77 GLN HN 4.39
&rst
ixpk= 0, nxpk= 0, iat=1053,1062, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89, &end
#
# 76 PRO HG3 77 GLN HN 4.39
&rst
ixpk= 0, nxpk= 0, iat=1053,1062, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89, &end
#
# 76 PRO HG3 77 GLN HN 4.39
&rst
ixpk= 0, nxpk= 0, iat=1053,1062, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89, &end
#
# 76 PRO HG3 91 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1053,1252, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 76 PRO HG3 91 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1053,1252, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 76 PRO HG3 91 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1053,1252, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 76 PRO HG3 91 LEU HB2 5.63
&rst
ixpk= 0, nxpk= 0, iat=1053,1256, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13, &end
#
# 76 PRO HG3 91 LEU HB2 5.63
&rst
ixpk= 0, nxpk= 0, iat=1053,1256, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13, &end
#
# 76 PRO HG3 91 LEU HB2 5.63
&rst
ixpk= 0, nxpk= 0, iat=1053,1256, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13, &end
#
# 76 PRO HG3 91 LEU QD1 4.06
&rst
ixpk= 0, nxpk= 0, iat=1053, -1, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
igr2=1261,1262,1263,
&end
#
# 76 PRO HG3 91 LEU QD1 4.06
&rst
ixpk= 0, nxpk= 0, iat=1053, -1, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
igr2=1261,1262,1263,
&end
#
# 76 PRO HG3 91 LEU QD1 4.06
&rst
ixpk= 0, nxpk= 0, iat=1053, -1, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
igr2=1261,1262,1263,
&end
#
# 77 GLN HN 77 GLN HA 4.12
&rst
ixpk= 0, nxpk= 0, iat=1062,1064, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62, &end
#
# 77 GLN HN 77 GLN HB2 4.39
&rst
ixpk= 0, nxpk= 0, iat=1062,1066, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89, &end
#
# 77 GLN HN 77 GLN HB2 4.39
&rst
ixpk= 0, nxpk= 0, iat=1062,1066, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89, &end
#
# 77 GLN HN 77 GLN HB2 4.39
&rst
ixpk= 0, nxpk= 0, iat=1062,1066, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89, &end
#
# 77 GLN HN 77 GLN HB3 4.15
&rst
ixpk= 0, nxpk= 0, iat=1062,1067, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65, &end
#
# 77 GLN HN 77 GLN HB3 4.15
&rst
ixpk= 0, nxpk= 0, iat=1062,1067, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65, &end
#
# 77 GLN HN 77 GLN HB3 4.15
&rst
ixpk= 0, nxpk= 0, iat=1062,1067, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65, &end
#
# 77 GLN HN 77 GLN HNE2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1062,1075, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 77 GLN HN 77 GLN HNE2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1062,1075, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 77 GLN HN 77 GLN HNE2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1062,1075, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 77 GLN HN 77 GLN QG 3.90
&rst
ixpk= 0, nxpk= 0, iat=1062, -1, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
igr2=1069,1070,
&end
#
# 77 GLN HN 77 GLN QG 3.90
&rst
ixpk= 0, nxpk= 0, iat=1062, -1, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
igr2=1069,1070,
&end
#
# 77 GLN HN 77 GLN QG 3.90
&rst
ixpk= 0, nxpk= 0, iat=1062, -1, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
igr2=1069,1070,
&end
#
# 77 GLN HN 78 ASN HN 3.54
&rst
ixpk= 0, nxpk= 0, iat=1062,1079, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04, &end
#
# 77 GLN HN 78 ASN HN 3.54
&rst
ixpk= 0, nxpk= 0, iat=1062,1079, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04, &end
#
# 77 GLN HN 78 ASN HN 3.54
&rst
ixpk= 0, nxpk= 0, iat=1062,1079, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04, &end
#
# 77 GLN HN 78 ASN HA 5.00
&rst
ixpk= 0, nxpk= 0, iat=1062,1081, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 77 GLN HN 78 ASN HA 5.00
&rst
ixpk= 0, nxpk= 0, iat=1062,1081, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 77 GLN HN 78 ASN HA 5.00
&rst
ixpk= 0, nxpk= 0, iat=1062,1081, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 77 GLN HN 78 ASN HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1062,1083, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 77 GLN HN 78 ASN HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1062,1083, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 77 GLN HN 78 ASN HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1062,1083, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 77 GLN HN 78 ASN HD21 4.40
&rst
ixpk= 0, nxpk= 0, iat=1062,1088, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 77 GLN HN 78 ASN HD21 4.40
&rst
ixpk= 0, nxpk= 0, iat=1062,1088, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 77 GLN HN 78 ASN HD21 4.40
&rst
ixpk= 0, nxpk= 0, iat=1062,1088, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 77 GLN HN 79 THR HN 5.92
&rst
ixpk= 0, nxpk= 0, iat=1062,1093, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42, &end
#
# 77 GLN HN 79 THR HN 5.92
&rst
ixpk= 0, nxpk= 0, iat=1062,1093, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42, &end
#
# 77 GLN HN 79 THR HN 5.92
&rst
ixpk= 0, nxpk= 0, iat=1062,1093, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42, &end
#
# 77 GLN HN 91 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1062,1252, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 77 GLN HN 91 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1062,1252, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 77 GLN HN 91 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1062,1252, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 77 GLN HN 91 LEU QD1 5.90
&rst
ixpk= 0, nxpk= 0, iat=1062, -1, r1= 1.30, r2= 1.80, r3= 7.09, r4= 7.59,
igr2=1261,1262,1263,
&end
#
# 77 GLN HN 91 LEU QD1 5.90
&rst
ixpk= 0, nxpk= 0, iat=1062, -1, r1= 1.30, r2= 1.80, r3= 7.09, r4= 7.59,
igr2=1261,1262,1263,
&end
#
# 77 GLN HN 91 LEU QD1 5.90
&rst
ixpk= 0, nxpk= 0, iat=1062, -1, r1= 1.30, r2= 1.80, r3= 7.09, r4= 7.59,
igr2=1261,1262,1263,
&end
#
# 77 GLN HA 77 GLN HB2 3.48
&rst
ixpk= 0, nxpk= 0, iat=1064,1066, r1= 1.30, r2= 1.80, r3= 3.48, r4= 3.98, &end
#
# 77 GLN HA 77 GLN HB3 4.57
&rst
ixpk= 0, nxpk= 0, iat=1064,1067, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07, &end
#
# 77 GLN HA 77 GLN QG 3.67
&rst
ixpk= 0, nxpk= 0, iat=1064, -1, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
igr2=1069,1070,
&end
#
# 77 GLN HA 77 GLN QG 3.67
&rst
ixpk= 0, nxpk= 0, iat=1064, -1, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
igr2=1069,1070,
&end
#
# 77 GLN HA 77 GLN QG 3.67
&rst
ixpk= 0, nxpk= 0, iat=1064, -1, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62,
igr2=1069,1070,
&end
#
# 77 GLN HA 78 ASN HN 3.87
&rst
ixpk= 0, nxpk= 0, iat=1064,1079, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37, &end
#
# 77 GLN HA 78 ASN HN 3.87
&rst
ixpk= 0, nxpk= 0, iat=1064,1079, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37, &end
#
# 77 GLN HA 78 ASN HN 3.87
&rst
ixpk= 0, nxpk= 0, iat=1064,1079, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37, &end
#
# 77 GLN HA 79 THR HN 5.21
&rst
ixpk= 0, nxpk= 0, iat=1064,1093, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71, &end
#
# 77 GLN HA 79 THR HN 5.21
&rst
ixpk= 0, nxpk= 0, iat=1064,1093, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71, &end
#
# 77 GLN HA 79 THR HN 5.21
&rst
ixpk= 0, nxpk= 0, iat=1064,1093, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71, &end
#
# 77 GLN HB2 77 GLN HB3 3.43
&rst
ixpk= 0, nxpk= 0, iat=1066,1067, r1= 1.30, r2= 1.80, r3= 3.43, r4= 3.93, &end
#
# 77 GLN HB2 78 ASN HN 5.13
&rst
ixpk= 0, nxpk= 0, iat=1066,1079, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63, &end
#
# 77 GLN HB2 78 ASN HN 5.13
&rst
ixpk= 0, nxpk= 0, iat=1066,1079, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63, &end
#
# 77 GLN HB2 78 ASN HN 5.13
&rst
ixpk= 0, nxpk= 0, iat=1066,1079, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63, &end
#
# 77 GLN HB3 77 GLN QG 3.48
&rst
ixpk= 0, nxpk= 0, iat=1067, -1, r1= 1.30, r2= 1.80, r3= 3.91, r4= 4.41,
igr2=1069,1070,
&end
#
# 77 GLN HB3 78 ASN HN 5.03
&rst
ixpk= 0, nxpk= 0, iat=1067,1079, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53, &end
#
# 77 GLN HB3 78 ASN HN 5.03
&rst
ixpk= 0, nxpk= 0, iat=1067,1079, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53, &end
#
# 77 GLN HB3 78 ASN HN 5.03
&rst
ixpk= 0, nxpk= 0, iat=1067,1079, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53, &end
#
# 78 ASN HN 78 ASN HA 3.22
&rst
ixpk= 0, nxpk= 0, iat=1079,1081, r1= 1.30, r2= 1.80, r3= 3.22, r4= 3.72, &end
#
# 78 ASN HN 78 ASN HA 3.22
&rst
ixpk= 0, nxpk= 0, iat=1079,1081, r1= 1.30, r2= 1.80, r3= 3.22, r4= 3.72, &end
#
# 78 ASN HN 78 ASN HA 3.22
&rst
ixpk= 0, nxpk= 0, iat=1079,1081, r1= 1.30, r2= 1.80, r3= 3.22, r4= 3.72, &end
#
# 78 ASN HN 78 ASN HB2 4.18
&rst
ixpk= 0, nxpk= 0, iat=1079,1083, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68, &end
#
# 78 ASN HN 78 ASN HB2 4.18
&rst
ixpk= 0, nxpk= 0, iat=1079,1083, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68, &end
#
# 78 ASN HN 78 ASN HB2 4.18
&rst
ixpk= 0, nxpk= 0, iat=1079,1083, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68, &end
#
# 78 ASN HN 78 ASN HB3 4.08
&rst
ixpk= 0, nxpk= 0, iat=1079,1084, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58, &end
#
# 78 ASN HN 78 ASN HB3 4.08
&rst
ixpk= 0, nxpk= 0, iat=1079,1084, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58, &end
#
# 78 ASN HN 78 ASN HB3 4.08
&rst
ixpk= 0, nxpk= 0, iat=1079,1084, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58, &end
#
# 78 ASN HN 78 ASN HD21 6.05
&rst
ixpk= 0, nxpk= 0, iat=1079,1088, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 78 ASN HN 78 ASN HD21 6.05
&rst
ixpk= 0, nxpk= 0, iat=1079,1088, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 78 ASN HN 78 ASN HD21 6.05
&rst
ixpk= 0, nxpk= 0, iat=1079,1088, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 78 ASN HN 78 ASN HD22 6.05
&rst
ixpk= 0, nxpk= 0, iat=1079,1089, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 78 ASN HN 78 ASN HD22 6.05
&rst
ixpk= 0, nxpk= 0, iat=1079,1089, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 78 ASN HN 78 ASN HD22 6.05
&rst
ixpk= 0, nxpk= 0, iat=1079,1089, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 78 ASN HN 79 THR HN 3.64
&rst
ixpk= 0, nxpk= 0, iat=1079,1093, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14, &end
#
# 78 ASN HN 79 THR HN 3.64
&rst
ixpk= 0, nxpk= 0, iat=1079,1093, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14, &end
#
# 78 ASN HN 79 THR HN 3.64
&rst
ixpk= 0, nxpk= 0, iat=1079,1093, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14, &end
#
# 78 ASN HN 79 THR HA 4.99
&rst
ixpk= 0, nxpk= 0, iat=1079,1095, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49, &end
#
# 78 ASN HN 79 THR HA 4.99
&rst
ixpk= 0, nxpk= 0, iat=1079,1095, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49, &end
#
# 78 ASN HN 79 THR HA 4.99
&rst
ixpk= 0, nxpk= 0, iat=1079,1095, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49, &end
#
# 78 ASN HN 79 THR QG2 5.12
&rst
ixpk= 0, nxpk= 0, iat=1079, -1, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
igr2=1099,1100,1101,
&end
#
# 78 ASN HN 79 THR QG2 5.12
&rst
ixpk= 0, nxpk= 0, iat=1079, -1, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
igr2=1099,1100,1101,
&end
#
# 78 ASN HN 79 THR QG2 5.12
&rst
ixpk= 0, nxpk= 0, iat=1079, -1, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
igr2=1099,1100,1101,
&end
#
# 78 ASN HN 80 GLY HN 5.70
&rst
ixpk= 0, nxpk= 0, iat=1079,1107, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20, &end
#
# 78 ASN HN 80 GLY HN 5.70
&rst
ixpk= 0, nxpk= 0, iat=1079,1107, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20, &end
#
# 78 ASN HN 80 GLY HN 5.70
&rst
ixpk= 0, nxpk= 0, iat=1079,1107, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20, &end
#
# 78 ASN HA 78 ASN HB2 3.86
&rst
ixpk= 0, nxpk= 0, iat=1081,1083, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 78 ASN HA 78 ASN HB3 3.94
&rst
ixpk= 0, nxpk= 0, iat=1081,1084, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44, &end
#
# 78 ASN HA 78 ASN HD21 5.51
&rst
ixpk= 0, nxpk= 0, iat=1081,1088, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01, &end
#
# 78 ASN HA 78 ASN HD21 5.51
&rst
ixpk= 0, nxpk= 0, iat=1081,1088, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01, &end
#
# 78 ASN HA 78 ASN HD21 5.51
&rst
ixpk= 0, nxpk= 0, iat=1081,1088, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01, &end
#
# 78 ASN HA 78 ASN HD22 6.05
&rst
ixpk= 0, nxpk= 0, iat=1081,1089, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 78 ASN HA 78 ASN HD22 6.05
&rst
ixpk= 0, nxpk= 0, iat=1081,1089, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 78 ASN HA 78 ASN HD22 6.05
&rst
ixpk= 0, nxpk= 0, iat=1081,1089, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 78 ASN HA 79 THR HN 3.84
&rst
ixpk= 0, nxpk= 0, iat=1081,1093, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34, &end
#
# 78 ASN HA 79 THR HN 3.84
&rst
ixpk= 0, nxpk= 0, iat=1081,1093, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34, &end
#
# 78 ASN HA 79 THR HN 3.84
&rst
ixpk= 0, nxpk= 0, iat=1081,1093, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34, &end
#
# 78 ASN HA 80 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1081,1107, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 78 ASN HA 80 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1081,1107, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 78 ASN HA 80 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1081,1107, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 78 ASN HB2 78 ASN HD21 4.24
&rst
ixpk= 0, nxpk= 0, iat=1083,1088, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74, &end
#
# 78 ASN HB2 78 ASN HD21 4.24
&rst
ixpk= 0, nxpk= 0, iat=1083,1088, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74, &end
#
# 78 ASN HB2 78 ASN HD21 4.24
&rst
ixpk= 0, nxpk= 0, iat=1083,1088, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74, &end
#
# 78 ASN HB2 78 ASN HD22 4.95
&rst
ixpk= 0, nxpk= 0, iat=1083,1089, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45, &end
#
# 78 ASN HB2 79 THR HN 5.16
&rst
ixpk= 0, nxpk= 0, iat=1083,1093, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66, &end
#
# 78 ASN HB2 79 THR HN 5.16
&rst
ixpk= 0, nxpk= 0, iat=1083,1093, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66, &end
#
# 78 ASN HB2 79 THR HN 5.16
&rst
ixpk= 0, nxpk= 0, iat=1083,1093, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66, &end
#
# 78 ASN HB2 80 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1083,1107, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 78 ASN HB2 80 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1083,1107, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 78 ASN HB2 80 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1083,1107, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 78 ASN HB3 78 ASN HB2 2.93
&rst
ixpk= 0, nxpk= 0, iat=1084,1083, r1= 1.30, r2= 1.80, r3= 2.93, r4= 3.43, &end
#
# 78 ASN HB3 78 ASN HD21 3.98
&rst
ixpk= 0, nxpk= 0, iat=1084,1088, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48, &end
#
# 78 ASN HB3 78 ASN HD21 3.98
&rst
ixpk= 0, nxpk= 0, iat=1084,1088, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48, &end
#
# 78 ASN HB3 78 ASN HD21 3.98
&rst
ixpk= 0, nxpk= 0, iat=1084,1088, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48, &end
#
# 78 ASN HB3 78 ASN HD22 4.72
&rst
ixpk= 0, nxpk= 0, iat=1084,1089, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22, &end
#
# 78 ASN HB3 79 THR HN 5.55
&rst
ixpk= 0, nxpk= 0, iat=1084,1093, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05, &end
#
# 78 ASN HB3 79 THR HN 5.55
&rst
ixpk= 0, nxpk= 0, iat=1084,1093, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05, &end
#
# 78 ASN HB3 79 THR HN 5.55
&rst
ixpk= 0, nxpk= 0, iat=1084,1093, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05, &end
#
# 78 ASN HB3 79 THR QG2 5.92
&rst
ixpk= 0, nxpk= 0, iat=1084, -1, r1= 1.30, r2= 1.80, r3= 7.11, r4= 7.61,
igr2=1099,1100,1101,
&end
#
# 78 ASN HB3 79 THR QG2 5.92
&rst
ixpk= 0, nxpk= 0, iat=1084, -1, r1= 1.30, r2= 1.80, r3= 7.11, r4= 7.61,
igr2=1099,1100,1101,
&end
#
# 78 ASN HB3 79 THR QG2 5.92
&rst
ixpk= 0, nxpk= 0, iat=1084, -1, r1= 1.30, r2= 1.80, r3= 7.11, r4= 7.61,
igr2=1099,1100,1101,
&end
#
# 78 ASN HB3 88 GLN HNE2 5.07
&rst
ixpk= 0, nxpk= 0, iat=1084,1224, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, &end
#
# 78 ASN HB3 88 GLN HNE2 5.07
&rst
ixpk= 0, nxpk= 0, iat=1084,1224, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, &end
#
# 78 ASN HB3 88 GLN HNE2 5.07
&rst
ixpk= 0, nxpk= 0, iat=1084,1224, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, &end
#
# 78 ASN HB3 91 LEU HN 5.02
&rst
ixpk= 0, nxpk= 0, iat=1084,1252, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52, &end
#
# 78 ASN HB3 91 LEU HN 5.02
&rst
ixpk= 0, nxpk= 0, iat=1084,1252, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52, &end
#
# 78 ASN HB3 91 LEU HN 5.02
&rst
ixpk= 0, nxpk= 0, iat=1084,1252, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52, &end
#
# 78 ASN HB3 91 LEU HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1084,1254, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 78 ASN HB3 91 LEU HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1084,1254, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 78 ASN HB3 91 LEU HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1084,1254, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 78 ASN HD21 78 ASN HD22 2.72
&rst
ixpk= 0, nxpk= 0, iat=1088,1089, r1= 1.30, r2= 1.80, r3= 2.72, r4= 3.22, &end
#
# 78 ASN HD21 90 HIG HA 5.18
&rst
ixpk= 0, nxpk= 0, iat=1088,1237, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68, &end
#
# 78 ASN HD21 90 HIG HA 5.18
&rst
ixpk= 0, nxpk= 0, iat=1088,1237, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68, &end
#
# 78 ASN HD21 90 HIG HA 5.18
&rst
ixpk= 0, nxpk= 0, iat=1088,1237, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68, &end
#
# 78 ASN HD21 91 LEU HG 6.05
&rst
ixpk= 0, nxpk= 0, iat=1088,1259, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 78 ASN HD21 91 LEU HG 6.05
&rst
ixpk= 0, nxpk= 0, iat=1088,1259, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 78 ASN HD21 91 LEU HG 6.05
&rst
ixpk= 0, nxpk= 0, iat=1088,1259, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 78 ASN HD21 91 LEU QD1 5.22
&rst
ixpk= 0, nxpk= 0, iat=1088, -1, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
igr2=1261,1262,1263,
&end
#
# 78 ASN HD21 91 LEU QD1 5.22
&rst
ixpk= 0, nxpk= 0, iat=1088, -1, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
igr2=1261,1262,1263,
&end
#
# 78 ASN HD21 91 LEU QD1 5.22
&rst
ixpk= 0, nxpk= 0, iat=1088, -1, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
igr2=1261,1262,1263,
&end
#
# 78 ASN HD22 90 HIG HA 5.06
&rst
ixpk= 0, nxpk= 0, iat=1089,1237, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56, &end
#
# 78 ASN HD22 90 HIG HA 5.06
&rst
ixpk= 0, nxpk= 0, iat=1089,1237, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56, &end
#
# 78 ASN HD22 90 HIG HA 5.06
&rst
ixpk= 0, nxpk= 0, iat=1089,1237, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56, &end
#
# 78 ASN HD22 91 LEU HN 5.46
&rst
ixpk= 0, nxpk= 0, iat=1089,1252, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96, &end
#
# 78 ASN HD22 91 LEU HN 5.46
&rst
ixpk= 0, nxpk= 0, iat=1089,1252, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96, &end
#
# 78 ASN HD22 91 LEU HN 5.46
&rst
ixpk= 0, nxpk= 0, iat=1089,1252, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96, &end
#
# 78 ASN HD22 91 LEU QD1 5.53
&rst
ixpk= 0, nxpk= 0, iat=1089, -1, r1= 1.30, r2= 1.80, r3= 6.64, r4= 7.14,
igr2=1261,1262,1263,
&end
#
# 78 ASN HD22 91 LEU QD1 5.53
&rst
ixpk= 0, nxpk= 0, iat=1089, -1, r1= 1.30, r2= 1.80, r3= 6.64, r4= 7.14,
igr2=1261,1262,1263,
&end
#
# 78 ASN HD22 91 LEU QD1 5.53
&rst
ixpk= 0, nxpk= 0, iat=1089, -1, r1= 1.30, r2= 1.80, r3= 6.64, r4= 7.14,
igr2=1261,1262,1263,
&end
#
# 79 THR HN 79 THR HA 4.17
&rst
ixpk= 0, nxpk= 0, iat=1093,1095, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67, &end
#
# 79 THR HN 79 THR HB 5.53
&rst
ixpk= 0, nxpk= 0, iat=1093,1097, r1= 1.30, r2= 1.80, r3= 5.53, r4= 6.03, &end
#
# 79 THR HN 79 THR QG2 3.69
&rst
ixpk= 0, nxpk= 0, iat=1093, -1, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
igr2=1099,1100,1101,
&end
#
# 79 THR HN 79 THR QG2 3.69
&rst
ixpk= 0, nxpk= 0, iat=1093, -1, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
igr2=1099,1100,1101,
&end
#
# 79 THR HN 79 THR QG2 3.69
&rst
ixpk= 0, nxpk= 0, iat=1093, -1, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
igr2=1099,1100,1101,
&end
#
# 79 THR HN 80 GLY HN 3.82
&rst
ixpk= 0, nxpk= 0, iat=1093,1107, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32, &end
#
# 79 THR HN 80 GLY HN 3.82
&rst
ixpk= 0, nxpk= 0, iat=1093,1107, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32, &end
#
# 79 THR HN 80 GLY HN 3.82
&rst
ixpk= 0, nxpk= 0, iat=1093,1107, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32, &end
#
# 79 THR HN 80 GLY QA 5.76
&rst
ixpk= 0, nxpk= 0, iat=1093, -1, r1= 1.30, r2= 1.80, r3= 6.47, r4= 6.97,
igr2=1109,1110,
&end
#
# 79 THR HN 80 GLY QA 5.76
&rst
ixpk= 0, nxpk= 0, iat=1093, -1, r1= 1.30, r2= 1.80, r3= 6.47, r4= 6.97,
igr2=1109,1110,
&end
#
# 79 THR HN 80 GLY QA 5.76
&rst
ixpk= 0, nxpk= 0, iat=1093, -1, r1= 1.30, r2= 1.80, r3= 6.47, r4= 6.97,
igr2=1109,1110,
&end
#
# 79 THR HN 81 LYS HN 5.29
&rst
ixpk= 0, nxpk= 0, iat=1093,1114, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79, &end
#
# 79 THR HN 81 LYS HN 5.29
&rst
ixpk= 0, nxpk= 0, iat=1093,1114, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79, &end
#
# 79 THR HN 81 LYS HN 5.29
&rst
ixpk= 0, nxpk= 0, iat=1093,1114, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79, &end
#
# 79 THR HA 79 THR HB 2.82
&rst
ixpk= 0, nxpk= 0, iat=1095,1097, r1= 1.30, r2= 1.80, r3= 2.82, r4= 3.32, &end
#
# 79 THR HA 79 THR HB 2.82
&rst
ixpk= 0, nxpk= 0, iat=1095,1097, r1= 1.30, r2= 1.80, r3= 2.82, r4= 3.32, &end
#
# 79 THR HA 79 THR HB 2.82
&rst
ixpk= 0, nxpk= 0, iat=1095,1097, r1= 1.30, r2= 1.80, r3= 2.82, r4= 3.32, &end
#
# 79 THR HA 79 THR QG2 3.56
&rst
ixpk= 0, nxpk= 0, iat=1095, -1, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,
igr2=1099,1100,1101,
&end
#
# 79 THR HA 79 THR QG2 3.56
&rst
ixpk= 0, nxpk= 0, iat=1095, -1, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,
igr2=1099,1100,1101,
&end
#
# 79 THR HA 79 THR QG2 3.56
&rst
ixpk= 0, nxpk= 0, iat=1095, -1, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,
igr2=1099,1100,1101,
&end
#
# 79 THR HA 80 GLY HN 4.62
&rst
ixpk= 0, nxpk= 0, iat=1095,1107, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12, &end
#
# 79 THR HA 81 LYS HD3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1095,1125, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 79 THR HA 81 LYS HD3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1095,1125, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 79 THR HA 81 LYS HD3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1095,1125, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 79 THR HB 79 THR QG2 3.49
&rst
ixpk= 0, nxpk= 0, iat=1097, -1, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69,
igr2=1099,1100,1101,
&end
#
# 79 THR HB 81 LYS HD3 5.36
&rst
ixpk= 0, nxpk= 0, iat=1097,1125, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86, &end
#
# 79 THR HB 81 LYS HD3 5.36
&rst
ixpk= 0, nxpk= 0, iat=1097,1125, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86, &end
#
# 79 THR HB 81 LYS HD3 5.36
&rst
ixpk= 0, nxpk= 0, iat=1097,1125, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86, &end
#
# 79 THR HB 89 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1097,1228, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 79 THR HB 89 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1097,1228, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 79 THR HB 89 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1097,1228, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 79 THR QG2 80 GLY HN 4.81
&rst
ixpk= 0, nxpk= 0, iat= -1,1107, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr1=1099,1100,1101,
&end
#
# 79 THR QG2 80 GLY HN 4.81
&rst
ixpk= 0, nxpk= 0, iat= -1,1107, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr1=1099,1100,1101,
&end
#
# 79 THR QG2 80 GLY HN 4.81
&rst
ixpk= 0, nxpk= 0, iat= -1,1107, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr1=1099,1100,1101,
&end
#
# 79 THR QG2 81 LYS HN 4.61
&rst
ixpk= 0, nxpk= 0, iat= -1,1114, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
igr1=1099,1100,1101,
&end
#
# 79 THR QG2 81 LYS HN 4.61
&rst
ixpk= 0, nxpk= 0, iat= -1,1114, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
igr1=1099,1100,1101,
&end
#
# 79 THR QG2 81 LYS HN 4.61
&rst
ixpk= 0, nxpk= 0, iat= -1,1114, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
igr1=1099,1100,1101,
&end
#
# 79 THR QG2 81 LYS HG2 3.19
&rst
ixpk= 0, nxpk= 0, iat= -1,1121, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,
igr1=1099,1100,1101,
&end
#
# 79 THR QG2 81 LYS HG2 3.19
&rst
ixpk= 0, nxpk= 0, iat= -1,1121, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,
igr1=1099,1100,1101,
&end
#
# 79 THR QG2 81 LYS HG2 3.19
&rst
ixpk= 0, nxpk= 0, iat= -1,1121, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33,
igr1=1099,1100,1101,
&end
#
# 79 THR QG2 88 GLN HB3 5.20
&rst
ixpk= 0, nxpk= 0, iat= -1,1216, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
igr1=1099,1100,1101,
&end
#
# 79 THR QG2 88 GLN HB3 5.20
&rst
ixpk= 0, nxpk= 0, iat= -1,1216, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
igr1=1099,1100,1101,
&end
#
# 79 THR QG2 88 GLN HB3 5.20
&rst
ixpk= 0, nxpk= 0, iat= -1,1216, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
igr1=1099,1100,1101,
&end
#
# 79 THR QG2 88 GLN HNE1 5.63
&rst
ixpk= 0, nxpk= 0, iat= -1,1223, r1= 1.30, r2= 1.80, r3= 6.76, r4= 7.26,
igr1=1099,1100,1101,
&end
#
# 79 THR QG2 88 GLN HNE1 5.63
&rst
ixpk= 0, nxpk= 0, iat= -1,1223, r1= 1.30, r2= 1.80, r3= 6.76, r4= 7.26,
igr1=1099,1100,1101,
&end
#
# 79 THR QG2 88 GLN HNE1 5.63
&rst
ixpk= 0, nxpk= 0, iat= -1,1223, r1= 1.30, r2= 1.80, r3= 6.76, r4= 7.26,
igr1=1099,1100,1101,
&end
#
# 79 THR QG2 88 GLN HG2 4.58
&rst
ixpk= 0, nxpk= 0, iat= -1,1218, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
igr1=1099,1100,1101,
&end
#
# 79 THR QG2 88 GLN HG2 4.58
&rst
ixpk= 0, nxpk= 0, iat= -1,1218, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
igr1=1099,1100,1101,
&end
#
# 79 THR QG2 88 GLN HG2 4.58
&rst
ixpk= 0, nxpk= 0, iat= -1,1218, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
igr1=1099,1100,1101,
&end
#
# 79 THR QG2 89 GLY HN 5.41
&rst
ixpk= 0, nxpk= 0, iat= -1,1228, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
igr1=1099,1100,1101,
&end
#
# 79 THR QG2 89 GLY HN 5.41
&rst
ixpk= 0, nxpk= 0, iat= -1,1228, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
igr1=1099,1100,1101,
&end
#
# 79 THR QG2 89 GLY HN 5.41
&rst
ixpk= 0, nxpk= 0, iat= -1,1228, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
igr1=1099,1100,1101,
&end
#
# 79 THR QG2 89 GLY HA2 4.67
&rst
ixpk= 0, nxpk= 0, iat= -1,1230, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr1=1099,1100,1101,
&end
#
# 79 THR QG2 89 GLY HA2 4.67
&rst
ixpk= 0, nxpk= 0, iat= -1,1230, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr1=1099,1100,1101,
&end
#
# 79 THR QG2 89 GLY HA2 4.67
&rst
ixpk= 0, nxpk= 0, iat= -1,1230, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr1=1099,1100,1101,
&end
#
# 79 THR QG2 89 GLY HA3 5.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1231, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
igr1=1099,1100,1101,
&end
#
# 79 THR QG2 89 GLY HA3 5.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1231, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
igr1=1099,1100,1101,
&end
#
# 79 THR QG2 89 GLY HA3 5.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1231, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
igr1=1099,1100,1101,
&end
#
# 79 THR QG2 90 HIG HN 4.97
&rst
ixpk= 0, nxpk= 0, iat= -1,1235, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr1=1099,1100,1101,
&end
#
# 79 THR QG2 90 HIG HN 4.97
&rst
ixpk= 0, nxpk= 0, iat= -1,1235, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr1=1099,1100,1101,
&end
#
# 79 THR QG2 90 HIG HN 4.97
&rst
ixpk= 0, nxpk= 0, iat= -1,1235, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr1=1099,1100,1101,
&end
#
# 79 THR QG2 90 HIG HA 5.69
&rst
ixpk= 0, nxpk= 0, iat= -1,1237, r1= 1.30, r2= 1.80, r3= 6.83, r4= 7.33,
igr1=1099,1100,1101,
&end
#
# 79 THR QG2 90 HIG HA 5.69
&rst
ixpk= 0, nxpk= 0, iat= -1,1237, r1= 1.30, r2= 1.80, r3= 6.83, r4= 7.33,
igr1=1099,1100,1101,
&end
#
# 79 THR QG2 90 HIG HA 5.69
&rst
ixpk= 0, nxpk= 0, iat= -1,1237, r1= 1.30, r2= 1.80, r3= 6.83, r4= 7.33,
igr1=1099,1100,1101,
&end
#
# 80 GLY HN 80 GLY QA 3.59
&rst
ixpk= 0, nxpk= 0, iat=1107, -1, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,
igr2=1109,1110,
&end
#
# 80 GLY HN 81 LYS HN 4.01
&rst
ixpk= 0, nxpk= 0, iat=1107,1114, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51, &end
#
# 80 GLY HN 81 LYS HN 4.01
&rst
ixpk= 0, nxpk= 0, iat=1107,1114, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51, &end
#
# 80 GLY HN 81 LYS HN 4.01
&rst
ixpk= 0, nxpk= 0, iat=1107,1114, r1= 1.30, r2= 1.80, r3= 4.01, r4= 4.51, &end
#
# 80 GLY HN 81 LYS HN 5.28
&rst
ixpk= 0, nxpk= 0, iat=1107,1114, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 80 GLY HN 81 LYS HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1107,1116, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 80 GLY HN 81 LYS HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1107,1116, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 80 GLY HN 81 LYS HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1107,1116, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 80 GLY HN 81 LYS HD3 5.74
&rst
ixpk= 0, nxpk= 0, iat=1107,1125, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24, &end
#
# 80 GLY HN 81 LYS HD3 5.74
&rst
ixpk= 0, nxpk= 0, iat=1107,1125, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24, &end
#
# 80 GLY HN 81 LYS HD3 5.74
&rst
ixpk= 0, nxpk= 0, iat=1107,1125, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24, &end
#
# 80 GLY HN 90 HIG HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1107,1235, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 80 GLY HN 90 HIG HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1107,1235, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 80 GLY HN 90 HIG HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1107,1235, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 80 GLY HN 90 HIG HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1107,1237, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 80 GLY HN 90 HIG HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1107,1237, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 80 GLY HN 90 HIG HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1107,1237, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 80 GLY HA2 81 LYS HN 2.97
&rst
ixpk= 0, nxpk= 0, iat=1109,1114, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 80 GLY QA 81 LYS HN 4.03
&rst
ixpk= 0, nxpk= 0, iat= -1,1114, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
igr1=1109,1110,
&end
#
# 80 GLY QA 81 LYS HB2 5.95
&rst
ixpk= 0, nxpk= 0, iat= -1,1118, r1= 1.30, r2= 1.80, r3= 6.68, r4= 7.18,
igr1=1109,1110,
&end
#
# 80 GLY QA 81 LYS HB2 5.95
&rst
ixpk= 0, nxpk= 0, iat= -1,1118, r1= 1.30, r2= 1.80, r3= 6.68, r4= 7.18,
igr1=1109,1110,
&end
#
# 80 GLY QA 81 LYS HB2 5.95
&rst
ixpk= 0, nxpk= 0, iat= -1,1118, r1= 1.30, r2= 1.80, r3= 6.68, r4= 7.18,
igr1=1109,1110,
&end
#
# 80 GLY QA 81 LYS HD3 5.71
&rst
ixpk= 0, nxpk= 0, iat= -1,1125, r1= 1.30, r2= 1.80, r3= 6.41, r4= 6.91,
igr1=1109,1110,
&end
#
# 80 GLY QA 81 LYS HD3 5.71
&rst
ixpk= 0, nxpk= 0, iat= -1,1125, r1= 1.30, r2= 1.80, r3= 6.41, r4= 6.91,
igr1=1109,1110,
&end
#
# 80 GLY QA 81 LYS HD3 5.71
&rst
ixpk= 0, nxpk= 0, iat= -1,1125, r1= 1.30, r2= 1.80, r3= 6.41, r4= 6.91,
igr1=1109,1110,
&end
#
# 80 GLY QA 81 LYS HG2 5.72
&rst
ixpk= 0, nxpk= 0, iat= -1,1121, r1= 1.30, r2= 1.80, r3= 6.42, r4= 6.92,
igr1=1109,1110,
&end
#
# 80 GLY QA 81 LYS HG2 5.72
&rst
ixpk= 0, nxpk= 0, iat= -1,1121, r1= 1.30, r2= 1.80, r3= 6.42, r4= 6.92,
igr1=1109,1110,
&end
#
# 80 GLY QA 81 LYS HG2 5.72
&rst
ixpk= 0, nxpk= 0, iat= -1,1121, r1= 1.30, r2= 1.80, r3= 6.42, r4= 6.92,
igr1=1109,1110,
&end
#
# 80 GLY QA 89 GLY HA3 5.61
&rst
ixpk= 0, nxpk= 0, iat= -1,1231, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
igr1=1109,1110,
&end
#
# 80 GLY QA 89 GLY HA3 5.61
&rst
ixpk= 0, nxpk= 0, iat= -1,1231, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
igr1=1109,1110,
&end
#
# 80 GLY QA 89 GLY HA3 5.61
&rst
ixpk= 0, nxpk= 0, iat= -1,1231, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
igr1=1109,1110,
&end
#
# 81 LYS HN 81 LYS HA 4.25
&rst
ixpk= 0, nxpk= 0, iat=1114,1116, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75, &end
#
# 81 LYS HN 81 LYS HB2 4.50
&rst
ixpk= 0, nxpk= 0, iat=1114,1118, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 81 LYS HN 81 LYS HB2 4.50
&rst
ixpk= 0, nxpk= 0, iat=1114,1118, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 81 LYS HN 81 LYS HB2 4.50
&rst
ixpk= 0, nxpk= 0, iat=1114,1118, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 81 LYS HN 81 LYS HB3 4.40
&rst
ixpk= 0, nxpk= 0, iat=1114,1119, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 81 LYS HN 81 LYS HB3 4.40
&rst
ixpk= 0, nxpk= 0, iat=1114,1119, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 81 LYS HN 81 LYS HB3 4.40
&rst
ixpk= 0, nxpk= 0, iat=1114,1119, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 81 LYS HN 81 LYS HD3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1114,1125, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 81 LYS HN 81 LYS HD3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1114,1125, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 81 LYS HN 81 LYS HD3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1114,1125, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 81 LYS HN 81 LYS HG2 3.83
&rst
ixpk= 0, nxpk= 0, iat=1114,1121, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33, &end
#
# 81 LYS HN 81 LYS HG2 3.83
&rst
ixpk= 0, nxpk= 0, iat=1114,1121, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33, &end
#
# 81 LYS HN 81 LYS HG2 3.83
&rst
ixpk= 0, nxpk= 0, iat=1114,1121, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33, &end
#
# 81 LYS HN 82 HIF HN 5.28
&rst
ixpk= 0, nxpk= 0, iat=1114,1136, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 81 LYS HN 82 HIF HN 5.28
&rst
ixpk= 0, nxpk= 0, iat=1114,1136, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 81 LYS HN 82 HIF HN 5.28
&rst
ixpk= 0, nxpk= 0, iat=1114,1136, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 81 LYS HN 82 HIF HN 5.28
&rst
ixpk= 0, nxpk= 0, iat=1114,1136, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 81 LYS HN 82 HIF HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1114,1138, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 81 LYS HN 82 HIF HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1114,1138, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 81 LYS HN 82 HIF HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1114,1138, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 81 LYS HN 89 GLY HA2 4.80
&rst
ixpk= 0, nxpk= 0, iat=1114,1230, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30, &end
#
# 81 LYS HN 89 GLY HA2 4.80
&rst
ixpk= 0, nxpk= 0, iat=1114,1230, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30, &end
#
# 81 LYS HN 89 GLY HA2 4.80
&rst
ixpk= 0, nxpk= 0, iat=1114,1230, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30, &end
#
# 81 LYS HN 89 GLY HA3 4.80
&rst
ixpk= 0, nxpk= 0, iat=1114,1231, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30, &end
#
# 81 LYS HN 89 GLY HA3 4.80
&rst
ixpk= 0, nxpk= 0, iat=1114,1231, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30, &end
#
# 81 LYS HN 89 GLY HA3 4.80
&rst
ixpk= 0, nxpk= 0, iat=1114,1231, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30, &end
#
# 81 LYS HN 90 HIG HN 4.91
&rst
ixpk= 0, nxpk= 0, iat=1114,1235, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41, &end
#
# 81 LYS HN 90 HIG HN 4.91
&rst
ixpk= 0, nxpk= 0, iat=1114,1235, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41, &end
#
# 81 LYS HN 90 HIG HN 4.91
&rst
ixpk= 0, nxpk= 0, iat=1114,1235, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41, &end
#
# 81 LYS HA 81 LYS HB3 5.94
&rst
ixpk= 0, nxpk= 0, iat=1116,1119, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44, &end
#
# 81 LYS HA 81 LYS HG3 4.94
&rst
ixpk= 0, nxpk= 0, iat=1116,1122, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44, &end
#
# 81 LYS HA 82 HIF HN 2.97
&rst
ixpk= 0, nxpk= 0, iat=1116,1136, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 81 LYS HA 82 HIF HN 3.34
&rst
ixpk= 0, nxpk= 0, iat=1116,1136, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84, &end
#
# 81 LYS HA 82 HIF HN 3.34
&rst
ixpk= 0, nxpk= 0, iat=1116,1136, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84, &end
#
# 81 LYS HA 82 HIF HN 3.34
&rst
ixpk= 0, nxpk= 0, iat=1116,1136, r1= 1.30, r2= 1.80, r3= 3.34, r4= 3.84, &end
#
# 81 LYS HA 82 HIF QB 5.57
&rst
ixpk= 0, nxpk= 0, iat=1116, -1, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75,
igr2=1140,1141,
&end
#
# 81 LYS HA 82 HIF QB 5.57
&rst
ixpk= 0, nxpk= 0, iat=1116, -1, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75,
igr2=1140,1141,
&end
#
# 81 LYS HA 82 HIF QB 5.57
&rst
ixpk= 0, nxpk= 0, iat=1116, -1, r1= 1.30, r2= 1.80, r3= 6.25, r4= 6.75,
igr2=1140,1141,
&end
#
# 81 LYS HB2 81 LYS HB3 3.62
&rst
ixpk= 0, nxpk= 0, iat=1118,1119, r1= 1.30, r2= 1.80, r3= 3.62, r4= 4.12, &end
#
# 81 LYS HB2 81 LYS HG2 3.58
&rst
ixpk= 0, nxpk= 0, iat=1118,1121, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08, &end
#
# 81 LYS HB2 81 LYS QE 6.05
&rst
ixpk= 0, nxpk= 0, iat=1118, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2=1127,1128,
&end
#
# 81 LYS HB2 81 LYS QE 6.05
&rst
ixpk= 0, nxpk= 0, iat=1118, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2=1127,1128,
&end
#
# 81 LYS HB2 81 LYS QE 6.05
&rst
ixpk= 0, nxpk= 0, iat=1118, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2=1127,1128,
&end
#
# 81 LYS HB2 82 HIF HN 5.00
&rst
ixpk= 0, nxpk= 0, iat=1118,1136, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 81 LYS HB2 82 HIF HN 5.00
&rst
ixpk= 0, nxpk= 0, iat=1118,1136, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 81 LYS HB2 82 HIF HN 5.00
&rst
ixpk= 0, nxpk= 0, iat=1118,1136, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 81 LYS HB2 82 HIF HN 5.72
&rst
ixpk= 0, nxpk= 0, iat=1118,1136, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 81 LYS HB2 89 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1118,1231, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 81 LYS HB2 89 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1118,1231, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 81 LYS HB2 89 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1118,1231, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 81 LYS HB3 81 LYS HG3 3.54
&rst
ixpk= 0, nxpk= 0, iat=1119,1122, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04, &end
#
# 81 LYS HB3 81 LYS QE 5.47
&rst
ixpk= 0, nxpk= 0, iat=1119, -1, r1= 1.30, r2= 1.80, r3= 6.14, r4= 6.64,
igr2=1127,1128,
&end
#
# 81 LYS HB3 81 LYS QE 5.47
&rst
ixpk= 0, nxpk= 0, iat=1119, -1, r1= 1.30, r2= 1.80, r3= 6.14, r4= 6.64,
igr2=1127,1128,
&end
#
# 81 LYS HB3 81 LYS QE 5.47
&rst
ixpk= 0, nxpk= 0, iat=1119, -1, r1= 1.30, r2= 1.80, r3= 6.14, r4= 6.64,
igr2=1127,1128,
&end
#
# 81 LYS HB3 82 HIF HN 4.92
&rst
ixpk= 0, nxpk= 0, iat=1119,1136, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42, &end
#
# 81 LYS HB3 82 HIF HN 4.92
&rst
ixpk= 0, nxpk= 0, iat=1119,1136, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42, &end
#
# 81 LYS HB3 82 HIF HN 4.92
&rst
ixpk= 0, nxpk= 0, iat=1119,1136, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42, &end
#
# 81 LYS HB3 82 HIF QB 5.60
&rst
ixpk= 0, nxpk= 0, iat=1119, -1, r1= 1.30, r2= 1.80, r3= 6.29, r4= 6.79,
igr2=1140,1141,
&end
#
# 81 LYS HB3 82 HIF QB 5.60
&rst
ixpk= 0, nxpk= 0, iat=1119, -1, r1= 1.30, r2= 1.80, r3= 6.29, r4= 6.79,
igr2=1140,1141,
&end
#
# 81 LYS HB3 82 HIF QB 5.60
&rst
ixpk= 0, nxpk= 0, iat=1119, -1, r1= 1.30, r2= 1.80, r3= 6.29, r4= 6.79,
igr2=1140,1141,
&end
#
# 81 LYS HB3 136 ASP HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1119,1923, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 81 LYS HB3 136 ASP HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1119,1923, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 81 LYS HB3 136 ASP HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1119,1923, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 81 LYS HB3 136 ASP HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1119,1925, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 81 LYS HB3 136 ASP HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1119,1925, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 81 LYS HB3 136 ASP HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1119,1925, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 81 LYS HB3 140 PRO HA 4.77
&rst
ixpk= 0, nxpk= 0, iat=1119,1998, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27, &end
#
# 81 LYS HB3 140 PRO HA 4.77
&rst
ixpk= 0, nxpk= 0, iat=1119,1998, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27, &end
#
# 81 LYS HB3 140 PRO HA 4.77
&rst
ixpk= 0, nxpk= 0, iat=1119,1998, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27, &end
#
# 81 LYS HD2 81 LYS QE 3.98
&rst
ixpk= 0, nxpk= 0, iat=1124, -1, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
igr2=1127,1128,
&end
#
# 81 LYS HD3 81 LYS QE 4.53
&rst
ixpk= 0, nxpk= 0, iat=1125, -1, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
igr2=1127,1128,
&end
#
# 81 LYS HG2 81 LYS HD3 4.17
&rst
ixpk= 0, nxpk= 0, iat=1121,1125, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67, &end
#
# 81 LYS HG2 89 GLY HA3 4.82
&rst
ixpk= 0, nxpk= 0, iat=1121,1231, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32, &end
#
# 81 LYS HG2 89 GLY HA3 4.82
&rst
ixpk= 0, nxpk= 0, iat=1121,1231, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32, &end
#
# 81 LYS HG2 89 GLY HA3 4.82
&rst
ixpk= 0, nxpk= 0, iat=1121,1231, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32, &end
#
# 81 LYS HG3 81 LYS HG2 3.02
&rst
ixpk= 0, nxpk= 0, iat=1122,1121, r1= 1.30, r2= 1.80, r3= 3.02, r4= 3.52, &end
#
# 81 LYS HG3 81 LYS QE 4.26
&rst
ixpk= 0, nxpk= 0, iat=1122, -1, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
igr2=1127,1128,
&end
#
# 81 LYS HG3 81 LYS QE 4.26
&rst
ixpk= 0, nxpk= 0, iat=1122, -1, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
igr2=1127,1128,
&end
#
# 81 LYS HG3 81 LYS QE 4.26
&rst
ixpk= 0, nxpk= 0, iat=1122, -1, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
igr2=1127,1128,
&end
#
# 81 LYS QE 136 ASP HA 5.97
&rst
ixpk= 0, nxpk= 0, iat= -1,1925, r1= 1.30, r2= 1.80, r3= 6.70, r4= 7.20,
igr1=1127,1128,
&end
#
# 81 LYS QE 136 ASP HA 5.97
&rst
ixpk= 0, nxpk= 0, iat= -1,1925, r1= 1.30, r2= 1.80, r3= 6.70, r4= 7.20,
igr1=1127,1128,
&end
#
# 81 LYS QE 136 ASP HA 5.97
&rst
ixpk= 0, nxpk= 0, iat= -1,1925, r1= 1.30, r2= 1.80, r3= 6.70, r4= 7.20,
igr1=1127,1128,
&end
#
# 82 HIF HN 82 HIF HA 4.58
&rst
ixpk= 0, nxpk= 0, iat=1136,1138, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08, &end
#
# 82 HIF HN 82 HIF QB 4.76
&rst
ixpk= 0, nxpk= 0, iat=1136, -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr2=1140,1141,
&end
#
# 82 HIF HN 82 HIF QB 4.33
&rst
ixpk= 0, nxpk= 0, iat=1136, -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
igr2=1140,1141,
&end
#
# 82 HIF HN 82 HIF QB 4.33
&rst
ixpk= 0, nxpk= 0, iat=1136, -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
igr2=1140,1141,
&end
#
# 82 HIF HN 82 HIF QB 4.33
&rst
ixpk= 0, nxpk= 0, iat=1136, -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
igr2=1140,1141,
&end
#
# 82 HIF HN 83 GLU HN 5.28
&rst
ixpk= 0, nxpk= 0, iat=1136,1153, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 82 HIF HN 83 GLU HN 5.76
&rst
ixpk= 0, nxpk= 0, iat=1136,1153, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26, &end
#
# 82 HIF HN 83 GLU HN 5.76
&rst
ixpk= 0, nxpk= 0, iat=1136,1153, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26, &end
#
# 82 HIF HN 83 GLU HN 5.76
&rst
ixpk= 0, nxpk= 0, iat=1136,1153, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26, &end
#
# 82 HIF HN 89 GLY HA3 4.06
&rst
ixpk= 0, nxpk= 0, iat=1136,1231, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56, &end
#
# 82 HIF HN 89 GLY HA3 4.06
&rst
ixpk= 0, nxpk= 0, iat=1136,1231, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56, &end
#
# 82 HIF HN 89 GLY HA3 4.06
&rst
ixpk= 0, nxpk= 0, iat=1136,1231, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56, &end
#
# 82 HIF HN 141 LEU QD1 5.26
&rst
ixpk= 0, nxpk= 0, iat=1136, -1, r1= 1.30, r2= 1.80, r3= 6.32, r4= 6.82,
igr2=2011,2012,2013,
&end
#
# 82 HIF HN 141 LEU QD1 5.26
&rst
ixpk= 0, nxpk= 0, iat=1136, -1, r1= 1.30, r2= 1.80, r3= 6.32, r4= 6.82,
igr2=2011,2012,2013,
&end
#
# 82 HIF HA 83 GLU HN 2.97
&rst
ixpk= 0, nxpk= 0, iat=1138,1153, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 82 HIF HA 83 GLU HN 3.86
&rst
ixpk= 0, nxpk= 0, iat=1138,1153, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 82 HIF HA 83 GLU HN 3.86
&rst
ixpk= 0, nxpk= 0, iat=1138,1153, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 82 HIF HA 83 GLU HN 3.86
&rst
ixpk= 0, nxpk= 0, iat=1138,1153, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 82 HIF HA 83 GLU HA 5.59
&rst
ixpk= 0, nxpk= 0, iat=1138,1155, r1= 1.30, r2= 1.80, r3= 5.59, r4= 6.09, &end
#
# 82 HIF HA 83 GLU HA 5.59
&rst
ixpk= 0, nxpk= 0, iat=1138,1155, r1= 1.30, r2= 1.80, r3= 5.59, r4= 6.09, &end
#
# 82 HIF HA 83 GLU HA 5.59
&rst
ixpk= 0, nxpk= 0, iat=1138,1155, r1= 1.30, r2= 1.80, r3= 5.59, r4= 6.09, &end
#
# 82 HIF HA 89 GLY HA2 4.95
&rst
ixpk= 0, nxpk= 0, iat=1138,1230, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45, &end
#
# 82 HIF HA 89 GLY HA2 4.95
&rst
ixpk= 0, nxpk= 0, iat=1138,1230, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45, &end
#
# 82 HIF HA 89 GLY HA2 4.95
&rst
ixpk= 0, nxpk= 0, iat=1138,1230, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45, &end
#
# 82 HIF HA 90 HIG HN 4.78
&rst
ixpk= 0, nxpk= 0, iat=1138,1235, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, &end
#
# 82 HIF HA 90 HIG HN 4.78
&rst
ixpk= 0, nxpk= 0, iat=1138,1235, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, &end
#
# 82 HIF HA 90 HIG HN 4.78
&rst
ixpk= 0, nxpk= 0, iat=1138,1235, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, &end
#
# 82 HIF HA 141 LEU QD1 5.97
&rst
ixpk= 0, nxpk= 0, iat=1138, -1, r1= 1.30, r2= 1.80, r3= 7.17, r4= 7.67,
igr2=2011,2012,2013,
&end
#
# 82 HIF HA 141 LEU QD1 5.97
&rst
ixpk= 0, nxpk= 0, iat=1138, -1, r1= 1.30, r2= 1.80, r3= 7.17, r4= 7.67,
igr2=2011,2012,2013,
&end
#
# 83 GLU HN 83 GLU HA 4.38
&rst
ixpk= 0, nxpk= 0, iat=1153,1155, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88, &end
#
# 83 GLU HN 83 GLU HG2 5.21
&rst
ixpk= 0, nxpk= 0, iat=1153,1160, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71, &end
#
# 83 GLU HN 83 GLU HG2 5.21
&rst
ixpk= 0, nxpk= 0, iat=1153,1160, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71, &end
#
# 83 GLU HN 83 GLU HG2 5.21
&rst
ixpk= 0, nxpk= 0, iat=1153,1160, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71, &end
#
# 83 GLU HN 83 GLU HG3 5.40
&rst
ixpk= 0, nxpk= 0, iat=1153,1161, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90, &end
#
# 83 GLU HN 83 GLU HG3 5.40
&rst
ixpk= 0, nxpk= 0, iat=1153,1161, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90, &end
#
# 83 GLU HN 83 GLU HG3 5.40
&rst
ixpk= 0, nxpk= 0, iat=1153,1161, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90, &end
#
# 83 GLU HN 83 GLU QB 4.95
&rst
ixpk= 0, nxpk= 0, iat=1153, -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
igr2=1157,1158,
&end
#
# 83 GLU HN 84 GLY HN 4.35
&rst
ixpk= 0, nxpk= 0, iat=1153,1168, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85, &end
#
# 83 GLU HN 84 GLY HN 4.35
&rst
ixpk= 0, nxpk= 0, iat=1153,1168, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85, &end
#
# 83 GLU HN 84 GLY HN 4.35
&rst
ixpk= 0, nxpk= 0, iat=1153,1168, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85, &end
#
# 83 GLU HN 84 GLY HN 5.28
&rst
ixpk= 0, nxpk= 0, iat=1153,1168, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 83 GLU HN 84 GLY HA2 5.83
&rst
ixpk= 0, nxpk= 0, iat=1153,1170, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33, &end
#
# 83 GLU HN 84 GLY HA2 5.83
&rst
ixpk= 0, nxpk= 0, iat=1153,1170, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33, &end
#
# 83 GLU HN 84 GLY HA2 5.83
&rst
ixpk= 0, nxpk= 0, iat=1153,1170, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33, &end
#
# 83 GLU HN 87 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1153,1207, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 83 GLU HN 87 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1153,1207, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 83 GLU HN 87 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1153,1207, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 83 GLU HN 88 GLN HN 5.76
&rst
ixpk= 0, nxpk= 0, iat=1153,1211, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26, &end
#
# 83 GLU HN 88 GLN HN 5.76
&rst
ixpk= 0, nxpk= 0, iat=1153,1211, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26, &end
#
# 83 GLU HN 88 GLN HN 5.76
&rst
ixpk= 0, nxpk= 0, iat=1153,1211, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26, &end
#
# 83 GLU HN 89 GLY HN 5.75
&rst
ixpk= 0, nxpk= 0, iat=1153,1228, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25, &end
#
# 83 GLU HN 89 GLY HN 5.75
&rst
ixpk= 0, nxpk= 0, iat=1153,1228, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25, &end
#
# 83 GLU HN 89 GLY HN 5.75
&rst
ixpk= 0, nxpk= 0, iat=1153,1228, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25, &end
#
# 83 GLU HN 89 GLY HA2 6.03
&rst
ixpk= 0, nxpk= 0, iat=1153,1230, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53, &end
#
# 83 GLU HN 89 GLY HA2 6.03
&rst
ixpk= 0, nxpk= 0, iat=1153,1230, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53, &end
#
# 83 GLU HN 89 GLY HA2 6.03
&rst
ixpk= 0, nxpk= 0, iat=1153,1230, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53, &end
#
# 83 GLU HN 90 HIG HN 4.82
&rst
ixpk= 0, nxpk= 0, iat=1153,1235, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32, &end
#
# 83 GLU HN 90 HIG HN 4.82
&rst
ixpk= 0, nxpk= 0, iat=1153,1235, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32, &end
#
# 83 GLU HN 90 HIG HN 4.82
&rst
ixpk= 0, nxpk= 0, iat=1153,1235, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32, &end
#
# 83 GLU HN 141 LEU QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat=1153, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=2011,2012,2013,
&end
#
# 83 GLU HN 141 LEU QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat=1153, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=2011,2012,2013,
&end
#
# 83 GLU HN 141 LEU QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat=1153, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=2011,2012,2013,
&end
#
# 83 GLU HA 83 GLU HG2 4.74
&rst
ixpk= 0, nxpk= 0, iat=1155,1160, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24, &end
#
# 83 GLU HA 83 GLU HG3 5.29
&rst
ixpk= 0, nxpk= 0, iat=1155,1161, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79, &end
#
# 83 GLU HA 83 GLU QB 3.54
&rst
ixpk= 0, nxpk= 0, iat=1155, -1, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47,
igr2=1157,1158,
&end
#
# 83 GLU HA 84 GLY HN 2.97
&rst
ixpk= 0, nxpk= 0, iat=1155,1168, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 83 GLU HA 84 GLY HN 3.11
&rst
ixpk= 0, nxpk= 0, iat=1155,1168, r1= 1.30, r2= 1.80, r3= 3.11, r4= 3.61, &end
#
# 83 GLU HA 84 GLY HN 3.11
&rst
ixpk= 0, nxpk= 0, iat=1155,1168, r1= 1.30, r2= 1.80, r3= 3.11, r4= 3.61, &end
#
# 83 GLU HA 84 GLY HN 3.11
&rst
ixpk= 0, nxpk= 0, iat=1155,1168, r1= 1.30, r2= 1.80, r3= 3.11, r4= 3.61, &end
#
# 83 GLU HA 84 GLY HA2 5.60
&rst
ixpk= 0, nxpk= 0, iat=1155,1170, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10, &end
#
# 83 GLU HA 84 GLY HA2 5.60
&rst
ixpk= 0, nxpk= 0, iat=1155,1170, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10, &end
#
# 83 GLU HA 84 GLY HA2 5.60
&rst
ixpk= 0, nxpk= 0, iat=1155,1170, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10, &end
#
# 83 GLU HA 85 PRO QD 4.73
&rst
ixpk= 0, nxpk= 0, iat=1155, -1, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
igr2=1176,1177,
&end
#
# 83 GLU HA 85 PRO QD 4.73
&rst
ixpk= 0, nxpk= 0, iat=1155, -1, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
igr2=1176,1177,
&end
#
# 83 GLU HA 85 PRO QD 4.73
&rst
ixpk= 0, nxpk= 0, iat=1155, -1, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
igr2=1176,1177,
&end
#
# 83 GLU HA 87 GLY HA3 5.69
&rst
ixpk= 0, nxpk= 0, iat=1155,1207, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19, &end
#
# 83 GLU HA 87 GLY HA3 5.69
&rst
ixpk= 0, nxpk= 0, iat=1155,1207, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19, &end
#
# 83 GLU HA 87 GLY HA3 5.69
&rst
ixpk= 0, nxpk= 0, iat=1155,1207, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19, &end
#
# 83 GLU HA 88 GLN HN 3.80
&rst
ixpk= 0, nxpk= 0, iat=1155,1211, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30, &end
#
# 83 GLU HA 88 GLN HN 3.80
&rst
ixpk= 0, nxpk= 0, iat=1155,1211, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30, &end
#
# 83 GLU HA 88 GLN HN 3.80
&rst
ixpk= 0, nxpk= 0, iat=1155,1211, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30, &end
#
# 83 GLU HA 89 GLY HA2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1155,1230, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 83 GLU HA 89 GLY HA2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1155,1230, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 83 GLU HA 89 GLY HA2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1155,1230, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 83 GLU HA 89 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1155,1231, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 83 GLU HA 89 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1155,1231, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 83 GLU HA 89 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1155,1231, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 83 GLU HA 90 HIG HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1155,1235, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 83 GLU HA 90 HIG HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1155,1235, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 83 GLU HA 90 HIG HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1155,1235, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 83 GLU HB2 84 GLY HN 5.72
&rst
ixpk= 0, nxpk= 0, iat=1157,1168, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 83 GLU HG2 84 GLY HN 5.51
&rst
ixpk= 0, nxpk= 0, iat=1160,1168, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01, &end
#
# 83 GLU HG2 84 GLY HN 5.51
&rst
ixpk= 0, nxpk= 0, iat=1160,1168, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01, &end
#
# 83 GLU HG2 84 GLY HN 5.51
&rst
ixpk= 0, nxpk= 0, iat=1160,1168, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01, &end
#
# 83 GLU HG2 84 GLY HA2 5.49
&rst
ixpk= 0, nxpk= 0, iat=1160,1170, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99, &end
#
# 83 GLU HG2 84 GLY HA2 5.49
&rst
ixpk= 0, nxpk= 0, iat=1160,1170, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99, &end
#
# 83 GLU HG2 84 GLY HA2 5.49
&rst
ixpk= 0, nxpk= 0, iat=1160,1170, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99, &end
#
# 83 GLU HG2 87 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1160,1207, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 83 GLU HG2 87 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1160,1207, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 83 GLU HG2 87 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1160,1207, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 83 GLU HG2 89 GLY HN 4.85
&rst
ixpk= 0, nxpk= 0, iat=1160,1228, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35, &end
#
# 83 GLU HG2 89 GLY HN 4.85
&rst
ixpk= 0, nxpk= 0, iat=1160,1228, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35, &end
#
# 83 GLU HG2 89 GLY HN 4.85
&rst
ixpk= 0, nxpk= 0, iat=1160,1228, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35, &end
#
# 83 GLU HG2 89 GLY HA2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1160,1230, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 83 GLU HG2 89 GLY HA2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1160,1230, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 83 GLU HG2 89 GLY HA2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1160,1230, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 83 GLU HG3 83 GLU HG2 3.83
&rst
ixpk= 0, nxpk= 0, iat=1161,1160, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33, &end
#
# 83 GLU HG3 84 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1161,1168, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 83 GLU HG3 84 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1161,1168, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 83 GLU HG3 84 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1161,1168, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 83 GLU HG3 89 GLY HN 4.99
&rst
ixpk= 0, nxpk= 0, iat=1161,1228, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49, &end
#
# 83 GLU HG3 89 GLY HN 4.99
&rst
ixpk= 0, nxpk= 0, iat=1161,1228, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49, &end
#
# 83 GLU HG3 89 GLY HN 4.99
&rst
ixpk= 0, nxpk= 0, iat=1161,1228, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49, &end
#
# 83 GLU HG3 90 HIG HN 6.02
&rst
ixpk= 0, nxpk= 0, iat=1161,1235, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52, &end
#
# 83 GLU HG3 90 HIG HN 6.02
&rst
ixpk= 0, nxpk= 0, iat=1161,1235, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52, &end
#
# 83 GLU HG3 90 HIG HN 6.02
&rst
ixpk= 0, nxpk= 0, iat=1161,1235, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52, &end
#
# 83 GLU QB 84 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1168, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1=1157,1158,
&end
#
# 83 GLU QB 84 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1168, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1=1157,1158,
&end
#
# 83 GLU QB 84 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1168, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1=1157,1158,
&end
#
# 83 GLU QB 87 GLY HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1204, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1=1157,1158,
&end
#
# 83 GLU QB 87 GLY HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1204, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1=1157,1158,
&end
#
# 83 GLU QB 87 GLY HN 5.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1204, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1=1157,1158,
&end
#
# 83 GLU QB 87 GLY HA2 5.04
&rst
ixpk= 0, nxpk= 0, iat= -1,1206, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr1=1157,1158,
&end
#
# 83 GLU QB 87 GLY HA2 5.04
&rst
ixpk= 0, nxpk= 0, iat= -1,1206, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr1=1157,1158,
&end
#
# 83 GLU QB 87 GLY HA2 5.04
&rst
ixpk= 0, nxpk= 0, iat= -1,1206, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr1=1157,1158,
&end
#
# 83 GLU QB 87 GLY HA3 5.10
&rst
ixpk= 0, nxpk= 0, iat= -1,1207, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
igr1=1157,1158,
&end
#
# 83 GLU QB 87 GLY HA3 5.10
&rst
ixpk= 0, nxpk= 0, iat= -1,1207, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
igr1=1157,1158,
&end
#
# 83 GLU QB 87 GLY HA3 5.10
&rst
ixpk= 0, nxpk= 0, iat= -1,1207, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
igr1=1157,1158,
&end
#
# 83 GLU QB 88 GLN HN 4.35
&rst
ixpk= 0, nxpk= 0, iat= -1,1211, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
igr1=1157,1158,
&end
#
# 83 GLU QB 88 GLN HN 4.35
&rst
ixpk= 0, nxpk= 0, iat= -1,1211, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
igr1=1157,1158,
&end
#
# 83 GLU QB 88 GLN HN 4.35
&rst
ixpk= 0, nxpk= 0, iat= -1,1211, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
igr1=1157,1158,
&end
#
# 83 GLU QB 89 GLY HN 3.31
&rst
ixpk= 0, nxpk= 0, iat= -1,1228, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,
igr1=1157,1158,
&end
#
# 83 GLU QB 89 GLY HN 3.31
&rst
ixpk= 0, nxpk= 0, iat= -1,1228, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,
igr1=1157,1158,
&end
#
# 83 GLU QB 89 GLY HN 3.31
&rst
ixpk= 0, nxpk= 0, iat= -1,1228, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22,
igr1=1157,1158,
&end
#
# 83 GLU QB 89 GLY HA2 5.62
&rst
ixpk= 0, nxpk= 0, iat= -1,1230, r1= 1.30, r2= 1.80, r3= 6.31, r4= 6.81,
igr1=1157,1158,
&end
#
# 83 GLU QB 89 GLY HA2 5.62
&rst
ixpk= 0, nxpk= 0, iat= -1,1230, r1= 1.30, r2= 1.80, r3= 6.31, r4= 6.81,
igr1=1157,1158,
&end
#
# 83 GLU QB 89 GLY HA2 5.62
&rst
ixpk= 0, nxpk= 0, iat= -1,1230, r1= 1.30, r2= 1.80, r3= 6.31, r4= 6.81,
igr1=1157,1158,
&end
#
# 83 GLU QB 90 HIG HN 4.85
&rst
ixpk= 0, nxpk= 0, iat= -1,1235, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
igr1=1157,1158,
&end
#
# 83 GLU QB 90 HIG HN 4.85
&rst
ixpk= 0, nxpk= 0, iat= -1,1235, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
igr1=1157,1158,
&end
#
# 83 GLU QB 90 HIG HN 4.85
&rst
ixpk= 0, nxpk= 0, iat= -1,1235, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
igr1=1157,1158,
&end
#
# 83 GLU QB 91 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1252, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1=1157,1158,
&end
#
# 83 GLU QB 91 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1252, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1=1157,1158,
&end
#
# 83 GLU QB 91 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1252, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1=1157,1158,
&end
#
# 84 GLY HN 84 GLY HA2 4.80
&rst
ixpk= 0, nxpk= 0, iat=1168,1170, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30, &end
#
# 84 GLY HN 84 GLY HA3 4.03
&rst
ixpk= 0, nxpk= 0, iat=1168,1171, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53, &end
#
# 84 GLY HN 85 PRO QD 6.05
&rst
ixpk= 0, nxpk= 0, iat=1168, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2=1176,1177,
&end
#
# 84 GLY HN 85 PRO QD 6.05
&rst
ixpk= 0, nxpk= 0, iat=1168, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2=1176,1177,
&end
#
# 84 GLY HN 85 PRO QD 6.05
&rst
ixpk= 0, nxpk= 0, iat=1168, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2=1176,1177,
&end
#
# 84 GLY HN 86 GLU HN 4.62
&rst
ixpk= 0, nxpk= 0, iat=1168,1189, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12, &end
#
# 84 GLY HN 86 GLU HN 4.62
&rst
ixpk= 0, nxpk= 0, iat=1168,1189, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12, &end
#
# 84 GLY HN 86 GLU HN 4.62
&rst
ixpk= 0, nxpk= 0, iat=1168,1189, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12, &end
#
# 84 GLY HN 87 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1168,1207, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 84 GLY HN 87 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1168,1207, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 84 GLY HN 87 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1168,1207, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 84 GLY HN 88 GLN HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1168,1211, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 84 GLY HN 88 GLN HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1168,1211, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 84 GLY HN 88 GLN HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1168,1211, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 84 GLY HN 93 ASM HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1168,1283, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 84 GLY HN 133 ASN HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1168,1883, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 84 GLY HN 133 ASN HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1168,1883, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 84 GLY HN 133 ASN HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1168,1883, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 84 GLY HN 133 ASN HB2 5.43
&rst
ixpk= 0, nxpk= 0, iat=1168,1885, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93, &end
#
# 84 GLY HN 133 ASN HB2 5.43
&rst
ixpk= 0, nxpk= 0, iat=1168,1885, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93, &end
#
# 84 GLY HN 133 ASN HB2 5.43
&rst
ixpk= 0, nxpk= 0, iat=1168,1885, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93, &end
#
# 84 GLY HA2 84 GLY HA3 4.44
&rst
ixpk= 0, nxpk= 0, iat=1170,1171, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94, &end
#
# 84 GLY HA2 86 GLU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1170,1189, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 84 GLY HA2 86 GLU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1170,1189, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 84 GLY HA2 86 GLU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1170,1189, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 84 GLY HA3 85 PRO QD 3.59
&rst
ixpk= 0, nxpk= 0, iat=1171, -1, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,
igr2=1176,1177,
&end
#
# 84 GLY HA3 85 PRO QD 3.59
&rst
ixpk= 0, nxpk= 0, iat=1171, -1, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,
igr2=1176,1177,
&end
#
# 84 GLY HA3 85 PRO QD 3.59
&rst
ixpk= 0, nxpk= 0, iat=1171, -1, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,
igr2=1176,1177,
&end
#
# 84 GLY HA3 133 ASN HN 5.42
&rst
ixpk= 0, nxpk= 0, iat=1171,1881, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92, &end
#
# 84 GLY HA3 133 ASN HN 5.42
&rst
ixpk= 0, nxpk= 0, iat=1171,1881, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92, &end
#
# 84 GLY HA3 133 ASN HN 5.42
&rst
ixpk= 0, nxpk= 0, iat=1171,1881, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92, &end
#
# 84 GLY HA3 133 ASN HB2 5.79
&rst
ixpk= 0, nxpk= 0, iat=1171,1885, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29, &end
#
# 84 GLY HA3 133 ASN HB2 5.79
&rst
ixpk= 0, nxpk= 0, iat=1171,1885, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29, &end
#
# 84 GLY HA3 133 ASN HB2 5.79
&rst
ixpk= 0, nxpk= 0, iat=1171,1885, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29, &end
#
# 84 GLY HA3 133 ASN HD21 6.02
&rst
ixpk= 0, nxpk= 0, iat=1171,1890, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52, &end
#
# 84 GLY HA3 133 ASN HD21 6.02
&rst
ixpk= 0, nxpk= 0, iat=1171,1890, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52, &end
#
# 84 GLY HA3 133 ASN HD21 6.02
&rst
ixpk= 0, nxpk= 0, iat=1171,1890, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52, &end
#
# 85 PRO HA 85 PRO QD 6.05
&rst
ixpk= 0, nxpk= 0, iat=1185, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2=1176,1177,
&end
#
# 85 PRO HA 86 GLU HN 5.03
&rst
ixpk= 0, nxpk= 0, iat=1185,1189, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53, &end
#
# 85 PRO HA 86 GLU QG 5.55
&rst
ixpk= 0, nxpk= 0, iat=1185, -1, r1= 1.30, r2= 1.80, r3= 6.23, r4= 6.73,
igr2=1196,1197,
&end
#
# 85 PRO HA 86 GLU QG 5.55
&rst
ixpk= 0, nxpk= 0, iat=1185, -1, r1= 1.30, r2= 1.80, r3= 6.23, r4= 6.73,
igr2=1196,1197,
&end
#
# 85 PRO HA 86 GLU QG 5.55
&rst
ixpk= 0, nxpk= 0, iat=1185, -1, r1= 1.30, r2= 1.80, r3= 6.23, r4= 6.73,
igr2=1196,1197,
&end
#
# 85 PRO HA 133 ASN HD21 5.84
&rst
ixpk= 0, nxpk= 0, iat=1185,1890, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34, &end
#
# 85 PRO HA 133 ASN HD21 5.84
&rst
ixpk= 0, nxpk= 0, iat=1185,1890, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34, &end
#
# 85 PRO HA 133 ASN HD21 5.84
&rst
ixpk= 0, nxpk= 0, iat=1185,1890, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34, &end
#
# 85 PRO HB2 85 PRO HA 3.75
&rst
ixpk= 0, nxpk= 0, iat=1182,1185, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25, &end
#
# 85 PRO HB2 133 ASN HD21 4.87
&rst
ixpk= 0, nxpk= 0, iat=1182,1890, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37, &end
#
# 85 PRO HB2 133 ASN HD21 4.87
&rst
ixpk= 0, nxpk= 0, iat=1182,1890, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37, &end
#
# 85 PRO HB2 133 ASN HD21 4.87
&rst
ixpk= 0, nxpk= 0, iat=1182,1890, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37, &end
#
# 85 PRO HB2 133 ASN HD22 6.05
&rst
ixpk= 0, nxpk= 0, iat=1182,1891, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 85 PRO HB2 133 ASN HD22 6.05
&rst
ixpk= 0, nxpk= 0, iat=1182,1891, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 85 PRO HB2 133 ASN HD22 6.05
&rst
ixpk= 0, nxpk= 0, iat=1182,1891, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 85 PRO HB3 86 GLU QG 2.93
&rst
ixpk= 0, nxpk= 0, iat=1183, -1, r1= 1.30, r2= 1.80, r3= 3.29, r4= 3.79,
igr2=1196,1197,
&end
#
# 85 PRO HB3 86 GLU QG 2.93
&rst
ixpk= 0, nxpk= 0, iat=1183, -1, r1= 1.30, r2= 1.80, r3= 3.29, r4= 3.79,
igr2=1196,1197,
&end
#
# 85 PRO HB3 86 GLU QG 2.93
&rst
ixpk= 0, nxpk= 0, iat=1183, -1, r1= 1.30, r2= 1.80, r3= 3.29, r4= 3.79,
igr2=1196,1197,
&end
#
# 85 PRO QD 86 GLU HN 5.72
&rst
ixpk= 0, nxpk= 0, iat= -1,1189, r1= 1.30, r2= 1.80, r3= 6.42, r4= 6.92,
igr1=1176,1177,
&end
#
# 85 PRO QD 86 GLU HN 5.72
&rst
ixpk= 0, nxpk= 0, iat= -1,1189, r1= 1.30, r2= 1.80, r3= 6.42, r4= 6.92,
igr1=1176,1177,
&end
#
# 85 PRO QD 86 GLU HN 5.72
&rst
ixpk= 0, nxpk= 0, iat= -1,1189, r1= 1.30, r2= 1.80, r3= 6.42, r4= 6.92,
igr1=1176,1177,
&end
#
# 85 PRO QD 133 ASN HA 5.19
&rst
ixpk= 0, nxpk= 0, iat= -1,1883, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33,
igr1=1176,1177,
&end
#
# 85 PRO QD 133 ASN HA 5.19
&rst
ixpk= 0, nxpk= 0, iat= -1,1883, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33,
igr1=1176,1177,
&end
#
# 85 PRO QD 133 ASN HA 5.19
&rst
ixpk= 0, nxpk= 0, iat= -1,1883, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33,
igr1=1176,1177,
&end
#
# 85 PRO QD 133 ASN HD22 5.96
&rst
ixpk= 0, nxpk= 0, iat= -1,1891, r1= 1.30, r2= 1.80, r3= 6.69, r4= 7.19,
igr1=1176,1177,
&end
#
# 85 PRO QD 133 ASN HD22 5.96
&rst
ixpk= 0, nxpk= 0, iat= -1,1891, r1= 1.30, r2= 1.80, r3= 6.69, r4= 7.19,
igr1=1176,1177,
&end
#
# 85 PRO QD 133 ASN HD22 5.96
&rst
ixpk= 0, nxpk= 0, iat= -1,1891, r1= 1.30, r2= 1.80, r3= 6.69, r4= 7.19,
igr1=1176,1177,
&end
#
# 85 PRO QG 85 PRO QD 5.85
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.37, r4= 7.87,
igr1=1179,1180,
igr2=1176,1177,
&end
#
# 85 PRO QG 86 GLU HN 4.80
&rst
ixpk= 0, nxpk= 0, iat= -1,1189, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr1=1179,1180,
&end
#
# 85 PRO QG 86 GLU HN 4.80
&rst
ixpk= 0, nxpk= 0, iat= -1,1189, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr1=1179,1180,
&end
#
# 85 PRO QG 86 GLU HN 4.80
&rst
ixpk= 0, nxpk= 0, iat= -1,1189, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr1=1179,1180,
&end
#
# 85 PRO QG 86 GLU QG 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,
igr1=1179,1180,
igr2=1196,1197,
&end
#
# 85 PRO QG 86 GLU QG 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,
igr1=1179,1180,
igr2=1196,1197,
&end
#
# 85 PRO QG 86 GLU QG 3.00
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,
igr1=1179,1180,
igr2=1196,1197,
&end
#
# 85 PRO QG 87 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1204, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1=1179,1180,
&end
#
# 85 PRO QG 87 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1204, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1=1179,1180,
&end
#
# 85 PRO QG 87 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1204, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1=1179,1180,
&end
#
# 85 PRO QG 133 ASN HD21 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1890, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1=1179,1180,
&end
#
# 85 PRO QG 133 ASN HD21 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1890, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1=1179,1180,
&end
#
# 85 PRO QG 133 ASN HD21 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1890, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1=1179,1180,
&end
#
# 86 GLU HN 86 GLU HA 4.53
&rst
ixpk= 0, nxpk= 0, iat=1189,1191, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03, &end
#
# 86 GLU HN 86 GLU HB2 4.17
&rst
ixpk= 0, nxpk= 0, iat=1189,1193, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67, &end
#
# 86 GLU HN 86 GLU HB2 4.17
&rst
ixpk= 0, nxpk= 0, iat=1189,1193, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67, &end
#
# 86 GLU HN 86 GLU HB2 4.17
&rst
ixpk= 0, nxpk= 0, iat=1189,1193, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67, &end
#
# 86 GLU HN 86 GLU HB3 3.89
&rst
ixpk= 0, nxpk= 0, iat=1189,1194, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39, &end
#
# 86 GLU HN 86 GLU HB3 3.89
&rst
ixpk= 0, nxpk= 0, iat=1189,1194, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39, &end
#
# 86 GLU HN 86 GLU HB3 3.89
&rst
ixpk= 0, nxpk= 0, iat=1189,1194, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39, &end
#
# 86 GLU HN 86 GLU QG 3.87
&rst
ixpk= 0, nxpk= 0, iat=1189, -1, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,
igr2=1196,1197,
&end
#
# 86 GLU HN 86 GLU QG 3.87
&rst
ixpk= 0, nxpk= 0, iat=1189, -1, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,
igr2=1196,1197,
&end
#
# 86 GLU HN 86 GLU QG 3.87
&rst
ixpk= 0, nxpk= 0, iat=1189, -1, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,
igr2=1196,1197,
&end
#
# 86 GLU HN 87 GLY HN 3.50
&rst
ixpk= 0, nxpk= 0, iat=1189,1204, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 86 GLU HN 87 GLY HN 3.50
&rst
ixpk= 0, nxpk= 0, iat=1189,1204, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 86 GLU HN 87 GLY HN 3.50
&rst
ixpk= 0, nxpk= 0, iat=1189,1204, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 86 GLU HN 87 GLY HN 5.28
&rst
ixpk= 0, nxpk= 0, iat=1189,1204, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 86 GLU HN 87 GLY HA3 5.47
&rst
ixpk= 0, nxpk= 0, iat=1189,1207, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97, &end
#
# 86 GLU HN 87 GLY HA3 5.47
&rst
ixpk= 0, nxpk= 0, iat=1189,1207, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97, &end
#
# 86 GLU HN 87 GLY HA3 5.47
&rst
ixpk= 0, nxpk= 0, iat=1189,1207, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97, &end
#
# 86 GLU HA 86 GLU HB2 3.97
&rst
ixpk= 0, nxpk= 0, iat=1191,1193, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47, &end
#
# 86 GLU HA 86 GLU HB3 4.21
&rst
ixpk= 0, nxpk= 0, iat=1191,1194, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71, &end
#
# 86 GLU HA 86 GLU QG 3.85
&rst
ixpk= 0, nxpk= 0, iat=1191, -1, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,
igr2=1196,1197,
&end
#
# 86 GLU HA 86 GLU QG 3.85
&rst
ixpk= 0, nxpk= 0, iat=1191, -1, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,
igr2=1196,1197,
&end
#
# 86 GLU HA 86 GLU QG 3.85
&rst
ixpk= 0, nxpk= 0, iat=1191, -1, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82,
igr2=1196,1197,
&end
#
# 86 GLU HA 87 GLY HN 2.97
&rst
ixpk= 0, nxpk= 0, iat=1191,1204, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 86 GLU HA 87 GLY HN 4.75
&rst
ixpk= 0, nxpk= 0, iat=1191,1204, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, &end
#
# 86 GLU HB2 86 GLU HB3 3.44
&rst
ixpk= 0, nxpk= 0, iat=1193,1194, r1= 1.30, r2= 1.80, r3= 3.44, r4= 3.94, &end
#
# 86 GLU HB2 86 GLU QG 3.52
&rst
ixpk= 0, nxpk= 0, iat=1193, -1, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
igr2=1196,1197,
&end
#
# 86 GLU HB2 87 GLY HN 4.71
&rst
ixpk= 0, nxpk= 0, iat=1193,1204, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21, &end
#
# 86 GLU HB2 87 GLY HN 4.71
&rst
ixpk= 0, nxpk= 0, iat=1193,1204, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21, &end
#
# 86 GLU HB2 87 GLY HN 4.71
&rst
ixpk= 0, nxpk= 0, iat=1193,1204, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21, &end
#
# 86 GLU HB2 87 GLY HN 5.72
&rst
ixpk= 0, nxpk= 0, iat=1193,1204, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 86 GLU HB3 86 GLU QG 3.16
&rst
ixpk= 0, nxpk= 0, iat=1194, -1, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05,
igr2=1196,1197,
&end
#
# 86 GLU HB3 86 GLU QG 3.16
&rst
ixpk= 0, nxpk= 0, iat=1194, -1, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05,
igr2=1196,1197,
&end
#
# 86 GLU HB3 86 GLU QG 3.16
&rst
ixpk= 0, nxpk= 0, iat=1194, -1, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05,
igr2=1196,1197,
&end
#
# 86 GLU HB3 87 GLY HN 5.26
&rst
ixpk= 0, nxpk= 0, iat=1194,1204, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76, &end
#
# 86 GLU HB3 87 GLY HN 5.26
&rst
ixpk= 0, nxpk= 0, iat=1194,1204, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76, &end
#
# 86 GLU HB3 87 GLY HN 5.26
&rst
ixpk= 0, nxpk= 0, iat=1194,1204, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76, &end
#
# 86 GLU QG 87 GLY HN 5.48
&rst
ixpk= 0, nxpk= 0, iat= -1,1204, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
igr1=1196,1197,
&end
#
# 86 GLU QG 87 GLY HN 5.48
&rst
ixpk= 0, nxpk= 0, iat= -1,1204, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
igr1=1196,1197,
&end
#
# 86 GLU QG 87 GLY HN 5.48
&rst
ixpk= 0, nxpk= 0, iat= -1,1204, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
igr1=1196,1197,
&end
#
# 87 GLY HN 87 GLY HA2 4.07
&rst
ixpk= 0, nxpk= 0, iat=1204,1206, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57, &end
#
# 87 GLY HN 87 GLY HA3 3.98
&rst
ixpk= 0, nxpk= 0, iat=1204,1207, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48, &end
#
# 87 GLY HN 88 GLN HN 4.88
&rst
ixpk= 0, nxpk= 0, iat=1204,1211, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38, &end
#
# 87 GLY HN 88 GLN HN 4.88
&rst
ixpk= 0, nxpk= 0, iat=1204,1211, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38, &end
#
# 87 GLY HN 88 GLN HN 4.88
&rst
ixpk= 0, nxpk= 0, iat=1204,1211, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38, &end
#
# 87 GLY HN 88 GLN HN 5.28
&rst
ixpk= 0, nxpk= 0, iat=1204,1211, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 87 GLY HA2 88 GLN HN 3.50
&rst
ixpk= 0, nxpk= 0, iat=1206,1211, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 87 GLY HA2 88 GLN HN 3.89
&rst
ixpk= 0, nxpk= 0, iat=1206,1211, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39, &end
#
# 87 GLY HA2 88 GLN HN 3.89
&rst
ixpk= 0, nxpk= 0, iat=1206,1211, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39, &end
#
# 87 GLY HA2 88 GLN HN 3.89
&rst
ixpk= 0, nxpk= 0, iat=1206,1211, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39, &end
#
# 87 GLY HA2 89 GLY HN 6.01
&rst
ixpk= 0, nxpk= 0, iat=1206,1228, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51, &end
#
# 87 GLY HA2 89 GLY HN 6.01
&rst
ixpk= 0, nxpk= 0, iat=1206,1228, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51, &end
#
# 87 GLY HA2 89 GLY HN 6.01
&rst
ixpk= 0, nxpk= 0, iat=1206,1228, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51, &end
#
# 87 GLY HA3 87 GLY HA2 3.99
&rst
ixpk= 0, nxpk= 0, iat=1207,1206, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49, &end
#
# 87 GLY HA3 88 GLN HN 3.89
&rst
ixpk= 0, nxpk= 0, iat=1207,1211, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39, &end
#
# 87 GLY HA3 88 GLN HN 3.89
&rst
ixpk= 0, nxpk= 0, iat=1207,1211, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39, &end
#
# 87 GLY HA3 88 GLN HN 3.89
&rst
ixpk= 0, nxpk= 0, iat=1207,1211, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39, &end
#
# 88 GLN HN 88 GLN HA 4.36
&rst
ixpk= 0, nxpk= 0, iat=1211,1213, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86, &end
#
# 88 GLN HN 88 GLN HB2 3.83
&rst
ixpk= 0, nxpk= 0, iat=1211,1215, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33, &end
#
# 88 GLN HN 88 GLN HB2 3.83
&rst
ixpk= 0, nxpk= 0, iat=1211,1215, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33, &end
#
# 88 GLN HN 88 GLN HB2 3.83
&rst
ixpk= 0, nxpk= 0, iat=1211,1215, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33, &end
#
# 88 GLN HN 88 GLN HB3 3.94
&rst
ixpk= 0, nxpk= 0, iat=1211,1216, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44, &end
#
# 88 GLN HN 88 GLN HB3 3.94
&rst
ixpk= 0, nxpk= 0, iat=1211,1216, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44, &end
#
# 88 GLN HN 88 GLN HB3 3.94
&rst
ixpk= 0, nxpk= 0, iat=1211,1216, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44, &end
#
# 88 GLN HN 88 GLN HG3 4.63
&rst
ixpk= 0, nxpk= 0, iat=1211,1219, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, &end
#
# 88 GLN HN 88 GLN HG3 4.63
&rst
ixpk= 0, nxpk= 0, iat=1211,1219, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, &end
#
# 88 GLN HN 88 GLN HG3 4.63
&rst
ixpk= 0, nxpk= 0, iat=1211,1219, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, &end
#
# 88 GLN HN 89 GLY HN 3.86
&rst
ixpk= 0, nxpk= 0, iat=1211,1228, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 88 GLN HN 89 GLY HN 3.86
&rst
ixpk= 0, nxpk= 0, iat=1211,1228, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 88 GLN HN 89 GLY HN 3.86
&rst
ixpk= 0, nxpk= 0, iat=1211,1228, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 88 GLN HN 89 GLY HN 5.28
&rst
ixpk= 0, nxpk= 0, iat=1211,1228, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 88 GLN HN 89 GLY HA3 5.70
&rst
ixpk= 0, nxpk= 0, iat=1211,1231, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20, &end
#
# 88 GLN HN 89 GLY HA3 5.70
&rst
ixpk= 0, nxpk= 0, iat=1211,1231, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20, &end
#
# 88 GLN HN 89 GLY HA3 5.70
&rst
ixpk= 0, nxpk= 0, iat=1211,1231, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20, &end
#
# 88 GLN HA 88 GLN HB2 4.62
&rst
ixpk= 0, nxpk= 0, iat=1213,1215, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12, &end
#
# 88 GLN HA 88 GLN HB3 4.28
&rst
ixpk= 0, nxpk= 0, iat=1213,1216, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78, &end
#
# 88 GLN HA 88 GLN HNE1 5.30
&rst
ixpk= 0, nxpk= 0, iat=1213,1223, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80, &end
#
# 88 GLN HA 88 GLN HNE1 5.30
&rst
ixpk= 0, nxpk= 0, iat=1213,1223, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80, &end
#
# 88 GLN HA 88 GLN HNE1 5.30
&rst
ixpk= 0, nxpk= 0, iat=1213,1223, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80, &end
#
# 88 GLN HA 88 GLN HG3 4.28
&rst
ixpk= 0, nxpk= 0, iat=1213,1219, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78, &end
#
# 88 GLN HA 88 GLN HG3 4.28
&rst
ixpk= 0, nxpk= 0, iat=1213,1219, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78, &end
#
# 88 GLN HA 88 GLN HG3 4.28
&rst
ixpk= 0, nxpk= 0, iat=1213,1219, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78, &end
#
# 88 GLN HA 89 GLY HN 2.97
&rst
ixpk= 0, nxpk= 0, iat=1213,1228, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 88 GLN HA 89 GLY HN 4.47
&rst
ixpk= 0, nxpk= 0, iat=1213,1228, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97, &end
#
# 88 GLN HB2 88 GLN HNE2 5.79
&rst
ixpk= 0, nxpk= 0, iat=1215,1224, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29, &end
#
# 88 GLN HB2 88 GLN HNE2 5.79
&rst
ixpk= 0, nxpk= 0, iat=1215,1224, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29, &end
#
# 88 GLN HB2 88 GLN HNE2 5.79
&rst
ixpk= 0, nxpk= 0, iat=1215,1224, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29, &end
#
# 88 GLN HB3 88 GLN HB2 3.31
&rst
ixpk= 0, nxpk= 0, iat=1216,1215, r1= 1.30, r2= 1.80, r3= 3.31, r4= 3.81, &end
#
# 88 GLN HB3 88 GLN HG2 2.90
&rst
ixpk= 0, nxpk= 0, iat=1216,1218, r1= 1.30, r2= 1.80, r3= 2.90, r4= 3.40, &end
#
# 88 GLN HB3 88 GLN HG2 2.90
&rst
ixpk= 0, nxpk= 0, iat=1216,1218, r1= 1.30, r2= 1.80, r3= 2.90, r4= 3.40, &end
#
# 88 GLN HB3 88 GLN HG2 2.90
&rst
ixpk= 0, nxpk= 0, iat=1216,1218, r1= 1.30, r2= 1.80, r3= 2.90, r4= 3.40, &end
#
# 88 GLN HB3 89 GLY HN 4.96
&rst
ixpk= 0, nxpk= 0, iat=1216,1228, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46, &end
#
# 88 GLN HB3 89 GLY HN 4.96
&rst
ixpk= 0, nxpk= 0, iat=1216,1228, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46, &end
#
# 88 GLN HB3 89 GLY HN 4.96
&rst
ixpk= 0, nxpk= 0, iat=1216,1228, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46, &end
#
# 88 GLN HB3 89 GLY HN 5.72
&rst
ixpk= 0, nxpk= 0, iat=1216,1228, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 88 GLN HNE1 88 GLN HNE2 2.64
&rst
ixpk= 0, nxpk= 0, iat=1223,1224, r1= 1.30, r2= 1.80, r3= 2.64, r4= 3.14, &end
#
# 88 GLN HNE1 89 GLY HN 4.17
&rst
ixpk= 0, nxpk= 0, iat=1223,1228, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67, &end
#
# 88 GLN HNE1 89 GLY HN 4.17
&rst
ixpk= 0, nxpk= 0, iat=1223,1228, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67, &end
#
# 88 GLN HNE1 89 GLY HN 4.17
&rst
ixpk= 0, nxpk= 0, iat=1223,1228, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67, &end
#
# 88 GLN HG2 88 GLN HNE2 5.61
&rst
ixpk= 0, nxpk= 0, iat=1218,1224, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11, &end
#
# 88 GLN HG3 88 GLN HNE1 4.75
&rst
ixpk= 0, nxpk= 0, iat=1219,1223, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, &end
#
# 88 GLN HG3 88 GLN HNE2 5.95
&rst
ixpk= 0, nxpk= 0, iat=1219,1224, r1= 1.30, r2= 1.80, r3= 5.95, r4= 6.45, &end
#
# 89 GLY HN 89 GLY HA2 4.38
&rst
ixpk= 0, nxpk= 0, iat=1228,1230, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88, &end
#
# 89 GLY HN 89 GLY HA3 4.15
&rst
ixpk= 0, nxpk= 0, iat=1228,1231, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65, &end
#
# 89 GLY HN 90 HIG HN 4.39
&rst
ixpk= 0, nxpk= 0, iat=1228,1235, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89, &end
#
# 89 GLY HN 90 HIG HN 4.39
&rst
ixpk= 0, nxpk= 0, iat=1228,1235, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89, &end
#
# 89 GLY HN 90 HIG HN 4.39
&rst
ixpk= 0, nxpk= 0, iat=1228,1235, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89, &end
#
# 89 GLY HA2 90 HIG HN 3.60
&rst
ixpk= 0, nxpk= 0, iat=1230,1235, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10, &end
#
# 89 GLY HA2 90 HIG HN 3.60
&rst
ixpk= 0, nxpk= 0, iat=1230,1235, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10, &end
#
# 89 GLY HA2 90 HIG HN 3.60
&rst
ixpk= 0, nxpk= 0, iat=1230,1235, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10, &end
#
# 89 GLY HA3 89 GLY HA2 4.04
&rst
ixpk= 0, nxpk= 0, iat=1231,1230, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, &end
#
# 89 GLY HA3 90 HIG HN 3.82
&rst
ixpk= 0, nxpk= 0, iat=1231,1235, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32, &end
#
# 89 GLY HA3 90 HIG HN 3.82
&rst
ixpk= 0, nxpk= 0, iat=1231,1235, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32, &end
#
# 89 GLY HA3 90 HIG HN 3.82
&rst
ixpk= 0, nxpk= 0, iat=1231,1235, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32, &end
#
# 90 HIG HN 91 LEU HN 5.17
&rst
ixpk= 0, nxpk= 0, iat=1235,1252, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67, &end
#
# 90 HIG HN 91 LEU HN 5.17
&rst
ixpk= 0, nxpk= 0, iat=1235,1252, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67, &end
#
# 90 HIG HN 91 LEU HN 5.17
&rst
ixpk= 0, nxpk= 0, iat=1235,1252, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67, &end
#
# 90 HIG HA 91 LEU HN 3.74
&rst
ixpk= 0, nxpk= 0, iat=1237,1252, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24, &end
#
# 90 HIG HA 91 LEU HN 3.74
&rst
ixpk= 0, nxpk= 0, iat=1237,1252, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24, &end
#
# 90 HIG HA 91 LEU HN 3.74
&rst
ixpk= 0, nxpk= 0, iat=1237,1252, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24, &end
#
# 90 HIG HA 91 LEU HB2 5.95
&rst
ixpk= 0, nxpk= 0, iat=1237,1256, r1= 1.30, r2= 1.80, r3= 5.95, r4= 6.45, &end
#
# 90 HIG HA 91 LEU HB2 5.95
&rst
ixpk= 0, nxpk= 0, iat=1237,1256, r1= 1.30, r2= 1.80, r3= 5.95, r4= 6.45, &end
#
# 90 HIG HA 91 LEU HB2 5.95
&rst
ixpk= 0, nxpk= 0, iat=1237,1256, r1= 1.30, r2= 1.80, r3= 5.95, r4= 6.45, &end
#
# 90 HIG HA 91 LEU QD1 5.24
&rst
ixpk= 0, nxpk= 0, iat=1237, -1, r1= 1.30, r2= 1.80, r3= 6.29, r4= 6.79,
igr2=1261,1262,1263,
&end
#
# 90 HIG HA 91 LEU QD1 5.24
&rst
ixpk= 0, nxpk= 0, iat=1237, -1, r1= 1.30, r2= 1.80, r3= 6.29, r4= 6.79,
igr2=1261,1262,1263,
&end
#
# 90 HIG HA 91 LEU QD1 5.24
&rst
ixpk= 0, nxpk= 0, iat=1237, -1, r1= 1.30, r2= 1.80, r3= 6.29, r4= 6.79,
igr2=1261,1262,1263,
&end
#
# 90 HIG HA 92 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1237,1271, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 90 HIG HA 92 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1237,1271, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 90 HIG HA 92 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1237,1271, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 91 LEU HN 91 LEU HA 4.22
&rst
ixpk= 0, nxpk= 0, iat=1252,1254, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 91 LEU HN 91 LEU HB2 3.81
&rst
ixpk= 0, nxpk= 0, iat=1252,1256, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31, &end
#
# 91 LEU HN 91 LEU HB2 3.81
&rst
ixpk= 0, nxpk= 0, iat=1252,1256, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31, &end
#
# 91 LEU HN 91 LEU HB2 3.81
&rst
ixpk= 0, nxpk= 0, iat=1252,1256, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31, &end
#
# 91 LEU HN 91 LEU HB3 4.40
&rst
ixpk= 0, nxpk= 0, iat=1252,1257, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 91 LEU HN 91 LEU HB3 4.40
&rst
ixpk= 0, nxpk= 0, iat=1252,1257, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 91 LEU HN 91 LEU HB3 4.40
&rst
ixpk= 0, nxpk= 0, iat=1252,1257, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 91 LEU HN 91 LEU HG 5.51
&rst
ixpk= 0, nxpk= 0, iat=1252,1259, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01, &end
#
# 91 LEU HN 91 LEU HG 5.51
&rst
ixpk= 0, nxpk= 0, iat=1252,1259, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01, &end
#
# 91 LEU HN 91 LEU HG 5.51
&rst
ixpk= 0, nxpk= 0, iat=1252,1259, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01, &end
#
# 91 LEU HN 91 LEU QD1 4.27
&rst
ixpk= 0, nxpk= 0, iat=1252, -1, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
igr2=1261,1262,1263,
&end
#
# 91 LEU HN 91 LEU QD1 4.27
&rst
ixpk= 0, nxpk= 0, iat=1252, -1, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
igr2=1261,1262,1263,
&end
#
# 91 LEU HN 91 LEU QD1 4.27
&rst
ixpk= 0, nxpk= 0, iat=1252, -1, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
igr2=1261,1262,1263,
&end
#
# 91 LEU HN 92 GLY HN 4.18
&rst
ixpk= 0, nxpk= 0, iat=1252,1271, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68, &end
#
# 91 LEU HN 92 GLY HN 4.18
&rst
ixpk= 0, nxpk= 0, iat=1252,1271, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68, &end
#
# 91 LEU HN 92 GLY HN 4.18
&rst
ixpk= 0, nxpk= 0, iat=1252,1271, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68, &end
#
# 91 LEU HA 91 LEU HB2 3.63
&rst
ixpk= 0, nxpk= 0, iat=1254,1256, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13, &end
#
# 91 LEU HA 91 LEU HB3 4.53
&rst
ixpk= 0, nxpk= 0, iat=1254,1257, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03, &end
#
# 91 LEU HA 91 LEU QD1 4.75
&rst
ixpk= 0, nxpk= 0, iat=1254, -1, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr2=1261,1262,1263,
&end
#
# 91 LEU HA 91 LEU QD1 4.75
&rst
ixpk= 0, nxpk= 0, iat=1254, -1, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr2=1261,1262,1263,
&end
#
# 91 LEU HA 91 LEU QD1 4.75
&rst
ixpk= 0, nxpk= 0, iat=1254, -1, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr2=1261,1262,1263,
&end
#
# 91 LEU HA 91 LEU QD2 3.84
&rst
ixpk= 0, nxpk= 0, iat=1254, -1, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
igr2=1265,1266,1267,
&end
#
# 91 LEU HA 91 LEU QD2 3.84
&rst
ixpk= 0, nxpk= 0, iat=1254, -1, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
igr2=1265,1266,1267,
&end
#
# 91 LEU HA 91 LEU QD2 3.84
&rst
ixpk= 0, nxpk= 0, iat=1254, -1, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
igr2=1265,1266,1267,
&end
#
# 91 LEU HA 92 GLY HN 4.24
&rst
ixpk= 0, nxpk= 0, iat=1254,1271, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74, &end
#
# 91 LEU HA 93 ASM HN 5.87
&rst
ixpk= 0, nxpk= 0, iat=1254,1278, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37, &end
#
# 91 LEU HA 93 ASM HN 5.87
&rst
ixpk= 0, nxpk= 0, iat=1254,1278, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37, &end
#
# 91 LEU HA 93 ASM HN 5.87
&rst
ixpk= 0, nxpk= 0, iat=1254,1278, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37, &end
#
# 91 LEU HA 113 ARG HE 5.76
&rst
ixpk= 0, nxpk= 0, iat=1254,1576, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26, &end
#
# 91 LEU HA 113 ARG HE 5.76
&rst
ixpk= 0, nxpk= 0, iat=1254,1576, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26, &end
#
# 91 LEU HA 113 ARG HE 5.76
&rst
ixpk= 0, nxpk= 0, iat=1254,1576, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26, &end
#
# 91 LEU HB2 91 LEU HB3 3.66
&rst
ixpk= 0, nxpk= 0, iat=1256,1257, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16, &end
#
# 91 LEU HB2 91 LEU QD1 3.55
&rst
ixpk= 0, nxpk= 0, iat=1256, -1, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,
igr2=1261,1262,1263,
&end
#
# 91 LEU HB2 91 LEU QD1 3.55
&rst
ixpk= 0, nxpk= 0, iat=1256, -1, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,
igr2=1261,1262,1263,
&end
#
# 91 LEU HB2 91 LEU QD1 3.55
&rst
ixpk= 0, nxpk= 0, iat=1256, -1, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76,
igr2=1261,1262,1263,
&end
#
# 91 LEU HB2 92 GLY HN 5.39
&rst
ixpk= 0, nxpk= 0, iat=1256,1271, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89, &end
#
# 91 LEU HB2 92 GLY HN 5.39
&rst
ixpk= 0, nxpk= 0, iat=1256,1271, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89, &end
#
# 91 LEU HB2 92 GLY HN 5.39
&rst
ixpk= 0, nxpk= 0, iat=1256,1271, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89, &end
#
# 91 LEU HB3 91 LEU QD2 4.78
&rst
ixpk= 0, nxpk= 0, iat=1257, -1, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24,
igr2=1265,1266,1267,
&end
#
# 91 LEU HG 91 LEU QD2 3.71
&rst
ixpk= 0, nxpk= 0, iat=1259, -1, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
igr2=1265,1266,1267,
&end
#
# 91 LEU QD1 91 LEU QD2 3.43
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr1=1261,1262,1263,
igr2=1265,1266,1267,
&end
#
# 92 GLY HN 92 GLY HA2 4.92
&rst
ixpk= 0, nxpk= 0, iat=1271,1273, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42, &end
#
# 92 GLY HN 92 GLY HA3 4.12
&rst
ixpk= 0, nxpk= 0, iat=1271,1274, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62, &end
#
# 92 GLY HN 93 ASM HN 4.62
&rst
ixpk= 0, nxpk= 0, iat=1271,1278, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12, &end
#
# 92 GLY HN 93 ASM HN 4.62
&rst
ixpk= 0, nxpk= 0, iat=1271,1278, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12, &end
#
# 92 GLY HN 93 ASM HN 4.62
&rst
ixpk= 0, nxpk= 0, iat=1271,1278, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12, &end
#
# 92 GLY HA2 93 ASM HN 5.38
&rst
ixpk= 0, nxpk= 0, iat=1273,1278, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88, &end
#
# 92 GLY HA2 94 LEU QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat=1273, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1299,1300,1301,
&end
#
# 92 GLY HA2 94 LEU QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat=1273, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1299,1300,1301,
&end
#
# 92 GLY HA2 94 LEU QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat=1273, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1299,1300,1301,
&end
#
# 92 GLY HA3 93 ASM HN 5.76
&rst
ixpk= 0, nxpk= 0, iat=1274,1278, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26, &end
#
# 92 GLY HA3 94 LEU QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat=1274, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1299,1300,1301,
&end
#
# 92 GLY HA3 94 LEU QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat=1274, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1299,1300,1301,
&end
#
# 92 GLY HA3 94 LEU QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat=1274, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1299,1300,1301,
&end
#
# 93 ASM HN 93 ASM HA 4.51
&rst
ixpk= 0, nxpk= 0, iat=1278,1280, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01, &end
#
# 93 ASM HN 94 LEU HN 5.72
&rst
ixpk= 0, nxpk= 0, iat=1278,1290, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 93 ASM HN 94 LEU HN 5.72
&rst
ixpk= 0, nxpk= 0, iat=1278,1290, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 93 ASM HN 94 LEU HN 5.72
&rst
ixpk= 0, nxpk= 0, iat=1278,1290, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 93 ASM HN 94 LEU QD1 5.14
&rst
ixpk= 0, nxpk= 0, iat=1278, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2=1299,1300,1301,
&end
#
# 93 ASM HN 94 LEU QD1 5.14
&rst
ixpk= 0, nxpk= 0, iat=1278, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2=1299,1300,1301,
&end
#
# 93 ASM HN 94 LEU QD1 5.14
&rst
ixpk= 0, nxpk= 0, iat=1278, -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr2=1299,1300,1301,
&end
#
# 93 ASM HN 113 ARG HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1278,1567, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 93 ASM HN 113 ARG HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1278,1567, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 93 ASM HN 113 ARG HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1278,1567, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 93 ASM HA 94 LEU HN 3.86
&rst
ixpk= 0, nxpk= 0, iat=1280,1290, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 93 ASM HA 94 LEU HN 3.86
&rst
ixpk= 0, nxpk= 0, iat=1280,1290, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 93 ASM HA 94 LEU HN 3.86
&rst
ixpk= 0, nxpk= 0, iat=1280,1290, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 93 ASM HA 94 LEU HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1280,1295, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 93 ASM HA 94 LEU HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1280,1295, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 93 ASM HA 94 LEU QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat=1280, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1299,1300,1301,
&end
#
# 93 ASM HA 94 LEU QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat=1280, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1299,1300,1301,
&end
#
# 93 ASM HA 94 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1280, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1303,1304,1305,
&end
#
# 93 ASM HA 94 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1280, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1303,1304,1305,
&end
#
# 94 LEU HN 94 LEU HA 5.07
&rst
ixpk= 0, nxpk= 0, iat=1290,1292, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, &end
#
# 94 LEU HN 94 LEU HB2 4.81
&rst
ixpk= 0, nxpk= 0, iat=1290,1294, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31, &end
#
# 94 LEU HN 94 LEU HB3 5.17
&rst
ixpk= 0, nxpk= 0, iat=1290,1295, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67, &end
#
# 94 LEU HN 94 LEU HG 4.67
&rst
ixpk= 0, nxpk= 0, iat=1290,1297, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, &end
#
# 94 LEU HN 94 LEU HG 4.67
&rst
ixpk= 0, nxpk= 0, iat=1290,1297, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, &end
#
# 94 LEU HN 94 LEU HG 4.67
&rst
ixpk= 0, nxpk= 0, iat=1290,1297, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, &end
#
# 94 LEU HN 94 LEU QD1 4.94
&rst
ixpk= 0, nxpk= 0, iat=1290, -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr2=1299,1300,1301,
&end
#
# 94 LEU HN 94 LEU QD1 4.94
&rst
ixpk= 0, nxpk= 0, iat=1290, -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr2=1299,1300,1301,
&end
#
# 94 LEU HN 94 LEU QD1 4.94
&rst
ixpk= 0, nxpk= 0, iat=1290, -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr2=1299,1300,1301,
&end
#
# 94 LEU HN 94 LEU QD2 5.05
&rst
ixpk= 0, nxpk= 0, iat=1290, -1, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
igr2=1303,1304,1305,
&end
#
# 94 LEU HN 94 LEU QD2 5.05
&rst
ixpk= 0, nxpk= 0, iat=1290, -1, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
igr2=1303,1304,1305,
&end
#
# 94 LEU HN 94 LEU QD2 5.05
&rst
ixpk= 0, nxpk= 0, iat=1290, -1, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
igr2=1303,1304,1305,
&end
#
# 94 LEU HN 95 PRO HD2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1290,1310, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 94 LEU HN 95 PRO HD2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1290,1310, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 94 LEU HN 95 PRO HD2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1290,1310, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 94 LEU HN 95 PRO HD3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1290,1311, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 94 LEU HN 95 PRO HD3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1290,1311, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 94 LEU HN 95 PRO HD3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1290,1311, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 94 LEU HA 94 LEU HB2 5.13
&rst
ixpk= 0, nxpk= 0, iat=1292,1294, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63, &end
#
# 94 LEU HA 94 LEU HB3 4.93
&rst
ixpk= 0, nxpk= 0, iat=1292,1295, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43, &end
#
# 94 LEU HA 94 LEU QD1 4.20
&rst
ixpk= 0, nxpk= 0, iat=1292, -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr2=1299,1300,1301,
&end
#
# 94 LEU HA 94 LEU QD1 4.20
&rst
ixpk= 0, nxpk= 0, iat=1292, -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr2=1299,1300,1301,
&end
#
# 94 LEU HA 94 LEU QD1 4.20
&rst
ixpk= 0, nxpk= 0, iat=1292, -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr2=1299,1300,1301,
&end
#
# 94 LEU HA 94 LEU QD2 5.61
&rst
ixpk= 0, nxpk= 0, iat=1292, -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
igr2=1303,1304,1305,
&end
#
# 94 LEU HA 94 LEU QD2 5.61
&rst
ixpk= 0, nxpk= 0, iat=1292, -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
igr2=1303,1304,1305,
&end
#
# 94 LEU HA 94 LEU QD2 5.61
&rst
ixpk= 0, nxpk= 0, iat=1292, -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
igr2=1303,1304,1305,
&end
#
# 94 LEU HA 95 PRO HD2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1292,1310, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 94 LEU HA 95 PRO HD3 5.14
&rst
ixpk= 0, nxpk= 0, iat=1292,1311, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64, &end
#
# 94 LEU HA 95 PRO HG2 5.83
&rst
ixpk= 0, nxpk= 0, iat=1292,1313, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33, &end
#
# 94 LEU HA 95 PRO HG2 5.83
&rst
ixpk= 0, nxpk= 0, iat=1292,1313, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33, &end
#
# 94 LEU HA 95 PRO HG2 5.83
&rst
ixpk= 0, nxpk= 0, iat=1292,1313, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33, &end
#
# 94 LEU HA 111 ALA QB 5.79
&rst
ixpk= 0, nxpk= 0, iat=1292, -1, r1= 1.30, r2= 1.80, r3= 6.95, r4= 7.45,
igr2=1543,1544,1545,
&end
#
# 94 LEU HA 111 ALA QB 5.79
&rst
ixpk= 0, nxpk= 0, iat=1292, -1, r1= 1.30, r2= 1.80, r3= 6.95, r4= 7.45,
igr2=1543,1544,1545,
&end
#
# 94 LEU HA 111 ALA QB 5.79
&rst
ixpk= 0, nxpk= 0, iat=1292, -1, r1= 1.30, r2= 1.80, r3= 6.95, r4= 7.45,
igr2=1543,1544,1545,
&end
#
# 94 LEU HB2 94 LEU QD1 4.75
&rst
ixpk= 0, nxpk= 0, iat=1294, -1, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr2=1299,1300,1301,
&end
#
# 94 LEU HB2 94 LEU QD2 4.54
&rst
ixpk= 0, nxpk= 0, iat=1294, -1, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,
igr2=1303,1304,1305,
&end
#
# 94 LEU HB2 94 LEU QD2 4.54
&rst
ixpk= 0, nxpk= 0, iat=1294, -1, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,
igr2=1303,1304,1305,
&end
#
# 94 LEU HB2 94 LEU QD2 4.54
&rst
ixpk= 0, nxpk= 0, iat=1294, -1, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,
igr2=1303,1304,1305,
&end
#
# 94 LEU HB2 95 PRO HD2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1294,1310, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 94 LEU HB2 95 PRO HD2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1294,1310, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 94 LEU HB2 95 PRO HD2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1294,1310, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 94 LEU HB2 95 PRO HD3 5.94
&rst
ixpk= 0, nxpk= 0, iat=1294,1311, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44, &end
#
# 94 LEU HB2 95 PRO HD3 5.94
&rst
ixpk= 0, nxpk= 0, iat=1294,1311, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44, &end
#
# 94 LEU HB2 95 PRO HD3 5.94
&rst
ixpk= 0, nxpk= 0, iat=1294,1311, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44, &end
#
# 94 LEU HB2 111 ALA HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1294,1541, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 94 LEU HB2 111 ALA HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1294,1541, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 94 LEU HB2 111 ALA HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1294,1541, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 94 LEU HB3 94 LEU HB2 4.67
&rst
ixpk= 0, nxpk= 0, iat=1295,1294, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, &end
#
# 94 LEU HB3 94 LEU QD1 5.00
&rst
ixpk= 0, nxpk= 0, iat=1295, -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr2=1299,1300,1301,
&end
#
# 94 LEU HB3 94 LEU QD2 4.54
&rst
ixpk= 0, nxpk= 0, iat=1295, -1, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,
igr2=1303,1304,1305,
&end
#
# 94 LEU HB3 94 LEU QD2 4.54
&rst
ixpk= 0, nxpk= 0, iat=1295, -1, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,
igr2=1303,1304,1305,
&end
#
# 94 LEU HB3 94 LEU QD2 4.54
&rst
ixpk= 0, nxpk= 0, iat=1295, -1, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,
igr2=1303,1304,1305,
&end
#
# 94 LEU HB3 95 PRO HD2 5.93
&rst
ixpk= 0, nxpk= 0, iat=1295,1310, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43, &end
#
# 94 LEU HB3 95 PRO HD2 5.93
&rst
ixpk= 0, nxpk= 0, iat=1295,1310, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43, &end
#
# 94 LEU HB3 95 PRO HD2 5.93
&rst
ixpk= 0, nxpk= 0, iat=1295,1310, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43, &end
#
# 94 LEU HB3 95 PRO HD3 5.14
&rst
ixpk= 0, nxpk= 0, iat=1295,1311, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64, &end
#
# 94 LEU HB3 95 PRO HD3 5.14
&rst
ixpk= 0, nxpk= 0, iat=1295,1311, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64, &end
#
# 94 LEU HB3 95 PRO HD3 5.14
&rst
ixpk= 0, nxpk= 0, iat=1295,1311, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64, &end
#
# 94 LEU HB3 95 PRO HG2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1295,1313, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 94 LEU HB3 95 PRO HG2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1295,1313, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 94 LEU HB3 95 PRO HG2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1295,1313, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 94 LEU HB3 111 ALA HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1295,1541, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 94 LEU HB3 111 ALA HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1295,1541, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 94 LEU HB3 111 ALA HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1295,1541, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 94 LEU HG 94 LEU QD1 4.19
&rst
ixpk= 0, nxpk= 0, iat=1297, -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
igr2=1299,1300,1301,
&end
#
# 94 LEU QD1 94 LEU QD2 3.82
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
igr1=1299,1300,1301,
igr2=1303,1304,1305,
&end
#
# 94 LEU QD1 95 PRO HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1319, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1299,1300,1301,
&end
#
# 94 LEU QD1 95 PRO HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1319, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1299,1300,1301,
&end
#
# 94 LEU QD1 95 PRO HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1319, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1299,1300,1301,
&end
#
# 94 LEU QD1 95 PRO HD2 5.29
&rst
ixpk= 0, nxpk= 0, iat= -1,1310, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
igr1=1299,1300,1301,
&end
#
# 94 LEU QD1 95 PRO HD2 5.29
&rst
ixpk= 0, nxpk= 0, iat= -1,1310, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
igr1=1299,1300,1301,
&end
#
# 94 LEU QD1 95 PRO HD2 5.29
&rst
ixpk= 0, nxpk= 0, iat= -1,1310, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
igr1=1299,1300,1301,
&end
#
# 94 LEU QD1 95 PRO HD3 5.53
&rst
ixpk= 0, nxpk= 0, iat= -1,1311, r1= 1.30, r2= 1.80, r3= 6.64, r4= 7.14,
igr1=1299,1300,1301,
&end
#
# 94 LEU QD1 95 PRO HD3 5.53
&rst
ixpk= 0, nxpk= 0, iat= -1,1311, r1= 1.30, r2= 1.80, r3= 6.64, r4= 7.14,
igr1=1299,1300,1301,
&end
#
# 94 LEU QD1 95 PRO HD3 5.53
&rst
ixpk= 0, nxpk= 0, iat= -1,1311, r1= 1.30, r2= 1.80, r3= 6.64, r4= 7.14,
igr1=1299,1300,1301,
&end
#
# 94 LEU QD1 95 PRO HG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1313, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1299,1300,1301,
&end
#
# 94 LEU QD1 95 PRO HG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1313, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1299,1300,1301,
&end
#
# 94 LEU QD1 95 PRO HG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1313, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1299,1300,1301,
&end
#
# 94 LEU QD1 111 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1539, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1299,1300,1301,
&end
#
# 94 LEU QD1 111 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1539, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1299,1300,1301,
&end
#
# 94 LEU QD1 111 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1539, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1299,1300,1301,
&end
#
# 94 LEU QD1 111 ALA HA 5.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1541, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
igr1=1299,1300,1301,
&end
#
# 94 LEU QD1 111 ALA HA 5.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1541, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
igr1=1299,1300,1301,
&end
#
# 94 LEU QD1 111 ALA HA 5.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1541, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
igr1=1299,1300,1301,
&end
#
# 94 LEU QD1 111 ALA QB 3.76
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr1=1299,1300,1301,
igr2=1543,1544,1545,
&end
#
# 94 LEU QD1 111 ALA QB 3.76
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr1=1299,1300,1301,
igr2=1543,1544,1545,
&end
#
# 94 LEU QD1 111 ALA QB 3.76
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr1=1299,1300,1301,
igr2=1543,1544,1545,
&end
#
# 94 LEU QD1 112 PRO HD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1550, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1299,1300,1301,
&end
#
# 94 LEU QD1 112 PRO HD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1550, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1299,1300,1301,
&end
#
# 94 LEU QD1 112 PRO HD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1550, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1299,1300,1301,
&end
#
# 94 LEU QD1 113 ARG HN 5.69
&rst
ixpk= 0, nxpk= 0, iat= -1,1563, r1= 1.30, r2= 1.80, r3= 6.83, r4= 7.33,
igr1=1299,1300,1301,
&end
#
# 94 LEU QD1 113 ARG HN 5.69
&rst
ixpk= 0, nxpk= 0, iat= -1,1563, r1= 1.30, r2= 1.80, r3= 6.83, r4= 7.33,
igr1=1299,1300,1301,
&end
#
# 94 LEU QD1 113 ARG HN 5.69
&rst
ixpk= 0, nxpk= 0, iat= -1,1563, r1= 1.30, r2= 1.80, r3= 6.83, r4= 7.33,
igr1=1299,1300,1301,
&end
#
# 94 LEU QD1 113 ARG HB3 5.43
&rst
ixpk= 0, nxpk= 0, iat= -1,1568, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
igr1=1299,1300,1301,
&end
#
# 94 LEU QD1 113 ARG HB3 5.43
&rst
ixpk= 0, nxpk= 0, iat= -1,1568, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
igr1=1299,1300,1301,
&end
#
# 94 LEU QD1 113 ARG HB3 5.43
&rst
ixpk= 0, nxpk= 0, iat= -1,1568, r1= 1.30, r2= 1.80, r3= 6.52, r4= 7.02,
igr1=1299,1300,1301,
&end
#
# 94 LEU QD1 113 ARG HE 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1576, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1299,1300,1301,
&end
#
# 94 LEU QD1 113 ARG HE 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1576, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1299,1300,1301,
&end
#
# 94 LEU QD1 113 ARG HE 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1576, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1299,1300,1301,
&end
#
# 94 LEU QD1 114 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1587, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1299,1300,1301,
&end
#
# 94 LEU QD1 114 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1587, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1299,1300,1301,
&end
#
# 94 LEU QD1 114 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1587, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1299,1300,1301,
&end
#
# 94 LEU QD1 114 LEU HG 4.63
&rst
ixpk= 0, nxpk= 0, iat= -1,1594, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
igr1=1299,1300,1301,
&end
#
# 94 LEU QD1 114 LEU HG 4.63
&rst
ixpk= 0, nxpk= 0, iat= -1,1594, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
igr1=1299,1300,1301,
&end
#
# 94 LEU QD1 114 LEU HG 4.63
&rst
ixpk= 0, nxpk= 0, iat= -1,1594, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
igr1=1299,1300,1301,
&end
#
# 94 LEU QD1 114 LEU QD1 4.67
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
igr1=1299,1300,1301,
igr2=1596,1597,1598,
&end
#
# 94 LEU QD1 114 LEU QD1 4.67
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
igr1=1299,1300,1301,
igr2=1596,1597,1598,
&end
#
# 94 LEU QD1 114 LEU QD1 4.67
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
igr1=1299,1300,1301,
igr2=1596,1597,1598,
&end
#
# 94 LEU QD1 114 LEU QD2 3.90
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
igr1=1299,1300,1301,
igr2=1600,1601,1602,
&end
#
# 94 LEU QD1 114 LEU QD2 3.90
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
igr1=1299,1300,1301,
igr2=1600,1601,1602,
&end
#
# 94 LEU QD1 114 LEU QD2 3.90
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12,
igr1=1299,1300,1301,
igr2=1600,1601,1602,
&end
#
# 94 LEU QD2 94 LEU HG 4.31
&rst
ixpk= 0, nxpk= 0, iat= -1,1297, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
igr1=1303,1304,1305,
&end
#
# 94 LEU QD2 95 PRO HD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1310, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1303,1304,1305,
&end
#
# 94 LEU QD2 95 PRO HD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1310, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1303,1304,1305,
&end
#
# 94 LEU QD2 95 PRO HD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1310, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1303,1304,1305,
&end
#
# 94 LEU QD2 95 PRO HD3 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1311, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1303,1304,1305,
&end
#
# 94 LEU QD2 95 PRO HD3 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1311, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1303,1304,1305,
&end
#
# 94 LEU QD2 95 PRO HD3 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1311, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1303,1304,1305,
&end
#
# 94 LEU QD2 109 VAL QG2 5.47
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.89, r4= 8.39,
igr1=1303,1304,1305,
igr2=1519,1520,1521,
&end
#
# 94 LEU QD2 109 VAL QG2 5.47
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.89, r4= 8.39,
igr1=1303,1304,1305,
igr2=1519,1520,1521,
&end
#
# 94 LEU QD2 109 VAL QG2 5.47
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.89, r4= 8.39,
igr1=1303,1304,1305,
igr2=1519,1520,1521,
&end
#
# 94 LEU QD2 111 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1539, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1303,1304,1305,
&end
#
# 94 LEU QD2 111 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1539, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1303,1304,1305,
&end
#
# 94 LEU QD2 111 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1539, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1303,1304,1305,
&end
#
# 94 LEU QD2 111 ALA HA 5.22
&rst
ixpk= 0, nxpk= 0, iat= -1,1541, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
igr1=1303,1304,1305,
&end
#
# 94 LEU QD2 111 ALA HA 5.22
&rst
ixpk= 0, nxpk= 0, iat= -1,1541, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
igr1=1303,1304,1305,
&end
#
# 94 LEU QD2 111 ALA HA 5.22
&rst
ixpk= 0, nxpk= 0, iat= -1,1541, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
igr1=1303,1304,1305,
&end
#
# 94 LEU QD2 111 ALA QB 5.51
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.95, r4= 8.45,
igr1=1303,1304,1305,
igr2=1543,1544,1545,
&end
#
# 94 LEU QD2 111 ALA QB 5.51
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.95, r4= 8.45,
igr1=1303,1304,1305,
igr2=1543,1544,1545,
&end
#
# 94 LEU QD2 111 ALA QB 5.51
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.95, r4= 8.45,
igr1=1303,1304,1305,
igr2=1543,1544,1545,
&end
#
# 94 LEU QD2 114 LEU QD2 5.33
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.69, r4= 8.19,
igr1=1303,1304,1305,
igr2=1600,1601,1602,
&end
#
# 94 LEU QD2 114 LEU QD2 5.33
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.69, r4= 8.19,
igr1=1303,1304,1305,
igr2=1600,1601,1602,
&end
#
# 94 LEU QD2 114 LEU QD2 5.33
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.69, r4= 8.19,
igr1=1303,1304,1305,
igr2=1600,1601,1602,
&end
#
# 94 LEU QD2 125 LEU HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1769, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1303,1304,1305,
&end
#
# 94 LEU QD2 125 LEU HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1769, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1303,1304,1305,
&end
#
# 94 LEU QD2 125 LEU HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1769, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1303,1304,1305,
&end
#
# 94 LEU QD2 125 LEU QD1 6.01
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.67, r4= 9.17,
igr1=1303,1304,1305,
igr2=1776,1777,1778,
&end
#
# 94 LEU QD2 125 LEU QD1 6.01
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.67, r4= 9.17,
igr1=1303,1304,1305,
igr2=1776,1777,1778,
&end
#
# 94 LEU QD2 125 LEU QD1 6.01
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.67, r4= 9.17,
igr1=1303,1304,1305,
igr2=1776,1777,1778,
&end
#
# 94 LEU QD2 125 LEU QD2 3.99
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
igr1=1303,1304,1305,
igr2=1780,1781,1782,
&end
#
# 94 LEU QD2 125 LEU QD2 3.99
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
igr1=1303,1304,1305,
igr2=1780,1781,1782,
&end
#
# 94 LEU QD2 125 LEU QD2 3.99
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25,
igr1=1303,1304,1305,
igr2=1780,1781,1782,
&end
#
# 94 LEU QD2 126 MET HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1786, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1303,1304,1305,
&end
#
# 94 LEU QD2 126 MET HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1786, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1303,1304,1305,
&end
#
# 94 LEU QD2 126 MET HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1786, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1303,1304,1305,
&end
#
# 95 PRO HA 95 PRO HB2 4.61
&rst
ixpk= 0, nxpk= 0, iat=1319,1316, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 95 PRO HA 96 VAL HN 3.51
&rst
ixpk= 0, nxpk= 0, iat=1319,1323, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01, &end
#
# 95 PRO HA 96 VAL HN 3.51
&rst
ixpk= 0, nxpk= 0, iat=1319,1323, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01, &end
#
# 95 PRO HA 96 VAL HN 3.51
&rst
ixpk= 0, nxpk= 0, iat=1319,1323, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01, &end
#
# 95 PRO HB2 95 PRO HB3 4.43
&rst
ixpk= 0, nxpk= 0, iat=1316,1317, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93, &end
#
# 95 PRO HB2 96 VAL HN 4.39
&rst
ixpk= 0, nxpk= 0, iat=1316,1323, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89, &end
#
# 95 PRO HB2 96 VAL HN 4.39
&rst
ixpk= 0, nxpk= 0, iat=1316,1323, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89, &end
#
# 95 PRO HB2 96 VAL HN 4.39
&rst
ixpk= 0, nxpk= 0, iat=1316,1323, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89, &end
#
# 95 PRO HB2 96 VAL HA 5.10
&rst
ixpk= 0, nxpk= 0, iat=1316,1325, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, &end
#
# 95 PRO HB2 96 VAL HA 5.10
&rst
ixpk= 0, nxpk= 0, iat=1316,1325, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, &end
#
# 95 PRO HB2 96 VAL HA 5.10
&rst
ixpk= 0, nxpk= 0, iat=1316,1325, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, &end
#
# 95 PRO HB2 109 VAL QG1 4.98
&rst
ixpk= 0, nxpk= 0, iat=1316, -1, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
igr2=1515,1516,1517,
&end
#
# 95 PRO HB2 109 VAL QG1 4.98
&rst
ixpk= 0, nxpk= 0, iat=1316, -1, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
igr2=1515,1516,1517,
&end
#
# 95 PRO HB2 109 VAL QG1 4.98
&rst
ixpk= 0, nxpk= 0, iat=1316, -1, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
igr2=1515,1516,1517,
&end
#
# 95 PRO HB2 110 THR HN 5.72
&rst
ixpk= 0, nxpk= 0, iat=1316,1525, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 95 PRO HB2 110 THR HN 5.72
&rst
ixpk= 0, nxpk= 0, iat=1316,1525, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 95 PRO HB2 110 THR HN 5.72
&rst
ixpk= 0, nxpk= 0, iat=1316,1525, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 95 PRO HB3 95 PRO HA 4.06
&rst
ixpk= 0, nxpk= 0, iat=1317,1319, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56, &end
#
# 95 PRO HB3 96 VAL HN 4.86
&rst
ixpk= 0, nxpk= 0, iat=1317,1323, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36, &end
#
# 95 PRO HB3 96 VAL HN 4.86
&rst
ixpk= 0, nxpk= 0, iat=1317,1323, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36, &end
#
# 95 PRO HB3 96 VAL HN 4.86
&rst
ixpk= 0, nxpk= 0, iat=1317,1323, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36, &end
#
# 95 PRO HB3 109 VAL HA 5.61
&rst
ixpk= 0, nxpk= 0, iat=1317,1511, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11, &end
#
# 95 PRO HB3 109 VAL HA 5.61
&rst
ixpk= 0, nxpk= 0, iat=1317,1511, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11, &end
#
# 95 PRO HB3 109 VAL HA 5.61
&rst
ixpk= 0, nxpk= 0, iat=1317,1511, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11, &end
#
# 95 PRO HB3 110 THR HN 5.37
&rst
ixpk= 0, nxpk= 0, iat=1317,1525, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87, &end
#
# 95 PRO HB3 110 THR HN 5.37
&rst
ixpk= 0, nxpk= 0, iat=1317,1525, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87, &end
#
# 95 PRO HB3 110 THR HN 5.37
&rst
ixpk= 0, nxpk= 0, iat=1317,1525, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87, &end
#
# 95 PRO HD2 95 PRO HA 5.95
&rst
ixpk= 0, nxpk= 0, iat=1310,1319, r1= 1.30, r2= 1.80, r3= 5.95, r4= 6.45, &end
#
# 95 PRO HD2 95 PRO HD3 4.97
&rst
ixpk= 0, nxpk= 0, iat=1310,1311, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 95 PRO HD2 95 PRO HG2 5.93
&rst
ixpk= 0, nxpk= 0, iat=1310,1313, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43, &end
#
# 95 PRO HD2 96 VAL HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1310,1323, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 95 PRO HD2 96 VAL HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1310,1323, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 95 PRO HD2 96 VAL HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1310,1323, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 95 PRO HD2 109 VAL HB 6.05
&rst
ixpk= 0, nxpk= 0, iat=1310,1513, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 95 PRO HD2 109 VAL HB 6.05
&rst
ixpk= 0, nxpk= 0, iat=1310,1513, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 95 PRO HD2 109 VAL HB 6.05
&rst
ixpk= 0, nxpk= 0, iat=1310,1513, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 95 PRO HD2 109 VAL QG1 6.05
&rst
ixpk= 0, nxpk= 0, iat=1310, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1515,1516,1517,
&end
#
# 95 PRO HD2 109 VAL QG1 6.05
&rst
ixpk= 0, nxpk= 0, iat=1310, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1515,1516,1517,
&end
#
# 95 PRO HD2 109 VAL QG1 6.05
&rst
ixpk= 0, nxpk= 0, iat=1310, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1515,1516,1517,
&end
#
# 95 PRO HD2 110 THR HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1310,1525, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 95 PRO HD2 110 THR HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1310,1525, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 95 PRO HD2 110 THR HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1310,1525, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 95 PRO HD2 111 ALA HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1310,1541, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 95 PRO HD2 111 ALA HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1310,1541, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 95 PRO HD2 111 ALA HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1310,1541, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 95 PRO HD2 111 ALA QB 5.86
&rst
ixpk= 0, nxpk= 0, iat=1310, -1, r1= 1.30, r2= 1.80, r3= 7.04, r4= 7.54,
igr2=1543,1544,1545,
&end
#
# 95 PRO HD2 111 ALA QB 5.86
&rst
ixpk= 0, nxpk= 0, iat=1310, -1, r1= 1.30, r2= 1.80, r3= 7.04, r4= 7.54,
igr2=1543,1544,1545,
&end
#
# 95 PRO HD2 111 ALA QB 5.86
&rst
ixpk= 0, nxpk= 0, iat=1310, -1, r1= 1.30, r2= 1.80, r3= 7.04, r4= 7.54,
igr2=1543,1544,1545,
&end
#
# 95 PRO HD3 95 PRO HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1311,1316, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 95 PRO HD3 95 PRO HB3 5.80
&rst
ixpk= 0, nxpk= 0, iat=1311,1317, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30, &end
#
# 95 PRO HD3 95 PRO HG2 6.01
&rst
ixpk= 0, nxpk= 0, iat=1311,1313, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51, &end
#
# 95 PRO HD3 109 VAL HB 5.88
&rst
ixpk= 0, nxpk= 0, iat=1311,1513, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38, &end
#
# 95 PRO HD3 109 VAL HB 5.88
&rst
ixpk= 0, nxpk= 0, iat=1311,1513, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38, &end
#
# 95 PRO HD3 109 VAL HB 5.88
&rst
ixpk= 0, nxpk= 0, iat=1311,1513, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38, &end
#
# 95 PRO HD3 109 VAL QG1 6.05
&rst
ixpk= 0, nxpk= 0, iat=1311, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1515,1516,1517,
&end
#
# 95 PRO HD3 109 VAL QG1 6.05
&rst
ixpk= 0, nxpk= 0, iat=1311, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1515,1516,1517,
&end
#
# 95 PRO HD3 109 VAL QG1 6.05
&rst
ixpk= 0, nxpk= 0, iat=1311, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1515,1516,1517,
&end
#
# 95 PRO HD3 109 VAL QG2 5.53
&rst
ixpk= 0, nxpk= 0, iat=1311, -1, r1= 1.30, r2= 1.80, r3= 6.64, r4= 7.14,
igr2=1519,1520,1521,
&end
#
# 95 PRO HD3 109 VAL QG2 5.53
&rst
ixpk= 0, nxpk= 0, iat=1311, -1, r1= 1.30, r2= 1.80, r3= 6.64, r4= 7.14,
igr2=1519,1520,1521,
&end
#
# 95 PRO HD3 109 VAL QG2 5.53
&rst
ixpk= 0, nxpk= 0, iat=1311, -1, r1= 1.30, r2= 1.80, r3= 6.64, r4= 7.14,
igr2=1519,1520,1521,
&end
#
# 95 PRO HD3 110 THR HN 5.92
&rst
ixpk= 0, nxpk= 0, iat=1311,1525, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42, &end
#
# 95 PRO HD3 110 THR HN 5.92
&rst
ixpk= 0, nxpk= 0, iat=1311,1525, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42, &end
#
# 95 PRO HD3 110 THR HN 5.92
&rst
ixpk= 0, nxpk= 0, iat=1311,1525, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42, &end
#
# 95 PRO HD3 113 ARG HN 5.98
&rst
ixpk= 0, nxpk= 0, iat=1311,1563, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48, &end
#
# 95 PRO HD3 113 ARG HN 5.98
&rst
ixpk= 0, nxpk= 0, iat=1311,1563, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48, &end
#
# 95 PRO HD3 113 ARG HN 5.98
&rst
ixpk= 0, nxpk= 0, iat=1311,1563, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48, &end
#
# 95 PRO HG2 109 VAL HB 4.49
&rst
ixpk= 0, nxpk= 0, iat=1313,1513, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99, &end
#
# 95 PRO HG2 109 VAL HB 4.49
&rst
ixpk= 0, nxpk= 0, iat=1313,1513, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99, &end
#
# 95 PRO HG2 109 VAL HB 4.49
&rst
ixpk= 0, nxpk= 0, iat=1313,1513, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99, &end
#
# 95 PRO HG2 109 VAL QG2 5.27
&rst
ixpk= 0, nxpk= 0, iat=1313, -1, r1= 1.30, r2= 1.80, r3= 6.33, r4= 6.83,
igr2=1519,1520,1521,
&end
#
# 95 PRO HG2 109 VAL QG2 5.27
&rst
ixpk= 0, nxpk= 0, iat=1313, -1, r1= 1.30, r2= 1.80, r3= 6.33, r4= 6.83,
igr2=1519,1520,1521,
&end
#
# 95 PRO HG2 109 VAL QG2 5.27
&rst
ixpk= 0, nxpk= 0, iat=1313, -1, r1= 1.30, r2= 1.80, r3= 6.33, r4= 6.83,
igr2=1519,1520,1521,
&end
#
# 95 PRO HG2 110 THR HN 4.77
&rst
ixpk= 0, nxpk= 0, iat=1313,1525, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27, &end
#
# 95 PRO HG2 110 THR HN 4.77
&rst
ixpk= 0, nxpk= 0, iat=1313,1525, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27, &end
#
# 95 PRO HG2 110 THR HN 4.77
&rst
ixpk= 0, nxpk= 0, iat=1313,1525, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27, &end
#
# 95 PRO HG2 110 THR HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1313,1527, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 95 PRO HG2 110 THR HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1313,1527, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 95 PRO HG2 110 THR HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1313,1527, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 95 PRO HG3 95 PRO HB2 4.35
&rst
ixpk= 0, nxpk= 0, iat=1314,1316, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85, &end
#
# 95 PRO HG3 95 PRO HD3 5.78
&rst
ixpk= 0, nxpk= 0, iat=1314,1311, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28, &end
#
# 95 PRO HG3 96 VAL HN 5.09
&rst
ixpk= 0, nxpk= 0, iat=1314,1323, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59, &end
#
# 95 PRO HG3 96 VAL HN 5.09
&rst
ixpk= 0, nxpk= 0, iat=1314,1323, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59, &end
#
# 95 PRO HG3 96 VAL HN 5.09
&rst
ixpk= 0, nxpk= 0, iat=1314,1323, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59, &end
#
# 95 PRO HG3 109 VAL QG1 5.51
&rst
ixpk= 0, nxpk= 0, iat=1314, -1, r1= 1.30, r2= 1.80, r3= 6.62, r4= 7.12,
igr2=1515,1516,1517,
&end
#
# 95 PRO HG3 109 VAL QG1 5.51
&rst
ixpk= 0, nxpk= 0, iat=1314, -1, r1= 1.30, r2= 1.80, r3= 6.62, r4= 7.12,
igr2=1515,1516,1517,
&end
#
# 95 PRO HG3 109 VAL QG1 5.51
&rst
ixpk= 0, nxpk= 0, iat=1314, -1, r1= 1.30, r2= 1.80, r3= 6.62, r4= 7.12,
igr2=1515,1516,1517,
&end
#
# 95 PRO HG3 110 THR HN 4.30
&rst
ixpk= 0, nxpk= 0, iat=1314,1525, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80, &end
#
# 95 PRO HG3 110 THR HN 4.30
&rst
ixpk= 0, nxpk= 0, iat=1314,1525, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80, &end
#
# 95 PRO HG3 110 THR HN 4.30
&rst
ixpk= 0, nxpk= 0, iat=1314,1525, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80, &end
#
# 96 VAL HN 96 VAL HA 4.11
&rst
ixpk= 0, nxpk= 0, iat=1323,1325, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 96 VAL HN 96 VAL HB 4.29
&rst
ixpk= 0, nxpk= 0, iat=1323,1327, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79, &end
#
# 96 VAL HN 96 VAL HB 4.29
&rst
ixpk= 0, nxpk= 0, iat=1323,1327, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79, &end
#
# 96 VAL HN 96 VAL HB 4.29
&rst
ixpk= 0, nxpk= 0, iat=1323,1327, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79, &end
#
# 96 VAL HN 96 VAL QG1 3.88
&rst
ixpk= 0, nxpk= 0, iat=1323, -1, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
igr2=1329,1330,1331,
&end
#
# 96 VAL HN 96 VAL QG1 3.88
&rst
ixpk= 0, nxpk= 0, iat=1323, -1, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
igr2=1329,1330,1331,
&end
#
# 96 VAL HN 96 VAL QG1 3.88
&rst
ixpk= 0, nxpk= 0, iat=1323, -1, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
igr2=1329,1330,1331,
&end
#
# 96 VAL HN 96 VAL QG2 3.85
&rst
ixpk= 0, nxpk= 0, iat=1323, -1, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
igr2=1333,1334,1335,
&end
#
# 96 VAL HN 96 VAL QG2 3.85
&rst
ixpk= 0, nxpk= 0, iat=1323, -1, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
igr2=1333,1334,1335,
&end
#
# 96 VAL HN 96 VAL QG2 3.85
&rst
ixpk= 0, nxpk= 0, iat=1323, -1, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
igr2=1333,1334,1335,
&end
#
# 96 VAL HN 97 LEU HN 5.06
&rst
ixpk= 0, nxpk= 0, iat=1323,1339, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56, &end
#
# 96 VAL HN 97 LEU HN 5.06
&rst
ixpk= 0, nxpk= 0, iat=1323,1339, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56, &end
#
# 96 VAL HN 97 LEU HN 5.06
&rst
ixpk= 0, nxpk= 0, iat=1323,1339, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56, &end
#
# 96 VAL HN 132 ASP HB3 6.01
&rst
ixpk= 0, nxpk= 0, iat=1323,1874, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51, &end
#
# 96 VAL HN 132 ASP HB3 6.01
&rst
ixpk= 0, nxpk= 0, iat=1323,1874, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51, &end
#
# 96 VAL HN 132 ASP HB3 6.01
&rst
ixpk= 0, nxpk= 0, iat=1323,1874, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51, &end
#
# 96 VAL HA 96 VAL HB 4.04
&rst
ixpk= 0, nxpk= 0, iat=1325,1327, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, &end
#
# 96 VAL HA 96 VAL QG1 4.16
&rst
ixpk= 0, nxpk= 0, iat=1325, -1, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,
igr2=1329,1330,1331,
&end
#
# 96 VAL HA 96 VAL QG1 4.16
&rst
ixpk= 0, nxpk= 0, iat=1325, -1, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,
igr2=1329,1330,1331,
&end
#
# 96 VAL HA 96 VAL QG1 4.16
&rst
ixpk= 0, nxpk= 0, iat=1325, -1, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,
igr2=1329,1330,1331,
&end
#
# 96 VAL HA 96 VAL QG2 3.87
&rst
ixpk= 0, nxpk= 0, iat=1325, -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
igr2=1333,1334,1335,
&end
#
# 96 VAL HA 96 VAL QG2 3.87
&rst
ixpk= 0, nxpk= 0, iat=1325, -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
igr2=1333,1334,1335,
&end
#
# 96 VAL HA 96 VAL QG2 3.87
&rst
ixpk= 0, nxpk= 0, iat=1325, -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
igr2=1333,1334,1335,
&end
#
# 96 VAL HA 97 LEU HN 3.25
&rst
ixpk= 0, nxpk= 0, iat=1325,1339, r1= 1.30, r2= 1.80, r3= 3.25, r4= 3.75, &end
#
# 96 VAL HA 97 LEU HN 3.25
&rst
ixpk= 0, nxpk= 0, iat=1325,1339, r1= 1.30, r2= 1.80, r3= 3.25, r4= 3.75, &end
#
# 96 VAL HA 97 LEU HN 3.25
&rst
ixpk= 0, nxpk= 0, iat=1325,1339, r1= 1.30, r2= 1.80, r3= 3.25, r4= 3.75, &end
#
# 96 VAL HA 97 LEU HB2 5.39
&rst
ixpk= 0, nxpk= 0, iat=1325,1343, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89, &end
#
# 96 VAL HA 97 LEU HB2 5.39
&rst
ixpk= 0, nxpk= 0, iat=1325,1343, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89, &end
#
# 96 VAL HA 97 LEU HB2 5.39
&rst
ixpk= 0, nxpk= 0, iat=1325,1343, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89, &end
#
# 96 VAL HA 97 LEU HB3 5.72
&rst
ixpk= 0, nxpk= 0, iat=1325,1344, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 96 VAL HA 97 LEU HB3 5.72
&rst
ixpk= 0, nxpk= 0, iat=1325,1344, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 96 VAL HA 97 LEU HB3 5.72
&rst
ixpk= 0, nxpk= 0, iat=1325,1344, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 96 VAL HA 132 ASP HA 5.38
&rst
ixpk= 0, nxpk= 0, iat=1325,1871, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88, &end
#
# 96 VAL HA 132 ASP HA 5.38
&rst
ixpk= 0, nxpk= 0, iat=1325,1871, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88, &end
#
# 96 VAL HA 132 ASP HA 5.38
&rst
ixpk= 0, nxpk= 0, iat=1325,1871, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88, &end
#
# 96 VAL HB 96 VAL QG1 3.41
&rst
ixpk= 0, nxpk= 0, iat=1327, -1, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60,
igr2=1329,1330,1331,
&end
#
# 96 VAL HB 96 VAL QG2 3.71
&rst
ixpk= 0, nxpk= 0, iat=1327, -1, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96,
igr2=1333,1334,1335,
&end
#
# 96 VAL HB 97 LEU HN 3.71
&rst
ixpk= 0, nxpk= 0, iat=1327,1339, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21, &end
#
# 96 VAL HB 97 LEU HN 3.71
&rst
ixpk= 0, nxpk= 0, iat=1327,1339, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21, &end
#
# 96 VAL HB 97 LEU HN 3.71
&rst
ixpk= 0, nxpk= 0, iat=1327,1339, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21, &end
#
# 96 VAL HB 97 LEU HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1327,1343, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 96 VAL HB 97 LEU HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1327,1343, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 96 VAL HB 97 LEU HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1327,1343, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 96 VAL HB 97 LEU HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1327,1344, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 96 VAL HB 97 LEU HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1327,1344, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 96 VAL HB 97 LEU HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1327,1344, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 96 VAL QG1 97 LEU HN 4.65
&rst
ixpk= 0, nxpk= 0, iat= -1,1339, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr1=1329,1330,1331,
&end
#
# 96 VAL QG1 97 LEU HN 4.65
&rst
ixpk= 0, nxpk= 0, iat= -1,1339, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr1=1329,1330,1331,
&end
#
# 96 VAL QG1 97 LEU HN 4.65
&rst
ixpk= 0, nxpk= 0, iat= -1,1339, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr1=1329,1330,1331,
&end
#
# 96 VAL QG1 98 VAL HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1358, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1329,1330,1331,
&end
#
# 96 VAL QG1 98 VAL HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1358, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1329,1330,1331,
&end
#
# 96 VAL QG1 98 VAL HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1358, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1329,1330,1331,
&end
#
# 96 VAL QG1 132 ASP HB2 4.38
&rst
ixpk= 0, nxpk= 0, iat= -1,1873, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr1=1329,1330,1331,
&end
#
# 96 VAL QG1 132 ASP HB2 4.38
&rst
ixpk= 0, nxpk= 0, iat= -1,1873, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr1=1329,1330,1331,
&end
#
# 96 VAL QG1 132 ASP HB2 4.38
&rst
ixpk= 0, nxpk= 0, iat= -1,1873, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76,
igr1=1329,1330,1331,
&end
#
# 96 VAL QG1 133 ASN HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1881, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1329,1330,1331,
&end
#
# 96 VAL QG1 133 ASN HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1881, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1329,1330,1331,
&end
#
# 96 VAL QG1 133 ASN HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1881, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1329,1330,1331,
&end
#
# 96 VAL QG2 96 VAL QG1 3.41
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
igr1=1333,1334,1335,
igr2=1329,1330,1331,
&end
#
# 96 VAL QG2 97 LEU HN 4.27
&rst
ixpk= 0, nxpk= 0, iat= -1,1339, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
igr1=1333,1334,1335,
&end
#
# 96 VAL QG2 97 LEU HN 4.27
&rst
ixpk= 0, nxpk= 0, iat= -1,1339, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
igr1=1333,1334,1335,
&end
#
# 96 VAL QG2 97 LEU HN 4.27
&rst
ixpk= 0, nxpk= 0, iat= -1,1339, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
igr1=1333,1334,1335,
&end
#
# 96 VAL QG2 98 VAL HN 4.97
&rst
ixpk= 0, nxpk= 0, iat= -1,1358, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr1=1333,1334,1335,
&end
#
# 96 VAL QG2 98 VAL HN 4.97
&rst
ixpk= 0, nxpk= 0, iat= -1,1358, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr1=1333,1334,1335,
&end
#
# 96 VAL QG2 98 VAL HN 4.97
&rst
ixpk= 0, nxpk= 0, iat= -1,1358, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr1=1333,1334,1335,
&end
#
# 96 VAL QG2 98 VAL QG1 3.42
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,
igr1=1333,1334,1335,
igr2=1364,1365,1366,
&end
#
# 96 VAL QG2 98 VAL QG1 3.42
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,
igr1=1333,1334,1335,
igr2=1364,1365,1366,
&end
#
# 96 VAL QG2 98 VAL QG1 3.42
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43,
igr1=1333,1334,1335,
igr2=1364,1365,1366,
&end
#
# 96 VAL QG2 132 ASP HB2 5.78
&rst
ixpk= 0, nxpk= 0, iat= -1,1873, r1= 1.30, r2= 1.80, r3= 6.94, r4= 7.44,
igr1=1333,1334,1335,
&end
#
# 96 VAL QG2 132 ASP HB2 5.78
&rst
ixpk= 0, nxpk= 0, iat= -1,1873, r1= 1.30, r2= 1.80, r3= 6.94, r4= 7.44,
igr1=1333,1334,1335,
&end
#
# 96 VAL QG2 132 ASP HB2 5.78
&rst
ixpk= 0, nxpk= 0, iat= -1,1873, r1= 1.30, r2= 1.80, r3= 6.94, r4= 7.44,
igr1=1333,1334,1335,
&end
#
# 96 VAL QG2 132 ASP HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1874, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1333,1334,1335,
&end
#
# 96 VAL QG2 132 ASP HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1874, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1333,1334,1335,
&end
#
# 96 VAL QG2 132 ASP HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1874, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1333,1334,1335,
&end
#
# 97 LEU HN 97 LEU HB2 3.94
&rst
ixpk= 0, nxpk= 0, iat=1339,1343, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44, &end
#
# 97 LEU HN 97 LEU HB2 3.94
&rst
ixpk= 0, nxpk= 0, iat=1339,1343, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44, &end
#
# 97 LEU HN 97 LEU HB2 3.94
&rst
ixpk= 0, nxpk= 0, iat=1339,1343, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44, &end
#
# 97 LEU HN 97 LEU HB3 4.00
&rst
ixpk= 0, nxpk= 0, iat=1339,1344, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 97 LEU HN 97 LEU HB3 4.00
&rst
ixpk= 0, nxpk= 0, iat=1339,1344, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 97 LEU HN 97 LEU HB3 4.00
&rst
ixpk= 0, nxpk= 0, iat=1339,1344, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 97 LEU HN 97 LEU QD1 4.71
&rst
ixpk= 0, nxpk= 0, iat=1339, -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr2=1348,1349,1350,
&end
#
# 97 LEU HN 97 LEU QD1 4.71
&rst
ixpk= 0, nxpk= 0, iat=1339, -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr2=1348,1349,1350,
&end
#
# 97 LEU HN 97 LEU QD1 4.71
&rst
ixpk= 0, nxpk= 0, iat=1339, -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr2=1348,1349,1350,
&end
#
# 97 LEU HN 127 ILE QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1339, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1809,1810,1811,
&end
#
# 97 LEU HN 127 ILE QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1339, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1809,1810,1811,
&end
#
# 97 LEU HN 127 ILE QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1339, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1809,1810,1811,
&end
#
# 97 LEU HA 97 LEU HB2 4.70
&rst
ixpk= 0, nxpk= 0, iat=1341,1343, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 97 LEU HA 97 LEU HB3 4.49
&rst
ixpk= 0, nxpk= 0, iat=1341,1344, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99, &end
#
# 97 LEU HA 97 LEU HG 4.83
&rst
ixpk= 0, nxpk= 0, iat=1341,1346, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33, &end
#
# 97 LEU HA 97 LEU QD1 3.83
&rst
ixpk= 0, nxpk= 0, iat=1341, -1, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
igr2=1348,1349,1350,
&end
#
# 97 LEU HA 97 LEU QD1 3.83
&rst
ixpk= 0, nxpk= 0, iat=1341, -1, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
igr2=1348,1349,1350,
&end
#
# 97 LEU HA 97 LEU QD1 3.83
&rst
ixpk= 0, nxpk= 0, iat=1341, -1, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
igr2=1348,1349,1350,
&end
#
# 97 LEU HA 97 LEU QD2 5.65
&rst
ixpk= 0, nxpk= 0, iat=1341, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2=1352,1353,1354,
&end
#
# 97 LEU HA 97 LEU QD2 5.65
&rst
ixpk= 0, nxpk= 0, iat=1341, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2=1352,1353,1354,
&end
#
# 97 LEU HA 97 LEU QD2 5.65
&rst
ixpk= 0, nxpk= 0, iat=1341, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2=1352,1353,1354,
&end
#
# 97 LEU HA 98 VAL HN 3.26
&rst
ixpk= 0, nxpk= 0, iat=1341,1358, r1= 1.30, r2= 1.80, r3= 3.26, r4= 3.76, &end
#
# 97 LEU HA 98 VAL HN 3.26
&rst
ixpk= 0, nxpk= 0, iat=1341,1358, r1= 1.30, r2= 1.80, r3= 3.26, r4= 3.76, &end
#
# 97 LEU HA 98 VAL HN 3.26
&rst
ixpk= 0, nxpk= 0, iat=1341,1358, r1= 1.30, r2= 1.80, r3= 3.26, r4= 3.76, &end
#
# 97 LEU HB2 97 LEU QD2 4.49
&rst
ixpk= 0, nxpk= 0, iat=1343, -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr2=1352,1353,1354,
&end
#
# 97 LEU HB2 97 LEU QD2 4.49
&rst
ixpk= 0, nxpk= 0, iat=1343, -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr2=1352,1353,1354,
&end
#
# 97 LEU HB2 97 LEU QD2 4.49
&rst
ixpk= 0, nxpk= 0, iat=1343, -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr2=1352,1353,1354,
&end
#
# 97 LEU HB2 98 VAL HN 5.60
&rst
ixpk= 0, nxpk= 0, iat=1343,1358, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10, &end
#
# 97 LEU HB2 98 VAL HN 5.60
&rst
ixpk= 0, nxpk= 0, iat=1343,1358, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10, &end
#
# 97 LEU HB2 98 VAL HN 5.60
&rst
ixpk= 0, nxpk= 0, iat=1343,1358, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10, &end
#
# 97 LEU HB3 97 LEU HB2 3.82
&rst
ixpk= 0, nxpk= 0, iat=1344,1343, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32, &end
#
# 97 LEU HB3 97 LEU HG 5.24
&rst
ixpk= 0, nxpk= 0, iat=1344,1346, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74, &end
#
# 97 LEU HB3 97 LEU QD2 3.85
&rst
ixpk= 0, nxpk= 0, iat=1344, -1, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
igr2=1352,1353,1354,
&end
#
# 97 LEU HB3 97 LEU QD2 3.85
&rst
ixpk= 0, nxpk= 0, iat=1344, -1, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
igr2=1352,1353,1354,
&end
#
# 97 LEU HB3 97 LEU QD2 3.85
&rst
ixpk= 0, nxpk= 0, iat=1344, -1, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
igr2=1352,1353,1354,
&end
#
# 97 LEU HB3 98 VAL HN 4.97
&rst
ixpk= 0, nxpk= 0, iat=1344,1358, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 97 LEU HB3 98 VAL HN 4.97
&rst
ixpk= 0, nxpk= 0, iat=1344,1358, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 97 LEU HB3 98 VAL HN 4.97
&rst
ixpk= 0, nxpk= 0, iat=1344,1358, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 97 LEU HG 97 LEU QD2 4.70
&rst
ixpk= 0, nxpk= 0, iat=1346, -1, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14,
igr2=1352,1353,1354,
&end
#
# 97 LEU QD1 97 LEU HG 4.43
&rst
ixpk= 0, nxpk= 0, iat= -1,1346, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
igr1=1348,1349,1350,
&end
#
# 97 LEU QD1 98 VAL HN 4.18
&rst
ixpk= 0, nxpk= 0, iat= -1,1358, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
igr1=1348,1349,1350,
&end
#
# 97 LEU QD1 98 VAL HN 4.18
&rst
ixpk= 0, nxpk= 0, iat= -1,1358, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
igr1=1348,1349,1350,
&end
#
# 97 LEU QD1 98 VAL HN 4.18
&rst
ixpk= 0, nxpk= 0, iat= -1,1358, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
igr1=1348,1349,1350,
&end
#
# 97 LEU QD1 98 VAL HA 5.64
&rst
ixpk= 0, nxpk= 0, iat= -1,1360, r1= 1.30, r2= 1.80, r3= 6.77, r4= 7.27,
igr1=1348,1349,1350,
&end
#
# 97 LEU QD1 98 VAL HA 5.64
&rst
ixpk= 0, nxpk= 0, iat= -1,1360, r1= 1.30, r2= 1.80, r3= 6.77, r4= 7.27,
igr1=1348,1349,1350,
&end
#
# 97 LEU QD1 98 VAL HA 5.64
&rst
ixpk= 0, nxpk= 0, iat= -1,1360, r1= 1.30, r2= 1.80, r3= 6.77, r4= 7.27,
igr1=1348,1349,1350,
&end
#
# 97 LEU QD1 98 VAL HB 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1362, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1348,1349,1350,
&end
#
# 97 LEU QD1 98 VAL HB 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1362, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1348,1349,1350,
&end
#
# 97 LEU QD1 98 VAL HB 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1362, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1348,1349,1350,
&end
#
# 97 LEU QD1 99 VAL HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1374, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1348,1349,1350,
&end
#
# 97 LEU QD1 99 VAL HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1374, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1348,1349,1350,
&end
#
# 97 LEU QD1 99 VAL HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1374, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1348,1349,1350,
&end
#
# 97 LEU QD1 99 VAL HA 5.91
&rst
ixpk= 0, nxpk= 0, iat= -1,1376, r1= 1.30, r2= 1.80, r3= 7.10, r4= 7.60,
igr1=1348,1349,1350,
&end
#
# 97 LEU QD1 99 VAL HA 5.91
&rst
ixpk= 0, nxpk= 0, iat= -1,1376, r1= 1.30, r2= 1.80, r3= 7.10, r4= 7.60,
igr1=1348,1349,1350,
&end
#
# 97 LEU QD1 99 VAL HA 5.91
&rst
ixpk= 0, nxpk= 0, iat= -1,1376, r1= 1.30, r2= 1.80, r3= 7.10, r4= 7.60,
igr1=1348,1349,1350,
&end
#
# 97 LEU QD1 105 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1456, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1348,1349,1350,
&end
#
# 97 LEU QD1 105 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1456, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1348,1349,1350,
&end
#
# 97 LEU QD1 105 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1456, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1348,1349,1350,
&end
#
# 97 LEU QD1 105 ALA HA 5.84
&rst
ixpk= 0, nxpk= 0, iat= -1,1458, r1= 1.30, r2= 1.80, r3= 7.01, r4= 7.51,
igr1=1348,1349,1350,
&end
#
# 97 LEU QD1 105 ALA HA 5.84
&rst
ixpk= 0, nxpk= 0, iat= -1,1458, r1= 1.30, r2= 1.80, r3= 7.01, r4= 7.51,
igr1=1348,1349,1350,
&end
#
# 97 LEU QD1 105 ALA HA 5.84
&rst
ixpk= 0, nxpk= 0, iat= -1,1458, r1= 1.30, r2= 1.80, r3= 7.01, r4= 7.51,
igr1=1348,1349,1350,
&end
#
# 97 LEU QD1 105 ALA QB 4.57
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
igr1=1348,1349,1350,
igr2=1460,1461,1462,
&end
#
# 97 LEU QD1 105 ALA QB 4.57
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
igr1=1348,1349,1350,
igr2=1460,1461,1462,
&end
#
# 97 LEU QD1 105 ALA QB 4.57
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
igr1=1348,1349,1350,
igr2=1460,1461,1462,
&end
#
# 97 LEU QD1 106 THR HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1466, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1348,1349,1350,
&end
#
# 97 LEU QD1 106 THR HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1466, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1348,1349,1350,
&end
#
# 97 LEU QD1 106 THR HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1466, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1348,1349,1350,
&end
#
# 97 LEU QD1 107 GLU HN 6.02
&rst
ixpk= 0, nxpk= 0, iat= -1,1480, r1= 1.30, r2= 1.80, r3= 7.23, r4= 7.73,
igr1=1348,1349,1350,
&end
#
# 97 LEU QD1 107 GLU HN 6.02
&rst
ixpk= 0, nxpk= 0, iat= -1,1480, r1= 1.30, r2= 1.80, r3= 7.23, r4= 7.73,
igr1=1348,1349,1350,
&end
#
# 97 LEU QD1 107 GLU HN 6.02
&rst
ixpk= 0, nxpk= 0, iat= -1,1480, r1= 1.30, r2= 1.80, r3= 7.23, r4= 7.73,
igr1=1348,1349,1350,
&end
#
# 97 LEU QD1 107 GLU HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1482, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1348,1349,1350,
&end
#
# 97 LEU QD1 107 GLU HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1482, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1348,1349,1350,
&end
#
# 97 LEU QD1 107 GLU HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1482, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1348,1349,1350,
&end
#
# 97 LEU QD1 107 GLU HB2 5.83
&rst
ixpk= 0, nxpk= 0, iat= -1,1484, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,
igr1=1348,1349,1350,
&end
#
# 97 LEU QD1 107 GLU HB2 5.83
&rst
ixpk= 0, nxpk= 0, iat= -1,1484, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,
igr1=1348,1349,1350,
&end
#
# 97 LEU QD1 107 GLU HB2 5.83
&rst
ixpk= 0, nxpk= 0, iat= -1,1484, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,
igr1=1348,1349,1350,
&end
#
# 97 LEU QD1 107 GLU HB3 5.87
&rst
ixpk= 0, nxpk= 0, iat= -1,1485, r1= 1.30, r2= 1.80, r3= 7.05, r4= 7.55,
igr1=1348,1349,1350,
&end
#
# 97 LEU QD1 107 GLU HB3 5.87
&rst
ixpk= 0, nxpk= 0, iat= -1,1485, r1= 1.30, r2= 1.80, r3= 7.05, r4= 7.55,
igr1=1348,1349,1350,
&end
#
# 97 LEU QD1 107 GLU HB3 5.87
&rst
ixpk= 0, nxpk= 0, iat= -1,1485, r1= 1.30, r2= 1.80, r3= 7.05, r4= 7.55,
igr1=1348,1349,1350,
&end
#
# 97 LEU QD1 107 GLU HG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1487, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1348,1349,1350,
&end
#
# 97 LEU QD1 107 GLU HG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1487, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1348,1349,1350,
&end
#
# 97 LEU QD1 107 GLU HG2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1487, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1348,1349,1350,
&end
#
# 97 LEU QD1 107 GLU HG3 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1488, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1348,1349,1350,
&end
#
# 97 LEU QD1 107 GLU HG3 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1488, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1348,1349,1350,
&end
#
# 97 LEU QD1 107 GLU HG3 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1488, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1348,1349,1350,
&end
#
# 97 LEU QD1 108 PRO HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1505, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1348,1349,1350,
&end
#
# 97 LEU QD1 108 PRO HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1505, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1348,1349,1350,
&end
#
# 97 LEU QD1 108 PRO HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1505, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1348,1349,1350,
&end
#
# 97 LEU QD1 109 VAL HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1509, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1348,1349,1350,
&end
#
# 97 LEU QD1 109 VAL HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1509, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1348,1349,1350,
&end
#
# 97 LEU QD1 109 VAL HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1509, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1348,1349,1350,
&end
#
# 97 LEU QD2 97 LEU QD1 3.27
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
igr1=1352,1353,1354,
igr2=1348,1349,1350,
&end
#
# 97 LEU QD2 127 ILE HA 5.79
&rst
ixpk= 0, nxpk= 0, iat= -1,1805, r1= 1.30, r2= 1.80, r3= 6.95, r4= 7.45,
igr1=1352,1353,1354,
&end
#
# 97 LEU QD2 127 ILE HA 5.79
&rst
ixpk= 0, nxpk= 0, iat= -1,1805, r1= 1.30, r2= 1.80, r3= 6.95, r4= 7.45,
igr1=1352,1353,1354,
&end
#
# 97 LEU QD2 127 ILE HA 5.79
&rst
ixpk= 0, nxpk= 0, iat= -1,1805, r1= 1.30, r2= 1.80, r3= 6.95, r4= 7.45,
igr1=1352,1353,1354,
&end
#
# 97 LEU QD2 127 ILE HB 5.18
&rst
ixpk= 0, nxpk= 0, iat= -1,1807, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
igr1=1352,1353,1354,
&end
#
# 97 LEU QD2 127 ILE HB 5.18
&rst
ixpk= 0, nxpk= 0, iat= -1,1807, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
igr1=1352,1353,1354,
&end
#
# 97 LEU QD2 127 ILE HB 5.18
&rst
ixpk= 0, nxpk= 0, iat= -1,1807, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
igr1=1352,1353,1354,
&end
#
# 97 LEU QD2 127 ILE QD1 4.48
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.46, r4= 6.96,
igr1=1352,1353,1354,
igr2=1816,1817,1818,
&end
#
# 97 LEU QD2 127 ILE QD1 4.48
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.46, r4= 6.96,
igr1=1352,1353,1354,
igr2=1816,1817,1818,
&end
#
# 97 LEU QD2 127 ILE QD1 4.48
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.46, r4= 6.96,
igr1=1352,1353,1354,
igr2=1816,1817,1818,
&end
#
# 97 LEU QD2 127 ILE QG2 5.03
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.25, r4= 7.75,
igr1=1352,1353,1354,
igr2=1809,1810,1811,
&end
#
# 97 LEU QD2 127 ILE QG2 5.03
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.25, r4= 7.75,
igr1=1352,1353,1354,
igr2=1809,1810,1811,
&end
#
# 97 LEU QD2 127 ILE QG2 5.03
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.25, r4= 7.75,
igr1=1352,1353,1354,
igr2=1809,1810,1811,
&end
#
# 98 VAL HN 98 VAL HA 4.10
&rst
ixpk= 0, nxpk= 0, iat=1358,1360, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60, &end
#
# 98 VAL HN 98 VAL HB 3.61
&rst
ixpk= 0, nxpk= 0, iat=1358,1362, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11, &end
#
# 98 VAL HN 98 VAL HB 3.61
&rst
ixpk= 0, nxpk= 0, iat=1358,1362, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11, &end
#
# 98 VAL HN 98 VAL HB 3.61
&rst
ixpk= 0, nxpk= 0, iat=1358,1362, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11, &end
#
# 98 VAL HN 98 VAL QG1 4.58
&rst
ixpk= 0, nxpk= 0, iat=1358, -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
igr2=1364,1365,1366,
&end
#
# 98 VAL HN 98 VAL QG1 4.58
&rst
ixpk= 0, nxpk= 0, iat=1358, -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
igr2=1364,1365,1366,
&end
#
# 98 VAL HN 98 VAL QG1 4.58
&rst
ixpk= 0, nxpk= 0, iat=1358, -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
igr2=1364,1365,1366,
&end
#
# 98 VAL HN 98 VAL QG2 4.08
&rst
ixpk= 0, nxpk= 0, iat=1358, -1, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,
igr2=1368,1369,1370,
&end
#
# 98 VAL HN 98 VAL QG2 4.08
&rst
ixpk= 0, nxpk= 0, iat=1358, -1, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,
igr2=1368,1369,1370,
&end
#
# 98 VAL HN 98 VAL QG2 4.08
&rst
ixpk= 0, nxpk= 0, iat=1358, -1, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,
igr2=1368,1369,1370,
&end
#
# 98 VAL HN 99 VAL HN 5.45
&rst
ixpk= 0, nxpk= 0, iat=1358,1374, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95, &end
#
# 98 VAL HN 99 VAL HN 5.45
&rst
ixpk= 0, nxpk= 0, iat=1358,1374, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95, &end
#
# 98 VAL HN 99 VAL HN 5.45
&rst
ixpk= 0, nxpk= 0, iat=1358,1374, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95, &end
#
# 98 VAL HN 99 VAL QG1 6.05
&rst
ixpk= 0, nxpk= 0, iat=1358, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1380,1381,1382,
&end
#
# 98 VAL HN 99 VAL QG1 6.05
&rst
ixpk= 0, nxpk= 0, iat=1358, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1380,1381,1382,
&end
#
# 98 VAL HN 99 VAL QG1 6.05
&rst
ixpk= 0, nxpk= 0, iat=1358, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1380,1381,1382,
&end
#
# 98 VAL HN 105 ALA QB 5.97
&rst
ixpk= 0, nxpk= 0, iat=1358, -1, r1= 1.30, r2= 1.80, r3= 7.17, r4= 7.67,
igr2=1460,1461,1462,
&end
#
# 98 VAL HN 105 ALA QB 5.97
&rst
ixpk= 0, nxpk= 0, iat=1358, -1, r1= 1.30, r2= 1.80, r3= 7.17, r4= 7.67,
igr2=1460,1461,1462,
&end
#
# 98 VAL HN 105 ALA QB 5.97
&rst
ixpk= 0, nxpk= 0, iat=1358, -1, r1= 1.30, r2= 1.80, r3= 7.17, r4= 7.67,
igr2=1460,1461,1462,
&end
#
# 98 VAL HN 107 GLU HB2 6.00
&rst
ixpk= 0, nxpk= 0, iat=1358,1484, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 98 VAL HN 107 GLU HB2 6.00
&rst
ixpk= 0, nxpk= 0, iat=1358,1484, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 98 VAL HN 107 GLU HB2 6.00
&rst
ixpk= 0, nxpk= 0, iat=1358,1484, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 98 VAL HA 98 VAL HB 4.41
&rst
ixpk= 0, nxpk= 0, iat=1360,1362, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, &end
#
# 98 VAL HA 98 VAL QG1 3.86
&rst
ixpk= 0, nxpk= 0, iat=1360, -1, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
igr2=1364,1365,1366,
&end
#
# 98 VAL HA 98 VAL QG1 3.86
&rst
ixpk= 0, nxpk= 0, iat=1360, -1, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
igr2=1364,1365,1366,
&end
#
# 98 VAL HA 98 VAL QG1 3.86
&rst
ixpk= 0, nxpk= 0, iat=1360, -1, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
igr2=1364,1365,1366,
&end
#
# 98 VAL HA 98 VAL QG2 3.85
&rst
ixpk= 0, nxpk= 0, iat=1360, -1, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
igr2=1368,1369,1370,
&end
#
# 98 VAL HA 98 VAL QG2 3.85
&rst
ixpk= 0, nxpk= 0, iat=1360, -1, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
igr2=1368,1369,1370,
&end
#
# 98 VAL HA 98 VAL QG2 3.85
&rst
ixpk= 0, nxpk= 0, iat=1360, -1, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
igr2=1368,1369,1370,
&end
#
# 98 VAL HA 99 VAL HN 3.19
&rst
ixpk= 0, nxpk= 0, iat=1360,1374, r1= 1.30, r2= 1.80, r3= 3.19, r4= 3.69, &end
#
# 98 VAL HA 99 VAL HN 3.19
&rst
ixpk= 0, nxpk= 0, iat=1360,1374, r1= 1.30, r2= 1.80, r3= 3.19, r4= 3.69, &end
#
# 98 VAL HA 99 VAL HN 3.19
&rst
ixpk= 0, nxpk= 0, iat=1360,1374, r1= 1.30, r2= 1.80, r3= 3.19, r4= 3.69, &end
#
# 98 VAL HB 98 VAL QG2 3.52
&rst
ixpk= 0, nxpk= 0, iat=1362, -1, r1= 1.30, r2= 1.80, r3= 4.23, r4= 4.73,
igr2=1368,1369,1370,
&end
#
# 98 VAL HB 99 VAL HN 6.04
&rst
ixpk= 0, nxpk= 0, iat=1362,1374, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54, &end
#
# 98 VAL HB 99 VAL HN 6.04
&rst
ixpk= 0, nxpk= 0, iat=1362,1374, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54, &end
#
# 98 VAL HB 99 VAL HN 6.04
&rst
ixpk= 0, nxpk= 0, iat=1362,1374, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54, &end
#
# 98 VAL HB 107 GLU HN 5.98
&rst
ixpk= 0, nxpk= 0, iat=1362,1480, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48, &end
#
# 98 VAL HB 107 GLU HN 5.98
&rst
ixpk= 0, nxpk= 0, iat=1362,1480, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48, &end
#
# 98 VAL HB 107 GLU HN 5.98
&rst
ixpk= 0, nxpk= 0, iat=1362,1480, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48, &end
#
# 98 VAL QG1 98 VAL QG2 3.28
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
igr1=1364,1365,1366,
igr2=1368,1369,1370,
&end
#
# 98 VAL QG1 99 VAL HN 4.37
&rst
ixpk= 0, nxpk= 0, iat= -1,1374, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
igr1=1364,1365,1366,
&end
#
# 98 VAL QG1 99 VAL HN 4.37
&rst
ixpk= 0, nxpk= 0, iat= -1,1374, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
igr1=1364,1365,1366,
&end
#
# 98 VAL QG1 99 VAL HN 4.37
&rst
ixpk= 0, nxpk= 0, iat= -1,1374, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75,
igr1=1364,1365,1366,
&end
#
# 98 VAL QG2 99 VAL HN 4.72
&rst
ixpk= 0, nxpk= 0, iat= -1,1374, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
igr1=1368,1369,1370,
&end
#
# 98 VAL QG2 99 VAL HN 4.72
&rst
ixpk= 0, nxpk= 0, iat= -1,1374, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
igr1=1368,1369,1370,
&end
#
# 98 VAL QG2 99 VAL HN 4.72
&rst
ixpk= 0, nxpk= 0, iat= -1,1374, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
igr1=1368,1369,1370,
&end
#
# 98 VAL QG2 100 ASN HN 4.88
&rst
ixpk= 0, nxpk= 0, iat= -1,1390, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
igr1=1368,1369,1370,
&end
#
# 98 VAL QG2 100 ASN HN 4.88
&rst
ixpk= 0, nxpk= 0, iat= -1,1390, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
igr1=1368,1369,1370,
&end
#
# 98 VAL QG2 100 ASN HN 4.88
&rst
ixpk= 0, nxpk= 0, iat= -1,1390, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
igr1=1368,1369,1370,
&end
#
# 99 VAL HN 99 VAL HB 4.28
&rst
ixpk= 0, nxpk= 0, iat=1374,1378, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78, &end
#
# 99 VAL HN 99 VAL HB 4.28
&rst
ixpk= 0, nxpk= 0, iat=1374,1378, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78, &end
#
# 99 VAL HN 99 VAL HB 4.28
&rst
ixpk= 0, nxpk= 0, iat=1374,1378, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78, &end
#
# 99 VAL HN 99 VAL QG1 4.11
&rst
ixpk= 0, nxpk= 0, iat=1374, -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
igr2=1380,1381,1382,
&end
#
# 99 VAL HN 99 VAL QG1 4.11
&rst
ixpk= 0, nxpk= 0, iat=1374, -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
igr2=1380,1381,1382,
&end
#
# 99 VAL HN 99 VAL QG1 4.11
&rst
ixpk= 0, nxpk= 0, iat=1374, -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
igr2=1380,1381,1382,
&end
#
# 99 VAL HN 99 VAL QG2 3.92
&rst
ixpk= 0, nxpk= 0, iat=1374, -1, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
igr2=1384,1385,1386,
&end
#
# 99 VAL HN 99 VAL QG2 3.92
&rst
ixpk= 0, nxpk= 0, iat=1374, -1, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
igr2=1384,1385,1386,
&end
#
# 99 VAL HN 99 VAL QG2 3.92
&rst
ixpk= 0, nxpk= 0, iat=1374, -1, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
igr2=1384,1385,1386,
&end
#
# 99 VAL HN 105 ALA QB 6.05
&rst
ixpk= 0, nxpk= 0, iat=1374, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1460,1461,1462,
&end
#
# 99 VAL HN 105 ALA QB 6.05
&rst
ixpk= 0, nxpk= 0, iat=1374, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1460,1461,1462,
&end
#
# 99 VAL HN 105 ALA QB 6.05
&rst
ixpk= 0, nxpk= 0, iat=1374, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1460,1461,1462,
&end
#
# 99 VAL HN 107 GLU HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1374,1484, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 99 VAL HN 107 GLU HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1374,1484, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 99 VAL HN 107 GLU HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1374,1484, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 99 VAL HA 99 VAL HB 4.86
&rst
ixpk= 0, nxpk= 0, iat=1376,1378, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36, &end
#
# 99 VAL HA 99 VAL QG1 3.92
&rst
ixpk= 0, nxpk= 0, iat=1376, -1, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
igr2=1380,1381,1382,
&end
#
# 99 VAL HA 99 VAL QG1 3.92
&rst
ixpk= 0, nxpk= 0, iat=1376, -1, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
igr2=1380,1381,1382,
&end
#
# 99 VAL HA 99 VAL QG1 3.92
&rst
ixpk= 0, nxpk= 0, iat=1376, -1, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
igr2=1380,1381,1382,
&end
#
# 99 VAL HA 99 VAL QG2 3.86
&rst
ixpk= 0, nxpk= 0, iat=1376, -1, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
igr2=1384,1385,1386,
&end
#
# 99 VAL HA 99 VAL QG2 3.86
&rst
ixpk= 0, nxpk= 0, iat=1376, -1, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
igr2=1384,1385,1386,
&end
#
# 99 VAL HA 99 VAL QG2 3.86
&rst
ixpk= 0, nxpk= 0, iat=1376, -1, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14,
igr2=1384,1385,1386,
&end
#
# 99 VAL HA 100 ASN HN 3.59
&rst
ixpk= 0, nxpk= 0, iat=1376,1390, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09, &end
#
# 99 VAL HA 100 ASN HN 3.59
&rst
ixpk= 0, nxpk= 0, iat=1376,1390, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09, &end
#
# 99 VAL HA 100 ASN HN 3.59
&rst
ixpk= 0, nxpk= 0, iat=1376,1390, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09, &end
#
# 99 VAL HA 100 ASN HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1376,1392, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 99 VAL HA 100 ASN HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1376,1392, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 99 VAL HA 100 ASN HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1376,1392, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 99 VAL HA 100 ASN HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1376,1394, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 99 VAL HA 100 ASN HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1376,1394, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 99 VAL HA 100 ASN HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1376,1394, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 99 VAL HA 100 ASN HB3 6.02
&rst
ixpk= 0, nxpk= 0, iat=1376,1395, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52, &end
#
# 99 VAL HA 100 ASN HB3 6.02
&rst
ixpk= 0, nxpk= 0, iat=1376,1395, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52, &end
#
# 99 VAL HA 100 ASN HB3 6.02
&rst
ixpk= 0, nxpk= 0, iat=1376,1395, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52, &end
#
# 99 VAL HA 104 ILE HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1376,1437, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 99 VAL HA 104 ILE HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1376,1437, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 99 VAL HA 104 ILE HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1376,1437, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 99 VAL HA 105 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1376,1456, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 99 VAL HA 105 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1376,1456, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 99 VAL HA 105 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1376,1456, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 99 VAL HA 105 ALA HA 4.39
&rst
ixpk= 0, nxpk= 0, iat=1376,1458, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89, &end
#
# 99 VAL HA 105 ALA HA 4.39
&rst
ixpk= 0, nxpk= 0, iat=1376,1458, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89, &end
#
# 99 VAL HA 105 ALA HA 4.39
&rst
ixpk= 0, nxpk= 0, iat=1376,1458, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89, &end
#
# 99 VAL HA 105 ALA QB 3.95
&rst
ixpk= 0, nxpk= 0, iat=1376, -1, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr2=1460,1461,1462,
&end
#
# 99 VAL HA 105 ALA QB 3.95
&rst
ixpk= 0, nxpk= 0, iat=1376, -1, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr2=1460,1461,1462,
&end
#
# 99 VAL HA 105 ALA QB 3.95
&rst
ixpk= 0, nxpk= 0, iat=1376, -1, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24,
igr2=1460,1461,1462,
&end
#
# 99 VAL HA 106 THR HN 5.21
&rst
ixpk= 0, nxpk= 0, iat=1376,1466, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71, &end
#
# 99 VAL HA 106 THR HN 5.21
&rst
ixpk= 0, nxpk= 0, iat=1376,1466, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71, &end
#
# 99 VAL HA 106 THR HN 5.21
&rst
ixpk= 0, nxpk= 0, iat=1376,1466, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71, &end
#
# 99 VAL HB 99 VAL QG1 4.11
&rst
ixpk= 0, nxpk= 0, iat=1378, -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
igr2=1380,1381,1382,
&end
#
# 99 VAL HB 100 ASN HN 4.26
&rst
ixpk= 0, nxpk= 0, iat=1378,1390, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76, &end
#
# 99 VAL HB 100 ASN HN 4.26
&rst
ixpk= 0, nxpk= 0, iat=1378,1390, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76, &end
#
# 99 VAL HB 100 ASN HN 4.26
&rst
ixpk= 0, nxpk= 0, iat=1378,1390, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76, &end
#
# 99 VAL QG1 99 VAL QG2 3.35
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
igr1=1380,1381,1382,
igr2=1384,1385,1386,
&end
#
# 99 VAL QG1 100 ASN HN 4.80
&rst
ixpk= 0, nxpk= 0, iat= -1,1390, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
igr1=1380,1381,1382,
&end
#
# 99 VAL QG1 100 ASN HN 4.80
&rst
ixpk= 0, nxpk= 0, iat= -1,1390, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
igr1=1380,1381,1382,
&end
#
# 99 VAL QG1 100 ASN HN 4.80
&rst
ixpk= 0, nxpk= 0, iat= -1,1390, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
igr1=1380,1381,1382,
&end
#
# 99 VAL QG1 105 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1456, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1380,1381,1382,
&end
#
# 99 VAL QG1 105 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1456, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1380,1381,1382,
&end
#
# 99 VAL QG1 105 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1456, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1380,1381,1382,
&end
#
# 99 VAL QG1 105 ALA HA 5.87
&rst
ixpk= 0, nxpk= 0, iat= -1,1458, r1= 1.30, r2= 1.80, r3= 7.05, r4= 7.55,
igr1=1380,1381,1382,
&end
#
# 99 VAL QG1 105 ALA HA 5.87
&rst
ixpk= 0, nxpk= 0, iat= -1,1458, r1= 1.30, r2= 1.80, r3= 7.05, r4= 7.55,
igr1=1380,1381,1382,
&end
#
# 99 VAL QG1 105 ALA HA 5.87
&rst
ixpk= 0, nxpk= 0, iat= -1,1458, r1= 1.30, r2= 1.80, r3= 7.05, r4= 7.55,
igr1=1380,1381,1382,
&end
#
# 99 VAL QG1 105 ALA QB 3.84
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
igr1=1380,1381,1382,
igr2=1460,1461,1462,
&end
#
# 99 VAL QG1 105 ALA QB 3.84
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
igr1=1380,1381,1382,
igr2=1460,1461,1462,
&end
#
# 99 VAL QG1 105 ALA QB 3.84
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
igr1=1380,1381,1382,
igr2=1460,1461,1462,
&end
#
# 99 VAL QG2 99 VAL HB 4.09
&rst
ixpk= 0, nxpk= 0, iat= -1,1378, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
igr1=1384,1385,1386,
&end
#
# 99 VAL QG2 100 ASN HN 3.97
&rst
ixpk= 0, nxpk= 0, iat= -1,1390, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
igr1=1384,1385,1386,
&end
#
# 99 VAL QG2 100 ASN HN 3.97
&rst
ixpk= 0, nxpk= 0, iat= -1,1390, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
igr1=1384,1385,1386,
&end
#
# 99 VAL QG2 100 ASN HN 3.97
&rst
ixpk= 0, nxpk= 0, iat= -1,1390, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
igr1=1384,1385,1386,
&end
#
# 99 VAL QG2 100 ASN HA 5.80
&rst
ixpk= 0, nxpk= 0, iat= -1,1392, r1= 1.30, r2= 1.80, r3= 6.97, r4= 7.47,
igr1=1384,1385,1386,
&end
#
# 99 VAL QG2 100 ASN HA 5.80
&rst
ixpk= 0, nxpk= 0, iat= -1,1392, r1= 1.30, r2= 1.80, r3= 6.97, r4= 7.47,
igr1=1384,1385,1386,
&end
#
# 99 VAL QG2 100 ASN HA 5.80
&rst
ixpk= 0, nxpk= 0, iat= -1,1392, r1= 1.30, r2= 1.80, r3= 6.97, r4= 7.47,
igr1=1384,1385,1386,
&end
#
# 99 VAL QG2 100 ASN HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1394, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1384,1385,1386,
&end
#
# 99 VAL QG2 100 ASN HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1394, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1384,1385,1386,
&end
#
# 99 VAL QG2 100 ASN HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1394, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1384,1385,1386,
&end
#
# 99 VAL QG2 102 ASP HN 5.20
&rst
ixpk= 0, nxpk= 0, iat= -1,1418, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
igr1=1384,1385,1386,
&end
#
# 99 VAL QG2 102 ASP HN 5.20
&rst
ixpk= 0, nxpk= 0, iat= -1,1418, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
igr1=1384,1385,1386,
&end
#
# 99 VAL QG2 102 ASP HN 5.20
&rst
ixpk= 0, nxpk= 0, iat= -1,1418, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
igr1=1384,1385,1386,
&end
#
# 99 VAL QG2 103 GLY HN 4.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1430, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr1=1384,1385,1386,
&end
#
# 99 VAL QG2 103 GLY HN 4.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1430, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr1=1384,1385,1386,
&end
#
# 99 VAL QG2 103 GLY HN 4.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1430, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr1=1384,1385,1386,
&end
#
# 99 VAL QG2 103 GLY HA2 4.75
&rst
ixpk= 0, nxpk= 0, iat= -1,1432, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr1=1384,1385,1386,
&end
#
# 99 VAL QG2 103 GLY HA2 4.75
&rst
ixpk= 0, nxpk= 0, iat= -1,1432, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr1=1384,1385,1386,
&end
#
# 99 VAL QG2 103 GLY HA2 4.75
&rst
ixpk= 0, nxpk= 0, iat= -1,1432, r1= 1.30, r2= 1.80, r3= 5.70, r4= 6.20,
igr1=1384,1385,1386,
&end
#
# 99 VAL QG2 103 GLY HA3 4.51
&rst
ixpk= 0, nxpk= 0, iat= -1,1433, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr1=1384,1385,1386,
&end
#
# 99 VAL QG2 103 GLY HA3 4.51
&rst
ixpk= 0, nxpk= 0, iat= -1,1433, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr1=1384,1385,1386,
&end
#
# 99 VAL QG2 103 GLY HA3 4.51
&rst
ixpk= 0, nxpk= 0, iat= -1,1433, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92,
igr1=1384,1385,1386,
&end
#
# 99 VAL QG2 104 ILE HN 4.36
&rst
ixpk= 0, nxpk= 0, iat= -1,1437, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr1=1384,1385,1386,
&end
#
# 99 VAL QG2 104 ILE HN 4.36
&rst
ixpk= 0, nxpk= 0, iat= -1,1437, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr1=1384,1385,1386,
&end
#
# 99 VAL QG2 104 ILE HN 4.36
&rst
ixpk= 0, nxpk= 0, iat= -1,1437, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr1=1384,1385,1386,
&end
#
# 99 VAL QG2 104 ILE HA 5.09
&rst
ixpk= 0, nxpk= 0, iat= -1,1439, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
igr1=1384,1385,1386,
&end
#
# 99 VAL QG2 104 ILE HA 5.09
&rst
ixpk= 0, nxpk= 0, iat= -1,1439, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
igr1=1384,1385,1386,
&end
#
# 99 VAL QG2 104 ILE HA 5.09
&rst
ixpk= 0, nxpk= 0, iat= -1,1439, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
igr1=1384,1385,1386,
&end
#
# 99 VAL QG2 105 ALA HN 5.38
&rst
ixpk= 0, nxpk= 0, iat= -1,1456, r1= 1.30, r2= 1.80, r3= 6.46, r4= 6.96,
igr1=1384,1385,1386,
&end
#
# 99 VAL QG2 105 ALA HN 5.38
&rst
ixpk= 0, nxpk= 0, iat= -1,1456, r1= 1.30, r2= 1.80, r3= 6.46, r4= 6.96,
igr1=1384,1385,1386,
&end
#
# 99 VAL QG2 105 ALA HN 5.38
&rst
ixpk= 0, nxpk= 0, iat= -1,1456, r1= 1.30, r2= 1.80, r3= 6.46, r4= 6.96,
igr1=1384,1385,1386,
&end
#
# 99 VAL QG2 105 ALA QB 4.36
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.29, r4= 6.79,
igr1=1384,1385,1386,
igr2=1460,1461,1462,
&end
#
# 99 VAL QG2 105 ALA QB 4.36
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.29, r4= 6.79,
igr1=1384,1385,1386,
igr2=1460,1461,1462,
&end
#
# 99 VAL QG2 105 ALA QB 4.36
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.29, r4= 6.79,
igr1=1384,1385,1386,
igr2=1460,1461,1462,
&end
#
# 99 VAL QG2 106 THR HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1466, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1384,1385,1386,
&end
#
# 99 VAL QG2 106 THR HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1466, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1384,1385,1386,
&end
#
# 99 VAL QG2 106 THR HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1466, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1384,1385,1386,
&end
#
# 100 ASN HN 100 ASN HA 3.97
&rst
ixpk= 0, nxpk= 0, iat=1390,1392, r1= 1.30, r2= 1.80, r3= 3.97, r4= 4.47, &end
#
# 100 ASN HN 100 ASN HB2 4.78
&rst
ixpk= 0, nxpk= 0, iat=1390,1394, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, &end
#
# 100 ASN HN 100 ASN HB3 4.19
&rst
ixpk= 0, nxpk= 0, iat=1390,1395, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69, &end
#
# 100 ASN HN 100 ASN HB3 4.19
&rst
ixpk= 0, nxpk= 0, iat=1390,1395, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69, &end
#
# 100 ASN HN 100 ASN HB3 4.19
&rst
ixpk= 0, nxpk= 0, iat=1390,1395, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69, &end
#
# 100 ASN HN 100 ASN HD21 5.14
&rst
ixpk= 0, nxpk= 0, iat=1390,1399, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64, &end
#
# 100 ASN HN 100 ASN HD21 5.14
&rst
ixpk= 0, nxpk= 0, iat=1390,1399, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64, &end
#
# 100 ASN HN 100 ASN HD21 5.14
&rst
ixpk= 0, nxpk= 0, iat=1390,1399, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64, &end
#
# 100 ASN HN 100 ASN HD22 5.20
&rst
ixpk= 0, nxpk= 0, iat=1390,1400, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70, &end
#
# 100 ASN HN 100 ASN HD22 5.20
&rst
ixpk= 0, nxpk= 0, iat=1390,1400, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70, &end
#
# 100 ASN HN 100 ASN HD22 5.20
&rst
ixpk= 0, nxpk= 0, iat=1390,1400, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70, &end
#
# 100 ASN HN 101 ASN HD21 6.05
&rst
ixpk= 0, nxpk= 0, iat=1390,1413, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 100 ASN HN 101 ASN HD21 6.05
&rst
ixpk= 0, nxpk= 0, iat=1390,1413, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 100 ASN HN 101 ASN HD21 6.05
&rst
ixpk= 0, nxpk= 0, iat=1390,1413, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 100 ASN HN 103 GLY HN 5.79
&rst
ixpk= 0, nxpk= 0, iat=1390,1430, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29, &end
#
# 100 ASN HN 103 GLY HN 5.79
&rst
ixpk= 0, nxpk= 0, iat=1390,1430, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29, &end
#
# 100 ASN HN 103 GLY HN 5.79
&rst
ixpk= 0, nxpk= 0, iat=1390,1430, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29, &end
#
# 100 ASN HN 104 ILE HN 4.40
&rst
ixpk= 0, nxpk= 0, iat=1390,1437, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 100 ASN HN 104 ILE HN 4.40
&rst
ixpk= 0, nxpk= 0, iat=1390,1437, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 100 ASN HN 104 ILE HN 4.40
&rst
ixpk= 0, nxpk= 0, iat=1390,1437, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 100 ASN HN 104 ILE HB 6.05
&rst
ixpk= 0, nxpk= 0, iat=1390,1441, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 100 ASN HN 104 ILE HB 6.05
&rst
ixpk= 0, nxpk= 0, iat=1390,1441, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 100 ASN HN 104 ILE HB 6.05
&rst
ixpk= 0, nxpk= 0, iat=1390,1441, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 100 ASN HN 104 ILE QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1390, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1443,1444,1445,
&end
#
# 100 ASN HN 104 ILE QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1390, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1443,1444,1445,
&end
#
# 100 ASN HN 104 ILE QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1390, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1443,1444,1445,
&end
#
# 100 ASN HN 105 ALA HN 5.43
&rst
ixpk= 0, nxpk= 0, iat=1390,1456, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93, &end
#
# 100 ASN HN 105 ALA HN 5.43
&rst
ixpk= 0, nxpk= 0, iat=1390,1456, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93, &end
#
# 100 ASN HN 105 ALA HN 5.43
&rst
ixpk= 0, nxpk= 0, iat=1390,1456, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93, &end
#
# 100 ASN HN 105 ALA HA 4.47
&rst
ixpk= 0, nxpk= 0, iat=1390,1458, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97, &end
#
# 100 ASN HN 105 ALA HA 4.47
&rst
ixpk= 0, nxpk= 0, iat=1390,1458, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97, &end
#
# 100 ASN HN 105 ALA HA 4.47
&rst
ixpk= 0, nxpk= 0, iat=1390,1458, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97, &end
#
# 100 ASN HN 105 ALA QB 5.29
&rst
ixpk= 0, nxpk= 0, iat=1390, -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
igr2=1460,1461,1462,
&end
#
# 100 ASN HN 105 ALA QB 5.29
&rst
ixpk= 0, nxpk= 0, iat=1390, -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
igr2=1460,1461,1462,
&end
#
# 100 ASN HN 105 ALA QB 5.29
&rst
ixpk= 0, nxpk= 0, iat=1390, -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
igr2=1460,1461,1462,
&end
#
# 100 ASN HN 106 THR HN 4.95
&rst
ixpk= 0, nxpk= 0, iat=1390,1466, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45, &end
#
# 100 ASN HN 106 THR HN 4.95
&rst
ixpk= 0, nxpk= 0, iat=1390,1466, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45, &end
#
# 100 ASN HN 106 THR HN 4.95
&rst
ixpk= 0, nxpk= 0, iat=1390,1466, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45, &end
#
# 100 ASN HN 106 THR QG2 5.93
&rst
ixpk= 0, nxpk= 0, iat=1390, -1, r1= 1.30, r2= 1.80, r3= 7.12, r4= 7.62,
igr2=1472,1473,1474,
&end
#
# 100 ASN HN 106 THR QG2 5.93
&rst
ixpk= 0, nxpk= 0, iat=1390, -1, r1= 1.30, r2= 1.80, r3= 7.12, r4= 7.62,
igr2=1472,1473,1474,
&end
#
# 100 ASN HN 106 THR QG2 5.93
&rst
ixpk= 0, nxpk= 0, iat=1390, -1, r1= 1.30, r2= 1.80, r3= 7.12, r4= 7.62,
igr2=1472,1473,1474,
&end
#
# 100 ASN HA 100 ASN HB2 3.90
&rst
ixpk= 0, nxpk= 0, iat=1392,1394, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40, &end
#
# 100 ASN HA 100 ASN HB3 3.94
&rst
ixpk= 0, nxpk= 0, iat=1392,1395, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44, &end
#
# 100 ASN HA 100 ASN HD22 6.05
&rst
ixpk= 0, nxpk= 0, iat=1392,1400, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 100 ASN HA 100 ASN HD22 6.05
&rst
ixpk= 0, nxpk= 0, iat=1392,1400, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 100 ASN HA 100 ASN HD22 6.05
&rst
ixpk= 0, nxpk= 0, iat=1392,1400, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 100 ASN HA 101 ASN HN 3.55
&rst
ixpk= 0, nxpk= 0, iat=1392,1404, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05, &end
#
# 100 ASN HA 101 ASN HN 3.55
&rst
ixpk= 0, nxpk= 0, iat=1392,1404, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05, &end
#
# 100 ASN HA 101 ASN HN 3.55
&rst
ixpk= 0, nxpk= 0, iat=1392,1404, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05, &end
#
# 100 ASN HA 101 ASN HB3 5.03
&rst
ixpk= 0, nxpk= 0, iat=1392,1409, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53, &end
#
# 100 ASN HA 101 ASN HB3 5.03
&rst
ixpk= 0, nxpk= 0, iat=1392,1409, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53, &end
#
# 100 ASN HA 101 ASN HB3 5.03
&rst
ixpk= 0, nxpk= 0, iat=1392,1409, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53, &end
#
# 100 ASN HA 101 ASN HD21 5.71
&rst
ixpk= 0, nxpk= 0, iat=1392,1413, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21, &end
#
# 100 ASN HA 101 ASN HD21 5.71
&rst
ixpk= 0, nxpk= 0, iat=1392,1413, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21, &end
#
# 100 ASN HA 101 ASN HD21 5.71
&rst
ixpk= 0, nxpk= 0, iat=1392,1413, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21, &end
#
# 100 ASN HA 102 ASP HN 5.28
&rst
ixpk= 0, nxpk= 0, iat=1392,1418, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 100 ASN HA 102 ASP HN 5.28
&rst
ixpk= 0, nxpk= 0, iat=1392,1418, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 100 ASN HA 102 ASP HN 5.28
&rst
ixpk= 0, nxpk= 0, iat=1392,1418, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 100 ASN HA 106 THR QG2 5.02
&rst
ixpk= 0, nxpk= 0, iat=1392, -1, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
igr2=1472,1473,1474,
&end
#
# 100 ASN HA 106 THR QG2 5.02
&rst
ixpk= 0, nxpk= 0, iat=1392, -1, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
igr2=1472,1473,1474,
&end
#
# 100 ASN HA 106 THR QG2 5.02
&rst
ixpk= 0, nxpk= 0, iat=1392, -1, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
igr2=1472,1473,1474,
&end
#
# 100 ASN HB2 100 ASN HD21 4.75
&rst
ixpk= 0, nxpk= 0, iat=1394,1399, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, &end
#
# 100 ASN HB2 100 ASN HD22 5.00
&rst
ixpk= 0, nxpk= 0, iat=1394,1400, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 100 ASN HB2 101 ASN HN 3.78
&rst
ixpk= 0, nxpk= 0, iat=1394,1404, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28, &end
#
# 100 ASN HB2 101 ASN HN 3.78
&rst
ixpk= 0, nxpk= 0, iat=1394,1404, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28, &end
#
# 100 ASN HB2 101 ASN HN 3.78
&rst
ixpk= 0, nxpk= 0, iat=1394,1404, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28, &end
#
# 100 ASN HB2 101 ASN HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1394,1409, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 100 ASN HB2 101 ASN HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1394,1409, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 100 ASN HB2 101 ASN HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1394,1409, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 100 ASN HB2 101 ASN HD21 4.93
&rst
ixpk= 0, nxpk= 0, iat=1394,1413, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43, &end
#
# 100 ASN HB2 101 ASN HD21 4.93
&rst
ixpk= 0, nxpk= 0, iat=1394,1413, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43, &end
#
# 100 ASN HB2 101 ASN HD21 4.93
&rst
ixpk= 0, nxpk= 0, iat=1394,1413, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43, &end
#
# 100 ASN HB2 102 ASP HN 4.84
&rst
ixpk= 0, nxpk= 0, iat=1394,1418, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34, &end
#
# 100 ASN HB2 102 ASP HN 4.84
&rst
ixpk= 0, nxpk= 0, iat=1394,1418, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34, &end
#
# 100 ASN HB2 102 ASP HN 4.84
&rst
ixpk= 0, nxpk= 0, iat=1394,1418, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34, &end
#
# 100 ASN HB2 104 ILE HN 5.86
&rst
ixpk= 0, nxpk= 0, iat=1394,1437, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36, &end
#
# 100 ASN HB2 104 ILE HN 5.86
&rst
ixpk= 0, nxpk= 0, iat=1394,1437, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36, &end
#
# 100 ASN HB2 104 ILE HN 5.86
&rst
ixpk= 0, nxpk= 0, iat=1394,1437, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36, &end
#
# 100 ASN HB2 104 ILE HB 6.05
&rst
ixpk= 0, nxpk= 0, iat=1394,1441, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 100 ASN HB2 104 ILE HB 6.05
&rst
ixpk= 0, nxpk= 0, iat=1394,1441, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 100 ASN HB2 104 ILE HB 6.05
&rst
ixpk= 0, nxpk= 0, iat=1394,1441, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 100 ASN HB3 100 ASN HB2 3.85
&rst
ixpk= 0, nxpk= 0, iat=1395,1394, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35, &end
#
# 100 ASN HB3 100 ASN HD21 4.32
&rst
ixpk= 0, nxpk= 0, iat=1395,1399, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82, &end
#
# 100 ASN HB3 100 ASN HD21 4.32
&rst
ixpk= 0, nxpk= 0, iat=1395,1399, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82, &end
#
# 100 ASN HB3 100 ASN HD21 4.32
&rst
ixpk= 0, nxpk= 0, iat=1395,1399, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82, &end
#
# 100 ASN HB3 100 ASN HD22 4.84
&rst
ixpk= 0, nxpk= 0, iat=1395,1400, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34, &end
#
# 100 ASN HB3 101 ASN HN 3.98
&rst
ixpk= 0, nxpk= 0, iat=1395,1404, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48, &end
#
# 100 ASN HB3 101 ASN HN 3.98
&rst
ixpk= 0, nxpk= 0, iat=1395,1404, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48, &end
#
# 100 ASN HB3 101 ASN HN 3.98
&rst
ixpk= 0, nxpk= 0, iat=1395,1404, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48, &end
#
# 100 ASN HB3 101 ASN HD21 4.87
&rst
ixpk= 0, nxpk= 0, iat=1395,1413, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37, &end
#
# 100 ASN HB3 101 ASN HD21 4.87
&rst
ixpk= 0, nxpk= 0, iat=1395,1413, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37, &end
#
# 100 ASN HB3 101 ASN HD21 4.87
&rst
ixpk= 0, nxpk= 0, iat=1395,1413, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37, &end
#
# 100 ASN HB3 101 ASN HD22 6.05
&rst
ixpk= 0, nxpk= 0, iat=1395,1414, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 100 ASN HB3 101 ASN HD22 6.05
&rst
ixpk= 0, nxpk= 0, iat=1395,1414, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 100 ASN HB3 101 ASN HD22 6.05
&rst
ixpk= 0, nxpk= 0, iat=1395,1414, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 100 ASN HB3 102 ASP HN 5.33
&rst
ixpk= 0, nxpk= 0, iat=1395,1418, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83, &end
#
# 100 ASN HB3 102 ASP HN 5.33
&rst
ixpk= 0, nxpk= 0, iat=1395,1418, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83, &end
#
# 100 ASN HB3 102 ASP HN 5.33
&rst
ixpk= 0, nxpk= 0, iat=1395,1418, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83, &end
#
# 100 ASN HB3 104 ILE HN 5.91
&rst
ixpk= 0, nxpk= 0, iat=1395,1437, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41, &end
#
# 100 ASN HB3 104 ILE HN 5.91
&rst
ixpk= 0, nxpk= 0, iat=1395,1437, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41, &end
#
# 100 ASN HB3 104 ILE HN 5.91
&rst
ixpk= 0, nxpk= 0, iat=1395,1437, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41, &end
#
# 100 ASN HB3 106 THR QG2 5.55
&rst
ixpk= 0, nxpk= 0, iat=1395, -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
igr2=1472,1473,1474,
&end
#
# 100 ASN HB3 106 THR QG2 5.55
&rst
ixpk= 0, nxpk= 0, iat=1395, -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
igr2=1472,1473,1474,
&end
#
# 100 ASN HB3 106 THR QG2 5.55
&rst
ixpk= 0, nxpk= 0, iat=1395, -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
igr2=1472,1473,1474,
&end
#
# 100 ASN HD21 100 ASN HD22 3.19
&rst
ixpk= 0, nxpk= 0, iat=1399,1400, r1= 1.30, r2= 1.80, r3= 3.19, r4= 3.69, &end
#
# 100 ASN HD21 101 ASN HN 5.45
&rst
ixpk= 0, nxpk= 0, iat=1399,1404, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95, &end
#
# 100 ASN HD21 101 ASN HN 5.45
&rst
ixpk= 0, nxpk= 0, iat=1399,1404, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95, &end
#
# 100 ASN HD21 101 ASN HN 5.45
&rst
ixpk= 0, nxpk= 0, iat=1399,1404, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95, &end
#
# 100 ASN HD21 102 ASP HN 5.33
&rst
ixpk= 0, nxpk= 0, iat=1399,1418, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83, &end
#
# 100 ASN HD21 102 ASP HN 5.33
&rst
ixpk= 0, nxpk= 0, iat=1399,1418, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83, &end
#
# 100 ASN HD21 102 ASP HN 5.33
&rst
ixpk= 0, nxpk= 0, iat=1399,1418, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83, &end
#
# 100 ASN HD21 103 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1399,1430, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 100 ASN HD21 103 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1399,1430, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 100 ASN HD21 103 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1399,1430, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 100 ASN HD21 104 ILE HN 5.26
&rst
ixpk= 0, nxpk= 0, iat=1399,1437, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76, &end
#
# 100 ASN HD21 104 ILE HN 5.26
&rst
ixpk= 0, nxpk= 0, iat=1399,1437, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76, &end
#
# 100 ASN HD21 104 ILE HN 5.26
&rst
ixpk= 0, nxpk= 0, iat=1399,1437, r1= 1.30, r2= 1.80, r3= 5.26, r4= 5.76, &end
#
# 100 ASN HD21 104 ILE HA 4.14
&rst
ixpk= 0, nxpk= 0, iat=1399,1439, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64, &end
#
# 100 ASN HD21 104 ILE HA 4.14
&rst
ixpk= 0, nxpk= 0, iat=1399,1439, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64, &end
#
# 100 ASN HD21 104 ILE HA 4.14
&rst
ixpk= 0, nxpk= 0, iat=1399,1439, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64, &end
#
# 100 ASN HD21 104 ILE HB 5.04
&rst
ixpk= 0, nxpk= 0, iat=1399,1441, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54, &end
#
# 100 ASN HD21 104 ILE HB 5.04
&rst
ixpk= 0, nxpk= 0, iat=1399,1441, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54, &end
#
# 100 ASN HD21 104 ILE HB 5.04
&rst
ixpk= 0, nxpk= 0, iat=1399,1441, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54, &end
#
# 100 ASN HD21 104 ILE HG12 6.05
&rst
ixpk= 0, nxpk= 0, iat=1399,1447, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 100 ASN HD21 104 ILE HG12 6.05
&rst
ixpk= 0, nxpk= 0, iat=1399,1447, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 100 ASN HD21 104 ILE HG12 6.05
&rst
ixpk= 0, nxpk= 0, iat=1399,1447, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 100 ASN HD21 104 ILE HG13 5.90
&rst
ixpk= 0, nxpk= 0, iat=1399,1448, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40, &end
#
# 100 ASN HD21 104 ILE HG13 5.90
&rst
ixpk= 0, nxpk= 0, iat=1399,1448, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40, &end
#
# 100 ASN HD21 104 ILE HG13 5.90
&rst
ixpk= 0, nxpk= 0, iat=1399,1448, r1= 1.30, r2= 1.80, r3= 5.90, r4= 6.40, &end
#
# 100 ASN HD21 104 ILE QG2 5.40
&rst
ixpk= 0, nxpk= 0, iat=1399, -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
igr2=1443,1444,1445,
&end
#
# 100 ASN HD21 104 ILE QG2 5.40
&rst
ixpk= 0, nxpk= 0, iat=1399, -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
igr2=1443,1444,1445,
&end
#
# 100 ASN HD21 104 ILE QG2 5.40
&rst
ixpk= 0, nxpk= 0, iat=1399, -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
igr2=1443,1444,1445,
&end
#
# 100 ASN HD21 106 THR HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1399,1466, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 100 ASN HD21 106 THR HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1399,1466, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 100 ASN HD21 106 THR HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1399,1466, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 100 ASN HD21 106 THR QG2 5.31
&rst
ixpk= 0, nxpk= 0, iat=1399, -1, r1= 1.30, r2= 1.80, r3= 6.38, r4= 6.88,
igr2=1472,1473,1474,
&end
#
# 100 ASN HD21 106 THR QG2 5.31
&rst
ixpk= 0, nxpk= 0, iat=1399, -1, r1= 1.30, r2= 1.80, r3= 6.38, r4= 6.88,
igr2=1472,1473,1474,
&end
#
# 100 ASN HD21 106 THR QG2 5.31
&rst
ixpk= 0, nxpk= 0, iat=1399, -1, r1= 1.30, r2= 1.80, r3= 6.38, r4= 6.88,
igr2=1472,1473,1474,
&end
#
# 100 ASN HD22 101 ASN HN 5.78
&rst
ixpk= 0, nxpk= 0, iat=1400,1404, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28, &end
#
# 100 ASN HD22 101 ASN HN 5.78
&rst
ixpk= 0, nxpk= 0, iat=1400,1404, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28, &end
#
# 100 ASN HD22 101 ASN HN 5.78
&rst
ixpk= 0, nxpk= 0, iat=1400,1404, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28, &end
#
# 100 ASN HD22 101 ASN HD21 4.21
&rst
ixpk= 0, nxpk= 0, iat=1400,1413, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71, &end
#
# 100 ASN HD22 101 ASN HD21 4.21
&rst
ixpk= 0, nxpk= 0, iat=1400,1413, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71, &end
#
# 100 ASN HD22 101 ASN HD21 4.21
&rst
ixpk= 0, nxpk= 0, iat=1400,1413, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71, &end
#
# 100 ASN HD22 102 ASP HN 5.28
&rst
ixpk= 0, nxpk= 0, iat=1400,1418, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 100 ASN HD22 102 ASP HN 5.28
&rst
ixpk= 0, nxpk= 0, iat=1400,1418, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 100 ASN HD22 102 ASP HN 5.28
&rst
ixpk= 0, nxpk= 0, iat=1400,1418, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 100 ASN HD22 102 ASP HA 3.83
&rst
ixpk= 0, nxpk= 0, iat=1400,1420, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33, &end
#
# 100 ASN HD22 102 ASP HA 3.83
&rst
ixpk= 0, nxpk= 0, iat=1400,1420, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33, &end
#
# 100 ASN HD22 102 ASP HA 3.83
&rst
ixpk= 0, nxpk= 0, iat=1400,1420, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33, &end
#
# 100 ASN HD22 102 ASP HB3 4.63
&rst
ixpk= 0, nxpk= 0, iat=1400,1423, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, &end
#
# 100 ASN HD22 102 ASP HB3 4.63
&rst
ixpk= 0, nxpk= 0, iat=1400,1423, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, &end
#
# 100 ASN HD22 102 ASP HB3 4.63
&rst
ixpk= 0, nxpk= 0, iat=1400,1423, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, &end
#
# 100 ASN HD22 103 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1400,1430, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 100 ASN HD22 103 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1400,1430, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 100 ASN HD22 103 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1400,1430, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 100 ASN HD22 104 ILE HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1400,1437, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 100 ASN HD22 104 ILE HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1400,1437, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 100 ASN HD22 104 ILE HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1400,1437, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 100 ASN HD22 104 ILE HB 4.47
&rst
ixpk= 0, nxpk= 0, iat=1400,1441, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97, &end
#
# 100 ASN HD22 104 ILE HB 4.47
&rst
ixpk= 0, nxpk= 0, iat=1400,1441, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97, &end
#
# 100 ASN HD22 104 ILE HB 4.47
&rst
ixpk= 0, nxpk= 0, iat=1400,1441, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97, &end
#
# 100 ASN HD22 104 ILE HG12 6.05
&rst
ixpk= 0, nxpk= 0, iat=1400,1447, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 100 ASN HD22 104 ILE HG12 6.05
&rst
ixpk= 0, nxpk= 0, iat=1400,1447, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 100 ASN HD22 104 ILE HG12 6.05
&rst
ixpk= 0, nxpk= 0, iat=1400,1447, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 100 ASN HD22 104 ILE QD1 5.22
&rst
ixpk= 0, nxpk= 0, iat=1400, -1, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
igr2=1450,1451,1452,
&end
#
# 100 ASN HD22 104 ILE QD1 5.22
&rst
ixpk= 0, nxpk= 0, iat=1400, -1, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
igr2=1450,1451,1452,
&end
#
# 100 ASN HD22 104 ILE QD1 5.22
&rst
ixpk= 0, nxpk= 0, iat=1400, -1, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
igr2=1450,1451,1452,
&end
#
# 100 ASN HD22 104 ILE QG2 4.87
&rst
ixpk= 0, nxpk= 0, iat=1400, -1, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
igr2=1443,1444,1445,
&end
#
# 100 ASN HD22 104 ILE QG2 4.87
&rst
ixpk= 0, nxpk= 0, iat=1400, -1, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
igr2=1443,1444,1445,
&end
#
# 100 ASN HD22 104 ILE QG2 4.87
&rst
ixpk= 0, nxpk= 0, iat=1400, -1, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
igr2=1443,1444,1445,
&end
#
# 100 ASN HD22 106 THR QG2 5.60
&rst
ixpk= 0, nxpk= 0, iat=1400, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=1472,1473,1474,
&end
#
# 100 ASN HD22 106 THR QG2 5.60
&rst
ixpk= 0, nxpk= 0, iat=1400, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=1472,1473,1474,
&end
#
# 100 ASN HD22 106 THR QG2 5.60
&rst
ixpk= 0, nxpk= 0, iat=1400, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=1472,1473,1474,
&end
#
# 101 ASN HN 101 ASN HA 3.89
&rst
ixpk= 0, nxpk= 0, iat=1404,1406, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39, &end
#
# 101 ASN HN 101 ASN HB2 3.90
&rst
ixpk= 0, nxpk= 0, iat=1404,1408, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40, &end
#
# 101 ASN HN 101 ASN HB2 3.90
&rst
ixpk= 0, nxpk= 0, iat=1404,1408, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40, &end
#
# 101 ASN HN 101 ASN HB2 3.90
&rst
ixpk= 0, nxpk= 0, iat=1404,1408, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40, &end
#
# 101 ASN HN 101 ASN HB3 3.76
&rst
ixpk= 0, nxpk= 0, iat=1404,1409, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26, &end
#
# 101 ASN HN 101 ASN HB3 3.76
&rst
ixpk= 0, nxpk= 0, iat=1404,1409, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26, &end
#
# 101 ASN HN 101 ASN HB3 3.76
&rst
ixpk= 0, nxpk= 0, iat=1404,1409, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26, &end
#
# 101 ASN HN 101 ASN HD21 5.71
&rst
ixpk= 0, nxpk= 0, iat=1404,1413, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21, &end
#
# 101 ASN HN 101 ASN HD21 5.71
&rst
ixpk= 0, nxpk= 0, iat=1404,1413, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21, &end
#
# 101 ASN HN 101 ASN HD21 5.71
&rst
ixpk= 0, nxpk= 0, iat=1404,1413, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21, &end
#
# 101 ASN HN 101 ASN HD22 6.05
&rst
ixpk= 0, nxpk= 0, iat=1404,1414, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 101 ASN HN 101 ASN HD22 6.05
&rst
ixpk= 0, nxpk= 0, iat=1404,1414, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 101 ASN HN 101 ASN HD22 6.05
&rst
ixpk= 0, nxpk= 0, iat=1404,1414, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 101 ASN HN 102 ASP HN 4.42
&rst
ixpk= 0, nxpk= 0, iat=1404,1418, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92, &end
#
# 101 ASN HN 102 ASP HN 4.42
&rst
ixpk= 0, nxpk= 0, iat=1404,1418, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92, &end
#
# 101 ASN HN 102 ASP HN 4.42
&rst
ixpk= 0, nxpk= 0, iat=1404,1418, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92, &end
#
# 101 ASN HN 103 GLY HN 6.00
&rst
ixpk= 0, nxpk= 0, iat=1404,1430, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 101 ASN HN 103 GLY HN 6.00
&rst
ixpk= 0, nxpk= 0, iat=1404,1430, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 101 ASN HN 103 GLY HN 6.00
&rst
ixpk= 0, nxpk= 0, iat=1404,1430, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 101 ASN HN 104 ILE HN 5.79
&rst
ixpk= 0, nxpk= 0, iat=1404,1437, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29, &end
#
# 101 ASN HN 104 ILE HN 5.79
&rst
ixpk= 0, nxpk= 0, iat=1404,1437, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29, &end
#
# 101 ASN HN 104 ILE HN 5.79
&rst
ixpk= 0, nxpk= 0, iat=1404,1437, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29, &end
#
# 101 ASN HN 106 THR QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1404, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1472,1473,1474,
&end
#
# 101 ASN HN 106 THR QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1404, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1472,1473,1474,
&end
#
# 101 ASN HN 106 THR QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1404, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1472,1473,1474,
&end
#
# 101 ASN HA 101 ASN HB2 4.10
&rst
ixpk= 0, nxpk= 0, iat=1406,1408, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60, &end
#
# 101 ASN HA 101 ASN HB3 3.74
&rst
ixpk= 0, nxpk= 0, iat=1406,1409, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24, &end
#
# 101 ASN HA 101 ASN HD21 5.25
&rst
ixpk= 0, nxpk= 0, iat=1406,1413, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75, &end
#
# 101 ASN HA 101 ASN HD21 5.25
&rst
ixpk= 0, nxpk= 0, iat=1406,1413, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75, &end
#
# 101 ASN HA 101 ASN HD21 5.25
&rst
ixpk= 0, nxpk= 0, iat=1406,1413, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75, &end
#
# 101 ASN HA 102 ASP HN 4.58
&rst
ixpk= 0, nxpk= 0, iat=1406,1418, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08, &end
#
# 101 ASN HA 102 ASP HB2 6.00
&rst
ixpk= 0, nxpk= 0, iat=1406,1422, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 101 ASN HA 102 ASP HB2 6.00
&rst
ixpk= 0, nxpk= 0, iat=1406,1422, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 101 ASN HA 102 ASP HB2 6.00
&rst
ixpk= 0, nxpk= 0, iat=1406,1422, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 101 ASN HA 103 GLY HN 5.37
&rst
ixpk= 0, nxpk= 0, iat=1406,1430, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87, &end
#
# 101 ASN HA 103 GLY HN 5.37
&rst
ixpk= 0, nxpk= 0, iat=1406,1430, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87, &end
#
# 101 ASN HA 103 GLY HN 5.37
&rst
ixpk= 0, nxpk= 0, iat=1406,1430, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87, &end
#
# 101 ASN HB2 101 ASN HD21 4.37
&rst
ixpk= 0, nxpk= 0, iat=1408,1413, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87, &end
#
# 101 ASN HB2 101 ASN HD21 4.37
&rst
ixpk= 0, nxpk= 0, iat=1408,1413, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87, &end
#
# 101 ASN HB2 101 ASN HD21 4.37
&rst
ixpk= 0, nxpk= 0, iat=1408,1413, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87, &end
#
# 101 ASN HB2 102 ASP HN 5.29
&rst
ixpk= 0, nxpk= 0, iat=1408,1418, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79, &end
#
# 101 ASN HB2 102 ASP HN 5.29
&rst
ixpk= 0, nxpk= 0, iat=1408,1418, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79, &end
#
# 101 ASN HB2 102 ASP HN 5.29
&rst
ixpk= 0, nxpk= 0, iat=1408,1418, r1= 1.30, r2= 1.80, r3= 5.29, r4= 5.79, &end
#
# 101 ASN HB3 101 ASN HB2 2.83
&rst
ixpk= 0, nxpk= 0, iat=1409,1408, r1= 1.30, r2= 1.80, r3= 2.83, r4= 3.33, &end
#
# 101 ASN HB3 101 ASN HD21 4.22
&rst
ixpk= 0, nxpk= 0, iat=1409,1413, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 101 ASN HB3 101 ASN HD21 4.22
&rst
ixpk= 0, nxpk= 0, iat=1409,1413, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 101 ASN HB3 101 ASN HD21 4.22
&rst
ixpk= 0, nxpk= 0, iat=1409,1413, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 101 ASN HB3 101 ASN HD22 4.66
&rst
ixpk= 0, nxpk= 0, iat=1409,1414, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16, &end
#
# 101 ASN HB3 102 ASP HN 5.46
&rst
ixpk= 0, nxpk= 0, iat=1409,1418, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96, &end
#
# 101 ASN HB3 102 ASP HN 5.46
&rst
ixpk= 0, nxpk= 0, iat=1409,1418, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96, &end
#
# 101 ASN HB3 102 ASP HN 5.46
&rst
ixpk= 0, nxpk= 0, iat=1409,1418, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96, &end
#
# 101 ASN HD21 101 ASN HD22 2.67
&rst
ixpk= 0, nxpk= 0, iat=1413,1414, r1= 1.30, r2= 1.80, r3= 2.67, r4= 3.17, &end
#
# 101 ASN HD21 102 ASP HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1413,1418, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 101 ASN HD21 102 ASP HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1413,1418, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 101 ASN HD21 102 ASP HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1413,1418, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 101 ASN HD21 103 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1413,1430, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 101 ASN HD21 103 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1413,1430, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 101 ASN HD21 103 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1413,1430, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 101 ASN HD22 102 ASP HB3 5.22
&rst
ixpk= 0, nxpk= 0, iat=1414,1423, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72, &end
#
# 101 ASN HD22 102 ASP HB3 5.22
&rst
ixpk= 0, nxpk= 0, iat=1414,1423, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72, &end
#
# 101 ASN HD22 102 ASP HB3 5.22
&rst
ixpk= 0, nxpk= 0, iat=1414,1423, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72, &end
#
# 102 ASP HN 102 ASP HA 4.21
&rst
ixpk= 0, nxpk= 0, iat=1418,1420, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71, &end
#
# 102 ASP HN 102 ASP HB2 3.86
&rst
ixpk= 0, nxpk= 0, iat=1418,1422, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 102 ASP HN 102 ASP HB2 3.86
&rst
ixpk= 0, nxpk= 0, iat=1418,1422, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 102 ASP HN 102 ASP HB2 3.86
&rst
ixpk= 0, nxpk= 0, iat=1418,1422, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 102 ASP HN 102 ASP HB3 3.82
&rst
ixpk= 0, nxpk= 0, iat=1418,1423, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32, &end
#
# 102 ASP HN 102 ASP HB3 3.82
&rst
ixpk= 0, nxpk= 0, iat=1418,1423, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32, &end
#
# 102 ASP HN 102 ASP HB3 3.82
&rst
ixpk= 0, nxpk= 0, iat=1418,1423, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32, &end
#
# 102 ASP HN 103 GLY HN 3.28
&rst
ixpk= 0, nxpk= 0, iat=1418,1430, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78, &end
#
# 102 ASP HN 103 GLY HN 3.28
&rst
ixpk= 0, nxpk= 0, iat=1418,1430, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78, &end
#
# 102 ASP HN 103 GLY HN 3.28
&rst
ixpk= 0, nxpk= 0, iat=1418,1430, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78, &end
#
# 102 ASP HN 103 GLY HA3 5.50
&rst
ixpk= 0, nxpk= 0, iat=1418,1433, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 102 ASP HN 103 GLY HA3 5.50
&rst
ixpk= 0, nxpk= 0, iat=1418,1433, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 102 ASP HN 103 GLY HA3 5.50
&rst
ixpk= 0, nxpk= 0, iat=1418,1433, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 102 ASP HN 104 ILE HN 4.38
&rst
ixpk= 0, nxpk= 0, iat=1418,1437, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88, &end
#
# 102 ASP HN 104 ILE HN 4.38
&rst
ixpk= 0, nxpk= 0, iat=1418,1437, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88, &end
#
# 102 ASP HN 104 ILE HN 4.38
&rst
ixpk= 0, nxpk= 0, iat=1418,1437, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88, &end
#
# 102 ASP HN 104 ILE HB 6.05
&rst
ixpk= 0, nxpk= 0, iat=1418,1441, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 102 ASP HN 104 ILE HB 6.05
&rst
ixpk= 0, nxpk= 0, iat=1418,1441, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 102 ASP HN 104 ILE HB 6.05
&rst
ixpk= 0, nxpk= 0, iat=1418,1441, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 102 ASP HN 104 ILE HG12 5.93
&rst
ixpk= 0, nxpk= 0, iat=1418,1447, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43, &end
#
# 102 ASP HN 104 ILE HG12 5.93
&rst
ixpk= 0, nxpk= 0, iat=1418,1447, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43, &end
#
# 102 ASP HN 104 ILE HG12 5.93
&rst
ixpk= 0, nxpk= 0, iat=1418,1447, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43, &end
#
# 102 ASP HN 104 ILE QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat=1418, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1450,1451,1452,
&end
#
# 102 ASP HN 104 ILE QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat=1418, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1450,1451,1452,
&end
#
# 102 ASP HN 104 ILE QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat=1418, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1450,1451,1452,
&end
#
# 102 ASP HA 102 ASP HB2 3.87
&rst
ixpk= 0, nxpk= 0, iat=1420,1422, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37, &end
#
# 102 ASP HA 102 ASP HB3 4.10
&rst
ixpk= 0, nxpk= 0, iat=1420,1423, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60, &end
#
# 102 ASP HA 103 GLY HN 5.49
&rst
ixpk= 0, nxpk= 0, iat=1420,1430, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99, &end
#
# 102 ASP HB2 103 GLY HN 5.22
&rst
ixpk= 0, nxpk= 0, iat=1422,1430, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72, &end
#
# 102 ASP HB2 103 GLY HN 5.22
&rst
ixpk= 0, nxpk= 0, iat=1422,1430, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72, &end
#
# 102 ASP HB2 103 GLY HN 5.22
&rst
ixpk= 0, nxpk= 0, iat=1422,1430, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72, &end
#
# 102 ASP HB2 104 ILE HN 5.35
&rst
ixpk= 0, nxpk= 0, iat=1422,1437, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85, &end
#
# 102 ASP HB2 104 ILE HN 5.35
&rst
ixpk= 0, nxpk= 0, iat=1422,1437, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85, &end
#
# 102 ASP HB2 104 ILE HN 5.35
&rst
ixpk= 0, nxpk= 0, iat=1422,1437, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85, &end
#
# 102 ASP HB2 104 ILE HG12 6.01
&rst
ixpk= 0, nxpk= 0, iat=1422,1447, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51, &end
#
# 102 ASP HB2 104 ILE HG12 6.01
&rst
ixpk= 0, nxpk= 0, iat=1422,1447, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51, &end
#
# 102 ASP HB2 104 ILE HG12 6.01
&rst
ixpk= 0, nxpk= 0, iat=1422,1447, r1= 1.30, r2= 1.80, r3= 6.01, r4= 6.51, &end
#
# 102 ASP HB2 104 ILE QD1 4.65
&rst
ixpk= 0, nxpk= 0, iat=1422, -1, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr2=1450,1451,1452,
&end
#
# 102 ASP HB2 104 ILE QD1 4.65
&rst
ixpk= 0, nxpk= 0, iat=1422, -1, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr2=1450,1451,1452,
&end
#
# 102 ASP HB2 104 ILE QD1 4.65
&rst
ixpk= 0, nxpk= 0, iat=1422, -1, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr2=1450,1451,1452,
&end
#
# 102 ASP HB3 103 GLY HN 5.21
&rst
ixpk= 0, nxpk= 0, iat=1423,1430, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71, &end
#
# 102 ASP HB3 103 GLY HN 5.21
&rst
ixpk= 0, nxpk= 0, iat=1423,1430, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71, &end
#
# 102 ASP HB3 103 GLY HN 5.21
&rst
ixpk= 0, nxpk= 0, iat=1423,1430, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71, &end
#
# 102 ASP HB3 104 ILE HN 5.07
&rst
ixpk= 0, nxpk= 0, iat=1423,1437, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, &end
#
# 102 ASP HB3 104 ILE HN 5.07
&rst
ixpk= 0, nxpk= 0, iat=1423,1437, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, &end
#
# 102 ASP HB3 104 ILE HN 5.07
&rst
ixpk= 0, nxpk= 0, iat=1423,1437, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, &end
#
# 102 ASP HB3 104 ILE HB 5.91
&rst
ixpk= 0, nxpk= 0, iat=1423,1441, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41, &end
#
# 102 ASP HB3 104 ILE HB 5.91
&rst
ixpk= 0, nxpk= 0, iat=1423,1441, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41, &end
#
# 102 ASP HB3 104 ILE HB 5.91
&rst
ixpk= 0, nxpk= 0, iat=1423,1441, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41, &end
#
# 102 ASP HB3 104 ILE QD1 4.41
&rst
ixpk= 0, nxpk= 0, iat=1423, -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr2=1450,1451,1452,
&end
#
# 102 ASP HB3 104 ILE QD1 4.41
&rst
ixpk= 0, nxpk= 0, iat=1423, -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr2=1450,1451,1452,
&end
#
# 102 ASP HB3 104 ILE QD1 4.41
&rst
ixpk= 0, nxpk= 0, iat=1423, -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr2=1450,1451,1452,
&end
#
# 103 GLY HN 103 GLY HA2 3.90
&rst
ixpk= 0, nxpk= 0, iat=1430,1432, r1= 1.30, r2= 1.80, r3= 3.90, r4= 4.40, &end
#
# 103 GLY HN 103 GLY HA3 3.75
&rst
ixpk= 0, nxpk= 0, iat=1430,1433, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25, &end
#
# 103 GLY HN 104 ILE HN 3.62
&rst
ixpk= 0, nxpk= 0, iat=1430,1437, r1= 1.30, r2= 1.80, r3= 3.62, r4= 4.12, &end
#
# 103 GLY HN 104 ILE HN 3.62
&rst
ixpk= 0, nxpk= 0, iat=1430,1437, r1= 1.30, r2= 1.80, r3= 3.62, r4= 4.12, &end
#
# 103 GLY HN 104 ILE HN 3.62
&rst
ixpk= 0, nxpk= 0, iat=1430,1437, r1= 1.30, r2= 1.80, r3= 3.62, r4= 4.12, &end
#
# 103 GLY HN 104 ILE HN 5.28
&rst
ixpk= 0, nxpk= 0, iat=1430,1437, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 103 GLY HN 104 ILE HA 5.63
&rst
ixpk= 0, nxpk= 0, iat=1430,1439, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13, &end
#
# 103 GLY HN 104 ILE HA 5.63
&rst
ixpk= 0, nxpk= 0, iat=1430,1439, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13, &end
#
# 103 GLY HN 104 ILE HA 5.63
&rst
ixpk= 0, nxpk= 0, iat=1430,1439, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13, &end
#
# 103 GLY HN 104 ILE HB 6.05
&rst
ixpk= 0, nxpk= 0, iat=1430,1441, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 103 GLY HN 104 ILE HB 6.05
&rst
ixpk= 0, nxpk= 0, iat=1430,1441, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 103 GLY HN 104 ILE HB 6.05
&rst
ixpk= 0, nxpk= 0, iat=1430,1441, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 103 GLY HN 104 ILE HG12 6.05
&rst
ixpk= 0, nxpk= 0, iat=1430,1447, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 103 GLY HN 104 ILE HG12 6.05
&rst
ixpk= 0, nxpk= 0, iat=1430,1447, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 103 GLY HN 104 ILE HG12 6.05
&rst
ixpk= 0, nxpk= 0, iat=1430,1447, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 103 GLY HN 104 ILE QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat=1430, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1450,1451,1452,
&end
#
# 103 GLY HN 104 ILE QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat=1430, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1450,1451,1452,
&end
#
# 103 GLY HN 104 ILE QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat=1430, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1450,1451,1452,
&end
#
# 103 GLY HA2 104 ILE HN 2.97
&rst
ixpk= 0, nxpk= 0, iat=1432,1437, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 103 GLY HA2 104 ILE HN 4.55
&rst
ixpk= 0, nxpk= 0, iat=1432,1437, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05, &end
#
# 103 GLY HA2 104 ILE HB 6.05
&rst
ixpk= 0, nxpk= 0, iat=1432,1441, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 103 GLY HA2 104 ILE HB 6.05
&rst
ixpk= 0, nxpk= 0, iat=1432,1441, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 103 GLY HA2 104 ILE HB 6.05
&rst
ixpk= 0, nxpk= 0, iat=1432,1441, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 103 GLY HA3 103 GLY HA2 3.43
&rst
ixpk= 0, nxpk= 0, iat=1433,1432, r1= 1.30, r2= 1.80, r3= 3.43, r4= 3.93, &end
#
# 103 GLY HA3 104 ILE HN 4.61
&rst
ixpk= 0, nxpk= 0, iat=1433,1437, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 104 ILE HN 104 ILE HA 4.66
&rst
ixpk= 0, nxpk= 0, iat=1437,1439, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16, &end
#
# 104 ILE HN 104 ILE HB 3.65
&rst
ixpk= 0, nxpk= 0, iat=1437,1441, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15, &end
#
# 104 ILE HN 104 ILE HB 3.65
&rst
ixpk= 0, nxpk= 0, iat=1437,1441, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15, &end
#
# 104 ILE HN 104 ILE HB 3.65
&rst
ixpk= 0, nxpk= 0, iat=1437,1441, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15, &end
#
# 104 ILE HN 104 ILE HG12 4.48
&rst
ixpk= 0, nxpk= 0, iat=1437,1447, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98, &end
#
# 104 ILE HN 104 ILE HG12 4.48
&rst
ixpk= 0, nxpk= 0, iat=1437,1447, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98, &end
#
# 104 ILE HN 104 ILE HG12 4.48
&rst
ixpk= 0, nxpk= 0, iat=1437,1447, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98, &end
#
# 104 ILE HN 104 ILE HG13 4.70
&rst
ixpk= 0, nxpk= 0, iat=1437,1448, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 104 ILE HN 104 ILE HG13 4.70
&rst
ixpk= 0, nxpk= 0, iat=1437,1448, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 104 ILE HN 104 ILE HG13 4.70
&rst
ixpk= 0, nxpk= 0, iat=1437,1448, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20, &end
#
# 104 ILE HN 104 ILE QD1 4.58
&rst
ixpk= 0, nxpk= 0, iat=1437, -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
igr2=1450,1451,1452,
&end
#
# 104 ILE HN 104 ILE QD1 4.58
&rst
ixpk= 0, nxpk= 0, iat=1437, -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
igr2=1450,1451,1452,
&end
#
# 104 ILE HN 104 ILE QD1 4.58
&rst
ixpk= 0, nxpk= 0, iat=1437, -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
igr2=1450,1451,1452,
&end
#
# 104 ILE HN 104 ILE QG2 4.94
&rst
ixpk= 0, nxpk= 0, iat=1437, -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr2=1443,1444,1445,
&end
#
# 104 ILE HN 104 ILE QG2 4.94
&rst
ixpk= 0, nxpk= 0, iat=1437, -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr2=1443,1444,1445,
&end
#
# 104 ILE HN 104 ILE QG2 4.94
&rst
ixpk= 0, nxpk= 0, iat=1437, -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr2=1443,1444,1445,
&end
#
# 104 ILE HN 105 ALA HN 5.28
&rst
ixpk= 0, nxpk= 0, iat=1437,1456, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 104 ILE HN 105 ALA HN 5.37
&rst
ixpk= 0, nxpk= 0, iat=1437,1456, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87, &end
#
# 104 ILE HN 105 ALA HN 5.37
&rst
ixpk= 0, nxpk= 0, iat=1437,1456, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87, &end
#
# 104 ILE HN 105 ALA HN 5.37
&rst
ixpk= 0, nxpk= 0, iat=1437,1456, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87, &end
#
# 104 ILE HA 104 ILE HB 4.80
&rst
ixpk= 0, nxpk= 0, iat=1439,1441, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30, &end
#
# 104 ILE HA 104 ILE HG12 4.81
&rst
ixpk= 0, nxpk= 0, iat=1439,1447, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31, &end
#
# 104 ILE HA 104 ILE HG13 4.32
&rst
ixpk= 0, nxpk= 0, iat=1439,1448, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82, &end
#
# 104 ILE HA 104 ILE HG13 4.32
&rst
ixpk= 0, nxpk= 0, iat=1439,1448, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82, &end
#
# 104 ILE HA 104 ILE HG13 4.32
&rst
ixpk= 0, nxpk= 0, iat=1439,1448, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82, &end
#
# 104 ILE HA 104 ILE QD1 4.36
&rst
ixpk= 0, nxpk= 0, iat=1439, -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr2=1450,1451,1452,
&end
#
# 104 ILE HA 104 ILE QD1 4.36
&rst
ixpk= 0, nxpk= 0, iat=1439, -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr2=1450,1451,1452,
&end
#
# 104 ILE HA 104 ILE QD1 4.36
&rst
ixpk= 0, nxpk= 0, iat=1439, -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr2=1450,1451,1452,
&end
#
# 104 ILE HA 104 ILE QG2 3.81
&rst
ixpk= 0, nxpk= 0, iat=1439, -1, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
igr2=1443,1444,1445,
&end
#
# 104 ILE HA 104 ILE QG2 3.81
&rst
ixpk= 0, nxpk= 0, iat=1439, -1, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
igr2=1443,1444,1445,
&end
#
# 104 ILE HA 104 ILE QG2 3.81
&rst
ixpk= 0, nxpk= 0, iat=1439, -1, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
igr2=1443,1444,1445,
&end
#
# 104 ILE HA 105 ALA HN 2.97
&rst
ixpk= 0, nxpk= 0, iat=1439,1456, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 104 ILE HA 105 ALA HN 3.50
&rst
ixpk= 0, nxpk= 0, iat=1439,1456, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 104 ILE HA 105 ALA HN 3.50
&rst
ixpk= 0, nxpk= 0, iat=1439,1456, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 104 ILE HA 105 ALA HN 3.50
&rst
ixpk= 0, nxpk= 0, iat=1439,1456, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 104 ILE HA 105 ALA QB 4.41
&rst
ixpk= 0, nxpk= 0, iat=1439, -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr2=1460,1461,1462,
&end
#
# 104 ILE HA 105 ALA QB 4.41
&rst
ixpk= 0, nxpk= 0, iat=1439, -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr2=1460,1461,1462,
&end
#
# 104 ILE HA 105 ALA QB 4.41
&rst
ixpk= 0, nxpk= 0, iat=1439, -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr2=1460,1461,1462,
&end
#
# 104 ILE HB 104 ILE HG12 5.06
&rst
ixpk= 0, nxpk= 0, iat=1441,1447, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56, &end
#
# 104 ILE HB 104 ILE HG13 4.78
&rst
ixpk= 0, nxpk= 0, iat=1441,1448, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, &end
#
# 104 ILE HB 104 ILE QD1 3.98
&rst
ixpk= 0, nxpk= 0, iat=1441, -1, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
igr2=1450,1451,1452,
&end
#
# 104 ILE HB 104 ILE QD1 3.98
&rst
ixpk= 0, nxpk= 0, iat=1441, -1, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
igr2=1450,1451,1452,
&end
#
# 104 ILE HB 104 ILE QD1 3.98
&rst
ixpk= 0, nxpk= 0, iat=1441, -1, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
igr2=1450,1451,1452,
&end
#
# 104 ILE HB 105 ALA HN 5.13
&rst
ixpk= 0, nxpk= 0, iat=1441,1456, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63, &end
#
# 104 ILE HB 105 ALA HN 5.13
&rst
ixpk= 0, nxpk= 0, iat=1441,1456, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63, &end
#
# 104 ILE HB 105 ALA HN 5.13
&rst
ixpk= 0, nxpk= 0, iat=1441,1456, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63, &end
#
# 104 ILE HB 105 ALA HN 5.72
&rst
ixpk= 0, nxpk= 0, iat=1441,1456, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 104 ILE HG12 104 ILE QD1 3.96
&rst
ixpk= 0, nxpk= 0, iat=1447, -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
igr2=1450,1451,1452,
&end
#
# 104 ILE HG12 105 ALA HN 5.79
&rst
ixpk= 0, nxpk= 0, iat=1447,1456, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29, &end
#
# 104 ILE HG12 105 ALA HN 5.79
&rst
ixpk= 0, nxpk= 0, iat=1447,1456, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29, &end
#
# 104 ILE HG12 105 ALA HN 5.79
&rst
ixpk= 0, nxpk= 0, iat=1447,1456, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29, &end
#
# 104 ILE HG13 104 ILE HG12 3.09
&rst
ixpk= 0, nxpk= 0, iat=1448,1447, r1= 1.30, r2= 1.80, r3= 3.09, r4= 3.59, &end
#
# 104 ILE HG13 104 ILE QD1 3.22
&rst
ixpk= 0, nxpk= 0, iat=1448, -1, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37,
igr2=1450,1451,1452,
&end
#
# 104 ILE QG2 104 ILE HG12 4.19
&rst
ixpk= 0, nxpk= 0, iat= -1,1447, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
igr1=1443,1444,1445,
&end
#
# 104 ILE QG2 104 ILE HG12 4.19
&rst
ixpk= 0, nxpk= 0, iat= -1,1447, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
igr1=1443,1444,1445,
&end
#
# 104 ILE QG2 104 ILE HG12 4.19
&rst
ixpk= 0, nxpk= 0, iat= -1,1447, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
igr1=1443,1444,1445,
&end
#
# 104 ILE QG2 104 ILE HG13 3.27
&rst
ixpk= 0, nxpk= 0, iat= -1,1448, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
igr1=1443,1444,1445,
&end
#
# 104 ILE QG2 104 ILE HG13 3.27
&rst
ixpk= 0, nxpk= 0, iat= -1,1448, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
igr1=1443,1444,1445,
&end
#
# 104 ILE QG2 104 ILE HG13 3.27
&rst
ixpk= 0, nxpk= 0, iat= -1,1448, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
igr1=1443,1444,1445,
&end
#
# 104 ILE QG2 105 ALA HN 3.88
&rst
ixpk= 0, nxpk= 0, iat= -1,1456, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
igr1=1443,1444,1445,
&end
#
# 104 ILE QG2 105 ALA HN 3.88
&rst
ixpk= 0, nxpk= 0, iat= -1,1456, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
igr1=1443,1444,1445,
&end
#
# 104 ILE QG2 105 ALA HN 3.88
&rst
ixpk= 0, nxpk= 0, iat= -1,1456, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
igr1=1443,1444,1445,
&end
#
# 104 ILE QG2 106 THR HN 5.82
&rst
ixpk= 0, nxpk= 0, iat= -1,1466, r1= 1.30, r2= 1.80, r3= 6.99, r4= 7.49,
igr1=1443,1444,1445,
&end
#
# 104 ILE QG2 106 THR HN 5.82
&rst
ixpk= 0, nxpk= 0, iat= -1,1466, r1= 1.30, r2= 1.80, r3= 6.99, r4= 7.49,
igr1=1443,1444,1445,
&end
#
# 104 ILE QG2 106 THR HN 5.82
&rst
ixpk= 0, nxpk= 0, iat= -1,1466, r1= 1.30, r2= 1.80, r3= 6.99, r4= 7.49,
igr1=1443,1444,1445,
&end
#
# 104 ILE QG2 106 THR HB 5.72
&rst
ixpk= 0, nxpk= 0, iat= -1,1470, r1= 1.30, r2= 1.80, r3= 6.87, r4= 7.37,
igr1=1443,1444,1445,
&end
#
# 104 ILE QG2 106 THR HB 5.72
&rst
ixpk= 0, nxpk= 0, iat= -1,1470, r1= 1.30, r2= 1.80, r3= 6.87, r4= 7.37,
igr1=1443,1444,1445,
&end
#
# 104 ILE QG2 106 THR HB 5.72
&rst
ixpk= 0, nxpk= 0, iat= -1,1470, r1= 1.30, r2= 1.80, r3= 6.87, r4= 7.37,
igr1=1443,1444,1445,
&end
#
# 105 ALA HN 105 ALA HA 4.36
&rst
ixpk= 0, nxpk= 0, iat=1456,1458, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86, &end
#
# 105 ALA HN 105 ALA QB 3.98
&rst
ixpk= 0, nxpk= 0, iat=1456, -1, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
igr2=1460,1461,1462,
&end
#
# 105 ALA HN 105 ALA QB 3.98
&rst
ixpk= 0, nxpk= 0, iat=1456, -1, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
igr2=1460,1461,1462,
&end
#
# 105 ALA HN 105 ALA QB 3.98
&rst
ixpk= 0, nxpk= 0, iat=1456, -1, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28,
igr2=1460,1461,1462,
&end
#
# 105 ALA HN 106 THR HN 5.28
&rst
ixpk= 0, nxpk= 0, iat=1456,1466, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 105 ALA HN 106 THR HN 5.52
&rst
ixpk= 0, nxpk= 0, iat=1456,1466, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02, &end
#
# 105 ALA HN 106 THR HN 5.52
&rst
ixpk= 0, nxpk= 0, iat=1456,1466, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02, &end
#
# 105 ALA HN 106 THR HN 5.52
&rst
ixpk= 0, nxpk= 0, iat=1456,1466, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02, &end
#
# 105 ALA HA 106 THR HN 2.97
&rst
ixpk= 0, nxpk= 0, iat=1458,1466, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 105 ALA HA 106 THR HN 3.29
&rst
ixpk= 0, nxpk= 0, iat=1458,1466, r1= 1.30, r2= 1.80, r3= 3.29, r4= 3.79, &end
#
# 105 ALA HA 106 THR HN 3.29
&rst
ixpk= 0, nxpk= 0, iat=1458,1466, r1= 1.30, r2= 1.80, r3= 3.29, r4= 3.79, &end
#
# 105 ALA HA 106 THR HN 3.29
&rst
ixpk= 0, nxpk= 0, iat=1458,1466, r1= 1.30, r2= 1.80, r3= 3.29, r4= 3.79, &end
#
# 105 ALA HA 107 GLU HN 4.35
&rst
ixpk= 0, nxpk= 0, iat=1458,1480, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85, &end
#
# 105 ALA HA 107 GLU HN 4.35
&rst
ixpk= 0, nxpk= 0, iat=1458,1480, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85, &end
#
# 105 ALA HA 107 GLU HN 4.35
&rst
ixpk= 0, nxpk= 0, iat=1458,1480, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85, &end
#
# 105 ALA QB 106 THR HN 5.72
&rst
ixpk= 0, nxpk= 0, iat= -1,1466, r1= 1.30, r2= 1.80, r3= 6.87, r4= 7.37,
igr1=1460,1461,1462,
&end
#
# 105 ALA QB 105 ALA HA 3.74
&rst
ixpk= 0, nxpk= 0, iat= -1,1458, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
igr1=1460,1461,1462,
&end
#
# 105 ALA QB 106 THR HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1468, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1460,1461,1462,
&end
#
# 105 ALA QB 106 THR HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1468, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1460,1461,1462,
&end
#
# 105 ALA QB 106 THR HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1468, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1460,1461,1462,
&end
#
# 105 ALA QB 107 GLU HN 4.93
&rst
ixpk= 0, nxpk= 0, iat= -1,1480, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
igr1=1460,1461,1462,
&end
#
# 105 ALA QB 107 GLU HN 4.93
&rst
ixpk= 0, nxpk= 0, iat= -1,1480, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
igr1=1460,1461,1462,
&end
#
# 105 ALA QB 107 GLU HN 4.93
&rst
ixpk= 0, nxpk= 0, iat= -1,1480, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42,
igr1=1460,1461,1462,
&end
#
# 106 THR HN 106 THR HA 4.78
&rst
ixpk= 0, nxpk= 0, iat=1466,1468, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, &end
#
# 106 THR HN 106 THR HB 5.36
&rst
ixpk= 0, nxpk= 0, iat=1466,1470, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86, &end
#
# 106 THR HN 106 THR QG2 4.31
&rst
ixpk= 0, nxpk= 0, iat=1466, -1, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
igr2=1472,1473,1474,
&end
#
# 106 THR HN 106 THR QG2 4.31
&rst
ixpk= 0, nxpk= 0, iat=1466, -1, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
igr2=1472,1473,1474,
&end
#
# 106 THR HN 106 THR QG2 4.31
&rst
ixpk= 0, nxpk= 0, iat=1466, -1, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
igr2=1472,1473,1474,
&end
#
# 106 THR HN 107 GLU HN 3.27
&rst
ixpk= 0, nxpk= 0, iat=1466,1480, r1= 1.30, r2= 1.80, r3= 3.27, r4= 3.77, &end
#
# 106 THR HN 107 GLU HN 3.27
&rst
ixpk= 0, nxpk= 0, iat=1466,1480, r1= 1.30, r2= 1.80, r3= 3.27, r4= 3.77, &end
#
# 106 THR HN 107 GLU HN 3.27
&rst
ixpk= 0, nxpk= 0, iat=1466,1480, r1= 1.30, r2= 1.80, r3= 3.27, r4= 3.77, &end
#
# 106 THR HN 107 GLU HN 5.28
&rst
ixpk= 0, nxpk= 0, iat=1466,1480, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 106 THR HN 107 GLU HB2 5.09
&rst
ixpk= 0, nxpk= 0, iat=1466,1484, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59, &end
#
# 106 THR HN 107 GLU HB2 5.09
&rst
ixpk= 0, nxpk= 0, iat=1466,1484, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59, &end
#
# 106 THR HN 107 GLU HB2 5.09
&rst
ixpk= 0, nxpk= 0, iat=1466,1484, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59, &end
#
# 106 THR HN 107 GLU HB3 5.69
&rst
ixpk= 0, nxpk= 0, iat=1466,1485, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19, &end
#
# 106 THR HN 107 GLU HB3 5.69
&rst
ixpk= 0, nxpk= 0, iat=1466,1485, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19, &end
#
# 106 THR HN 107 GLU HB3 5.69
&rst
ixpk= 0, nxpk= 0, iat=1466,1485, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19, &end
#
# 106 THR HN 107 GLU HG2 5.62
&rst
ixpk= 0, nxpk= 0, iat=1466,1487, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12, &end
#
# 106 THR HN 107 GLU HG2 5.62
&rst
ixpk= 0, nxpk= 0, iat=1466,1487, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12, &end
#
# 106 THR HN 107 GLU HG2 5.62
&rst
ixpk= 0, nxpk= 0, iat=1466,1487, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12, &end
#
# 106 THR HN 107 GLU HG3 5.46
&rst
ixpk= 0, nxpk= 0, iat=1466,1488, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96, &end
#
# 106 THR HN 107 GLU HG3 5.46
&rst
ixpk= 0, nxpk= 0, iat=1466,1488, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96, &end
#
# 106 THR HN 107 GLU HG3 5.46
&rst
ixpk= 0, nxpk= 0, iat=1466,1488, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96, &end
#
# 106 THR HA 106 THR HB 3.81
&rst
ixpk= 0, nxpk= 0, iat=1468,1470, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31, &end
#
# 106 THR HA 106 THR QG2 3.75
&rst
ixpk= 0, nxpk= 0, iat=1468, -1, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
igr2=1472,1473,1474,
&end
#
# 106 THR HA 106 THR QG2 3.75
&rst
ixpk= 0, nxpk= 0, iat=1468, -1, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
igr2=1472,1473,1474,
&end
#
# 106 THR HA 106 THR QG2 3.75
&rst
ixpk= 0, nxpk= 0, iat=1468, -1, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
igr2=1472,1473,1474,
&end
#
# 106 THR HA 107 GLU HN 2.97
&rst
ixpk= 0, nxpk= 0, iat=1468,1480, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 106 THR HA 107 GLU HN 4.46
&rst
ixpk= 0, nxpk= 0, iat=1468,1480, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, &end
#
# 106 THR HB 107 GLU HN 4.91
&rst
ixpk= 0, nxpk= 0, iat=1470,1480, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41, &end
#
# 106 THR HB 107 GLU HN 4.91
&rst
ixpk= 0, nxpk= 0, iat=1470,1480, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41, &end
#
# 106 THR HB 107 GLU HN 4.91
&rst
ixpk= 0, nxpk= 0, iat=1470,1480, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41, &end
#
# 106 THR HB 107 GLU HN 5.72
&rst
ixpk= 0, nxpk= 0, iat=1470,1480, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 106 THR HB 107 GLU HG3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1470,1488, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 106 THR HB 107 GLU HG3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1470,1488, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 106 THR HB 107 GLU HG3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1470,1488, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 106 THR QG2 106 THR HB 3.30
&rst
ixpk= 0, nxpk= 0, iat= -1,1470, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
igr1=1472,1473,1474,
&end
#
# 106 THR QG2 107 GLU HN 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1480, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr1=1472,1473,1474,
&end
#
# 106 THR QG2 107 GLU HN 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1480, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr1=1472,1473,1474,
&end
#
# 106 THR QG2 107 GLU HN 5.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1480, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr1=1472,1473,1474,
&end
#
# 106 THR QG2 107 GLU HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1482, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1472,1473,1474,
&end
#
# 106 THR QG2 107 GLU HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1482, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1472,1473,1474,
&end
#
# 106 THR QG2 107 GLU HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1482, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1472,1473,1474,
&end
#
# 107 GLU HN 107 GLU HA 3.76
&rst
ixpk= 0, nxpk= 0, iat=1480,1482, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26, &end
#
# 107 GLU HN 107 GLU HB2 3.52
&rst
ixpk= 0, nxpk= 0, iat=1480,1484, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02, &end
#
# 107 GLU HN 107 GLU HB2 3.52
&rst
ixpk= 0, nxpk= 0, iat=1480,1484, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02, &end
#
# 107 GLU HN 107 GLU HB2 3.52
&rst
ixpk= 0, nxpk= 0, iat=1480,1484, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02, &end
#
# 107 GLU HN 107 GLU HB3 3.95
&rst
ixpk= 0, nxpk= 0, iat=1480,1485, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45, &end
#
# 107 GLU HN 107 GLU HB3 3.95
&rst
ixpk= 0, nxpk= 0, iat=1480,1485, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45, &end
#
# 107 GLU HN 107 GLU HB3 3.95
&rst
ixpk= 0, nxpk= 0, iat=1480,1485, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45, &end
#
# 107 GLU HN 107 GLU HG2 4.62
&rst
ixpk= 0, nxpk= 0, iat=1480,1487, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12, &end
#
# 107 GLU HN 107 GLU HG2 4.62
&rst
ixpk= 0, nxpk= 0, iat=1480,1487, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12, &end
#
# 107 GLU HN 107 GLU HG2 4.62
&rst
ixpk= 0, nxpk= 0, iat=1480,1487, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12, &end
#
# 107 GLU HN 107 GLU HG3 4.33
&rst
ixpk= 0, nxpk= 0, iat=1480,1488, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83, &end
#
# 107 GLU HN 107 GLU HG3 4.33
&rst
ixpk= 0, nxpk= 0, iat=1480,1488, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83, &end
#
# 107 GLU HN 107 GLU HG3 4.33
&rst
ixpk= 0, nxpk= 0, iat=1480,1488, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83, &end
#
# 107 GLU HN 108 PRO HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1480,1505, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 107 GLU HN 108 PRO HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1480,1505, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 107 GLU HN 108 PRO HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1480,1505, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 107 GLU HN 108 PRO HD3 5.92
&rst
ixpk= 0, nxpk= 0, iat=1480,1497, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42, &end
#
# 107 GLU HA 107 GLU HB2 3.73
&rst
ixpk= 0, nxpk= 0, iat=1482,1484, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23, &end
#
# 107 GLU HA 107 GLU HB3 4.35
&rst
ixpk= 0, nxpk= 0, iat=1482,1485, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85, &end
#
# 107 GLU HA 107 GLU HG2 4.17
&rst
ixpk= 0, nxpk= 0, iat=1482,1487, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67, &end
#
# 107 GLU HA 107 GLU HG2 4.17
&rst
ixpk= 0, nxpk= 0, iat=1482,1487, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67, &end
#
# 107 GLU HA 107 GLU HG2 4.17
&rst
ixpk= 0, nxpk= 0, iat=1482,1487, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67, &end
#
# 107 GLU HA 107 GLU HG3 4.99
&rst
ixpk= 0, nxpk= 0, iat=1482,1488, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49, &end
#
# 107 GLU HA 108 PRO HA 5.05
&rst
ixpk= 0, nxpk= 0, iat=1482,1505, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55, &end
#
# 107 GLU HA 108 PRO HA 5.05
&rst
ixpk= 0, nxpk= 0, iat=1482,1505, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55, &end
#
# 107 GLU HA 108 PRO HA 5.05
&rst
ixpk= 0, nxpk= 0, iat=1482,1505, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55, &end
#
# 107 GLU HA 108 PRO HG2 5.14
&rst
ixpk= 0, nxpk= 0, iat=1482,1499, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64, &end
#
# 107 GLU HA 108 PRO HG2 5.14
&rst
ixpk= 0, nxpk= 0, iat=1482,1499, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64, &end
#
# 107 GLU HA 108 PRO HG2 5.14
&rst
ixpk= 0, nxpk= 0, iat=1482,1499, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64, &end
#
# 107 GLU HA 108 PRO HG3 4.98
&rst
ixpk= 0, nxpk= 0, iat=1482,1500, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48, &end
#
# 107 GLU HA 108 PRO HG3 4.98
&rst
ixpk= 0, nxpk= 0, iat=1482,1500, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48, &end
#
# 107 GLU HA 108 PRO HG3 4.98
&rst
ixpk= 0, nxpk= 0, iat=1482,1500, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48, &end
#
# 107 GLU HB2 107 GLU HB3 2.84
&rst
ixpk= 0, nxpk= 0, iat=1484,1485, r1= 1.30, r2= 1.80, r3= 2.84, r4= 3.34, &end
#
# 107 GLU HB3 108 PRO HD3 5.09
&rst
ixpk= 0, nxpk= 0, iat=1485,1497, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59, &end
#
# 107 GLU HB3 108 PRO HD3 5.09
&rst
ixpk= 0, nxpk= 0, iat=1485,1497, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59, &end
#
# 107 GLU HG2 107 GLU HG3 2.97
&rst
ixpk= 0, nxpk= 0, iat=1487,1488, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 108 PRO HA 108 PRO HG2 5.62
&rst
ixpk= 0, nxpk= 0, iat=1505,1499, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12, &end
#
# 108 PRO HA 109 VAL HN 2.97
&rst
ixpk= 0, nxpk= 0, iat=1505,1509, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 108 PRO HA 109 VAL HN 3.58
&rst
ixpk= 0, nxpk= 0, iat=1505,1509, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08, &end
#
# 108 PRO HA 109 VAL HN 3.58
&rst
ixpk= 0, nxpk= 0, iat=1505,1509, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08, &end
#
# 108 PRO HA 109 VAL HN 3.58
&rst
ixpk= 0, nxpk= 0, iat=1505,1509, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08, &end
#
# 108 PRO HA 109 VAL QG2 5.33
&rst
ixpk= 0, nxpk= 0, iat=1505, -1, r1= 1.30, r2= 1.80, r3= 6.40, r4= 6.90,
igr2=1519,1520,1521,
&end
#
# 108 PRO HA 109 VAL QG2 5.33
&rst
ixpk= 0, nxpk= 0, iat=1505, -1, r1= 1.30, r2= 1.80, r3= 6.40, r4= 6.90,
igr2=1519,1520,1521,
&end
#
# 108 PRO HA 109 VAL QG2 5.33
&rst
ixpk= 0, nxpk= 0, iat=1505, -1, r1= 1.30, r2= 1.80, r3= 6.40, r4= 6.90,
igr2=1519,1520,1521,
&end
#
# 108 PRO HB2 108 PRO HA 4.06
&rst
ixpk= 0, nxpk= 0, iat=1502,1505, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56, &end
#
# 108 PRO HB2 108 PRO HB3 3.52
&rst
ixpk= 0, nxpk= 0, iat=1502,1503, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02, &end
#
# 108 PRO HB2 109 VAL HN 4.42
&rst
ixpk= 0, nxpk= 0, iat=1502,1509, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92, &end
#
# 108 PRO HB2 109 VAL HN 4.42
&rst
ixpk= 0, nxpk= 0, iat=1502,1509, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92, &end
#
# 108 PRO HB2 109 VAL HN 4.42
&rst
ixpk= 0, nxpk= 0, iat=1502,1509, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92, &end
#
# 108 PRO HB2 109 VAL HN 5.72
&rst
ixpk= 0, nxpk= 0, iat=1502,1509, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 108 PRO HB2 109 VAL HA 5.43
&rst
ixpk= 0, nxpk= 0, iat=1502,1511, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93, &end
#
# 108 PRO HB2 109 VAL HA 5.43
&rst
ixpk= 0, nxpk= 0, iat=1502,1511, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93, &end
#
# 108 PRO HB2 109 VAL HA 5.43
&rst
ixpk= 0, nxpk= 0, iat=1502,1511, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93, &end
#
# 108 PRO HB3 108 PRO HA 4.16
&rst
ixpk= 0, nxpk= 0, iat=1503,1505, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66, &end
#
# 108 PRO HB3 108 PRO HD2 5.05
&rst
ixpk= 0, nxpk= 0, iat=1503,1496, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55, &end
#
# 108 PRO HB3 108 PRO HD3 4.85
&rst
ixpk= 0, nxpk= 0, iat=1503,1497, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35, &end
#
# 108 PRO HB3 109 VAL HN 4.81
&rst
ixpk= 0, nxpk= 0, iat=1503,1509, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31, &end
#
# 108 PRO HB3 109 VAL HN 4.81
&rst
ixpk= 0, nxpk= 0, iat=1503,1509, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31, &end
#
# 108 PRO HB3 109 VAL HN 4.81
&rst
ixpk= 0, nxpk= 0, iat=1503,1509, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31, &end
#
# 108 PRO HD2 108 PRO HD3 3.61
&rst
ixpk= 0, nxpk= 0, iat=1496,1497, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11, &end
#
# 108 PRO HD3 109 VAL QG1 5.92
&rst
ixpk= 0, nxpk= 0, iat=1497, -1, r1= 1.30, r2= 1.80, r3= 7.11, r4= 7.61,
igr2=1515,1516,1517,
&end
#
# 108 PRO HD3 109 VAL QG1 5.92
&rst
ixpk= 0, nxpk= 0, iat=1497, -1, r1= 1.30, r2= 1.80, r3= 7.11, r4= 7.61,
igr2=1515,1516,1517,
&end
#
# 108 PRO HG3 108 PRO HA 4.90
&rst
ixpk= 0, nxpk= 0, iat=1500,1505, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40, &end
#
# 108 PRO HG3 108 PRO HD2 3.93
&rst
ixpk= 0, nxpk= 0, iat=1500,1496, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43, &end
#
# 109 VAL HN 109 VAL HA 4.18
&rst
ixpk= 0, nxpk= 0, iat=1509,1511, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68, &end
#
# 109 VAL HN 109 VAL HB 4.73
&rst
ixpk= 0, nxpk= 0, iat=1509,1513, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, &end
#
# 109 VAL HN 109 VAL QG2 3.48
&rst
ixpk= 0, nxpk= 0, iat=1509, -1, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
igr2=1519,1520,1521,
&end
#
# 109 VAL HN 109 VAL QG2 3.48
&rst
ixpk= 0, nxpk= 0, iat=1509, -1, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
igr2=1519,1520,1521,
&end
#
# 109 VAL HN 109 VAL QG2 3.48
&rst
ixpk= 0, nxpk= 0, iat=1509, -1, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
igr2=1519,1520,1521,
&end
#
# 109 VAL HN 110 THR HN 5.28
&rst
ixpk= 0, nxpk= 0, iat=1509,1525, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 109 VAL HN 110 THR HN 6.02
&rst
ixpk= 0, nxpk= 0, iat=1509,1525, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52, &end
#
# 109 VAL HN 110 THR HN 6.02
&rst
ixpk= 0, nxpk= 0, iat=1509,1525, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52, &end
#
# 109 VAL HN 110 THR HN 6.02
&rst
ixpk= 0, nxpk= 0, iat=1509,1525, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52, &end
#
# 109 VAL HN 110 THR HA 5.61
&rst
ixpk= 0, nxpk= 0, iat=1509,1527, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11, &end
#
# 109 VAL HN 110 THR HA 5.61
&rst
ixpk= 0, nxpk= 0, iat=1509,1527, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11, &end
#
# 109 VAL HN 110 THR HA 5.61
&rst
ixpk= 0, nxpk= 0, iat=1509,1527, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11, &end
#
# 109 VAL HA 109 VAL HB 3.92
&rst
ixpk= 0, nxpk= 0, iat=1511,1513, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42, &end
#
# 109 VAL HA 109 VAL QG1 3.65
&rst
ixpk= 0, nxpk= 0, iat=1511, -1, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
igr2=1515,1516,1517,
&end
#
# 109 VAL HA 109 VAL QG1 3.65
&rst
ixpk= 0, nxpk= 0, iat=1511, -1, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
igr2=1515,1516,1517,
&end
#
# 109 VAL HA 109 VAL QG1 3.65
&rst
ixpk= 0, nxpk= 0, iat=1511, -1, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
igr2=1515,1516,1517,
&end
#
# 109 VAL HA 109 VAL QG2 4.97
&rst
ixpk= 0, nxpk= 0, iat=1511, -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr2=1519,1520,1521,
&end
#
# 109 VAL HA 110 THR HN 2.97
&rst
ixpk= 0, nxpk= 0, iat=1511,1525, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 109 VAL HA 110 THR HN 3.33
&rst
ixpk= 0, nxpk= 0, iat=1511,1525, r1= 1.30, r2= 1.80, r3= 3.33, r4= 3.83, &end
#
# 109 VAL HA 110 THR HN 3.33
&rst
ixpk= 0, nxpk= 0, iat=1511,1525, r1= 1.30, r2= 1.80, r3= 3.33, r4= 3.83, &end
#
# 109 VAL HA 110 THR HN 3.33
&rst
ixpk= 0, nxpk= 0, iat=1511,1525, r1= 1.30, r2= 1.80, r3= 3.33, r4= 3.83, &end
#
# 109 VAL HA 110 THR HB 5.12
&rst
ixpk= 0, nxpk= 0, iat=1511,1529, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, &end
#
# 109 VAL HA 110 THR HB 5.12
&rst
ixpk= 0, nxpk= 0, iat=1511,1529, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, &end
#
# 109 VAL HA 110 THR HB 5.12
&rst
ixpk= 0, nxpk= 0, iat=1511,1529, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, &end
#
# 109 VAL HB 109 VAL QG2 4.52
&rst
ixpk= 0, nxpk= 0, iat=1513, -1, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
igr2=1519,1520,1521,
&end
#
# 109 VAL HB 110 THR HN 4.03
&rst
ixpk= 0, nxpk= 0, iat=1513,1525, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53, &end
#
# 109 VAL HB 110 THR HN 4.03
&rst
ixpk= 0, nxpk= 0, iat=1513,1525, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53, &end
#
# 109 VAL HB 110 THR HN 4.03
&rst
ixpk= 0, nxpk= 0, iat=1513,1525, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53, &end
#
# 109 VAL HB 110 THR HN 5.72
&rst
ixpk= 0, nxpk= 0, iat=1513,1525, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 109 VAL HB 110 THR HB 6.05
&rst
ixpk= 0, nxpk= 0, iat=1513,1529, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 109 VAL HB 110 THR HB 6.05
&rst
ixpk= 0, nxpk= 0, iat=1513,1529, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 109 VAL HB 110 THR HB 6.05
&rst
ixpk= 0, nxpk= 0, iat=1513,1529, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 109 VAL QG1 109 VAL HB 4.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1513, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
igr1=1515,1516,1517,
&end
#
# 109 VAL QG1 110 THR HB 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1529, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1515,1516,1517,
&end
#
# 109 VAL QG1 110 THR HB 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1529, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1515,1516,1517,
&end
#
# 109 VAL QG1 110 THR HB 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1529, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1515,1516,1517,
&end
#
# 109 VAL QG2 110 THR HN 4.11
&rst
ixpk= 0, nxpk= 0, iat= -1,1525, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
igr1=1519,1520,1521,
&end
#
# 109 VAL QG2 110 THR HN 4.11
&rst
ixpk= 0, nxpk= 0, iat= -1,1525, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
igr1=1519,1520,1521,
&end
#
# 109 VAL QG2 110 THR HN 4.11
&rst
ixpk= 0, nxpk= 0, iat= -1,1525, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
igr1=1519,1520,1521,
&end
#
# 109 VAL QG2 110 THR HA 5.69
&rst
ixpk= 0, nxpk= 0, iat= -1,1527, r1= 1.30, r2= 1.80, r3= 6.83, r4= 7.33,
igr1=1519,1520,1521,
&end
#
# 109 VAL QG2 110 THR HA 5.69
&rst
ixpk= 0, nxpk= 0, iat= -1,1527, r1= 1.30, r2= 1.80, r3= 6.83, r4= 7.33,
igr1=1519,1520,1521,
&end
#
# 109 VAL QG2 110 THR HA 5.69
&rst
ixpk= 0, nxpk= 0, iat= -1,1527, r1= 1.30, r2= 1.80, r3= 6.83, r4= 7.33,
igr1=1519,1520,1521,
&end
#
# 109 VAL QG2 111 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1539, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1519,1520,1521,
&end
#
# 109 VAL QG2 111 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1539, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1519,1520,1521,
&end
#
# 109 VAL QG2 111 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1539, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1519,1520,1521,
&end
#
# 110 THR HN 110 THR HA 4.64
&rst
ixpk= 0, nxpk= 0, iat=1525,1527, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14, &end
#
# 110 THR HN 110 THR HB 3.72
&rst
ixpk= 0, nxpk= 0, iat=1525,1529, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22, &end
#
# 110 THR HN 110 THR HB 3.72
&rst
ixpk= 0, nxpk= 0, iat=1525,1529, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22, &end
#
# 110 THR HN 110 THR HB 3.72
&rst
ixpk= 0, nxpk= 0, iat=1525,1529, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22, &end
#
# 110 THR HN 110 THR QG2 5.24
&rst
ixpk= 0, nxpk= 0, iat=1525, -1, r1= 1.30, r2= 1.80, r3= 6.29, r4= 6.79,
igr2=1531,1532,1533,
&end
#
# 110 THR HN 110 THR QG2 5.24
&rst
ixpk= 0, nxpk= 0, iat=1525, -1, r1= 1.30, r2= 1.80, r3= 6.29, r4= 6.79,
igr2=1531,1532,1533,
&end
#
# 110 THR HN 110 THR QG2 5.24
&rst
ixpk= 0, nxpk= 0, iat=1525, -1, r1= 1.30, r2= 1.80, r3= 6.29, r4= 6.79,
igr2=1531,1532,1533,
&end
#
# 110 THR HN 111 ALA HN 5.28
&rst
ixpk= 0, nxpk= 0, iat=1525,1539, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 110 THR HN 111 ALA HN 5.78
&rst
ixpk= 0, nxpk= 0, iat=1525,1539, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28, &end
#
# 110 THR HN 111 ALA HN 5.78
&rst
ixpk= 0, nxpk= 0, iat=1525,1539, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28, &end
#
# 110 THR HN 111 ALA HN 5.78
&rst
ixpk= 0, nxpk= 0, iat=1525,1539, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28, &end
#
# 110 THR HN 111 ALA QB 6.05
&rst
ixpk= 0, nxpk= 0, iat=1525, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1543,1544,1545,
&end
#
# 110 THR HN 111 ALA QB 6.05
&rst
ixpk= 0, nxpk= 0, iat=1525, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1543,1544,1545,
&end
#
# 110 THR HN 111 ALA QB 6.05
&rst
ixpk= 0, nxpk= 0, iat=1525, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1543,1544,1545,
&end
#
# 110 THR HA 110 THR HB 4.64
&rst
ixpk= 0, nxpk= 0, iat=1527,1529, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14, &end
#
# 110 THR HA 110 THR QG2 4.03
&rst
ixpk= 0, nxpk= 0, iat=1527, -1, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
igr2=1531,1532,1533,
&end
#
# 110 THR HA 110 THR QG2 4.03
&rst
ixpk= 0, nxpk= 0, iat=1527, -1, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
igr2=1531,1532,1533,
&end
#
# 110 THR HA 110 THR QG2 4.03
&rst
ixpk= 0, nxpk= 0, iat=1527, -1, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
igr2=1531,1532,1533,
&end
#
# 110 THR HA 111 ALA HN 2.97
&rst
ixpk= 0, nxpk= 0, iat=1527,1539, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 110 THR HA 111 ALA HN 3.32
&rst
ixpk= 0, nxpk= 0, iat=1527,1539, r1= 1.30, r2= 1.80, r3= 3.32, r4= 3.82, &end
#
# 110 THR HA 111 ALA HN 3.32
&rst
ixpk= 0, nxpk= 0, iat=1527,1539, r1= 1.30, r2= 1.80, r3= 3.32, r4= 3.82, &end
#
# 110 THR HA 111 ALA HN 3.32
&rst
ixpk= 0, nxpk= 0, iat=1527,1539, r1= 1.30, r2= 1.80, r3= 3.32, r4= 3.82, &end
#
# 110 THR HA 111 ALA QB 5.16
&rst
ixpk= 0, nxpk= 0, iat=1527, -1, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
igr2=1543,1544,1545,
&end
#
# 110 THR HA 111 ALA QB 5.16
&rst
ixpk= 0, nxpk= 0, iat=1527, -1, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
igr2=1543,1544,1545,
&end
#
# 110 THR HA 111 ALA QB 5.16
&rst
ixpk= 0, nxpk= 0, iat=1527, -1, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
igr2=1543,1544,1545,
&end
#
# 110 THR HB 111 ALA HN 4.82
&rst
ixpk= 0, nxpk= 0, iat=1529,1539, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32, &end
#
# 110 THR HB 111 ALA HN 4.82
&rst
ixpk= 0, nxpk= 0, iat=1529,1539, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32, &end
#
# 110 THR HB 111 ALA HN 4.82
&rst
ixpk= 0, nxpk= 0, iat=1529,1539, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32, &end
#
# 110 THR HB 111 ALA HN 5.72
&rst
ixpk= 0, nxpk= 0, iat=1529,1539, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 110 THR HB 111 ALA QB 6.05
&rst
ixpk= 0, nxpk= 0, iat=1529, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1543,1544,1545,
&end
#
# 110 THR HB 111 ALA QB 6.05
&rst
ixpk= 0, nxpk= 0, iat=1529, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1543,1544,1545,
&end
#
# 110 THR HB 111 ALA QB 6.05
&rst
ixpk= 0, nxpk= 0, iat=1529, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1543,1544,1545,
&end
#
# 110 THR HB 112 PRO QG 5.65
&rst
ixpk= 0, nxpk= 0, iat=1529, -1, r1= 1.30, r2= 1.80, r3= 6.34, r4= 6.84,
igr2=1553,1554,
&end
#
# 110 THR HB 112 PRO QG 5.65
&rst
ixpk= 0, nxpk= 0, iat=1529, -1, r1= 1.30, r2= 1.80, r3= 6.34, r4= 6.84,
igr2=1553,1554,
&end
#
# 110 THR HB 112 PRO QG 5.65
&rst
ixpk= 0, nxpk= 0, iat=1529, -1, r1= 1.30, r2= 1.80, r3= 6.34, r4= 6.84,
igr2=1553,1554,
&end
#
# 110 THR QG2 110 THR HB 3.45
&rst
ixpk= 0, nxpk= 0, iat= -1,1529, r1= 1.30, r2= 1.80, r3= 4.14, r4= 4.64,
igr1=1531,1532,1533,
&end
#
# 110 THR QG2 111 ALA HN 3.80
&rst
ixpk= 0, nxpk= 0, iat= -1,1539, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
igr1=1531,1532,1533,
&end
#
# 110 THR QG2 111 ALA HN 3.80
&rst
ixpk= 0, nxpk= 0, iat= -1,1539, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
igr1=1531,1532,1533,
&end
#
# 110 THR QG2 111 ALA HN 3.80
&rst
ixpk= 0, nxpk= 0, iat= -1,1539, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
igr1=1531,1532,1533,
&end
#
# 110 THR QG2 111 ALA HA 5.42
&rst
ixpk= 0, nxpk= 0, iat= -1,1541, r1= 1.30, r2= 1.80, r3= 6.51, r4= 7.01,
igr1=1531,1532,1533,
&end
#
# 110 THR QG2 111 ALA HA 5.42
&rst
ixpk= 0, nxpk= 0, iat= -1,1541, r1= 1.30, r2= 1.80, r3= 6.51, r4= 7.01,
igr1=1531,1532,1533,
&end
#
# 110 THR QG2 111 ALA HA 5.42
&rst
ixpk= 0, nxpk= 0, iat= -1,1541, r1= 1.30, r2= 1.80, r3= 6.51, r4= 7.01,
igr1=1531,1532,1533,
&end
#
# 110 THR QG2 112 PRO HA 5.12
&rst
ixpk= 0, nxpk= 0, iat= -1,1559, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
igr1=1531,1532,1533,
&end
#
# 110 THR QG2 112 PRO HA 5.12
&rst
ixpk= 0, nxpk= 0, iat= -1,1559, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
igr1=1531,1532,1533,
&end
#
# 110 THR QG2 112 PRO HA 5.12
&rst
ixpk= 0, nxpk= 0, iat= -1,1559, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
igr1=1531,1532,1533,
&end
#
# 110 THR QG2 112 PRO HD2 5.58
&rst
ixpk= 0, nxpk= 0, iat= -1,1550, r1= 1.30, r2= 1.80, r3= 6.70, r4= 7.20,
igr1=1531,1532,1533,
&end
#
# 110 THR QG2 112 PRO HD2 5.58
&rst
ixpk= 0, nxpk= 0, iat= -1,1550, r1= 1.30, r2= 1.80, r3= 6.70, r4= 7.20,
igr1=1531,1532,1533,
&end
#
# 110 THR QG2 112 PRO HD2 5.58
&rst
ixpk= 0, nxpk= 0, iat= -1,1550, r1= 1.30, r2= 1.80, r3= 6.70, r4= 7.20,
igr1=1531,1532,1533,
&end
#
# 110 THR QG2 112 PRO HD3 5.54
&rst
ixpk= 0, nxpk= 0, iat= -1,1551, r1= 1.30, r2= 1.80, r3= 6.65, r4= 7.15,
igr1=1531,1532,1533,
&end
#
# 110 THR QG2 112 PRO HD3 5.54
&rst
ixpk= 0, nxpk= 0, iat= -1,1551, r1= 1.30, r2= 1.80, r3= 6.65, r4= 7.15,
igr1=1531,1532,1533,
&end
#
# 110 THR QG2 112 PRO HD3 5.54
&rst
ixpk= 0, nxpk= 0, iat= -1,1551, r1= 1.30, r2= 1.80, r3= 6.65, r4= 7.15,
igr1=1531,1532,1533,
&end
#
# 110 THR QG2 112 PRO QG 5.69
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.67, r4= 8.17,
igr1=1531,1532,1533,
igr2=1553,1554,
&end
#
# 110 THR QG2 112 PRO QG 5.69
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.67, r4= 8.17,
igr1=1531,1532,1533,
igr2=1553,1554,
&end
#
# 110 THR QG2 112 PRO QG 5.69
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.67, r4= 8.17,
igr1=1531,1532,1533,
igr2=1553,1554,
&end
#
# 111 ALA HN 111 ALA HA 4.35
&rst
ixpk= 0, nxpk= 0, iat=1539,1541, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85, &end
#
# 111 ALA HN 111 ALA QB 3.80
&rst
ixpk= 0, nxpk= 0, iat=1539, -1, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
igr2=1543,1544,1545,
&end
#
# 111 ALA HN 111 ALA QB 3.80
&rst
ixpk= 0, nxpk= 0, iat=1539, -1, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
igr2=1543,1544,1545,
&end
#
# 111 ALA HN 111 ALA QB 3.80
&rst
ixpk= 0, nxpk= 0, iat=1539, -1, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
igr2=1543,1544,1545,
&end
#
# 111 ALA HN 114 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1539,1587, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 111 ALA HN 114 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1539,1587, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 111 ALA HN 114 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1539,1587, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 111 ALA HA 112 PRO HA 4.97
&rst
ixpk= 0, nxpk= 0, iat=1541,1559, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 111 ALA HA 112 PRO HA 4.97
&rst
ixpk= 0, nxpk= 0, iat=1541,1559, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 111 ALA HA 112 PRO HA 4.97
&rst
ixpk= 0, nxpk= 0, iat=1541,1559, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 111 ALA HA 112 PRO QG 4.67
&rst
ixpk= 0, nxpk= 0, iat=1541, -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr2=1553,1554,
&end
#
# 111 ALA HA 112 PRO QG 4.67
&rst
ixpk= 0, nxpk= 0, iat=1541, -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr2=1553,1554,
&end
#
# 111 ALA HA 112 PRO QG 4.67
&rst
ixpk= 0, nxpk= 0, iat=1541, -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr2=1553,1554,
&end
#
# 111 ALA HA 113 ARG HN 4.64
&rst
ixpk= 0, nxpk= 0, iat=1541,1563, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14, &end
#
# 111 ALA HA 113 ARG HN 4.64
&rst
ixpk= 0, nxpk= 0, iat=1541,1563, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14, &end
#
# 111 ALA HA 113 ARG HN 4.64
&rst
ixpk= 0, nxpk= 0, iat=1541,1563, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14, &end
#
# 111 ALA HA 114 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1541,1587, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 111 ALA HA 114 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1541,1587, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 111 ALA HA 114 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1541,1587, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 111 ALA QB 111 ALA HA 3.92
&rst
ixpk= 0, nxpk= 0, iat= -1,1541, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21,
igr1=1543,1544,1545,
&end
#
# 111 ALA QB 113 ARG HN 4.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1563, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1=1543,1544,1545,
&end
#
# 111 ALA QB 113 ARG HN 4.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1563, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1=1543,1544,1545,
&end
#
# 111 ALA QB 113 ARG HN 4.00
&rst
ixpk= 0, nxpk= 0, iat= -1,1563, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1=1543,1544,1545,
&end
#
# 111 ALA QB 114 LEU HN 5.13
&rst
ixpk= 0, nxpk= 0, iat= -1,1587, r1= 1.30, r2= 1.80, r3= 6.16, r4= 6.66,
igr1=1543,1544,1545,
&end
#
# 111 ALA QB 114 LEU HN 5.13
&rst
ixpk= 0, nxpk= 0, iat= -1,1587, r1= 1.30, r2= 1.80, r3= 6.16, r4= 6.66,
igr1=1543,1544,1545,
&end
#
# 111 ALA QB 114 LEU HN 5.13
&rst
ixpk= 0, nxpk= 0, iat= -1,1587, r1= 1.30, r2= 1.80, r3= 6.16, r4= 6.66,
igr1=1543,1544,1545,
&end
#
# 111 ALA QB 114 LEU QD2 4.41
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
igr1=1543,1544,1545,
igr2=1600,1601,1602,
&end
#
# 111 ALA QB 114 LEU QD2 4.41
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
igr1=1543,1544,1545,
igr2=1600,1601,1602,
&end
#
# 111 ALA QB 114 LEU QD2 4.41
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
igr1=1543,1544,1545,
igr2=1600,1601,1602,
&end
#
# 112 PRO HA 113 ARG HN 3.50 (#)
&rst
ixpk= 0, nxpk= 0, iat=1559,1563, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 112 PRO HA 113 ARG HN 5.43
&rst
ixpk= 0, nxpk= 0, iat=1559,1563, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93, &end
#
# 112 PRO HA 114 LEU HN 4.96
&rst
ixpk= 0, nxpk= 0, iat=1559,1587, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46, &end
#
# 112 PRO HA 114 LEU HN 4.96
&rst
ixpk= 0, nxpk= 0, iat=1559,1587, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46, &end
#
# 112 PRO HA 114 LEU HN 4.96
&rst
ixpk= 0, nxpk= 0, iat=1559,1587, r1= 1.30, r2= 1.80, r3= 4.96, r4= 5.46, &end
#
# 112 PRO HA 115 LYS QE 6.05
&rst
ixpk= 0, nxpk= 0, iat=1559, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2=1619,1620,
&end
#
# 112 PRO HA 115 LYS QE 6.05
&rst
ixpk= 0, nxpk= 0, iat=1559, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2=1619,1620,
&end
#
# 112 PRO HA 115 LYS QE 6.05
&rst
ixpk= 0, nxpk= 0, iat=1559, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2=1619,1620,
&end
#
# 112 PRO HB2 112 PRO HA 3.77
&rst
ixpk= 0, nxpk= 0, iat=1556,1559, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27, &end
#
# 112 PRO HB2 112 PRO HD3 4.29
&rst
ixpk= 0, nxpk= 0, iat=1556,1551, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79, &end
#
# 112 PRO HB2 112 PRO QG 3.78
&rst
ixpk= 0, nxpk= 0, iat=1556, -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
igr2=1553,1554,
&end
#
# 112 PRO HB2 113 ARG HN 5.16
&rst
ixpk= 0, nxpk= 0, iat=1556,1563, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66, &end
#
# 112 PRO HB2 113 ARG HN 5.72
&rst
ixpk= 0, nxpk= 0, iat=1556,1563, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 112 PRO HB3 112 PRO HA 3.82
&rst
ixpk= 0, nxpk= 0, iat=1557,1559, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32, &end
#
# 112 PRO HB3 112 PRO HB2 3.11
&rst
ixpk= 0, nxpk= 0, iat=1557,1556, r1= 1.30, r2= 1.80, r3= 3.11, r4= 3.61, &end
#
# 112 PRO HB3 112 PRO QG 2.96
&rst
ixpk= 0, nxpk= 0, iat=1557, -1, r1= 1.30, r2= 1.80, r3= 3.32, r4= 3.82,
igr2=1553,1554,
&end
#
# 112 PRO HB3 113 ARG HN 4.69
&rst
ixpk= 0, nxpk= 0, iat=1557,1563, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, &end
#
# 112 PRO HB3 113 ARG HN 4.69
&rst
ixpk= 0, nxpk= 0, iat=1557,1563, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, &end
#
# 112 PRO HB3 113 ARG HN 4.69
&rst
ixpk= 0, nxpk= 0, iat=1557,1563, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, &end
#
# 112 PRO HD2 112 PRO QG 6.05
&rst
ixpk= 0, nxpk= 0, iat=1550, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2=1553,1554,
&end
#
# 112 PRO HD2 113 ARG HN 4.37
&rst
ixpk= 0, nxpk= 0, iat=1550,1563, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87, &end
#
# 112 PRO HD2 113 ARG HN 4.37
&rst
ixpk= 0, nxpk= 0, iat=1550,1563, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87, &end
#
# 112 PRO HD2 113 ARG HN 4.37
&rst
ixpk= 0, nxpk= 0, iat=1550,1563, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87, &end
#
# 112 PRO HD2 114 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1550,1587, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 112 PRO HD2 114 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1550,1587, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 112 PRO HD2 114 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1550,1587, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 112 PRO HD3 112 PRO HA 5.20
&rst
ixpk= 0, nxpk= 0, iat=1551,1559, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70, &end
#
# 112 PRO HD3 112 PRO HB3 4.97
&rst
ixpk= 0, nxpk= 0, iat=1551,1557, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 112 PRO HD3 114 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1551,1587, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 112 PRO HD3 114 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1551,1587, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 112 PRO HD3 114 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1551,1587, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 112 PRO QG 112 PRO HA 4.47
&rst
ixpk= 0, nxpk= 0, iat= -1,1559, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52,
igr1=1553,1554,
&end
#
# 112 PRO QG 112 PRO HD3 3.59
&rst
ixpk= 0, nxpk= 0, iat= -1,1551, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,
igr1=1553,1554,
&end
#
# 112 PRO QG 113 ARG HN 4.21
&rst
ixpk= 0, nxpk= 0, iat= -1,1563, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
igr1=1553,1554,
&end
#
# 112 PRO QG 113 ARG HN 4.21
&rst
ixpk= 0, nxpk= 0, iat= -1,1563, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
igr1=1553,1554,
&end
#
# 112 PRO QG 113 ARG HN 4.21
&rst
ixpk= 0, nxpk= 0, iat= -1,1563, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23,
igr1=1553,1554,
&end
#
# 113 ARG HN 113 ARG HA 4.19
&rst
ixpk= 0, nxpk= 0, iat=1563,1565, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69, &end
#
# 113 ARG HN 113 ARG HB2 5.60
&rst
ixpk= 0, nxpk= 0, iat=1563,1567, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10, &end
#
# 113 ARG HN 113 ARG HB3 4.17
&rst
ixpk= 0, nxpk= 0, iat=1563,1568, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67, &end
#
# 113 ARG HN 113 ARG HB3 4.17
&rst
ixpk= 0, nxpk= 0, iat=1563,1568, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67, &end
#
# 113 ARG HN 113 ARG HB3 4.17
&rst
ixpk= 0, nxpk= 0, iat=1563,1568, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67, &end
#
# 113 ARG HN 113 ARG HD2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1563,1573, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 113 ARG HN 113 ARG HD2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1563,1573, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 113 ARG HN 113 ARG HD2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1563,1573, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 113 ARG HN 113 ARG HD3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1563,1574, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 113 ARG HN 113 ARG HD3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1563,1574, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 113 ARG HN 113 ARG HD3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1563,1574, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 113 ARG HN 113 ARG HE 5.92
&rst
ixpk= 0, nxpk= 0, iat=1563,1576, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42, &end
#
# 113 ARG HN 113 ARG HE 5.92
&rst
ixpk= 0, nxpk= 0, iat=1563,1576, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42, &end
#
# 113 ARG HN 113 ARG HE 5.92
&rst
ixpk= 0, nxpk= 0, iat=1563,1576, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42, &end
#
# 113 ARG HN 113 ARG HG2 4.63
&rst
ixpk= 0, nxpk= 0, iat=1563,1570, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, &end
#
# 113 ARG HN 113 ARG HG2 4.63
&rst
ixpk= 0, nxpk= 0, iat=1563,1570, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, &end
#
# 113 ARG HN 113 ARG HG2 4.63
&rst
ixpk= 0, nxpk= 0, iat=1563,1570, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, &end
#
# 113 ARG HN 113 ARG HG3 5.86
&rst
ixpk= 0, nxpk= 0, iat=1563,1571, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36, &end
#
# 113 ARG HN 113 ARG HG3 5.86
&rst
ixpk= 0, nxpk= 0, iat=1563,1571, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36, &end
#
# 113 ARG HN 113 ARG HG3 5.86
&rst
ixpk= 0, nxpk= 0, iat=1563,1571, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36, &end
#
# 113 ARG HN 114 LEU HN 3.74
&rst
ixpk= 0, nxpk= 0, iat=1563,1587, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24, &end
#
# 113 ARG HN 114 LEU HN 3.74
&rst
ixpk= 0, nxpk= 0, iat=1563,1587, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24, &end
#
# 113 ARG HN 114 LEU HN 3.74
&rst
ixpk= 0, nxpk= 0, iat=1563,1587, r1= 1.30, r2= 1.80, r3= 3.74, r4= 4.24, &end
#
# 113 ARG HN 114 LEU HN 5.28
&rst
ixpk= 0, nxpk= 0, iat=1563,1587, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 113 ARG HN 114 LEU HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1563,1589, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 113 ARG HN 114 LEU HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1563,1589, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 113 ARG HN 114 LEU HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1563,1589, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 113 ARG HN 114 LEU HG 5.80
&rst
ixpk= 0, nxpk= 0, iat=1563,1594, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30, &end
#
# 113 ARG HN 114 LEU HG 5.80
&rst
ixpk= 0, nxpk= 0, iat=1563,1594, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30, &end
#
# 113 ARG HN 114 LEU HG 5.80
&rst
ixpk= 0, nxpk= 0, iat=1563,1594, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30, &end
#
# 113 ARG HN 114 LEU QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat=1563, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1596,1597,1598,
&end
#
# 113 ARG HN 114 LEU QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat=1563, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1596,1597,1598,
&end
#
# 113 ARG HN 114 LEU QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat=1563, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1596,1597,1598,
&end
#
# 113 ARG HN 114 LEU QD2 5.00
&rst
ixpk= 0, nxpk= 0, iat=1563, -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr2=1600,1601,1602,
&end
#
# 113 ARG HN 114 LEU QD2 5.00
&rst
ixpk= 0, nxpk= 0, iat=1563, -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr2=1600,1601,1602,
&end
#
# 113 ARG HN 114 LEU QD2 5.00
&rst
ixpk= 0, nxpk= 0, iat=1563, -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr2=1600,1601,1602,
&end
#
# 113 ARG HA 113 ARG HD2 5.88
&rst
ixpk= 0, nxpk= 0, iat=1565,1573, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38, &end
#
# 113 ARG HA 113 ARG HD2 5.88
&rst
ixpk= 0, nxpk= 0, iat=1565,1573, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38, &end
#
# 113 ARG HA 113 ARG HD2 5.88
&rst
ixpk= 0, nxpk= 0, iat=1565,1573, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38, &end
#
# 113 ARG HA 113 ARG HD3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1565,1574, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 113 ARG HA 113 ARG HD3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1565,1574, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 113 ARG HA 113 ARG HD3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1565,1574, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 113 ARG HA 113 ARG HE 6.05
&rst
ixpk= 0, nxpk= 0, iat=1565,1576, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 113 ARG HA 113 ARG HE 6.05
&rst
ixpk= 0, nxpk= 0, iat=1565,1576, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 113 ARG HA 113 ARG HE 6.05
&rst
ixpk= 0, nxpk= 0, iat=1565,1576, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 113 ARG HA 113 ARG HG2 5.40
&rst
ixpk= 0, nxpk= 0, iat=1565,1570, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90, &end
#
# 113 ARG HA 113 ARG HG3 4.84
&rst
ixpk= 0, nxpk= 0, iat=1565,1571, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34, &end
#
# 113 ARG HA 114 LEU HN 3.50 (#)
&rst
ixpk= 0, nxpk= 0, iat=1565,1587, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 113 ARG HA 114 LEU HN 4.48
&rst
ixpk= 0, nxpk= 0, iat=1565,1587, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98, &end
#
# 113 ARG HA 114 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1565, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1600,1601,1602,
&end
#
# 113 ARG HA 114 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1565, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1600,1601,1602,
&end
#
# 113 ARG HA 114 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1565, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1600,1601,1602,
&end
#
# 113 ARG HB2 113 ARG HD2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1567,1573, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 113 ARG HB2 113 ARG HD3 5.72
&rst
ixpk= 0, nxpk= 0, iat=1567,1574, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 113 ARG HB2 113 ARG HE 6.05
&rst
ixpk= 0, nxpk= 0, iat=1567,1576, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 113 ARG HB2 113 ARG HE 6.05
&rst
ixpk= 0, nxpk= 0, iat=1567,1576, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 113 ARG HB2 113 ARG HE 6.05
&rst
ixpk= 0, nxpk= 0, iat=1567,1576, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 113 ARG HB2 113 ARG HG2 4.73
&rst
ixpk= 0, nxpk= 0, iat=1567,1570, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, &end
#
# 113 ARG HB2 113 ARG HG3 4.87
&rst
ixpk= 0, nxpk= 0, iat=1567,1571, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37, &end
#
# 113 ARG HB2 114 LEU HN 5.72
&rst
ixpk= 0, nxpk= 0, iat=1567,1587, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 113 ARG HB2 114 LEU QD2 5.48
&rst
ixpk= 0, nxpk= 0, iat=1567, -1, r1= 1.30, r2= 1.80, r3= 6.58, r4= 7.08,
igr2=1600,1601,1602,
&end
#
# 113 ARG HB2 114 LEU QD2 5.48
&rst
ixpk= 0, nxpk= 0, iat=1567, -1, r1= 1.30, r2= 1.80, r3= 6.58, r4= 7.08,
igr2=1600,1601,1602,
&end
#
# 113 ARG HB2 114 LEU QD2 5.48
&rst
ixpk= 0, nxpk= 0, iat=1567, -1, r1= 1.30, r2= 1.80, r3= 6.58, r4= 7.08,
igr2=1600,1601,1602,
&end
#
# 113 ARG HB3 113 ARG HB2 3.54
&rst
ixpk= 0, nxpk= 0, iat=1568,1567, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04, &end
#
# 113 ARG HB3 113 ARG HD3 6.00
&rst
ixpk= 0, nxpk= 0, iat=1568,1574, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 113 ARG HB3 113 ARG HE 5.95
&rst
ixpk= 0, nxpk= 0, iat=1568,1576, r1= 1.30, r2= 1.80, r3= 5.95, r4= 6.45, &end
#
# 113 ARG HB3 113 ARG HE 5.95
&rst
ixpk= 0, nxpk= 0, iat=1568,1576, r1= 1.30, r2= 1.80, r3= 5.95, r4= 6.45, &end
#
# 113 ARG HB3 113 ARG HE 5.95
&rst
ixpk= 0, nxpk= 0, iat=1568,1576, r1= 1.30, r2= 1.80, r3= 5.95, r4= 6.45, &end
#
# 113 ARG HB3 114 LEU HN 4.87
&rst
ixpk= 0, nxpk= 0, iat=1568,1587, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37, &end
#
# 113 ARG HB3 114 LEU HN 4.87
&rst
ixpk= 0, nxpk= 0, iat=1568,1587, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37, &end
#
# 113 ARG HB3 114 LEU HN 4.87
&rst
ixpk= 0, nxpk= 0, iat=1568,1587, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37, &end
#
# 113 ARG HD2 113 ARG HE 5.59
&rst
ixpk= 0, nxpk= 0, iat=1573,1576, r1= 1.30, r2= 1.80, r3= 5.59, r4= 6.09, &end
#
# 113 ARG HD2 113 ARG NH2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1573, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2=1582,1583,
&end
#
# 113 ARG HD2 114 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1573, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1600,1601,1602,
&end
#
# 113 ARG HD2 114 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1573, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1600,1601,1602,
&end
#
# 113 ARG HD2 114 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1573, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1600,1601,1602,
&end
#
# 113 ARG HD3 113 ARG HD2 4.08
&rst
ixpk= 0, nxpk= 0, iat=1574,1573, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58, &end
#
# 113 ARG HD3 113 ARG HE 5.92
&rst
ixpk= 0, nxpk= 0, iat=1574,1576, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42, &end
#
# 113 ARG HD3 113 ARG NH2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1574, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2=1582,1583,
&end
#
# 113 ARG HD3 113 ARG NH2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1574, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2=1582,1583,
&end
#
# 113 ARG HE 114 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1576, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1600,1601,1602,
&end
#
# 113 ARG HE 114 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1576, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1600,1601,1602,
&end
#
# 113 ARG HE 114 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1576, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1600,1601,1602,
&end
#
# 113 ARG HG2 113 ARG HD2 5.27
&rst
ixpk= 0, nxpk= 0, iat=1570,1573, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77, &end
#
# 113 ARG HG2 113 ARG HD3 5.08
&rst
ixpk= 0, nxpk= 0, iat=1570,1574, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58, &end
#
# 113 ARG HG2 113 ARG HE 6.05
&rst
ixpk= 0, nxpk= 0, iat=1570,1576, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 113 ARG HG2 114 LEU QD2 4.92
&rst
ixpk= 0, nxpk= 0, iat=1570, -1, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41,
igr2=1600,1601,1602,
&end
#
# 113 ARG HG2 114 LEU QD2 4.92
&rst
ixpk= 0, nxpk= 0, iat=1570, -1, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41,
igr2=1600,1601,1602,
&end
#
# 113 ARG HG2 114 LEU QD2 4.92
&rst
ixpk= 0, nxpk= 0, iat=1570, -1, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41,
igr2=1600,1601,1602,
&end
#
# 113 ARG HG3 113 ARG HD2 4.75
&rst
ixpk= 0, nxpk= 0, iat=1571,1573, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, &end
#
# 113 ARG HG3 113 ARG HD3 5.18
&rst
ixpk= 0, nxpk= 0, iat=1571,1574, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68, &end
#
# 113 ARG HG3 113 ARG HE 5.64
&rst
ixpk= 0, nxpk= 0, iat=1571,1576, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14, &end
#
# 113 ARG NH2 113 ARG HE 5.75
&rst
ixpk= 0, nxpk= 0, iat= -1,1576, r1= 1.30, r2= 1.80, r3= 6.45, r4= 6.95,
igr1=1582,1583,
&end
#
# 113 ARG NH2 113 ARG HE 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1576, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1=1582,1583,
&end
#
# 113 ARG NH2 113 ARG NH2 5.55
#This appears to be self-referential: ignoring
#
# 114 LEU HN 114 LEU HA 4.18
&rst
ixpk= 0, nxpk= 0, iat=1587,1589, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68, &end
#
# 114 LEU HN 114 LEU HB2 3.84
&rst
ixpk= 0, nxpk= 0, iat=1587,1591, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34, &end
#
# 114 LEU HN 114 LEU HB2 3.84
&rst
ixpk= 0, nxpk= 0, iat=1587,1591, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34, &end
#
# 114 LEU HN 114 LEU HB2 3.84
&rst
ixpk= 0, nxpk= 0, iat=1587,1591, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34, &end
#
# 114 LEU HN 114 LEU HB3 4.35
&rst
ixpk= 0, nxpk= 0, iat=1587,1592, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85, &end
#
# 114 LEU HN 114 LEU HB3 4.35
&rst
ixpk= 0, nxpk= 0, iat=1587,1592, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85, &end
#
# 114 LEU HN 114 LEU HB3 4.35
&rst
ixpk= 0, nxpk= 0, iat=1587,1592, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85, &end
#
# 114 LEU HN 114 LEU HG 4.54
&rst
ixpk= 0, nxpk= 0, iat=1587,1594, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 114 LEU HN 114 LEU HG 4.54
&rst
ixpk= 0, nxpk= 0, iat=1587,1594, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 114 LEU HN 114 LEU HG 4.54
&rst
ixpk= 0, nxpk= 0, iat=1587,1594, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 114 LEU HN 114 LEU QD1 4.97
&rst
ixpk= 0, nxpk= 0, iat=1587, -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr2=1596,1597,1598,
&end
#
# 114 LEU HN 114 LEU QD1 4.97
&rst
ixpk= 0, nxpk= 0, iat=1587, -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr2=1596,1597,1598,
&end
#
# 114 LEU HN 114 LEU QD1 4.97
&rst
ixpk= 0, nxpk= 0, iat=1587, -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr2=1596,1597,1598,
&end
#
# 114 LEU HN 114 LEU QD2 4.70
&rst
ixpk= 0, nxpk= 0, iat=1587, -1, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14,
igr2=1600,1601,1602,
&end
#
# 114 LEU HN 114 LEU QD2 4.70
&rst
ixpk= 0, nxpk= 0, iat=1587, -1, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14,
igr2=1600,1601,1602,
&end
#
# 114 LEU HN 114 LEU QD2 4.70
&rst
ixpk= 0, nxpk= 0, iat=1587, -1, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14,
igr2=1600,1601,1602,
&end
#
# 114 LEU HN 115 LYS HN 4.73
&rst
ixpk= 0, nxpk= 0, iat=1587,1606, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, &end
#
# 114 LEU HN 115 LYS HN 4.73
&rst
ixpk= 0, nxpk= 0, iat=1587,1606, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, &end
#
# 114 LEU HN 115 LYS HN 4.73
&rst
ixpk= 0, nxpk= 0, iat=1587,1606, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, &end
#
# 114 LEU HN 115 LYS HN 5.28
&rst
ixpk= 0, nxpk= 0, iat=1587,1606, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 114 LEU HN 116 SER HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1587,1628, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 114 LEU HN 116 SER HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1587,1628, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 114 LEU HN 116 SER HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1587,1628, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 114 LEU HA 114 LEU HB2 5.21
&rst
ixpk= 0, nxpk= 0, iat=1589,1591, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71, &end
#
# 114 LEU HA 114 LEU HB3 4.47
&rst
ixpk= 0, nxpk= 0, iat=1589,1592, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97, &end
#
# 114 LEU HA 114 LEU HG 4.49
&rst
ixpk= 0, nxpk= 0, iat=1589,1594, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99, &end
#
# 114 LEU HA 114 LEU HG 4.49
&rst
ixpk= 0, nxpk= 0, iat=1589,1594, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99, &end
#
# 114 LEU HA 114 LEU HG 4.49
&rst
ixpk= 0, nxpk= 0, iat=1589,1594, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99, &end
#
# 114 LEU HA 114 LEU QD1 4.09
&rst
ixpk= 0, nxpk= 0, iat=1589, -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
igr2=1596,1597,1598,
&end
#
# 114 LEU HA 114 LEU QD1 4.09
&rst
ixpk= 0, nxpk= 0, iat=1589, -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
igr2=1596,1597,1598,
&end
#
# 114 LEU HA 114 LEU QD1 4.09
&rst
ixpk= 0, nxpk= 0, iat=1589, -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
igr2=1596,1597,1598,
&end
#
# 114 LEU HA 114 LEU QD2 4.57
&rst
ixpk= 0, nxpk= 0, iat=1589, -1, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
igr2=1600,1601,1602,
&end
#
# 114 LEU HA 114 LEU QD2 4.57
&rst
ixpk= 0, nxpk= 0, iat=1589, -1, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
igr2=1600,1601,1602,
&end
#
# 114 LEU HA 114 LEU QD2 4.57
&rst
ixpk= 0, nxpk= 0, iat=1589, -1, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99,
igr2=1600,1601,1602,
&end
#
# 114 LEU HA 115 LYS HN 2.97
&rst
ixpk= 0, nxpk= 0, iat=1589,1606, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 114 LEU HA 115 LYS HN 3.23
&rst
ixpk= 0, nxpk= 0, iat=1589,1606, r1= 1.30, r2= 1.80, r3= 3.23, r4= 3.73, &end
#
# 114 LEU HA 115 LYS HN 3.23
&rst
ixpk= 0, nxpk= 0, iat=1589,1606, r1= 1.30, r2= 1.80, r3= 3.23, r4= 3.73, &end
#
# 114 LEU HA 115 LYS HN 3.23
&rst
ixpk= 0, nxpk= 0, iat=1589,1606, r1= 1.30, r2= 1.80, r3= 3.23, r4= 3.73, &end
#
# 114 LEU HA 116 SER HN 4.38
&rst
ixpk= 0, nxpk= 0, iat=1589,1628, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88, &end
#
# 114 LEU HA 116 SER HN 4.38
&rst
ixpk= 0, nxpk= 0, iat=1589,1628, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88, &end
#
# 114 LEU HA 116 SER HN 4.38
&rst
ixpk= 0, nxpk= 0, iat=1589,1628, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88, &end
#
# 114 LEU HB2 114 LEU HB3 4.07
&rst
ixpk= 0, nxpk= 0, iat=1591,1592, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57, &end
#
# 114 LEU HB2 114 LEU QD2 4.95
&rst
ixpk= 0, nxpk= 0, iat=1591, -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
igr2=1600,1601,1602,
&end
#
# 114 LEU HB2 115 LYS HN 4.30
&rst
ixpk= 0, nxpk= 0, iat=1591,1606, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80, &end
#
# 114 LEU HB2 115 LYS HN 4.30
&rst
ixpk= 0, nxpk= 0, iat=1591,1606, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80, &end
#
# 114 LEU HB2 115 LYS HN 4.30
&rst
ixpk= 0, nxpk= 0, iat=1591,1606, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80, &end
#
# 114 LEU HB2 115 LYS HN 5.72
&rst
ixpk= 0, nxpk= 0, iat=1591,1606, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 114 LEU HB2 116 SER HN 4.87
&rst
ixpk= 0, nxpk= 0, iat=1591,1628, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37, &end
#
# 114 LEU HB2 116 SER HN 4.87
&rst
ixpk= 0, nxpk= 0, iat=1591,1628, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37, &end
#
# 114 LEU HB2 116 SER HN 4.87
&rst
ixpk= 0, nxpk= 0, iat=1591,1628, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37, &end
#
# 114 LEU HB3 114 LEU QD1 4.42
&rst
ixpk= 0, nxpk= 0, iat=1592, -1, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
igr2=1596,1597,1598,
&end
#
# 114 LEU HB3 114 LEU QD1 4.42
&rst
ixpk= 0, nxpk= 0, iat=1592, -1, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
igr2=1596,1597,1598,
&end
#
# 114 LEU HB3 114 LEU QD1 4.42
&rst
ixpk= 0, nxpk= 0, iat=1592, -1, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
igr2=1596,1597,1598,
&end
#
# 114 LEU HB3 115 LYS HN 5.30
&rst
ixpk= 0, nxpk= 0, iat=1592,1606, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80, &end
#
# 114 LEU HB3 115 LYS HN 5.30
&rst
ixpk= 0, nxpk= 0, iat=1592,1606, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80, &end
#
# 114 LEU HB3 115 LYS HN 5.30
&rst
ixpk= 0, nxpk= 0, iat=1592,1606, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80, &end
#
# 114 LEU HB3 116 SER HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1592,1628, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 114 LEU HB3 116 SER HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1592,1628, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 114 LEU HB3 116 SER HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1592,1628, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 114 LEU HG 114 LEU QD2 4.42
&rst
ixpk= 0, nxpk= 0, iat=1594, -1, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
igr2=1600,1601,1602,
&end
#
# 114 LEU HG 115 LYS HN 5.40
&rst
ixpk= 0, nxpk= 0, iat=1594,1606, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90, &end
#
# 114 LEU HG 115 LYS HN 5.40
&rst
ixpk= 0, nxpk= 0, iat=1594,1606, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90, &end
#
# 114 LEU HG 115 LYS HN 5.40
&rst
ixpk= 0, nxpk= 0, iat=1594,1606, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90, &end
#
# 114 LEU QD1 115 LYS HN 4.20
&rst
ixpk= 0, nxpk= 0, iat= -1,1606, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr1=1596,1597,1598,
&end
#
# 114 LEU QD1 115 LYS HN 4.20
&rst
ixpk= 0, nxpk= 0, iat= -1,1606, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr1=1596,1597,1598,
&end
#
# 114 LEU QD1 115 LYS HN 4.20
&rst
ixpk= 0, nxpk= 0, iat= -1,1606, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr1=1596,1597,1598,
&end
#
# 114 LEU QD1 115 LYS HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1608, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1596,1597,1598,
&end
#
# 114 LEU QD1 115 LYS HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1608, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1596,1597,1598,
&end
#
# 114 LEU QD1 115 LYS HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1608, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1596,1597,1598,
&end
#
# 114 LEU QD1 116 SER HN 4.28
&rst
ixpk= 0, nxpk= 0, iat= -1,1628, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
igr1=1596,1597,1598,
&end
#
# 114 LEU QD1 116 SER HN 4.28
&rst
ixpk= 0, nxpk= 0, iat= -1,1628, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
igr1=1596,1597,1598,
&end
#
# 114 LEU QD1 116 SER HN 4.28
&rst
ixpk= 0, nxpk= 0, iat= -1,1628, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
igr1=1596,1597,1598,
&end
#
# 114 LEU QD2 114 LEU QD1 2.97
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78,
igr1=1600,1601,1602,
igr2=1596,1597,1598,
&end
#
# 114 LEU QD2 115 LYS HN 5.75
&rst
ixpk= 0, nxpk= 0, iat= -1,1606, r1= 1.30, r2= 1.80, r3= 6.91, r4= 7.41,
igr1=1600,1601,1602,
&end
#
# 114 LEU QD2 115 LYS HN 5.75
&rst
ixpk= 0, nxpk= 0, iat= -1,1606, r1= 1.30, r2= 1.80, r3= 6.91, r4= 7.41,
igr1=1600,1601,1602,
&end
#
# 114 LEU QD2 115 LYS HN 5.75
&rst
ixpk= 0, nxpk= 0, iat= -1,1606, r1= 1.30, r2= 1.80, r3= 6.91, r4= 7.41,
igr1=1600,1601,1602,
&end
#
# 114 LEU QD2 116 SER HN 5.93
&rst
ixpk= 0, nxpk= 0, iat= -1,1628, r1= 1.30, r2= 1.80, r3= 7.12, r4= 7.62,
igr1=1600,1601,1602,
&end
#
# 114 LEU QD2 116 SER HN 5.93
&rst
ixpk= 0, nxpk= 0, iat= -1,1628, r1= 1.30, r2= 1.80, r3= 7.12, r4= 7.62,
igr1=1600,1601,1602,
&end
#
# 114 LEU QD2 116 SER HN 5.93
&rst
ixpk= 0, nxpk= 0, iat= -1,1628, r1= 1.30, r2= 1.80, r3= 7.12, r4= 7.62,
igr1=1600,1601,1602,
&end
#
# 115 LYS HN 115 LYS HA 4.06
&rst
ixpk= 0, nxpk= 0, iat=1606,1608, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56, &end
#
# 115 LYS HN 115 LYS HB2 4.52
&rst
ixpk= 0, nxpk= 0, iat=1606,1610, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02, &end
#
# 115 LYS HN 115 LYS HB2 4.52
&rst
ixpk= 0, nxpk= 0, iat=1606,1610, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02, &end
#
# 115 LYS HN 115 LYS HB2 4.52
&rst
ixpk= 0, nxpk= 0, iat=1606,1610, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02, &end
#
# 115 LYS HN 115 LYS HB3 3.95
&rst
ixpk= 0, nxpk= 0, iat=1606,1611, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45, &end
#
# 115 LYS HN 115 LYS HB3 3.95
&rst
ixpk= 0, nxpk= 0, iat=1606,1611, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45, &end
#
# 115 LYS HN 115 LYS HB3 3.95
&rst
ixpk= 0, nxpk= 0, iat=1606,1611, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45, &end
#
# 115 LYS HN 115 LYS HG2 5.92
&rst
ixpk= 0, nxpk= 0, iat=1606,1613, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42, &end
#
# 115 LYS HN 115 LYS HG2 5.92
&rst
ixpk= 0, nxpk= 0, iat=1606,1613, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42, &end
#
# 115 LYS HN 115 LYS HG2 5.92
&rst
ixpk= 0, nxpk= 0, iat=1606,1613, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42, &end
#
# 115 LYS HN 115 LYS QD 4.59
&rst
ixpk= 0, nxpk= 0, iat=1606, -1, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
igr2=1616,1617,
&end
#
# 115 LYS HN 115 LYS QD 4.59
&rst
ixpk= 0, nxpk= 0, iat=1606, -1, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
igr2=1616,1617,
&end
#
# 115 LYS HN 115 LYS QD 4.59
&rst
ixpk= 0, nxpk= 0, iat=1606, -1, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65,
igr2=1616,1617,
&end
#
# 115 LYS HN 115 LYS QE 6.05
&rst
ixpk= 0, nxpk= 0, iat=1606, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2=1619,1620,
&end
#
# 115 LYS HN 115 LYS QE 6.05
&rst
ixpk= 0, nxpk= 0, iat=1606, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2=1619,1620,
&end
#
# 115 LYS HN 115 LYS QE 6.05
&rst
ixpk= 0, nxpk= 0, iat=1606, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2=1619,1620,
&end
#
# 115 LYS HN 116 SER HN 3.28
&rst
ixpk= 0, nxpk= 0, iat=1606,1628, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78, &end
#
# 115 LYS HN 116 SER HN 3.28
&rst
ixpk= 0, nxpk= 0, iat=1606,1628, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78, &end
#
# 115 LYS HN 116 SER HN 3.28
&rst
ixpk= 0, nxpk= 0, iat=1606,1628, r1= 1.30, r2= 1.80, r3= 3.28, r4= 3.78, &end
#
# 115 LYS HN 116 SER HN 5.28
&rst
ixpk= 0, nxpk= 0, iat=1606,1628, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 115 LYS HN 116 SER HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1606,1630, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 115 LYS HN 116 SER HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1606,1630, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 115 LYS HN 116 SER HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1606,1630, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 115 LYS HN 116 SER HB2 5.98
&rst
ixpk= 0, nxpk= 0, iat=1606,1632, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48, &end
#
# 115 LYS HN 116 SER HB2 5.98
&rst
ixpk= 0, nxpk= 0, iat=1606,1632, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48, &end
#
# 115 LYS HN 116 SER HB2 5.98
&rst
ixpk= 0, nxpk= 0, iat=1606,1632, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48, &end
#
# 115 LYS HN 116 SER HB3 5.16
&rst
ixpk= 0, nxpk= 0, iat=1606,1633, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66, &end
#
# 115 LYS HN 116 SER HB3 5.16
&rst
ixpk= 0, nxpk= 0, iat=1606,1633, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66, &end
#
# 115 LYS HN 116 SER HB3 5.16
&rst
ixpk= 0, nxpk= 0, iat=1606,1633, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66, &end
#
# 115 LYS HN 119 GLU QG 5.79
&rst
ixpk= 0, nxpk= 0, iat=1606, -1, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
igr2=1677,1678,
&end
#
# 115 LYS HN 119 GLU QG 5.79
&rst
ixpk= 0, nxpk= 0, iat=1606, -1, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
igr2=1677,1678,
&end
#
# 115 LYS HN 119 GLU QG 5.79
&rst
ixpk= 0, nxpk= 0, iat=1606, -1, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00,
igr2=1677,1678,
&end
#
# 115 LYS HA 115 LYS HB2 4.09
&rst
ixpk= 0, nxpk= 0, iat=1608,1610, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59, &end
#
# 115 LYS HA 115 LYS HB3 3.62
&rst
ixpk= 0, nxpk= 0, iat=1608,1611, r1= 1.30, r2= 1.80, r3= 3.62, r4= 4.12, &end
#
# 115 LYS HA 115 LYS HG2 4.12
&rst
ixpk= 0, nxpk= 0, iat=1608,1613, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62, &end
#
# 115 LYS HA 115 LYS HG2 4.12
&rst
ixpk= 0, nxpk= 0, iat=1608,1613, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62, &end
#
# 115 LYS HA 115 LYS HG2 4.12
&rst
ixpk= 0, nxpk= 0, iat=1608,1613, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62, &end
#
# 115 LYS HA 115 LYS HG3 4.61
&rst
ixpk= 0, nxpk= 0, iat=1608,1614, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 115 LYS HA 115 LYS HG3 4.61
&rst
ixpk= 0, nxpk= 0, iat=1608,1614, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 115 LYS HA 115 LYS HG3 4.61
&rst
ixpk= 0, nxpk= 0, iat=1608,1614, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 115 LYS HA 115 LYS QD 3.99
&rst
ixpk= 0, nxpk= 0, iat=1608, -1, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
igr2=1616,1617,
&end
#
# 115 LYS HA 115 LYS QD 3.99
&rst
ixpk= 0, nxpk= 0, iat=1608, -1, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
igr2=1616,1617,
&end
#
# 115 LYS HA 115 LYS QD 3.99
&rst
ixpk= 0, nxpk= 0, iat=1608, -1, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
igr2=1616,1617,
&end
#
# 115 LYS HA 115 LYS QE 6.05
&rst
ixpk= 0, nxpk= 0, iat=1608, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2=1619,1620,
&end
#
# 115 LYS HA 115 LYS QE 6.05
&rst
ixpk= 0, nxpk= 0, iat=1608, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2=1619,1620,
&end
#
# 115 LYS HA 115 LYS QE 6.05
&rst
ixpk= 0, nxpk= 0, iat=1608, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2=1619,1620,
&end
#
# 115 LYS HA 116 SER HN 2.97
&rst
ixpk= 0, nxpk= 0, iat=1608,1628, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 115 LYS HA 116 SER HN 4.48
&rst
ixpk= 0, nxpk= 0, iat=1608,1628, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98, &end
#
# 115 LYS HB2 115 LYS HG2 4.16
&rst
ixpk= 0, nxpk= 0, iat=1610,1613, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66, &end
#
# 115 LYS HB2 115 LYS QE 5.61
&rst
ixpk= 0, nxpk= 0, iat=1610, -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
igr2=1619,1620,
&end
#
# 115 LYS HB2 115 LYS QE 5.61
&rst
ixpk= 0, nxpk= 0, iat=1610, -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
igr2=1619,1620,
&end
#
# 115 LYS HB2 115 LYS QE 5.61
&rst
ixpk= 0, nxpk= 0, iat=1610, -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
igr2=1619,1620,
&end
#
# 115 LYS HB2 116 SER HN 5.05
&rst
ixpk= 0, nxpk= 0, iat=1610,1628, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55, &end
#
# 115 LYS HB2 116 SER HN 5.05
&rst
ixpk= 0, nxpk= 0, iat=1610,1628, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55, &end
#
# 115 LYS HB2 116 SER HN 5.05
&rst
ixpk= 0, nxpk= 0, iat=1610,1628, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55, &end
#
# 115 LYS HB2 116 SER HN 5.72
&rst
ixpk= 0, nxpk= 0, iat=1610,1628, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 115 LYS HB3 115 LYS HB2 2.85
&rst
ixpk= 0, nxpk= 0, iat=1611,1610, r1= 1.30, r2= 1.80, r3= 2.85, r4= 3.35, &end
#
# 115 LYS HB3 116 SER HN 4.22
&rst
ixpk= 0, nxpk= 0, iat=1611,1628, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 115 LYS HB3 116 SER HN 4.22
&rst
ixpk= 0, nxpk= 0, iat=1611,1628, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 115 LYS HB3 116 SER HN 4.22
&rst
ixpk= 0, nxpk= 0, iat=1611,1628, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 115 LYS HG2 115 LYS QD 3.05
&rst
ixpk= 0, nxpk= 0, iat=1613, -1, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92,
igr2=1616,1617,
&end
#
# 115 LYS HG2 115 LYS QD 3.05
&rst
ixpk= 0, nxpk= 0, iat=1613, -1, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92,
igr2=1616,1617,
&end
#
# 115 LYS HG2 115 LYS QD 3.05
&rst
ixpk= 0, nxpk= 0, iat=1613, -1, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92,
igr2=1616,1617,
&end
#
# 115 LYS HG2 116 SER HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1613,1628, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 115 LYS HG2 116 SER HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1613,1628, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 115 LYS HG2 116 SER HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1613,1628, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 115 LYS HG3 116 SER HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1614,1628, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 115 LYS HG3 116 SER HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1614,1628, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 115 LYS HG3 116 SER HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1614,1628, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 115 LYS QD 115 LYS QE 3.88
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
igr1=1616,1617,
igr2=1619,1620,
&end
#
# 116 SER HN 116 SER HA 4.04
&rst
ixpk= 0, nxpk= 0, iat=1628,1630, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, &end
#
# 116 SER HN 116 SER HB2 4.36
&rst
ixpk= 0, nxpk= 0, iat=1628,1632, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86, &end
#
# 116 SER HN 116 SER HB2 4.36
&rst
ixpk= 0, nxpk= 0, iat=1628,1632, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86, &end
#
# 116 SER HN 116 SER HB2 4.36
&rst
ixpk= 0, nxpk= 0, iat=1628,1632, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86, &end
#
# 116 SER HN 116 SER HB3 3.67
&rst
ixpk= 0, nxpk= 0, iat=1628,1633, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17, &end
#
# 116 SER HN 116 SER HB3 3.67
&rst
ixpk= 0, nxpk= 0, iat=1628,1633, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17, &end
#
# 116 SER HN 116 SER HB3 3.67
&rst
ixpk= 0, nxpk= 0, iat=1628,1633, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17, &end
#
# 116 SER HN 117 LEU HN 5.03
&rst
ixpk= 0, nxpk= 0, iat=1628,1639, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53, &end
#
# 116 SER HN 117 LEU HN 5.03
&rst
ixpk= 0, nxpk= 0, iat=1628,1639, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53, &end
#
# 116 SER HN 117 LEU HN 5.03
&rst
ixpk= 0, nxpk= 0, iat=1628,1639, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53, &end
#
# 116 SER HN 119 GLU HN 5.14
&rst
ixpk= 0, nxpk= 0, iat=1628,1670, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64, &end
#
# 116 SER HN 119 GLU HN 5.14
&rst
ixpk= 0, nxpk= 0, iat=1628,1670, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64, &end
#
# 116 SER HN 119 GLU HN 5.14
&rst
ixpk= 0, nxpk= 0, iat=1628,1670, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64, &end
#
# 116 SER HN 119 GLU QG 4.36
&rst
ixpk= 0, nxpk= 0, iat=1628, -1, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
igr2=1677,1678,
&end
#
# 116 SER HN 119 GLU QG 4.36
&rst
ixpk= 0, nxpk= 0, iat=1628, -1, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
igr2=1677,1678,
&end
#
# 116 SER HN 119 GLU QG 4.36
&rst
ixpk= 0, nxpk= 0, iat=1628, -1, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
igr2=1677,1678,
&end
#
# 116 SER HA 116 SER HB2 3.80
&rst
ixpk= 0, nxpk= 0, iat=1630,1632, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30, &end
#
# 116 SER HA 116 SER HB3 4.18
&rst
ixpk= 0, nxpk= 0, iat=1630,1633, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68, &end
#
# 116 SER HA 117 LEU HN 3.33
&rst
ixpk= 0, nxpk= 0, iat=1630,1639, r1= 1.30, r2= 1.80, r3= 3.33, r4= 3.83, &end
#
# 116 SER HA 117 LEU HN 3.33
&rst
ixpk= 0, nxpk= 0, iat=1630,1639, r1= 1.30, r2= 1.80, r3= 3.33, r4= 3.83, &end
#
# 116 SER HA 117 LEU HN 3.33
&rst
ixpk= 0, nxpk= 0, iat=1630,1639, r1= 1.30, r2= 1.80, r3= 3.33, r4= 3.83, &end
#
# 116 SER HA 117 LEU HA 5.75
&rst
ixpk= 0, nxpk= 0, iat=1630,1641, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25, &end
#
# 116 SER HA 117 LEU HA 5.75
&rst
ixpk= 0, nxpk= 0, iat=1630,1641, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25, &end
#
# 116 SER HA 117 LEU HA 5.75
&rst
ixpk= 0, nxpk= 0, iat=1630,1641, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25, &end
#
# 116 SER HA 117 LEU HB2 5.58
&rst
ixpk= 0, nxpk= 0, iat=1630,1643, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08, &end
#
# 116 SER HA 117 LEU HB2 5.58
&rst
ixpk= 0, nxpk= 0, iat=1630,1643, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08, &end
#
# 116 SER HA 117 LEU HB2 5.58
&rst
ixpk= 0, nxpk= 0, iat=1630,1643, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08, &end
#
# 116 SER HA 117 LEU QD1 5.86
&rst
ixpk= 0, nxpk= 0, iat=1630, -1, r1= 1.30, r2= 1.80, r3= 7.04, r4= 7.54,
igr2=1648,1649,1650,
&end
#
# 116 SER HA 117 LEU QD1 5.86
&rst
ixpk= 0, nxpk= 0, iat=1630, -1, r1= 1.30, r2= 1.80, r3= 7.04, r4= 7.54,
igr2=1648,1649,1650,
&end
#
# 116 SER HA 117 LEU QD1 5.86
&rst
ixpk= 0, nxpk= 0, iat=1630, -1, r1= 1.30, r2= 1.80, r3= 7.04, r4= 7.54,
igr2=1648,1649,1650,
&end
#
# 116 SER HA 117 LEU QD2 5.74
&rst
ixpk= 0, nxpk= 0, iat=1630, -1, r1= 1.30, r2= 1.80, r3= 6.89, r4= 7.39,
igr2=1652,1653,1654,
&end
#
# 116 SER HA 117 LEU QD2 5.74
&rst
ixpk= 0, nxpk= 0, iat=1630, -1, r1= 1.30, r2= 1.80, r3= 6.89, r4= 7.39,
igr2=1652,1653,1654,
&end
#
# 116 SER HA 117 LEU QD2 5.74
&rst
ixpk= 0, nxpk= 0, iat=1630, -1, r1= 1.30, r2= 1.80, r3= 6.89, r4= 7.39,
igr2=1652,1653,1654,
&end
#
# 116 SER HA 118 ASP HN 4.66
&rst
ixpk= 0, nxpk= 0, iat=1630,1658, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16, &end
#
# 116 SER HA 118 ASP HN 4.66
&rst
ixpk= 0, nxpk= 0, iat=1630,1658, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16, &end
#
# 116 SER HA 118 ASP HN 4.66
&rst
ixpk= 0, nxpk= 0, iat=1630,1658, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16, &end
#
# 116 SER HB2 117 LEU HN 3.99
&rst
ixpk= 0, nxpk= 0, iat=1632,1639, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49, &end
#
# 116 SER HB2 117 LEU HN 3.99
&rst
ixpk= 0, nxpk= 0, iat=1632,1639, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49, &end
#
# 116 SER HB2 117 LEU HN 3.99
&rst
ixpk= 0, nxpk= 0, iat=1632,1639, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49, &end
#
# 116 SER HB2 117 LEU HB2 5.71
&rst
ixpk= 0, nxpk= 0, iat=1632,1643, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21, &end
#
# 116 SER HB2 117 LEU HB2 5.71
&rst
ixpk= 0, nxpk= 0, iat=1632,1643, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21, &end
#
# 116 SER HB2 117 LEU HB2 5.71
&rst
ixpk= 0, nxpk= 0, iat=1632,1643, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21, &end
#
# 116 SER HB2 117 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1632, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1652,1653,1654,
&end
#
# 116 SER HB2 117 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1632, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1652,1653,1654,
&end
#
# 116 SER HB2 117 LEU QD2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1632, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1652,1653,1654,
&end
#
# 116 SER HB2 118 ASP HN 3.96
&rst
ixpk= 0, nxpk= 0, iat=1632,1658, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46, &end
#
# 116 SER HB2 118 ASP HN 3.96
&rst
ixpk= 0, nxpk= 0, iat=1632,1658, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46, &end
#
# 116 SER HB2 118 ASP HN 3.96
&rst
ixpk= 0, nxpk= 0, iat=1632,1658, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46, &end
#
# 116 SER HB2 118 ASP QB 5.10
&rst
ixpk= 0, nxpk= 0, iat=1632, -1, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
igr2=1662,1663,
&end
#
# 116 SER HB2 118 ASP QB 5.10
&rst
ixpk= 0, nxpk= 0, iat=1632, -1, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
igr2=1662,1663,
&end
#
# 116 SER HB2 118 ASP QB 5.10
&rst
ixpk= 0, nxpk= 0, iat=1632, -1, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
igr2=1662,1663,
&end
#
# 116 SER HB2 119 GLU HN 5.69
&rst
ixpk= 0, nxpk= 0, iat=1632,1670, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19, &end
#
# 116 SER HB2 119 GLU HN 5.69
&rst
ixpk= 0, nxpk= 0, iat=1632,1670, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19, &end
#
# 116 SER HB2 119 GLU HN 5.69
&rst
ixpk= 0, nxpk= 0, iat=1632,1670, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19, &end
#
# 116 SER HB2 119 GLU QG 4.91
&rst
ixpk= 0, nxpk= 0, iat=1632, -1, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
igr2=1677,1678,
&end
#
# 116 SER HB2 119 GLU QG 4.91
&rst
ixpk= 0, nxpk= 0, iat=1632, -1, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
igr2=1677,1678,
&end
#
# 116 SER HB2 119 GLU QG 4.91
&rst
ixpk= 0, nxpk= 0, iat=1632, -1, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01,
igr2=1677,1678,
&end
#
# 116 SER HB3 116 SER HB2 3.22
&rst
ixpk= 0, nxpk= 0, iat=1633,1632, r1= 1.30, r2= 1.80, r3= 3.22, r4= 3.72, &end
#
# 116 SER HB3 117 LEU HN 4.59
&rst
ixpk= 0, nxpk= 0, iat=1633,1639, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 116 SER HB3 117 LEU HN 4.59
&rst
ixpk= 0, nxpk= 0, iat=1633,1639, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 116 SER HB3 117 LEU HN 4.59
&rst
ixpk= 0, nxpk= 0, iat=1633,1639, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 116 SER HB3 118 ASP HN 4.22
&rst
ixpk= 0, nxpk= 0, iat=1633,1658, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 116 SER HB3 118 ASP HN 4.22
&rst
ixpk= 0, nxpk= 0, iat=1633,1658, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 116 SER HB3 118 ASP HN 4.22
&rst
ixpk= 0, nxpk= 0, iat=1633,1658, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 116 SER HB3 118 ASP QB 5.09
&rst
ixpk= 0, nxpk= 0, iat=1633, -1, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21,
igr2=1662,1663,
&end
#
# 116 SER HB3 118 ASP QB 5.09
&rst
ixpk= 0, nxpk= 0, iat=1633, -1, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21,
igr2=1662,1663,
&end
#
# 116 SER HB3 118 ASP QB 5.09
&rst
ixpk= 0, nxpk= 0, iat=1633, -1, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21,
igr2=1662,1663,
&end
#
# 116 SER HB3 119 GLU HN 4.63
&rst
ixpk= 0, nxpk= 0, iat=1633,1670, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, &end
#
# 116 SER HB3 119 GLU HN 4.63
&rst
ixpk= 0, nxpk= 0, iat=1633,1670, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, &end
#
# 116 SER HB3 119 GLU HN 4.63
&rst
ixpk= 0, nxpk= 0, iat=1633,1670, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, &end
#
# 116 SER HB3 119 GLU QG 4.05
&rst
ixpk= 0, nxpk= 0, iat=1633, -1, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,
igr2=1677,1678,
&end
#
# 116 SER HB3 119 GLU QG 4.05
&rst
ixpk= 0, nxpk= 0, iat=1633, -1, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,
igr2=1677,1678,
&end
#
# 116 SER HB3 119 GLU QG 4.05
&rst
ixpk= 0, nxpk= 0, iat=1633, -1, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05,
igr2=1677,1678,
&end
#
# 117 LEU HN 117 LEU HA 3.98
&rst
ixpk= 0, nxpk= 0, iat=1639,1641, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48, &end
#
# 117 LEU HN 117 LEU HB2 3.78
&rst
ixpk= 0, nxpk= 0, iat=1639,1643, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28, &end
#
# 117 LEU HN 117 LEU HB2 3.78
&rst
ixpk= 0, nxpk= 0, iat=1639,1643, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28, &end
#
# 117 LEU HN 117 LEU HB2 3.78
&rst
ixpk= 0, nxpk= 0, iat=1639,1643, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28, &end
#
# 117 LEU HN 117 LEU HB3 4.08
&rst
ixpk= 0, nxpk= 0, iat=1639,1644, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58, &end
#
# 117 LEU HN 117 LEU HB3 4.08
&rst
ixpk= 0, nxpk= 0, iat=1639,1644, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58, &end
#
# 117 LEU HN 117 LEU HB3 4.08
&rst
ixpk= 0, nxpk= 0, iat=1639,1644, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58, &end
#
# 117 LEU HN 117 LEU HG 3.96
&rst
ixpk= 0, nxpk= 0, iat=1639,1646, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46, &end
#
# 117 LEU HN 117 LEU HG 3.96
&rst
ixpk= 0, nxpk= 0, iat=1639,1646, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46, &end
#
# 117 LEU HN 117 LEU HG 3.96
&rst
ixpk= 0, nxpk= 0, iat=1639,1646, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46, &end
#
# 117 LEU HN 117 LEU QD2 4.32
&rst
ixpk= 0, nxpk= 0, iat=1639, -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
igr2=1652,1653,1654,
&end
#
# 117 LEU HN 117 LEU QD2 4.32
&rst
ixpk= 0, nxpk= 0, iat=1639, -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
igr2=1652,1653,1654,
&end
#
# 117 LEU HN 117 LEU QD2 4.32
&rst
ixpk= 0, nxpk= 0, iat=1639, -1, r1= 1.30, r2= 1.80, r3= 5.19, r4= 5.69,
igr2=1652,1653,1654,
&end
#
# 117 LEU HN 118 ASP HN 3.69
&rst
ixpk= 0, nxpk= 0, iat=1639,1658, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19, &end
#
# 117 LEU HN 118 ASP HN 3.69
&rst
ixpk= 0, nxpk= 0, iat=1639,1658, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19, &end
#
# 117 LEU HN 118 ASP HN 3.69
&rst
ixpk= 0, nxpk= 0, iat=1639,1658, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19, &end
#
# 117 LEU HN 118 ASP HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1639,1660, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 117 LEU HN 118 ASP HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1639,1660, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 117 LEU HN 118 ASP HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1639,1660, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 117 LEU HN 118 ASP QB 5.52
&rst
ixpk= 0, nxpk= 0, iat=1639, -1, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
igr2=1662,1663,
&end
#
# 117 LEU HN 118 ASP QB 5.52
&rst
ixpk= 0, nxpk= 0, iat=1639, -1, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
igr2=1662,1663,
&end
#
# 117 LEU HN 118 ASP QB 5.52
&rst
ixpk= 0, nxpk= 0, iat=1639, -1, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
igr2=1662,1663,
&end
#
# 117 LEU HN 119 GLU HN 5.35
&rst
ixpk= 0, nxpk= 0, iat=1639,1670, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85, &end
#
# 117 LEU HN 119 GLU HN 5.35
&rst
ixpk= 0, nxpk= 0, iat=1639,1670, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85, &end
#
# 117 LEU HN 119 GLU HN 5.35
&rst
ixpk= 0, nxpk= 0, iat=1639,1670, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85, &end
#
# 117 LEU HN 120 VAL HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1639,1685, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 117 LEU HN 120 VAL HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1639,1685, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 117 LEU HN 120 VAL HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1639,1685, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 117 LEU HN 120 VAL QG2 5.92
&rst
ixpk= 0, nxpk= 0, iat=1639, -1, r1= 1.30, r2= 1.80, r3= 7.11, r4= 7.61,
igr2=1695,1696,1697,
&end
#
# 117 LEU HN 120 VAL QG2 5.92
&rst
ixpk= 0, nxpk= 0, iat=1639, -1, r1= 1.30, r2= 1.80, r3= 7.11, r4= 7.61,
igr2=1695,1696,1697,
&end
#
# 117 LEU HN 120 VAL QG2 5.92
&rst
ixpk= 0, nxpk= 0, iat=1639, -1, r1= 1.30, r2= 1.80, r3= 7.11, r4= 7.61,
igr2=1695,1696,1697,
&end
#
# 117 LEU HA 117 LEU HB2 4.27
&rst
ixpk= 0, nxpk= 0, iat=1641,1643, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77, &end
#
# 117 LEU HA 117 LEU HB3 3.98
&rst
ixpk= 0, nxpk= 0, iat=1641,1644, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48, &end
#
# 117 LEU HA 117 LEU HG 4.59
&rst
ixpk= 0, nxpk= 0, iat=1641,1646, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 117 LEU HA 117 LEU HG 4.59
&rst
ixpk= 0, nxpk= 0, iat=1641,1646, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 117 LEU HA 117 LEU HG 4.59
&rst
ixpk= 0, nxpk= 0, iat=1641,1646, r1= 1.30, r2= 1.80, r3= 4.59, r4= 5.09, &end
#
# 117 LEU HA 117 LEU QD1 3.65
&rst
ixpk= 0, nxpk= 0, iat=1641, -1, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
igr2=1648,1649,1650,
&end
#
# 117 LEU HA 117 LEU QD1 3.65
&rst
ixpk= 0, nxpk= 0, iat=1641, -1, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
igr2=1648,1649,1650,
&end
#
# 117 LEU HA 117 LEU QD1 3.65
&rst
ixpk= 0, nxpk= 0, iat=1641, -1, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
igr2=1648,1649,1650,
&end
#
# 117 LEU HA 119 GLU HN 5.48
&rst
ixpk= 0, nxpk= 0, iat=1641,1670, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98, &end
#
# 117 LEU HA 119 GLU HN 5.48
&rst
ixpk= 0, nxpk= 0, iat=1641,1670, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98, &end
#
# 117 LEU HA 119 GLU HN 5.48
&rst
ixpk= 0, nxpk= 0, iat=1641,1670, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98, &end
#
# 117 LEU HA 119 GLU QG 6.00
&rst
ixpk= 0, nxpk= 0, iat=1641, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=1677,1678,
&end
#
# 117 LEU HA 119 GLU QG 6.00
&rst
ixpk= 0, nxpk= 0, iat=1641, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=1677,1678,
&end
#
# 117 LEU HA 119 GLU QG 6.00
&rst
ixpk= 0, nxpk= 0, iat=1641, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=1677,1678,
&end
#
# 117 LEU HA 120 VAL HN 4.82
&rst
ixpk= 0, nxpk= 0, iat=1641,1685, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32, &end
#
# 117 LEU HA 120 VAL HN 4.82
&rst
ixpk= 0, nxpk= 0, iat=1641,1685, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32, &end
#
# 117 LEU HA 120 VAL HN 4.82
&rst
ixpk= 0, nxpk= 0, iat=1641,1685, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32, &end
#
# 117 LEU HA 120 VAL HB 6.05
&rst
ixpk= 0, nxpk= 0, iat=1641,1689, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 117 LEU HA 120 VAL HB 6.05
&rst
ixpk= 0, nxpk= 0, iat=1641,1689, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 117 LEU HA 120 VAL HB 6.05
&rst
ixpk= 0, nxpk= 0, iat=1641,1689, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 117 LEU HA 120 VAL QG1 5.27
&rst
ixpk= 0, nxpk= 0, iat=1641, -1, r1= 1.30, r2= 1.80, r3= 6.33, r4= 6.83,
igr2=1691,1692,1693,
&end
#
# 117 LEU HA 120 VAL QG1 5.27
&rst
ixpk= 0, nxpk= 0, iat=1641, -1, r1= 1.30, r2= 1.80, r3= 6.33, r4= 6.83,
igr2=1691,1692,1693,
&end
#
# 117 LEU HA 120 VAL QG1 5.27
&rst
ixpk= 0, nxpk= 0, iat=1641, -1, r1= 1.30, r2= 1.80, r3= 6.33, r4= 6.83,
igr2=1691,1692,1693,
&end
#
# 117 LEU HA 120 VAL QG2 3.88
&rst
ixpk= 0, nxpk= 0, iat=1641, -1, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
igr2=1695,1696,1697,
&end
#
# 117 LEU HA 120 VAL QG2 3.88
&rst
ixpk= 0, nxpk= 0, iat=1641, -1, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
igr2=1695,1696,1697,
&end
#
# 117 LEU HA 120 VAL QG2 3.88
&rst
ixpk= 0, nxpk= 0, iat=1641, -1, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16,
igr2=1695,1696,1697,
&end
#
# 117 LEU HA 121 LYS HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1641,1701, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 117 LEU HA 121 LYS HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1641,1701, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 117 LEU HA 121 LYS HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1641,1701, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 117 LEU HB2 117 LEU HB3 3.35
&rst
ixpk= 0, nxpk= 0, iat=1643,1644, r1= 1.30, r2= 1.80, r3= 3.35, r4= 3.85, &end
#
# 117 LEU HB2 117 LEU QD1 4.36
&rst
ixpk= 0, nxpk= 0, iat=1643, -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr2=1648,1649,1650,
&end
#
# 117 LEU HB2 117 LEU QD1 4.36
&rst
ixpk= 0, nxpk= 0, iat=1643, -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr2=1648,1649,1650,
&end
#
# 117 LEU HB2 117 LEU QD1 4.36
&rst
ixpk= 0, nxpk= 0, iat=1643, -1, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74,
igr2=1648,1649,1650,
&end
#
# 117 LEU HB2 117 LEU QD2 3.85
&rst
ixpk= 0, nxpk= 0, iat=1643, -1, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
igr2=1652,1653,1654,
&end
#
# 117 LEU HB2 117 LEU QD2 3.85
&rst
ixpk= 0, nxpk= 0, iat=1643, -1, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
igr2=1652,1653,1654,
&end
#
# 117 LEU HB2 117 LEU QD2 3.85
&rst
ixpk= 0, nxpk= 0, iat=1643, -1, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
igr2=1652,1653,1654,
&end
#
# 117 LEU HB2 118 ASP HN 4.26
&rst
ixpk= 0, nxpk= 0, iat=1643,1658, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76, &end
#
# 117 LEU HB2 118 ASP HN 4.26
&rst
ixpk= 0, nxpk= 0, iat=1643,1658, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76, &end
#
# 117 LEU HB2 118 ASP HN 4.26
&rst
ixpk= 0, nxpk= 0, iat=1643,1658, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76, &end
#
# 117 LEU HB2 119 GLU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1643,1670, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 117 LEU HB2 119 GLU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1643,1670, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 117 LEU HB2 119 GLU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1643,1670, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 117 LEU HB3 117 LEU QD1 3.93
&rst
ixpk= 0, nxpk= 0, iat=1644, -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
igr2=1648,1649,1650,
&end
#
# 117 LEU HB3 117 LEU QD1 3.93
&rst
ixpk= 0, nxpk= 0, iat=1644, -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
igr2=1648,1649,1650,
&end
#
# 117 LEU HB3 117 LEU QD1 3.93
&rst
ixpk= 0, nxpk= 0, iat=1644, -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
igr2=1648,1649,1650,
&end
#
# 117 LEU HB3 118 ASP HN 4.47
&rst
ixpk= 0, nxpk= 0, iat=1644,1658, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97, &end
#
# 117 LEU HB3 118 ASP HN 4.47
&rst
ixpk= 0, nxpk= 0, iat=1644,1658, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97, &end
#
# 117 LEU HB3 118 ASP HN 4.47
&rst
ixpk= 0, nxpk= 0, iat=1644,1658, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97, &end
#
# 117 LEU HG 117 LEU QD2 3.96
&rst
ixpk= 0, nxpk= 0, iat=1646, -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
igr2=1652,1653,1654,
&end
#
# 117 LEU HG 118 ASP HN 5.82
&rst
ixpk= 0, nxpk= 0, iat=1646,1658, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32, &end
#
# 117 LEU HG 118 ASP HN 5.82
&rst
ixpk= 0, nxpk= 0, iat=1646,1658, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32, &end
#
# 117 LEU HG 118 ASP HN 5.82
&rst
ixpk= 0, nxpk= 0, iat=1646,1658, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32, &end
#
# 117 LEU QD1 117 LEU HG 3.93
&rst
ixpk= 0, nxpk= 0, iat= -1,1646, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
igr1=1648,1649,1650,
&end
#
# 117 LEU QD1 118 ASP HN 5.27
&rst
ixpk= 0, nxpk= 0, iat= -1,1658, r1= 1.30, r2= 1.80, r3= 6.33, r4= 6.83,
igr1=1648,1649,1650,
&end
#
# 117 LEU QD1 118 ASP HN 5.27
&rst
ixpk= 0, nxpk= 0, iat= -1,1658, r1= 1.30, r2= 1.80, r3= 6.33, r4= 6.83,
igr1=1648,1649,1650,
&end
#
# 117 LEU QD1 118 ASP HN 5.27
&rst
ixpk= 0, nxpk= 0, iat= -1,1658, r1= 1.30, r2= 1.80, r3= 6.33, r4= 6.83,
igr1=1648,1649,1650,
&end
#
# 117 LEU QD1 120 VAL HN 5.78
&rst
ixpk= 0, nxpk= 0, iat= -1,1685, r1= 1.30, r2= 1.80, r3= 6.94, r4= 7.44,
igr1=1648,1649,1650,
&end
#
# 117 LEU QD1 120 VAL HN 5.78
&rst
ixpk= 0, nxpk= 0, iat= -1,1685, r1= 1.30, r2= 1.80, r3= 6.94, r4= 7.44,
igr1=1648,1649,1650,
&end
#
# 117 LEU QD1 120 VAL HN 5.78
&rst
ixpk= 0, nxpk= 0, iat= -1,1685, r1= 1.30, r2= 1.80, r3= 6.94, r4= 7.44,
igr1=1648,1649,1650,
&end
#
# 117 LEU QD2 118 ASP HN 5.12
&rst
ixpk= 0, nxpk= 0, iat= -1,1658, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
igr1=1652,1653,1654,
&end
#
# 117 LEU QD2 118 ASP HN 5.12
&rst
ixpk= 0, nxpk= 0, iat= -1,1658, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
igr1=1652,1653,1654,
&end
#
# 117 LEU QD2 118 ASP HN 5.12
&rst
ixpk= 0, nxpk= 0, iat= -1,1658, r1= 1.30, r2= 1.80, r3= 6.15, r4= 6.65,
igr1=1652,1653,1654,
&end
#
# 118 ASP HN 118 ASP HA 3.54
&rst
ixpk= 0, nxpk= 0, iat=1658,1660, r1= 1.30, r2= 1.80, r3= 3.54, r4= 4.04, &end
#
# 118 ASP HN 118 ASP QB 3.21
&rst
ixpk= 0, nxpk= 0, iat=1658, -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr2=1662,1663,
&end
#
# 118 ASP HN 118 ASP QB 3.21
&rst
ixpk= 0, nxpk= 0, iat=1658, -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr2=1662,1663,
&end
#
# 118 ASP HN 118 ASP QB 3.21
&rst
ixpk= 0, nxpk= 0, iat=1658, -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr2=1662,1663,
&end
#
# 118 ASP HN 119 GLU HN 3.69
&rst
ixpk= 0, nxpk= 0, iat=1658,1670, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19, &end
#
# 118 ASP HN 119 GLU HN 3.69
&rst
ixpk= 0, nxpk= 0, iat=1658,1670, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19, &end
#
# 118 ASP HN 119 GLU HN 3.69
&rst
ixpk= 0, nxpk= 0, iat=1658,1670, r1= 1.30, r2= 1.80, r3= 3.69, r4= 4.19, &end
#
# 118 ASP HN 119 GLU QG 4.76
&rst
ixpk= 0, nxpk= 0, iat=1658, -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr2=1677,1678,
&end
#
# 118 ASP HN 119 GLU QG 4.76
&rst
ixpk= 0, nxpk= 0, iat=1658, -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr2=1677,1678,
&end
#
# 118 ASP HN 119 GLU QG 4.76
&rst
ixpk= 0, nxpk= 0, iat=1658, -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr2=1677,1678,
&end
#
# 118 ASP HN 120 VAL HN 5.08
&rst
ixpk= 0, nxpk= 0, iat=1658,1685, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58, &end
#
# 118 ASP HN 120 VAL HN 5.08
&rst
ixpk= 0, nxpk= 0, iat=1658,1685, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58, &end
#
# 118 ASP HN 120 VAL HN 5.08
&rst
ixpk= 0, nxpk= 0, iat=1658,1685, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58, &end
#
# 118 ASP HN 120 VAL QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1658, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1695,1696,1697,
&end
#
# 118 ASP HN 120 VAL QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1658, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1695,1696,1697,
&end
#
# 118 ASP HN 120 VAL QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1658, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1695,1696,1697,
&end
#
# 118 ASP HN 121 LYS HN 5.85
&rst
ixpk= 0, nxpk= 0, iat=1658,1701, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35, &end
#
# 118 ASP HN 121 LYS HN 5.85
&rst
ixpk= 0, nxpk= 0, iat=1658,1701, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35, &end
#
# 118 ASP HN 121 LYS HN 5.85
&rst
ixpk= 0, nxpk= 0, iat=1658,1701, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35, &end
#
# 118 ASP HN 121 LYS QE 6.05
&rst
ixpk= 0, nxpk= 0, iat=1658, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2=1714,1715,
&end
#
# 118 ASP HN 121 LYS QE 6.05
&rst
ixpk= 0, nxpk= 0, iat=1658, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2=1714,1715,
&end
#
# 118 ASP HN 121 LYS QE 6.05
&rst
ixpk= 0, nxpk= 0, iat=1658, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2=1714,1715,
&end
#
# 118 ASP HA 118 ASP QB 3.40
&rst
ixpk= 0, nxpk= 0, iat=1660, -1, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,
igr2=1662,1663,
&end
#
# 118 ASP HA 120 VAL HN 5.13
&rst
ixpk= 0, nxpk= 0, iat=1660,1685, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63, &end
#
# 118 ASP HA 120 VAL HN 5.13
&rst
ixpk= 0, nxpk= 0, iat=1660,1685, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63, &end
#
# 118 ASP HA 120 VAL HN 5.13
&rst
ixpk= 0, nxpk= 0, iat=1660,1685, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63, &end
#
# 118 ASP HA 121 LYS HN 4.76
&rst
ixpk= 0, nxpk= 0, iat=1660,1701, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26, &end
#
# 118 ASP HA 121 LYS HN 4.76
&rst
ixpk= 0, nxpk= 0, iat=1660,1701, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26, &end
#
# 118 ASP HA 121 LYS HN 4.76
&rst
ixpk= 0, nxpk= 0, iat=1660,1701, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26, &end
#
# 118 ASP HA 121 LYS HG2 5.27
&rst
ixpk= 0, nxpk= 0, iat=1660,1708, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77, &end
#
# 118 ASP HA 121 LYS HG2 5.27
&rst
ixpk= 0, nxpk= 0, iat=1660,1708, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77, &end
#
# 118 ASP HA 121 LYS HG2 5.27
&rst
ixpk= 0, nxpk= 0, iat=1660,1708, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77, &end
#
# 118 ASP HA 121 LYS HG3 4.75
&rst
ixpk= 0, nxpk= 0, iat=1660,1709, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, &end
#
# 118 ASP HA 121 LYS HG3 4.75
&rst
ixpk= 0, nxpk= 0, iat=1660,1709, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, &end
#
# 118 ASP HA 121 LYS HG3 4.75
&rst
ixpk= 0, nxpk= 0, iat=1660,1709, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, &end
#
# 118 ASP HA 121 LYS QB 3.76
&rst
ixpk= 0, nxpk= 0, iat=1660, -1, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
igr2=1705,1706,
&end
#
# 118 ASP HA 121 LYS QB 3.76
&rst
ixpk= 0, nxpk= 0, iat=1660, -1, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
igr2=1705,1706,
&end
#
# 118 ASP HA 121 LYS QB 3.76
&rst
ixpk= 0, nxpk= 0, iat=1660, -1, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72,
igr2=1705,1706,
&end
#
# 118 ASP HA 121 LYS QD 3.61
&rst
ixpk= 0, nxpk= 0, iat=1660, -1, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,
igr2=1711,1712,
&end
#
# 118 ASP HA 121 LYS QD 3.61
&rst
ixpk= 0, nxpk= 0, iat=1660, -1, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,
igr2=1711,1712,
&end
#
# 118 ASP HA 121 LYS QD 3.61
&rst
ixpk= 0, nxpk= 0, iat=1660, -1, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55,
igr2=1711,1712,
&end
#
# 118 ASP HA 121 LYS QE 5.36
&rst
ixpk= 0, nxpk= 0, iat=1660, -1, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,
igr2=1714,1715,
&end
#
# 118 ASP HA 121 LYS QE 5.36
&rst
ixpk= 0, nxpk= 0, iat=1660, -1, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,
igr2=1714,1715,
&end
#
# 118 ASP HA 121 LYS QE 5.36
&rst
ixpk= 0, nxpk= 0, iat=1660, -1, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,
igr2=1714,1715,
&end
#
# 118 ASP QB 119 GLU HN 4.14
&rst
ixpk= 0, nxpk= 0, iat= -1,1670, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
igr1=1662,1663,
&end
#
# 118 ASP QB 119 GLU HN 4.14
&rst
ixpk= 0, nxpk= 0, iat= -1,1670, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
igr1=1662,1663,
&end
#
# 118 ASP QB 119 GLU HN 4.14
&rst
ixpk= 0, nxpk= 0, iat= -1,1670, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
igr1=1662,1663,
&end
#
# 118 ASP QB 119 GLU HA 5.18
&rst
ixpk= 0, nxpk= 0, iat= -1,1672, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
igr1=1662,1663,
&end
#
# 118 ASP QB 119 GLU HA 5.18
&rst
ixpk= 0, nxpk= 0, iat= -1,1672, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
igr1=1662,1663,
&end
#
# 118 ASP QB 119 GLU HA 5.18
&rst
ixpk= 0, nxpk= 0, iat= -1,1672, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
igr1=1662,1663,
&end
#
# 118 ASP QB 121 LYS HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1701, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1=1662,1663,
&end
#
# 118 ASP QB 121 LYS HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1701, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1=1662,1663,
&end
#
# 118 ASP QB 121 LYS HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1701, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1=1662,1663,
&end
#
# 118 ASP QB 121 LYS QD 3.92
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
igr1=1662,1663,
igr2=1711,1712,
&end
#
# 118 ASP QB 121 LYS QD 3.92
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
igr1=1662,1663,
igr2=1711,1712,
&end
#
# 118 ASP QB 121 LYS QD 3.92
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
igr1=1662,1663,
igr2=1711,1712,
&end
#
# 118 ASP QB 121 LYS QE 4.81
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
igr1=1662,1663,
igr2=1714,1715,
&end
#
# 118 ASP QB 121 LYS QE 4.81
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
igr1=1662,1663,
igr2=1714,1715,
&end
#
# 118 ASP QB 121 LYS QE 4.81
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
igr1=1662,1663,
igr2=1714,1715,
&end
#
# 119 GLU HN 119 GLU HA 3.73
&rst
ixpk= 0, nxpk= 0, iat=1670,1672, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23, &end
#
# 119 GLU HN 119 GLU HB2 5.04
&rst
ixpk= 0, nxpk= 0, iat=1670,1674, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54, &end
#
# 119 GLU HN 119 GLU HB3 4.15
&rst
ixpk= 0, nxpk= 0, iat=1670,1675, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65, &end
#
# 119 GLU HN 119 GLU HB3 4.15
&rst
ixpk= 0, nxpk= 0, iat=1670,1675, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65, &end
#
# 119 GLU HN 119 GLU HB3 4.15
&rst
ixpk= 0, nxpk= 0, iat=1670,1675, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65, &end
#
# 119 GLU HN 119 GLU QG 3.43
&rst
ixpk= 0, nxpk= 0, iat=1670, -1, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35,
igr2=1677,1678,
&end
#
# 119 GLU HN 119 GLU QG 3.43
&rst
ixpk= 0, nxpk= 0, iat=1670, -1, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35,
igr2=1677,1678,
&end
#
# 119 GLU HN 119 GLU QG 3.43
&rst
ixpk= 0, nxpk= 0, iat=1670, -1, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35,
igr2=1677,1678,
&end
#
# 119 GLU HN 120 VAL HN 3.84
&rst
ixpk= 0, nxpk= 0, iat=1670,1685, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34, &end
#
# 119 GLU HN 120 VAL HN 3.84
&rst
ixpk= 0, nxpk= 0, iat=1670,1685, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34, &end
#
# 119 GLU HN 120 VAL HN 3.84
&rst
ixpk= 0, nxpk= 0, iat=1670,1685, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34, &end
#
# 119 GLU HN 120 VAL QG1 4.97
&rst
ixpk= 0, nxpk= 0, iat=1670, -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr2=1691,1692,1693,
&end
#
# 119 GLU HN 120 VAL QG1 4.97
&rst
ixpk= 0, nxpk= 0, iat=1670, -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr2=1691,1692,1693,
&end
#
# 119 GLU HN 120 VAL QG1 4.97
&rst
ixpk= 0, nxpk= 0, iat=1670, -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr2=1691,1692,1693,
&end
#
# 119 GLU HN 120 VAL QG2 4.85
&rst
ixpk= 0, nxpk= 0, iat=1670, -1, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32,
igr2=1695,1696,1697,
&end
#
# 119 GLU HN 120 VAL QG2 4.85
&rst
ixpk= 0, nxpk= 0, iat=1670, -1, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32,
igr2=1695,1696,1697,
&end
#
# 119 GLU HN 120 VAL QG2 4.85
&rst
ixpk= 0, nxpk= 0, iat=1670, -1, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32,
igr2=1695,1696,1697,
&end
#
# 119 GLU HN 121 LYS HN 4.81
&rst
ixpk= 0, nxpk= 0, iat=1670,1701, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31, &end
#
# 119 GLU HN 121 LYS HN 4.81
&rst
ixpk= 0, nxpk= 0, iat=1670,1701, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31, &end
#
# 119 GLU HN 121 LYS HN 4.81
&rst
ixpk= 0, nxpk= 0, iat=1670,1701, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31, &end
#
# 119 GLU HA 119 GLU HB2 4.32
&rst
ixpk= 0, nxpk= 0, iat=1672,1674, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82, &end
#
# 119 GLU HA 119 GLU HB3 3.61
&rst
ixpk= 0, nxpk= 0, iat=1672,1675, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11, &end
#
# 119 GLU HA 119 GLU QG 3.49
&rst
ixpk= 0, nxpk= 0, iat=1672, -1, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
igr2=1677,1678,
&end
#
# 119 GLU HA 119 GLU QG 3.49
&rst
ixpk= 0, nxpk= 0, iat=1672, -1, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
igr2=1677,1678,
&end
#
# 119 GLU HA 119 GLU QG 3.49
&rst
ixpk= 0, nxpk= 0, iat=1672, -1, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
igr2=1677,1678,
&end
#
# 119 GLU HA 120 VAL HN 4.51
&rst
ixpk= 0, nxpk= 0, iat=1672,1685, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01, &end
#
# 119 GLU HA 120 VAL QG1 5.21
&rst
ixpk= 0, nxpk= 0, iat=1672, -1, r1= 1.30, r2= 1.80, r3= 6.26, r4= 6.76,
igr2=1691,1692,1693,
&end
#
# 119 GLU HA 120 VAL QG1 5.21
&rst
ixpk= 0, nxpk= 0, iat=1672, -1, r1= 1.30, r2= 1.80, r3= 6.26, r4= 6.76,
igr2=1691,1692,1693,
&end
#
# 119 GLU HA 120 VAL QG1 5.21
&rst
ixpk= 0, nxpk= 0, iat=1672, -1, r1= 1.30, r2= 1.80, r3= 6.26, r4= 6.76,
igr2=1691,1692,1693,
&end
#
# 119 GLU HA 121 LYS HN 5.58
&rst
ixpk= 0, nxpk= 0, iat=1672,1701, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08, &end
#
# 119 GLU HA 121 LYS HN 5.58
&rst
ixpk= 0, nxpk= 0, iat=1672,1701, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08, &end
#
# 119 GLU HA 121 LYS HN 5.58
&rst
ixpk= 0, nxpk= 0, iat=1672,1701, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08, &end
#
# 119 GLU HA 121 LYS QE 5.13
&rst
ixpk= 0, nxpk= 0, iat=1672, -1, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
igr2=1714,1715,
&end
#
# 119 GLU HA 121 LYS QE 5.13
&rst
ixpk= 0, nxpk= 0, iat=1672, -1, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
igr2=1714,1715,
&end
#
# 119 GLU HA 121 LYS QE 5.13
&rst
ixpk= 0, nxpk= 0, iat=1672, -1, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
igr2=1714,1715,
&end
#
# 119 GLU HB2 120 VAL HN 4.41
&rst
ixpk= 0, nxpk= 0, iat=1674,1685, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, &end
#
# 119 GLU HB2 120 VAL HN 4.41
&rst
ixpk= 0, nxpk= 0, iat=1674,1685, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, &end
#
# 119 GLU HB2 120 VAL HN 4.41
&rst
ixpk= 0, nxpk= 0, iat=1674,1685, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, &end
#
# 119 GLU HB3 119 GLU QG 3.39
&rst
ixpk= 0, nxpk= 0, iat=1675, -1, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31,
igr2=1677,1678,
&end
#
# 119 GLU HB3 120 VAL HN 5.42
&rst
ixpk= 0, nxpk= 0, iat=1675,1685, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92, &end
#
# 119 GLU HB3 120 VAL HN 5.42
&rst
ixpk= 0, nxpk= 0, iat=1675,1685, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92, &end
#
# 119 GLU HB3 120 VAL HN 5.42
&rst
ixpk= 0, nxpk= 0, iat=1675,1685, r1= 1.30, r2= 1.80, r3= 5.42, r4= 5.92, &end
#
# 119 GLU HB3 120 VAL HA 5.58
&rst
ixpk= 0, nxpk= 0, iat=1675,1687, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08, &end
#
# 119 GLU HB3 120 VAL HA 5.58
&rst
ixpk= 0, nxpk= 0, iat=1675,1687, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08, &end
#
# 119 GLU HB3 120 VAL HA 5.58
&rst
ixpk= 0, nxpk= 0, iat=1675,1687, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08, &end
#
# 120 VAL HN 120 VAL HA 4.20
&rst
ixpk= 0, nxpk= 0, iat=1685,1687, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 120 VAL HN 120 VAL HB 4.83
&rst
ixpk= 0, nxpk= 0, iat=1685,1689, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33, &end
#
# 120 VAL HN 120 VAL QG1 4.19
&rst
ixpk= 0, nxpk= 0, iat=1685, -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
igr2=1691,1692,1693,
&end
#
# 120 VAL HN 120 VAL QG1 4.19
&rst
ixpk= 0, nxpk= 0, iat=1685, -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
igr2=1691,1692,1693,
&end
#
# 120 VAL HN 120 VAL QG1 4.19
&rst
ixpk= 0, nxpk= 0, iat=1685, -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
igr2=1691,1692,1693,
&end
#
# 120 VAL HN 120 VAL QG2 3.44
&rst
ixpk= 0, nxpk= 0, iat=1685, -1, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
igr2=1695,1696,1697,
&end
#
# 120 VAL HN 120 VAL QG2 3.44
&rst
ixpk= 0, nxpk= 0, iat=1685, -1, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
igr2=1695,1696,1697,
&end
#
# 120 VAL HN 120 VAL QG2 3.44
&rst
ixpk= 0, nxpk= 0, iat=1685, -1, r1= 1.30, r2= 1.80, r3= 4.13, r4= 4.63,
igr2=1695,1696,1697,
&end
#
# 120 VAL HN 121 LYS HN 3.30
&rst
ixpk= 0, nxpk= 0, iat=1685,1701, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80, &end
#
# 120 VAL HN 121 LYS HN 3.30
&rst
ixpk= 0, nxpk= 0, iat=1685,1701, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80, &end
#
# 120 VAL HN 121 LYS HN 3.30
&rst
ixpk= 0, nxpk= 0, iat=1685,1701, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80, &end
#
# 120 VAL HN 121 LYS HA 5.75
&rst
ixpk= 0, nxpk= 0, iat=1685,1703, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25, &end
#
# 120 VAL HN 121 LYS HA 5.75
&rst
ixpk= 0, nxpk= 0, iat=1685,1703, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25, &end
#
# 120 VAL HN 121 LYS HA 5.75
&rst
ixpk= 0, nxpk= 0, iat=1685,1703, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25, &end
#
# 120 VAL HN 121 LYS HG3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1685,1709, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 120 VAL HN 121 LYS HG3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1685,1709, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 120 VAL HN 121 LYS HG3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1685,1709, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 120 VAL HN 121 LYS QB 4.76
&rst
ixpk= 0, nxpk= 0, iat=1685, -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr2=1705,1706,
&end
#
# 120 VAL HN 121 LYS QB 4.76
&rst
ixpk= 0, nxpk= 0, iat=1685, -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr2=1705,1706,
&end
#
# 120 VAL HN 121 LYS QB 4.76
&rst
ixpk= 0, nxpk= 0, iat=1685, -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr2=1705,1706,
&end
#
# 120 VAL HN 121 LYS QE 6.05
&rst
ixpk= 0, nxpk= 0, iat=1685, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2=1714,1715,
&end
#
# 120 VAL HN 121 LYS QE 6.05
&rst
ixpk= 0, nxpk= 0, iat=1685, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2=1714,1715,
&end
#
# 120 VAL HN 121 LYS QE 6.05
&rst
ixpk= 0, nxpk= 0, iat=1685, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2=1714,1715,
&end
#
# 120 VAL HN 122 ASP HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1685,1723, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 120 VAL HN 122 ASP HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1685,1723, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 120 VAL HN 122 ASP HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1685,1723, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 120 VAL HN 153 ILE QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat=1685, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=2164,2165,2166,
&end
#
# 120 VAL HN 153 ILE QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat=1685, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=2164,2165,2166,
&end
#
# 120 VAL HN 153 ILE QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat=1685, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=2164,2165,2166,
&end
#
# 120 VAL HA 120 VAL HB 3.92
&rst
ixpk= 0, nxpk= 0, iat=1687,1689, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42, &end
#
# 120 VAL HA 120 VAL QG1 3.42
&rst
ixpk= 0, nxpk= 0, iat=1687, -1, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
igr2=1691,1692,1693,
&end
#
# 120 VAL HA 120 VAL QG1 3.42
&rst
ixpk= 0, nxpk= 0, iat=1687, -1, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
igr2=1691,1692,1693,
&end
#
# 120 VAL HA 120 VAL QG1 3.42
&rst
ixpk= 0, nxpk= 0, iat=1687, -1, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
igr2=1691,1692,1693,
&end
#
# 120 VAL HA 121 LYS HN 4.42
&rst
ixpk= 0, nxpk= 0, iat=1687,1701, r1= 1.30, r2= 1.80, r3= 4.42, r4= 4.92, &end
#
# 120 VAL HA 123 LYS HB2 4.71
&rst
ixpk= 0, nxpk= 0, iat=1687,1739, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21, &end
#
# 120 VAL HA 123 LYS HB2 4.71
&rst
ixpk= 0, nxpk= 0, iat=1687,1739, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21, &end
#
# 120 VAL HA 123 LYS HB2 4.71
&rst
ixpk= 0, nxpk= 0, iat=1687,1739, r1= 1.30, r2= 1.80, r3= 4.71, r4= 5.21, &end
#
# 120 VAL HA 123 LYS HE3 6.03
&rst
ixpk= 0, nxpk= 0, iat=1687,1749, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53, &end
#
# 120 VAL HA 123 LYS HE3 6.03
&rst
ixpk= 0, nxpk= 0, iat=1687,1749, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53, &end
#
# 120 VAL HA 123 LYS HE3 6.03
&rst
ixpk= 0, nxpk= 0, iat=1687,1749, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53, &end
#
# 120 VAL HA 123 LYS HG3 4.12
&rst
ixpk= 0, nxpk= 0, iat=1687,1743, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62, &end
#
# 120 VAL HA 123 LYS HG3 4.12
&rst
ixpk= 0, nxpk= 0, iat=1687,1743, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62, &end
#
# 120 VAL HA 123 LYS HG3 4.12
&rst
ixpk= 0, nxpk= 0, iat=1687,1743, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62, &end
#
# 120 VAL HB 121 LYS HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1689,1701, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 120 VAL HB 121 LYS HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1689,1701, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 120 VAL HB 121 LYS HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1689,1701, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 120 VAL HB 123 LYS HN 4.91
&rst
ixpk= 0, nxpk= 0, iat=1689,1735, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41, &end
#
# 120 VAL HB 123 LYS HN 4.91
&rst
ixpk= 0, nxpk= 0, iat=1689,1735, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41, &end
#
# 120 VAL HB 123 LYS HN 4.91
&rst
ixpk= 0, nxpk= 0, iat=1689,1735, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41, &end
#
# 120 VAL HB 153 ILE HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1689,2151, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 120 VAL HB 153 ILE HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1689,2151, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 120 VAL HB 153 ILE HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1689,2151, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 120 VAL HB 153 ILE QD1 4.35
&rst
ixpk= 0, nxpk= 0, iat=1689, -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
igr2=2164,2165,2166,
&end
#
# 120 VAL HB 153 ILE QD1 4.35
&rst
ixpk= 0, nxpk= 0, iat=1689, -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
igr2=2164,2165,2166,
&end
#
# 120 VAL HB 153 ILE QD1 4.35
&rst
ixpk= 0, nxpk= 0, iat=1689, -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
igr2=2164,2165,2166,
&end
#
# 120 VAL HB 153 ILE QG2 5.20
&rst
ixpk= 0, nxpk= 0, iat=1689, -1, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
igr2=2157,2158,2159,
&end
#
# 120 VAL HB 153 ILE QG2 5.20
&rst
ixpk= 0, nxpk= 0, iat=1689, -1, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
igr2=2157,2158,2159,
&end
#
# 120 VAL HB 153 ILE QG2 5.20
&rst
ixpk= 0, nxpk= 0, iat=1689, -1, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
igr2=2157,2158,2159,
&end
#
# 120 VAL QG1 120 VAL HB 3.84
&rst
ixpk= 0, nxpk= 0, iat= -1,1689, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11,
igr1=1691,1692,1693,
&end
#
# 120 VAL QG1 120 VAL QG2 3.32
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
igr1=1691,1692,1693,
igr2=1695,1696,1697,
&end
#
# 120 VAL QG1 121 LYS HN 4.86
&rst
ixpk= 0, nxpk= 0, iat= -1,1701, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
igr1=1691,1692,1693,
&end
#
# 120 VAL QG1 121 LYS HN 4.86
&rst
ixpk= 0, nxpk= 0, iat= -1,1701, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
igr1=1691,1692,1693,
&end
#
# 120 VAL QG1 121 LYS HN 4.86
&rst
ixpk= 0, nxpk= 0, iat= -1,1701, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34,
igr1=1691,1692,1693,
&end
#
# 120 VAL QG1 122 ASP HN 4.76
&rst
ixpk= 0, nxpk= 0, iat= -1,1723, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
igr1=1691,1692,1693,
&end
#
# 120 VAL QG1 122 ASP HN 4.76
&rst
ixpk= 0, nxpk= 0, iat= -1,1723, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
igr1=1691,1692,1693,
&end
#
# 120 VAL QG1 122 ASP HN 4.76
&rst
ixpk= 0, nxpk= 0, iat= -1,1723, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
igr1=1691,1692,1693,
&end
#
# 120 VAL QG1 123 LYS HE2 5.94
&rst
ixpk= 0, nxpk= 0, iat= -1,1748, r1= 1.30, r2= 1.80, r3= 7.13, r4= 7.63,
igr1=1691,1692,1693,
&end
#
# 120 VAL QG1 123 LYS HE2 5.94
&rst
ixpk= 0, nxpk= 0, iat= -1,1748, r1= 1.30, r2= 1.80, r3= 7.13, r4= 7.63,
igr1=1691,1692,1693,
&end
#
# 120 VAL QG1 123 LYS HE2 5.94
&rst
ixpk= 0, nxpk= 0, iat= -1,1748, r1= 1.30, r2= 1.80, r3= 7.13, r4= 7.63,
igr1=1691,1692,1693,
&end
#
# 120 VAL QG1 123 LYS HE3 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1749, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1691,1692,1693,
&end
#
# 120 VAL QG1 123 LYS HE3 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1749, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1691,1692,1693,
&end
#
# 120 VAL QG1 123 LYS HE3 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1749, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1691,1692,1693,
&end
#
# 120 VAL QG2 120 VAL HB 3.74
&rst
ixpk= 0, nxpk= 0, iat= -1,1689, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
igr1=1695,1696,1697,
&end
#
# 120 VAL QG2 121 LYS HN 4.43
&rst
ixpk= 0, nxpk= 0, iat= -1,1701, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
igr1=1695,1696,1697,
&end
#
# 120 VAL QG2 121 LYS HN 4.43
&rst
ixpk= 0, nxpk= 0, iat= -1,1701, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
igr1=1695,1696,1697,
&end
#
# 120 VAL QG2 121 LYS HN 4.43
&rst
ixpk= 0, nxpk= 0, iat= -1,1701, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82,
igr1=1695,1696,1697,
&end
#
# 120 VAL QG2 153 ILE QD1 3.43
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr1=1695,1696,1697,
igr2=2164,2165,2166,
&end
#
# 120 VAL QG2 153 ILE QD1 3.43
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr1=1695,1696,1697,
igr2=2164,2165,2166,
&end
#
# 120 VAL QG2 153 ILE QD1 3.43
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr1=1695,1696,1697,
igr2=2164,2165,2166,
&end
#
# 121 LYS HN 121 LYS HA 3.94
&rst
ixpk= 0, nxpk= 0, iat=1701,1703, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44, &end
#
# 121 LYS HN 121 LYS HG2 4.50
&rst
ixpk= 0, nxpk= 0, iat=1701,1708, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 121 LYS HN 121 LYS HG2 4.50
&rst
ixpk= 0, nxpk= 0, iat=1701,1708, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 121 LYS HN 121 LYS HG2 4.50
&rst
ixpk= 0, nxpk= 0, iat=1701,1708, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 121 LYS HN 121 LYS HG3 4.85
&rst
ixpk= 0, nxpk= 0, iat=1701,1709, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35, &end
#
# 121 LYS HN 121 LYS HG3 4.85
&rst
ixpk= 0, nxpk= 0, iat=1701,1709, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35, &end
#
# 121 LYS HN 121 LYS HG3 4.85
&rst
ixpk= 0, nxpk= 0, iat=1701,1709, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35, &end
#
# 121 LYS HN 121 LYS QB 3.20
&rst
ixpk= 0, nxpk= 0, iat=1701, -1, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09,
igr2=1705,1706,
&end
#
# 121 LYS HN 121 LYS QB 3.20
&rst
ixpk= 0, nxpk= 0, iat=1701, -1, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09,
igr2=1705,1706,
&end
#
# 121 LYS HN 121 LYS QB 3.20
&rst
ixpk= 0, nxpk= 0, iat=1701, -1, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09,
igr2=1705,1706,
&end
#
# 121 LYS HN 121 LYS QE 6.05
&rst
ixpk= 0, nxpk= 0, iat=1701, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2=1714,1715,
&end
#
# 121 LYS HN 121 LYS QE 6.05
&rst
ixpk= 0, nxpk= 0, iat=1701, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2=1714,1715,
&end
#
# 121 LYS HN 121 LYS QE 6.05
&rst
ixpk= 0, nxpk= 0, iat=1701, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2=1714,1715,
&end
#
# 121 LYS HN 122 ASP HN 4.95
&rst
ixpk= 0, nxpk= 0, iat=1701,1723, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45, &end
#
# 121 LYS HN 122 ASP HN 4.95
&rst
ixpk= 0, nxpk= 0, iat=1701,1723, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45, &end
#
# 121 LYS HN 122 ASP HN 4.95
&rst
ixpk= 0, nxpk= 0, iat=1701,1723, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45, &end
#
# 121 LYS HN 123 LYS HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1701,1735, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 121 LYS HN 123 LYS HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1701,1735, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 121 LYS HN 123 LYS HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1701,1735, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 121 LYS HN 123 LYS HG3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1701,1743, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 121 LYS HN 123 LYS HG3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1701,1743, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 121 LYS HN 123 LYS HG3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1701,1743, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 121 LYS HN 153 ILE QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat=1701, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=2164,2165,2166,
&end
#
# 121 LYS HN 153 ILE QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat=1701, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=2164,2165,2166,
&end
#
# 121 LYS HN 153 ILE QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat=1701, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=2164,2165,2166,
&end
#
# 121 LYS HA 121 LYS HG2 5.03
&rst
ixpk= 0, nxpk= 0, iat=1703,1708, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53, &end
#
# 121 LYS HA 121 LYS HG3 4.98
&rst
ixpk= 0, nxpk= 0, iat=1703,1709, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48, &end
#
# 121 LYS HA 121 LYS QB 3.52
&rst
ixpk= 0, nxpk= 0, iat=1703, -1, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45,
igr2=1705,1706,
&end
#
# 121 LYS HA 122 ASP HN 3.52
&rst
ixpk= 0, nxpk= 0, iat=1703,1723, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02, &end
#
# 121 LYS HA 122 ASP HN 3.52
&rst
ixpk= 0, nxpk= 0, iat=1703,1723, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02, &end
#
# 121 LYS HA 122 ASP HN 3.52
&rst
ixpk= 0, nxpk= 0, iat=1703,1723, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02, &end
#
# 121 LYS HA 123 LYS HN 4.43
&rst
ixpk= 0, nxpk= 0, iat=1703,1735, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93, &end
#
# 121 LYS HA 123 LYS HN 4.43
&rst
ixpk= 0, nxpk= 0, iat=1703,1735, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93, &end
#
# 121 LYS HA 123 LYS HN 4.43
&rst
ixpk= 0, nxpk= 0, iat=1703,1735, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93, &end
#
# 121 LYS HA 153 ILE HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1703,2151, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 121 LYS HA 153 ILE HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1703,2151, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 121 LYS HA 153 ILE HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1703,2151, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 121 LYS HA 153 ILE QG2 4.16
&rst
ixpk= 0, nxpk= 0, iat=1703, -1, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,
igr2=2157,2158,2159,
&end
#
# 121 LYS HA 153 ILE QG2 4.16
&rst
ixpk= 0, nxpk= 0, iat=1703, -1, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,
igr2=2157,2158,2159,
&end
#
# 121 LYS HA 153 ILE QG2 4.16
&rst
ixpk= 0, nxpk= 0, iat=1703, -1, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,
igr2=2157,2158,2159,
&end
#
# 121 LYS HG2 121 LYS QE 4.95
&rst
ixpk= 0, nxpk= 0, iat=1708, -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
igr2=1714,1715,
&end
#
# 121 LYS HG2 122 ASP HN 5.24
&rst
ixpk= 0, nxpk= 0, iat=1708,1723, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74, &end
#
# 121 LYS HG2 122 ASP HN 5.24
&rst
ixpk= 0, nxpk= 0, iat=1708,1723, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74, &end
#
# 121 LYS HG2 122 ASP HN 5.24
&rst
ixpk= 0, nxpk= 0, iat=1708,1723, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74, &end
#
# 121 LYS HG2 122 ASP HB2 5.08
&rst
ixpk= 0, nxpk= 0, iat=1708,1727, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58, &end
#
# 121 LYS HG2 122 ASP HB2 5.08
&rst
ixpk= 0, nxpk= 0, iat=1708,1727, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58, &end
#
# 121 LYS HG2 122 ASP HB2 5.08
&rst
ixpk= 0, nxpk= 0, iat=1708,1727, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58, &end
#
# 121 LYS HG2 122 ASP HB3 5.87
&rst
ixpk= 0, nxpk= 0, iat=1708,1728, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37, &end
#
# 121 LYS HG2 122 ASP HB3 5.87
&rst
ixpk= 0, nxpk= 0, iat=1708,1728, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37, &end
#
# 121 LYS HG2 122 ASP HB3 5.87
&rst
ixpk= 0, nxpk= 0, iat=1708,1728, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37, &end
#
# 121 LYS HG3 121 LYS HG2 3.46
&rst
ixpk= 0, nxpk= 0, iat=1709,1708, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96, &end
#
# 121 LYS HG3 121 LYS QE 3.35
&rst
ixpk= 0, nxpk= 0, iat=1709, -1, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,
igr2=1714,1715,
&end
#
# 121 LYS HG3 121 LYS QE 3.35
&rst
ixpk= 0, nxpk= 0, iat=1709, -1, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,
igr2=1714,1715,
&end
#
# 121 LYS HG3 121 LYS QE 3.35
&rst
ixpk= 0, nxpk= 0, iat=1709, -1, r1= 1.30, r2= 1.80, r3= 3.76, r4= 4.26,
igr2=1714,1715,
&end
#
# 121 LYS HG3 122 ASP HN 5.96
&rst
ixpk= 0, nxpk= 0, iat=1709,1723, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46, &end
#
# 121 LYS HG3 122 ASP HN 5.96
&rst
ixpk= 0, nxpk= 0, iat=1709,1723, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46, &end
#
# 121 LYS HG3 122 ASP HN 5.96
&rst
ixpk= 0, nxpk= 0, iat=1709,1723, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46, &end
#
# 121 LYS HG3 122 ASP HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1709,1727, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 121 LYS HG3 122 ASP HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1709,1727, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 121 LYS HG3 122 ASP HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1709,1727, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 121 LYS HG3 122 ASP HB3 4.30
&rst
ixpk= 0, nxpk= 0, iat=1709,1728, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80, &end
#
# 121 LYS HG3 122 ASP HB3 4.30
&rst
ixpk= 0, nxpk= 0, iat=1709,1728, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80, &end
#
# 121 LYS HG3 122 ASP HB3 4.30
&rst
ixpk= 0, nxpk= 0, iat=1709,1728, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80, &end
#
# 121 LYS QB 121 LYS HG2 2.93
&rst
ixpk= 0, nxpk= 0, iat= -1,1708, r1= 1.30, r2= 1.80, r3= 3.29, r4= 3.79,
igr1=1705,1706,
&end
#
# 121 LYS QB 121 LYS HG2 2.93
&rst
ixpk= 0, nxpk= 0, iat= -1,1708, r1= 1.30, r2= 1.80, r3= 3.29, r4= 3.79,
igr1=1705,1706,
&end
#
# 121 LYS QB 121 LYS HG2 2.93
&rst
ixpk= 0, nxpk= 0, iat= -1,1708, r1= 1.30, r2= 1.80, r3= 3.29, r4= 3.79,
igr1=1705,1706,
&end
#
# 121 LYS QB 121 LYS QE 5.15
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
igr1=1705,1706,
igr2=1714,1715,
&end
#
# 121 LYS QB 121 LYS QE 5.15
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
igr1=1705,1706,
igr2=1714,1715,
&end
#
# 121 LYS QB 121 LYS QE 5.15
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
igr1=1705,1706,
igr2=1714,1715,
&end
#
# 121 LYS QB 122 ASP HN 4.36
&rst
ixpk= 0, nxpk= 0, iat= -1,1723, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
igr1=1705,1706,
&end
#
# 121 LYS QB 122 ASP HN 4.36
&rst
ixpk= 0, nxpk= 0, iat= -1,1723, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
igr1=1705,1706,
&end
#
# 121 LYS QB 122 ASP HN 4.36
&rst
ixpk= 0, nxpk= 0, iat= -1,1723, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
igr1=1705,1706,
&end
#
# 121 LYS QD 121 LYS QE 3.01
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,
igr1=1711,1712,
igr2=1714,1715,
&end
#
# 121 LYS QD 121 LYS QE 3.01
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,
igr1=1711,1712,
igr2=1714,1715,
&end
#
# 121 LYS QD 121 LYS QE 3.01
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.79, r4= 4.29,
igr1=1711,1712,
igr2=1714,1715,
&end
#
# 121 LYS QD 122 ASP HN 6.03
&rst
ixpk= 0, nxpk= 0, iat= -1,1723, r1= 1.30, r2= 1.80, r3= 6.77, r4= 7.27,
igr1=1711,1712,
&end
#
# 121 LYS QD 122 ASP HN 6.03
&rst
ixpk= 0, nxpk= 0, iat= -1,1723, r1= 1.30, r2= 1.80, r3= 6.77, r4= 7.27,
igr1=1711,1712,
&end
#
# 121 LYS QD 122 ASP HN 6.03
&rst
ixpk= 0, nxpk= 0, iat= -1,1723, r1= 1.30, r2= 1.80, r3= 6.77, r4= 7.27,
igr1=1711,1712,
&end
#
# 121 LYS QE 122 ASP HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1723, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1=1714,1715,
&end
#
# 121 LYS QE 122 ASP HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1723, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1=1714,1715,
&end
#
# 121 LYS QE 122 ASP HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1723, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1=1714,1715,
&end
#
# 122 ASP HN 122 ASP HA 3.61
&rst
ixpk= 0, nxpk= 0, iat=1723,1725, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11, &end
#
# 122 ASP HN 122 ASP HB2 4.62
&rst
ixpk= 0, nxpk= 0, iat=1723,1727, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12, &end
#
# 122 ASP HN 122 ASP HB2 4.62
&rst
ixpk= 0, nxpk= 0, iat=1723,1727, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12, &end
#
# 122 ASP HN 122 ASP HB2 4.62
&rst
ixpk= 0, nxpk= 0, iat=1723,1727, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12, &end
#
# 122 ASP HN 122 ASP HB3 4.51
&rst
ixpk= 0, nxpk= 0, iat=1723,1728, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01, &end
#
# 122 ASP HN 122 ASP HB3 4.51
&rst
ixpk= 0, nxpk= 0, iat=1723,1728, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01, &end
#
# 122 ASP HN 122 ASP HB3 4.51
&rst
ixpk= 0, nxpk= 0, iat=1723,1728, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01, &end
#
# 122 ASP HN 123 LYS HN 3.65
&rst
ixpk= 0, nxpk= 0, iat=1723,1735, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15, &end
#
# 122 ASP HN 123 LYS HN 3.65
&rst
ixpk= 0, nxpk= 0, iat=1723,1735, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15, &end
#
# 122 ASP HN 123 LYS HN 3.65
&rst
ixpk= 0, nxpk= 0, iat=1723,1735, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15, &end
#
# 122 ASP HN 123 LYS HA 5.10
&rst
ixpk= 0, nxpk= 0, iat=1723,1737, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, &end
#
# 122 ASP HN 123 LYS HA 5.10
&rst
ixpk= 0, nxpk= 0, iat=1723,1737, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, &end
#
# 122 ASP HN 123 LYS HA 5.10
&rst
ixpk= 0, nxpk= 0, iat=1723,1737, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, &end
#
# 122 ASP HN 123 LYS HB2 5.96
&rst
ixpk= 0, nxpk= 0, iat=1723,1739, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46, &end
#
# 122 ASP HN 123 LYS HB2 5.96
&rst
ixpk= 0, nxpk= 0, iat=1723,1739, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46, &end
#
# 122 ASP HN 123 LYS HB2 5.96
&rst
ixpk= 0, nxpk= 0, iat=1723,1739, r1= 1.30, r2= 1.80, r3= 5.96, r4= 6.46, &end
#
# 122 ASP HN 123 LYS HG2 5.62
&rst
ixpk= 0, nxpk= 0, iat=1723,1742, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12, &end
#
# 122 ASP HN 123 LYS HG2 5.62
&rst
ixpk= 0, nxpk= 0, iat=1723,1742, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12, &end
#
# 122 ASP HN 123 LYS HG2 5.62
&rst
ixpk= 0, nxpk= 0, iat=1723,1742, r1= 1.30, r2= 1.80, r3= 5.62, r4= 6.12, &end
#
# 122 ASP HN 123 LYS HG3 3.94
&rst
ixpk= 0, nxpk= 0, iat=1723,1743, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44, &end
#
# 122 ASP HN 123 LYS HG3 3.94
&rst
ixpk= 0, nxpk= 0, iat=1723,1743, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44, &end
#
# 122 ASP HN 123 LYS HG3 3.94
&rst
ixpk= 0, nxpk= 0, iat=1723,1743, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44, &end
#
# 122 ASP HN 123 LYS QD 5.55
&rst
ixpk= 0, nxpk= 0, iat=1723, -1, r1= 1.30, r2= 1.80, r3= 6.23, r4= 6.73,
igr2=1745,1746,
&end
#
# 122 ASP HN 123 LYS QD 5.55
&rst
ixpk= 0, nxpk= 0, iat=1723, -1, r1= 1.30, r2= 1.80, r3= 6.23, r4= 6.73,
igr2=1745,1746,
&end
#
# 122 ASP HN 123 LYS QD 5.55
&rst
ixpk= 0, nxpk= 0, iat=1723, -1, r1= 1.30, r2= 1.80, r3= 6.23, r4= 6.73,
igr2=1745,1746,
&end
#
# 122 ASP HN 153 ILE HB 5.33
&rst
ixpk= 0, nxpk= 0, iat=1723,2155, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83, &end
#
# 122 ASP HN 153 ILE HB 5.33
&rst
ixpk= 0, nxpk= 0, iat=1723,2155, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83, &end
#
# 122 ASP HN 153 ILE HB 5.33
&rst
ixpk= 0, nxpk= 0, iat=1723,2155, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83, &end
#
# 122 ASP HN 153 ILE QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat=1723, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=2164,2165,2166,
&end
#
# 122 ASP HN 153 ILE QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat=1723, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=2164,2165,2166,
&end
#
# 122 ASP HN 153 ILE QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat=1723, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=2164,2165,2166,
&end
#
# 122 ASP HN 153 ILE QG2 5.48
&rst
ixpk= 0, nxpk= 0, iat=1723, -1, r1= 1.30, r2= 1.80, r3= 6.58, r4= 7.08,
igr2=2157,2158,2159,
&end
#
# 122 ASP HN 153 ILE QG2 5.48
&rst
ixpk= 0, nxpk= 0, iat=1723, -1, r1= 1.30, r2= 1.80, r3= 6.58, r4= 7.08,
igr2=2157,2158,2159,
&end
#
# 122 ASP HN 153 ILE QG2 5.48
&rst
ixpk= 0, nxpk= 0, iat=1723, -1, r1= 1.30, r2= 1.80, r3= 6.58, r4= 7.08,
igr2=2157,2158,2159,
&end
#
# 122 ASP HA 122 ASP HB2 3.92
&rst
ixpk= 0, nxpk= 0, iat=1725,1727, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42, &end
#
# 122 ASP HA 122 ASP HB3 3.93
&rst
ixpk= 0, nxpk= 0, iat=1725,1728, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43, &end
#
# 122 ASP HA 123 LYS HN 3.71
&rst
ixpk= 0, nxpk= 0, iat=1725,1735, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21, &end
#
# 122 ASP HA 123 LYS HN 3.71
&rst
ixpk= 0, nxpk= 0, iat=1725,1735, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21, &end
#
# 122 ASP HA 123 LYS HN 3.71
&rst
ixpk= 0, nxpk= 0, iat=1725,1735, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21, &end
#
# 122 ASP HB2 123 LYS HN 5.09
&rst
ixpk= 0, nxpk= 0, iat=1727,1735, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59, &end
#
# 122 ASP HB2 123 LYS HN 5.09
&rst
ixpk= 0, nxpk= 0, iat=1727,1735, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59, &end
#
# 122 ASP HB2 123 LYS HN 5.09
&rst
ixpk= 0, nxpk= 0, iat=1727,1735, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59, &end
#
# 122 ASP HB3 122 ASP HB2 2.93
&rst
ixpk= 0, nxpk= 0, iat=1728,1727, r1= 1.30, r2= 1.80, r3= 2.93, r4= 3.43, &end
#
# 122 ASP HB3 123 LYS HN 5.06
&rst
ixpk= 0, nxpk= 0, iat=1728,1735, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56, &end
#
# 122 ASP HB3 123 LYS HN 5.06
&rst
ixpk= 0, nxpk= 0, iat=1728,1735, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56, &end
#
# 122 ASP HB3 123 LYS HN 5.06
&rst
ixpk= 0, nxpk= 0, iat=1728,1735, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56, &end
#
# 123 LYS HN 123 LYS HA 4.32
&rst
ixpk= 0, nxpk= 0, iat=1735,1737, r1= 1.30, r2= 1.80, r3= 4.32, r4= 4.82, &end
#
# 123 LYS HN 123 LYS HB2 3.75
&rst
ixpk= 0, nxpk= 0, iat=1735,1739, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25, &end
#
# 123 LYS HN 123 LYS HB2 3.75
&rst
ixpk= 0, nxpk= 0, iat=1735,1739, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25, &end
#
# 123 LYS HN 123 LYS HB2 3.75
&rst
ixpk= 0, nxpk= 0, iat=1735,1739, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25, &end
#
# 123 LYS HN 123 LYS HB3 4.28
&rst
ixpk= 0, nxpk= 0, iat=1735,1740, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78, &end
#
# 123 LYS HN 123 LYS HB3 4.28
&rst
ixpk= 0, nxpk= 0, iat=1735,1740, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78, &end
#
# 123 LYS HN 123 LYS HB3 4.28
&rst
ixpk= 0, nxpk= 0, iat=1735,1740, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78, &end
#
# 123 LYS HN 123 LYS HE2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1735,1748, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 123 LYS HN 123 LYS HE2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1735,1748, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 123 LYS HN 123 LYS HE2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1735,1748, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 123 LYS HN 123 LYS HG2 4.64
&rst
ixpk= 0, nxpk= 0, iat=1735,1742, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14, &end
#
# 123 LYS HN 123 LYS HG2 4.64
&rst
ixpk= 0, nxpk= 0, iat=1735,1742, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14, &end
#
# 123 LYS HN 123 LYS HG2 4.64
&rst
ixpk= 0, nxpk= 0, iat=1735,1742, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14, &end
#
# 123 LYS HN 123 LYS HG3 4.46
&rst
ixpk= 0, nxpk= 0, iat=1735,1743, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, &end
#
# 123 LYS HN 123 LYS HG3 4.46
&rst
ixpk= 0, nxpk= 0, iat=1735,1743, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, &end
#
# 123 LYS HN 123 LYS HG3 4.46
&rst
ixpk= 0, nxpk= 0, iat=1735,1743, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, &end
#
# 123 LYS HN 123 LYS QD 5.36
&rst
ixpk= 0, nxpk= 0, iat=1735, -1, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,
igr2=1745,1746,
&end
#
# 123 LYS HN 123 LYS QD 5.36
&rst
ixpk= 0, nxpk= 0, iat=1735, -1, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,
igr2=1745,1746,
&end
#
# 123 LYS HN 123 LYS QD 5.36
&rst
ixpk= 0, nxpk= 0, iat=1735, -1, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52,
igr2=1745,1746,
&end
#
# 123 LYS HN 124 ALA HN 5.16
&rst
ixpk= 0, nxpk= 0, iat=1735,1757, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66, &end
#
# 123 LYS HN 124 ALA HN 5.16
&rst
ixpk= 0, nxpk= 0, iat=1735,1757, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66, &end
#
# 123 LYS HN 124 ALA HN 5.16
&rst
ixpk= 0, nxpk= 0, iat=1735,1757, r1= 1.30, r2= 1.80, r3= 5.16, r4= 5.66, &end
#
# 123 LYS HN 124 ALA HN 5.28
&rst
ixpk= 0, nxpk= 0, iat=1735,1757, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 123 LYS HN 125 LEU QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat=1735, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1776,1777,1778,
&end
#
# 123 LYS HN 125 LEU QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat=1735, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1776,1777,1778,
&end
#
# 123 LYS HN 125 LEU QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat=1735, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1776,1777,1778,
&end
#
# 123 LYS HN 152 VAL HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1735,2137, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 123 LYS HN 152 VAL HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1735,2137, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 123 LYS HN 152 VAL HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1735,2137, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 123 LYS HN 152 VAL QG1 4.83
&rst
ixpk= 0, nxpk= 0, iat=1735, -1, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
igr2=2141,2142,2143,
&end
#
# 123 LYS HN 152 VAL QG1 4.83
&rst
ixpk= 0, nxpk= 0, iat=1735, -1, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
igr2=2141,2142,2143,
&end
#
# 123 LYS HN 152 VAL QG1 4.83
&rst
ixpk= 0, nxpk= 0, iat=1735, -1, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30,
igr2=2141,2142,2143,
&end
#
# 123 LYS HN 153 ILE HN 4.37
&rst
ixpk= 0, nxpk= 0, iat=1735,2151, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87, &end
#
# 123 LYS HN 153 ILE HN 4.37
&rst
ixpk= 0, nxpk= 0, iat=1735,2151, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87, &end
#
# 123 LYS HN 153 ILE HN 4.37
&rst
ixpk= 0, nxpk= 0, iat=1735,2151, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87, &end
#
# 123 LYS HN 153 ILE HB 4.75
&rst
ixpk= 0, nxpk= 0, iat=1735,2155, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, &end
#
# 123 LYS HN 153 ILE HB 4.75
&rst
ixpk= 0, nxpk= 0, iat=1735,2155, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, &end
#
# 123 LYS HN 153 ILE HB 4.75
&rst
ixpk= 0, nxpk= 0, iat=1735,2155, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, &end
#
# 123 LYS HN 153 ILE HG12 5.30
&rst
ixpk= 0, nxpk= 0, iat=1735,2161, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80, &end
#
# 123 LYS HN 153 ILE HG12 5.30
&rst
ixpk= 0, nxpk= 0, iat=1735,2161, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80, &end
#
# 123 LYS HN 153 ILE HG12 5.30
&rst
ixpk= 0, nxpk= 0, iat=1735,2161, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80, &end
#
# 123 LYS HN 153 ILE QD1 4.40
&rst
ixpk= 0, nxpk= 0, iat=1735, -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
igr2=2164,2165,2166,
&end
#
# 123 LYS HN 153 ILE QD1 4.40
&rst
ixpk= 0, nxpk= 0, iat=1735, -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
igr2=2164,2165,2166,
&end
#
# 123 LYS HN 153 ILE QD1 4.40
&rst
ixpk= 0, nxpk= 0, iat=1735, -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
igr2=2164,2165,2166,
&end
#
# 123 LYS HN 153 ILE QG2 4.73
&rst
ixpk= 0, nxpk= 0, iat=1735, -1, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
igr2=2157,2158,2159,
&end
#
# 123 LYS HN 153 ILE QG2 4.73
&rst
ixpk= 0, nxpk= 0, iat=1735, -1, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
igr2=2157,2158,2159,
&end
#
# 123 LYS HN 153 ILE QG2 4.73
&rst
ixpk= 0, nxpk= 0, iat=1735, -1, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
igr2=2157,2158,2159,
&end
#
# 123 LYS HA 123 LYS HB2 4.73
&rst
ixpk= 0, nxpk= 0, iat=1737,1739, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, &end
#
# 123 LYS HA 123 LYS HB3 4.10
&rst
ixpk= 0, nxpk= 0, iat=1737,1740, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60, &end
#
# 123 LYS HA 123 LYS HG2 4.61
&rst
ixpk= 0, nxpk= 0, iat=1737,1742, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 123 LYS HA 123 LYS HG2 4.61
&rst
ixpk= 0, nxpk= 0, iat=1737,1742, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 123 LYS HA 123 LYS HG2 4.61
&rst
ixpk= 0, nxpk= 0, iat=1737,1742, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 123 LYS HA 123 LYS HG3 4.11
&rst
ixpk= 0, nxpk= 0, iat=1737,1743, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 123 LYS HA 123 LYS HG3 4.11
&rst
ixpk= 0, nxpk= 0, iat=1737,1743, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 123 LYS HA 123 LYS HG3 4.11
&rst
ixpk= 0, nxpk= 0, iat=1737,1743, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 123 LYS HA 123 LYS QD 4.37
&rst
ixpk= 0, nxpk= 0, iat=1737, -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
igr2=1745,1746,
&end
#
# 123 LYS HA 123 LYS QD 4.37
&rst
ixpk= 0, nxpk= 0, iat=1737, -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
igr2=1745,1746,
&end
#
# 123 LYS HA 123 LYS QD 4.37
&rst
ixpk= 0, nxpk= 0, iat=1737, -1, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
igr2=1745,1746,
&end
#
# 123 LYS HA 124 ALA HN 2.97
&rst
ixpk= 0, nxpk= 0, iat=1737,1757, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 123 LYS HA 124 ALA HN 3.51
&rst
ixpk= 0, nxpk= 0, iat=1737,1757, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01, &end
#
# 123 LYS HA 124 ALA HN 3.51
&rst
ixpk= 0, nxpk= 0, iat=1737,1757, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01, &end
#
# 123 LYS HA 124 ALA HN 3.51
&rst
ixpk= 0, nxpk= 0, iat=1737,1757, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01, &end
#
# 123 LYS HB2 123 LYS HG3 3.99
&rst
ixpk= 0, nxpk= 0, iat=1739,1743, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49, &end
#
# 123 LYS HB2 124 ALA HN 3.99
&rst
ixpk= 0, nxpk= 0, iat=1739,1757, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49, &end
#
# 123 LYS HB2 124 ALA HN 3.99
&rst
ixpk= 0, nxpk= 0, iat=1739,1757, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49, &end
#
# 123 LYS HB2 124 ALA HN 3.99
&rst
ixpk= 0, nxpk= 0, iat=1739,1757, r1= 1.30, r2= 1.80, r3= 3.99, r4= 4.49, &end
#
# 123 LYS HB2 124 ALA HN 5.72
&rst
ixpk= 0, nxpk= 0, iat=1739,1757, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 123 LYS HB2 125 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1739,1767, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 123 LYS HB2 125 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1739,1767, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 123 LYS HB2 125 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1739,1767, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 123 LYS HB3 123 LYS HE2 5.07
&rst
ixpk= 0, nxpk= 0, iat=1740,1748, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, &end
#
# 123 LYS HB3 123 LYS HE2 5.07
&rst
ixpk= 0, nxpk= 0, iat=1740,1748, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, &end
#
# 123 LYS HB3 123 LYS HE2 5.07
&rst
ixpk= 0, nxpk= 0, iat=1740,1748, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, &end
#
# 123 LYS HB3 123 LYS HG3 4.51
&rst
ixpk= 0, nxpk= 0, iat=1740,1743, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01, &end
#
# 123 LYS HB3 123 LYS QD 2.96
&rst
ixpk= 0, nxpk= 0, iat=1740, -1, r1= 1.30, r2= 1.80, r3= 3.32, r4= 3.82,
igr2=1745,1746,
&end
#
# 123 LYS HB3 123 LYS QD 2.96
&rst
ixpk= 0, nxpk= 0, iat=1740, -1, r1= 1.30, r2= 1.80, r3= 3.32, r4= 3.82,
igr2=1745,1746,
&end
#
# 123 LYS HB3 123 LYS QD 2.96
&rst
ixpk= 0, nxpk= 0, iat=1740, -1, r1= 1.30, r2= 1.80, r3= 3.32, r4= 3.82,
igr2=1745,1746,
&end
#
# 123 LYS HB3 124 ALA HN 4.25
&rst
ixpk= 0, nxpk= 0, iat=1740,1757, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75, &end
#
# 123 LYS HB3 124 ALA HN 4.25
&rst
ixpk= 0, nxpk= 0, iat=1740,1757, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75, &end
#
# 123 LYS HB3 124 ALA HN 4.25
&rst
ixpk= 0, nxpk= 0, iat=1740,1757, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75, &end
#
# 123 LYS HE2 123 LYS HE3 3.56
&rst
ixpk= 0, nxpk= 0, iat=1748,1749, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06, &end
#
# 123 LYS HE2 124 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1748,1757, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 123 LYS HE2 124 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1748,1757, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 123 LYS HE2 124 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1748,1757, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 123 LYS HG2 123 LYS HE2 4.15
&rst
ixpk= 0, nxpk= 0, iat=1742,1748, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65, &end
#
# 123 LYS HG2 123 LYS HE2 4.15
&rst
ixpk= 0, nxpk= 0, iat=1742,1748, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65, &end
#
# 123 LYS HG2 123 LYS HE2 4.15
&rst
ixpk= 0, nxpk= 0, iat=1742,1748, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65, &end
#
# 123 LYS HG2 123 LYS HE3 4.77
&rst
ixpk= 0, nxpk= 0, iat=1742,1749, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27, &end
#
# 123 LYS HG3 123 LYS HE2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1743,1748, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 123 LYS QD 123 LYS HE2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1748, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1=1745,1746,
&end
#
# 123 LYS QD 124 ALA HN 4.97
&rst
ixpk= 0, nxpk= 0, iat= -1,1757, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr1=1745,1746,
&end
#
# 123 LYS QD 124 ALA HN 4.97
&rst
ixpk= 0, nxpk= 0, iat= -1,1757, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr1=1745,1746,
&end
#
# 123 LYS QD 124 ALA HN 4.97
&rst
ixpk= 0, nxpk= 0, iat= -1,1757, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08,
igr1=1745,1746,
&end
#
# 124 ALA HN 124 ALA HA 4.43
&rst
ixpk= 0, nxpk= 0, iat=1757,1759, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93, &end
#
# 124 ALA HN 124 ALA QB 3.64
&rst
ixpk= 0, nxpk= 0, iat=1757, -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
igr2=1761,1762,1763,
&end
#
# 124 ALA HN 124 ALA QB 3.64
&rst
ixpk= 0, nxpk= 0, iat=1757, -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
igr2=1761,1762,1763,
&end
#
# 124 ALA HN 124 ALA QB 3.64
&rst
ixpk= 0, nxpk= 0, iat=1757, -1, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87,
igr2=1761,1762,1763,
&end
#
# 124 ALA HN 125 LEU HN 4.95
&rst
ixpk= 0, nxpk= 0, iat=1757,1767, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45, &end
#
# 124 ALA HN 125 LEU HN 4.95
&rst
ixpk= 0, nxpk= 0, iat=1757,1767, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45, &end
#
# 124 ALA HN 125 LEU HN 4.95
&rst
ixpk= 0, nxpk= 0, iat=1757,1767, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45, &end
#
# 124 ALA HN 125 LEU HN 5.28
&rst
ixpk= 0, nxpk= 0, iat=1757,1767, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 124 ALA HN 152 VAL HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1757,2137, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 124 ALA HN 152 VAL HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1757,2137, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 124 ALA HN 152 VAL HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1757,2137, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 124 ALA HN 153 ILE HN 5.91
&rst
ixpk= 0, nxpk= 0, iat=1757,2151, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41, &end
#
# 124 ALA HN 153 ILE HN 5.91
&rst
ixpk= 0, nxpk= 0, iat=1757,2151, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41, &end
#
# 124 ALA HN 153 ILE HN 5.91
&rst
ixpk= 0, nxpk= 0, iat=1757,2151, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41, &end
#
# 124 ALA HN 153 ILE QD1 6.03
&rst
ixpk= 0, nxpk= 0, iat=1757, -1, r1= 1.30, r2= 1.80, r3= 7.24, r4= 7.74,
igr2=2164,2165,2166,
&end
#
# 124 ALA HN 153 ILE QD1 6.03
&rst
ixpk= 0, nxpk= 0, iat=1757, -1, r1= 1.30, r2= 1.80, r3= 7.24, r4= 7.74,
igr2=2164,2165,2166,
&end
#
# 124 ALA HN 153 ILE QD1 6.03
&rst
ixpk= 0, nxpk= 0, iat=1757, -1, r1= 1.30, r2= 1.80, r3= 7.24, r4= 7.74,
igr2=2164,2165,2166,
&end
#
# 124 ALA HA 125 LEU HN 2.97
&rst
ixpk= 0, nxpk= 0, iat=1759,1767, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 124 ALA HA 125 LEU HN 3.40
&rst
ixpk= 0, nxpk= 0, iat=1759,1767, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90, &end
#
# 124 ALA HA 125 LEU HN 3.40
&rst
ixpk= 0, nxpk= 0, iat=1759,1767, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90, &end
#
# 124 ALA HA 125 LEU HN 3.40
&rst
ixpk= 0, nxpk= 0, iat=1759,1767, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90, &end
#
# 124 ALA HA 125 LEU QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat=1759, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1776,1777,1778,
&end
#
# 124 ALA HA 125 LEU QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat=1759, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1776,1777,1778,
&end
#
# 124 ALA HA 125 LEU QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat=1759, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1776,1777,1778,
&end
#
# 124 ALA HA 126 MET QE 5.19
&rst
ixpk= 0, nxpk= 0, iat=1759, -1, r1= 1.30, r2= 1.80, r3= 6.23, r4= 6.73,
igr2=1797,1798,1799,
&end
#
# 124 ALA HA 126 MET QE 5.19
&rst
ixpk= 0, nxpk= 0, iat=1759, -1, r1= 1.30, r2= 1.80, r3= 6.23, r4= 6.73,
igr2=1797,1798,1799,
&end
#
# 124 ALA HA 126 MET QE 5.19
&rst
ixpk= 0, nxpk= 0, iat=1759, -1, r1= 1.30, r2= 1.80, r3= 6.23, r4= 6.73,
igr2=1797,1798,1799,
&end
#
# 124 ALA HA 152 VAL HN 4.64
&rst
ixpk= 0, nxpk= 0, iat=1759,2135, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14, &end
#
# 124 ALA HA 152 VAL HN 4.64
&rst
ixpk= 0, nxpk= 0, iat=1759,2135, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14, &end
#
# 124 ALA HA 152 VAL HN 4.64
&rst
ixpk= 0, nxpk= 0, iat=1759,2135, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14, &end
#
# 124 ALA HA 152 VAL HA 3.95
&rst
ixpk= 0, nxpk= 0, iat=1759,2137, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45, &end
#
# 124 ALA HA 152 VAL HA 3.95
&rst
ixpk= 0, nxpk= 0, iat=1759,2137, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45, &end
#
# 124 ALA HA 152 VAL HA 3.95
&rst
ixpk= 0, nxpk= 0, iat=1759,2137, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45, &end
#
# 124 ALA HA 152 VAL QG1 5.13
&rst
ixpk= 0, nxpk= 0, iat=1759, -1, r1= 1.30, r2= 1.80, r3= 6.16, r4= 6.66,
igr2=2141,2142,2143,
&end
#
# 124 ALA HA 152 VAL QG1 5.13
&rst
ixpk= 0, nxpk= 0, iat=1759, -1, r1= 1.30, r2= 1.80, r3= 6.16, r4= 6.66,
igr2=2141,2142,2143,
&end
#
# 124 ALA HA 152 VAL QG1 5.13
&rst
ixpk= 0, nxpk= 0, iat=1759, -1, r1= 1.30, r2= 1.80, r3= 6.16, r4= 6.66,
igr2=2141,2142,2143,
&end
#
# 124 ALA HA 152 VAL QG2 4.73
&rst
ixpk= 0, nxpk= 0, iat=1759, -1, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
igr2=2145,2146,2147,
&end
#
# 124 ALA HA 152 VAL QG2 4.73
&rst
ixpk= 0, nxpk= 0, iat=1759, -1, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
igr2=2145,2146,2147,
&end
#
# 124 ALA HA 152 VAL QG2 4.73
&rst
ixpk= 0, nxpk= 0, iat=1759, -1, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
igr2=2145,2146,2147,
&end
#
# 124 ALA HA 153 ILE HN 5.02
&rst
ixpk= 0, nxpk= 0, iat=1759,2151, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52, &end
#
# 124 ALA HA 153 ILE HN 5.02
&rst
ixpk= 0, nxpk= 0, iat=1759,2151, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52, &end
#
# 124 ALA HA 153 ILE HN 5.02
&rst
ixpk= 0, nxpk= 0, iat=1759,2151, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52, &end
#
# 124 ALA QB 125 LEU HN 5.72
&rst
ixpk= 0, nxpk= 0, iat= -1,1767, r1= 1.30, r2= 1.80, r3= 6.87, r4= 7.37,
igr1=1761,1762,1763,
&end
#
# 124 ALA QB 124 ALA HA 3.76
&rst
ixpk= 0, nxpk= 0, iat= -1,1759, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02,
igr1=1761,1762,1763,
&end
#
# 124 ALA QB 125 LEU HN 4.10
&rst
ixpk= 0, nxpk= 0, iat= -1,1767, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
igr1=1761,1762,1763,
&end
#
# 124 ALA QB 125 LEU HN 4.10
&rst
ixpk= 0, nxpk= 0, iat= -1,1767, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
igr1=1761,1762,1763,
&end
#
# 124 ALA QB 125 LEU HN 4.10
&rst
ixpk= 0, nxpk= 0, iat= -1,1767, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
igr1=1761,1762,1763,
&end
#
# 124 ALA QB 126 MET QE 3.46
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,
igr1=1761,1762,1763,
igr2=1797,1798,1799,
&end
#
# 124 ALA QB 126 MET QE 3.46
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,
igr1=1761,1762,1763,
igr2=1797,1798,1799,
&end
#
# 124 ALA QB 126 MET QE 3.46
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49,
igr1=1761,1762,1763,
igr2=1797,1798,1799,
&end
#
# 124 ALA QB 151 GLY HN 4.33
&rst
ixpk= 0, nxpk= 0, iat= -1,2128, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
igr1=1761,1762,1763,
&end
#
# 124 ALA QB 151 GLY HN 4.33
&rst
ixpk= 0, nxpk= 0, iat= -1,2128, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
igr1=1761,1762,1763,
&end
#
# 124 ALA QB 151 GLY HN 4.33
&rst
ixpk= 0, nxpk= 0, iat= -1,2128, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
igr1=1761,1762,1763,
&end
#
# 124 ALA QB 152 VAL HN 5.73
&rst
ixpk= 0, nxpk= 0, iat= -1,2135, r1= 1.30, r2= 1.80, r3= 6.88, r4= 7.38,
igr1=1761,1762,1763,
&end
#
# 124 ALA QB 152 VAL HN 5.73
&rst
ixpk= 0, nxpk= 0, iat= -1,2135, r1= 1.30, r2= 1.80, r3= 6.88, r4= 7.38,
igr1=1761,1762,1763,
&end
#
# 124 ALA QB 152 VAL HN 5.73
&rst
ixpk= 0, nxpk= 0, iat= -1,2135, r1= 1.30, r2= 1.80, r3= 6.88, r4= 7.38,
igr1=1761,1762,1763,
&end
#
# 124 ALA QB 152 VAL HA 4.46
&rst
ixpk= 0, nxpk= 0, iat= -1,2137, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
igr1=1761,1762,1763,
&end
#
# 124 ALA QB 152 VAL HA 4.46
&rst
ixpk= 0, nxpk= 0, iat= -1,2137, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
igr1=1761,1762,1763,
&end
#
# 124 ALA QB 152 VAL HA 4.46
&rst
ixpk= 0, nxpk= 0, iat= -1,2137, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
igr1=1761,1762,1763,
&end
#
# 124 ALA QB 152 VAL QG1 5.38
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.76, r4= 8.26,
igr1=1761,1762,1763,
igr2=2141,2142,2143,
&end
#
# 124 ALA QB 152 VAL QG1 5.38
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.76, r4= 8.26,
igr1=1761,1762,1763,
igr2=2141,2142,2143,
&end
#
# 124 ALA QB 152 VAL QG1 5.38
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.76, r4= 8.26,
igr1=1761,1762,1763,
igr2=2141,2142,2143,
&end
#
# 124 ALA QB 153 ILE HN 5.49
&rst
ixpk= 0, nxpk= 0, iat= -1,2151, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
igr1=1761,1762,1763,
&end
#
# 124 ALA QB 153 ILE HN 5.49
&rst
ixpk= 0, nxpk= 0, iat= -1,2151, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
igr1=1761,1762,1763,
&end
#
# 124 ALA QB 153 ILE HN 5.49
&rst
ixpk= 0, nxpk= 0, iat= -1,2151, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
igr1=1761,1762,1763,
&end
#
# 125 LEU HN 125 LEU HA 4.74
&rst
ixpk= 0, nxpk= 0, iat=1767,1769, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24, &end
#
# 125 LEU HN 125 LEU HB2 4.07
&rst
ixpk= 0, nxpk= 0, iat=1767,1771, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57, &end
#
# 125 LEU HN 125 LEU HB2 4.07
&rst
ixpk= 0, nxpk= 0, iat=1767,1771, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57, &end
#
# 125 LEU HN 125 LEU HB2 4.07
&rst
ixpk= 0, nxpk= 0, iat=1767,1771, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57, &end
#
# 125 LEU HN 125 LEU HB3 4.18
&rst
ixpk= 0, nxpk= 0, iat=1767,1772, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68, &end
#
# 125 LEU HN 125 LEU HB3 4.18
&rst
ixpk= 0, nxpk= 0, iat=1767,1772, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68, &end
#
# 125 LEU HN 125 LEU HB3 4.18
&rst
ixpk= 0, nxpk= 0, iat=1767,1772, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68, &end
#
# 125 LEU HN 125 LEU HG 4.44
&rst
ixpk= 0, nxpk= 0, iat=1767,1774, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94, &end
#
# 125 LEU HN 125 LEU HG 4.44
&rst
ixpk= 0, nxpk= 0, iat=1767,1774, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94, &end
#
# 125 LEU HN 125 LEU HG 4.44
&rst
ixpk= 0, nxpk= 0, iat=1767,1774, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94, &end
#
# 125 LEU HN 125 LEU QD1 4.08
&rst
ixpk= 0, nxpk= 0, iat=1767, -1, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,
igr2=1776,1777,1778,
&end
#
# 125 LEU HN 125 LEU QD1 4.08
&rst
ixpk= 0, nxpk= 0, iat=1767, -1, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,
igr2=1776,1777,1778,
&end
#
# 125 LEU HN 125 LEU QD1 4.08
&rst
ixpk= 0, nxpk= 0, iat=1767, -1, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,
igr2=1776,1777,1778,
&end
#
# 125 LEU HN 125 LEU QD2 5.35
&rst
ixpk= 0, nxpk= 0, iat=1767, -1, r1= 1.30, r2= 1.80, r3= 6.43, r4= 6.93,
igr2=1780,1781,1782,
&end
#
# 125 LEU HN 125 LEU QD2 5.35
&rst
ixpk= 0, nxpk= 0, iat=1767, -1, r1= 1.30, r2= 1.80, r3= 6.43, r4= 6.93,
igr2=1780,1781,1782,
&end
#
# 125 LEU HN 125 LEU QD2 5.35
&rst
ixpk= 0, nxpk= 0, iat=1767, -1, r1= 1.30, r2= 1.80, r3= 6.43, r4= 6.93,
igr2=1780,1781,1782,
&end
#
# 125 LEU HN 126 MET HN 5.28
&rst
ixpk= 0, nxpk= 0, iat=1767,1786, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 125 LEU HN 126 MET HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1767,1786, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 125 LEU HN 126 MET HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1767,1786, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 125 LEU HN 126 MET HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1767,1786, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 125 LEU HN 150 CYX HA 5.32
&rst
ixpk= 0, nxpk= 0, iat=1767,2120, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82, &end
#
# 125 LEU HN 150 CYX HA 5.32
&rst
ixpk= 0, nxpk= 0, iat=1767,2120, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82, &end
#
# 125 LEU HN 150 CYX HA 5.32
&rst
ixpk= 0, nxpk= 0, iat=1767,2120, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82, &end
#
# 125 LEU HN 151 GLY HN 3.86
&rst
ixpk= 0, nxpk= 0, iat=1767,2128, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 125 LEU HN 151 GLY HN 3.86
&rst
ixpk= 0, nxpk= 0, iat=1767,2128, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 125 LEU HN 151 GLY HN 3.86
&rst
ixpk= 0, nxpk= 0, iat=1767,2128, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 125 LEU HN 151 GLY HA3 6.02
&rst
ixpk= 0, nxpk= 0, iat=1767,2131, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52, &end
#
# 125 LEU HN 151 GLY HA3 6.02
&rst
ixpk= 0, nxpk= 0, iat=1767,2131, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52, &end
#
# 125 LEU HN 151 GLY HA3 6.02
&rst
ixpk= 0, nxpk= 0, iat=1767,2131, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52, &end
#
# 125 LEU HN 152 VAL HN 5.41
&rst
ixpk= 0, nxpk= 0, iat=1767,2135, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91, &end
#
# 125 LEU HN 152 VAL HN 5.41
&rst
ixpk= 0, nxpk= 0, iat=1767,2135, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91, &end
#
# 125 LEU HN 152 VAL HN 5.41
&rst
ixpk= 0, nxpk= 0, iat=1767,2135, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91, &end
#
# 125 LEU HN 152 VAL HA 4.26
&rst
ixpk= 0, nxpk= 0, iat=1767,2137, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76, &end
#
# 125 LEU HN 152 VAL HA 4.26
&rst
ixpk= 0, nxpk= 0, iat=1767,2137, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76, &end
#
# 125 LEU HN 152 VAL HA 4.26
&rst
ixpk= 0, nxpk= 0, iat=1767,2137, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76, &end
#
# 125 LEU HN 152 VAL QG1 5.87
&rst
ixpk= 0, nxpk= 0, iat=1767, -1, r1= 1.30, r2= 1.80, r3= 7.05, r4= 7.55,
igr2=2141,2142,2143,
&end
#
# 125 LEU HN 152 VAL QG1 5.87
&rst
ixpk= 0, nxpk= 0, iat=1767, -1, r1= 1.30, r2= 1.80, r3= 7.05, r4= 7.55,
igr2=2141,2142,2143,
&end
#
# 125 LEU HN 152 VAL QG1 5.87
&rst
ixpk= 0, nxpk= 0, iat=1767, -1, r1= 1.30, r2= 1.80, r3= 7.05, r4= 7.55,
igr2=2141,2142,2143,
&end
#
# 125 LEU HN 152 VAL QG2 5.17
&rst
ixpk= 0, nxpk= 0, iat=1767, -1, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,
igr2=2145,2146,2147,
&end
#
# 125 LEU HN 152 VAL QG2 5.17
&rst
ixpk= 0, nxpk= 0, iat=1767, -1, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,
igr2=2145,2146,2147,
&end
#
# 125 LEU HN 152 VAL QG2 5.17
&rst
ixpk= 0, nxpk= 0, iat=1767, -1, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,
igr2=2145,2146,2147,
&end
#
# 125 LEU HN 153 ILE HN 5.00
&rst
ixpk= 0, nxpk= 0, iat=1767,2151, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 125 LEU HN 153 ILE HN 5.00
&rst
ixpk= 0, nxpk= 0, iat=1767,2151, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 125 LEU HN 153 ILE HN 5.00
&rst
ixpk= 0, nxpk= 0, iat=1767,2151, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 125 LEU HN 153 ILE HG12 4.98
&rst
ixpk= 0, nxpk= 0, iat=1767,2161, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48, &end
#
# 125 LEU HN 153 ILE HG12 4.98
&rst
ixpk= 0, nxpk= 0, iat=1767,2161, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48, &end
#
# 125 LEU HN 153 ILE HG12 4.98
&rst
ixpk= 0, nxpk= 0, iat=1767,2161, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48, &end
#
# 125 LEU HN 153 ILE QD1 5.02
&rst
ixpk= 0, nxpk= 0, iat=1767, -1, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
igr2=2164,2165,2166,
&end
#
# 125 LEU HN 153 ILE QD1 5.02
&rst
ixpk= 0, nxpk= 0, iat=1767, -1, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
igr2=2164,2165,2166,
&end
#
# 125 LEU HN 153 ILE QD1 5.02
&rst
ixpk= 0, nxpk= 0, iat=1767, -1, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
igr2=2164,2165,2166,
&end
#
# 125 LEU HA 125 LEU HB2 5.37
&rst
ixpk= 0, nxpk= 0, iat=1769,1771, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87, &end
#
# 125 LEU HA 125 LEU HB3 5.24
&rst
ixpk= 0, nxpk= 0, iat=1769,1772, r1= 1.30, r2= 1.80, r3= 5.24, r4= 5.74, &end
#
# 125 LEU HA 125 LEU HG 6.02
&rst
ixpk= 0, nxpk= 0, iat=1769,1774, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52, &end
#
# 125 LEU HA 125 LEU QD1 4.49
&rst
ixpk= 0, nxpk= 0, iat=1769, -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr2=1776,1777,1778,
&end
#
# 125 LEU HA 125 LEU QD1 4.49
&rst
ixpk= 0, nxpk= 0, iat=1769, -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr2=1776,1777,1778,
&end
#
# 125 LEU HA 125 LEU QD1 4.49
&rst
ixpk= 0, nxpk= 0, iat=1769, -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr2=1776,1777,1778,
&end
#
# 125 LEU HA 125 LEU QD2 4.17
&rst
ixpk= 0, nxpk= 0, iat=1769, -1, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
igr2=1780,1781,1782,
&end
#
# 125 LEU HA 125 LEU QD2 4.17
&rst
ixpk= 0, nxpk= 0, iat=1769, -1, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
igr2=1780,1781,1782,
&end
#
# 125 LEU HA 125 LEU QD2 4.17
&rst
ixpk= 0, nxpk= 0, iat=1769, -1, r1= 1.30, r2= 1.80, r3= 5.01, r4= 5.51,
igr2=1780,1781,1782,
&end
#
# 125 LEU HA 126 MET HN 2.97
&rst
ixpk= 0, nxpk= 0, iat=1769,1786, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 125 LEU HA 126 MET HN 3.65
&rst
ixpk= 0, nxpk= 0, iat=1769,1786, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15, &end
#
# 125 LEU HA 126 MET HN 3.65
&rst
ixpk= 0, nxpk= 0, iat=1769,1786, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15, &end
#
# 125 LEU HA 126 MET HN 3.65
&rst
ixpk= 0, nxpk= 0, iat=1769,1786, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15, &end
#
# 125 LEU HA 153 ILE QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat=1769, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=2164,2165,2166,
&end
#
# 125 LEU HA 153 ILE QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat=1769, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=2164,2165,2166,
&end
#
# 125 LEU HA 153 ILE QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat=1769, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=2164,2165,2166,
&end
#
# 125 LEU HB2 125 LEU QD2 4.31
&rst
ixpk= 0, nxpk= 0, iat=1771, -1, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
igr2=1780,1781,1782,
&end
#
# 125 LEU HB2 125 LEU QD2 4.31
&rst
ixpk= 0, nxpk= 0, iat=1771, -1, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
igr2=1780,1781,1782,
&end
#
# 125 LEU HB2 125 LEU QD2 4.31
&rst
ixpk= 0, nxpk= 0, iat=1771, -1, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
igr2=1780,1781,1782,
&end
#
# 125 LEU HB2 126 MET HN 5.72
&rst
ixpk= 0, nxpk= 0, iat=1771,1786, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 125 LEU HB2 126 MET HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1771,1786, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 125 LEU HB2 126 MET HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1771,1786, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 125 LEU HB2 126 MET HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1771,1786, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 125 LEU HB2 151 GLY HN 5.07
&rst
ixpk= 0, nxpk= 0, iat=1771,2128, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, &end
#
# 125 LEU HB2 151 GLY HN 5.07
&rst
ixpk= 0, nxpk= 0, iat=1771,2128, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, &end
#
# 125 LEU HB2 151 GLY HN 5.07
&rst
ixpk= 0, nxpk= 0, iat=1771,2128, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, &end
#
# 125 LEU HB3 125 LEU HB2 3.61
&rst
ixpk= 0, nxpk= 0, iat=1772,1771, r1= 1.30, r2= 1.80, r3= 3.61, r4= 4.11, &end
#
# 125 LEU HB3 125 LEU QD2 5.33
&rst
ixpk= 0, nxpk= 0, iat=1772, -1, r1= 1.30, r2= 1.80, r3= 6.40, r4= 6.90,
igr2=1780,1781,1782,
&end
#
# 125 LEU HB3 126 MET HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1772,1786, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 125 LEU HB3 126 MET HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1772,1786, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 125 LEU HB3 126 MET HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1772,1786, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 125 LEU HB3 151 GLY HN 5.94
&rst
ixpk= 0, nxpk= 0, iat=1772,2128, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44, &end
#
# 125 LEU HB3 151 GLY HN 5.94
&rst
ixpk= 0, nxpk= 0, iat=1772,2128, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44, &end
#
# 125 LEU HB3 151 GLY HN 5.94
&rst
ixpk= 0, nxpk= 0, iat=1772,2128, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44, &end
#
# 125 LEU HG 126 MET HN 5.36
&rst
ixpk= 0, nxpk= 0, iat=1774,1786, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86, &end
#
# 125 LEU HG 126 MET HN 5.36
&rst
ixpk= 0, nxpk= 0, iat=1774,1786, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86, &end
#
# 125 LEU HG 126 MET HN 5.36
&rst
ixpk= 0, nxpk= 0, iat=1774,1786, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86, &end
#
# 125 LEU QD1 126 MET HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1786, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1776,1777,1778,
&end
#
# 125 LEU QD1 126 MET HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1786, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1776,1777,1778,
&end
#
# 125 LEU QD1 126 MET HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1786, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1776,1777,1778,
&end
#
# 125 LEU QD1 151 GLY HN 6.01
&rst
ixpk= 0, nxpk= 0, iat= -1,2128, r1= 1.30, r2= 1.80, r3= 7.22, r4= 7.72,
igr1=1776,1777,1778,
&end
#
# 125 LEU QD1 151 GLY HN 6.01
&rst
ixpk= 0, nxpk= 0, iat= -1,2128, r1= 1.30, r2= 1.80, r3= 7.22, r4= 7.72,
igr1=1776,1777,1778,
&end
#
# 125 LEU QD1 151 GLY HN 6.01
&rst
ixpk= 0, nxpk= 0, iat= -1,2128, r1= 1.30, r2= 1.80, r3= 7.22, r4= 7.72,
igr1=1776,1777,1778,
&end
#
# 125 LEU QD1 152 VAL HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,2135, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1776,1777,1778,
&end
#
# 125 LEU QD1 152 VAL HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,2135, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1776,1777,1778,
&end
#
# 125 LEU QD1 152 VAL HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,2135, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1776,1777,1778,
&end
#
# 125 LEU QD2 125 LEU HG 3.72
&rst
ixpk= 0, nxpk= 0, iat= -1,1774, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
igr1=1780,1781,1782,
&end
#
# 125 LEU QD2 125 LEU QD1 3.54
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,
igr1=1780,1781,1782,
igr2=1776,1777,1778,
&end
#
# 125 LEU QD2 151 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,2128, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1780,1781,1782,
&end
#
# 125 LEU QD2 151 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,2128, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1780,1781,1782,
&end
#
# 125 LEU QD2 151 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,2128, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1780,1781,1782,
&end
#
# 125 LEU QD2 151 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,2131, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1780,1781,1782,
&end
#
# 125 LEU QD2 151 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,2131, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1780,1781,1782,
&end
#
# 125 LEU QD2 151 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,2131, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1780,1781,1782,
&end
#
# 125 LEU QD2 153 ILE HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,2151, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1780,1781,1782,
&end
#
# 125 LEU QD2 153 ILE HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,2151, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1780,1781,1782,
&end
#
# 125 LEU QD2 153 ILE HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,2151, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1780,1781,1782,
&end
#
# 125 LEU QD2 153 ILE QD1 4.19
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54,
igr1=1780,1781,1782,
igr2=2164,2165,2166,
&end
#
# 125 LEU QD2 153 ILE QD1 4.19
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54,
igr1=1780,1781,1782,
igr2=2164,2165,2166,
&end
#
# 125 LEU QD2 153 ILE QD1 4.19
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54,
igr1=1780,1781,1782,
igr2=2164,2165,2166,
&end
#
# 126 MET HN 126 MET HA 5.27
&rst
ixpk= 0, nxpk= 0, iat=1786,1788, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77, &end
#
# 126 MET HN 126 MET HB2 4.41
&rst
ixpk= 0, nxpk= 0, iat=1786,1790, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, &end
#
# 126 MET HN 126 MET HB2 4.41
&rst
ixpk= 0, nxpk= 0, iat=1786,1790, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, &end
#
# 126 MET HN 126 MET HB2 4.41
&rst
ixpk= 0, nxpk= 0, iat=1786,1790, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, &end
#
# 126 MET HN 126 MET HB3 4.43
&rst
ixpk= 0, nxpk= 0, iat=1786,1791, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93, &end
#
# 126 MET HN 126 MET HB3 4.43
&rst
ixpk= 0, nxpk= 0, iat=1786,1791, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93, &end
#
# 126 MET HN 126 MET HB3 4.43
&rst
ixpk= 0, nxpk= 0, iat=1786,1791, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93, &end
#
# 126 MET HN 126 MET HG2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1786,1793, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 126 MET HN 126 MET HG2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1786,1793, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 126 MET HN 126 MET HG2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1786,1793, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 126 MET HN 126 MET QE 5.00
&rst
ixpk= 0, nxpk= 0, iat=1786, -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr2=1797,1798,1799,
&end
#
# 126 MET HN 126 MET QE 5.00
&rst
ixpk= 0, nxpk= 0, iat=1786, -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr2=1797,1798,1799,
&end
#
# 126 MET HN 126 MET QE 5.00
&rst
ixpk= 0, nxpk= 0, iat=1786, -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr2=1797,1798,1799,
&end
#
# 126 MET HN 127 ILE HN 4.66
&rst
ixpk= 0, nxpk= 0, iat=1786,1803, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16, &end
#
# 126 MET HN 127 ILE HN 4.66
&rst
ixpk= 0, nxpk= 0, iat=1786,1803, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16, &end
#
# 126 MET HN 127 ILE HN 4.66
&rst
ixpk= 0, nxpk= 0, iat=1786,1803, r1= 1.30, r2= 1.80, r3= 4.66, r4= 5.16, &end
#
# 126 MET HN 127 ILE HN 5.28
&rst
ixpk= 0, nxpk= 0, iat=1786,1803, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 126 MET HN 150 CYX HA 6.00
&rst
ixpk= 0, nxpk= 0, iat=1786,2120, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 126 MET HN 150 CYX HA 6.00
&rst
ixpk= 0, nxpk= 0, iat=1786,2120, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 126 MET HN 150 CYX HA 6.00
&rst
ixpk= 0, nxpk= 0, iat=1786,2120, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 126 MET HA 126 MET HB2 5.25
&rst
ixpk= 0, nxpk= 0, iat=1788,1790, r1= 1.30, r2= 1.80, r3= 5.25, r4= 5.75, &end
#
# 126 MET HA 126 MET HB3 5.45
&rst
ixpk= 0, nxpk= 0, iat=1788,1791, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95, &end
#
# 126 MET HA 126 MET HG2 4.17
&rst
ixpk= 0, nxpk= 0, iat=1788,1793, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67, &end
#
# 126 MET HA 126 MET HG2 4.17
&rst
ixpk= 0, nxpk= 0, iat=1788,1793, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67, &end
#
# 126 MET HA 126 MET HG2 4.17
&rst
ixpk= 0, nxpk= 0, iat=1788,1793, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67, &end
#
# 126 MET HA 126 MET HG3 5.50
&rst
ixpk= 0, nxpk= 0, iat=1788,1794, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 126 MET HA 127 ILE HN 2.97
&rst
ixpk= 0, nxpk= 0, iat=1788,1803, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 126 MET HA 127 ILE HN 3.44
&rst
ixpk= 0, nxpk= 0, iat=1788,1803, r1= 1.30, r2= 1.80, r3= 3.44, r4= 3.94, &end
#
# 126 MET HA 127 ILE HN 3.44
&rst
ixpk= 0, nxpk= 0, iat=1788,1803, r1= 1.30, r2= 1.80, r3= 3.44, r4= 3.94, &end
#
# 126 MET HA 127 ILE HN 3.44
&rst
ixpk= 0, nxpk= 0, iat=1788,1803, r1= 1.30, r2= 1.80, r3= 3.44, r4= 3.94, &end
#
# 126 MET HA 127 ILE HB 4.95
&rst
ixpk= 0, nxpk= 0, iat=1788,1807, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45, &end
#
# 126 MET HA 127 ILE HB 4.95
&rst
ixpk= 0, nxpk= 0, iat=1788,1807, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45, &end
#
# 126 MET HA 127 ILE HB 4.95
&rst
ixpk= 0, nxpk= 0, iat=1788,1807, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45, &end
#
# 126 MET HA 127 ILE HG12 5.06
&rst
ixpk= 0, nxpk= 0, iat=1788,1813, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56, &end
#
# 126 MET HA 127 ILE HG12 5.06
&rst
ixpk= 0, nxpk= 0, iat=1788,1813, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56, &end
#
# 126 MET HA 127 ILE HG12 5.06
&rst
ixpk= 0, nxpk= 0, iat=1788,1813, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56, &end
#
# 126 MET HA 127 ILE HG13 6.05
&rst
ixpk= 0, nxpk= 0, iat=1788,1814, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 126 MET HA 127 ILE HG13 6.05
&rst
ixpk= 0, nxpk= 0, iat=1788,1814, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 126 MET HA 127 ILE HG13 6.05
&rst
ixpk= 0, nxpk= 0, iat=1788,1814, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 126 MET HA 150 CYX HA 4.41
&rst
ixpk= 0, nxpk= 0, iat=1788,2120, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, &end
#
# 126 MET HA 150 CYX HA 4.41
&rst
ixpk= 0, nxpk= 0, iat=1788,2120, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, &end
#
# 126 MET HA 150 CYX HA 4.41
&rst
ixpk= 0, nxpk= 0, iat=1788,2120, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, &end
#
# 126 MET HA 150 CYX HB2 6.02
&rst
ixpk= 0, nxpk= 0, iat=1788,2123, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52, &end
#
# 126 MET HA 150 CYX HB2 6.02
&rst
ixpk= 0, nxpk= 0, iat=1788,2123, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52, &end
#
# 126 MET HA 150 CYX HB2 6.02
&rst
ixpk= 0, nxpk= 0, iat=1788,2123, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52, &end
#
# 126 MET HB2 126 MET HB3 4.50
&rst
ixpk= 0, nxpk= 0, iat=1790,1791, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 126 MET HB2 126 MET HG2 5.38
&rst
ixpk= 0, nxpk= 0, iat=1790,1793, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88, &end
#
# 126 MET HB2 126 MET HG3 5.08
&rst
ixpk= 0, nxpk= 0, iat=1790,1794, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58, &end
#
# 126 MET HB2 126 MET QE 4.81
&rst
ixpk= 0, nxpk= 0, iat=1790, -1, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr2=1797,1798,1799,
&end
#
# 126 MET HB2 126 MET QE 4.81
&rst
ixpk= 0, nxpk= 0, iat=1790, -1, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr2=1797,1798,1799,
&end
#
# 126 MET HB2 126 MET QE 4.81
&rst
ixpk= 0, nxpk= 0, iat=1790, -1, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28,
igr2=1797,1798,1799,
&end
#
# 126 MET HB2 127 ILE HN 5.27
&rst
ixpk= 0, nxpk= 0, iat=1790,1803, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77, &end
#
# 126 MET HB2 127 ILE HN 5.27
&rst
ixpk= 0, nxpk= 0, iat=1790,1803, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77, &end
#
# 126 MET HB2 127 ILE HN 5.27
&rst
ixpk= 0, nxpk= 0, iat=1790,1803, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77, &end
#
# 126 MET HB2 127 ILE HN 5.72
&rst
ixpk= 0, nxpk= 0, iat=1790,1803, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 126 MET HB2 127 ILE HA 5.71
&rst
ixpk= 0, nxpk= 0, iat=1790,1805, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21, &end
#
# 126 MET HB2 127 ILE HA 5.71
&rst
ixpk= 0, nxpk= 0, iat=1790,1805, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21, &end
#
# 126 MET HB2 127 ILE HA 5.71
&rst
ixpk= 0, nxpk= 0, iat=1790,1805, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21, &end
#
# 126 MET HB2 148 TYR HN 4.95
&rst
ixpk= 0, nxpk= 0, iat=1790,2087, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45, &end
#
# 126 MET HB2 148 TYR HN 4.95
&rst
ixpk= 0, nxpk= 0, iat=1790,2087, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45, &end
#
# 126 MET HB2 148 TYR HN 4.95
&rst
ixpk= 0, nxpk= 0, iat=1790,2087, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45, &end
#
# 126 MET HB2 149 ALA HN 4.88
&rst
ixpk= 0, nxpk= 0, iat=1790,2108, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38, &end
#
# 126 MET HB2 149 ALA HN 4.88
&rst
ixpk= 0, nxpk= 0, iat=1790,2108, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38, &end
#
# 126 MET HB2 149 ALA HN 4.88
&rst
ixpk= 0, nxpk= 0, iat=1790,2108, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38, &end
#
# 126 MET HB3 126 MET HG2 5.67
&rst
ixpk= 0, nxpk= 0, iat=1791,1793, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17, &end
#
# 126 MET HB3 150 CYX HA 5.80
&rst
ixpk= 0, nxpk= 0, iat=1791,2120, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30, &end
#
# 126 MET HB3 150 CYX HA 5.80
&rst
ixpk= 0, nxpk= 0, iat=1791,2120, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30, &end
#
# 126 MET HB3 150 CYX HA 5.80
&rst
ixpk= 0, nxpk= 0, iat=1791,2120, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30, &end
#
# 126 MET HG2 126 MET QE 5.04
&rst
ixpk= 0, nxpk= 0, iat=1793, -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
igr2=1797,1798,1799,
&end
#
# 126 MET HG2 126 MET QE 5.04
&rst
ixpk= 0, nxpk= 0, iat=1793, -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
igr2=1797,1798,1799,
&end
#
# 126 MET HG2 126 MET QE 5.04
&rst
ixpk= 0, nxpk= 0, iat=1793, -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
igr2=1797,1798,1799,
&end
#
# 126 MET HG2 149 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1793,2108, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 126 MET HG2 149 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1793,2108, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 126 MET HG2 149 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1793,2108, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 126 MET HG2 150 CYX HA 3.96
&rst
ixpk= 0, nxpk= 0, iat=1793,2120, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46, &end
#
# 126 MET HG2 150 CYX HA 3.96
&rst
ixpk= 0, nxpk= 0, iat=1793,2120, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46, &end
#
# 126 MET HG2 150 CYX HA 3.96
&rst
ixpk= 0, nxpk= 0, iat=1793,2120, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46, &end
#
# 126 MET HG2 150 CYX HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1793,2123, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 126 MET HG2 150 CYX HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1793,2123, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 126 MET HG2 150 CYX HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1793,2123, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 126 MET HG3 127 ILE HN 5.71
&rst
ixpk= 0, nxpk= 0, iat=1794,1803, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21, &end
#
# 126 MET HG3 127 ILE HN 5.71
&rst
ixpk= 0, nxpk= 0, iat=1794,1803, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21, &end
#
# 126 MET HG3 127 ILE HN 5.71
&rst
ixpk= 0, nxpk= 0, iat=1794,1803, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21, &end
#
# 126 MET HG3 150 CYX HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1794,2118, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 126 MET HG3 150 CYX HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1794,2118, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 126 MET HG3 150 CYX HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1794,2118, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 126 MET HG3 150 CYX HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1794,2120, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 126 MET HG3 150 CYX HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1794,2120, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 126 MET HG3 150 CYX HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1794,2120, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 126 MET HG3 150 CYX HB2 5.13
&rst
ixpk= 0, nxpk= 0, iat=1794,2123, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63, &end
#
# 126 MET HG3 150 CYX HB2 5.13
&rst
ixpk= 0, nxpk= 0, iat=1794,2123, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63, &end
#
# 126 MET HG3 150 CYX HB2 5.13
&rst
ixpk= 0, nxpk= 0, iat=1794,2123, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63, &end
#
# 126 MET QE 150 CYX HA 5.63
&rst
ixpk= 0, nxpk= 0, iat= -1,2120, r1= 1.30, r2= 1.80, r3= 6.76, r4= 7.26,
igr1=1797,1798,1799,
&end
#
# 126 MET QE 150 CYX HA 5.63
&rst
ixpk= 0, nxpk= 0, iat= -1,2120, r1= 1.30, r2= 1.80, r3= 6.76, r4= 7.26,
igr1=1797,1798,1799,
&end
#
# 126 MET QE 150 CYX HA 5.63
&rst
ixpk= 0, nxpk= 0, iat= -1,2120, r1= 1.30, r2= 1.80, r3= 6.76, r4= 7.26,
igr1=1797,1798,1799,
&end
#
# 127 ILE HN 127 ILE HA 5.37
&rst
ixpk= 0, nxpk= 0, iat=1803,1805, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87, &end
#
# 127 ILE HN 127 ILE HB 4.17
&rst
ixpk= 0, nxpk= 0, iat=1803,1807, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67, &end
#
# 127 ILE HN 127 ILE HB 4.17
&rst
ixpk= 0, nxpk= 0, iat=1803,1807, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67, &end
#
# 127 ILE HN 127 ILE HB 4.17
&rst
ixpk= 0, nxpk= 0, iat=1803,1807, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67, &end
#
# 127 ILE HN 127 ILE HG12 4.60
&rst
ixpk= 0, nxpk= 0, iat=1803,1813, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 127 ILE HN 127 ILE HG12 4.60
&rst
ixpk= 0, nxpk= 0, iat=1803,1813, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 127 ILE HN 127 ILE HG12 4.60
&rst
ixpk= 0, nxpk= 0, iat=1803,1813, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 127 ILE HN 127 ILE HG13 6.05
&rst
ixpk= 0, nxpk= 0, iat=1803,1814, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 127 ILE HN 127 ILE HG13 6.05
&rst
ixpk= 0, nxpk= 0, iat=1803,1814, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 127 ILE HN 127 ILE HG13 6.05
&rst
ixpk= 0, nxpk= 0, iat=1803,1814, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 127 ILE HN 127 ILE QD1 5.62
&rst
ixpk= 0, nxpk= 0, iat=1803, -1, r1= 1.30, r2= 1.80, r3= 6.75, r4= 7.25,
igr2=1816,1817,1818,
&end
#
# 127 ILE HN 127 ILE QD1 5.62
&rst
ixpk= 0, nxpk= 0, iat=1803, -1, r1= 1.30, r2= 1.80, r3= 6.75, r4= 7.25,
igr2=1816,1817,1818,
&end
#
# 127 ILE HN 127 ILE QD1 5.62
&rst
ixpk= 0, nxpk= 0, iat=1803, -1, r1= 1.30, r2= 1.80, r3= 6.75, r4= 7.25,
igr2=1816,1817,1818,
&end
#
# 127 ILE HN 127 ILE QG2 4.40
&rst
ixpk= 0, nxpk= 0, iat=1803, -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
igr2=1809,1810,1811,
&end
#
# 127 ILE HN 127 ILE QG2 4.40
&rst
ixpk= 0, nxpk= 0, iat=1803, -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
igr2=1809,1810,1811,
&end
#
# 127 ILE HN 127 ILE QG2 4.40
&rst
ixpk= 0, nxpk= 0, iat=1803, -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
igr2=1809,1810,1811,
&end
#
# 127 ILE HN 128 HID HN 5.41
&rst
ixpk= 0, nxpk= 0, iat=1803,1822, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91, &end
#
# 127 ILE HN 128 HID HN 5.41
&rst
ixpk= 0, nxpk= 0, iat=1803,1822, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91, &end
#
# 127 ILE HN 128 HID HN 5.41
&rst
ixpk= 0, nxpk= 0, iat=1803,1822, r1= 1.30, r2= 1.80, r3= 5.41, r4= 5.91, &end
#
# 127 ILE HN 148 TYR HN 5.31
&rst
ixpk= 0, nxpk= 0, iat=1803,2087, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81, &end
#
# 127 ILE HN 148 TYR HN 5.31
&rst
ixpk= 0, nxpk= 0, iat=1803,2087, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81, &end
#
# 127 ILE HN 148 TYR HN 5.31
&rst
ixpk= 0, nxpk= 0, iat=1803,2087, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81, &end
#
# 127 ILE HN 149 ALA HN 4.64
&rst
ixpk= 0, nxpk= 0, iat=1803,2108, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14, &end
#
# 127 ILE HN 149 ALA HN 4.64
&rst
ixpk= 0, nxpk= 0, iat=1803,2108, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14, &end
#
# 127 ILE HN 149 ALA HN 4.64
&rst
ixpk= 0, nxpk= 0, iat=1803,2108, r1= 1.30, r2= 1.80, r3= 4.64, r4= 5.14, &end
#
# 127 ILE HN 150 CYX HA 4.74
&rst
ixpk= 0, nxpk= 0, iat=1803,2120, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24, &end
#
# 127 ILE HN 150 CYX HA 4.74
&rst
ixpk= 0, nxpk= 0, iat=1803,2120, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24, &end
#
# 127 ILE HN 150 CYX HA 4.74
&rst
ixpk= 0, nxpk= 0, iat=1803,2120, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24, &end
#
# 127 ILE HN 150 CYX HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1803,2123, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 127 ILE HN 150 CYX HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1803,2123, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 127 ILE HN 150 CYX HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1803,2123, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 127 ILE HN 151 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1803,2128, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 127 ILE HN 151 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1803,2128, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 127 ILE HN 151 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1803,2128, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 127 ILE HA 127 ILE HB 5.14
&rst
ixpk= 0, nxpk= 0, iat=1805,1807, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64, &end
#
# 127 ILE HA 127 ILE HG12 5.12
&rst
ixpk= 0, nxpk= 0, iat=1805,1813, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, &end
#
# 127 ILE HA 127 ILE HG13 4.88
&rst
ixpk= 0, nxpk= 0, iat=1805,1814, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38, &end
#
# 127 ILE HA 127 ILE QD1 5.16
&rst
ixpk= 0, nxpk= 0, iat=1805, -1, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
igr2=1816,1817,1818,
&end
#
# 127 ILE HA 127 ILE QD1 5.16
&rst
ixpk= 0, nxpk= 0, iat=1805, -1, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
igr2=1816,1817,1818,
&end
#
# 127 ILE HA 127 ILE QD1 5.16
&rst
ixpk= 0, nxpk= 0, iat=1805, -1, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
igr2=1816,1817,1818,
&end
#
# 127 ILE HA 127 ILE QG2 4.19
&rst
ixpk= 0, nxpk= 0, iat=1805, -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
igr2=1809,1810,1811,
&end
#
# 127 ILE HA 127 ILE QG2 4.19
&rst
ixpk= 0, nxpk= 0, iat=1805, -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
igr2=1809,1810,1811,
&end
#
# 127 ILE HA 127 ILE QG2 4.19
&rst
ixpk= 0, nxpk= 0, iat=1805, -1, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
igr2=1809,1810,1811,
&end
#
# 127 ILE HA 128 HID HN 3.51
&rst
ixpk= 0, nxpk= 0, iat=1805,1822, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01, &end
#
# 127 ILE HA 128 HID HN 3.51
&rst
ixpk= 0, nxpk= 0, iat=1805,1822, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01, &end
#
# 127 ILE HA 128 HID HN 3.51
&rst
ixpk= 0, nxpk= 0, iat=1805,1822, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01, &end
#
# 127 ILE HB 127 ILE QD1 3.97
&rst
ixpk= 0, nxpk= 0, iat=1807, -1, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
igr2=1816,1817,1818,
&end
#
# 127 ILE HB 127 ILE QD1 3.97
&rst
ixpk= 0, nxpk= 0, iat=1807, -1, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
igr2=1816,1817,1818,
&end
#
# 127 ILE HB 127 ILE QD1 3.97
&rst
ixpk= 0, nxpk= 0, iat=1807, -1, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
igr2=1816,1817,1818,
&end
#
# 127 ILE HB 128 HID HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1807,1822, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 127 ILE HB 128 HID HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1807,1822, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 127 ILE HB 128 HID HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1807,1822, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 127 ILE HB 148 TYR HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1807,2087, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 127 ILE HB 148 TYR HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1807,2087, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 127 ILE HB 148 TYR HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1807,2087, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 127 ILE HB 148 TYR QD 6.05
&rst
ixpk= 0, nxpk= 0, iat=1807, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2=2095,2104,
&end
#
# 127 ILE HB 148 TYR QD 6.05
&rst
ixpk= 0, nxpk= 0, iat=1807, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2=2095,2104,
&end
#
# 127 ILE HB 148 TYR QD 6.05
&rst
ixpk= 0, nxpk= 0, iat=1807, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2=2095,2104,
&end
#
# 127 ILE HB 149 ALA HN 4.39
&rst
ixpk= 0, nxpk= 0, iat=1807,2108, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89, &end
#
# 127 ILE HB 149 ALA HN 4.39
&rst
ixpk= 0, nxpk= 0, iat=1807,2108, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89, &end
#
# 127 ILE HB 149 ALA HN 4.39
&rst
ixpk= 0, nxpk= 0, iat=1807,2108, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89, &end
#
# 127 ILE HB 149 ALA QB 4.97
&rst
ixpk= 0, nxpk= 0, iat=1807, -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr2=2112,2113,2114,
&end
#
# 127 ILE HB 149 ALA QB 4.97
&rst
ixpk= 0, nxpk= 0, iat=1807, -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr2=2112,2113,2114,
&end
#
# 127 ILE HB 149 ALA QB 4.97
&rst
ixpk= 0, nxpk= 0, iat=1807, -1, r1= 1.30, r2= 1.80, r3= 5.97, r4= 6.47,
igr2=2112,2113,2114,
&end
#
# 127 ILE HG12 127 ILE QD1 4.31
&rst
ixpk= 0, nxpk= 0, iat=1813, -1, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68,
igr2=1816,1817,1818,
&end
#
# 127 ILE HG12 128 HID HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1813,1822, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 127 ILE HG12 128 HID HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1813,1822, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 127 ILE HG12 128 HID HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1813,1822, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 127 ILE HG13 127 ILE HG12 4.49
&rst
ixpk= 0, nxpk= 0, iat=1814,1813, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99, &end
#
# 127 ILE HG13 127 ILE QD1 4.27
&rst
ixpk= 0, nxpk= 0, iat=1814, -1, r1= 1.30, r2= 1.80, r3= 5.13, r4= 5.63,
igr2=1816,1817,1818,
&end
#
# 127 ILE HG13 128 HID HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1814,1822, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 127 ILE HG13 128 HID HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1814,1822, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 127 ILE QD1 148 TYR HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,2092, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1816,1817,1818,
&end
#
# 127 ILE QD1 148 TYR HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,2092, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1816,1817,1818,
&end
#
# 127 ILE QD1 148 TYR HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,2092, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1816,1817,1818,
&end
#
# 127 ILE QD1 148 TYR QD 5.25
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.08, r4= 7.58,
igr1=1816,1817,1818,
igr2=2095,2104,
&end
#
# 127 ILE QD1 148 TYR QD 5.25
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.08, r4= 7.58,
igr1=1816,1817,1818,
igr2=2095,2104,
&end
#
# 127 ILE QD1 148 TYR QD 5.25
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.08, r4= 7.58,
igr1=1816,1817,1818,
igr2=2095,2104,
&end
#
# 127 ILE QD1 149 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,2108, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1816,1817,1818,
&end
#
# 127 ILE QD1 149 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,2108, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1816,1817,1818,
&end
#
# 127 ILE QD1 149 ALA HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,2108, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1816,1817,1818,
&end
#
# 127 ILE QD1 149 ALA HA 5.33
&rst
ixpk= 0, nxpk= 0, iat= -1,2110, r1= 1.30, r2= 1.80, r3= 6.40, r4= 6.90,
igr1=1816,1817,1818,
&end
#
# 127 ILE QD1 149 ALA HA 5.33
&rst
ixpk= 0, nxpk= 0, iat= -1,2110, r1= 1.30, r2= 1.80, r3= 6.40, r4= 6.90,
igr1=1816,1817,1818,
&end
#
# 127 ILE QD1 149 ALA HA 5.33
&rst
ixpk= 0, nxpk= 0, iat= -1,2110, r1= 1.30, r2= 1.80, r3= 6.40, r4= 6.90,
igr1=1816,1817,1818,
&end
#
# 127 ILE QD1 149 ALA QB 4.58
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1=1816,1817,1818,
igr2=2112,2113,2114,
&end
#
# 127 ILE QD1 149 ALA QB 4.58
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1=1816,1817,1818,
igr2=2112,2113,2114,
&end
#
# 127 ILE QD1 149 ALA QB 4.58
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1=1816,1817,1818,
igr2=2112,2113,2114,
&end
#
# 127 ILE QD1 150 CYX HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,2118, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1816,1817,1818,
&end
#
# 127 ILE QD1 150 CYX HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,2118, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1816,1817,1818,
&end
#
# 127 ILE QD1 150 CYX HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,2118, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1816,1817,1818,
&end
#
# 127 ILE QG2 127 ILE HB 3.80
&rst
ixpk= 0, nxpk= 0, iat= -1,1807, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
igr1=1809,1810,1811,
&end
#
# 127 ILE QG2 127 ILE QD1 3.74
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr1=1809,1810,1811,
igr2=1816,1817,1818,
&end
#
# 127 ILE QG2 127 ILE QD1 3.74
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr1=1809,1810,1811,
igr2=1816,1817,1818,
&end
#
# 127 ILE QG2 127 ILE QD1 3.74
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr1=1809,1810,1811,
igr2=1816,1817,1818,
&end
#
# 127 ILE QG2 128 HID HN 4.01
&rst
ixpk= 0, nxpk= 0, iat= -1,1822, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32,
igr1=1809,1810,1811,
&end
#
# 127 ILE QG2 148 TYR HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,2087, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1809,1810,1811,
&end
#
# 127 ILE QG2 148 TYR HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,2087, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1809,1810,1811,
&end
#
# 127 ILE QG2 148 TYR HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,2087, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1809,1810,1811,
&end
#
# 127 ILE QG2 148 TYR HB3 5.59
&rst
ixpk= 0, nxpk= 0, iat= -1,2092, r1= 1.30, r2= 1.80, r3= 6.71, r4= 7.21,
igr1=1809,1810,1811,
&end
#
# 127 ILE QG2 148 TYR HB3 5.59
&rst
ixpk= 0, nxpk= 0, iat= -1,2092, r1= 1.30, r2= 1.80, r3= 6.71, r4= 7.21,
igr1=1809,1810,1811,
&end
#
# 127 ILE QG2 148 TYR HB3 5.59
&rst
ixpk= 0, nxpk= 0, iat= -1,2092, r1= 1.30, r2= 1.80, r3= 6.71, r4= 7.21,
igr1=1809,1810,1811,
&end
#
# 127 ILE QG2 148 TYR QD 4.93
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.65, r4= 7.15,
igr1=1809,1810,1811,
igr2=2095,2104,
&end
#
# 127 ILE QG2 148 TYR QD 4.93
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.65, r4= 7.15,
igr1=1809,1810,1811,
igr2=2095,2104,
&end
#
# 127 ILE QG2 148 TYR QD 4.93
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.65, r4= 7.15,
igr1=1809,1810,1811,
igr2=2095,2104,
&end
#
# 127 ILE QG2 149 ALA HN 5.26
&rst
ixpk= 0, nxpk= 0, iat= -1,2108, r1= 1.30, r2= 1.80, r3= 6.32, r4= 6.82,
igr1=1809,1810,1811,
&end
#
# 127 ILE QG2 149 ALA HN 5.26
&rst
ixpk= 0, nxpk= 0, iat= -1,2108, r1= 1.30, r2= 1.80, r3= 6.32, r4= 6.82,
igr1=1809,1810,1811,
&end
#
# 127 ILE QG2 149 ALA HN 5.26
&rst
ixpk= 0, nxpk= 0, iat= -1,2108, r1= 1.30, r2= 1.80, r3= 6.32, r4= 6.82,
igr1=1809,1810,1811,
&end
#
# 128 HID HN 128 HID HA 4.55
&rst
ixpk= 0, nxpk= 0, iat=1822,1824, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05, &end
#
# 128 HID HA 129 VAL HN 3.88
&rst
ixpk= 0, nxpk= 0, iat=1824,1839, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38, &end
#
# 128 HID HA 129 VAL HN 3.88
&rst
ixpk= 0, nxpk= 0, iat=1824,1839, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38, &end
#
# 128 HID HA 129 VAL HN 3.88
&rst
ixpk= 0, nxpk= 0, iat=1824,1839, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38, &end
#
# 128 HID HA 129 VAL HB 6.05
&rst
ixpk= 0, nxpk= 0, iat=1824,1843, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 128 HID HA 129 VAL HB 6.05
&rst
ixpk= 0, nxpk= 0, iat=1824,1843, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 128 HID HA 129 VAL HB 6.05
&rst
ixpk= 0, nxpk= 0, iat=1824,1843, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 128 HID HA 130 GLY HN 5.47
&rst
ixpk= 0, nxpk= 0, iat=1824,1855, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97, &end
#
# 128 HID HA 130 GLY HN 5.47
&rst
ixpk= 0, nxpk= 0, iat=1824,1855, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97, &end
#
# 128 HID HA 130 GLY HN 5.47
&rst
ixpk= 0, nxpk= 0, iat=1824,1855, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97, &end
#
# 128 HID HA 147 ARG HA 4.75
&rst
ixpk= 0, nxpk= 0, iat=1824,2065, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, &end
#
# 128 HID HA 147 ARG HA 4.75
&rst
ixpk= 0, nxpk= 0, iat=1824,2065, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, &end
#
# 128 HID HA 147 ARG HA 4.75
&rst
ixpk= 0, nxpk= 0, iat=1824,2065, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, &end
#
# 128 HID HA 148 TYR HN 5.05
&rst
ixpk= 0, nxpk= 0, iat=1824,2087, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55, &end
#
# 128 HID HA 148 TYR HN 5.05
&rst
ixpk= 0, nxpk= 0, iat=1824,2087, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55, &end
#
# 128 HID HA 148 TYR HN 5.05
&rst
ixpk= 0, nxpk= 0, iat=1824,2087, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55, &end
#
# 129 VAL HN 129 VAL HA 4.19
&rst
ixpk= 0, nxpk= 0, iat=1839,1841, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69, &end
#
# 129 VAL HN 129 VAL HB 3.77
&rst
ixpk= 0, nxpk= 0, iat=1839,1843, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27, &end
#
# 129 VAL HN 129 VAL HB 3.77
&rst
ixpk= 0, nxpk= 0, iat=1839,1843, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27, &end
#
# 129 VAL HN 129 VAL HB 3.77
&rst
ixpk= 0, nxpk= 0, iat=1839,1843, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27, &end
#
# 129 VAL HN 129 VAL QG1 3.93
&rst
ixpk= 0, nxpk= 0, iat=1839, -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
igr2=1845,1846,1847,
&end
#
# 129 VAL HN 129 VAL QG1 3.93
&rst
ixpk= 0, nxpk= 0, iat=1839, -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
igr2=1845,1846,1847,
&end
#
# 129 VAL HN 129 VAL QG1 3.93
&rst
ixpk= 0, nxpk= 0, iat=1839, -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
igr2=1845,1846,1847,
&end
#
# 129 VAL HN 129 VAL QG2 3.85
&rst
ixpk= 0, nxpk= 0, iat=1839, -1, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
igr2=1849,1850,1851,
&end
#
# 129 VAL HN 129 VAL QG2 3.85
&rst
ixpk= 0, nxpk= 0, iat=1839, -1, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
igr2=1849,1850,1851,
&end
#
# 129 VAL HN 129 VAL QG2 3.85
&rst
ixpk= 0, nxpk= 0, iat=1839, -1, r1= 1.30, r2= 1.80, r3= 4.62, r4= 5.12,
igr2=1849,1850,1851,
&end
#
# 129 VAL HN 130 GLY HN 3.84
&rst
ixpk= 0, nxpk= 0, iat=1839,1855, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34, &end
#
# 129 VAL HN 130 GLY HN 3.84
&rst
ixpk= 0, nxpk= 0, iat=1839,1855, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34, &end
#
# 129 VAL HN 130 GLY HN 3.84
&rst
ixpk= 0, nxpk= 0, iat=1839,1855, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34, &end
#
# 129 VAL HN 146 THR HB 5.74
&rst
ixpk= 0, nxpk= 0, iat=1839,2053, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24, &end
#
# 129 VAL HN 146 THR HB 5.74
&rst
ixpk= 0, nxpk= 0, iat=1839,2053, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24, &end
#
# 129 VAL HN 146 THR HB 5.74
&rst
ixpk= 0, nxpk= 0, iat=1839,2053, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24, &end
#
# 129 VAL HN 146 THR QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1839, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=2055,2056,2057,
&end
#
# 129 VAL HN 146 THR QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1839, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=2055,2056,2057,
&end
#
# 129 VAL HN 146 THR QG2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1839, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=2055,2056,2057,
&end
#
# 129 VAL HN 147 ARG HA 5.15
&rst
ixpk= 0, nxpk= 0, iat=1839,2065, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65, &end
#
# 129 VAL HN 147 ARG HA 5.15
&rst
ixpk= 0, nxpk= 0, iat=1839,2065, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65, &end
#
# 129 VAL HN 147 ARG HA 5.15
&rst
ixpk= 0, nxpk= 0, iat=1839,2065, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65, &end
#
# 129 VAL HN 147 ARG QD 6.05
&rst
ixpk= 0, nxpk= 0, iat=1839, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2=2073,2074,
&end
#
# 129 VAL HN 147 ARG QD 6.05
&rst
ixpk= 0, nxpk= 0, iat=1839, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2=2073,2074,
&end
#
# 129 VAL HN 147 ARG QD 6.05
&rst
ixpk= 0, nxpk= 0, iat=1839, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2=2073,2074,
&end
#
# 129 VAL HN 148 TYR HB2 4.73
&rst
ixpk= 0, nxpk= 0, iat=1839,2091, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, &end
#
# 129 VAL HN 148 TYR HB2 4.73
&rst
ixpk= 0, nxpk= 0, iat=1839,2091, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, &end
#
# 129 VAL HN 148 TYR HB2 4.73
&rst
ixpk= 0, nxpk= 0, iat=1839,2091, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, &end
#
# 129 VAL HN 148 TYR HB3 6.02
&rst
ixpk= 0, nxpk= 0, iat=1839,2092, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52, &end
#
# 129 VAL HN 148 TYR HB3 6.02
&rst
ixpk= 0, nxpk= 0, iat=1839,2092, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52, &end
#
# 129 VAL HN 148 TYR HB3 6.02
&rst
ixpk= 0, nxpk= 0, iat=1839,2092, r1= 1.30, r2= 1.80, r3= 6.02, r4= 6.52, &end
#
# 129 VAL HN 148 TYR QD 5.98
&rst
ixpk= 0, nxpk= 0, iat=1839, -1, r1= 1.30, r2= 1.80, r3= 6.71, r4= 7.21,
igr2=2095,2104,
&end
#
# 129 VAL HN 148 TYR QD 5.98
&rst
ixpk= 0, nxpk= 0, iat=1839, -1, r1= 1.30, r2= 1.80, r3= 6.71, r4= 7.21,
igr2=2095,2104,
&end
#
# 129 VAL HN 148 TYR QD 5.98
&rst
ixpk= 0, nxpk= 0, iat=1839, -1, r1= 1.30, r2= 1.80, r3= 6.71, r4= 7.21,
igr2=2095,2104,
&end
#
# 129 VAL HA 129 VAL HB 4.30
&rst
ixpk= 0, nxpk= 0, iat=1841,1843, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80, &end
#
# 129 VAL HA 129 VAL QG1 3.77
&rst
ixpk= 0, nxpk= 0, iat=1841, -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
igr2=1845,1846,1847,
&end
#
# 129 VAL HA 129 VAL QG1 3.77
&rst
ixpk= 0, nxpk= 0, iat=1841, -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
igr2=1845,1846,1847,
&end
#
# 129 VAL HA 129 VAL QG1 3.77
&rst
ixpk= 0, nxpk= 0, iat=1841, -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
igr2=1845,1846,1847,
&end
#
# 129 VAL HA 129 VAL QG2 3.93
&rst
ixpk= 0, nxpk= 0, iat=1841, -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
igr2=1849,1850,1851,
&end
#
# 129 VAL HA 129 VAL QG2 3.93
&rst
ixpk= 0, nxpk= 0, iat=1841, -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
igr2=1849,1850,1851,
&end
#
# 129 VAL HA 129 VAL QG2 3.93
&rst
ixpk= 0, nxpk= 0, iat=1841, -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
igr2=1849,1850,1851,
&end
#
# 129 VAL HA 130 GLY HN 4.39
&rst
ixpk= 0, nxpk= 0, iat=1841,1855, r1= 1.30, r2= 1.80, r3= 4.39, r4= 4.89, &end
#
# 129 VAL HA 131 GLY HN 5.73
&rst
ixpk= 0, nxpk= 0, iat=1841,1862, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23, &end
#
# 129 VAL HA 131 GLY HN 5.73
&rst
ixpk= 0, nxpk= 0, iat=1841,1862, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23, &end
#
# 129 VAL HA 131 GLY HN 5.73
&rst
ixpk= 0, nxpk= 0, iat=1841,1862, r1= 1.30, r2= 1.80, r3= 5.73, r4= 6.23, &end
#
# 129 VAL HA 148 TYR HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1841,2091, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 129 VAL HA 148 TYR HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1841,2091, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 129 VAL HA 148 TYR HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1841,2091, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 129 VAL HA 148 TYR HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1841,2092, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 129 VAL HA 148 TYR HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1841,2092, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 129 VAL HA 148 TYR HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1841,2092, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 129 VAL HA 148 TYR QD 5.82
&rst
ixpk= 0, nxpk= 0, iat=1841, -1, r1= 1.30, r2= 1.80, r3= 6.53, r4= 7.03,
igr2=2095,2104,
&end
#
# 129 VAL HA 148 TYR QD 5.82
&rst
ixpk= 0, nxpk= 0, iat=1841, -1, r1= 1.30, r2= 1.80, r3= 6.53, r4= 7.03,
igr2=2095,2104,
&end
#
# 129 VAL HA 148 TYR QD 5.82
&rst
ixpk= 0, nxpk= 0, iat=1841, -1, r1= 1.30, r2= 1.80, r3= 6.53, r4= 7.03,
igr2=2095,2104,
&end
#
# 129 VAL HB 129 VAL QG1 3.99
&rst
ixpk= 0, nxpk= 0, iat=1843, -1, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
igr2=1845,1846,1847,
&end
#
# 129 VAL HB 130 GLY HN 4.04
&rst
ixpk= 0, nxpk= 0, iat=1843,1855, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, &end
#
# 129 VAL HB 130 GLY HN 4.04
&rst
ixpk= 0, nxpk= 0, iat=1843,1855, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, &end
#
# 129 VAL HB 130 GLY HN 4.04
&rst
ixpk= 0, nxpk= 0, iat=1843,1855, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, &end
#
# 129 VAL HB 130 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1843,1858, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 129 VAL HB 130 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1843,1858, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 129 VAL HB 130 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1843,1858, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 129 VAL HB 146 THR HN 5.06
&rst
ixpk= 0, nxpk= 0, iat=1843,2049, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56, &end
#
# 129 VAL HB 146 THR HN 5.06
&rst
ixpk= 0, nxpk= 0, iat=1843,2049, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56, &end
#
# 129 VAL HB 146 THR HN 5.06
&rst
ixpk= 0, nxpk= 0, iat=1843,2049, r1= 1.30, r2= 1.80, r3= 5.06, r4= 5.56, &end
#
# 129 VAL HB 146 THR HB 4.46
&rst
ixpk= 0, nxpk= 0, iat=1843,2053, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, &end
#
# 129 VAL HB 146 THR HB 4.46
&rst
ixpk= 0, nxpk= 0, iat=1843,2053, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, &end
#
# 129 VAL HB 146 THR HB 4.46
&rst
ixpk= 0, nxpk= 0, iat=1843,2053, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, &end
#
# 129 VAL QG1 129 VAL QG2 3.40
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40,
igr1=1845,1846,1847,
igr2=1849,1850,1851,
&end
#
# 129 VAL QG1 130 GLY HN 4.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1855, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr1=1845,1846,1847,
&end
#
# 129 VAL QG1 130 GLY HN 4.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1855, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr1=1845,1846,1847,
&end
#
# 129 VAL QG1 130 GLY HN 4.50
&rst
ixpk= 0, nxpk= 0, iat= -1,1855, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr1=1845,1846,1847,
&end
#
# 129 VAL QG1 131 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1862, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1845,1846,1847,
&end
#
# 129 VAL QG1 131 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1862, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1845,1846,1847,
&end
#
# 129 VAL QG1 131 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1862, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1845,1846,1847,
&end
#
# 129 VAL QG1 146 THR HB 4.60
&rst
ixpk= 0, nxpk= 0, iat= -1,2053, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
igr1=1845,1846,1847,
&end
#
# 129 VAL QG1 146 THR HB 4.60
&rst
ixpk= 0, nxpk= 0, iat= -1,2053, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
igr1=1845,1846,1847,
&end
#
# 129 VAL QG1 146 THR HB 4.60
&rst
ixpk= 0, nxpk= 0, iat= -1,2053, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
igr1=1845,1846,1847,
&end
#
# 129 VAL QG1 148 TYR HN 5.90
&rst
ixpk= 0, nxpk= 0, iat= -1,2087, r1= 1.30, r2= 1.80, r3= 7.09, r4= 7.59,
igr1=1845,1846,1847,
&end
#
# 129 VAL QG1 148 TYR HB2 4.41
&rst
ixpk= 0, nxpk= 0, iat= -1,2091, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr1=1845,1846,1847,
&end
#
# 129 VAL QG1 148 TYR HB2 4.41
&rst
ixpk= 0, nxpk= 0, iat= -1,2091, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr1=1845,1846,1847,
&end
#
# 129 VAL QG1 148 TYR HB2 4.41
&rst
ixpk= 0, nxpk= 0, iat= -1,2091, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr1=1845,1846,1847,
&end
#
# 129 VAL QG1 148 TYR QD 3.93
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr1=1845,1846,1847,
igr2=2095,2104,
&end
#
# 129 VAL QG1 148 TYR QD 3.93
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr1=1845,1846,1847,
igr2=2095,2104,
&end
#
# 129 VAL QG1 148 TYR QD 3.93
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr1=1845,1846,1847,
igr2=2095,2104,
&end
#
# 129 VAL QG2 129 VAL HB 3.90
&rst
ixpk= 0, nxpk= 0, iat= -1,1843, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
igr1=1849,1850,1851,
&end
#
# 129 VAL QG2 130 GLY HN 4.42
&rst
ixpk= 0, nxpk= 0, iat= -1,1855, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
igr1=1849,1850,1851,
&end
#
# 129 VAL QG2 130 GLY HN 4.42
&rst
ixpk= 0, nxpk= 0, iat= -1,1855, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
igr1=1849,1850,1851,
&end
#
# 129 VAL QG2 130 GLY HN 4.42
&rst
ixpk= 0, nxpk= 0, iat= -1,1855, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81,
igr1=1849,1850,1851,
&end
#
# 129 VAL QG2 130 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1858, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1849,1850,1851,
&end
#
# 129 VAL QG2 130 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1858, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1849,1850,1851,
&end
#
# 129 VAL QG2 130 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1858, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1849,1850,1851,
&end
#
# 129 VAL QG2 146 THR HN 5.49
&rst
ixpk= 0, nxpk= 0, iat= -1,2049, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
igr1=1849,1850,1851,
&end
#
# 129 VAL QG2 146 THR HN 5.49
&rst
ixpk= 0, nxpk= 0, iat= -1,2049, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
igr1=1849,1850,1851,
&end
#
# 129 VAL QG2 146 THR HN 5.49
&rst
ixpk= 0, nxpk= 0, iat= -1,2049, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
igr1=1849,1850,1851,
&end
#
# 129 VAL QG2 146 THR HB 4.20
&rst
ixpk= 0, nxpk= 0, iat= -1,2053, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr1=1849,1850,1851,
&end
#
# 129 VAL QG2 146 THR HB 4.20
&rst
ixpk= 0, nxpk= 0, iat= -1,2053, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr1=1849,1850,1851,
&end
#
# 129 VAL QG2 146 THR HB 4.20
&rst
ixpk= 0, nxpk= 0, iat= -1,2053, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr1=1849,1850,1851,
&end
#
# 129 VAL QG2 147 ARG HN 4.88
&rst
ixpk= 0, nxpk= 0, iat= -1,2063, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
igr1=1849,1850,1851,
&end
#
# 129 VAL QG2 147 ARG HN 4.88
&rst
ixpk= 0, nxpk= 0, iat= -1,2063, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
igr1=1849,1850,1851,
&end
#
# 129 VAL QG2 147 ARG HN 4.88
&rst
ixpk= 0, nxpk= 0, iat= -1,2063, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
igr1=1849,1850,1851,
&end
#
# 129 VAL QG2 147 ARG QD 5.03
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.78, r4= 7.28,
igr1=1849,1850,1851,
igr2=2073,2074,
&end
#
# 129 VAL QG2 147 ARG QD 5.03
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.78, r4= 7.28,
igr1=1849,1850,1851,
igr2=2073,2074,
&end
#
# 129 VAL QG2 147 ARG QD 5.03
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.78, r4= 7.28,
igr1=1849,1850,1851,
igr2=2073,2074,
&end
#
# 129 VAL QG2 148 TYR HN 4.98
&rst
ixpk= 0, nxpk= 0, iat= -1,2087, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
igr1=1849,1850,1851,
&end
#
# 129 VAL QG2 148 TYR HN 4.98
&rst
ixpk= 0, nxpk= 0, iat= -1,2087, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
igr1=1849,1850,1851,
&end
#
# 129 VAL QG2 148 TYR HN 4.98
&rst
ixpk= 0, nxpk= 0, iat= -1,2087, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48,
igr1=1849,1850,1851,
&end
#
# 129 VAL QG2 148 TYR HA 4.47
&rst
ixpk= 0, nxpk= 0, iat= -1,2089, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr1=1849,1850,1851,
&end
#
# 129 VAL QG2 148 TYR HA 4.47
&rst
ixpk= 0, nxpk= 0, iat= -1,2089, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr1=1849,1850,1851,
&end
#
# 129 VAL QG2 148 TYR HA 4.47
&rst
ixpk= 0, nxpk= 0, iat= -1,2089, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87,
igr1=1849,1850,1851,
&end
#
# 129 VAL QG2 148 TYR HB2 4.46
&rst
ixpk= 0, nxpk= 0, iat= -1,2091, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
igr1=1849,1850,1851,
&end
#
# 129 VAL QG2 148 TYR HB2 4.46
&rst
ixpk= 0, nxpk= 0, iat= -1,2091, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
igr1=1849,1850,1851,
&end
#
# 129 VAL QG2 148 TYR HB2 4.46
&rst
ixpk= 0, nxpk= 0, iat= -1,2091, r1= 1.30, r2= 1.80, r3= 5.36, r4= 5.86,
igr1=1849,1850,1851,
&end
#
# 129 VAL QG2 148 TYR QD 4.18
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr1=1849,1850,1851,
igr2=2095,2104,
&end
#
# 129 VAL QG2 148 TYR QD 4.18
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr1=1849,1850,1851,
igr2=2095,2104,
&end
#
# 129 VAL QG2 148 TYR QD 4.18
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr1=1849,1850,1851,
igr2=2095,2104,
&end
#
# 130 GLY HN 130 GLY HA2 4.04
&rst
ixpk= 0, nxpk= 0, iat=1855,1857, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, &end
#
# 130 GLY HN 130 GLY HA3 3.73
&rst
ixpk= 0, nxpk= 0, iat=1855,1858, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23, &end
#
# 130 GLY HN 131 GLY HN 4.63
&rst
ixpk= 0, nxpk= 0, iat=1855,1862, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, &end
#
# 130 GLY HN 131 GLY HN 4.63
&rst
ixpk= 0, nxpk= 0, iat=1855,1862, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, &end
#
# 130 GLY HN 131 GLY HN 4.63
&rst
ixpk= 0, nxpk= 0, iat=1855,1862, r1= 1.30, r2= 1.80, r3= 4.63, r4= 5.13, &end
#
# 130 GLY HN 131 GLY HA2 5.79
&rst
ixpk= 0, nxpk= 0, iat=1855,1864, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29, &end
#
# 130 GLY HN 131 GLY HA2 5.79
&rst
ixpk= 0, nxpk= 0, iat=1855,1864, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29, &end
#
# 130 GLY HN 131 GLY HA2 5.79
&rst
ixpk= 0, nxpk= 0, iat=1855,1864, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29, &end
#
# 130 GLY HN 144 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1855,2035, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 130 GLY HN 144 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1855,2035, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 130 GLY HN 144 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1855,2035, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 130 GLY HN 144 GLY HA2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1855,2037, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 130 GLY HN 144 GLY HA2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1855,2037, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 130 GLY HN 144 GLY HA2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1855,2037, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 130 GLY HN 144 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1855,2038, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 130 GLY HN 144 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1855,2038, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 130 GLY HN 144 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1855,2038, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 130 GLY HN 145 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1855,2042, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 130 GLY HN 145 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1855,2042, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 130 GLY HN 145 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1855,2042, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 130 GLY HN 145 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1855,2045, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 130 GLY HN 145 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1855,2045, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 130 GLY HN 145 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1855,2045, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 130 GLY HN 146 THR HN 5.59
&rst
ixpk= 0, nxpk= 0, iat=1855,2049, r1= 1.30, r2= 1.80, r3= 5.59, r4= 6.09, &end
#
# 130 GLY HN 146 THR HN 5.59
&rst
ixpk= 0, nxpk= 0, iat=1855,2049, r1= 1.30, r2= 1.80, r3= 5.59, r4= 6.09, &end
#
# 130 GLY HN 146 THR HN 5.59
&rst
ixpk= 0, nxpk= 0, iat=1855,2049, r1= 1.30, r2= 1.80, r3= 5.59, r4= 6.09, &end
#
# 130 GLY HA2 130 GLY HA3 3.89
&rst
ixpk= 0, nxpk= 0, iat=1857,1858, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39, &end
#
# 130 GLY HA2 131 GLY HN 3.80
&rst
ixpk= 0, nxpk= 0, iat=1857,1862, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30, &end
#
# 130 GLY HA2 131 GLY HN 3.80
&rst
ixpk= 0, nxpk= 0, iat=1857,1862, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30, &end
#
# 130 GLY HA2 131 GLY HN 3.80
&rst
ixpk= 0, nxpk= 0, iat=1857,1862, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30, &end
#
# 130 GLY HA2 144 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1857,2038, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 130 GLY HA2 144 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1857,2038, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 130 GLY HA2 144 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1857,2038, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 130 GLY HA3 131 GLY HN 4.44
&rst
ixpk= 0, nxpk= 0, iat=1858,1862, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94, &end
#
# 130 GLY HA3 144 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1858,2035, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 130 GLY HA3 144 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1858,2035, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 130 GLY HA3 144 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1858,2035, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 131 GLY HN 131 GLY HA2 3.73
&rst
ixpk= 0, nxpk= 0, iat=1862,1864, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23, &end
#
# 131 GLY HN 131 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1862,1865, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 131 GLY HN 132 ASP HN 4.30
&rst
ixpk= 0, nxpk= 0, iat=1862,1869, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80, &end
#
# 131 GLY HN 132 ASP HN 4.30
&rst
ixpk= 0, nxpk= 0, iat=1862,1869, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80, &end
#
# 131 GLY HN 132 ASP HN 4.30
&rst
ixpk= 0, nxpk= 0, iat=1862,1869, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80, &end
#
# 131 GLY HA2 132 ASP HN 3.58
&rst
ixpk= 0, nxpk= 0, iat=1864,1869, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08, &end
#
# 131 GLY HA2 132 ASP HN 3.58
&rst
ixpk= 0, nxpk= 0, iat=1864,1869, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08, &end
#
# 131 GLY HA2 132 ASP HN 3.58
&rst
ixpk= 0, nxpk= 0, iat=1864,1869, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08, &end
#
# 131 GLY HA2 132 ASP HA 5.33
&rst
ixpk= 0, nxpk= 0, iat=1864,1871, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83, &end
#
# 131 GLY HA2 132 ASP HA 5.33
&rst
ixpk= 0, nxpk= 0, iat=1864,1871, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83, &end
#
# 131 GLY HA2 132 ASP HA 5.33
&rst
ixpk= 0, nxpk= 0, iat=1864,1871, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83, &end
#
# 131 GLY HA2 132 ASP HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1864,1874, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 131 GLY HA2 132 ASP HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1864,1874, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 131 GLY HA2 132 ASP HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1864,1874, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 131 GLY HA3 131 GLY HA2 4.07
&rst
ixpk= 0, nxpk= 0, iat=1865,1864, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57, &end
#
# 131 GLY HA3 132 ASP HN 3.85
&rst
ixpk= 0, nxpk= 0, iat=1865,1869, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35, &end
#
# 131 GLY HA3 132 ASP HN 3.85
&rst
ixpk= 0, nxpk= 0, iat=1865,1869, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35, &end
#
# 131 GLY HA3 132 ASP HN 3.85
&rst
ixpk= 0, nxpk= 0, iat=1865,1869, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35, &end
#
# 132 ASP HN 132 ASP HA 4.51
&rst
ixpk= 0, nxpk= 0, iat=1869,1871, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01, &end
#
# 132 ASP HN 132 ASP HB2 4.55
&rst
ixpk= 0, nxpk= 0, iat=1869,1873, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05, &end
#
# 132 ASP HN 132 ASP HB2 4.55
&rst
ixpk= 0, nxpk= 0, iat=1869,1873, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05, &end
#
# 132 ASP HN 132 ASP HB2 4.55
&rst
ixpk= 0, nxpk= 0, iat=1869,1873, r1= 1.30, r2= 1.80, r3= 4.55, r4= 5.05, &end
#
# 132 ASP HN 132 ASP HB3 4.84
&rst
ixpk= 0, nxpk= 0, iat=1869,1874, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34, &end
#
# 132 ASP HN 133 ASN HN 5.52
&rst
ixpk= 0, nxpk= 0, iat=1869,1881, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02, &end
#
# 132 ASP HN 133 ASN HN 5.52
&rst
ixpk= 0, nxpk= 0, iat=1869,1881, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02, &end
#
# 132 ASP HN 133 ASN HN 5.52
&rst
ixpk= 0, nxpk= 0, iat=1869,1881, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02, &end
#
# 132 ASP HN 134 MET HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1869,1895, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 132 ASP HN 134 MET HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1869,1895, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 132 ASP HN 134 MET HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1869,1895, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 132 ASP HN 134 MET HB3 5.98
&rst
ixpk= 0, nxpk= 0, iat=1869,1900, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48, &end
#
# 132 ASP HN 134 MET HB3 5.98
&rst
ixpk= 0, nxpk= 0, iat=1869,1900, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48, &end
#
# 132 ASP HN 134 MET HB3 5.98
&rst
ixpk= 0, nxpk= 0, iat=1869,1900, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48, &end
#
# 132 ASP HN 134 MET QE 6.05
&rst
ixpk= 0, nxpk= 0, iat=1869, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1906,1907,1908,
&end
#
# 132 ASP HN 134 MET QE 6.05
&rst
ixpk= 0, nxpk= 0, iat=1869, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1906,1907,1908,
&end
#
# 132 ASP HN 134 MET QE 6.05
&rst
ixpk= 0, nxpk= 0, iat=1869, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1906,1907,1908,
&end
#
# 132 ASP HA 132 ASP HB2 5.45
&rst
ixpk= 0, nxpk= 0, iat=1871,1873, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95, &end
#
# 132 ASP HA 132 ASP HB3 5.55
&rst
ixpk= 0, nxpk= 0, iat=1871,1874, r1= 1.30, r2= 1.80, r3= 5.55, r4= 6.05, &end
#
# 132 ASP HA 133 ASN HN 3.66
&rst
ixpk= 0, nxpk= 0, iat=1871,1881, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16, &end
#
# 132 ASP HA 133 ASN HN 3.66
&rst
ixpk= 0, nxpk= 0, iat=1871,1881, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16, &end
#
# 132 ASP HA 133 ASN HN 3.66
&rst
ixpk= 0, nxpk= 0, iat=1871,1881, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16, &end
#
# 132 ASP HA 134 MET HN 5.37
&rst
ixpk= 0, nxpk= 0, iat=1871,1895, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87, &end
#
# 132 ASP HA 134 MET HN 5.37
&rst
ixpk= 0, nxpk= 0, iat=1871,1895, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87, &end
#
# 132 ASP HA 134 MET HN 5.37
&rst
ixpk= 0, nxpk= 0, iat=1871,1895, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87, &end
#
# 132 ASP HB2 132 ASP HB3 4.27
&rst
ixpk= 0, nxpk= 0, iat=1873,1874, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77, &end
#
# 132 ASP HB2 133 ASN HN 5.82
&rst
ixpk= 0, nxpk= 0, iat=1873,1881, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32, &end
#
# 132 ASP HB2 133 ASN HN 5.82
&rst
ixpk= 0, nxpk= 0, iat=1873,1881, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32, &end
#
# 132 ASP HB2 133 ASN HN 5.82
&rst
ixpk= 0, nxpk= 0, iat=1873,1881, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32, &end
#
# 132 ASP HB2 133 ASN HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1873,1883, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 132 ASP HB2 133 ASN HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1873,1883, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 132 ASP HB2 133 ASN HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1873,1883, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 132 ASP HB2 134 MET QE 4.76
&rst
ixpk= 0, nxpk= 0, iat=1873, -1, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
igr2=1906,1907,1908,
&end
#
# 132 ASP HB2 134 MET QE 4.76
&rst
ixpk= 0, nxpk= 0, iat=1873, -1, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
igr2=1906,1907,1908,
&end
#
# 132 ASP HB2 134 MET QE 4.76
&rst
ixpk= 0, nxpk= 0, iat=1873, -1, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22,
igr2=1906,1907,1908,
&end
#
# 132 ASP HB3 133 ASN HN 5.68
&rst
ixpk= 0, nxpk= 0, iat=1874,1881, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18, &end
#
# 132 ASP HB3 133 ASN HN 5.68
&rst
ixpk= 0, nxpk= 0, iat=1874,1881, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18, &end
#
# 132 ASP HB3 133 ASN HN 5.68
&rst
ixpk= 0, nxpk= 0, iat=1874,1881, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18, &end
#
# 133 ASN HN 133 ASN HA 3.88
&rst
ixpk= 0, nxpk= 0, iat=1881,1883, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38, &end
#
# 133 ASN HN 133 ASN HB2 4.95
&rst
ixpk= 0, nxpk= 0, iat=1881,1885, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45, &end
#
# 133 ASN HN 133 ASN HB3 4.81
&rst
ixpk= 0, nxpk= 0, iat=1881,1886, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31, &end
#
# 133 ASN HN 134 MET HN 4.21
&rst
ixpk= 0, nxpk= 0, iat=1881,1895, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71, &end
#
# 133 ASN HN 134 MET HN 4.21
&rst
ixpk= 0, nxpk= 0, iat=1881,1895, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71, &end
#
# 133 ASN HN 134 MET HN 4.21
&rst
ixpk= 0, nxpk= 0, iat=1881,1895, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71, &end
#
# 133 ASN HN 134 MET HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1881,1897, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 133 ASN HN 134 MET HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1881,1897, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 133 ASN HN 134 MET HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1881,1897, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 133 ASN HA 133 ASN HB2 4.06
&rst
ixpk= 0, nxpk= 0, iat=1883,1885, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56, &end
#
# 133 ASN HA 133 ASN HB3 4.12
&rst
ixpk= 0, nxpk= 0, iat=1883,1886, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62, &end
#
# 133 ASN HA 133 ASN HD22 6.05
&rst
ixpk= 0, nxpk= 0, iat=1883,1891, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 133 ASN HA 133 ASN HD22 6.05
&rst
ixpk= 0, nxpk= 0, iat=1883,1891, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 133 ASN HA 133 ASN HD22 6.05
&rst
ixpk= 0, nxpk= 0, iat=1883,1891, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 133 ASN HA 134 MET HN 4.87
&rst
ixpk= 0, nxpk= 0, iat=1883,1895, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37, &end
#
# 133 ASN HB2 133 ASN HB3 3.98
&rst
ixpk= 0, nxpk= 0, iat=1885,1886, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48, &end
#
# 133 ASN HB2 134 MET HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1885,1895, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 133 ASN HB2 134 MET HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1885,1895, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 133 ASN HB2 134 MET HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1885,1895, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 133 ASN HB2 135 SER HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1885,1912, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 133 ASN HB2 135 SER HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1885,1912, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 133 ASN HB2 135 SER HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1885,1912, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 133 ASN HB3 133 ASN HD21 6.05
&rst
ixpk= 0, nxpk= 0, iat=1886,1890, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 133 ASN HD21 133 ASN HD22 2.64
&rst
ixpk= 0, nxpk= 0, iat=1890,1891, r1= 1.30, r2= 1.80, r3= 2.64, r4= 3.14, &end
#
# 133 ASN HD21 134 MET HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1890,1895, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 133 ASN HD21 134 MET HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1890,1895, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 133 ASN HD21 134 MET HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1890,1895, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 133 ASN HD21 134 MET HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1890,1897, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 133 ASN HD21 134 MET HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1890,1897, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 133 ASN HD21 134 MET HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1890,1897, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 133 ASN HD21 134 MET QE 4.69
&rst
ixpk= 0, nxpk= 0, iat=1890, -1, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr2=1906,1907,1908,
&end
#
# 133 ASN HD21 134 MET QE 4.69
&rst
ixpk= 0, nxpk= 0, iat=1890, -1, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr2=1906,1907,1908,
&end
#
# 133 ASN HD21 134 MET QE 4.69
&rst
ixpk= 0, nxpk= 0, iat=1890, -1, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr2=1906,1907,1908,
&end
#
# 133 ASN HD22 134 MET HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1891,1897, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 133 ASN HD22 134 MET HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1891,1897, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 133 ASN HD22 134 MET HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1891,1897, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 134 MET HN 134 MET HA 3.71
&rst
ixpk= 0, nxpk= 0, iat=1895,1897, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21, &end
#
# 134 MET HN 134 MET HB2 5.32
&rst
ixpk= 0, nxpk= 0, iat=1895,1899, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82, &end
#
# 134 MET HN 134 MET HB3 4.84
&rst
ixpk= 0, nxpk= 0, iat=1895,1900, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34, &end
#
# 134 MET HN 134 MET HG2 5.79
&rst
ixpk= 0, nxpk= 0, iat=1895,1902, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29, &end
#
# 134 MET HN 134 MET HG2 5.79
&rst
ixpk= 0, nxpk= 0, iat=1895,1902, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29, &end
#
# 134 MET HN 134 MET HG2 5.79
&rst
ixpk= 0, nxpk= 0, iat=1895,1902, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29, &end
#
# 134 MET HN 134 MET HG3 5.17
&rst
ixpk= 0, nxpk= 0, iat=1895,1903, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67, &end
#
# 134 MET HN 134 MET HG3 5.17
&rst
ixpk= 0, nxpk= 0, iat=1895,1903, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67, &end
#
# 134 MET HN 134 MET HG3 5.17
&rst
ixpk= 0, nxpk= 0, iat=1895,1903, r1= 1.30, r2= 1.80, r3= 5.17, r4= 5.67, &end
#
# 134 MET HN 134 MET QE 5.62
&rst
ixpk= 0, nxpk= 0, iat=1895, -1, r1= 1.30, r2= 1.80, r3= 6.75, r4= 7.25,
igr2=1906,1907,1908,
&end
#
# 134 MET HN 134 MET QE 5.62
&rst
ixpk= 0, nxpk= 0, iat=1895, -1, r1= 1.30, r2= 1.80, r3= 6.75, r4= 7.25,
igr2=1906,1907,1908,
&end
#
# 134 MET HN 134 MET QE 5.62
&rst
ixpk= 0, nxpk= 0, iat=1895, -1, r1= 1.30, r2= 1.80, r3= 6.75, r4= 7.25,
igr2=1906,1907,1908,
&end
#
# 134 MET HN 135 SER HN 4.06
&rst
ixpk= 0, nxpk= 0, iat=1895,1912, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56, &end
#
# 134 MET HN 135 SER HN 4.06
&rst
ixpk= 0, nxpk= 0, iat=1895,1912, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56, &end
#
# 134 MET HN 135 SER HN 4.06
&rst
ixpk= 0, nxpk= 0, iat=1895,1912, r1= 1.30, r2= 1.80, r3= 4.06, r4= 4.56, &end
#
# 134 MET HN 142 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1895,2021, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 134 MET HN 142 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1895,2021, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 134 MET HN 142 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1895,2021, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 134 MET HN 142 GLY HA3 5.28
&rst
ixpk= 0, nxpk= 0, iat=1895,2024, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 134 MET HN 142 GLY HA3 5.28
&rst
ixpk= 0, nxpk= 0, iat=1895,2024, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 134 MET HN 142 GLY HA3 5.28
&rst
ixpk= 0, nxpk= 0, iat=1895,2024, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 134 MET HA 134 MET HB2 5.20
&rst
ixpk= 0, nxpk= 0, iat=1897,1899, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70, &end
#
# 134 MET HA 134 MET HB3 4.75
&rst
ixpk= 0, nxpk= 0, iat=1897,1900, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, &end
#
# 134 MET HA 134 MET HG2 5.79
&rst
ixpk= 0, nxpk= 0, iat=1897,1902, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29, &end
#
# 134 MET HA 134 MET QE 6.05
&rst
ixpk= 0, nxpk= 0, iat=1897, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1906,1907,1908,
&end
#
# 134 MET HA 134 MET QE 6.05
&rst
ixpk= 0, nxpk= 0, iat=1897, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1906,1907,1908,
&end
#
# 134 MET HA 134 MET QE 6.05
&rst
ixpk= 0, nxpk= 0, iat=1897, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=1906,1907,1908,
&end
#
# 134 MET HA 135 SER HN 4.41
&rst
ixpk= 0, nxpk= 0, iat=1897,1912, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, &end
#
# 134 MET HA 137 GLN HNE2 5.37
&rst
ixpk= 0, nxpk= 0, iat=1897,1948, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87, &end
#
# 134 MET HA 137 GLN HNE2 5.37
&rst
ixpk= 0, nxpk= 0, iat=1897,1948, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87, &end
#
# 134 MET HA 137 GLN HNE2 5.37
&rst
ixpk= 0, nxpk= 0, iat=1897,1948, r1= 1.30, r2= 1.80, r3= 5.37, r4= 5.87, &end
#
# 134 MET HA 142 GLY HA2 5.98
&rst
ixpk= 0, nxpk= 0, iat=1897,2023, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48, &end
#
# 134 MET HA 142 GLY HA2 5.98
&rst
ixpk= 0, nxpk= 0, iat=1897,2023, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48, &end
#
# 134 MET HA 142 GLY HA2 5.98
&rst
ixpk= 0, nxpk= 0, iat=1897,2023, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48, &end
#
# 134 MET HA 142 GLY HA3 5.98
&rst
ixpk= 0, nxpk= 0, iat=1897,2024, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48, &end
#
# 134 MET HA 142 GLY HA3 5.98
&rst
ixpk= 0, nxpk= 0, iat=1897,2024, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48, &end
#
# 134 MET HA 142 GLY HA3 5.98
&rst
ixpk= 0, nxpk= 0, iat=1897,2024, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48, &end
#
# 134 MET HB2 134 MET HG2 4.67
&rst
ixpk= 0, nxpk= 0, iat=1899,1902, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, &end
#
# 134 MET HB2 134 MET QE 4.40
&rst
ixpk= 0, nxpk= 0, iat=1899, -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
igr2=1906,1907,1908,
&end
#
# 134 MET HB2 134 MET QE 4.40
&rst
ixpk= 0, nxpk= 0, iat=1899, -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
igr2=1906,1907,1908,
&end
#
# 134 MET HB2 134 MET QE 4.40
&rst
ixpk= 0, nxpk= 0, iat=1899, -1, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78,
igr2=1906,1907,1908,
&end
#
# 134 MET HB2 135 SER HN 5.80
&rst
ixpk= 0, nxpk= 0, iat=1899,1912, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30, &end
#
# 134 MET HB2 135 SER HN 5.80
&rst
ixpk= 0, nxpk= 0, iat=1899,1912, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30, &end
#
# 134 MET HB2 135 SER HN 5.80
&rst
ixpk= 0, nxpk= 0, iat=1899,1912, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30, &end
#
# 134 MET HB2 142 GLY HA2 5.45
&rst
ixpk= 0, nxpk= 0, iat=1899,2023, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95, &end
#
# 134 MET HB2 142 GLY HA2 5.45
&rst
ixpk= 0, nxpk= 0, iat=1899,2023, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95, &end
#
# 134 MET HB2 142 GLY HA2 5.45
&rst
ixpk= 0, nxpk= 0, iat=1899,2023, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95, &end
#
# 134 MET HB2 142 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1899,2024, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 134 MET HB2 142 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1899,2024, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 134 MET HB2 142 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1899,2024, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 134 MET HB3 134 MET HB2 4.31
&rst
ixpk= 0, nxpk= 0, iat=1900,1899, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81, &end
#
# 134 MET HB3 134 MET HG2 4.78
&rst
ixpk= 0, nxpk= 0, iat=1900,1902, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, &end
#
# 134 MET HB3 135 SER HN 5.95
&rst
ixpk= 0, nxpk= 0, iat=1900,1912, r1= 1.30, r2= 1.80, r3= 5.95, r4= 6.45, &end
#
# 134 MET HB3 135 SER HN 5.95
&rst
ixpk= 0, nxpk= 0, iat=1900,1912, r1= 1.30, r2= 1.80, r3= 5.95, r4= 6.45, &end
#
# 134 MET HB3 135 SER HN 5.95
&rst
ixpk= 0, nxpk= 0, iat=1900,1912, r1= 1.30, r2= 1.80, r3= 5.95, r4= 6.45, &end
#
# 134 MET HB3 142 GLY HA2 4.30
&rst
ixpk= 0, nxpk= 0, iat=1900,2023, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80, &end
#
# 134 MET HB3 142 GLY HA2 4.30
&rst
ixpk= 0, nxpk= 0, iat=1900,2023, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80, &end
#
# 134 MET HB3 142 GLY HA2 4.30
&rst
ixpk= 0, nxpk= 0, iat=1900,2023, r1= 1.30, r2= 1.80, r3= 4.30, r4= 4.80, &end
#
# 134 MET HB3 142 GLY HA3 5.82
&rst
ixpk= 0, nxpk= 0, iat=1900,2024, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32, &end
#
# 134 MET HB3 142 GLY HA3 5.82
&rst
ixpk= 0, nxpk= 0, iat=1900,2024, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32, &end
#
# 134 MET HB3 142 GLY HA3 5.82
&rst
ixpk= 0, nxpk= 0, iat=1900,2024, r1= 1.30, r2= 1.80, r3= 5.82, r4= 6.32, &end
#
# 134 MET HG2 134 MET QE 4.71
&rst
ixpk= 0, nxpk= 0, iat=1902, -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr2=1906,1907,1908,
&end
#
# 134 MET HG2 134 MET QE 4.71
&rst
ixpk= 0, nxpk= 0, iat=1902, -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr2=1906,1907,1908,
&end
#
# 134 MET HG2 134 MET QE 4.71
&rst
ixpk= 0, nxpk= 0, iat=1902, -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr2=1906,1907,1908,
&end
#
# 134 MET HG2 137 GLN HNE2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1902,1948, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 134 MET HG2 137 GLN HNE2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1902,1948, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 134 MET HG2 137 GLN HNE2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1902,1948, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 134 MET HG2 142 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1902,2024, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 134 MET HG2 142 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1902,2024, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 134 MET HG2 142 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1902,2024, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 134 MET HG3 134 MET HG2 4.04
&rst
ixpk= 0, nxpk= 0, iat=1903,1902, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, &end
#
# 134 MET HG3 134 MET QE 3.18
&rst
ixpk= 0, nxpk= 0, iat=1903, -1, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,
igr2=1906,1907,1908,
&end
#
# 134 MET HG3 134 MET QE 3.18
&rst
ixpk= 0, nxpk= 0, iat=1903, -1, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,
igr2=1906,1907,1908,
&end
#
# 134 MET HG3 134 MET QE 3.18
&rst
ixpk= 0, nxpk= 0, iat=1903, -1, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32,
igr2=1906,1907,1908,
&end
#
# 134 MET HG3 137 GLN HNE2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1903,1948, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 134 MET HG3 137 GLN HNE2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1903,1948, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 134 MET HG3 137 GLN HNE2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1903,1948, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 134 MET QE 135 SER HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1912, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1906,1907,1908,
&end
#
# 134 MET QE 135 SER HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1912, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1906,1907,1908,
&end
#
# 134 MET QE 135 SER HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1912, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1906,1907,1908,
&end
#
# 135 SER HN 135 SER HA 4.37
&rst
ixpk= 0, nxpk= 0, iat=1912,1914, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87, &end
#
# 135 SER HN 135 SER HB2 4.38
&rst
ixpk= 0, nxpk= 0, iat=1912,1916, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88, &end
#
# 135 SER HN 135 SER HB2 4.38
&rst
ixpk= 0, nxpk= 0, iat=1912,1916, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88, &end
#
# 135 SER HN 135 SER HB2 4.38
&rst
ixpk= 0, nxpk= 0, iat=1912,1916, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88, &end
#
# 135 SER HN 135 SER HB3 4.21
&rst
ixpk= 0, nxpk= 0, iat=1912,1917, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71, &end
#
# 135 SER HN 135 SER HB3 4.21
&rst
ixpk= 0, nxpk= 0, iat=1912,1917, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71, &end
#
# 135 SER HN 135 SER HB3 4.21
&rst
ixpk= 0, nxpk= 0, iat=1912,1917, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71, &end
#
# 135 SER HN 136 ASP HN 5.68
&rst
ixpk= 0, nxpk= 0, iat=1912,1923, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18, &end
#
# 135 SER HN 136 ASP HN 5.68
&rst
ixpk= 0, nxpk= 0, iat=1912,1923, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18, &end
#
# 135 SER HN 136 ASP HN 5.68
&rst
ixpk= 0, nxpk= 0, iat=1912,1923, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18, &end
#
# 135 SER HN 142 GLY HN 5.75
&rst
ixpk= 0, nxpk= 0, iat=1912,2021, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25, &end
#
# 135 SER HN 142 GLY HN 5.75
&rst
ixpk= 0, nxpk= 0, iat=1912,2021, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25, &end
#
# 135 SER HN 142 GLY HN 5.75
&rst
ixpk= 0, nxpk= 0, iat=1912,2021, r1= 1.30, r2= 1.80, r3= 5.75, r4= 6.25, &end
#
# 135 SER HN 142 GLY HA2 5.98
&rst
ixpk= 0, nxpk= 0, iat=1912,2023, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48, &end
#
# 135 SER HN 142 GLY HA2 5.98
&rst
ixpk= 0, nxpk= 0, iat=1912,2023, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48, &end
#
# 135 SER HN 142 GLY HA2 5.98
&rst
ixpk= 0, nxpk= 0, iat=1912,2023, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48, &end
#
# 135 SER HN 142 GLY HA3 4.88
&rst
ixpk= 0, nxpk= 0, iat=1912,2024, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38, &end
#
# 135 SER HN 142 GLY HA3 4.88
&rst
ixpk= 0, nxpk= 0, iat=1912,2024, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38, &end
#
# 135 SER HN 142 GLY HA3 4.88
&rst
ixpk= 0, nxpk= 0, iat=1912,2024, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38, &end
#
# 135 SER HA 135 SER HB2 4.54
&rst
ixpk= 0, nxpk= 0, iat=1914,1916, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 135 SER HA 135 SER HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1914,1917, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 135 SER HA 136 ASP HN 3.60
&rst
ixpk= 0, nxpk= 0, iat=1914,1923, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10, &end
#
# 135 SER HA 136 ASP HN 3.60
&rst
ixpk= 0, nxpk= 0, iat=1914,1923, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10, &end
#
# 135 SER HA 136 ASP HN 3.60
&rst
ixpk= 0, nxpk= 0, iat=1914,1923, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10, &end
#
# 135 SER HA 136 ASP HA 5.67
&rst
ixpk= 0, nxpk= 0, iat=1914,1925, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17, &end
#
# 135 SER HA 136 ASP HA 5.67
&rst
ixpk= 0, nxpk= 0, iat=1914,1925, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17, &end
#
# 135 SER HA 136 ASP HA 5.67
&rst
ixpk= 0, nxpk= 0, iat=1914,1925, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17, &end
#
# 135 SER HA 136 ASP HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1914,1928, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 135 SER HA 136 ASP HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1914,1928, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 135 SER HA 136 ASP HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1914,1928, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 135 SER HA 137 GLN HN 4.40
&rst
ixpk= 0, nxpk= 0, iat=1914,1935, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 135 SER HA 137 GLN HN 4.40
&rst
ixpk= 0, nxpk= 0, iat=1914,1935, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 135 SER HA 137 GLN HN 4.40
&rst
ixpk= 0, nxpk= 0, iat=1914,1935, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, &end
#
# 135 SER HB2 135 SER HB3 3.52
&rst
ixpk= 0, nxpk= 0, iat=1916,1917, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02, &end
#
# 135 SER HB2 136 ASP HN 4.67
&rst
ixpk= 0, nxpk= 0, iat=1916,1923, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, &end
#
# 135 SER HB2 136 ASP HN 4.67
&rst
ixpk= 0, nxpk= 0, iat=1916,1923, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, &end
#
# 135 SER HB2 136 ASP HN 4.67
&rst
ixpk= 0, nxpk= 0, iat=1916,1923, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, &end
#
# 135 SER HB3 136 ASP HN 4.90
&rst
ixpk= 0, nxpk= 0, iat=1917,1923, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40, &end
#
# 135 SER HB3 136 ASP HN 4.90
&rst
ixpk= 0, nxpk= 0, iat=1917,1923, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40, &end
#
# 135 SER HB3 136 ASP HN 4.90
&rst
ixpk= 0, nxpk= 0, iat=1917,1923, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40, &end
#
# 135 SER HB3 137 GLN HN 5.83
&rst
ixpk= 0, nxpk= 0, iat=1917,1935, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33, &end
#
# 135 SER HB3 137 GLN HN 5.83
&rst
ixpk= 0, nxpk= 0, iat=1917,1935, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33, &end
#
# 135 SER HB3 137 GLN HN 5.83
&rst
ixpk= 0, nxpk= 0, iat=1917,1935, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33, &end
#
# 136 ASP HN 136 ASP HA 4.36
&rst
ixpk= 0, nxpk= 0, iat=1923,1925, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86, &end
#
# 136 ASP HN 136 ASP HB2 4.21
&rst
ixpk= 0, nxpk= 0, iat=1923,1927, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71, &end
#
# 136 ASP HN 136 ASP HB2 4.21
&rst
ixpk= 0, nxpk= 0, iat=1923,1927, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71, &end
#
# 136 ASP HN 136 ASP HB2 4.21
&rst
ixpk= 0, nxpk= 0, iat=1923,1927, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71, &end
#
# 136 ASP HN 136 ASP HB3 4.43
&rst
ixpk= 0, nxpk= 0, iat=1923,1928, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93, &end
#
# 136 ASP HN 136 ASP HB3 4.43
&rst
ixpk= 0, nxpk= 0, iat=1923,1928, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93, &end
#
# 136 ASP HN 136 ASP HB3 4.43
&rst
ixpk= 0, nxpk= 0, iat=1923,1928, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93, &end
#
# 136 ASP HN 137 GLN HN 3.55
&rst
ixpk= 0, nxpk= 0, iat=1923,1935, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05, &end
#
# 136 ASP HN 137 GLN HN 3.55
&rst
ixpk= 0, nxpk= 0, iat=1923,1935, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05, &end
#
# 136 ASP HN 137 GLN HN 3.55
&rst
ixpk= 0, nxpk= 0, iat=1923,1935, r1= 1.30, r2= 1.80, r3= 3.55, r4= 4.05, &end
#
# 136 ASP HN 137 GLN HN 5.28
&rst
ixpk= 0, nxpk= 0, iat=1923,1935, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 136 ASP HN 137 GLN HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1923,1937, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 136 ASP HN 137 GLN HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1923,1937, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 136 ASP HN 137 GLN HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=1923,1937, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 136 ASP HN 137 GLN HB3 5.57
&rst
ixpk= 0, nxpk= 0, iat=1923,1940, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07, &end
#
# 136 ASP HN 137 GLN HB3 5.57
&rst
ixpk= 0, nxpk= 0, iat=1923,1940, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07, &end
#
# 136 ASP HN 137 GLN HB3 5.57
&rst
ixpk= 0, nxpk= 0, iat=1923,1940, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07, &end
#
# 136 ASP HN 137 GLN HNE2 5.72
&rst
ixpk= 0, nxpk= 0, iat=1923,1948, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 136 ASP HN 137 GLN HNE2 5.72
&rst
ixpk= 0, nxpk= 0, iat=1923,1948, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 136 ASP HN 137 GLN HNE2 5.72
&rst
ixpk= 0, nxpk= 0, iat=1923,1948, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 136 ASP HN 137 GLN HG3 5.72
&rst
ixpk= 0, nxpk= 0, iat=1923,1943, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 136 ASP HN 137 GLN HG3 5.72
&rst
ixpk= 0, nxpk= 0, iat=1923,1943, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 136 ASP HN 137 GLN HG3 5.72
&rst
ixpk= 0, nxpk= 0, iat=1923,1943, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 136 ASP HN 142 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1923,2021, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 136 ASP HN 142 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1923,2021, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 136 ASP HN 142 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1923,2021, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 136 ASP HA 136 ASP HB2 4.58
&rst
ixpk= 0, nxpk= 0, iat=1925,1927, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08, &end
#
# 136 ASP HA 136 ASP HB3 4.81
&rst
ixpk= 0, nxpk= 0, iat=1925,1928, r1= 1.30, r2= 1.80, r3= 4.81, r4= 5.31, &end
#
# 136 ASP HA 137 GLN HN 2.97
&rst
ixpk= 0, nxpk= 0, iat=1925,1935, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 136 ASP HA 137 GLN HN 4.85
&rst
ixpk= 0, nxpk= 0, iat=1925,1935, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35, &end
#
# 136 ASP HA 137 GLN HNE2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1925,1948, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 136 ASP HA 137 GLN HNE2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1925,1948, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 136 ASP HA 137 GLN HNE2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1925,1948, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 136 ASP HB2 137 GLN HN 5.31
&rst
ixpk= 0, nxpk= 0, iat=1927,1935, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81, &end
#
# 136 ASP HB2 137 GLN HN 5.31
&rst
ixpk= 0, nxpk= 0, iat=1927,1935, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81, &end
#
# 136 ASP HB2 137 GLN HN 5.31
&rst
ixpk= 0, nxpk= 0, iat=1927,1935, r1= 1.30, r2= 1.80, r3= 5.31, r4= 5.81, &end
#
# 136 ASP HB2 137 GLN HN 5.72
&rst
ixpk= 0, nxpk= 0, iat=1927,1935, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 136 ASP HB2 137 GLN HNE2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1927,1948, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 136 ASP HB2 137 GLN HNE2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1927,1948, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 136 ASP HB2 137 GLN HNE2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1927,1948, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 136 ASP HB3 136 ASP HB2 3.66
&rst
ixpk= 0, nxpk= 0, iat=1928,1927, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16, &end
#
# 136 ASP HB3 137 GLN HN 5.68
&rst
ixpk= 0, nxpk= 0, iat=1928,1935, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18, &end
#
# 136 ASP HB3 137 GLN HN 5.68
&rst
ixpk= 0, nxpk= 0, iat=1928,1935, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18, &end
#
# 136 ASP HB3 137 GLN HN 5.68
&rst
ixpk= 0, nxpk= 0, iat=1928,1935, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18, &end
#
# 136 ASP HB3 137 GLN HA 5.18
&rst
ixpk= 0, nxpk= 0, iat=1928,1937, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68, &end
#
# 136 ASP HB3 137 GLN HA 5.18
&rst
ixpk= 0, nxpk= 0, iat=1928,1937, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68, &end
#
# 136 ASP HB3 137 GLN HA 5.18
&rst
ixpk= 0, nxpk= 0, iat=1928,1937, r1= 1.30, r2= 1.80, r3= 5.18, r4= 5.68, &end
#
# 136 ASP HB3 137 GLN HNE2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1928,1948, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 136 ASP HB3 137 GLN HNE2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1928,1948, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 136 ASP HB3 137 GLN HNE2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1928,1948, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 137 GLN HN 137 GLN HA 4.22
&rst
ixpk= 0, nxpk= 0, iat=1935,1937, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 137 GLN HN 137 GLN HB2 4.28
&rst
ixpk= 0, nxpk= 0, iat=1935,1939, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78, &end
#
# 137 GLN HN 137 GLN HB2 4.28
&rst
ixpk= 0, nxpk= 0, iat=1935,1939, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78, &end
#
# 137 GLN HN 137 GLN HB2 4.28
&rst
ixpk= 0, nxpk= 0, iat=1935,1939, r1= 1.30, r2= 1.80, r3= 4.28, r4= 4.78, &end
#
# 137 GLN HN 137 GLN HB3 4.11
&rst
ixpk= 0, nxpk= 0, iat=1935,1940, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 137 GLN HN 137 GLN HB3 4.11
&rst
ixpk= 0, nxpk= 0, iat=1935,1940, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 137 GLN HN 137 GLN HB3 4.11
&rst
ixpk= 0, nxpk= 0, iat=1935,1940, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 137 GLN HN 137 GLN HNE1 6.05
&rst
ixpk= 0, nxpk= 0, iat=1935,1947, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 137 GLN HN 137 GLN HNE1 6.05
&rst
ixpk= 0, nxpk= 0, iat=1935,1947, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 137 GLN HN 137 GLN HNE1 6.05
&rst
ixpk= 0, nxpk= 0, iat=1935,1947, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 137 GLN HN 137 GLN HNE2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1935,1948, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 137 GLN HN 137 GLN HNE2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1935,1948, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 137 GLN HN 137 GLN HNE2 6.05
&rst
ixpk= 0, nxpk= 0, iat=1935,1948, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 137 GLN HN 137 GLN HG2 5.30
&rst
ixpk= 0, nxpk= 0, iat=1935,1942, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80, &end
#
# 137 GLN HN 137 GLN HG2 5.30
&rst
ixpk= 0, nxpk= 0, iat=1935,1942, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80, &end
#
# 137 GLN HN 137 GLN HG2 5.30
&rst
ixpk= 0, nxpk= 0, iat=1935,1942, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80, &end
#
# 137 GLN HN 137 GLN HG3 4.69
&rst
ixpk= 0, nxpk= 0, iat=1935,1943, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, &end
#
# 137 GLN HN 137 GLN HG3 4.69
&rst
ixpk= 0, nxpk= 0, iat=1935,1943, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, &end
#
# 137 GLN HN 137 GLN HG3 4.69
&rst
ixpk= 0, nxpk= 0, iat=1935,1943, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, &end
#
# 137 GLN HN 139 LYS HN 5.92
&rst
ixpk= 0, nxpk= 0, iat=1935,1966, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42, &end
#
# 137 GLN HN 139 LYS HN 5.92
&rst
ixpk= 0, nxpk= 0, iat=1935,1966, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42, &end
#
# 137 GLN HN 139 LYS HN 5.92
&rst
ixpk= 0, nxpk= 0, iat=1935,1966, r1= 1.30, r2= 1.80, r3= 5.92, r4= 6.42, &end
#
# 137 GLN HN 141 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1935,2002, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 137 GLN HN 141 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1935,2002, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 137 GLN HN 141 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1935,2002, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 137 GLN HN 142 GLY HN 5.32
&rst
ixpk= 0, nxpk= 0, iat=1935,2021, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82, &end
#
# 137 GLN HN 142 GLY HN 5.32
&rst
ixpk= 0, nxpk= 0, iat=1935,2021, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82, &end
#
# 137 GLN HN 142 GLY HN 5.32
&rst
ixpk= 0, nxpk= 0, iat=1935,2021, r1= 1.30, r2= 1.80, r3= 5.32, r4= 5.82, &end
#
# 137 GLN HN 142 GLY HA3 5.03
&rst
ixpk= 0, nxpk= 0, iat=1935,2024, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53, &end
#
# 137 GLN HN 142 GLY HA3 5.03
&rst
ixpk= 0, nxpk= 0, iat=1935,2024, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53, &end
#
# 137 GLN HN 142 GLY HA3 5.03
&rst
ixpk= 0, nxpk= 0, iat=1935,2024, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53, &end
#
# 137 GLN HA 137 GLN HB2 4.05
&rst
ixpk= 0, nxpk= 0, iat=1937,1939, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55, &end
#
# 137 GLN HA 137 GLN HB3 4.22
&rst
ixpk= 0, nxpk= 0, iat=1937,1940, r1= 1.30, r2= 1.80, r3= 4.22, r4= 4.72, &end
#
# 137 GLN HA 137 GLN HNE1 6.00
&rst
ixpk= 0, nxpk= 0, iat=1937,1947, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 137 GLN HA 137 GLN HNE1 6.00
&rst
ixpk= 0, nxpk= 0, iat=1937,1947, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 137 GLN HA 137 GLN HNE1 6.00
&rst
ixpk= 0, nxpk= 0, iat=1937,1947, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 137 GLN HA 137 GLN HG2 4.29
&rst
ixpk= 0, nxpk= 0, iat=1937,1942, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79, &end
#
# 137 GLN HA 137 GLN HG2 4.29
&rst
ixpk= 0, nxpk= 0, iat=1937,1942, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79, &end
#
# 137 GLN HA 137 GLN HG2 4.29
&rst
ixpk= 0, nxpk= 0, iat=1937,1942, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79, &end
#
# 137 GLN HA 137 GLN HG3 4.20
&rst
ixpk= 0, nxpk= 0, iat=1937,1943, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 137 GLN HA 137 GLN HG3 4.20
&rst
ixpk= 0, nxpk= 0, iat=1937,1943, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 137 GLN HA 137 GLN HG3 4.20
&rst
ixpk= 0, nxpk= 0, iat=1937,1943, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 137 GLN HA 138 PRO HG3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1937,1957, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 137 GLN HA 138 PRO HG3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1937,1957, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 137 GLN HA 138 PRO HG3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1937,1957, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 137 GLN HA 139 LYS HN 4.65
&rst
ixpk= 0, nxpk= 0, iat=1937,1966, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15, &end
#
# 137 GLN HA 139 LYS HN 4.65
&rst
ixpk= 0, nxpk= 0, iat=1937,1966, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15, &end
#
# 137 GLN HA 139 LYS HN 4.65
&rst
ixpk= 0, nxpk= 0, iat=1937,1966, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15, &end
#
# 137 GLN HB2 137 GLN HB3 3.23
&rst
ixpk= 0, nxpk= 0, iat=1939,1940, r1= 1.30, r2= 1.80, r3= 3.23, r4= 3.73, &end
#
# 137 GLN HB2 137 GLN HNE1 6.05
&rst
ixpk= 0, nxpk= 0, iat=1939,1947, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 137 GLN HB2 137 GLN HNE1 6.05
&rst
ixpk= 0, nxpk= 0, iat=1939,1947, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 137 GLN HB2 137 GLN HNE1 6.05
&rst
ixpk= 0, nxpk= 0, iat=1939,1947, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 137 GLN HB2 137 GLN HG3 3.93
&rst
ixpk= 0, nxpk= 0, iat=1939,1943, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43, &end
#
# 137 GLN HB2 138 PRO HA 5.71
&rst
ixpk= 0, nxpk= 0, iat=1939,1962, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21, &end
#
# 137 GLN HB2 138 PRO HA 5.71
&rst
ixpk= 0, nxpk= 0, iat=1939,1962, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21, &end
#
# 137 GLN HB2 138 PRO HA 5.71
&rst
ixpk= 0, nxpk= 0, iat=1939,1962, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21, &end
#
# 137 GLN HNE1 137 GLN HNE2 2.64
&rst
ixpk= 0, nxpk= 0, iat=1947,1948, r1= 1.30, r2= 1.80, r3= 2.64, r4= 3.14, &end
#
# 137 GLN HNE1 143 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1947,2031, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 137 GLN HNE1 143 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1947,2031, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 137 GLN HNE1 143 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1947,2031, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 137 GLN HG2 137 GLN HNE1 5.21
&rst
ixpk= 0, nxpk= 0, iat=1942,1947, r1= 1.30, r2= 1.80, r3= 5.21, r4= 5.71, &end
#
# 137 GLN HG2 137 GLN HNE2 5.91
&rst
ixpk= 0, nxpk= 0, iat=1942,1948, r1= 1.30, r2= 1.80, r3= 5.91, r4= 6.41, &end
#
# 137 GLN HG3 137 GLN HNE1 4.52
&rst
ixpk= 0, nxpk= 0, iat=1943,1947, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02, &end
#
# 137 GLN HG3 137 GLN HNE2 5.45
&rst
ixpk= 0, nxpk= 0, iat=1943,1948, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95, &end
#
# 138 PRO HA 138 PRO HB2 4.26
&rst
ixpk= 0, nxpk= 0, iat=1962,1959, r1= 1.30, r2= 1.80, r3= 4.26, r4= 4.76, &end
#
# 138 PRO HA 138 PRO HG3 5.79
&rst
ixpk= 0, nxpk= 0, iat=1962,1957, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29, &end
#
# 138 PRO HA 139 LYS HN 3.50 (#)
&rst
ixpk= 0, nxpk= 0, iat=1962,1966, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 138 PRO HA 139 LYS HN 4.57
&rst
ixpk= 0, nxpk= 0, iat=1962,1966, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07, &end
#
# 138 PRO HB2 139 LYS HN 5.72
&rst
ixpk= 0, nxpk= 0, iat=1959,1966, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 138 PRO HB3 138 PRO HA 3.81
&rst
ixpk= 0, nxpk= 0, iat=1960,1962, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31, &end
#
# 138 PRO HB3 138 PRO HD3 5.83
&rst
ixpk= 0, nxpk= 0, iat=1960,1954, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33, &end
#
# 138 PRO HB3 139 LYS HN 5.27
&rst
ixpk= 0, nxpk= 0, iat=1960,1966, r1= 1.30, r2= 1.80, r3= 5.27, r4= 5.77, &end
#
# 138 PRO HD2 139 LYS HN 5.15
&rst
ixpk= 0, nxpk= 0, iat=1953,1966, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65, &end
#
# 138 PRO HD2 139 LYS HN 5.15
&rst
ixpk= 0, nxpk= 0, iat=1953,1966, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65, &end
#
# 138 PRO HD2 139 LYS HN 5.15
&rst
ixpk= 0, nxpk= 0, iat=1953,1966, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65, &end
#
# 138 PRO HD3 138 PRO HA 5.64
&rst
ixpk= 0, nxpk= 0, iat=1954,1962, r1= 1.30, r2= 1.80, r3= 5.64, r4= 6.14, &end
#
# 138 PRO HD3 139 LYS HN 4.93
&rst
ixpk= 0, nxpk= 0, iat=1954,1966, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43, &end
#
# 138 PRO HD3 139 LYS HN 4.93
&rst
ixpk= 0, nxpk= 0, iat=1954,1966, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43, &end
#
# 138 PRO HD3 139 LYS HN 4.93
&rst
ixpk= 0, nxpk= 0, iat=1954,1966, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43, &end
#
# 138 PRO HG2 138 PRO HA 4.54
&rst
ixpk= 0, nxpk= 0, iat=1956,1962, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 138 PRO HG2 138 PRO HD3 4.61
&rst
ixpk= 0, nxpk= 0, iat=1956,1954, r1= 1.30, r2= 1.80, r3= 4.61, r4= 5.11, &end
#
# 138 PRO HG2 138 PRO HG3 3.88
&rst
ixpk= 0, nxpk= 0, iat=1956,1957, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38, &end
#
# 138 PRO HG2 139 LYS HN 4.97
&rst
ixpk= 0, nxpk= 0, iat=1956,1966, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 138 PRO HG2 139 LYS HN 4.97
&rst
ixpk= 0, nxpk= 0, iat=1956,1966, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 138 PRO HG2 139 LYS HN 4.97
&rst
ixpk= 0, nxpk= 0, iat=1956,1966, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 138 PRO HG3 138 PRO HD3 4.60
&rst
ixpk= 0, nxpk= 0, iat=1957,1954, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 138 PRO HG3 139 LYS HN 5.74
&rst
ixpk= 0, nxpk= 0, iat=1957,1966, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24, &end
#
# 138 PRO HG3 139 LYS HN 5.74
&rst
ixpk= 0, nxpk= 0, iat=1957,1966, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24, &end
#
# 138 PRO HG3 139 LYS HN 5.74
&rst
ixpk= 0, nxpk= 0, iat=1957,1966, r1= 1.30, r2= 1.80, r3= 5.74, r4= 6.24, &end
#
# 138 PRO HG3 139 LYS HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1957,1971, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 138 PRO HG3 139 LYS HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1957,1971, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 138 PRO HG3 139 LYS HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat=1957,1971, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 138 PRO HG3 139 LYS QG 5.53
&rst
ixpk= 0, nxpk= 0, iat=1957, -1, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,
igr2=1973,1974,
&end
#
# 138 PRO HG3 139 LYS QG 5.53
&rst
ixpk= 0, nxpk= 0, iat=1957, -1, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,
igr2=1973,1974,
&end
#
# 138 PRO HG3 139 LYS QG 5.53
&rst
ixpk= 0, nxpk= 0, iat=1957, -1, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,
igr2=1973,1974,
&end
#
# 139 LYS HN 139 LYS HA 4.80
&rst
ixpk= 0, nxpk= 0, iat=1966,1968, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30, &end
#
# 139 LYS HN 139 LYS HB2 4.33
&rst
ixpk= 0, nxpk= 0, iat=1966,1970, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83, &end
#
# 139 LYS HN 139 LYS HB2 4.33
&rst
ixpk= 0, nxpk= 0, iat=1966,1970, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83, &end
#
# 139 LYS HN 139 LYS HB2 4.33
&rst
ixpk= 0, nxpk= 0, iat=1966,1970, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83, &end
#
# 139 LYS HN 139 LYS HB3 3.77
&rst
ixpk= 0, nxpk= 0, iat=1966,1971, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27, &end
#
# 139 LYS HN 139 LYS HB3 3.77
&rst
ixpk= 0, nxpk= 0, iat=1966,1971, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27, &end
#
# 139 LYS HN 139 LYS HB3 3.77
&rst
ixpk= 0, nxpk= 0, iat=1966,1971, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27, &end
#
# 139 LYS HN 139 LYS QE 4.86
&rst
ixpk= 0, nxpk= 0, iat=1966, -1, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
igr2=1979,1980,
&end
#
# 139 LYS HN 139 LYS QE 4.86
&rst
ixpk= 0, nxpk= 0, iat=1966, -1, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
igr2=1979,1980,
&end
#
# 139 LYS HN 139 LYS QE 4.86
&rst
ixpk= 0, nxpk= 0, iat=1966, -1, r1= 1.30, r2= 1.80, r3= 5.46, r4= 5.96,
igr2=1979,1980,
&end
#
# 139 LYS HN 139 LYS QG 5.19
&rst
ixpk= 0, nxpk= 0, iat=1966, -1, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33,
igr2=1973,1974,
&end
#
# 139 LYS HN 139 LYS QG 5.19
&rst
ixpk= 0, nxpk= 0, iat=1966, -1, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33,
igr2=1973,1974,
&end
#
# 139 LYS HN 139 LYS QG 5.19
&rst
ixpk= 0, nxpk= 0, iat=1966, -1, r1= 1.30, r2= 1.80, r3= 5.83, r4= 6.33,
igr2=1973,1974,
&end
#
# 139 LYS HN 140 PRO HD2 5.58
&rst
ixpk= 0, nxpk= 0, iat=1966,1989, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08, &end
#
# 139 LYS HN 140 PRO HD2 5.58
&rst
ixpk= 0, nxpk= 0, iat=1966,1989, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08, &end
#
# 139 LYS HN 140 PRO HD2 5.58
&rst
ixpk= 0, nxpk= 0, iat=1966,1989, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08, &end
#
# 139 LYS HN 141 LEU HN 6.50
&rst
ixpk= 0, nxpk= 0, iat=1966,2002, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00, &end
#
# 139 LYS HN 143 GLY HN 5.87
&rst
ixpk= 0, nxpk= 0, iat=1966,2028, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37, &end
#
# 139 LYS HN 143 GLY HN 5.87
&rst
ixpk= 0, nxpk= 0, iat=1966,2028, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37, &end
#
# 139 LYS HN 143 GLY HN 5.87
&rst
ixpk= 0, nxpk= 0, iat=1966,2028, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37, &end
#
# 139 LYS HN 143 GLY HA2 4.35
&rst
ixpk= 0, nxpk= 0, iat=1966,2030, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85, &end
#
# 139 LYS HN 143 GLY HA2 4.35
&rst
ixpk= 0, nxpk= 0, iat=1966,2030, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85, &end
#
# 139 LYS HN 143 GLY HA2 4.35
&rst
ixpk= 0, nxpk= 0, iat=1966,2030, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85, &end
#
# 139 LYS HA 139 LYS HB2 4.05
&rst
ixpk= 0, nxpk= 0, iat=1968,1970, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55, &end
#
# 139 LYS HA 139 LYS QG 3.96
&rst
ixpk= 0, nxpk= 0, iat=1968, -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
igr2=1973,1974,
&end
#
# 139 LYS HA 139 LYS QG 3.96
&rst
ixpk= 0, nxpk= 0, iat=1968, -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
igr2=1973,1974,
&end
#
# 139 LYS HA 139 LYS QG 3.96
&rst
ixpk= 0, nxpk= 0, iat=1968, -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
igr2=1973,1974,
&end
#
# 139 LYS HA 140 PRO HA 5.63
&rst
ixpk= 0, nxpk= 0, iat=1968,1998, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13, &end
#
# 139 LYS HA 140 PRO HD2 3.94
&rst
ixpk= 0, nxpk= 0, iat=1968,1989, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44, &end
#
# 139 LYS HA 140 PRO HD2 3.94
&rst
ixpk= 0, nxpk= 0, iat=1968,1989, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44, &end
#
# 139 LYS HA 140 PRO HD2 3.94
&rst
ixpk= 0, nxpk= 0, iat=1968,1989, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44, &end
#
# 139 LYS HA 140 PRO HD3 5.59
&rst
ixpk= 0, nxpk= 0, iat=1968,1990, r1= 1.30, r2= 1.80, r3= 5.59, r4= 6.09, &end
#
# 139 LYS HA 140 PRO HG3 4.73
&rst
ixpk= 0, nxpk= 0, iat=1968,1993, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, &end
#
# 139 LYS HA 140 PRO HG3 4.73
&rst
ixpk= 0, nxpk= 0, iat=1968,1993, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, &end
#
# 139 LYS HA 140 PRO HG3 4.73
&rst
ixpk= 0, nxpk= 0, iat=1968,1993, r1= 1.30, r2= 1.80, r3= 4.73, r4= 5.23, &end
#
# 139 LYS HA 143 GLY HN 5.76
&rst
ixpk= 0, nxpk= 0, iat=1968,2028, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26, &end
#
# 139 LYS HA 143 GLY HN 5.76
&rst
ixpk= 0, nxpk= 0, iat=1968,2028, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26, &end
#
# 139 LYS HA 143 GLY HN 5.76
&rst
ixpk= 0, nxpk= 0, iat=1968,2028, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26, &end
#
# 139 LYS HB2 140 PRO HD2 4.98
&rst
ixpk= 0, nxpk= 0, iat=1970,1989, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48, &end
#
# 139 LYS HB2 140 PRO HD2 4.98
&rst
ixpk= 0, nxpk= 0, iat=1970,1989, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48, &end
#
# 139 LYS HB2 140 PRO HD2 4.98
&rst
ixpk= 0, nxpk= 0, iat=1970,1989, r1= 1.30, r2= 1.80, r3= 4.98, r4= 5.48, &end
#
# 139 LYS HB2 143 GLY HN 4.69
&rst
ixpk= 0, nxpk= 0, iat=1970,2028, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, &end
#
# 139 LYS HB2 143 GLY HN 4.69
&rst
ixpk= 0, nxpk= 0, iat=1970,2028, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, &end
#
# 139 LYS HB2 143 GLY HN 4.69
&rst
ixpk= 0, nxpk= 0, iat=1970,2028, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, &end
#
# 139 LYS HB2 143 GLY HA2 4.25
&rst
ixpk= 0, nxpk= 0, iat=1970,2030, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75, &end
#
# 139 LYS HB2 143 GLY HA2 4.25
&rst
ixpk= 0, nxpk= 0, iat=1970,2030, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75, &end
#
# 139 LYS HB2 143 GLY HA2 4.25
&rst
ixpk= 0, nxpk= 0, iat=1970,2030, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75, &end
#
# 139 LYS HB2 144 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1970,2035, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 139 LYS HB2 144 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1970,2035, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 139 LYS HB2 144 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1970,2035, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 139 LYS HB3 139 LYS HB2 3.46
&rst
ixpk= 0, nxpk= 0, iat=1971,1970, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96, &end
#
# 139 LYS HB3 140 PRO HD2 5.10
&rst
ixpk= 0, nxpk= 0, iat=1971,1989, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, &end
#
# 139 LYS HB3 140 PRO HD2 5.10
&rst
ixpk= 0, nxpk= 0, iat=1971,1989, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, &end
#
# 139 LYS HB3 140 PRO HD2 5.10
&rst
ixpk= 0, nxpk= 0, iat=1971,1989, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60, &end
#
# 139 LYS HB3 143 GLY HN 4.47
&rst
ixpk= 0, nxpk= 0, iat=1971,2028, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97, &end
#
# 139 LYS HB3 143 GLY HN 4.47
&rst
ixpk= 0, nxpk= 0, iat=1971,2028, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97, &end
#
# 139 LYS HB3 143 GLY HN 4.47
&rst
ixpk= 0, nxpk= 0, iat=1971,2028, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97, &end
#
# 139 LYS HB3 143 GLY HA2 4.54
&rst
ixpk= 0, nxpk= 0, iat=1971,2030, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 139 LYS HB3 143 GLY HA2 4.54
&rst
ixpk= 0, nxpk= 0, iat=1971,2030, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 139 LYS HB3 143 GLY HA2 4.54
&rst
ixpk= 0, nxpk= 0, iat=1971,2030, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 139 LYS HB3 144 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1971,2035, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 139 LYS HB3 144 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1971,2035, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 139 LYS HB3 144 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1971,2035, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 139 LYS QD 139 LYS QE 5.13
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.46, r4= 6.96,
igr1=1976,1977,
igr2=1979,1980,
&end
#
# 139 LYS QD 140 PRO HD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1989, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1=1976,1977,
&end
#
# 139 LYS QD 140 PRO HD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1989, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1=1976,1977,
&end
#
# 139 LYS QD 140 PRO HD2 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,1989, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1=1976,1977,
&end
#
# 139 LYS QE 143 GLY HA2 5.13
&rst
ixpk= 0, nxpk= 0, iat= -1,2030, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
igr1=1979,1980,
&end
#
# 139 LYS QE 143 GLY HA2 5.13
&rst
ixpk= 0, nxpk= 0, iat= -1,2030, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
igr1=1979,1980,
&end
#
# 139 LYS QE 143 GLY HA2 5.13
&rst
ixpk= 0, nxpk= 0, iat= -1,2030, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
igr1=1979,1980,
&end
#
# 139 LYS QG 139 LYS QD 3.30
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
igr1=1973,1974,
igr2=1976,1977,
&end
#
# 139 LYS QG 139 LYS QD 3.30
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
igr1=1973,1974,
igr2=1976,1977,
&end
#
# 139 LYS QG 139 LYS QD 3.30
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
igr1=1973,1974,
igr2=1976,1977,
&end
#
# 139 LYS QG 140 PRO HD2 5.21
&rst
ixpk= 0, nxpk= 0, iat= -1,1989, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
igr1=1973,1974,
&end
#
# 139 LYS QG 140 PRO HD2 5.21
&rst
ixpk= 0, nxpk= 0, iat= -1,1989, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
igr1=1973,1974,
&end
#
# 139 LYS QG 140 PRO HD2 5.21
&rst
ixpk= 0, nxpk= 0, iat= -1,1989, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
igr1=1973,1974,
&end
#
# 139 LYS QG 140 PRO HD3 3.99
&rst
ixpk= 0, nxpk= 0, iat= -1,1990, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
igr1=1973,1974,
&end
#
# 139 LYS QG 140 PRO HD3 3.99
&rst
ixpk= 0, nxpk= 0, iat= -1,1990, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
igr1=1973,1974,
&end
#
# 139 LYS QG 140 PRO HD3 3.99
&rst
ixpk= 0, nxpk= 0, iat= -1,1990, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
igr1=1973,1974,
&end
#
# 139 LYS QG 143 GLY HA2 4.76
&rst
ixpk= 0, nxpk= 0, iat= -1,2030, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr1=1973,1974,
&end
#
# 139 LYS QG 143 GLY HA2 4.76
&rst
ixpk= 0, nxpk= 0, iat= -1,2030, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr1=1973,1974,
&end
#
# 139 LYS QG 143 GLY HA2 4.76
&rst
ixpk= 0, nxpk= 0, iat= -1,2030, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
igr1=1973,1974,
&end
#
# 140 PRO HA 141 LEU HN 3.63
&rst
ixpk= 0, nxpk= 0, iat=1998,2002, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13, &end
#
# 140 PRO HA 141 LEU HN 3.63
&rst
ixpk= 0, nxpk= 0, iat=1998,2002, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13, &end
#
# 140 PRO HA 141 LEU HN 3.63
&rst
ixpk= 0, nxpk= 0, iat=1998,2002, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13, &end
#
# 140 PRO HA 141 LEU HA 5.48
&rst
ixpk= 0, nxpk= 0, iat=1998,2004, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98, &end
#
# 140 PRO HA 141 LEU HA 5.48
&rst
ixpk= 0, nxpk= 0, iat=1998,2004, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98, &end
#
# 140 PRO HA 141 LEU HA 5.48
&rst
ixpk= 0, nxpk= 0, iat=1998,2004, r1= 1.30, r2= 1.80, r3= 5.48, r4= 5.98, &end
#
# 140 PRO HA 141 LEU QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat=1998, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=2011,2012,2013,
&end
#
# 140 PRO HA 141 LEU QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat=1998, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=2011,2012,2013,
&end
#
# 140 PRO HA 141 LEU QD1 6.05
&rst
ixpk= 0, nxpk= 0, iat=1998, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr2=2011,2012,2013,
&end
#
# 140 PRO HA 142 GLY HN 5.45
&rst
ixpk= 0, nxpk= 0, iat=1998,2021, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95, &end
#
# 140 PRO HA 142 GLY HN 5.45
&rst
ixpk= 0, nxpk= 0, iat=1998,2021, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95, &end
#
# 140 PRO HA 142 GLY HN 5.45
&rst
ixpk= 0, nxpk= 0, iat=1998,2021, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95, &end
#
# 140 PRO HA 143 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1998,2028, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 140 PRO HA 143 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1998,2028, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 140 PRO HA 143 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1998,2028, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 140 PRO HB2 140 PRO HA 3.86
&rst
ixpk= 0, nxpk= 0, iat=1995,1998, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, &end
#
# 140 PRO HB2 140 PRO HB3 3.39
&rst
ixpk= 0, nxpk= 0, iat=1995,1996, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89, &end
#
# 140 PRO HB2 140 PRO HD3 4.09
&rst
ixpk= 0, nxpk= 0, iat=1995,1990, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59, &end
#
# 140 PRO HB2 140 PRO HG2 3.50
&rst
ixpk= 0, nxpk= 0, iat=1995,1992, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 140 PRO HB2 141 LEU HN 4.78
&rst
ixpk= 0, nxpk= 0, iat=1995,2002, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, &end
#
# 140 PRO HB2 141 LEU HN 4.78
&rst
ixpk= 0, nxpk= 0, iat=1995,2002, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, &end
#
# 140 PRO HB2 141 LEU HN 4.78
&rst
ixpk= 0, nxpk= 0, iat=1995,2002, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, &end
#
# 140 PRO HB2 141 LEU QD1 5.88
&rst
ixpk= 0, nxpk= 0, iat=1995, -1, r1= 1.30, r2= 1.80, r3= 7.06, r4= 7.56,
igr2=2011,2012,2013,
&end
#
# 140 PRO HB2 141 LEU QD1 5.88
&rst
ixpk= 0, nxpk= 0, iat=1995, -1, r1= 1.30, r2= 1.80, r3= 7.06, r4= 7.56,
igr2=2011,2012,2013,
&end
#
# 140 PRO HB2 141 LEU QD1 5.88
&rst
ixpk= 0, nxpk= 0, iat=1995, -1, r1= 1.30, r2= 1.80, r3= 7.06, r4= 7.56,
igr2=2011,2012,2013,
&end
#
# 140 PRO HB2 141 LEU QD2 5.75
&rst
ixpk= 0, nxpk= 0, iat=1995, -1, r1= 1.30, r2= 1.80, r3= 6.91, r4= 7.41,
igr2=2015,2016,2017,
&end
#
# 140 PRO HB2 141 LEU QD2 5.75
&rst
ixpk= 0, nxpk= 0, iat=1995, -1, r1= 1.30, r2= 1.80, r3= 6.91, r4= 7.41,
igr2=2015,2016,2017,
&end
#
# 140 PRO HB2 141 LEU QD2 5.75
&rst
ixpk= 0, nxpk= 0, iat=1995, -1, r1= 1.30, r2= 1.80, r3= 6.91, r4= 7.41,
igr2=2015,2016,2017,
&end
#
# 140 PRO HB3 141 LEU HN 5.15
&rst
ixpk= 0, nxpk= 0, iat=1996,2002, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65, &end
#
# 140 PRO HD2 140 PRO HB2 4.52
&rst
ixpk= 0, nxpk= 0, iat=1989,1995, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02, &end
#
# 140 PRO HD2 140 PRO HD3 3.43
&rst
ixpk= 0, nxpk= 0, iat=1989,1990, r1= 1.30, r2= 1.80, r3= 3.43, r4= 3.93, &end
#
# 140 PRO HD2 140 PRO HG2 3.95
&rst
ixpk= 0, nxpk= 0, iat=1989,1992, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45, &end
#
# 140 PRO HD2 141 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1989,2002, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 140 PRO HD2 141 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1989,2002, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 140 PRO HD2 141 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1989,2002, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 140 PRO HD3 141 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1990,2002, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 140 PRO HD3 141 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1990,2002, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 140 PRO HD3 141 LEU HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=1990,2002, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 140 PRO HG2 141 LEU HN 5.84
&rst
ixpk= 0, nxpk= 0, iat=1992,2002, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34, &end
#
# 140 PRO HG2 141 LEU HN 5.84
&rst
ixpk= 0, nxpk= 0, iat=1992,2002, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34, &end
#
# 140 PRO HG2 141 LEU HN 5.84
&rst
ixpk= 0, nxpk= 0, iat=1992,2002, r1= 1.30, r2= 1.80, r3= 5.84, r4= 6.34, &end
#
# 140 PRO HG3 140 PRO HA 4.25
&rst
ixpk= 0, nxpk= 0, iat=1993,1998, r1= 1.30, r2= 1.80, r3= 4.25, r4= 4.75, &end
#
# 140 PRO HG3 140 PRO HD3 3.58
&rst
ixpk= 0, nxpk= 0, iat=1993,1990, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08, &end
#
# 141 LEU HN 141 LEU HA 3.88
&rst
ixpk= 0, nxpk= 0, iat=2002,2004, r1= 1.30, r2= 1.80, r3= 3.88, r4= 4.38, &end
#
# 141 LEU HN 141 LEU HB2 5.47
&rst
ixpk= 0, nxpk= 0, iat=2002,2006, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97, &end
#
# 141 LEU HN 141 LEU HB3 5.52
&rst
ixpk= 0, nxpk= 0, iat=2002,2007, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02, &end
#
# 141 LEU HN 141 LEU HG 4.93
&rst
ixpk= 0, nxpk= 0, iat=2002,2009, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43, &end
#
# 141 LEU HN 141 LEU HG 4.93
&rst
ixpk= 0, nxpk= 0, iat=2002,2009, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43, &end
#
# 141 LEU HN 141 LEU HG 4.93
&rst
ixpk= 0, nxpk= 0, iat=2002,2009, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43, &end
#
# 141 LEU HN 141 LEU QD1 4.49
&rst
ixpk= 0, nxpk= 0, iat=2002, -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr2=2011,2012,2013,
&end
#
# 141 LEU HN 141 LEU QD1 4.49
&rst
ixpk= 0, nxpk= 0, iat=2002, -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr2=2011,2012,2013,
&end
#
# 141 LEU HN 141 LEU QD1 4.49
&rst
ixpk= 0, nxpk= 0, iat=2002, -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr2=2011,2012,2013,
&end
#
# 141 LEU HN 141 LEU QD2 5.51
&rst
ixpk= 0, nxpk= 0, iat=2002, -1, r1= 1.30, r2= 1.80, r3= 6.62, r4= 7.12,
igr2=2015,2016,2017,
&end
#
# 141 LEU HN 141 LEU QD2 5.51
&rst
ixpk= 0, nxpk= 0, iat=2002, -1, r1= 1.30, r2= 1.80, r3= 6.62, r4= 7.12,
igr2=2015,2016,2017,
&end
#
# 141 LEU HN 141 LEU QD2 5.51
&rst
ixpk= 0, nxpk= 0, iat=2002, -1, r1= 1.30, r2= 1.80, r3= 6.62, r4= 7.12,
igr2=2015,2016,2017,
&end
#
# 141 LEU HN 142 GLY HN 4.24
&rst
ixpk= 0, nxpk= 0, iat=2002,2021, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74, &end
#
# 141 LEU HN 142 GLY HN 4.24
&rst
ixpk= 0, nxpk= 0, iat=2002,2021, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74, &end
#
# 141 LEU HN 142 GLY HN 4.24
&rst
ixpk= 0, nxpk= 0, iat=2002,2021, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74, &end
#
# 141 LEU HN 142 GLY HA2 5.52
&rst
ixpk= 0, nxpk= 0, iat=2002,2023, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02, &end
#
# 141 LEU HN 142 GLY HA2 5.52
&rst
ixpk= 0, nxpk= 0, iat=2002,2023, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02, &end
#
# 141 LEU HN 142 GLY HA2 5.52
&rst
ixpk= 0, nxpk= 0, iat=2002,2023, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02, &end
#
# 141 LEU HN 142 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat=2002,2024, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 141 LEU HN 142 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat=2002,2024, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 141 LEU HN 142 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat=2002,2024, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 141 LEU HN 143 GLY HN 5.94
&rst
ixpk= 0, nxpk= 0, iat=2002,2028, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44, &end
#
# 141 LEU HN 143 GLY HN 5.94
&rst
ixpk= 0, nxpk= 0, iat=2002,2028, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44, &end
#
# 141 LEU HN 143 GLY HN 5.94
&rst
ixpk= 0, nxpk= 0, iat=2002,2028, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44, &end
#
# 141 LEU HA 141 LEU HB2 5.07
&rst
ixpk= 0, nxpk= 0, iat=2004,2006, r1= 1.30, r2= 1.80, r3= 5.07, r4= 5.57, &end
#
# 141 LEU HA 141 LEU HB3 4.88
&rst
ixpk= 0, nxpk= 0, iat=2004,2007, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38, &end
#
# 141 LEU HA 141 LEU HG 4.60
&rst
ixpk= 0, nxpk= 0, iat=2004,2009, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 141 LEU HA 141 LEU HG 4.60
&rst
ixpk= 0, nxpk= 0, iat=2004,2009, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 141 LEU HA 141 LEU HG 4.60
&rst
ixpk= 0, nxpk= 0, iat=2004,2009, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10, &end
#
# 141 LEU HA 141 LEU QD1 4.05
&rst
ixpk= 0, nxpk= 0, iat=2004, -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
igr2=2011,2012,2013,
&end
#
# 141 LEU HA 141 LEU QD1 4.05
&rst
ixpk= 0, nxpk= 0, iat=2004, -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
igr2=2011,2012,2013,
&end
#
# 141 LEU HA 141 LEU QD1 4.05
&rst
ixpk= 0, nxpk= 0, iat=2004, -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
igr2=2011,2012,2013,
&end
#
# 141 LEU HA 141 LEU QD2 5.69
&rst
ixpk= 0, nxpk= 0, iat=2004, -1, r1= 1.30, r2= 1.80, r3= 6.83, r4= 7.33,
igr2=2015,2016,2017,
&end
#
# 141 LEU HA 141 LEU QD2 5.69
&rst
ixpk= 0, nxpk= 0, iat=2004, -1, r1= 1.30, r2= 1.80, r3= 6.83, r4= 7.33,
igr2=2015,2016,2017,
&end
#
# 141 LEU HA 141 LEU QD2 5.69
&rst
ixpk= 0, nxpk= 0, iat=2004, -1, r1= 1.30, r2= 1.80, r3= 6.83, r4= 7.33,
igr2=2015,2016,2017,
&end
#
# 141 LEU HA 142 GLY HN 4.49
&rst
ixpk= 0, nxpk= 0, iat=2004,2021, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99, &end
#
# 141 LEU HA 142 GLY HA2 4.51
&rst
ixpk= 0, nxpk= 0, iat=2004,2023, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01, &end
#
# 141 LEU HA 142 GLY HA2 4.51
&rst
ixpk= 0, nxpk= 0, iat=2004,2023, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01, &end
#
# 141 LEU HA 142 GLY HA2 4.51
&rst
ixpk= 0, nxpk= 0, iat=2004,2023, r1= 1.30, r2= 1.80, r3= 4.51, r4= 5.01, &end
#
# 141 LEU HA 143 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=2004,2028, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 141 LEU HA 143 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=2004,2028, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 141 LEU HA 143 GLY HN 6.05 (#)
&rst
ixpk= 0, nxpk= 0, iat=2004,2028, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 141 LEU HA 144 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=2004,2035, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 141 LEU HA 144 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=2004,2035, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 141 LEU HA 144 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=2004,2035, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 141 LEU HA 145 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=2004,2042, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 141 LEU HA 145 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=2004,2042, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 141 LEU HA 145 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=2004,2042, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 141 LEU HB2 141 LEU HB3 4.19
&rst
ixpk= 0, nxpk= 0, iat=2006,2007, r1= 1.30, r2= 1.80, r3= 4.19, r4= 4.69, &end
#
# 141 LEU HB2 141 LEU HG 5.69
&rst
ixpk= 0, nxpk= 0, iat=2006,2009, r1= 1.30, r2= 1.80, r3= 5.69, r4= 6.19, &end
#
# 141 LEU HB2 141 LEU QD1 5.04
&rst
ixpk= 0, nxpk= 0, iat=2006, -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
igr2=2011,2012,2013,
&end
#
# 141 LEU HB3 142 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=2007,2021, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 141 LEU HB3 142 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=2007,2021, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 141 LEU HB3 142 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=2007,2021, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 141 LEU HB3 143 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=2007,2028, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 141 LEU HB3 143 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=2007,2028, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 141 LEU HB3 143 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=2007,2028, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 141 LEU HG 141 LEU QD2 3.61
&rst
ixpk= 0, nxpk= 0, iat=2009, -1, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,
igr2=2015,2016,2017,
&end
#
# 141 LEU HG 142 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=2009,2021, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 141 LEU HG 142 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=2009,2021, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 141 LEU HG 142 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=2009,2021, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 141 LEU QD1 141 LEU HG 3.90
&rst
ixpk= 0, nxpk= 0, iat= -1,2009, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
igr1=2011,2012,2013,
&end
#
# 141 LEU QD1 141 LEU QD2 3.73
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.38, r4= 5.88,
igr1=2011,2012,2013,
igr2=2015,2016,2017,
&end
#
# 141 LEU QD1 142 GLY HN 5.91
&rst
ixpk= 0, nxpk= 0, iat= -1,2021, r1= 1.30, r2= 1.80, r3= 7.10, r4= 7.60,
igr1=2011,2012,2013,
&end
#
# 141 LEU QD1 142 GLY HN 5.91
&rst
ixpk= 0, nxpk= 0, iat= -1,2021, r1= 1.30, r2= 1.80, r3= 7.10, r4= 7.60,
igr1=2011,2012,2013,
&end
#
# 141 LEU QD1 142 GLY HN 5.91
&rst
ixpk= 0, nxpk= 0, iat= -1,2021, r1= 1.30, r2= 1.80, r3= 7.10, r4= 7.60,
igr1=2011,2012,2013,
&end
#
# 141 LEU QD1 143 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,2028, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=2011,2012,2013,
&end
#
# 141 LEU QD1 143 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,2028, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=2011,2012,2013,
&end
#
# 141 LEU QD1 143 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,2028, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=2011,2012,2013,
&end
#
# 141 LEU QD2 143 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,2028, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=2015,2016,2017,
&end
#
# 141 LEU QD2 143 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,2028, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=2015,2016,2017,
&end
#
# 141 LEU QD2 143 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,2028, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=2015,2016,2017,
&end
#
# 141 LEU QD2 145 GLY HA3 5.49
&rst
ixpk= 0, nxpk= 0, iat= -1,2045, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
igr1=2015,2016,2017,
&end
#
# 141 LEU QD2 145 GLY HA3 5.49
&rst
ixpk= 0, nxpk= 0, iat= -1,2045, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
igr1=2015,2016,2017,
&end
#
# 141 LEU QD2 145 GLY HA3 5.49
&rst
ixpk= 0, nxpk= 0, iat= -1,2045, r1= 1.30, r2= 1.80, r3= 6.59, r4= 7.09,
igr1=2015,2016,2017,
&end
#
# 142 GLY HN 142 GLY HA2 4.12
&rst
ixpk= 0, nxpk= 0, iat=2021,2023, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62, &end
#
# 142 GLY HN 142 GLY HA3 4.50
&rst
ixpk= 0, nxpk= 0, iat=2021,2024, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 142 GLY HN 143 GLY HN 4.21
&rst
ixpk= 0, nxpk= 0, iat=2021,2028, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71, &end
#
# 142 GLY HN 143 GLY HN 4.21
&rst
ixpk= 0, nxpk= 0, iat=2021,2028, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71, &end
#
# 142 GLY HN 143 GLY HN 4.21
&rst
ixpk= 0, nxpk= 0, iat=2021,2028, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71, &end
#
# 142 GLY HN 143 GLY HA2 5.98
&rst
ixpk= 0, nxpk= 0, iat=2021,2030, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48, &end
#
# 142 GLY HN 143 GLY HA2 5.98
&rst
ixpk= 0, nxpk= 0, iat=2021,2030, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48, &end
#
# 142 GLY HN 143 GLY HA2 5.98
&rst
ixpk= 0, nxpk= 0, iat=2021,2030, r1= 1.30, r2= 1.80, r3= 5.98, r4= 6.48, &end
#
# 142 GLY HN 143 GLY HA3 6.04
&rst
ixpk= 0, nxpk= 0, iat=2021,2031, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54, &end
#
# 142 GLY HN 143 GLY HA3 6.04
&rst
ixpk= 0, nxpk= 0, iat=2021,2031, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54, &end
#
# 142 GLY HN 143 GLY HA3 6.04 (#)
&rst
ixpk= 0, nxpk= 0, iat=2021,2031, r1= 1.30, r2= 1.80, r3= 6.04, r4= 6.54, &end
#
# 142 GLY HN 144 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=2021,2035, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 142 GLY HN 144 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=2021,2035, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 142 GLY HN 144 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=2021,2035, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 142 GLY HN 145 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=2021,2042, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 142 GLY HN 145 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=2021,2042, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 142 GLY HN 145 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=2021,2042, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 142 GLY HA2 142 GLY HA3 4.97
&rst
ixpk= 0, nxpk= 0, iat=2023,2024, r1= 1.30, r2= 1.80, r3= 4.97, r4= 5.47, &end
#
# 142 GLY HA2 143 GLY HN 3.59
&rst
ixpk= 0, nxpk= 0, iat=2023,2028, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09, &end
#
# 142 GLY HA2 143 GLY HN 3.59
&rst
ixpk= 0, nxpk= 0, iat=2023,2028, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09, &end
#
# 142 GLY HA2 143 GLY HN 3.59
&rst
ixpk= 0, nxpk= 0, iat=2023,2028, r1= 1.30, r2= 1.80, r3= 3.59, r4= 4.09, &end
#
# 142 GLY HA2 143 GLY HA3 4.53
&rst
ixpk= 0, nxpk= 0, iat=2023,2031, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03, &end
#
# 142 GLY HA2 143 GLY HA3 4.53
&rst
ixpk= 0, nxpk= 0, iat=2023,2031, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03, &end
#
# 142 GLY HA2 143 GLY HA3 4.53
&rst
ixpk= 0, nxpk= 0, iat=2023,2031, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03, &end
#
# 142 GLY HA2 144 GLY HN 3.58
&rst
ixpk= 0, nxpk= 0, iat=2023,2035, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08, &end
#
# 142 GLY HA2 144 GLY HN 3.58
&rst
ixpk= 0, nxpk= 0, iat=2023,2035, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08, &end
#
# 142 GLY HA2 144 GLY HN 3.58
&rst
ixpk= 0, nxpk= 0, iat=2023,2035, r1= 1.30, r2= 1.80, r3= 3.58, r4= 4.08, &end
#
# 142 GLY HA2 144 GLY HA2 6.05
&rst
ixpk= 0, nxpk= 0, iat=2023,2037, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 142 GLY HA2 144 GLY HA2 6.05
&rst
ixpk= 0, nxpk= 0, iat=2023,2037, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 142 GLY HA2 144 GLY HA2 6.05
&rst
ixpk= 0, nxpk= 0, iat=2023,2037, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 142 GLY HA3 143 GLY HN 5.20 (#)
&rst
ixpk= 0, nxpk= 0, iat=2024,2028, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70, &end
#
# 143 GLY HN 143 GLY HA2 3.64
&rst
ixpk= 0, nxpk= 0, iat=2028,2030, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14, &end
#
# 143 GLY HN 143 GLY HA3 3.80
&rst
ixpk= 0, nxpk= 0, iat=2028,2031, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30, &end
#
# 143 GLY HN 144 GLY HN 4.00
&rst
ixpk= 0, nxpk= 0, iat=2028,2035, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 143 GLY HN 144 GLY HN 4.00
&rst
ixpk= 0, nxpk= 0, iat=2028,2035, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 143 GLY HN 144 GLY HN 4.00
&rst
ixpk= 0, nxpk= 0, iat=2028,2035, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 143 GLY HN 145 GLY HN 5.57
&rst
ixpk= 0, nxpk= 0, iat=2028,2042, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07, &end
#
# 143 GLY HN 145 GLY HN 5.57
&rst
ixpk= 0, nxpk= 0, iat=2028,2042, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07, &end
#
# 143 GLY HN 145 GLY HN 5.57
&rst
ixpk= 0, nxpk= 0, iat=2028,2042, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07, &end
#
# 143 GLY HA2 143 GLY HA3 3.77
&rst
ixpk= 0, nxpk= 0, iat=2030,2031, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27, &end
#
# 143 GLY HA2 144 GLY HN 6.05
&rst
ixpk= 0, nxpk= 0, iat=2030,2035, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 143 GLY HA3 144 GLY HN 4.82
&rst
ixpk= 0, nxpk= 0, iat=2031,2035, r1= 1.30, r2= 1.80, r3= 4.82, r4= 5.32, &end
#
# 144 GLY HN 144 GLY HA2 3.85
&rst
ixpk= 0, nxpk= 0, iat=2035,2037, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35, &end
#
# 144 GLY HN 144 GLY HA3 3.82
&rst
ixpk= 0, nxpk= 0, iat=2035,2038, r1= 1.30, r2= 1.80, r3= 3.82, r4= 4.32, &end
#
# 144 GLY HN 145 GLY HN 4.37
&rst
ixpk= 0, nxpk= 0, iat=2035,2042, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87, &end
#
# 144 GLY HN 145 GLY HN 4.37
&rst
ixpk= 0, nxpk= 0, iat=2035,2042, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87, &end
#
# 144 GLY HN 145 GLY HN 4.37
&rst
ixpk= 0, nxpk= 0, iat=2035,2042, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87, &end
#
# 144 GLY HN 145 GLY HA3 5.72
&rst
ixpk= 0, nxpk= 0, iat=2035,2045, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 144 GLY HN 145 GLY HA3 5.72
&rst
ixpk= 0, nxpk= 0, iat=2035,2045, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 144 GLY HN 145 GLY HA3 5.72
&rst
ixpk= 0, nxpk= 0, iat=2035,2045, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 144 GLY HA2 144 GLY HA3 4.03
&rst
ixpk= 0, nxpk= 0, iat=2037,2038, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53, &end
#
# 144 GLY HA3 145 GLY HN 5.05
&rst
ixpk= 0, nxpk= 0, iat=2038,2042, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55, &end
#
# 145 GLY HN 145 GLY HA2 3.98
&rst
ixpk= 0, nxpk= 0, iat=2042,2044, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48, &end
#
# 145 GLY HN 145 GLY HA3 3.95
&rst
ixpk= 0, nxpk= 0, iat=2042,2045, r1= 1.30, r2= 1.80, r3= 3.95, r4= 4.45, &end
#
# 145 GLY HN 146 THR HN 5.30
&rst
ixpk= 0, nxpk= 0, iat=2042,2049, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80, &end
#
# 145 GLY HN 146 THR HN 5.30
&rst
ixpk= 0, nxpk= 0, iat=2042,2049, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80, &end
#
# 145 GLY HN 146 THR HN 5.30
&rst
ixpk= 0, nxpk= 0, iat=2042,2049, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80, &end
#
# 145 GLY HA2 145 GLY HA3 3.63
&rst
ixpk= 0, nxpk= 0, iat=2044,2045, r1= 1.30, r2= 1.80, r3= 3.63, r4= 4.13, &end
#
# 145 GLY HA2 146 THR HN 3.65
&rst
ixpk= 0, nxpk= 0, iat=2044,2049, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15, &end
#
# 145 GLY HA2 146 THR HN 3.65
&rst
ixpk= 0, nxpk= 0, iat=2044,2049, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15, &end
#
# 145 GLY HA2 146 THR HN 3.65
&rst
ixpk= 0, nxpk= 0, iat=2044,2049, r1= 1.30, r2= 1.80, r3= 3.65, r4= 4.15, &end
#
# 145 GLY HA3 146 THR HN 3.78
&rst
ixpk= 0, nxpk= 0, iat=2045,2049, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28, &end
#
# 145 GLY HA3 146 THR HN 3.78
&rst
ixpk= 0, nxpk= 0, iat=2045,2049, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28, &end
#
# 145 GLY HA3 146 THR HN 3.78
&rst
ixpk= 0, nxpk= 0, iat=2045,2049, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28, &end
#
# 146 THR HN 146 THR HA 4.57
&rst
ixpk= 0, nxpk= 0, iat=2049,2051, r1= 1.30, r2= 1.80, r3= 4.57, r4= 5.07, &end
#
# 146 THR HN 146 THR QG2 5.16
&rst
ixpk= 0, nxpk= 0, iat=2049, -1, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
igr2=2055,2056,2057,
&end
#
# 146 THR HN 146 THR QG2 5.16
&rst
ixpk= 0, nxpk= 0, iat=2049, -1, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
igr2=2055,2056,2057,
&end
#
# 146 THR HN 146 THR QG2 5.16
&rst
ixpk= 0, nxpk= 0, iat=2049, -1, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70,
igr2=2055,2056,2057,
&end
#
# 146 THR HA 146 THR HB 3.94
&rst
ixpk= 0, nxpk= 0, iat=2051,2053, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44, &end
#
# 146 THR HA 146 THR QG2 3.99
&rst
ixpk= 0, nxpk= 0, iat=2051, -1, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
igr2=2055,2056,2057,
&end
#
# 146 THR HA 146 THR QG2 3.99
&rst
ixpk= 0, nxpk= 0, iat=2051, -1, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
igr2=2055,2056,2057,
&end
#
# 146 THR HA 146 THR QG2 3.99
&rst
ixpk= 0, nxpk= 0, iat=2051, -1, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
igr2=2055,2056,2057,
&end
#
# 146 THR HA 147 ARG HN 3.33
&rst
ixpk= 0, nxpk= 0, iat=2051,2063, r1= 1.30, r2= 1.80, r3= 3.33, r4= 3.83, &end
#
# 146 THR HA 147 ARG HN 3.33
&rst
ixpk= 0, nxpk= 0, iat=2051,2063, r1= 1.30, r2= 1.80, r3= 3.33, r4= 3.83, &end
#
# 146 THR HA 147 ARG HN 3.33
&rst
ixpk= 0, nxpk= 0, iat=2051,2063, r1= 1.30, r2= 1.80, r3= 3.33, r4= 3.83, &end
#
# 146 THR HB 146 THR QG2 3.72
&rst
ixpk= 0, nxpk= 0, iat=2053, -1, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97,
igr2=2055,2056,2057,
&end
#
# 146 THR HB 147 ARG HN 3.49
&rst
ixpk= 0, nxpk= 0, iat=2053,2063, r1= 1.30, r2= 1.80, r3= 3.49, r4= 3.99, &end
#
# 146 THR HB 147 ARG HN 3.49
&rst
ixpk= 0, nxpk= 0, iat=2053,2063, r1= 1.30, r2= 1.80, r3= 3.49, r4= 3.99, &end
#
# 146 THR HB 147 ARG HN 3.49
&rst
ixpk= 0, nxpk= 0, iat=2053,2063, r1= 1.30, r2= 1.80, r3= 3.49, r4= 3.99, &end
#
# 146 THR QG2 147 ARG HN 3.96
&rst
ixpk= 0, nxpk= 0, iat= -1,2063, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
igr1=2055,2056,2057,
&end
#
# 146 THR QG2 147 ARG HN 3.96
&rst
ixpk= 0, nxpk= 0, iat= -1,2063, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
igr1=2055,2056,2057,
&end
#
# 146 THR QG2 147 ARG HN 3.96
&rst
ixpk= 0, nxpk= 0, iat= -1,2063, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
igr1=2055,2056,2057,
&end
#
# 146 THR QG2 147 ARG QD 5.20
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.01, r4= 7.51,
igr1=2055,2056,2057,
igr2=2073,2074,
&end
#
# 146 THR QG2 147 ARG QD 5.20
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.01, r4= 7.51,
igr1=2055,2056,2057,
igr2=2073,2074,
&end
#
# 146 THR QG2 147 ARG QD 5.20
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.01, r4= 7.51,
igr1=2055,2056,2057,
igr2=2073,2074,
&end
#
# 147 ARG HN 147 ARG HA 4.93
&rst
ixpk= 0, nxpk= 0, iat=2063,2065, r1= 1.30, r2= 1.80, r3= 4.93, r4= 5.43, &end
#
# 147 ARG HN 147 ARG HB2 4.03
&rst
ixpk= 0, nxpk= 0, iat=2063,2067, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53, &end
#
# 147 ARG HN 147 ARG HB2 4.03
&rst
ixpk= 0, nxpk= 0, iat=2063,2067, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53, &end
#
# 147 ARG HN 147 ARG HB2 4.03
&rst
ixpk= 0, nxpk= 0, iat=2063,2067, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53, &end
#
# 147 ARG HN 147 ARG HB3 5.15
&rst
ixpk= 0, nxpk= 0, iat=2063,2068, r1= 1.30, r2= 1.80, r3= 5.15, r4= 5.65, &end
#
# 147 ARG HN 147 ARG HE 6.05
&rst
ixpk= 0, nxpk= 0, iat=2063,2076, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 147 ARG HN 147 ARG HE 6.05
&rst
ixpk= 0, nxpk= 0, iat=2063,2076, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 147 ARG HN 147 ARG HE 6.05
&rst
ixpk= 0, nxpk= 0, iat=2063,2076, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 147 ARG HN 147 ARG QD 6.05
&rst
ixpk= 0, nxpk= 0, iat=2063, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2=2073,2074,
&end
#
# 147 ARG HN 147 ARG QD 6.05
&rst
ixpk= 0, nxpk= 0, iat=2063, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2=2073,2074,
&end
#
# 147 ARG HN 147 ARG QD 6.05
&rst
ixpk= 0, nxpk= 0, iat=2063, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2=2073,2074,
&end
#
# 147 ARG HN 147 ARG QG 5.06
&rst
ixpk= 0, nxpk= 0, iat=2063, -1, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
igr2=2070,2071,
&end
#
# 147 ARG HN 147 ARG QG 5.06
&rst
ixpk= 0, nxpk= 0, iat=2063, -1, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
igr2=2070,2071,
&end
#
# 147 ARG HN 147 ARG QG 5.06
&rst
ixpk= 0, nxpk= 0, iat=2063, -1, r1= 1.30, r2= 1.80, r3= 5.68, r4= 6.18,
igr2=2070,2071,
&end
#
# 147 ARG HN 148 TYR QD 6.00
&rst
ixpk= 0, nxpk= 0, iat=2063, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=2095,2104,
&end
#
# 147 ARG HN 148 TYR QD 6.00
&rst
ixpk= 0, nxpk= 0, iat=2063, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=2095,2104,
&end
#
# 147 ARG HN 148 TYR QD 6.00
&rst
ixpk= 0, nxpk= 0, iat=2063, -1, r1= 1.30, r2= 1.80, r3= 6.73, r4= 7.23,
igr2=2095,2104,
&end
#
# 147 ARG HA 147 ARG HB2 5.58
&rst
ixpk= 0, nxpk= 0, iat=2065,2067, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08, &end
#
# 147 ARG HA 147 ARG HB3 5.58
&rst
ixpk= 0, nxpk= 0, iat=2065,2068, r1= 1.30, r2= 1.80, r3= 5.58, r4= 6.08, &end
#
# 147 ARG HA 147 ARG QG 4.55
&rst
ixpk= 0, nxpk= 0, iat=2065, -1, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,
igr2=2070,2071,
&end
#
# 147 ARG HA 147 ARG QG 4.55
&rst
ixpk= 0, nxpk= 0, iat=2065, -1, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,
igr2=2070,2071,
&end
#
# 147 ARG HA 147 ARG QG 4.55
&rst
ixpk= 0, nxpk= 0, iat=2065, -1, r1= 1.30, r2= 1.80, r3= 5.11, r4= 5.61,
igr2=2070,2071,
&end
#
# 147 ARG HA 148 TYR HN 3.73
&rst
ixpk= 0, nxpk= 0, iat=2065,2087, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23, &end
#
# 147 ARG HA 148 TYR HN 3.73
&rst
ixpk= 0, nxpk= 0, iat=2065,2087, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23, &end
#
# 147 ARG HA 148 TYR HN 3.73
&rst
ixpk= 0, nxpk= 0, iat=2065,2087, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23, &end
#
# 147 ARG HA 148 TYR HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=2065,2089, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 147 ARG HA 148 TYR HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=2065,2089, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 147 ARG HA 148 TYR HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=2065,2089, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 147 ARG HA 148 TYR HB2 5.94
&rst
ixpk= 0, nxpk= 0, iat=2065,2091, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44, &end
#
# 147 ARG HA 148 TYR HB2 5.94
&rst
ixpk= 0, nxpk= 0, iat=2065,2091, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44, &end
#
# 147 ARG HA 148 TYR HB2 5.94
&rst
ixpk= 0, nxpk= 0, iat=2065,2091, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44, &end
#
# 147 ARG HA 148 TYR HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat=2065,2092, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 147 ARG HA 148 TYR HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat=2065,2092, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 147 ARG HA 148 TYR HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat=2065,2092, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 147 ARG HA 148 TYR QD 6.05
&rst
ixpk= 0, nxpk= 0, iat=2065, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2=2095,2104,
&end
#
# 147 ARG HA 148 TYR QD 6.05
&rst
ixpk= 0, nxpk= 0, iat=2065, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2=2095,2104,
&end
#
# 147 ARG HA 148 TYR QD 6.05
&rst
ixpk= 0, nxpk= 0, iat=2065, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr2=2095,2104,
&end
#
# 147 ARG HA 149 ALA HN 4.53
&rst
ixpk= 0, nxpk= 0, iat=2065,2108, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03, &end
#
# 147 ARG HA 149 ALA HN 4.53
&rst
ixpk= 0, nxpk= 0, iat=2065,2108, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03, &end
#
# 147 ARG HA 149 ALA HN 4.53
&rst
ixpk= 0, nxpk= 0, iat=2065,2108, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03, &end
#
# 147 ARG HB2 147 ARG HB3 2.82
&rst
ixpk= 0, nxpk= 0, iat=2067,2068, r1= 1.30, r2= 1.80, r3= 2.82, r4= 3.32, &end
#
# 147 ARG HB2 147 ARG QD 5.16
&rst
ixpk= 0, nxpk= 0, iat=2067, -1, r1= 1.30, r2= 1.80, r3= 5.79, r4= 6.29,
igr2=2073,2074,
&end
#
# 147 ARG HB3 147 ARG HE 6.05
&rst
ixpk= 0, nxpk= 0, iat=2068,2076, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 147 ARG HB3 147 ARG HE 6.05
&rst
ixpk= 0, nxpk= 0, iat=2068,2076, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 147 ARG HB3 147 ARG HE 6.05
&rst
ixpk= 0, nxpk= 0, iat=2068,2076, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 147 ARG HB3 147 ARG QD 5.21
&rst
ixpk= 0, nxpk= 0, iat=2068, -1, r1= 1.30, r2= 1.80, r3= 5.85, r4= 6.35,
igr2=2073,2074,
&end
#
# 147 ARG HB3 148 TYR HN 5.72
&rst
ixpk= 0, nxpk= 0, iat=2068,2087, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 147 ARG HB3 148 TYR HN 5.72
&rst
ixpk= 0, nxpk= 0, iat=2068,2087, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 147 ARG HB3 148 TYR HN 5.72
&rst
ixpk= 0, nxpk= 0, iat=2068,2087, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 147 ARG QG 147 ARG QD 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.62, r4= 8.12,
igr1=2070,2071,
igr2=2073,2074,
&end
#
# 148 TYR HN 148 TYR HA 4.99
&rst
ixpk= 0, nxpk= 0, iat=2087,2089, r1= 1.30, r2= 1.80, r3= 4.99, r4= 5.49, &end
#
# 148 TYR HN 148 TYR HB2 4.27
&rst
ixpk= 0, nxpk= 0, iat=2087,2091, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77, &end
#
# 148 TYR HN 148 TYR HB2 4.27
&rst
ixpk= 0, nxpk= 0, iat=2087,2091, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77, &end
#
# 148 TYR HN 148 TYR HB2 4.27
&rst
ixpk= 0, nxpk= 0, iat=2087,2091, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77, &end
#
# 148 TYR HN 148 TYR HB3 4.04
&rst
ixpk= 0, nxpk= 0, iat=2087,2092, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, &end
#
# 148 TYR HN 148 TYR HB3 4.04
&rst
ixpk= 0, nxpk= 0, iat=2087,2092, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, &end
#
# 148 TYR HN 148 TYR HB3 4.04
&rst
ixpk= 0, nxpk= 0, iat=2087,2092, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54, &end
#
# 148 TYR HN 148 TYR QD 5.00
&rst
ixpk= 0, nxpk= 0, iat=2087, -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr2=2095,2104,
&end
#
# 148 TYR HN 148 TYR QD 5.00
&rst
ixpk= 0, nxpk= 0, iat=2087, -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr2=2095,2104,
&end
#
# 148 TYR HN 148 TYR QD 5.00
&rst
ixpk= 0, nxpk= 0, iat=2087, -1, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr2=2095,2104,
&end
#
# 148 TYR HN 149 ALA HN 3.52
&rst
ixpk= 0, nxpk= 0, iat=2087,2108, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02, &end
#
# 148 TYR HN 149 ALA HN 3.52
&rst
ixpk= 0, nxpk= 0, iat=2087,2108, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02, &end
#
# 148 TYR HN 149 ALA HN 3.52
&rst
ixpk= 0, nxpk= 0, iat=2087,2108, r1= 1.30, r2= 1.80, r3= 3.52, r4= 4.02, &end
#
# 148 TYR HN 149 ALA HN 5.28
&rst
ixpk= 0, nxpk= 0, iat=2087,2108, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 148 TYR HN 149 ALA HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=2087,2110, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 148 TYR HN 149 ALA HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=2087,2110, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 148 TYR HN 149 ALA HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=2087,2110, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 148 TYR HA 148 TYR HB2 4.29
&rst
ixpk= 0, nxpk= 0, iat=2089,2091, r1= 1.30, r2= 1.80, r3= 4.29, r4= 4.79, &end
#
# 148 TYR HA 148 TYR HB3 4.54
&rst
ixpk= 0, nxpk= 0, iat=2089,2092, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04, &end
#
# 148 TYR HA 148 TYR QD 4.30
&rst
ixpk= 0, nxpk= 0, iat=2089, -1, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
igr2=2095,2104,
&end
#
# 148 TYR HA 148 TYR QD 4.30
&rst
ixpk= 0, nxpk= 0, iat=2089, -1, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
igr2=2095,2104,
&end
#
# 148 TYR HA 148 TYR QD 4.30
&rst
ixpk= 0, nxpk= 0, iat=2089, -1, r1= 1.30, r2= 1.80, r3= 4.83, r4= 5.33,
igr2=2095,2104,
&end
#
# 148 TYR HA 149 ALA HN 2.97
&rst
ixpk= 0, nxpk= 0, iat=2089,2108, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 148 TYR HA 149 ALA HN 4.52
&rst
ixpk= 0, nxpk= 0, iat=2089,2108, r1= 1.30, r2= 1.80, r3= 4.52, r4= 5.02, &end
#
# 148 TYR HB2 148 TYR HB3 4.07
&rst
ixpk= 0, nxpk= 0, iat=2091,2092, r1= 1.30, r2= 1.80, r3= 4.07, r4= 4.57, &end
#
# 148 TYR HB2 149 ALA HN 4.47
&rst
ixpk= 0, nxpk= 0, iat=2091,2108, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97, &end
#
# 148 TYR HB2 149 ALA HN 4.47
&rst
ixpk= 0, nxpk= 0, iat=2091,2108, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97, &end
#
# 148 TYR HB2 149 ALA HN 4.47
&rst
ixpk= 0, nxpk= 0, iat=2091,2108, r1= 1.30, r2= 1.80, r3= 4.47, r4= 4.97, &end
#
# 148 TYR HB2 149 ALA HN 5.72
&rst
ixpk= 0, nxpk= 0, iat=2091,2108, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 148 TYR HB3 149 ALA HN 4.21
&rst
ixpk= 0, nxpk= 0, iat=2092,2108, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71, &end
#
# 148 TYR HB3 149 ALA HN 4.21
&rst
ixpk= 0, nxpk= 0, iat=2092,2108, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71, &end
#
# 148 TYR HB3 149 ALA HN 4.21
&rst
ixpk= 0, nxpk= 0, iat=2092,2108, r1= 1.30, r2= 1.80, r3= 4.21, r4= 4.71, &end
#
# 148 TYR HB3 149 ALA QB 5.10
&rst
ixpk= 0, nxpk= 0, iat=2092, -1, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,
igr2=2112,2113,2114,
&end
#
# 148 TYR HB3 149 ALA QB 5.10
&rst
ixpk= 0, nxpk= 0, iat=2092, -1, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,
igr2=2112,2113,2114,
&end
#
# 148 TYR HB3 149 ALA QB 5.10
&rst
ixpk= 0, nxpk= 0, iat=2092, -1, r1= 1.30, r2= 1.80, r3= 6.12, r4= 6.62,
igr2=2112,2113,2114,
&end
#
# 148 TYR QD 148 TYR HB2 4.40
&rst
ixpk= 0, nxpk= 0, iat= -1,2091, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
igr1=2095,2104,
&end
#
# 148 TYR QD 148 TYR HB3 4.50
&rst
ixpk= 0, nxpk= 0, iat= -1,2092, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
igr1=2095,2104,
&end
#
# 148 TYR QD 149 ALA HN 4.75
&rst
ixpk= 0, nxpk= 0, iat= -1,2108, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
igr1=2095,2104,
&end
#
# 148 TYR QD 149 ALA HN 4.75
&rst
ixpk= 0, nxpk= 0, iat= -1,2108, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
igr1=2095,2104,
&end
#
# 148 TYR QD 149 ALA HN 4.75
&rst
ixpk= 0, nxpk= 0, iat= -1,2108, r1= 1.30, r2= 1.80, r3= 5.33, r4= 5.83,
igr1=2095,2104,
&end
#
# 148 TYR QD 149 ALA HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,2110, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1=2095,2104,
&end
#
# 148 TYR QD 149 ALA HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,2110, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1=2095,2104,
&end
#
# 148 TYR QD 149 ALA HA 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,2110, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1=2095,2104,
&end
#
# 148 TYR QD 149 ALA QB 4.55
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.13, r4= 6.63,
igr1=2095,2104,
igr2=2112,2113,2114,
&end
#
# 148 TYR QD 149 ALA QB 4.55
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.13, r4= 6.63,
igr1=2095,2104,
igr2=2112,2113,2114,
&end
#
# 148 TYR QD 149 ALA QB 4.55
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.13, r4= 6.63,
igr1=2095,2104,
igr2=2112,2113,2114,
&end
#
# 149 ALA HN 149 ALA HA 4.16
&rst
ixpk= 0, nxpk= 0, iat=2108,2110, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66, &end
#
# 149 ALA HN 149 ALA QB 4.12
&rst
ixpk= 0, nxpk= 0, iat=2108, -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr2=2112,2113,2114,
&end
#
# 149 ALA HN 149 ALA QB 4.12
&rst
ixpk= 0, nxpk= 0, iat=2108, -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr2=2112,2113,2114,
&end
#
# 149 ALA HN 149 ALA QB 4.12
&rst
ixpk= 0, nxpk= 0, iat=2108, -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr2=2112,2113,2114,
&end
#
# 149 ALA HN 150 CYX HN 4.91
&rst
ixpk= 0, nxpk= 0, iat=2108,2118, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41, &end
#
# 149 ALA HN 150 CYX HN 4.91
&rst
ixpk= 0, nxpk= 0, iat=2108,2118, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41, &end
#
# 149 ALA HN 150 CYX HN 4.91
&rst
ixpk= 0, nxpk= 0, iat=2108,2118, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41, &end
#
# 149 ALA HN 150 CYX HN 5.28
&rst
ixpk= 0, nxpk= 0, iat=2108,2118, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 149 ALA HN 150 CYX HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat=2108,2123, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 149 ALA HN 150 CYX HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat=2108,2123, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 149 ALA HN 150 CYX HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat=2108,2123, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 149 ALA HA 150 CYX HN 2.97
&rst
ixpk= 0, nxpk= 0, iat=2110,2118, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 149 ALA HA 150 CYX HN 3.39
&rst
ixpk= 0, nxpk= 0, iat=2110,2118, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89, &end
#
# 149 ALA HA 150 CYX HN 3.39
&rst
ixpk= 0, nxpk= 0, iat=2110,2118, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89, &end
#
# 149 ALA HA 150 CYX HN 3.39
&rst
ixpk= 0, nxpk= 0, iat=2110,2118, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89, &end
#
# 149 ALA HA 150 CYX HB2 5.54
&rst
ixpk= 0, nxpk= 0, iat=2110,2123, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04, &end
#
# 149 ALA HA 150 CYX HB2 5.54
&rst
ixpk= 0, nxpk= 0, iat=2110,2123, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04, &end
#
# 149 ALA HA 150 CYX HB2 5.54
&rst
ixpk= 0, nxpk= 0, iat=2110,2123, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04, &end
#
# 149 ALA HA 150 CYX HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat=2110,2122, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 149 ALA HA 150 CYX HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat=2110,2122, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 149 ALA HA 150 CYX HB3 6.05
&rst
ixpk= 0, nxpk= 0, iat=2110,2122, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 149 ALA QB 150 CYX HN 5.72
&rst
ixpk= 0, nxpk= 0, iat= -1,2118, r1= 1.30, r2= 1.80, r3= 6.87, r4= 7.37,
igr1=2112,2113,2114,
&end
#
# 149 ALA QB 149 ALA HA 3.75
&rst
ixpk= 0, nxpk= 0, iat= -1,2110, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,
igr1=2112,2113,2114,
&end
#
# 149 ALA QB 150 CYX HN 4.10
&rst
ixpk= 0, nxpk= 0, iat= -1,2118, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
igr1=2112,2113,2114,
&end
#
# 149 ALA QB 150 CYX HN 4.10
&rst
ixpk= 0, nxpk= 0, iat= -1,2118, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
igr1=2112,2113,2114,
&end
#
# 149 ALA QB 150 CYX HN 4.10
&rst
ixpk= 0, nxpk= 0, iat= -1,2118, r1= 1.30, r2= 1.80, r3= 4.92, r4= 5.42,
igr1=2112,2113,2114,
&end
#
# 149 ALA QB 150 CYX HA 5.90
&rst
ixpk= 0, nxpk= 0, iat= -1,2120, r1= 1.30, r2= 1.80, r3= 7.09, r4= 7.59,
igr1=2112,2113,2114,
&end
#
# 149 ALA QB 150 CYX HA 5.90
&rst
ixpk= 0, nxpk= 0, iat= -1,2120, r1= 1.30, r2= 1.80, r3= 7.09, r4= 7.59,
igr1=2112,2113,2114,
&end
#
# 149 ALA QB 150 CYX HA 5.90
&rst
ixpk= 0, nxpk= 0, iat= -1,2120, r1= 1.30, r2= 1.80, r3= 7.09, r4= 7.59,
igr1=2112,2113,2114,
&end
#
# 149 ALA QB 151 GLY HN 5.83
&rst
ixpk= 0, nxpk= 0, iat= -1,2128, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,
igr1=2112,2113,2114,
&end
#
# 149 ALA QB 151 GLY HN 5.83
&rst
ixpk= 0, nxpk= 0, iat= -1,2128, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,
igr1=2112,2113,2114,
&end
#
# 149 ALA QB 151 GLY HN 5.83
&rst
ixpk= 0, nxpk= 0, iat= -1,2128, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,
igr1=2112,2113,2114,
&end
#
# 150 CYX HN 150 CYX HA 4.24
&rst
ixpk= 0, nxpk= 0, iat=2118,2120, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74, &end
#
# 150 CYX HN 150 CYX HB2 4.37
&rst
ixpk= 0, nxpk= 0, iat=2118,2123, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87, &end
#
# 150 CYX HN 150 CYX HB2 4.37
&rst
ixpk= 0, nxpk= 0, iat=2118,2123, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87, &end
#
# 150 CYX HN 150 CYX HB2 4.37
&rst
ixpk= 0, nxpk= 0, iat=2118,2123, r1= 1.30, r2= 1.80, r3= 4.37, r4= 4.87, &end
#
# 150 CYX HN 150 CYX HB3 4.43
&rst
ixpk= 0, nxpk= 0, iat=2118,2122, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93, &end
#
# 150 CYX HN 150 CYX HB3 4.43
&rst
ixpk= 0, nxpk= 0, iat=2118,2122, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93, &end
#
# 150 CYX HN 150 CYX HB3 4.43
&rst
ixpk= 0, nxpk= 0, iat=2118,2122, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93, &end
#
# 150 CYX HN 151 GLY HN 5.28
&rst
ixpk= 0, nxpk= 0, iat=2118,2128, r1= 1.30, r2= 1.80, r3= 5.28, r4= 5.78, &end
#
# 150 CYX HA 150 CYX HB2 4.41
&rst
ixpk= 0, nxpk= 0, iat=2120,2123, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91, &end
#
# 150 CYX HA 150 CYX HB3 4.80
&rst
ixpk= 0, nxpk= 0, iat=2120,2122, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30, &end
#
# 150 CYX HA 151 GLY HN 2.97
&rst
ixpk= 0, nxpk= 0, iat=2120,2128, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end
#
# 150 CYX HA 151 GLY HN 3.38
&rst
ixpk= 0, nxpk= 0, iat=2120,2128, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88, &end
#
# 150 CYX HA 151 GLY HN 3.38
&rst
ixpk= 0, nxpk= 0, iat=2120,2128, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88, &end
#
# 150 CYX HA 151 GLY HN 3.38
&rst
ixpk= 0, nxpk= 0, iat=2120,2128, r1= 1.30, r2= 1.80, r3= 3.38, r4= 3.88, &end
#
# 150 CYX HA 151 GLY HA2 6.03
&rst
ixpk= 0, nxpk= 0, iat=2120,2130, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53, &end
#
# 150 CYX HA 151 GLY HA2 6.03
&rst
ixpk= 0, nxpk= 0, iat=2120,2130, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53, &end
#
# 150 CYX HA 151 GLY HA2 6.03
&rst
ixpk= 0, nxpk= 0, iat=2120,2130, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53, &end
#
# 150 CYX HA 151 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat=2120,2131, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 150 CYX HA 151 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat=2120,2131, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 150 CYX HA 151 GLY HA3 6.05
&rst
ixpk= 0, nxpk= 0, iat=2120,2131, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 150 CYX HB2 151 GLY HN 4.74
&rst
ixpk= 0, nxpk= 0, iat=2123,2128, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24, &end
#
# 150 CYX HB2 151 GLY HN 4.74
&rst
ixpk= 0, nxpk= 0, iat=2123,2128, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24, &end
#
# 150 CYX HB2 151 GLY HN 4.74
&rst
ixpk= 0, nxpk= 0, iat=2123,2128, r1= 1.30, r2= 1.80, r3= 4.74, r4= 5.24, &end
#
# 150 CYX HB2 151 GLY HN 5.72
&rst
ixpk= 0, nxpk= 0, iat=2123,2128, r1= 1.30, r2= 1.80, r3= 5.72, r4= 6.22, &end
#
# 150 CYX HB3 150 CYX HB2 3.87
&rst
ixpk= 0, nxpk= 0, iat=2122,2123, r1= 1.30, r2= 1.80, r3= 3.87, r4= 4.37, &end
#
# 150 CYX HB3 151 GLY HN 5.40
&rst
ixpk= 0, nxpk= 0, iat=2122,2128, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90, &end
#
# 150 CYX HB3 151 GLY HN 5.40
&rst
ixpk= 0, nxpk= 0, iat=2122,2128, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90, &end
#
# 150 CYX HB3 151 GLY HN 5.40
&rst
ixpk= 0, nxpk= 0, iat=2122,2128, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90, &end
#
# 151 GLY HN 151 GLY HA2 4.27
&rst
ixpk= 0, nxpk= 0, iat=2128,2130, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77, &end
#
# 151 GLY HN 151 GLY HA3 4.31
&rst
ixpk= 0, nxpk= 0, iat=2128,2131, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81, &end
#
# 151 GLY HN 152 VAL HN 5.03
&rst
ixpk= 0, nxpk= 0, iat=2128,2135, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53, &end
#
# 151 GLY HN 152 VAL HN 5.03
&rst
ixpk= 0, nxpk= 0, iat=2128,2135, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53, &end
#
# 151 GLY HN 152 VAL HN 5.03
&rst
ixpk= 0, nxpk= 0, iat=2128,2135, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53, &end
#
# 151 GLY HN 152 VAL HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=2128,2137, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 151 GLY HN 152 VAL HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=2128,2137, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 151 GLY HN 152 VAL HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=2128,2137, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 151 GLY HA2 151 GLY HA3 3.80
&rst
ixpk= 0, nxpk= 0, iat=2130,2131, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30, &end
#
# 151 GLY HA2 152 VAL HN 4.05
&rst
ixpk= 0, nxpk= 0, iat=2130,2135, r1= 1.30, r2= 1.80, r3= 4.05, r4= 4.55, &end
#
# 151 GLY HA2 152 VAL QG2 5.13
&rst
ixpk= 0, nxpk= 0, iat=2130, -1, r1= 1.30, r2= 1.80, r3= 6.16, r4= 6.66,
igr2=2145,2146,2147,
&end
#
# 151 GLY HA2 152 VAL QG2 5.13
&rst
ixpk= 0, nxpk= 0, iat=2130, -1, r1= 1.30, r2= 1.80, r3= 6.16, r4= 6.66,
igr2=2145,2146,2147,
&end
#
# 151 GLY HA2 152 VAL QG2 5.13
&rst
ixpk= 0, nxpk= 0, iat=2130, -1, r1= 1.30, r2= 1.80, r3= 6.16, r4= 6.66,
igr2=2145,2146,2147,
&end
#
# 151 GLY HA3 152 VAL HN 3.92
&rst
ixpk= 0, nxpk= 0, iat=2131,2135, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42, &end
#
# 151 GLY HA3 152 VAL HN 3.92
&rst
ixpk= 0, nxpk= 0, iat=2131,2135, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42, &end
#
# 151 GLY HA3 152 VAL HN 3.92
&rst
ixpk= 0, nxpk= 0, iat=2131,2135, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42, &end
#
# 152 VAL HN 152 VAL HA 3.83
&rst
ixpk= 0, nxpk= 0, iat=2135,2137, r1= 1.30, r2= 1.80, r3= 3.83, r4= 4.33, &end
#
# 152 VAL HN 152 VAL HB 3.43
&rst
ixpk= 0, nxpk= 0, iat=2135,2139, r1= 1.30, r2= 1.80, r3= 3.43, r4= 3.93, &end
#
# 152 VAL HN 152 VAL HB 3.43
&rst
ixpk= 0, nxpk= 0, iat=2135,2139, r1= 1.30, r2= 1.80, r3= 3.43, r4= 3.93, &end
#
# 152 VAL HN 152 VAL HB 3.43
&rst
ixpk= 0, nxpk= 0, iat=2135,2139, r1= 1.30, r2= 1.80, r3= 3.43, r4= 3.93, &end
#
# 152 VAL HN 152 VAL QG1 4.35
&rst
ixpk= 0, nxpk= 0, iat=2135, -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
igr2=2141,2142,2143,
&end
#
# 152 VAL HN 152 VAL QG1 4.35
&rst
ixpk= 0, nxpk= 0, iat=2135, -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
igr2=2141,2142,2143,
&end
#
# 152 VAL HN 152 VAL QG1 4.35
&rst
ixpk= 0, nxpk= 0, iat=2135, -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
igr2=2141,2142,2143,
&end
#
# 152 VAL HN 152 VAL QG2 3.69
&rst
ixpk= 0, nxpk= 0, iat=2135, -1, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
igr2=2145,2146,2147,
&end
#
# 152 VAL HN 152 VAL QG2 3.69
&rst
ixpk= 0, nxpk= 0, iat=2135, -1, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
igr2=2145,2146,2147,
&end
#
# 152 VAL HN 152 VAL QG2 3.69
&rst
ixpk= 0, nxpk= 0, iat=2135, -1, r1= 1.30, r2= 1.80, r3= 4.43, r4= 4.93,
igr2=2145,2146,2147,
&end
#
# 152 VAL HA 152 VAL HB 4.36
&rst
ixpk= 0, nxpk= 0, iat=2137,2139, r1= 1.30, r2= 1.80, r3= 4.36, r4= 4.86, &end
#
# 152 VAL HA 152 VAL QG1 3.87
&rst
ixpk= 0, nxpk= 0, iat=2137, -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
igr2=2141,2142,2143,
&end
#
# 152 VAL HA 152 VAL QG1 3.87
&rst
ixpk= 0, nxpk= 0, iat=2137, -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
igr2=2141,2142,2143,
&end
#
# 152 VAL HA 152 VAL QG1 3.87
&rst
ixpk= 0, nxpk= 0, iat=2137, -1, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15,
igr2=2141,2142,2143,
&end
#
# 152 VAL HA 152 VAL QG2 3.65
&rst
ixpk= 0, nxpk= 0, iat=2137, -1, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
igr2=2145,2146,2147,
&end
#
# 152 VAL HA 152 VAL QG2 3.65
&rst
ixpk= 0, nxpk= 0, iat=2137, -1, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
igr2=2145,2146,2147,
&end
#
# 152 VAL HA 152 VAL QG2 3.65
&rst
ixpk= 0, nxpk= 0, iat=2137, -1, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
igr2=2145,2146,2147,
&end
#
# 152 VAL HA 153 ILE HN 3.37
&rst
ixpk= 0, nxpk= 0, iat=2137,2151, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87, &end
#
# 152 VAL HA 153 ILE HN 3.37
&rst
ixpk= 0, nxpk= 0, iat=2137,2151, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87, &end
#
# 152 VAL HA 153 ILE HN 3.37
&rst
ixpk= 0, nxpk= 0, iat=2137,2151, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87, &end
#
# 152 VAL HA 153 ILE HA 5.78
&rst
ixpk= 0, nxpk= 0, iat=2137,2153, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28, &end
#
# 152 VAL HA 153 ILE HA 5.78
&rst
ixpk= 0, nxpk= 0, iat=2137,2153, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28, &end
#
# 152 VAL HA 153 ILE HA 5.78
&rst
ixpk= 0, nxpk= 0, iat=2137,2153, r1= 1.30, r2= 1.80, r3= 5.78, r4= 6.28, &end
#
# 152 VAL HA 153 ILE HB 5.12
&rst
ixpk= 0, nxpk= 0, iat=2137,2155, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, &end
#
# 152 VAL HA 153 ILE HB 5.12
&rst
ixpk= 0, nxpk= 0, iat=2137,2155, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, &end
#
# 152 VAL HA 153 ILE HB 5.12
&rst
ixpk= 0, nxpk= 0, iat=2137,2155, r1= 1.30, r2= 1.80, r3= 5.12, r4= 5.62, &end
#
# 152 VAL HB 152 VAL QG1 3.61
&rst
ixpk= 0, nxpk= 0, iat=2139, -1, r1= 1.30, r2= 1.80, r3= 4.34, r4= 4.84,
igr2=2141,2142,2143,
&end
#
# 152 VAL HB 152 VAL QG2 3.73
&rst
ixpk= 0, nxpk= 0, iat=2139, -1, r1= 1.30, r2= 1.80, r3= 4.48, r4= 4.98,
igr2=2145,2146,2147,
&end
#
# 152 VAL HB 153 ILE HN 4.94
&rst
ixpk= 0, nxpk= 0, iat=2139,2151, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44, &end
#
# 152 VAL HB 153 ILE HN 4.94
&rst
ixpk= 0, nxpk= 0, iat=2139,2151, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44, &end
#
# 152 VAL HB 153 ILE HN 4.94
&rst
ixpk= 0, nxpk= 0, iat=2139,2151, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44, &end
#
# 152 VAL HB 153 ILE HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=2139,2153, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 152 VAL HB 153 ILE HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=2139,2153, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 152 VAL HB 153 ILE HA 6.05
&rst
ixpk= 0, nxpk= 0, iat=2139,2153, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 152 VAL QG1 152 VAL QG2 3.38
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.87, r4= 5.37,
igr1=2141,2142,2143,
igr2=2145,2146,2147,
&end
#
# 152 VAL QG1 153 ILE HN 3.97
&rst
ixpk= 0, nxpk= 0, iat= -1,2151, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
igr1=2141,2142,2143,
&end
#
# 152 VAL QG1 153 ILE HN 3.97
&rst
ixpk= 0, nxpk= 0, iat= -1,2151, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
igr1=2141,2142,2143,
&end
#
# 152 VAL QG1 153 ILE HN 3.97
&rst
ixpk= 0, nxpk= 0, iat= -1,2151, r1= 1.30, r2= 1.80, r3= 4.77, r4= 5.27,
igr1=2141,2142,2143,
&end
#
# 152 VAL QG1 154 LYS HE2 4.69
&rst
ixpk= 0, nxpk= 0, iat= -1,2183, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr1=2141,2142,2143,
&end
#
# 152 VAL QG1 154 LYS HE2 4.69
&rst
ixpk= 0, nxpk= 0, iat= -1,2183, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr1=2141,2142,2143,
&end
#
# 152 VAL QG1 154 LYS HE2 4.69
&rst
ixpk= 0, nxpk= 0, iat= -1,2183, r1= 1.30, r2= 1.80, r3= 5.63, r4= 6.13,
igr1=2141,2142,2143,
&end
#
# 152 VAL QG1 154 LYS HE3 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,2184, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=2141,2142,2143,
&end
#
# 152 VAL QG1 154 LYS HE3 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,2184, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=2141,2142,2143,
&end
#
# 152 VAL QG1 154 LYS HE3 6.05
&rst
ixpk= 0, nxpk= 0, iat= -1,2184, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=2141,2142,2143,
&end
#
# 153 ILE HN 153 ILE HA 4.31
&rst
ixpk= 0, nxpk= 0, iat=2151,2153, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81, &end
#
# 153 ILE HN 153 ILE HB 3.92
&rst
ixpk= 0, nxpk= 0, iat=2151,2155, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42, &end
#
# 153 ILE HN 153 ILE HB 3.92
&rst
ixpk= 0, nxpk= 0, iat=2151,2155, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42, &end
#
# 153 ILE HN 153 ILE HB 3.92
&rst
ixpk= 0, nxpk= 0, iat=2151,2155, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42, &end
#
# 153 ILE HN 153 ILE HG12 3.98
&rst
ixpk= 0, nxpk= 0, iat=2151,2161, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48, &end
#
# 153 ILE HN 153 ILE HG12 3.98
&rst
ixpk= 0, nxpk= 0, iat=2151,2161, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48, &end
#
# 153 ILE HN 153 ILE HG12 3.98
&rst
ixpk= 0, nxpk= 0, iat=2151,2161, r1= 1.30, r2= 1.80, r3= 3.98, r4= 4.48, &end
#
# 153 ILE HN 153 ILE HG13 4.08
&rst
ixpk= 0, nxpk= 0, iat=2151,2162, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58, &end
#
# 153 ILE HN 153 ILE HG13 4.08
&rst
ixpk= 0, nxpk= 0, iat=2151,2162, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58, &end
#
# 153 ILE HN 153 ILE HG13 4.08
&rst
ixpk= 0, nxpk= 0, iat=2151,2162, r1= 1.30, r2= 1.80, r3= 4.08, r4= 4.58, &end
#
# 153 ILE HN 153 ILE QD1 4.49
&rst
ixpk= 0, nxpk= 0, iat=2151, -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr2=2164,2165,2166,
&end
#
# 153 ILE HN 153 ILE QD1 4.49
&rst
ixpk= 0, nxpk= 0, iat=2151, -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr2=2164,2165,2166,
&end
#
# 153 ILE HN 153 ILE QD1 4.49
&rst
ixpk= 0, nxpk= 0, iat=2151, -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr2=2164,2165,2166,
&end
#
# 153 ILE HN 153 ILE QG2 4.07
&rst
ixpk= 0, nxpk= 0, iat=2151, -1, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
igr2=2157,2158,2159,
&end
#
# 153 ILE HN 153 ILE QG2 4.07
&rst
ixpk= 0, nxpk= 0, iat=2151, -1, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
igr2=2157,2158,2159,
&end
#
# 153 ILE HN 153 ILE QG2 4.07
&rst
ixpk= 0, nxpk= 0, iat=2151, -1, r1= 1.30, r2= 1.80, r3= 4.89, r4= 5.39,
igr2=2157,2158,2159,
&end
#
# 153 ILE HN 154 LYS HN 5.35
&rst
ixpk= 0, nxpk= 0, iat=2151,2170, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85, &end
#
# 153 ILE HN 154 LYS HN 5.35
&rst
ixpk= 0, nxpk= 0, iat=2151,2170, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85, &end
#
# 153 ILE HN 154 LYS HN 5.35
&rst
ixpk= 0, nxpk= 0, iat=2151,2170, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85, &end
#
# 153 ILE HA 153 ILE HB 4.75
&rst
ixpk= 0, nxpk= 0, iat=2153,2155, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, &end
#
# 153 ILE HA 153 ILE HG12 4.65
&rst
ixpk= 0, nxpk= 0, iat=2153,2161, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15, &end
#
# 153 ILE HA 153 ILE HG12 4.65
&rst
ixpk= 0, nxpk= 0, iat=2153,2161, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15, &end
#
# 153 ILE HA 153 ILE HG12 4.65
&rst
ixpk= 0, nxpk= 0, iat=2153,2161, r1= 1.30, r2= 1.80, r3= 4.65, r4= 5.15, &end
#
# 153 ILE HA 153 ILE HG13 5.60
&rst
ixpk= 0, nxpk= 0, iat=2153,2162, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10, &end
#
# 153 ILE HA 153 ILE QD1 4.94
&rst
ixpk= 0, nxpk= 0, iat=2153, -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr2=2164,2165,2166,
&end
#
# 153 ILE HA 153 ILE QD1 4.94
&rst
ixpk= 0, nxpk= 0, iat=2153, -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr2=2164,2165,2166,
&end
#
# 153 ILE HA 153 ILE QD1 4.94
&rst
ixpk= 0, nxpk= 0, iat=2153, -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
igr2=2164,2165,2166,
&end
#
# 153 ILE HA 153 ILE QG2 3.80
&rst
ixpk= 0, nxpk= 0, iat=2153, -1, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
igr2=2157,2158,2159,
&end
#
# 153 ILE HA 153 ILE QG2 3.80
&rst
ixpk= 0, nxpk= 0, iat=2153, -1, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
igr2=2157,2158,2159,
&end
#
# 153 ILE HA 153 ILE QG2 3.80
&rst
ixpk= 0, nxpk= 0, iat=2153, -1, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
igr2=2157,2158,2159,
&end
#
# 153 ILE HA 154 LYS HN 3.25
&rst
ixpk= 0, nxpk= 0, iat=2153,2170, r1= 1.30, r2= 1.80, r3= 3.25, r4= 3.75, &end
#
# 153 ILE HA 154 LYS HN 3.25
&rst
ixpk= 0, nxpk= 0, iat=2153,2170, r1= 1.30, r2= 1.80, r3= 3.25, r4= 3.75, &end
#
# 153 ILE HA 154 LYS HN 3.25
&rst
ixpk= 0, nxpk= 0, iat=2153,2170, r1= 1.30, r2= 1.80, r3= 3.25, r4= 3.75, &end
#
# 153 ILE HA 154 LYS HA 5.39
&rst
ixpk= 0, nxpk= 0, iat=2153,2172, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89, &end
#
# 153 ILE HA 154 LYS HA 5.39
&rst
ixpk= 0, nxpk= 0, iat=2153,2172, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89, &end
#
# 153 ILE HA 154 LYS HA 5.39
&rst
ixpk= 0, nxpk= 0, iat=2153,2172, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89, &end
#
# 153 ILE HA 154 LYS HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat=2153,2174, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 153 ILE HA 154 LYS HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat=2153,2174, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 153 ILE HA 154 LYS HB2 6.05
&rst
ixpk= 0, nxpk= 0, iat=2153,2174, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 153 ILE HA 154 LYS HG2 6.05
&rst
ixpk= 0, nxpk= 0, iat=2153,2177, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 153 ILE HA 154 LYS HG2 6.05
&rst
ixpk= 0, nxpk= 0, iat=2153,2177, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 153 ILE HA 154 LYS HG2 6.05
&rst
ixpk= 0, nxpk= 0, iat=2153,2177, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 153 ILE HA 154 LYS HG3 5.49
&rst
ixpk= 0, nxpk= 0, iat=2153,2178, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99, &end
#
# 153 ILE HA 154 LYS HG3 5.49
&rst
ixpk= 0, nxpk= 0, iat=2153,2178, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99, &end
#
# 153 ILE HA 154 LYS HG3 5.49
&rst
ixpk= 0, nxpk= 0, iat=2153,2178, r1= 1.30, r2= 1.80, r3= 5.49, r4= 5.99, &end
#
# 153 ILE HB 153 ILE HG13 3.89
&rst
ixpk= 0, nxpk= 0, iat=2155,2162, r1= 1.30, r2= 1.80, r3= 3.89, r4= 4.39, &end
#
# 153 ILE HB 153 ILE QD1 4.20
&rst
ixpk= 0, nxpk= 0, iat=2155, -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr2=2164,2165,2166,
&end
#
# 153 ILE HB 153 ILE QD1 4.20
&rst
ixpk= 0, nxpk= 0, iat=2155, -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr2=2164,2165,2166,
&end
#
# 153 ILE HB 153 ILE QD1 4.20
&rst
ixpk= 0, nxpk= 0, iat=2155, -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr2=2164,2165,2166,
&end
#
# 153 ILE HB 153 ILE QG2 3.83
&rst
ixpk= 0, nxpk= 0, iat=2155, -1, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
igr2=2157,2158,2159,
&end
#
# 153 ILE HB 154 LYS HN 5.51
&rst
ixpk= 0, nxpk= 0, iat=2155,2170, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01, &end
#
# 153 ILE HB 154 LYS HN 5.51
&rst
ixpk= 0, nxpk= 0, iat=2155,2170, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01, &end
#
# 153 ILE HB 154 LYS HN 5.51
&rst
ixpk= 0, nxpk= 0, iat=2155,2170, r1= 1.30, r2= 1.80, r3= 5.51, r4= 6.01, &end
#
# 153 ILE HG12 153 ILE QD1 4.24
&rst
ixpk= 0, nxpk= 0, iat=2161, -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
igr2=2164,2165,2166,
&end
#
# 153 ILE HG13 153 ILE HG12 3.40
&rst
ixpk= 0, nxpk= 0, iat=2162,2161, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90, &end
#
# 153 ILE HG13 153 ILE QD1 3.20
&rst
ixpk= 0, nxpk= 0, iat=2162, -1, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
igr2=2164,2165,2166,
&end
#
# 153 ILE HG13 154 LYS HN 4.90
&rst
ixpk= 0, nxpk= 0, iat=2162,2170, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40, &end
#
# 153 ILE HG13 154 LYS HN 4.90
&rst
ixpk= 0, nxpk= 0, iat=2162,2170, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40, &end
#
# 153 ILE HG13 154 LYS HN 4.90
&rst
ixpk= 0, nxpk= 0, iat=2162,2170, r1= 1.30, r2= 1.80, r3= 4.90, r4= 5.40, &end
#
# 153 ILE QG2 153 ILE HG12 4.71
&rst
ixpk= 0, nxpk= 0, iat= -1,2161, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr1=2157,2158,2159,
&end
#
# 153 ILE QG2 153 ILE HG13 3.20
&rst
ixpk= 0, nxpk= 0, iat= -1,2162, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
igr1=2157,2158,2159,
&end
#
# 153 ILE QG2 153 ILE HG13 3.20
&rst
ixpk= 0, nxpk= 0, iat= -1,2162, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
igr1=2157,2158,2159,
&end
#
# 153 ILE QG2 153 ILE HG13 3.20
&rst
ixpk= 0, nxpk= 0, iat= -1,2162, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
igr1=2157,2158,2159,
&end
#
# 153 ILE QG2 154 LYS HN 4.09
&rst
ixpk= 0, nxpk= 0, iat= -1,2170, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
igr1=2157,2158,2159,
&end
#
# 153 ILE QG2 154 LYS HN 4.09
&rst
ixpk= 0, nxpk= 0, iat= -1,2170, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
igr1=2157,2158,2159,
&end
#
# 153 ILE QG2 154 LYS HN 4.09
&rst
ixpk= 0, nxpk= 0, iat= -1,2170, r1= 1.30, r2= 1.80, r3= 4.91, r4= 5.41,
igr1=2157,2158,2159,
&end
#
# 153 ILE QG2 154 LYS HA 5.14
&rst
ixpk= 0, nxpk= 0, iat= -1,2172, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1=2157,2158,2159,
&end
#
# 153 ILE QG2 154 LYS HA 5.14
&rst
ixpk= 0, nxpk= 0, iat= -1,2172, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1=2157,2158,2159,
&end
#
# 153 ILE QG2 154 LYS HA 5.14
&rst
ixpk= 0, nxpk= 0, iat= -1,2172, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1=2157,2158,2159,
&end
#
# 154 LYS HN 154 LYS HA 4.10
&rst
ixpk= 0, nxpk= 0, iat=2170,2172, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60, &end
#
# 154 LYS HN 154 LYS HB2 3.92
&rst
ixpk= 0, nxpk= 0, iat=2170,2174, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42, &end
#
# 154 LYS HN 154 LYS HB2 3.92
&rst
ixpk= 0, nxpk= 0, iat=2170,2174, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42, &end
#
# 154 LYS HN 154 LYS HB2 3.92
&rst
ixpk= 0, nxpk= 0, iat=2170,2174, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42, &end
#
# 154 LYS HN 154 LYS HB3 3.85
&rst
ixpk= 0, nxpk= 0, iat=2170,2175, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35, &end
#
# 154 LYS HN 154 LYS HB3 3.85
&rst
ixpk= 0, nxpk= 0, iat=2170,2175, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35, &end
#
# 154 LYS HN 154 LYS HB3 3.85
&rst
ixpk= 0, nxpk= 0, iat=2170,2175, r1= 1.30, r2= 1.80, r3= 3.85, r4= 4.35, &end
#
# 154 LYS HN 154 LYS HG3 4.46
&rst
ixpk= 0, nxpk= 0, iat=2170,2178, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, &end
#
# 154 LYS HN 154 LYS HG3 4.46
&rst
ixpk= 0, nxpk= 0, iat=2170,2178, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, &end
#
# 154 LYS HN 154 LYS HG3 4.46
&rst
ixpk= 0, nxpk= 0, iat=2170,2178, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, &end
#
# 154 LYS HA 154 LYS HB2 3.64
&rst
ixpk= 0, nxpk= 0, iat=2172,2174, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14, &end
#
# 154 LYS HA 154 LYS HB3 4.16
&rst
ixpk= 0, nxpk= 0, iat=2172,2175, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66, &end
#
# 154 LYS HA 154 LYS HE3 6.03
&rst
ixpk= 0, nxpk= 0, iat=2172,2184, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53, &end
#
# 154 LYS HA 154 LYS HE3 6.03
&rst
ixpk= 0, nxpk= 0, iat=2172,2184, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53, &end
#
# 154 LYS HA 154 LYS HE3 6.03
&rst
ixpk= 0, nxpk= 0, iat=2172,2184, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53, &end
#
# 154 LYS HA 154 LYS HG2 4.67
&rst
ixpk= 0, nxpk= 0, iat=2172,2177, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, &end
#
# 154 LYS HA 154 LYS HG2 4.67
&rst
ixpk= 0, nxpk= 0, iat=2172,2177, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, &end
#
# 154 LYS HA 154 LYS HG2 4.67
&rst
ixpk= 0, nxpk= 0, iat=2172,2177, r1= 1.30, r2= 1.80, r3= 4.67, r4= 5.17, &end
#
# 154 LYS HA 154 LYS HG3 4.12
&rst
ixpk= 0, nxpk= 0, iat=2172,2178, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62, &end
#
# 154 LYS HA 154 LYS HG3 4.12
&rst
ixpk= 0, nxpk= 0, iat=2172,2178, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62, &end
#
# 154 LYS HA 154 LYS HG3 4.12
&rst
ixpk= 0, nxpk= 0, iat=2172,2178, r1= 1.30, r2= 1.80, r3= 4.12, r4= 4.62, &end
#
# 154 LYS HA 154 LYS QD 3.74
&rst
ixpk= 0, nxpk= 0, iat=2172, -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
igr2=2180,2181,
&end
#
# 154 LYS HA 154 LYS QD 3.74
&rst
ixpk= 0, nxpk= 0, iat=2172, -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
igr2=2180,2181,
&end
#
# 154 LYS HA 154 LYS QD 3.74
&rst
ixpk= 0, nxpk= 0, iat=2172, -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
igr2=2180,2181,
&end
#
# 154 LYS HB2 154 LYS HE2 6.05
&rst
ixpk= 0, nxpk= 0, iat=2174,2183, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 154 LYS HB2 154 LYS HE2 6.05
&rst
ixpk= 0, nxpk= 0, iat=2174,2183, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 154 LYS HB2 154 LYS HE2 6.05
&rst
ixpk= 0, nxpk= 0, iat=2174,2183, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55, &end
#
# 154 LYS HB2 154 LYS HE3 5.04
&rst
ixpk= 0, nxpk= 0, iat=2174,2184, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54, &end
#
# 154 LYS HB2 154 LYS HE3 5.04
&rst
ixpk= 0, nxpk= 0, iat=2174,2184, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54, &end
#
# 154 LYS HB2 154 LYS HE3 5.04
&rst
ixpk= 0, nxpk= 0, iat=2174,2184, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54, &end
#
# 154 LYS HB2 154 LYS HG2 4.20
&rst
ixpk= 0, nxpk= 0, iat=2174,2177, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 154 LYS HB3 154 LYS HB2 2.88
&rst
ixpk= 0, nxpk= 0, iat=2175,2174, r1= 1.30, r2= 1.80, r3= 2.88, r4= 3.38, &end
#
# 154 LYS HB3 154 LYS HG3 4.11
&rst
ixpk= 0, nxpk= 0, iat=2175,2178, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, &end
#
# 154 LYS HB3 154 LYS QD 2.96
&rst
ixpk= 0, nxpk= 0, iat=2175, -1, r1= 1.30, r2= 1.80, r3= 3.32, r4= 3.82,
igr2=2180,2181,
&end
#
# 154 LYS HB3 154 LYS QD 2.96
&rst
ixpk= 0, nxpk= 0, iat=2175, -1, r1= 1.30, r2= 1.80, r3= 3.32, r4= 3.82,
igr2=2180,2181,
&end
#
# 154 LYS HB3 154 LYS QD 2.96
&rst
ixpk= 0, nxpk= 0, iat=2175, -1, r1= 1.30, r2= 1.80, r3= 3.32, r4= 3.82,
igr2=2180,2181,
&end
#
# 154 LYS HG2 154 LYS HE3 5.35
&rst
ixpk= 0, nxpk= 0, iat=2177,2184, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85, &end
#
# 154 LYS HG2 154 LYS QD 3.51
&rst
ixpk= 0, nxpk= 0, iat=2177, -1, r1= 1.30, r2= 1.80, r3= 3.94, r4= 4.44,
igr2=2180,2181,
&end
#
# 154 LYS HG3 154 LYS HE3 5.35
&rst
ixpk= 0, nxpk= 0, iat=2178,2184, r1= 1.30, r2= 1.80, r3= 5.35, r4= 5.85, &end
#
# 154 LYS HG3 154 LYS HG2 3.02
&rst
ixpk= 0, nxpk= 0, iat=2178,2177, r1= 1.30, r2= 1.80, r3= 3.02, r4= 3.52, &end
#
# 154 LYS HG3 154 LYS QD 3.27
&rst
ixpk= 0, nxpk= 0, iat=2178, -1, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,
igr2=2180,2181,
&end
#
# 154 LYS HG3 154 LYS QD 3.27
&rst
ixpk= 0, nxpk= 0, iat=2178, -1, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,
igr2=2180,2181,
&end
#
# 154 LYS HG3 154 LYS QD 3.27
&rst
ixpk= 0, nxpk= 0, iat=2178, -1, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17,
igr2=2180,2181,
&end
#
# 154 LYS QD 154 LYS HE2 4.17
&rst
ixpk= 0, nxpk= 0, iat= -1,2183, r1= 1.30, r2= 1.80, r3= 4.68, r4= 5.18,
igr1=2180,2181,
&end
#
# 154 LYS QD 154 LYS HE3 3.72
&rst
ixpk= 0, nxpk= 0, iat= -1,2184, r1= 1.30, r2= 1.80, r3= 4.18, r4= 4.68,
igr1=2180,2181,
&end
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