NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
21498 |
2hna   |
cing | 1-original | 2 | AMBER | distance | NOE | simple |
#
# 0 AMB 20-2:13 68 PRO HA 2.80 (# 13:20 Single Ambig)
&rst
ixpk= 13, nxpk= 20, iat= -1, 971, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
rk2=20.0, rk3=20.0, ir6=1, ialtd=0,
igr1= 968, 969,1020,1021,
&end
#
# 0 AMB 20-2:14 0 AMB 20-1:14 4.80 (# 14:20 Double Ambig)
&rst
ixpk= 14, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.72, r4= 9.22,
igr1= 940, 941, 942, 944, 945, 946,1306,1307,1308,
igr2= 787, 788, 787, 788,
&end
#
# 0 AMB 20-2:16 54 SER HB- 4.80 (# 16:20 Single Ambig)
&rst
ixpk= 16, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.77, r4= 8.27,
igr1= 940, 941, 942, 944, 945, 946,1306,1307,1308,
igr2= 787, 788,
&end
#
# 0 AMB 20-2:56 52 VAL HA 4.00 (# 56:20 Single Ambig)
&rst
ixpk= 56, nxpk= 20, iat= -1, 750, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr1= 754, 755, 756, 758, 759, 760, 105, 106,
&end
#
# 0 AMB 20-2:60 0 AMB 20-1:60 3.00 (# 60:20 Double Ambig)
&rst
ixpk= 60, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
igr1= 962, 963, 962, 963,
igr2= 954, 955, 954, 955,
&end
#
# 0 AMB 20-2:61 0 AMB 20-1:61 3.00 (# 61:20 Double Ambig)
&rst
ixpk= 61, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
igr1= 962, 963, 962, 963,
igr2= 954, 955, 954, 955,
&end
#
# 0 AMB 20-2:62 81 SER HA 3.20 (# 62:20 Single Ambig)
&rst
ixpk= 62, nxpk= 20, iat= -1,1178, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,
igr1=1180,1181,1180,1181,
&end
#
# 0 AMB 20-2:72 141 SER HA 4.50 (# 72:20 Single Ambig)
&rst
ixpk= 72, nxpk= 20, iat= -1,2074, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
igr1=2127,2128,2127,2128,
&end
#
# 0 AMB 20-2:73 141 SER HA 3.20 (# 73:20 Single Ambig)
&rst
ixpk= 73, nxpk= 20, iat= -1,2074, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,
igr1=2076,2077,2076,2077,
&end
#
# 0 AMB 20-2:81 110 LYS HA 3.20 (# 81:20 Single Ambig)
&rst
ixpk= 81, nxpk= 20, iat= -1,1604, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,
igr1=1606,1607,1606,1607,
&end
#
# 0 AMB 20-2:87 0 AMB 20-1:87 3.20 (# 87:20 Double Ambig)
&rst
ixpk= 87, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
igr1= 269, 270, 330, 331,
igr2= 264, 325,
&end
#
# 23 ALA MB 0 AMB 20-1:88 4.00 (# 88:20 Single Ambig)
&rst
ixpk= 88, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr1= 317, 318, 319,
igr2= 264, 325,
&end
#
# 0 AMB 20-2:100 0 AMB 20-1:100 3.50 (# 100:20 Double Ambig)
&rst
ixpk= 100, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr1=1447,1448, 386, 387, 386, 387,
igr2=1445, 325,
&end
#
# 0 AMB 20-2:106 0 AMB 20-1:106 3.20 (# 106:20 Double Ambig)
&rst
ixpk= 106, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
igr1=1020,1021,1572,1573,
igr2=1018,1062,
&end
#
# 0 AMB 20-2:109 105 LEU HA 3.20 (# 109:20 Single Ambig)
&rst
ixpk= 109, nxpk= 20, iat= -1,1526, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,
igr1=1528,1529,1572,1573,
&end
#
# 0 AMB 20-2:110 105 LEU HA 4.00 (# 110:20 Single Ambig)
&rst
ixpk= 110, nxpk= 20, iat= -1,1526, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1=1531,1045,1046,
&end
#
# 0 AMB 20-2:113 0 AMB 20-1:113 3.00 (# 113:20 Double Ambig)
&rst
ixpk= 113, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
igr1=1064,1065,1067,1068,1064,1065,
igr2=1062,1018,
&end
#
# 0 AMB 20-2:131 0 AMB 20-1:131 4.00 (# 131:20 Double Ambig)
&rst
ixpk= 131, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.87, r4= 6.37,
igr1= 413, 414, 415,1067,1068,
igr2= 362,1079,
&end
#
# 0 AMB 20-2:142 0 AMB 20-1:142 3.20 (# 142:20 Double Ambig)
&rst
ixpk= 142, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
igr1=2050,2051, 342, 343,
igr2=2048, 296,
&end
#
# 0 AMB 20-2:145 0 AMB 20-1:145 4.20 (# 145:20 Double Ambig)
&rst
ixpk= 145, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.13, r4= 7.63,
igr1=2055,2056,2057,2059,2060,2061,1764,1765,1766,1768,
1769,1770,
igr2=2048, 296,
&end
#
# 0 AMB 20-2:147 22 LEU HA 3.20 (# 147:20 Single Ambig)
&rst
ixpk= 147, nxpk= 20, iat= -1, 296, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,
igr1= 298, 299, 342, 343,
&end
#
# 0 AMB 20-2:150 0 AMB 20-1:150 2.80 (# 150:20 Double Ambig)
&rst
ixpk= 150, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
igr1= 909, 910,1494,1495,
igr2= 907,1492,
&end
#
# 0 AMB 20-2:152 0 AMB 20-1:152 4.00 (# 152:20 Double Ambig)
&rst
ixpk= 152, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
igr1= 398, 399, 330, 331,1344,1345,
igr2= 340,1363,
&end
#
# 0 AMB 20-2:157 0 AMB 20-1:157 3.00 (# 157:20 Double Ambig)
&rst
ixpk= 157, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
igr1=1096,1097, 342, 343,
igr2=1094, 340,
&end
#
# 0 AMB 20-2:160 47 SER HA 2.80 (# 160:20 Single Ambig)
&rst
ixpk= 160, nxpk= 20, iat= -1, 670, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
igr1= 672, 673, 672, 673,
&end
#
# 0 AMB 20-2:174 111 ASN HA 3.00 (# 174:20 Single Ambig)
&rst
ixpk= 174, nxpk= 20, iat= -1,1626, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,
igr1=1628,1629,1628,1629,
&end
#
# 0 AMB 20-2:194 72 ALA HA 3.00 (# 194:20 Single Ambig)
&rst
ixpk= 194, nxpk= 20, iat= -1,1033, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,
igr1=1081,1082,1081,1082,
&end
#
# 0 AMB 20-2:209 40 LEU HA 3.20 (# 209:20 Single Ambig)
&rst
ixpk= 209, nxpk= 20, iat= -1, 562, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
igr1= 567, 583, 584,
&end
#
# 0 AMB 20-2:223 0 AMB 20-1:223 3.00 (# 223:20 Double Ambig)
&rst
ixpk= 223, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.23, r4= 5.73,
igr1= 629, 630,2113,2114,2115,2117,2118,2119,2113,2114,
2115,2117,2118,2119,
igr2= 627, 411,
&end
#
# 0 AMB 20-2:237 0 AMB 20-1:237 2.80 (# 237:20 Double Ambig)
&rst
ixpk= 237, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
igr1= 954, 955,1111,
igr2= 962, 963,1132,1133,
&end
#
# 0 AMB 20-2:245 0 AMB 20-1:245 3.00 (# 245:20 Double Ambig)
&rst
ixpk= 245, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
igr1= 648, 649, 968, 969,
igr2= 645, 646, 962, 963,
&end
#
# 0 AMB 20-2:248 0 AMB 20-1:248 3.00 (# 248:20 Double Ambig)
&rst
ixpk= 248, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
igr1= 648, 649, 968, 969,
igr2= 645, 646, 962, 963,
&end
#
# 0 AMB 20-2:287 0 AMB 20-1:287 4.00 (# 287:20 Double Ambig)
&rst
ixpk= 287, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 85, 86, 87, 89, 90, 91, 49, 50, 51,
igr2= 733, 734, 733, 734,
&end
#
# 0 AMB 20-2:296 51 LEU HB- 4.00 (# 296:20 Single Ambig)
&rst
ixpk= 296, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.48, r4= 6.98,
igr1= 85, 86, 87, 89, 90, 91, 49, 50, 51,
igr2= 733, 734,
&end
#
# 0 AMB 20-2:304 0 AMB 20-1:304 3.50 (# 304:20 Double Ambig)
&rst
ixpk= 304, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
igr1=1609,1610,1692,1693,
igr2=1615,1616,1615,1616,
&end
#
# 0 AMB 20-2:305 0 AMB 20-1:305 3.20 (# 305:20 Double Ambig)
&rst
ixpk= 305, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
igr1=1612,1613,1612,1613,
igr2=1615,1616,1615,1616,
&end
#
# 0 AMB 20-2:306 110 LYS HE- 3.20 (# 306:20 Single Ambig)
&rst
ixpk= 306, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
igr1=1612,1613,1612,1613,
igr2=1615,1616,
&end
#
# 0 AMB 20-2:307 139 LEU HB- 3.20 (# 307:20 Single Ambig)
&rst
ixpk= 307, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,
igr1=2048,1994,
igr2=2050,2051,
&end
#
# 0 AMB 20-2:308 0 AMB 20-1:308 3.20 (# 308:20 Double Ambig)
&rst
ixpk= 308, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
igr1=2048,1994,
igr2=2050,2051,2050,2051,
&end
#
# 0 AMB 20-2:316 0 AMB 20-1:316 3.80 (# 316:20 Double Ambig)
&rst
ixpk= 316, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.24, r4= 7.74,
igr1=2055,2056,2057,2059,2060,2061,1533,1534,1535,1537,
1538,1539,
igr2=2050,2051,1528,1529,
&end
#
# 0 AMB 20-2:320 0 AMB 20-1:320 3.50 (# 320:20 Double Ambig)
&rst
ixpk= 320, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr1=1526,2048,1994,
igr2=1528,1529,2050,2051,
&end
#
# 0 AMB 20-2:322 0 AMB 20-1:322 3.20 (# 322:20 Double Ambig)
&rst
ixpk= 322, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
igr1=1676,1677,1119,1120,1217,1218,
igr2=1679,1680,1122,1123,1679,1680,
&end
#
# 0 AMB 20-2:324 0 AMB 20-1:324 4.00 (# 324:20 Double Ambig)
&rst
ixpk= 324, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
igr1=2182,2183, 345, 346,
igr2=2188,2189, 351, 352,
&end
#
# 0 AMB 20-2:338 73 LEU HB- 3.50 (# 338:20 Single Ambig)
&rst
ixpk= 338, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr1=1572,1573,1067,1068,
igr2=1045,1046,
&end
#
# 0 AMB 20-2:341 0 AMB 20-1:341 4.00 (# 341:20 Double Ambig)
&rst
ixpk= 341, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.63, r4= 8.13,
igr1= 85, 86, 87, 89, 90, 91, 85, 86, 87, 89,
90, 91,
igr2= 80, 81, 80, 81,
&end
#
# 0 AMB 20-2:342 0 AMB 20-1:342 3.50 (# 342:20 Double Ambig)
&rst
ixpk= 342, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
igr1=1572,1573,1067,1068,
igr2=1045,1046,1045,1046,
&end
#
# 0 AMB 20-2:347 6 LEU HB- 4.00 (# 347:20 Single Ambig)
&rst
ixpk= 347, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 85, 86, 87, 89, 90, 91, 85, 86, 87, 89,
90, 91,
igr2= 80, 81,
&end
#
# 0 AMB 20-2:357 0 AMB 20-1:357 3.20 (# 357:20 Double Ambig)
&rst
ixpk= 357, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
igr1= 586, 564, 565,
igr2= 583, 584, 583, 584,
&end
#
# 0 AMB 20-2:358 0 AMB 20-1:358 3.80 (# 358:20 Double Ambig)
&rst
ixpk= 358, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.91, r4= 7.41,
igr1= 588, 589, 590, 592, 593, 594, 68, 69, 70,
igr2= 583, 584, 629, 630,
&end
#
# 0 AMB 20-2:359 0 AMB 20-1:359 3.50 (# 359:20 Double Ambig)
&rst
ixpk= 359, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr1= 66, 581,
igr2= 629, 630, 583, 584,
&end
#
# 0 AMB 20-2:366 88 ILE HB 3.00 (# 366:20 Single Ambig)
&rst
ixpk= 366, nxpk= 20, iat= -1,1278, r1= 1.30, r2= 1.80, r3= 4.15, r4= 4.65,
igr1= 774, 775, 770, 771, 772,1284,1285,
&end
#
# 0 AMB 20-2:370 0 AMB 20-1:370 5.00 (# 370:20 Double Ambig)
&rst
ixpk= 370, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.57, r4= 8.07,
igr1= 478, 479,2053,
igr2= 617, 618, 351, 352,
&end
#
# 0 AMB 20-2:380 0 AMB 20-1:380 4.20 (# 380:20 Double Ambig)
&rst
ixpk= 380, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
igr1=1280,1281,1282,1762,
igr2=1759,1760,1759,1760,
&end
#
# 0 AMB 20-2:384 109 LEU HB- 3.50 (# 384:20 Single Ambig)
&rst
ixpk= 384, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
igr1=1545,1585,
igr2=1587,1588,
&end
#
# 0 AMB 20-2:386 123 ILE HB 3.00 (# 386:20 Single Ambig)
&rst
ixpk= 386, nxpk= 20, iat= -1,1800, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,
igr1=1802,1803,1804, 303, 304, 305, 307, 308, 309,
&end
#
# 0 AMB 20-2:387 123 ILE HB 4.00 (# 387:20 Single Ambig)
&rst
ixpk= 387, nxpk= 20, iat= -1,1800, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,
igr1= 242, 243, 244, 246, 247, 248,1809,1810,1811,
&end
#
# 0 AMB 20-2:388 53 ILE HB 3.20 (# 388:20 Single Ambig)
&rst
ixpk= 388, nxpk= 20, iat= -1, 768, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
igr1= 777, 778, 779, 770, 771, 772, 774, 775,
&end
#
# 0 AMB 20-2:390 0 AMB 20-1:390 3.20 (# 390:20 Double Ambig)
&rst
ixpk= 390, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
igr1=1545,1585,
igr2=1587,1588,1587,1588,
&end
#
# 0 AMB 20-2:391 109 LEU HB- 3.20 (# 391:20 Single Ambig)
&rst
ixpk= 391, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,
igr1=1545,1585,
igr2=1587,1588,
&end
#
# 0 AMB 20-2:393 0 AMB 20-1:393 3.80 (# 393:20 Double Ambig)
&rst
ixpk= 393, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.90, r4= 8.40,
igr1= 303, 304, 305, 307, 308, 309, 85, 86, 87, 89,
90, 91,1802,1803,1804, 369, 370, 371, 373, 374,
375, 369, 370, 371, 373, 374, 375,
igr2= 298, 299,1800,
&end
#
# 0 AMB 20-2:396 0 AMB 20-1:396 6.00 (# 396:20 Double Ambig)
&rst
ixpk= 396, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.08, r4= 9.58,
igr1=1201,1138,1139,
igr2=1161,1162,1161,1162,
&end
#
# 0 AMB 20-2:399 22 LEU HB- 3.50 (# 399:20 Single Ambig)
&rst
ixpk= 399, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
igr1= 303, 304, 305, 307, 308, 309, 85, 86, 87, 89,
90, 91, 369, 370, 371, 373, 374, 375, 369, 370,
371, 373, 374, 375,
igr2= 298, 299,
&end
#
# 0 AMB 20-2:401 0 AMB 20-1:401 3.20 (# 401:20 Double Ambig)
&rst
ixpk= 401, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
igr1= 296, 315,
igr2= 298, 299, 298, 299,
&end
#
# 0 AMB 20-2:404 0 AMB 20-1:404 4.00 (# 404:20 Double Ambig)
&rst
ixpk= 404, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.63, r4= 8.13,
igr1=1166,1167,1168,1170,1171,1172,1166,1167,1168,1170,
1171,1172,
igr2=1161,1162,1161,1162,
&end
#
# 0 AMB 20-2:405 0 AMB 20-1:405 3.50 (# 405:20 Double Ambig)
&rst
ixpk= 405, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
igr1= 303, 304, 305, 307, 308, 309,1166,1167,1168,1170,
1171,1172, 369, 370, 371, 373, 374, 375,
igr2= 298, 299,1161,1162, 298, 299,
&end
#
# 0 AMB 20-2:411 49 ILE HB 3.00 (# 411:20 Single Ambig)
&rst
ixpk= 411, nxpk= 20, iat= -1, 690, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
igr1= 692, 693, 694, 49, 50, 51,
&end
#
# 0 AMB 20-2:412 49 ILE HB 3.00 (# 412:20 Single Ambig)
&rst
ixpk= 412, nxpk= 20, iat= -1, 690, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
igr1= 696, 697, 699, 700, 701,
&end
#
# 0 AMB 20-2:441 0 AMB 20-1:441 3.00 (# 441:20 Double Ambig)
&rst
ixpk= 441, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,
igr1= 383, 384, 383, 384, 383, 384,
igr2= 386, 387, 386, 387, 386, 387,
&end
#
# 0 AMB 20-2:442 0 AMB 20-1:442 3.00 (# 442:20 Double Ambig)
&rst
ixpk= 442, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
igr1= 383, 384, 383, 384,
igr2= 386, 387, 386, 387,
&end
#
# 0 AMB 20-2:444 0 AMB 20-1:444 4.00 (# 444:20 Double Ambig)
&rst
ixpk= 444, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr1= 340, 396,
igr2= 401, 402, 401, 402,
&end
#
# 0 AMB 20-2:448 0 AMB 20-1:448 3.00 (# 448:20 Double Ambig)
&rst
ixpk= 448, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
igr1=2009,1079,
igr2=2014,2015,1084,1085,
&end
#
# 0 AMB 20-2:455 0 AMB 20-1:455 5.00 (# 455:20 Double Ambig)
&rst
ixpk= 455, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.94, r4= 8.44,
igr1=1304,1035,1036,1037,
igr2=1550,1551,1084,1085,
&end
#
# 0 AMB 20-2:472 0 AMB 20-1:472 3.00 (# 472:20 Double Ambig)
&rst
ixpk= 472, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
igr1=1096,1097,1135,1136,
igr2=1099,1100,1099,1100,
&end
#
# 0 AMB 20-2:477 76 GLN HG- 3.00 (# 477:20 Single Ambig)
&rst
ixpk= 477, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
igr1=1096,1097,1135,1136,
igr2=1099,1100,
&end
#
# 0 AMB 20-2:479 74 GLN HG- 3.50 (# 479:20 Single Ambig)
&rst
ixpk= 479, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
igr1=1018,1062,
igr2=1067,1068,
&end
#
# 0 AMB 20-2:480 0 AMB 20-1:480 3.50 (# 480:20 Double Ambig)
&rst
ixpk= 480, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr1=1018,1062,
igr2=1067,1068,1067,1068,
&end
#
# 0 AMB 20-2:500 116 GLN HG- 3.20 (# 500:20 Single Ambig)
&rst
ixpk= 500, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,
igr1=1690,1259,1260,
igr2=1695,1696,
&end
#
# 0 AMB 20-2:503 78 PRO HB- 6.50 (# 503:20 Single Ambig)
&rst
ixpk= 503, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
igr1=1164, 583, 584,
igr2=1138,1139,
&end
#
# 0 AMB 20-2:504 0 AMB 20-1:504 3.00 (# 504:20 Double Ambig)
&rst
ixpk= 504, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
igr1=1509,1510, 662, 663, 664,
igr2=1506,1507,1138,1139,
&end
#
# 0 AMB 20-2:510 0 AMB 20-1:510 3.00 (# 510:20 Double Ambig)
&rst
ixpk= 510, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
igr1=1609,1610,1609,1610,
igr2=1606,1607,1606,1607,
&end
#
# 0 AMB 20-2:528 143 VAL HB 3.00 (# 528:20 Single Ambig)
&rst
ixpk= 528, nxpk= 20, iat= -1,2111, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
igr1=2113,2114,2115,2117,2118,2119,2113,2114,2115,2117,
2118,2119,
&end
#
# 0 AMB 20-2:533 0 AMB 20-1:533 3.00 (# 533:20 Double Ambig)
&rst
ixpk= 533, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.33, r4= 4.83,
igr1= 238, 962, 963,
igr2= 240, 968, 969,
&end
#
# 0 AMB 20-2:537 6 LEU HG 3.00 (# 537:20 Single Ambig)
&rst
ixpk= 537, nxpk= 20, iat= -1, 83, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
igr1= 85, 86, 87, 89, 90, 91, 85, 86, 87, 89,
90, 91,
&end
#
# 0 AMB 20-2:540 0 AMB 20-1:540 3.00 (# 540:20 Double Ambig)
&rst
ixpk= 540, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
igr1=1079, 340,
igr2=1081,1082, 342, 343,
&end
#
# 0 AMB 20-2:542 0 AMB 20-1:542 3.00 (# 542:20 Double Ambig)
&rst
ixpk= 542, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
igr1= 242, 243, 244, 246, 247, 248, 166, 167, 168, 170,
171, 172, 369, 370, 371, 373, 374, 375,
igr2= 240, 968, 969, 342, 343,
&end
#
# 0 AMB 20-2:560 74 GLN HB- 3.00 (# 560:20 Single Ambig)
&rst
ixpk= 560, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,
igr1=1062,1018,
igr2=1064,1065,
&end
#
# 0 AMB 20-2:566 0 AMB 20-1:566 3.00 (# 566:20 Double Ambig)
&rst
ixpk= 566, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
igr1=1062,1018,
igr2=1064,1065,1064,1065,1572,1573,
&end
#
# 0 AMB 20-2:567 0 AMB 20-1:567 3.20 (# 567:20 Double Ambig)
&rst
ixpk= 567, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
igr1=1615,1616,1615,1616,
igr2=1612,1613,1612,1613,
&end
#
# 0 AMB 20-2:570 28 GLU HB- 3.20 (# 570:20 Single Ambig)
&rst
ixpk= 570, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,
igr1= 396, 340,
igr2= 398, 399,
&end
#
# 0 AMB 20-2:578 0 AMB 20-1:578 3.00 (# 578:20 Double Ambig)
&rst
ixpk= 578, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
igr1=1018,1062,
igr2=1020,1021,1572,1573,
&end
#
# 0 AMB 20-2:585 0 AMB 20-1:585 3.00 (# 585:20 Double Ambig)
&rst
ixpk= 585, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
igr1=1116,1117, 256, 257, 258,
igr2=1119,1120, 204, 205,
&end
#
# 0 AMB 20-2:587 0 AMB 20-1:587 3.00 (# 587:20 Double Ambig)
&rst
ixpk= 587, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
igr1=1679,1680,1122,1123,
igr2=1676,1677,1119,1120,
&end
#
# 20 GLU HA 0 AMB 20-1:590 3.20 (# 590:20 Single Ambig)
&rst
ixpk= 590, nxpk= 20, iat= 264, -1, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,
igr2= 266, 267, 266, 267,
&end
#
# 0 AMB 20-2:591 0 AMB 20-1:591 3.00 (# 591:20 Double Ambig)
&rst
ixpk= 591, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
igr1=1099,1100,1099,1100,
igr2=1096,1097,1096,1097,
&end
#
# 0 AMB 20-2:592 76 GLN HB- 3.00 (# 592:20 Single Ambig)
&rst
ixpk= 592, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
igr1=1099,1100,1099,1100,
igr2=1096,1097,
&end
#
# 0 AMB 20-2:596 6 LEU MDX 4.00 (# 596:20 Single Ambig)
&rst
ixpk= 596, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.48, r4= 6.98,
igr1= 80, 81, 367,
igr2= 85, 86, 87, 89, 90, 91,
&end
#
# 0 AMB 20-2:599 6 LEU MDX 4.00 (# 599:20 Single Ambig)
&rst
ixpk= 599, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 733, 734, 298, 299,
igr2= 85, 86, 87, 89, 90, 91,
&end
#
# 0 AMB 20-2:603 0 AMB 20-1:603 5.00 (# 603:20 Double Ambig)
&rst
ixpk= 603, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.94, r4= 8.44,
igr1=1132,1133, 962, 963,
igr2=1096,1097, 965, 966,
&end
#
# 24 GLU HA 0 AMB 20-1:604 4.00 (# 604:20 Single Ambig)
&rst
ixpk= 604, nxpk= 20, iat= 325, -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr2= 383, 384, 383, 384,
&end
#
# 0 AMB 20-2:605 0 AMB 20-1:605 3.00 (# 605:20 Double Ambig)
&rst
ixpk= 605, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.45, r4= 5.95,
igr1= 386, 387, 386, 387, 386, 387,
igr2= 383, 384, 383, 384, 383, 384,
&end
#
# 0 AMB 20-2:620 0 AMB 20-1:620 3.00 (# 620:20 Double Ambig)
&rst
ixpk= 620, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
igr1=1695,1696, 690,
igr2=1692,1693, 696, 697,
&end
#
# 0 AMB 20-2:646 0 AMB 20-1:646 4.00 (# 646:20 Double Ambig)
&rst
ixpk= 646, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 53, 54,1533,1534,1535,1537,1538,1539,
igr2= 696, 697,1531,
&end
#
# 0 AMB 20-2:658 0 AMB 20-1:658 4.00 (# 658:20 Double Ambig)
&rst
ixpk= 658, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
igr1=1132,1133,1642,1643,
igr2=1135,1136,1135,1136,
&end
#
# 0 AMB 20-2:659 0 AMB 20-1:659 3.00 (# 659:20 Double Ambig)
&rst
ixpk= 659, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
igr1= 364, 365,1138,1139,
igr2= 367,1135,1136,
&end
#
# 0 AMB 20-2:664 0 AMB 20-1:664 3.20 (# 664:20 Double Ambig)
&rst
ixpk= 664, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
igr1= 351, 352,1223,1224,
igr2= 348, 349,1220,1221,
&end
#
# 0 AMB 20-2:674 26 LEU HG 3.00 (# 674:20 Single Ambig)
&rst
ixpk= 674, nxpk= 20, iat= -1, 367, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
igr1= 369, 370, 371, 373, 374, 375, 85, 86, 87, 89,
90, 91,
&end
#
# 0 AMB 20-2:676 0 AMB 20-1:676 3.00 (# 676:20 Double Ambig)
&rst
ixpk= 676, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
igr1=1606,1607,1528,1529,
igr2=1609,1610,1531,
&end
#
# 0 AMB 20-2:685 12 LEU HG 3.00 (# 685:20 Single Ambig)
&rst
ixpk= 685, nxpk= 20, iat= -1, 164, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
igr1= 166, 167, 168, 170, 171, 172, 166, 167, 168, 170,
171, 172,
&end
#
# 0 AMB 20-2:692 0 AMB 20-1:692 3.00 (# 692:20 Double Ambig)
&rst
ixpk= 692, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
igr1=1921,1922,1923,1914,1915,1916,
igr2=1918,1919,1918,1919,
&end
#
# 0 AMB 20-2:704 139 LEU HG 3.00 (# 704:20 Single Ambig)
&rst
ixpk= 704, nxpk= 20, iat= -1,2053, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
igr1=2055,2056,2057,2059,2060,2061,1764,1765,1766,1768,
1769,1770,
&end
#
# 0 AMB 20-2:711 139 LEU MDY 5.00 (# 711:20 Single Ambig)
&rst
ixpk= 711, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.57, r4= 8.07,
igr1=1994,2048,
igr2=2055,2056,2057,2059,2060,2061,
&end
#
# 0 AMB 20-2:720 0 AMB 20-1:720 3.00 (# 720:20 Double Ambig)
&rst
ixpk= 720, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
igr1=1506,1507, 629, 630,
igr2=1509,1510, 632,
&end
#
# 0 AMB 20-2:721 0 AMB 20-1:721 4.00 (# 721:20 Double Ambig)
&rst
ixpk= 721, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.37, r4= 8.87,
igr1=1528,1529, 367, 342, 343,2050,2051,
igr2=1533,1534,1535,1537,1538,1539, 369, 370, 371, 373,
374, 375,
&end
#
# 0 AMB 20-2:737 0 AMB 20-1:737 3.10 (# 737:20 Double Ambig)
&rst
ixpk= 737, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88,
igr1= 629, 630,1045,1046,
igr2= 632,1048,
&end
#
# 0 AMB 20-2:738 0 AMB 20-1:738 4.00 (# 738:20 Double Ambig)
&rst
ixpk= 738, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1=1526, 315, 296,
igr2=1533,1534,1535,1537,1538,1539, 369, 370, 371, 373,
374, 375,
&end
#
# 0 AMB 20-2:739 0 AMB 20-1:739 4.00 (# 739:20 Double Ambig)
&rst
ixpk= 739, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.63, r4= 8.13,
igr1= 364, 365,1550,1551,
igr2= 369, 370, 371, 373, 374, 375,1533,1534,1535,1537,
1538,1539,
&end
#
# 0 AMB 20-2:740 26 LEU MDY 4.00 (# 740:20 Single Ambig)
&rst
ixpk= 740, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1=2053, 367,2050,2051,
igr2= 369, 370, 371, 373, 374, 375,
&end
#
# 0 AMB 20-2:757 73 LEU MDY 5.00 (# 757:20 Single Ambig)
&rst
ixpk= 757, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3=10.20, r4=10.70,
igr1=1592,1593,1594,1596,1597,1598, 588, 589, 590, 592,
593, 594,
igr2=1050,1051,1052,1054,1055,1056,
&end
#
# 0 AMB 20-2:794 109 LEU MDY 4.00 (# 794:20 Single Ambig)
&rst
ixpk= 794, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
igr1=1585,1545,
igr2=1592,1593,1594,1596,1597,1598,
&end
#
# 0 AMB 20-2:804 0 AMB 20-1:804 3.00 (# 804:20 Double Ambig)
&rst
ixpk= 804, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
igr1=1676,1677,1217,1218,
igr2=1673,1674,1673,1674,
&end
#
# 0 AMB 20-2:813 146 LEU MDY 3.00 (# 813:20 Single Ambig)
&rst
ixpk= 813, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
igr1=2163, 692, 693, 694,
igr2=2165,2166,2167,2169,2170,2171,
&end
#
# 0 AMB 20-2:837 105 LEU MDY 5.50 (# 837:20 Single Ambig)
&rst
ixpk= 837, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
igr1= 997,1330,1331,
igr2=1533,1534,1535,1537,1538,1539,
&end
#
# 0 AMB 20-2:885 26 LEU MDX 4.50 (# 885:20 Single Ambig)
&rst
ixpk= 885, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
igr1=2053, 367, 342, 343,2050,2051,
igr2= 369, 370, 371, 373, 374, 375,
&end
#
# 0 AMB 20-2:888 0 AMB 20-1:888 3.00 (# 888:20 Double Ambig)
&rst
ixpk= 888, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
igr1= 240,1730,1731,
igr2= 242, 243, 244, 246, 247, 248,1747,1748,1749,
&end
#
# 0 AMB 20-2:899 0 AMB 20-1:899 5.50 (# 899:20 Double Ambig)
&rst
ixpk= 899, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
igr1= 367, 965, 966,
igr2= 466, 467, 468, 149, 150, 151,
&end
#
# 0 AMB 20-2:930 0 AMB 20-1:930 3.00 (# 930:20 Double Ambig)
&rst
ixpk= 930, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70,
igr1= 301, 602, 603,
igr2= 303, 304, 305, 307, 308, 309, 68, 69, 70,
&end
#
# 0 AMB 20-2:934 121 LEU MDX 5.00 (# 934:20 Single Ambig)
&rst
ixpk= 934, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.49, r4= 8.99,
igr1=1284,1285,1759,1760,
igr2=1764,1765,1766,1768,1769,1770,
&end
#
# 0 AMB 20-2:948 0 AMB 20-1:948 4.20 (# 948:20 Double Ambig)
&rst
ixpk= 948, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.63, r4= 8.13,
igr1=1135,1136,2053,
igr2=1166,1167,1168,1170,1171,1172,1764,1765,1766,1768,
1769,1770,
&end
#
# 0 AMB 20-2:980 83 VAL MGX 5.00 (# 980:20 Single Ambig)
&rst
ixpk= 980, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.49, r4= 8.99,
igr1=1164, 662, 663, 664,
igr2=1203,1204,1205,1207,1208,1209,
&end
#
# 0 AMB 20-2:1012 0 AMB 20-1:1012 3.00 (# 1012:20 Double Ambig)
&rst
ixpk= 1012, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36,
igr1=1304,1778,1779,
igr2=1306,1307,1308,1914,1915,1916,
&end
#
# 0 AMB 20-2:1017 90 ILE MG2 4.00 (# 1017:20 Single Ambig)
&rst
ixpk= 1017, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.28, r4= 6.78,
igr1=1310,1311,1268,1269,1270,
igr2=1306,1307,1308,
&end
#
# 0 AMB 20-2:1039 19 ALA MB 4.00 (# 1039:20 Single Ambig)
&rst
ixpk= 1039, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
igr1= 118, 119, 118, 119,
igr2= 256, 257, 258,
&end
#
# 0 AMB 20-2:1063 7 ILE MG2 4.00 (# 1063:20 Single Ambig)
&rst
ixpk= 1063, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.79, r4= 7.29,
igr1= 105, 106, 754, 755, 756, 758, 759, 760,
igr2= 101, 102, 103,
&end
#
# 0 AMB 20-2:1071 88 ILE MG2 4.00 (# 1071:20 Single Ambig)
&rst
ixpk= 1071, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.28, r4= 6.78,
igr1=1802,1803,1804,1759,1760,
igr2=1280,1281,1282,
&end
#
# 0 AMB 20-2:1074 88 ILE MG2 5.00 (# 1074:20 Single Ambig)
&rst
ixpk= 1074, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.57, r4= 8.07,
igr1=1284,1285,1759,1760,
igr2=1280,1281,1282,
&end
#
# 0 AMB 20-2:1077 53 ILE MD1 3.00 (# 1077:20 Single Ambig)
&rst
ixpk= 1077, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
igr1= 774, 775, 80, 81,
igr2= 777, 778, 779,
&end
#
# 0 AMB 20-2:1084 7 ILE MD1 3.00 (# 1084:20 Single Ambig)
&rst
ixpk= 1084, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.10, r4= 5.60,
igr1= 105, 106, 754, 755, 756, 758, 759, 760,
igr2= 108, 109, 110,
&end
#
# 0 AMB 20-2:1088 88 ILE MD1 4.50 (# 1088:20 Single Ambig)
&rst
ixpk= 1088, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
igr1= 303, 304, 305, 307, 308, 309,1764,1765,1766,1768,
1769,1770,
igr2=1287,1288,1289,
&end
#
# 0 AMB 20-2:1094 49 ILE MD1 3.00 (# 1094:20 Single Ambig)
&rst
ixpk= 1094, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
igr1= 696, 697,1217,1218,
igr2= 699, 700, 701,
&end
#
# 0 AMB 20-2:1103 88 ILE MD1 5.00 (# 1103:20 Single Ambig)
&rst
ixpk= 1103, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.09, r4= 9.59,
igr1= 303, 304, 305, 307, 308, 309,1764,1765,1766,1768,
1769,1770,
igr2=1287,1288,1289,
&end
#
# 0 AMB 20-2:1106 4 ILE MD1 4.00 (# 1106:20 Single Ambig)
&rst
ixpk= 1106, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,
igr1= 47, 696, 697,
igr2= 56, 57, 58,
&end
#
# 0 AMB 20-2:1119 143 VAL HA 4.00 (# 1119:20 Single Ambig)
&rst
ixpk= 1119, nxpk= 20, iat= -1,2109, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
igr1=2102,2156,
&end
#
# 0 AMB 20-2:1125 68 PRO HD- 3.00 (# 1125:20 Single Ambig)
&rst
ixpk= 1125, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
igr1= 954, 955, 954, 955,
igr2= 962, 963,
&end
#
# 0 AMB 20-2:1131 0 AMB 20-1:1131 3.20 (# 1131:20 Double Ambig)
&rst
ixpk= 1131, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
igr1=1649, 419,
igr2=1651,1652, 421, 422,
&end
#
# 41 LEU HN 0 AMB 20-1:1154 4.50 (# 1154:20 Single Ambig)
&rst
ixpk= 1154, nxpk= 20, iat= 579, -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
igr2= 564, 565, 583, 584,
&end
#
# 0 AMB 20-2:1164 40 LEU HB- 3.50 (# 1164:20 Single Ambig)
&rst
ixpk= 1164, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
igr1= 562, 615,
igr2= 564, 565,
&end
#
# 0 AMB 20-2:1165 0 AMB 20-1:1165 3.50 (# 1165:20 Double Ambig)
&rst
ixpk= 1165, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr1= 562, 615,
igr2= 564, 565, 564, 565,
&end
#
# 0 AMB 20-2:1167 0 AMB 20-1:1167 2.80 (# 1167:20 Double Ambig)
&rst
ixpk= 1167, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
igr1= 766, 78,
igr2=1278, 80, 81,
&end
#
# 0 AMB 20-2:1181 103 ASP HB- 3.00 (# 1181:20 Single Ambig)
&rst
ixpk= 1181, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,
igr1=1492,1411,
igr2=1494,1495,
&end
#
# 0 AMB 20-2:1183 0 AMB 20-1:1183 3.00 (# 1183:20 Double Ambig)
&rst
ixpk= 1183, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
igr1=1492,1411,
igr2=1494,1495,1494,1495,
&end
#
# 0 AMB 20-2:1190 0 AMB 20-1:1190 3.50 (# 1190:20 Double Ambig)
&rst
ixpk= 1190, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr1=1147, 952,
igr2=1149,1150, 999,1000,
&end
#
# 144 ASN HA 0 AMB 20-1:1203 3.20 (# 1203:20 Single Ambig)
&rst
ixpk= 1203, nxpk= 20, iat=2125, -1, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,
igr2=2127,2128,2127,2128,
&end
#
# 0 AMB 20-2:1206 0 AMB 20-1:1206 3.20 (# 1206:20 Double Ambig)
&rst
ixpk= 1206, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
igr1=1626, 217,
igr2=1628,1629, 219, 220,
&end
#
# 0 AMB 20-2:1208 0 AMB 20-1:1208 4.00 (# 1208:20 Double Ambig)
&rst
ixpk= 1208, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
igr1=1633,1634, 236,
igr2=1628,1629, 219, 220,
&end
#
# 0 AMB 20-2:1210 0 AMB 20-1:1210 4.00 (# 1210:20 Double Ambig)
&rst
ixpk= 1210, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
igr1=1633,1634, 236,
igr2=1628,1629, 219, 220,
&end
#
# 0 AMB 20-2:1213 0 AMB 20-1:1213 3.20 (# 1213:20 Double Ambig)
&rst
ixpk= 1213, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
igr1=1626, 217,
igr2=1628,1629, 219, 220,
&end
#
# 27 GLU HN 0 AMB 20-1:1221 4.00 (# 1221:20 Single Ambig)
&rst
ixpk= 1221, nxpk= 20, iat= 379, -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr2= 386, 387, 386, 387,
&end
#
# 0 AMB 20-2:1233 0 AMB 20-1:1233 3.50 (# 1233:20 Double Ambig)
&rst
ixpk= 1233, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr1=1016, 598,
igr2=1023,1024, 605, 606, 605, 606,
&end
#
# 42 GLU HN 0 AMB 20-1:1234 4.00 (# 1234:20 Single Ambig)
&rst
ixpk= 1234, nxpk= 20, iat= 598, -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr2= 605, 606, 605, 606,
&end
#
# 0 AMB 20-2:1238 0 AMB 20-1:1238 5.00 (# 1238:20 Double Ambig)
&rst
ixpk= 1238, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,
igr1=1077, 560,
igr2=1084,1085, 605, 606,
&end
#
# 0 AMB 20-2:1249 0 AMB 20-1:1249 3.50 (# 1249:20 Double Ambig)
&rst
ixpk= 1249, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr1=1213,1666,
igr2=1217,1218,1670,1671,
&end
#
# 0 AMB 20-2:1258 0 AMB 20-1:1258 3.00 (# 1258:20 Double Ambig)
&rst
ixpk= 1258, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
igr1=1937,1504,
igr2=1934,1935,1506,1507,
&end
#
# 0 AMB 20-2:1260 0 AMB 20-1:1260 3.00 (# 1260:20 Double Ambig)
&rst
ixpk= 1260, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
igr1=1141, 556,
igr2=1138,1139, 553, 554,
&end
#
# 110 LYS HA 0 AMB 20-1:1262 3.20 (# 1262:20 Single Ambig)
&rst
ixpk= 1262, nxpk= 20, iat=1604, -1, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,
igr2=1606,1607,1606,1607,
&end
#
# 110 LYS HN 0 AMB 20-1:1263 3.80 (# 1263:20 Single Ambig)
&rst
ixpk= 1263, nxpk= 20, iat=1602, -1, r1= 1.30, r2= 1.80, r3= 4.79, r4= 5.29,
igr2=1606,1607,1606,1607,
&end
#
# 110 LYS HA 0 AMB 20-1:1264 3.50 (# 1264:20 Single Ambig)
&rst
ixpk= 1264, nxpk= 20, iat=1604, -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
igr2=1606,1607,1606,1607,
&end
#
# 0 AMB 20-2:1268 0 AMB 20-1:1268 3.00 (# 1268:20 Double Ambig)
&rst
ixpk= 1268, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
igr1=1728,1668,
igr2=1730,1731,1606,1607,1606,1607,
&end
#
# 0 AMB 20-2:1271 0 AMB 20-1:1271 2.80 (# 1271:20 Double Ambig)
&rst
ixpk= 1271, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
igr1= 679,1524,
igr2=1201,1506,1507,
&end
#
# 0 AMB 20-2:1295 0 AMB 20-1:1295 5.00 (# 1295:20 Double Ambig)
&rst
ixpk= 1295, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.57, r4= 8.07,
igr1=1700,1701,1060,
igr2=1341,1342,1064,1065,
&end
#
# 0 AMB 20-2:1318 0 AMB 20-1:1318 3.20 (# 1318:20 Double Ambig)
&rst
ixpk= 1318, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
igr1= 600,1094,
igr2= 602, 603,1096,1097,
&end
#
# 28 GLU HN 0 AMB 20-1:1326 4.00 (# 1326:20 Single Ambig)
&rst
ixpk= 1326, nxpk= 20, iat= 394, -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr2= 383, 384, 383, 384,
&end
#
# 27 GLU HA 0 AMB 20-1:1329 3.50 (# 1329:20 Single Ambig)
&rst
ixpk= 1329, nxpk= 20, iat= 381, -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
igr2= 383, 384, 383, 384,
&end
#
# 0 AMB 20-2:1340 73 LEU MDY 6.50 (# 1340:20 Single Ambig)
&rst
ixpk= 1340, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3=11.04, r4=11.54,
igr1=1104,1105,1003,1012,
igr2=1050,1051,1052,1054,1055,1056,
&end
#
# 0 AMB 20-2:1342 40 LEU MDX 4.50 (# 1342:20 Single Ambig)
&rst
ixpk= 1342, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
igr1= 562, 615,
igr2= 569, 570, 571, 573, 574, 575,
&end
#
# 0 AMB 20-2:1366 44 LEU MDX 4.00 (# 1366:20 Single Ambig)
&rst
ixpk= 1366, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
igr1= 627, 33,
igr2= 634, 635, 636, 638, 639, 640,
&end
#
# 0 AMB 20-2:1386 32 THR MG2 5.50 (# 1386:20 Single Ambig)
&rst
ixpk= 1386, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr1= 428, 381,
igr2= 452, 453, 454,
&end
#
# 0 AMB 20-2:1404 0 AMB 20-1:1404 5.00 (# 1404:20 Double Ambig)
&rst
ixpk= 1404, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.49, r4= 8.99,
igr1=2137,1656,
igr2=2146,2147,2148,2150,2151,2152,1166,1167,1168,1170,
1171,1172,
&end
#
# 0 AMB 20-2:1413 0 AMB 20-1:1413 3.00 (# 1413:20 Double Ambig)
&rst
ixpk= 1413, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.54, r4= 5.04,
igr1=1413, 809,
igr2=1415,1416,1417, 811, 812, 813,
&end
#
# 0 AMB 20-2:1435 72 ALA MB 3.20 (# 1435:20 Single Ambig)
&rst
ixpk= 1435, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,
igr1=1033, 977,
igr2=1035,1036,1037,
&end
#
# 0 AMB 20-2:1451 83 VAL MGY 4.50 (# 1451:20 Single Ambig)
&rst
ixpk= 1451, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
igr1=1197, 679,
igr2=1203,1204,1205,1207,1208,1209,
&end
#
# 0 AMB 20-2:1452 83 VAL MGY 4.00 (# 1452:20 Single Ambig)
&rst
ixpk= 1452, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
igr1=1199, 670,
igr2=1203,1204,1205,1207,1208,1209,
&end
#
# 0 AMB 20-2:1468 82 ALA MB 4.50 (# 1468:20 Single Ambig)
&rst
ixpk= 1468, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
igr1=1197, 679,
igr2=1191,1192,1193,
&end
#
# 0 AMB 20-2:1506 0 AMB 20-1:1506 3.50 (# 1506:20 Double Ambig)
&rst
ixpk= 1506, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr1= 679,1524,
igr2= 672, 673,1330,1331,
&end
#
# 0 AMB 20-2:1507 0 AMB 20-1:1507 4.50 (# 1507:20 Double Ambig)
&rst
ixpk= 1507, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
igr1= 668,1558,
igr2= 672, 673,1330,1331,
&end
#
# 0 AMB 20-2:1508 0 AMB 20-1:1508 4.50 (# 1508:20 Double Ambig)
&rst
ixpk= 1508, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
igr1= 679,1197,
igr2= 672, 673, 672, 673,
&end
#
# 67 SER HN 0 AMB 20-1:1526 3.50 (# 1526:20 Single Ambig)
&rst
ixpk= 1526, nxpk= 20, iat= 950, -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
igr2= 954, 955, 954, 955,
&end
#
# 67 SER HN 0 AMB 20-1:1527 3.50 (# 1527:20 Single Ambig)
&rst
ixpk= 1527, nxpk= 20, iat= 950, -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
igr2= 954, 955, 954, 955,
&end
#
# 24 GLU HN 0 AMB 20-1:1535 3.50 (# 1535:20 Single Ambig)
&rst
ixpk= 1535, nxpk= 20, iat= 323, -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
igr2= 325, 264,
&end
#
# 0 AMB 20-2:1536 137 GLU HA 3.50 (# 1536:20 Single Ambig)
&rst
ixpk= 1536, nxpk= 20, iat= -1,2009, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
igr1=2007,2022,
&end
#
# 74 GLN HN 0 AMB 20-1:1541 3.50 (# 1541:20 Single Ambig)
&rst
ixpk= 1541, nxpk= 20, iat=1060, -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
igr2=1062,1018,
&end
#
# 0 AMB 20-2:1561 23 ALA HA 3.50 (# 1561:20 Single Ambig)
&rst
ixpk= 1561, nxpk= 20, iat= -1, 315, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
igr1= 313, 360,
&end
#
# 0 AMB 20-2:1563 19 ALA HA 3.50 (# 1563:20 Single Ambig)
&rst
ixpk= 1563, nxpk= 20, iat= -1, 254, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
igr1= 252, 262,
&end
#
# 0 AMB 20-2:1566 144 ASN HA 4.00 (# 1566:20 Single Ambig)
&rst
ixpk= 1566, nxpk= 20, iat= -1,2125, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
igr1=2175,2156,
&end
#
# 0 AMB 20-2:1569 72 ALA HA 3.50 (# 1569:20 Single Ambig)
&rst
ixpk= 1569, nxpk= 20, iat= -1,1033, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
igr1=1031,1041,
&end
#
# 0 AMB 20-2:1577 114 ALA HA 3.00 (# 1577:20 Single Ambig)
&rst
ixpk= 1577, nxpk= 20, iat= -1,1658, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87,
igr1=1666,1176,
&end
#
# 83 VAL HN 0 AMB 20-1:1580 4.00 (# 1580:20 Single Ambig)
&rst
ixpk= 1580, nxpk= 20, iat=1197, -1, r1= 1.30, r2= 1.80, r3= 4.49, r4= 4.99,
igr2=1189,1658,
&end
#
# 0 AMB 20-2:1591 0 AMB 20-1:1591 3.20 (# 1591:20 Double Ambig)
&rst
ixpk= 1591, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
igr1= 836, 843,
igr2= 838, 839, 838, 839,
&end
#
# 0 AMB 20-2:1593 48 GLY HA- 3.50 (# 1593:20 Single Ambig)
&rst
ixpk= 1593, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
igr1= 686, 679,
igr2= 681, 682,
&end
#
# 0 AMB 20-2:1610 33 THR HA 5.00 (# 1610:20 Single Ambig)
&rst
ixpk= 1610, nxpk= 20, iat= -1, 462, r1= 1.30, r2= 1.80, r3= 7.85, r4= 8.35,
igr1= 49, 50, 51, 85, 86, 87, 89, 90, 91, 85,
86, 87, 89, 90, 91,
&end
#
# 0 AMB 20-2:1619 84 ARG HA 3.00 (# 1619:20 Single Ambig)
&rst
ixpk= 1619, nxpk= 20, iat= -1,1215, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
igr1=1217,1218,1220,1221,1220,1221,
&end
#
# 0 AMB 20-2:1622 87 ALA HA 3.00 (# 1622:20 Single Ambig)
&rst
ixpk= 1622, nxpk= 20, iat= -1,1266, r1= 1.30, r2= 1.80, r3= 3.92, r4= 4.42,
igr1=1268,1269,1270,1310,1311,
&end
#
# 0 AMB 20-2:1633 84 ARG HA 3.00 (# 1633:20 Single Ambig)
&rst
ixpk= 1633, nxpk= 20, iat= -1,1215, r1= 1.30, r2= 1.80, r3= 3.37, r4= 3.87,
igr1=1666,1213,
&end
#
# 0 AMB 20-2:1634 84 ARG HA 3.00 (# 1634:20 Single Ambig)
&rst
ixpk= 1634, nxpk= 20, iat= -1,1215, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr1=1237,1245,1253,
&end
#
# 0 AMB 20-2:1649 0 AMB 20-1:1649 3.20 (# 1649:20 Double Ambig)
&rst
ixpk= 1649, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,
igr1=1411, 145,
igr2=1413, 147,
&end
#
# 0 AMB 20-2:1663 143 VAL HA 5.00 (# 1663:20 Single Ambig)
&rst
ixpk= 1663, nxpk= 20, iat= -1,2109, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
igr1=2160,2161,2185,2186,
&end
#
# 19 ALA MB 0 AMB 20-1:1664 4.00 (# 1664:20 Single Ambig)
&rst
ixpk= 1664, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.05, r4= 6.55,
igr1= 256, 257, 258,
igr2= 118, 119, 118, 119,
&end
#
# 68 PRO HD- 0 AMB 20-1:1710 3.20 (# 1710:20 Single Ambig)
&rst
ixpk= 1710, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
igr1= 962, 963,
igr2= 954, 955, 954, 955,
&end
#
# 0 AMB 20-2:1717 70 TYR HA 4.50 (# 1717:20 Single Ambig)
&rst
ixpk= 1717, nxpk= 20, iat= -1, 997, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
igr1=1041,1031,
&end
#
# 0 AMB 20-2:1722 0 AMB 20-1:1722 3.50 (# 1722:20 Double Ambig)
&rst
ixpk= 1722, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
igr1=2022, 975,
igr2=2024, 977,
&end
#
# 0 AMB 20-2:1727 123 ILE HA 5.00 (# 1727:20 Single Ambig)
&rst
ixpk= 1727, nxpk= 20, iat= -1,1798, r1= 1.30, r2= 1.80, r3= 6.74, r4= 7.24,
igr1=1809,1810,1811, 770, 771, 772,
&end
#
# 0 AMB 20-2:1731 136 GLU HA 4.50 (# 1731:20 Single Ambig)
&rst
ixpk= 1731, nxpk= 20, iat= -1,1994, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
igr1=2046, 287,
&end
#
# 0 AMB 20-2:1740 110 LYS HA 5.00 (# 1740:20 Single Ambig)
&rst
ixpk= 1740, nxpk= 20, iat= -1,1604, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr1=1638,1656,
&end
#
# 74 GLN HB- 0 AMB 20-1:1747 3.00 (# 1747:20 Single Ambig)
&rst
ixpk= 1747, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,
igr1=1064,1065,
igr2=1062,1018,
&end
#
# 0 AMB 20-2:1748 71 GLU HA 4.50 (# 1748:20 Single Ambig)
&rst
ixpk= 1748, nxpk= 20, iat= -1,1018, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
igr1=1031,1041,
&end
#
# 0 AMB 20-2:1765 0 AMB 20-1:1765 4.00 (# 1765:20 Double Ambig)
&rst
ixpk= 1765, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
igr1= 367,2050,2051,2053,1067,1068, 342, 343,
igr2= 362,1079,
&end
#
# 0 AMB 20-2:1785 96 ASP HA 3.50 (# 1785:20 Single Ambig)
&rst
ixpk= 1785, nxpk= 20, iat= -1,1399, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
igr1=1397,1423,
&end
#
# 0 AMB 20-2:1788 145 LEU HA 4.50 (# 1788:20 Single Ambig)
&rst
ixpk= 1788, nxpk= 20, iat= -1,2139, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
igr1=2156,2175,
&end
#
# 0 AMB 20-2:1793 107 ALA HA 4.00 (# 1793:20 Single Ambig)
&rst
ixpk= 1793, nxpk= 20, iat= -1,1560, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr1=1612,1613,1612,1613,
&end
#
# 0 AMB 20-2:1795 85 PHE HA 4.00 (# 1795:20 Single Ambig)
&rst
ixpk= 1795, nxpk= 20, iat= -1,1239, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1=1245,1253,1237,
&end
#
# 0 AMB 20-2:1809 0 AMB 20-1:1809 5.50 (# 1809:20 Double Ambig)
&rst
ixpk= 1809, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
igr1= 907, 97,
igr2= 919, 615,
&end
#
# 0 AMB 20-2:1822 50 TRP HA 5.50 (# 1822:20 Single Ambig)
&rst
ixpk= 1822, nxpk= 20, iat= -1, 707, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
igr1= 49, 50, 51, 692, 693, 694, 85, 86, 87, 89,
90, 91,
&end
#
# 0 AMB 20-2:1852 87 ALA HA 4.50 (# 1852:20 Single Ambig)
&rst
ixpk= 1852, nxpk= 20, iat= -1,1266, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
igr1=1310,1311,1533,1534,1535,1537,1538,1539,
&end
#
# 0 AMB 20-2:1860 78 PRO HD- 4.50 (# 1860:20 Single Ambig)
&rst
ixpk= 1860, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
igr1=1138,1139,1113,1114,
igr2=1132,1133,
&end
#
# 0 AMB 20-2:1864 0 AMB 20-1:1864 5.00 (# 1864:20 Double Ambig)
&rst
ixpk= 1864, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.94, r4= 8.44,
igr1=1096,1097, 965, 966,
igr2=1132,1133, 962, 963,
&end
#
# 0 AMB 20-2:1877 0 AMB 20-1:1877 5.50 (# 1877:20 Double Ambig)
&rst
ixpk= 1877, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3=11.42, r4=11.92,
igr1= 987, 985, 989, 547, 548, 547, 548, 539,
igr2= 541, 542, 541, 542, 541, 542, 541, 542, 541, 542,
&end
#
# 0 AMB 20-2:1900 0 AMB 20-1:1900 6.00 (# 1900:20 Double Ambig)
&rst
ixpk= 1900, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.71, r4=10.21,
igr1=1159,1728,1640,
igr2=1651,1652,1721,1722,1651,1652,
&end
#
# 0 AMB 20-2:1901 0 AMB 20-1:1901 6.00 (# 1901:20 Double Ambig)
&rst
ixpk= 1901, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.52, r4=10.02,
igr1=1180,1181,1180,1181,
igr2=1651,1652,1651,1652,
&end
#
# 0 AMB 20-2:1954 110 LYS HE- 4.00 (# 1954:20 Single Ambig)
&rst
ixpk= 1954, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr1=1609,1610,1692,1693,
igr2=1615,1616,
&end
#
# 0 AMB 20-2:1961 0 AMB 20-1:1961 6.00 (# 1961:20 Double Ambig)
&rst
ixpk= 1961, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.52, r4=10.02,
igr1=1547,1548,1550,1551,
igr2=1615,1616,1615,1616,
&end
#
# 0 AMB 20-2:1970 0 AMB 20-1:1970 4.00 (# 1970:20 Double Ambig)
&rst
ixpk= 1970, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.97, r4= 7.47,
igr1=1533,1534,1535,1537,1538,1539,2163,
igr2=1528,1529,2160,2161,
&end
#
# 0 AMB 20-2:1989 0 AMB 20-1:1989 6.00 (# 1989:20 Double Ambig)
&rst
ixpk= 1989, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.52, r4=10.02,
igr1=1550,1551,1547,1548,
igr2=1528,1529,1528,1529,
&end
#
# 0 AMB 20-2:1995 0 AMB 20-1:1995 4.00 (# 1995:20 Double Ambig)
&rst
ixpk= 1995, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.63, r4= 8.13,
igr1= 85, 86, 87, 89, 90, 91, 85, 86, 87, 89,
90, 91,
igr2= 80, 81, 80, 81,
&end
#
# 0 AMB 20-2:1996 0 AMB 20-1:1996 5.50 (# 1996:20 Double Ambig)
&rst
ixpk= 1996, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
igr1= 495, 496, 497, 777, 778, 779,
igr2= 80, 81, 80, 81,
&end
#
# 0 AMB 20-2:2015 40 LEU HB- 3.50 (# 2015:20 Single Ambig)
&rst
ixpk= 2015, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
igr1= 562, 615,
igr2= 564, 565,
&end
#
# 0 AMB 20-2:2036 0 AMB 20-1:2036 5.50 (# 2036:20 Double Ambig)
&rst
ixpk= 2036, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
igr1= 386, 387, 386, 387,
igr2= 364, 365, 364, 365,
&end
#
# 0 AMB 20-2:2038 0 AMB 20-1:2038 3.50 (# 2038:20 Double Ambig)
&rst
ixpk= 2038, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr1=2139, 147,
igr2=2141,2142, 161, 162,
&end
#
# 0 AMB 20-2:2039 0 AMB 20-1:2039 3.50 (# 2039:20 Double Ambig)
&rst
ixpk= 2039, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr1= 562, 615,
igr2= 564, 565, 564, 565,
&end
#
# 0 AMB 20-2:2046 0 AMB 20-1:2046 3.50 (# 2046:20 Double Ambig)
&rst
ixpk= 2046, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr1=1898, 862,
igr2=1900,1901, 864, 865,
&end
#
# 0 AMB 20-2:2057 109 LEU HB- 6.00 (# 2057:20 Single Ambig)
&rst
ixpk= 2057, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.71, r4=10.21,
igr1=1533,1534,1535,1537,1538,1539,1660,1661,1662,
igr2=1587,1588,
&end
#
# 0 AMB 20-2:2058 109 LEU HB- 4.00 (# 2058:20 Single Ambig)
&rst
ixpk= 2058, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr1=1545,1585,
igr2=1587,1588,
&end
#
# 0 AMB 20-2:2062 0 AMB 20-1:2062 4.00 (# 2062:20 Double Ambig)
&rst
ixpk= 2062, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.21, r4= 6.71,
igr1=1268,1269,1270,1310,1311, 774, 775,
igr2=1304, 768,
&end
#
# 0 AMB 20-2:2063 0 AMB 20-1:2063 4.00 (# 2063:20 Double Ambig)
&rst
ixpk= 2063, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16,
igr1=1545,1585,
igr2=1587,1588,1587,1588,
&end
#
# 0 AMB 20-2:2065 121 LEU HB- 5.00 (# 2065:20 Single Ambig)
&rst
ixpk= 2065, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,
igr1=1280,1281,1282,1762,
igr2=1759,1760,
&end
#
# 0 AMB 20-2:2095 103 ASP HB- 3.00 (# 2095:20 Single Ambig)
&rst
ixpk= 2095, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.78, r4= 4.28,
igr1=1492,1411,
igr2=1494,1495,
&end
#
# 0 AMB 20-2:2097 0 AMB 20-1:2097 3.50 (# 2097:20 Double Ambig)
&rst
ixpk= 2097, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr1=1159,1658,
igr2=1161,1162,1161,1162,
&end
#
# 0 AMB 20-2:2099 0 AMB 20-1:2099 6.50 (# 2099:20 Double Ambig)
&rst
ixpk= 2099, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.84, r4=10.34,
igr1=1201,1138,1139,
igr2=1161,1162,1161,1162,
&end
#
# 0 AMB 20-2:2100 80 LEU HB- 6.50 (# 2100:20 Single Ambig)
&rst
ixpk= 2100, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
igr1=1201,1138,1139,
igr2=1161,1162,
&end
#
# 0 AMB 20-2:2103 0 AMB 20-1:2103 3.50 (# 2103:20 Double Ambig)
&rst
ixpk= 2103, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
igr1= 296,1642,1643, 315,
igr2= 298, 299,1161,1162, 298, 299,
&end
#
# 0 AMB 20-2:2110 0 AMB 20-1:2110 5.50 (# 2110:20 Double Ambig)
&rst
ixpk= 2110, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3=10.17, r4=10.67,
igr1=1141, 660,1642,1643, 145,
igr2=1149,1150,1149,1150,1149,1150, 999,1000,
&end
#
# 0 AMB 20-2:2126 49 ILE HB 3.50 (# 2126:20 Single Ambig)
&rst
ixpk= 2126, nxpk= 20, iat= -1, 690, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
igr1= 692, 693, 694, 49, 50, 51,
&end
#
# 0 AMB 20-2:2136 0 AMB 20-1:2136 5.00 (# 2136:20 Double Ambig)
&rst
ixpk= 2136, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.53, r4=10.03,
igr1= 940, 941, 942, 944, 945, 946, 588, 589, 590, 592,
593, 594,
igr2= 979, 980, 979, 980,
&end
#
# 0 AMB 20-2:2147 0 AMB 20-1:2147 6.00 (# 2147:20 Double Ambig)
&rst
ixpk= 2147, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3=10.90, r4=11.40,
igr1=2179,2180,2179,2180,2141,2142,
igr2=2127,2128,2127,2128,2127,2128,
&end
#
# 0 AMB 20-2:2148 0 AMB 20-1:2148 6.00 (# 2148:20 Double Ambig)
&rst
ixpk= 2148, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.52, r4=10.02,
igr1=2179,2180,2179,2180,
igr2=2127,2128,2127,2128,
&end
#
# 146 LEU HN 0 AMB 20-1:2149 6.00 (# 2149:20 Single Ambig)
&rst
ixpk= 2149, nxpk= 20, iat=2156, -1, r1= 1.30, r2= 1.80, r3= 7.56, r4= 8.06,
igr2=2127,2128,2127,2128,
&end
#
# 0 AMB 20-2:2150 0 AMB 20-1:2150 4.00 (# 2150:20 Double Ambig)
&rst
ixpk= 2150, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.05, r4= 7.55,
igr1=2132,2133,2132,2133,2137,
igr2=2127,2128,2127,2128,2127,2128,
&end
#
# 0 AMB 20-2:2181 0 AMB 20-1:2181 3.50 (# 2181:20 Double Ambig)
&rst
ixpk= 2181, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr1= 264, 325,
igr2= 269, 270, 330, 331,
&end
#
# 0 AMB 20-2:2187 0 AMB 20-1:2187 3.20 (# 2187:20 Double Ambig)
&rst
ixpk= 2187, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
igr1=2009,1321,1322,
igr2=2014,2015,1344,1345,
&end
#
# 0 AMB 20-2:2193 0 AMB 20-1:2193 6.50 (# 2193:20 Double Ambig)
&rst
ixpk= 2193, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.19, r4= 9.69,
igr1= 995,1077,
igr2=1023,1024,1023,1024,
&end
#
# 33 THR MG2 0 AMB 20-1:2199 4.20 (# 2199:20 Single Ambig)
&rst
ixpk= 2199, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
igr1= 466, 467, 468,
igr2= 386, 387, 386, 387,
&end
#
# 0 AMB 20-2:2200 0 AMB 20-1:2200 5.50 (# 2200:20 Double Ambig)
&rst
ixpk= 2200, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
igr1= 394, 426, 474,
igr2= 386, 387, 386, 387, 386, 387,
&end
#
# 0 AMB 20-2:2201 0 AMB 20-1:2201 5.00 (# 2201:20 Double Ambig)
&rst
ixpk= 2201, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.49, r4= 8.99,
igr1=1033,1721,1722,1757,
igr2=1084,1085,1733,1734,1733,1734,
&end
#
# 0 AMB 20-2:2212 0 AMB 20-1:2212 6.50 (# 2212:20 Double Ambig)
&rst
ixpk= 2212, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3=11.04, r4=11.54,
igr1=1747,1748,1749,1306,1307,1308,
igr2=1344,1345,1344,1345,
&end
#
# 43 ASP HN 0 AMB 20-1:2214 6.50 (# 2214:20 Single Ambig)
&rst
ixpk= 2214, nxpk= 20, iat= 613, -1, r1= 1.30, r2= 1.80, r3= 8.19, r4= 8.69,
igr2= 605, 606, 605, 606,
&end
#
# 0 AMB 20-2:2236 0 AMB 20-1:2236 4.00 (# 2236:20 Double Ambig)
&rst
ixpk= 2236, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.40, r4= 7.90,
igr1= 720,1249, 722, 718,
igr2= 605, 606, 605, 606,1550,1551, 605, 606, 605, 606,
&end
#
# 0 AMB 20-2:2257 50 TRP HB- 6.00 (# 2257:20 Single Ambig)
&rst
ixpk= 2257, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.71, r4=10.21,
igr1= 108, 109, 110,1203,1204,1205,1207,1208,1209,
igr2= 709, 710,
&end
#
# 0 AMB 20-2:2268 0 AMB 20-1:2268 3.50 (# 2268:20 Double Ambig)
&rst
ixpk= 2268, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
igr1=1690,1259,1260,
igr2=1695,1696,1695,1696,
&end
#
# 0 AMB 20-2:2272 0 AMB 20-1:2272 4.50 (# 2272:20 Double Ambig)
&rst
ixpk= 2272, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
igr1=1132,1133,1526,1642,1643,
igr2=1138,1139,1506,1507,
&end
#
# 0 AMB 20-2:2275 0 AMB 20-1:2275 5.00 (# 2275:20 Double Ambig)
&rst
ixpk= 2275, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.57, r4= 8.07,
igr1=1159, 681, 682,1189,
igr2=1201,1138,1139,
&end
#
# 0 AMB 20-2:2281 0 AMB 20-1:2281 3.20 (# 2281:20 Double Ambig)
&rst
ixpk= 2281, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
igr1=1937,1560,
igr2=1934,1935,1606,1607,
&end
#
# 107 ALA HA 0 AMB 20-1:2282 5.00 (# 2282:20 Single Ambig)
&rst
ixpk= 2282, nxpk= 20, iat=1560, -1, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
igr2=1606,1607,1606,1607,
&end
#
# 111 ASN HN 0 AMB 20-1:2283 4.00 (# 2283:20 Single Ambig)
&rst
ixpk= 2283, nxpk= 20, iat=1624, -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr2=1606,1607,1606,1607,
&end
#
# 0 AMB 20-2:2319 6 LEU HG 3.20 (# 2319:20 Single Ambig)
&rst
ixpk= 2319, nxpk= 20, iat= -1, 83, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
igr1= 85, 86, 87, 89, 90, 91, 85, 86, 87, 89,
90, 91,
&end
#
# 0 AMB 20-2:2333 0 AMB 20-1:2333 4.00 (# 2333:20 Double Ambig)
&rst
ixpk= 2333, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.48, r4= 6.98,
igr1=2030,2046,2041,
igr2=2026,2027,2026,2027,2026,2027,
&end
#
# 0 AMB 20-2:2336 74 GLN HB- 3.20 (# 2336:20 Single Ambig)
&rst
ixpk= 2336, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.03, r4= 4.53,
igr1=1062,1018,
igr2=1064,1065,
&end
#
# 0 AMB 20-2:2351 110 LYS HD- 3.50 (# 2351:20 Single Ambig)
&rst
ixpk= 2351, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr1=1615,1616,1615,1616,
igr2=1612,1613,
&end
#
# 0 AMB 20-2:2354 0 AMB 20-1:2354 5.20 (# 2354:20 Double Ambig)
&rst
ixpk= 2354, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.25, r4= 8.75,
igr1= 348, 349, 348, 349,
igr2= 327, 328, 398, 399,
&end
#
# 0 AMB 20-2:2373 0 AMB 20-1:2373 3.50 (# 2373:20 Double Ambig)
&rst
ixpk= 2373, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
igr1=1679,1680,1122,1123,
igr2=1676,1677,1119,1120,
&end
#
# 20 GLU HN 0 AMB 20-1:2381 3.50 (# 2381:20 Single Ambig)
&rst
ixpk= 2381, nxpk= 20, iat= 262, -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
igr2= 266, 267, 266, 267,
&end
#
# 0 AMB 20-2:2385 68 PRO HG- 4.50 (# 2385:20 Single Ambig)
&rst
ixpk= 2385, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
igr1= 145, 971,
igr2= 965, 966,
&end
#
# 21 HIS HN 0 AMB 20-1:2390 4.00 (# 2390:20 Single Ambig)
&rst
ixpk= 2390, nxpk= 20, iat= 277, -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr2= 266, 267, 266, 267,
&end
#
# 0 AMB 20-2:2391 0 AMB 20-1:2391 3.20 (# 2391:20 Double Ambig)
&rst
ixpk= 2391, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.08, r4= 5.58,
igr1= 269, 270, 269, 270,
igr2= 266, 267, 266, 267,
&end
#
# 0 AMB 20-2:2393 0 AMB 20-1:2393 5.50 (# 2393:20 Double Ambig)
&rst
ixpk= 2393, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3=10.69, r4=11.19,
igr1= 68, 69, 70, 588, 589, 590, 592, 593, 594,
igr2= 602, 603, 602, 603,1096,1097,
&end
#
# 0 AMB 20-2:2418 4 ILE HG1- 4.50 (# 2418:20 Single Ambig)
&rst
ixpk= 2418, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
igr1= 696, 697, 47,
igr2= 53, 54,
&end
#
# 0 AMB 20-2:2423 0 AMB 20-1:2423 4.20 (# 2423:20 Double Ambig)
&rst
ixpk= 2423, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
igr1= 696, 697, 47,
igr2= 53, 54, 53, 54,
&end
#
# 0 AMB 20-2:2430 0 AMB 20-1:2430 3.80 (# 2430:20 Double Ambig)
&rst
ixpk= 2430, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
igr1=1615,1616,1223,1224,
igr2=1609,1610,1220,1221,
&end
#
# 0 AMB 20-2:2432 0 AMB 20-1:2432 4.20 (# 2432:20 Double Ambig)
&rst
ixpk= 2432, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.40, r4= 7.90,
igr1= 53, 54,1528,1529,1692,1693,
igr2= 696, 697,1531,1609,1610,
&end
#
# 0 AMB 20-2:2434 0 AMB 20-1:2434 4.50 (# 2434:20 Double Ambig)
&rst
ixpk= 2434, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
igr1= 505, 750, 476,
igr2= 510, 774, 775,
&end
#
# 0 AMB 20-2:2435 36 LEU HG 5.00 (# 2435:20 Single Ambig)
&rst
ixpk= 2435, nxpk= 20, iat= -1, 510, r1= 1.30, r2= 1.80, r3= 6.30, r4= 6.80,
igr1= 478, 479, 80, 81,
&end
#
# 0 AMB 20-2:2442 0 AMB 20-1:2442 4.50 (# 2442:20 Double Ambig)
&rst
ixpk= 2442, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
igr1= 362,1111,
igr2= 367,1135,1136,
&end
#
# 0 AMB 20-2:2445 0 AMB 20-1:2445 4.50 (# 2445:20 Double Ambig)
&rst
ixpk= 2445, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
igr1= 362,1111,
igr2= 367,1135,1136,
&end
#
# 0 AMB 20-2:2453 0 AMB 20-1:2453 4.00 (# 2453:20 Double Ambig)
&rst
ixpk= 2453, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.16, r4= 8.66,
igr1= 770, 771, 772, 242, 243, 244, 246, 247, 248,1809,
1810,1811,
igr2=1806,1807,1806,1807,1806,1807,
&end
#
# 0 AMB 20-2:2454 51 LEU HG 3.20 (# 2454:20 Single Ambig)
&rst
ixpk= 2454, nxpk= 20, iat= -1, 736, r1= 1.30, r2= 1.80, r3= 5.03, r4= 5.53,
igr1= 49, 50, 51, 85, 86, 87, 89, 90, 91, 369,
370, 371, 373, 374, 375,
&end
#
# 0 AMB 20-2:2457 0 AMB 20-1:2457 4.00 (# 2457:20 Double Ambig)
&rst
ixpk= 2457, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
igr1=1615,1616,1223,1224,
igr2=1609,1610,1220,1221,
&end
#
# 0 AMB 20-2:2460 0 AMB 20-1:2460 6.50 (# 2460:20 Double Ambig)
&rst
ixpk= 2460, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3=11.33, r4=11.83,
igr1=1199,1570,1339,1492,
igr2=1220,1221,1609,1610,1609,1610,1531,
&end
#
# 0 AMB 20-2:2468 0 AMB 20-1:2468 4.50 (# 2468:20 Double Ambig)
&rst
ixpk= 2468, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
igr1=1908,1197,
igr2=1918,1919,1164,
&end
#
# 0 AMB 20-2:2489 109 LEU HG 3.50 (# 2489:20 Single Ambig)
&rst
ixpk= 2489, nxpk= 20, iat= -1,1590, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
igr1=1545,1585,
&end
#
# 0 AMB 20-2:2513 41 LEU MDX 5.50 (# 2513:20 Single Ambig)
&rst
ixpk= 2513, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
igr1=1041,1031,
igr2= 588, 589, 590, 592, 593, 594,
&end
#
# 0 AMB 20-2:2514 73 LEU MDY 6.50 (# 2514:20 Single Ambig)
&rst
ixpk= 2514, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3=13.26, r4=13.76,
igr1=1533,1534,1535,1537,1538,1539, 588, 589, 590, 592,
593, 594,
igr2=1050,1051,1052,1054,1055,1056,
&end
#
# 0 AMB 20-2:2515 73 LEU MDY 5.50 (# 2515:20 Single Ambig)
&rst
ixpk= 2515, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
igr1=1572,1573,1135,1136,
igr2=1050,1051,1052,1054,1055,1056,
&end
#
# 40 LEU HN 0 AMB 20-1:2525 5.80 (# 2525:20 Single Ambig)
&rst
ixpk= 2525, nxpk= 20, iat= 560, -1, r1= 1.30, r2= 1.80, r3= 8.78, r4= 9.28,
igr2= 569, 570, 571, 573, 574, 575, 166, 167, 168, 170,
171, 172,
&end
#
# 0 AMB 20-2:2618 33 THR MG2 5.20 (# 2618:20 Single Ambig)
&rst
ixpk= 2618, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.01, r4= 9.51,
igr1= 56, 57, 58, 738, 739, 740, 742, 743, 744,
igr2= 466, 467, 468,
&end
#
# 0 AMB 20-2:2625 0 AMB 20-1:2625 4.00 (# 2625:20 Double Ambig)
&rst
ixpk= 2625, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
igr1= 564, 565, 768,
igr2= 569, 570, 571, 573, 574, 575, 242, 243, 244, 246,
247, 248,
&end
#
# 0 AMB 20-2:2634 0 AMB 20-1:2634 3.20 (# 2634:20 Double Ambig)
&rst
ixpk= 2634, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
igr1=1413, 809,
igr2=1415,1416,1417, 811, 812, 813,
&end
#
# 0 AMB 20-2:2635 87 ALA MB 5.50 (# 2635:20 Single Ambig)
&rst
ixpk= 2635, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
igr1=1550,1551,1344,1345,
igr2=1268,1269,1270,
&end
#
# 0 AMB 20-2:2682 49 ILE MG2 6.00 (# 2682:20 Single Ambig)
&rst
ixpk= 2682, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
igr1= 686, 679,
igr2= 692, 693, 694,
&end
#
# 0 AMB 20-2:2693 0 AMB 20-1:2693 4.20 (# 2693:20 Double Ambig)
&rst
ixpk= 2693, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.80, r4= 7.30,
igr1=1910,1321,1322,
igr2=1914,1915,1916,1306,1307,1308,
&end
#
# 0 AMB 20-2:2697 59 ALA MB 4.50 (# 2697:20 Single Ambig)
&rst
ixpk= 2697, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
igr1= 843, 836,
igr2= 847, 848, 849,
&end
#
# 0 AMB 20-2:2724 53 ILE MD1 5.20 (# 2724:20 Single Ambig)
&rst
ixpk= 2724, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.01, r4= 7.51,
igr1= 78, 766,
igr2= 777, 778, 779,
&end
#
# 0 AMB 20-2:2771 11 THR HB 6.50 (# 2771:20 Single Ambig)
&rst
ixpk= 2771, nxpk= 20, iat= -1, 147, r1= 1.30, r2= 1.80, r3= 8.19, r4= 8.69,
igr1= 136, 137, 136, 137,
&end
#
# 0 AMB 20-2:2776 3 ASP HA 5.50 (# 2776:20 Single Ambig)
&rst
ixpk= 2776, nxpk= 20, iat= -1, 33, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 23, 681, 682,
&end
#
# 50 TRP HE1 0 AMB 20-1:2814 5.50 (# 2814:20 Single Ambig)
&rst
ixpk= 2814, nxpk= 20, iat= 715, -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
igr2= 68, 69, 70,1166,1167,1168,1170,1171,1172,
&end
#
# 0 AMB 20-2:2819 0 AMB 20-1:2819 2.80 (# 2819:20 Double Ambig)
&rst
ixpk= 2819, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
igr1= 95,1484,1485,1486,
igr2= 78,1328,
&end
#
# 0 AMB 20-2:2825 6 LEU HG 5.50 (# 2825:20 Single Ambig)
&rst
ixpk= 2825, nxpk= 20, iat= -1, 83, r1= 1.30, r2= 1.80, r3= 7.61, r4= 8.11,
igr1= 298, 299, 733, 734, 466, 467, 468,
&end
#
# 0 AMB 20-2:2841 7 ILE HA 4.00 (# 2841:20 Single Ambig)
&rst
ixpk= 2841, nxpk= 20, iat= -1, 97, r1= 1.30, r2= 1.80, r3= 5.39, r4= 5.89,
igr1= 539, 95, 547, 548, 547, 548,
&end
#
# 0 AMB 20-2:2865 7 ILE MD1 5.00 (# 2865:20 Single Ambig)
&rst
ixpk= 2865, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.09, r4= 8.59,
igr1= 987, 985, 989, 95,1247,1251,
igr2= 108, 109, 110,
&end
#
# 0 AMB 20-2:2870 7 ILE MG2 5.00 (# 2870:20 Single Ambig)
&rst
ixpk= 2870, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.57, r4= 8.07,
igr1= 985, 989, 987, 539,
igr2= 101, 102, 103,
&end
#
# 19 ALA MB 0 AMB 20-1:2872 4.20 (# 2872:20 Single Ambig)
&rst
ixpk= 2872, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.35, r4= 6.85,
igr1= 256, 257, 258,
igr2= 118, 119, 118, 119,
&end
#
# 8 SER HA 0 AMB 20-1:2873 3.50 (# 2873:20 Single Ambig)
&rst
ixpk= 2873, nxpk= 20, iat= 116, -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
igr2= 118, 119, 118, 119,
&end
#
# 8 SER HN 0 AMB 20-1:2874 3.50 (# 2874:20 Single Ambig)
&rst
ixpk= 2874, nxpk= 20, iat= 114, -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
igr2= 118, 119, 118, 119,
&end
#
# 0 AMB 20-2:2896 40 LEU HB- 3.50 (# 2896:20 Single Ambig)
&rst
ixpk= 2896, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
igr1= 562, 615,
igr2= 564, 565,
&end
#
# 0 AMB 20-2:2931 0 AMB 20-1:2931 4.20 (# 2931:20 Double Ambig)
&rst
ixpk= 2931, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
igr1=1633,1634,1633,1634,
igr2=1628,1629,1628,1629,
&end
#
# 0 AMB 20-2:2932 18 VAL HA 5.50 (# 2932:20 Single Ambig)
&rst
ixpk= 2932, nxpk= 20, iat= -1, 238, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
igr1= 301, 266, 267, 266, 267,
&end
#
# 0 AMB 20-2:2940 0 AMB 20-1:2940 4.50 (# 2940:20 Double Ambig)
&rst
ixpk= 2940, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
igr1= 962, 963, 296,
igr2= 968, 969, 342, 343,
&end
#
# 0 AMB 20-2:2941 0 AMB 20-1:2941 3.50 (# 2941:20 Double Ambig)
&rst
ixpk= 2941, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
igr1= 238, 962, 963,
igr2= 240, 968, 969,
&end
#
# 0 AMB 20-2:2942 0 AMB 20-1:2942 6.50 (# 2942:20 Double Ambig)
&rst
ixpk= 2942, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3=11.81, r4=12.31,
igr1=1099,1100,1999,2000, 330, 331,
igr2=1081,1082, 342, 343, 342, 343,
&end
#
# 0 AMB 20-2:2943 0 AMB 20-1:2943 4.50 (# 2943:20 Double Ambig)
&rst
ixpk= 2943, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
igr1= 348, 349, 164,
igr2= 342, 343, 968, 969,
&end
#
# 0 AMB 20-2:2951 18 VAL MGY 3.20 (# 2951:20 Single Ambig)
&rst
ixpk= 2951, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
igr1= 240, 301,
igr2= 242, 243, 244, 246, 247, 248,
&end
#
# 0 AMB 20-2:2968 0 AMB 20-1:2968 4.50 (# 2968:20 Double Ambig)
&rst
ixpk= 2968, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
igr1= 379,1423, 294,
igr2= 325,1445, 264,
&end
#
# 20 GLU HA 0 AMB 20-1:2970 3.50 (# 2970:20 Single Ambig)
&rst
ixpk= 2970, nxpk= 20, iat= 264, -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
igr2= 266, 267, 266, 267,
&end
#
# 0 AMB 20-2:2980 0 AMB 20-1:2980 3.20 (# 2980:20 Double Ambig)
&rst
ixpk= 2980, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.70, r4= 5.20,
igr1=2053,2050,2051, 342, 343,
igr2=2048, 296,
&end
#
# 0 AMB 20-2:2983 0 AMB 20-1:2983 3.20 (# 2983:20 Double Ambig)
&rst
ixpk= 2983, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.31, r4= 4.81,
igr1= 301,2050,2051,
igr2= 296,2048,
&end
#
# 0 AMB 20-2:2984 22 LEU HG 4.00 (# 2984:20 Single Ambig)
&rst
ixpk= 2984, nxpk= 20, iat= -1, 301, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,
igr1=1802,1803,1804, 303, 304, 305, 307, 308, 309,
&end
#
# 0 AMB 20-2:2994 0 AMB 20-1:2994 3.50 (# 2994:20 Double Ambig)
&rst
ixpk= 2994, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr1= 269, 270, 330, 331,
igr2= 264, 325,
&end
#
# 0 AMB 20-2:2998 0 AMB 20-1:2998 4.20 (# 2998:20 Double Ambig)
&rst
ixpk= 2998, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.80, r4= 7.30,
igr1=1368,1369,1096,1097, 342, 343,
igr2=1363,1094, 340,
&end
#
# 0 AMB 20-2:3001 0 AMB 20-1:3001 5.00 (# 3001:20 Double Ambig)
&rst
ixpk= 3001, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,
igr1= 296,1994,
igr2= 342, 343, 342, 343,
&end
#
# 0 AMB 20-2:3007 0 AMB 20-1:3007 6.20 (# 3007:20 Double Ambig)
&rst
ixpk= 3007, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.94, r4= 9.44,
igr1= 962, 963, 296,
igr2= 164, 348, 349,
&end
#
# 0 AMB 20-2:3008 0 AMB 20-1:3008 5.00 (# 3008:20 Double Ambig)
&rst
ixpk= 3008, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.09, r4= 9.59,
igr1= 327, 328, 398, 399,1996,1997,
igr2= 348, 349, 348, 349, 348, 349,
&end
#
# 0 AMB 20-2:3010 0 AMB 20-1:3010 4.20 (# 3010:20 Double Ambig)
&rst
ixpk= 3010, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
igr1=2182,2183, 345, 346,
igr2=2188,2189, 351, 352,
&end
#
# 0 AMB 20-2:3011 0 AMB 20-1:3011 6.50 (# 3011:20 Double Ambig)
&rst
ixpk= 3011, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 9.54, r4=10.04,
igr1= 564, 565,1119,1120, 586,
igr2= 600,1079,
&end
#
# 0 AMB 20-2:3019 26 LEU HG 5.50 (# 3019:20 Single Ambig)
&rst
ixpk= 3019, nxpk= 20, iat= -1, 367, r1= 1.30, r2= 1.80, r3= 7.61, r4= 8.11,
igr1= 736,2055,2056,2057,2059,2060,2061,
&end
#
# 0 AMB 20-2:3023 26 LEU HG 5.00 (# 3023:20 Single Ambig)
&rst
ixpk= 3023, nxpk= 20, iat= -1, 367, r1= 1.30, r2= 1.80, r3= 5.61, r4= 6.11,
igr1= 360, 313,
&end
#
# 0 AMB 20-2:3024 0 AMB 20-1:3024 6.50 (# 3024:20 Double Ambig)
&rst
ixpk= 3024, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.76, r4= 9.26,
igr1=1157, 379,
igr2=1135,1136, 367,
&end
#
# 0 AMB 20-2:3032 27 GLU HB- 3.50 (# 3032:20 Single Ambig)
&rst
ixpk= 3032, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
igr1= 386, 387, 386, 387,
igr2= 383, 384,
&end
#
# 0 AMB 20-2:3037 0 AMB 20-1:3037 3.00 (# 3037:20 Double Ambig)
&rst
ixpk= 3037, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
igr1= 396, 340,
igr2= 398, 399, 398, 399,
&end
#
# 0 AMB 20-2:3048 29 ALA MB 6.00 (# 3048:20 Single Ambig)
&rst
ixpk= 3048, nxpk= 20, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.65, r4= 9.15,
igr1=2111, 398, 399,
igr2= 413, 414, 415,
&end
#
# 33 THR QG2 33 THR HB 3.00 (# 0.9873 0:20 2.23,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 464, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
rk2=80.0, rk3=80.0, ir6=1, ialtd=0,
igr1= 466, 467, 468,
&end
#
# 56 THR QG2 56 THR HB 3.00 (# 0.0000 2:20 2.24,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 809, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr1= 811, 812, 813,
&end
#
# 32 THR QG2 32 THR HB 3.00 (# 0.9992 3:20 2.38,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 450, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr1= 452, 453, 454,
&end
#
# 117 THR QG2 117 THR HB 3.00 (# 0.9958 4:20 2.29,)
&rst
ixpk= 0, nxpk= 0, iat= -1,1709, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr1=1711,1712,1713,
&end
#
# 97 THR QG2 97 THR HB 3.00 (# 0.0000 5:20 2.23,)
&rst
ixpk= 0, nxpk= 0, iat= -1,1413, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr1=1415,1416,1417,
&end
#
# 5 THR QG2 5 THR HB 4.00 (# 0.9669 6:20 2.23,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 66, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1= 68, 69, 70,
&end
#
# 11 THR QG2 11 THR HB 3.00 (# 0.0000 7:20 2.23,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 147, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr1= 149, 150, 151,
&end
#
# 120 THR QG2 120 THR HB 3.00 (# 0.9753 8:20 2.23,)
&rst
ixpk= 0, nxpk= 0, iat= -1,1745, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr1=1747,1748,1749,
&end
#
# 35 THR QG2 35 THR HB 3.00 (# 0.9832 9:20 2.23,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 493, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr1= 495, 496, 497,
&end
#
# 18 VAL QG1 18 VAL HA 3.80 (# 0.0000 10:20 1.99,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 238, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
igr1= 242, 243, 244,
&end
#
# 18 VAL QG2 18 VAL HA 3.80 (# 0.9963 11:20 1.99,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 238, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
igr1= 246, 247, 248,
&end
#
# 68 PRO HB2 68 PRO HA 2.80 (# 0.9501 12:20 2.30,)
&rst
ixpk= 0, nxpk= 0, iat= 968, 971, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30, &end
#
# 143 VAL HB 143 VAL HA 3.50 (# 0.0000 19:20 2.98,)
&rst
ixpk= 0, nxpk= 0, iat=2111,2109, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 80 LEU HG 112 SER HB2 5.50 (# 0.9476 28:20 3.42,)
&rst
ixpk= 0, nxpk= 0, iat=1164,1642, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 87 ALA QB 120 THR HA 4.20 (# 0.9663 35:20 2.46,)
&rst
ixpk= 0, nxpk= 0, iat= -1,1743, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr1=1268,1269,1270,
&end
#
# 131 PRO HB3 131 PRO HA 2.80 (# 0.0000 37:20 2.30,)
&rst
ixpk= 0, nxpk= 0, iat=1935,1937, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30, &end
#
# 39 PRO HB2 39 PRO HA 3.00 (# 0.9990 39:20 2.30,)
&rst
ixpk= 0, nxpk= 0, iat= 553, 556, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 11 THR QG2 11 THR HA 4.00 (# 0.0000 40:20 1.99,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 145, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1= 149, 150, 151,
&end
#
# 142 TRP HB3 142 TRP HA 3.00 (# 0.9793 42:20 2.29,)
&rst
ixpk= 0, nxpk= 0, iat=2088,2085, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 78 PRO HB2 78 PRO HA 3.00 (# 0.9980 46:20 2.30,)
&rst
ixpk= 0, nxpk= 0, iat=1138,1141, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 78 PRO HB3 78 PRO HA 3.00 (# 0.9747 47:20 2.30,)
&rst
ixpk= 0, nxpk= 0, iat=1139,1141, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 83 VAL QG2 83 VAL HA 4.00 (# 0.0000 51:20 2.36,)
&rst
ixpk= 0, nxpk= 0, iat= -1,1199, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1=1207,1208,1209,
&end
#
# 83 VAL HB 83 VAL HA 3.00 (# 0.9658 52:20 2.36,)
&rst
ixpk= 0, nxpk= 0, iat=1201,1199, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 83 VAL QG1 83 VAL HA 4.00 (# 0.0000 54:20 2.36,)
&rst
ixpk= 0, nxpk= 0, iat= -1,1199, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1=1203,1204,1205,
&end
#
# 7 ILE HB 52 VAL HA 3.00 (# 0.9668 55:20 2.13,)
&rst
ixpk= 0, nxpk= 0, iat= 99, 750, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 52 VAL QG2 52 VAL HA 4.00 (# 0.9909 57:20 2.39,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 750, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1= 758, 759, 760,
&end
#
# 141 SER HB3 138 TRP HA 4.00 (# 0.9393 58:20 2.93,)
&rst
ixpk= 0, nxpk= 0, iat=2077,2024, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 138 TRP HB2 138 TRP HA 3.20 (# 0.0000 59:20 2.74,)
&rst
ixpk= 0, nxpk= 0, iat=2026,2024, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 70 TYR HB3 70 TYR HA 3.00 (# 0.0000 65:20 2.24,)
&rst
ixpk= 0, nxpk= 0, iat=1000, 997, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 97 THR HB 97 THR HA 3.00 (# 0.9981 66:20 2.37,)
&rst
ixpk= 0, nxpk= 0, iat=1413,1411, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 72 ALA QB 69 PHE HA 4.20 (# 0.9935 68:20 2.77,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 977, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr1=1035,1036,1037,
&end
#
# 70 TYR HB2 70 TYR HA 3.00 (# 0.9507 69:20 2.24,)
&rst
ixpk= 0, nxpk= 0, iat= 999, 997, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 69 PHE HB2 69 PHE HA 3.20 (# 0.9923 70:20 2.43,)
&rst
ixpk= 0, nxpk= 0, iat= 979, 977, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 69 PHE HB3 69 PHE HA 3.50 (# 0.9934 71:20 2.43,)
&rst
ixpk= 0, nxpk= 0, iat= 980, 977, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 123 ILE QG2 123 ILE HA 3.20 (# 0.9766 74:20 2.01,)
&rst
ixpk= 0, nxpk= 0, iat= -1,1798, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
igr1=1802,1803,1804,
&end
#
# 136 GLU HG2 136 GLU HA 4.00 (# 0.0000 75:20 2.08,)
&rst
ixpk= 0, nxpk= 0, iat=1999,1994, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 136 GLU HB2 136 GLU HA 3.00 (# 0.0000 76:20 2.37,)
&rst
ixpk= 0, nxpk= 0, iat=1996,1994, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 7 ILE QG2 7 ILE HA 3.50 (# 0.0000 77:20 2.10,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 97, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
igr1= 101, 102, 103,
&end
#
# 110 LYS HG2 110 LYS HA 3.20 (# 0.9580 82:20 2.69,)
&rst
ixpk= 0, nxpk= 0, iat=1609,1604, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 109 LEU QD2 106 GLU HA 5.00 (# 0.0000 83:20 2.34,)
&rst
ixpk= 0, nxpk= 0, iat= -1,1545, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr1=1596,1597,1598,
&end
#
# 109 LEU HB2 106 GLU HA 3.50 (# 0.9906 85:20 2.12,)
&rst
ixpk= 0, nxpk= 0, iat=1587,1545, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 106 GLU HG2 106 GLU HA 3.50 (# 0.0000 86:20 2.21,)
&rst
ixpk= 0, nxpk= 0, iat=1550,1545, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 88 ILE QG2 88 ILE HA 3.50 (# 0.9856 89:20 2.36,)
&rst
ixpk= 0, nxpk= 0, iat= -1,1276, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
igr1=1280,1281,1282,
&end
#
# 104 LYS HB2 104 LYS HA 3.20 (# 0.9970 90:20 2.41,)
&rst
ixpk= 0, nxpk= 0, iat=1506,1504, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 107 ALA QB 104 LYS HA 3.50 (# 0.9996 91:20 2.06,)
&rst
ixpk= 0, nxpk= 0, iat= -1,1504, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
igr1=1562,1563,1564,
&end
#
# 104 LYS HG3 104 LYS HA 3.50 (# 0.9993 95:20 2.36,)
&rst
ixpk= 0, nxpk= 0, iat=1510,1504, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 137 GLU HB2 137 GLU HA 3.20 (# 0.9989 99:20 2.56,)
&rst
ixpk= 0, nxpk= 0, iat=2011,2009, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 121 LEU HB2 88 ILE HA 3.50 (# 0.9673 101:20 1.97,)
&rst
ixpk= 0, nxpk= 0, iat=1759,1276, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 71 GLU HG2 71 GLU HA 3.50 (# 0.0000 102:20 2.12,)
&rst
ixpk= 0, nxpk= 0, iat=1023,1018, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 28 GLU HG2 28 GLU HA 4.00 (# 0.9994 103:20 2.46,)
&rst
ixpk= 0, nxpk= 0, iat= 401, 396, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 28 GLU HB3 28 GLU HA 3.20 (# 0.9963 104:20 2.37,)
&rst
ixpk= 0, nxpk= 0, iat= 399, 396, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 71 GLU HG3 71 GLU HA 3.50 (# 0.9978 105:20 2.12,)
&rst
ixpk= 0, nxpk= 0, iat=1024,1018, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 21 HIS HB2 21 HIS HA 3.20 (# 0.0000 107:20 2.38,)
&rst
ixpk= 0, nxpk= 0, iat= 281, 279, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 21 HIS HB3 21 HIS HA 3.20 (# 0.0000 108:20 2.38,)
&rst
ixpk= 0, nxpk= 0, iat= 282, 279, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 105 LEU HG 105 LEU HA 4.00 (# 0.8206 110:20 3.65,)
&rst
ixpk= 0, nxpk= 0, iat=1531,1526, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 41 LEU HB2 41 LEU HA 3.20 (# 0.9954 114:20 2.70,)
&rst
ixpk= 0, nxpk= 0, iat= 583, 581, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 41 LEU HG 41 LEU HA 2.80 (# 0.9903 115:20 2.12,)
&rst
ixpk= 0, nxpk= 0, iat= 586, 581, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30, &end
#
# 109 LEU QD1 109 LEU HA 4.00 (# 0.9892 119:20 1.98,)
&rst
ixpk= 0, nxpk= 0, iat= -1,1585, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1=1592,1593,1594,
&end
#
# 109 LEU HB3 109 LEU HA 3.00 (# 0.0000 120:20 2.49,)
&rst
ixpk= 0, nxpk= 0, iat=1588,1585, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 130 ILE QG2 130 ILE HA 4.00 (# 0.0000 121:20 2.73,)
&rst
ixpk= 0, nxpk= 0, iat= -1,1910, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1=1914,1915,1916,
&end
#
# 130 ILE HB 130 ILE HA 3.50 (# 0.0000 123:20 2.97,)
&rst
ixpk= 0, nxpk= 0, iat=1912,1910, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 147 LYS HG2 147 LYS HA 3.00 (# 0.9845 124:20 2.12,)
&rst
ixpk= 0, nxpk= 0, iat=2182,2177, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 73 LEU HB3 73 LEU HA 3.20 (# 0.0000 127:20 2.52,)
&rst
ixpk= 0, nxpk= 0, iat=1046,1043, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 146 LEU HG 147 LYS HA 4.50 (# 0.0000 132:20 3.00,)
&rst
ixpk= 0, nxpk= 0, iat=2163,2177, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 73 LEU QD1 73 LEU HA 4.20 (# 0.0000 135:20 2.00,)
&rst
ixpk= 0, nxpk= 0, iat= -1,1043, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr1=1050,1051,1052,
&end
#
# 147 LYS HB3 147 LYS HA 3.20 (# 0.0000 138:20 2.67,)
&rst
ixpk= 0, nxpk= 0, iat=2180,2177, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 108 GLU HB2 108 GLU HA 3.00 (# 0.9808 139:20 2.46,)
&rst
ixpk= 0, nxpk= 0, iat=1572,1570, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 3 ASP HB2 3 ASP HA 3.20 (# 0.0000 143:20 2.70,)
&rst
ixpk= 0, nxpk= 0, iat= 35, 33, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 3 ASP HB3 3 ASP HA 3.20 (# 0.0000 144:20 2.70,)
&rst
ixpk= 0, nxpk= 0, iat= 36, 33, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 25 LYS HB3 25 LYS HA 3.00 (# 0.9988 148:20 2.37,)
&rst
ixpk= 0, nxpk= 0, iat= 343, 340, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 94 GLU HG3 94 GLU HA 4.00 (# 0.9938 149:20 2.06,)
&rst
ixpk= 0, nxpk= 0, iat=1369,1363, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 25 LYS HD2 25 LYS HA 3.50 (# 0.0000 153:20 2.15,)
&rst
ixpk= 0, nxpk= 0, iat= 348, 340, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 94 GLU HB2 94 GLU HA 3.00 (# 0.9933 154:20 2.29,)
&rst
ixpk= 0, nxpk= 0, iat=1365,1363, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 76 GLN HB2 76 GLN HA 3.00 (# 0.9699 155:20 2.35,)
&rst
ixpk= 0, nxpk= 0, iat=1096,1094, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 78 PRO HD2 77 LYS HA 3.00 (# 0.9294 162:20 2.00,)
&rst
ixpk= 0, nxpk= 0, iat=1132,1111, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 77 LYS HB2 77 LYS HA 3.00 (# 0.9837 163:20 2.40,)
&rst
ixpk= 0, nxpk= 0, iat=1113,1111, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 77 LYS HG2 77 LYS HA 3.50 (# 0.9984 164:20 2.24,)
&rst
ixpk= 0, nxpk= 0, iat=1116,1111, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 23 ALA QB 23 ALA HA 3.00 (# 0.0000 165:20 2.28,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 315, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr1= 317, 318, 319,
&end
#
# 26 LEU HB2 23 ALA HA 4.00 (# 0.9924 168:20 2.43,)
&rst
ixpk= 0, nxpk= 0, iat= 364, 315, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 34 GLU HG3 34 GLU HA 3.20 (# 0.9995 169:20 2.02,)
&rst
ixpk= 0, nxpk= 0, iat= 482, 476, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 34 GLU HB2 34 GLU HA 3.20 (# 0.9865 170:20 2.61,)
&rst
ixpk= 0, nxpk= 0, iat= 478, 476, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 116 GLN HG3 116 GLN HA 3.20 (# 0.9690 173:20 2.39,)
&rst
ixpk= 0, nxpk= 0, iat=1696,1690, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 116 GLN HB2 116 GLN HA 3.00 (# 0.9292 178:20 2.46,)
&rst
ixpk= 0, nxpk= 0, iat=1692,1690, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 116 GLN HB3 116 GLN HA 3.00 (# 0.9993 179:20 2.46,)
&rst
ixpk= 0, nxpk= 0, iat=1693,1690, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 145 LEU HB3 145 LEU HA 3.20 (# 0.9694 180:20 2.60,)
&rst
ixpk= 0, nxpk= 0, iat=2142,2139, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 145 LEU HB2 145 LEU HA 3.20 (# 0.0000 181:20 2.60,)
&rst
ixpk= 0, nxpk= 0, iat=2141,2139, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 19 ALA QB 19 ALA HA 3.00 (# 0.9716 182:20 2.22,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 254, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr1= 256, 257, 258,
&end
#
# 146 LEU HB2 146 LEU HA 2.80 (# 0.0000 185:20 2.22,)
&rst
ixpk= 0, nxpk= 0, iat=2160,2158, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30, &end
#
# 147 LYS HD2 144 ASN HA 3.50 (# 0.9963 187:20 1.91,)
&rst
ixpk= 0, nxpk= 0, iat=2185,2125, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 146 LEU HB3 146 LEU HA 2.80 (# 0.9979 189:20 2.22,)
&rst
ixpk= 0, nxpk= 0, iat=2161,2158, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30, &end
#
# 146 LEU HG 146 LEU HA 4.00 (# 0.9073 190:20 2.88,)
&rst
ixpk= 0, nxpk= 0, iat=2163,2158, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 12 LEU HB2 12 LEU HA 3.20 (# 0.9966 192:20 2.49,)
&rst
ixpk= 0, nxpk= 0, iat= 161, 159, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 72 ALA QB 72 ALA HA 3.00 (# 0.0000 195:20 2.30,)
&rst
ixpk= 0, nxpk= 0, iat= -1,1033, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr1=1035,1036,1037,
&end
#
# 65 ASN HB2 65 ASN HA 3.00 (# 0.0000 201:20 2.39,)
&rst
ixpk= 0, nxpk= 0, iat= 921, 919, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 65 ASN HB3 65 ASN HA 3.00 (# 0.9871 202:20 2.39,)
&rst
ixpk= 0, nxpk= 0, iat= 922, 919, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 121 LEU HG 121 LEU HA 2.80 (# 0.9888 207:20 2.23,)
&rst
ixpk= 0, nxpk= 0, iat=1762,1757, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30, &end
#
# 40 LEU HB3 40 LEU HA 3.20 (# 0.9911 210:20 2.44,)
&rst
ixpk= 0, nxpk= 0, iat= 565, 562, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 36 LEU HG 36 LEU HA 3.80 (# 0.9549 212:20 2.84,)
&rst
ixpk= 0, nxpk= 0, iat= 510, 505, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30, &end
#
# 36 LEU HB3 36 LEU HA 2.80 (# 0.0000 213:20 2.21,)
&rst
ixpk= 0, nxpk= 0, iat= 508, 505, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30, &end
#
# 40 LEU HB2 40 LEU HA 3.20 (# 0.9955 215:20 2.44,)
&rst
ixpk= 0, nxpk= 0, iat= 564, 562, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 59 ALA QB 59 ALA HA 3.00 (# 0.0000 217:20 2.22,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 845, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr1= 847, 848, 849,
&end
#
# 44 LEU QD1 44 LEU HA 4.00 (# 0.0000 220:20 1.99,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 627, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1= 634, 635, 636,
&end
#
# 45 PRO HD2 44 LEU HA 3.00 (# 0.9992 221:20 2.32,)
&rst
ixpk= 0, nxpk= 0, iat= 645, 627, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 45 PRO HD3 44 LEU HA 3.00 (# 0.0000 222:20 2.32,)
&rst
ixpk= 0, nxpk= 0, iat= 646, 627, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 46 ALA QB 46 ALA HA 3.00 (# 0.9740 224:20 2.26,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 660, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr1= 662, 663, 664,
&end
#
# 2 ALA QB 2 ALA HA 3.00 (# 0.9986 230:20 2.22,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 23, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr1= 25, 26, 27,
&end
#
# 130 ILE QG2 131 PRO HD3 4.00 (# 0.9945 233:20 1.94,)
&rst
ixpk= 0, nxpk= 0, iat= -1,1929, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1=1914,1915,1916,
&end
#
# 130 ILE HB 131 PRO HD2 2.80 (# 0.0000 234:20 1.81,)
&rst
ixpk= 0, nxpk= 0, iat=1912,1928, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30, &end
#
# 76 GLN HB2 78 PRO HD3 5.00 (# 0.9921 236:20 2.11,)
&rst
ixpk= 0, nxpk= 0, iat=1096,1133, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 44 LEU HB2 45 PRO HD2 3.50 (# 0.9457 242:20 1.80,)
&rst
ixpk= 0, nxpk= 0, iat= 629, 645, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 68 PRO HG2 68 PRO HD2 3.00 (# 0.9965 243:20 2.30,)
&rst
ixpk= 0, nxpk= 0, iat= 965, 962, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 44 LEU HB3 45 PRO HD2 3.50 (# 0.9992 246:20 1.80,)
&rst
ixpk= 0, nxpk= 0, iat= 630, 645, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 45 PRO HG3 45 PRO HD3 3.00 (# 0.0000 250:20 2.30,)
&rst
ixpk= 0, nxpk= 0, iat= 649, 646, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 45 PRO HG3 45 PRO HD2 3.00 (# 0.0000 251:20 2.30,)
&rst
ixpk= 0, nxpk= 0, iat= 649, 645, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 44 LEU HB3 45 PRO HD3 4.00 (# 0.0000 252:20 1.80,)
&rst
ixpk= 0, nxpk= 0, iat= 630, 646, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 51 LEU QD1 51 LEU HB2 4.00 (# 0.9976 294:20 2.19,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 733, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1= 738, 739, 740,
&end
#
# 36 LEU QD1 36 LEU HB2 3.50 (# 0.9982 299:20 1.99,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 507, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
igr1= 512, 513, 514,
&end
#
# 36 LEU HG 36 LEU HB2 3.20 (# 0.9710 300:20 2.62,)
&rst
ixpk= 0, nxpk= 0, iat= 510, 507, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 36 LEU HG 36 LEU HB3 3.20 (# 0.9766 303:20 2.62,)
&rst
ixpk= 0, nxpk= 0, iat= 510, 508, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 139 LEU QD2 139 LEU HB2 4.00 (# 0.9412 310:20 2.09,)
&rst
ixpk= 0, nxpk= 0, iat= -1,2050, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1=2059,2060,2061,
&end
#
# 146 LEU HA 146 LEU HB2 3.00 (# 0.0000 311:20 2.22,)
&rst
ixpk= 0, nxpk= 0, iat=2158,2160, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 146 LEU HA 146 LEU HB2 3.00 (# 0.0000 312:20 2.22,)
&rst
ixpk= 0, nxpk= 0, iat=2158,2160, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 146 LEU QD2 146 LEU HB3 3.80 (# 0.0000 313:20 1.99,)
&rst
ixpk= 0, nxpk= 0, iat= -1,2161, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
igr1=2169,2170,2171,
&end
#
# 115 LYS HG2 115 LYS HE2 3.50 (# 0.0000 317:20 2.00,)
&rst
ixpk= 0, nxpk= 0, iat=1673,1679, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 77 LYS HG3 77 LYS HE2 3.50 (# 0.9995 318:20 2.03,)
&rst
ixpk= 0, nxpk= 0, iat=1117,1122, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 147 LYS HD2 147 LYS HE2 3.00 (# 0.9991 323:20 2.27,)
&rst
ixpk= 0, nxpk= 0, iat=2185,2188, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 105 LEU QD1 105 LEU HB2 4.00 (# 0.9328 328:20 2.15,)
&rst
ixpk= 0, nxpk= 0, iat= -1,1528, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1=1533,1534,1535,
&end
#
# 105 LEU HA 105 LEU HB3 3.20 (# 0.9114 330:20 2.42,)
&rst
ixpk= 0, nxpk= 0, iat=1526,1529, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 147 LYS HG3 147 LYS HE2 4.00 (# 0.0000 333:20 2.07,)
&rst
ixpk= 0, nxpk= 0, iat=2183,2188, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 6 LEU HG 6 LEU HB3 3.00 (# 0.9962 336:20 2.36,)
&rst
ixpk= 0, nxpk= 0, iat= 83, 81, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 105 LEU QD2 105 LEU HB3 4.00 (# 0.9986 337:20 2.15,)
&rst
ixpk= 0, nxpk= 0, iat= -1,1529, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1=1537,1538,1539,
&end
#
# 25 LYS HD2 25 LYS HE2 3.20 (# 0.9906 339:20 2.22,)
&rst
ixpk= 0, nxpk= 0, iat= 348, 351, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 25 LYS HD2 25 LYS HE3 3.20 (# 0.9996 340:20 2.22,)
&rst
ixpk= 0, nxpk= 0, iat= 348, 352, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 73 LEU QD2 73 LEU HB2 3.80 (# 0.0000 344:20 2.24,)
&rst
ixpk= 0, nxpk= 0, iat= -1,1045, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
igr1=1054,1055,1056,
&end
#
# 41 LEU QD1 41 LEU HB3 3.80 (# 0.9837 346:20 1.96,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 584, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
igr1= 588, 589, 590,
&end
#
# 73 LEU QD2 73 LEU HB3 3.80 (# 0.0000 351:20 2.24,)
&rst
ixpk= 0, nxpk= 0, iat= -1,1046, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
igr1=1054,1055,1056,
&end
#
# 73 LEU QD1 73 LEU HB3 3.80 (# 0.0000 353:20 2.24,)
&rst
ixpk= 0, nxpk= 0, iat= -1,1046, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
igr1=1050,1051,1052,
&end
#
# 41 LEU QD2 41 LEU HB3 3.50 (# 0.9926 365:20 1.96,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 584, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
igr1= 592, 593, 594,
&end
#
# 88 ILE QG2 88 ILE HB 3.00 (# 0.9987 367:20 2.22,)
&rst
ixpk= 0, nxpk= 0, iat= -1,1278, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr1=1280,1281,1282,
&end
#
# 44 LEU QD2 44 LEU HB3 4.00 (# 0.9913 368:20 2.36,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 630, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1= 638, 639, 640,
&end
#
# 26 LEU QD2 26 LEU HB2 4.00 (# 0.9639 372:20 1.95,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 364, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1= 373, 374, 375,
&end
#
# 88 ILE QG2 88 ILE HB 3.00 (# 0.9987 374:20 2.22,)
&rst
ixpk= 0, nxpk= 0, iat= -1,1278, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr1=1280,1281,1282,
&end
#
# 90 ILE QG2 90 ILE HB 3.00 (# 0.9468 377:20 2.22,)
&rst
ixpk= 0, nxpk= 0, iat= -1,1304, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr1=1306,1307,1308,
&end
#
# 109 LEU HG 109 LEU HB2 3.00 (# 0.0000 378:20 2.31,)
&rst
ixpk= 0, nxpk= 0, iat=1590,1587, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 109 LEU QD2 109 LEU HB2 3.50 (# 0.0000 379:20 2.10,)
&rst
ixpk= 0, nxpk= 0, iat= -1,1587, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
igr1=1596,1597,1598,
&end
#
# 109 LEU QD2 109 LEU HB3 3.80 (# 0.0000 383:20 2.10,)
&rst
ixpk= 0, nxpk= 0, iat= -1,1588, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
igr1=1596,1597,1598,
&end
#
# 53 ILE HG12 53 ILE HB 3.20 (# 0.9536 394:20 2.66,)
&rst
ixpk= 0, nxpk= 0, iat= 774, 768, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 80 LEU QD2 80 LEU HB3 4.00 (# 0.0000 403:20 2.10,)
&rst
ixpk= 0, nxpk= 0, iat= -1,1162, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1=1170,1171,1172,
&end
#
# 70 TYR HA 70 TYR HB3 3.00 (# 0.9777 409:20 2.24,)
&rst
ixpk= 0, nxpk= 0, iat= 997,1000, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 130 ILE QG2 130 ILE HB 3.00 (# 0.0000 422:20 2.31,)
&rst
ixpk= 0, nxpk= 0, iat= -1,1912, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr1=1914,1915,1916,
&end
#
# 130 ILE HG12 130 ILE HB 3.00 (# 0.0000 424:20 2.42,)
&rst
ixpk= 0, nxpk= 0, iat=1918,1912, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 20 GLU HA 20 GLU HG2 3.00 (# 0.9916 430:20 2.09,)
&rst
ixpk= 0, nxpk= 0, iat= 264, 269, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 20 GLU HB3 20 GLU HG2 3.00 (# 0.9844 431:20 2.22,)
&rst
ixpk= 0, nxpk= 0, iat= 267, 269, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 71 GLU HA 71 GLU HG3 3.50 (# 0.9875 435:20 2.12,)
&rst
ixpk= 0, nxpk= 0, iat=1018,1024, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 71 GLU HA 71 GLU HG2 3.50 (# 0.9875 436:20 2.12,)
&rst
ixpk= 0, nxpk= 0, iat=1018,1023, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 33 THR QG2 27 GLU HG2 4.00 (# 0.9996 443:20 1.99,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 386, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1= 466, 467, 468,
&end
#
# 73 LEU HB3 108 GLU HG3 4.50 (# 0.9862 451:20 2.86,)
&rst
ixpk= 0, nxpk= 0, iat=1046,1576, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 2 ALA QB 34 GLU HG3 4.00 (# 0.9938 460:20 2.00,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 482, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1= 25, 26, 27,
&end
#
# 2 ALA QB 34 GLU HG2 4.00 (# 0.9952 464:20 2.00,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 481, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1= 25, 26, 27,
&end
#
# 106 GLU HA 106 GLU HG2 3.50 (# 0.9990 466:20 2.21,)
&rst
ixpk= 0, nxpk= 0, iat=1545,1550, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 106 GLU HA 106 GLU HG3 3.50 (# 0.9990 467:20 2.21,)
&rst
ixpk= 0, nxpk= 0, iat=1545,1551, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 122 LYS HG2 122 LYS HB2 3.00 (# 0.9899 468:20 2.21,)
&rst
ixpk= 0, nxpk= 0, iat=1781,1778, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 76 GLN HB2 76 GLN HG2 3.00 (# 0.9974 471:20 2.21,)
&rst
ixpk= 0, nxpk= 0, iat=1096,1099, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 72 ALA HA 76 GLN HG3 6.00 (# 0.0000 473:20 4.53,)
&rst
ixpk= 0, nxpk= 0, iat=1033,1100, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 76 GLN HB2 76 GLN HG3 3.00 (# 0.9655 475:20 2.21,)
&rst
ixpk= 0, nxpk= 0, iat=1096,1100, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 147 LYS HA 147 LYS HB3 3.30 (# 0.0000 483:20 2.67,)
&rst
ixpk= 0, nxpk= 0, iat=2177,2180, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80, &end
#
# 147 LYS HG2 147 LYS HB3 3.00 (# 0.0000 486:20 2.25,)
&rst
ixpk= 0, nxpk= 0, iat=2182,2180, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 34 GLU HG2 34 GLU HB3 3.00 (# 0.0000 488:20 2.21,)
&rst
ixpk= 0, nxpk= 0, iat= 481, 479, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 36 LEU QD2 34 GLU HB3 4.50 (# 0.9986 489:20 1.98,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 479, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr1= 516, 517, 518,
&end
#
# 34 GLU HG2 34 GLU HB2 3.00 (# 0.0000 491:20 2.21,)
&rst
ixpk= 0, nxpk= 0, iat= 481, 478, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 116 GLN HB3 116 GLN HG2 3.00 (# 0.0000 495:20 2.21,)
&rst
ixpk= 0, nxpk= 0, iat=1693,1695, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 52 VAL QG1 52 VAL HB 3.00 (# 0.9474 496:20 2.25,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 752, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr1= 754, 755, 756,
&end
#
# 52 VAL QG2 52 VAL HB 3.00 (# 0.9923 497:20 2.25,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 752, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr1= 758, 759, 760,
&end
#
# 52 VAL QG1 52 VAL HB 3.00 (# 0.9474 498:20 2.25,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 752, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr1= 754, 755, 756,
&end
#
# 104 LYS HA 104 LYS HB2 3.50 (# 0.9982 499:20 2.41,)
&rst
ixpk= 0, nxpk= 0, iat=1504,1506, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 116 GLN HB2 116 GLN HG3 3.20 (# 0.9796 502:20 2.21,)
&rst
ixpk= 0, nxpk= 0, iat=1692,1696, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 122 LYS HG2 131 PRO HB2 4.00 (# 0.9797 513:20 1.94,)
&rst
ixpk= 0, nxpk= 0, iat=1781,1934, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 83 VAL QG1 83 VAL HB 3.00 (# 0.9940 514:20 2.22,)
&rst
ixpk= 0, nxpk= 0, iat= -1,1201, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr1=1203,1204,1205,
&end
#
# 119 GLU HG2 119 GLU HB3 3.00 (# 0.0000 519:20 2.21,)
&rst
ixpk= 0, nxpk= 0, iat=1733,1731, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 83 VAL QG2 83 VAL HB 3.00 (# 0.9950 521:20 2.22,)
&rst
ixpk= 0, nxpk= 0, iat= -1,1201, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr1=1207,1208,1209,
&end
#
# 143 VAL HA 143 VAL HB 3.50 (# 0.0000 527:20 2.98,)
&rst
ixpk= 0, nxpk= 0, iat=2109,2111, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 18 VAL QG2 18 VAL HB 3.00 (# 0.9292 534:20 2.22,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 240, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr1= 246, 247, 248,
&end
#
# 75 GLU HA 75 GLU HB3 3.00 (# 0.9350 538:20 2.25,)
&rst
ixpk= 0, nxpk= 0, iat=1079,1082, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 138 TRP HA 138 TRP HB2 3.20 (# 0.9884 549:20 2.74,)
&rst
ixpk= 0, nxpk= 0, iat=2024,2026, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 121 LEU HG 138 TRP HB2 3.00 (# 0.9984 550:20 2.00,)
&rst
ixpk= 0, nxpk= 0, iat=1762,2026, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 121 LEU HG 138 TRP HB2 3.00 (# 0.9984 551:20 2.00,)
&rst
ixpk= 0, nxpk= 0, iat=1762,2026, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 94 GLU HA 94 GLU HB2 3.00 (# 0.0000 553:20 2.29,)
&rst
ixpk= 0, nxpk= 0, iat=1363,1365, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 106 GLU HA 106 GLU HB2 3.20 (# 0.9980 559:20 2.43,)
&rst
ixpk= 0, nxpk= 0, iat=1545,1547, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 106 GLU HB2 110 LYS HD2 4.00 (# 0.9759 572:20 1.97,)
&rst
ixpk= 0, nxpk= 0, iat=1547,1612, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 24 GLU HG2 24 GLU HB2 3.00 (# 0.9636 574:20 2.21,)
&rst
ixpk= 0, nxpk= 0, iat= 330, 327, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 24 GLU HA 24 GLU HB2 3.00 (# 0.9790 575:20 2.37,)
&rst
ixpk= 0, nxpk= 0, iat= 325, 327, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 147 LYS HE2 147 LYS HD2 3.00 (# 0.9404 577:20 2.27,)
&rst
ixpk= 0, nxpk= 0, iat=2188,2185, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 71 GLU HG2 71 GLU HB2 3.00 (# 0.9982 579:20 2.21,)
&rst
ixpk= 0, nxpk= 0, iat=1023,1020, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 24 GLU HA 24 GLU HB2 3.20 (# 0.9790 584:20 2.37,)
&rst
ixpk= 0, nxpk= 0, iat= 325, 327, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 77 LYS HG3 77 LYS HD3 3.00 (# 0.9893 588:20 2.24,)
&rst
ixpk= 0, nxpk= 0, iat=1117,1120, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 20 GLU HA 20 GLU HB3 3.20 (# 0.9394 589:20 2.50,)
&rst
ixpk= 0, nxpk= 0, iat= 264, 267, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 77 LYS HE2 77 LYS HD2 3.00 (# 0.9876 594:20 2.28,)
&rst
ixpk= 0, nxpk= 0, iat=1122,1119, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 23 ALA HA 6 LEU QD1 5.00 (# 0.9627 595:20 2.71,)
&rst
ixpk= 0, nxpk= 0, iat= 315, -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr2= 85, 86, 87,
&end
#
# 6 LEU HG 6 LEU QD1 3.00 (# 0.9333 597:20 2.21,)
&rst
ixpk= 0, nxpk= 0, iat= 83, -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr2= 85, 86, 87,
&end
#
# 90 ILE QD1 90 ILE HG12 3.00 (# 0.9780 612:20 2.21,)
&rst
ixpk= 0, nxpk= 0, iat= -1,1310, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr1=1313,1314,1315,
&end
#
# 139 LEU HA 142 TRP HB2 4.50 (# 0.9639 613:20 2.43,)
&rst
ixpk= 0, nxpk= 0, iat=2048,2087, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 90 ILE HB 90 ILE HG12 3.00 (# 0.9971 617:20 2.38,)
&rst
ixpk= 0, nxpk= 0, iat=1304,1310, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 142 TRP HA 142 TRP HB2 3.00 (# 0.0000 618:20 2.29,)
&rst
ixpk= 0, nxpk= 0, iat=2085,2087, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 45 PRO HD2 45 PRO HG2 3.00 (# 0.0000 619:20 2.30,)
&rst
ixpk= 0, nxpk= 0, iat= 645, 648, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 139 LEU HA 142 TRP HB3 4.00 (# 0.9639 621:20 2.43,)
&rst
ixpk= 0, nxpk= 0, iat=2048,2088, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 4 ILE QD1 4 ILE HG12 3.00 (# 0.0000 623:20 2.23,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 53, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr1= 56, 57, 58,
&end
#
# 45 PRO HD2 45 PRO HG3 3.00 (# 0.0000 624:20 2.30,)
&rst
ixpk= 0, nxpk= 0, iat= 645, 649, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 45 PRO HD3 45 PRO HG3 3.00 (# 0.0000 625:20 2.30,)
&rst
ixpk= 0, nxpk= 0, iat= 646, 649, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 45 PRO HD3 45 PRO HG2 3.00 (# 0.0000 627:20 2.30,)
&rst
ixpk= 0, nxpk= 0, iat= 646, 648, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 4 ILE QD1 4 ILE HG12 3.00 (# 0.9632 630:20 2.23,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 53, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr1= 56, 57, 58,
&end
#
# 7 ILE QD1 7 ILE HG12 3.00 (# 0.0000 631:20 2.21,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 105, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr1= 108, 109, 110,
&end
#
# 7 ILE QD1 7 ILE HG12 3.00 (# 0.0000 636:20 2.21,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 105, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr1= 108, 109, 110,
&end
#
# 53 ILE HB 53 ILE HG12 3.20 (# 0.9744 639:20 2.66,)
&rst
ixpk= 0, nxpk= 0, iat= 768, 774, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 7 ILE QD1 7 ILE HG12 3.00 (# 0.0000 642:20 2.21,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 105, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr1= 108, 109, 110,
&end
#
# 7 ILE HB 7 ILE HG12 3.10 (# 0.9932 643:20 2.47,)
&rst
ixpk= 0, nxpk= 0, iat= 99, 105, r1= 1.30, r2= 1.80, r3= 3.10, r4= 3.60, &end
#
# 41 LEU QD2 41 LEU HG 3.00 (# 0.9739 647:20 2.22,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 586, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr1= 592, 593, 594,
&end
#
# 36 LEU HB3 36 LEU HG 3.20 (# 0.9598 649:20 2.62,)
&rst
ixpk= 0, nxpk= 0, iat= 508, 510, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 51 LEU QD1 51 LEU HG 3.00 (# 0.9961 650:20 2.21,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 736, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr1= 738, 739, 740,
&end
#
# 78 PRO HB3 78 PRO HG2 3.00 (# 0.9530 656:20 2.32,)
&rst
ixpk= 0, nxpk= 0, iat=1139,1135, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 25 LYS HA 25 LYS HD2 3.50 (# 0.9962 663:20 2.15,)
&rst
ixpk= 0, nxpk= 0, iat= 340, 348, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 25 LYS HG3 25 LYS HD2 3.00 (# 0.9917 665:20 2.41,)
&rst
ixpk= 0, nxpk= 0, iat= 346, 348, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 88 ILE QD1 53 ILE HG12 3.80 (# 0.9995 667:20 1.99,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 774, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
igr1=1287,1288,1289,
&end
#
# 36 LEU HB3 36 LEU HG 3.20 (# 0.9954 668:20 2.62,)
&rst
ixpk= 0, nxpk= 0, iat= 508, 510, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 110 LYS HD2 110 LYS HG2 3.00 (# 0.0000 677:20 2.22,)
&rst
ixpk= 0, nxpk= 0, iat=1612,1609, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 40 LEU HB3 40 LEU HG 3.30 (# 0.9988 682:20 2.61,)
&rst
ixpk= 0, nxpk= 0, iat= 565, 567, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80, &end
#
# 40 LEU QD1 40 LEU HG 3.00 (# 0.0000 683:20 2.22,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 567, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr1= 569, 570, 571,
&end
#
# 40 LEU HB2 40 LEU HG 3.40 (# 0.0000 684:20 2.61,)
&rst
ixpk= 0, nxpk= 0, iat= 564, 567, r1= 1.30, r2= 1.80, r3= 3.40, r4= 3.90, &end
#
# 109 LEU QD1 109 LEU HG 3.00 (# 0.9952 699:20 2.22,)
&rst
ixpk= 0, nxpk= 0, iat= -1,1590, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr1=1592,1593,1594,
&end
#
# 105 LEU HB2 105 LEU QD1 4.00 (# 0.9673 702:20 2.15,)
&rst
ixpk= 0, nxpk= 0, iat=1528, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2=1533,1534,1535,
&end
#
# 109 LEU HG 105 LEU QD1 4.00 (# 0.9624 707:20 1.99,)
&rst
ixpk= 0, nxpk= 0, iat=1590, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2=1533,1534,1535,
&end
#
# 109 LEU QD2 109 LEU HG 3.00 (# 0.0000 709:20 2.22,)
&rst
ixpk= 0, nxpk= 0, iat= -1,1590, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr1=1596,1597,1598,
&end
#
# 44 LEU QD2 44 LEU HG 3.00 (# 0.0000 710:20 2.26,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 632, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr1= 638, 639, 640,
&end
#
# 43 ASP HB2 36 LEU QD1 4.00 (# 0.0000 713:20 1.98,)
&rst
ixpk= 0, nxpk= 0, iat= 617, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2= 512, 513, 514,
&end
#
# 44 LEU HG 44 LEU QD2 3.00 (# 0.0000 715:20 2.26,)
&rst
ixpk= 0, nxpk= 0, iat= 632, -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr2= 638, 639, 640,
&end
#
# 44 LEU HB3 44 LEU QD2 3.80 (# 0.9796 716:20 2.36,)
&rst
ixpk= 0, nxpk= 0, iat= 630, -1, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
igr2= 638, 639, 640,
&end
#
# 104 LYS HB2 104 LYS HG2 3.00 (# 0.0000 718:20 2.21,)
&rst
ixpk= 0, nxpk= 0, iat=1506,1509, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 34 GLU HB2 36 LEU QD1 4.50 (# 0.9609 723:20 1.98,)
&rst
ixpk= 0, nxpk= 0, iat= 478, -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr2= 512, 513, 514,
&end
#
# 36 LEU HB2 36 LEU QD1 3.50 (# 0.9922 724:20 1.99,)
&rst
ixpk= 0, nxpk= 0, iat= 507, -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
igr2= 512, 513, 514,
&end
#
# 36 LEU HB3 36 LEU QD1 3.50 (# 0.0000 725:20 1.99,)
&rst
ixpk= 0, nxpk= 0, iat= 508, -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
igr2= 512, 513, 514,
&end
#
# 44 LEU HB2 44 LEU QD2 4.00 (# 0.9986 728:20 2.36,)
&rst
ixpk= 0, nxpk= 0, iat= 629, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2= 638, 639, 640,
&end
#
# 104 LYS HB2 104 LYS HG2 3.00 (# 0.0000 730:20 2.21,)
&rst
ixpk= 0, nxpk= 0, iat=1506,1509, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 73 LEU QD2 73 LEU HG 3.00 (# 0.0000 736:20 2.23,)
&rst
ixpk= 0, nxpk= 0, iat= -1,1048, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr1=1054,1055,1056,
&end
#
# 105 LEU HG 105 LEU QD1 3.00 (# 0.9765 743:20 2.23,)
&rst
ixpk= 0, nxpk= 0, iat=1531, -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr2=1533,1534,1535,
&end
#
# 41 LEU HB2 41 LEU QD1 4.00 (# 0.9991 746:20 1.96,)
&rst
ixpk= 0, nxpk= 0, iat= 583, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2= 588, 589, 590,
&end
#
# 70 TYR HA 73 LEU QD2 5.00 (# 0.9977 749:20 1.97,)
&rst
ixpk= 0, nxpk= 0, iat= 997, -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr2=1054,1055,1056,
&end
#
# 73 LEU HB2 73 LEU QD2 4.00 (# 0.9852 750:20 2.24,)
&rst
ixpk= 0, nxpk= 0, iat=1045, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2=1054,1055,1056,
&end
#
# 73 LEU HG 73 LEU QD2 3.00 (# 0.9585 751:20 2.23,)
&rst
ixpk= 0, nxpk= 0, iat=1048, -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr2=1054,1055,1056,
&end
#
# 73 LEU HB3 73 LEU QD2 4.00 (# 0.0000 756:20 2.24,)
&rst
ixpk= 0, nxpk= 0, iat=1046, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2=1054,1055,1056,
&end
#
# 121 LEU QD2 121 LEU HG 3.00 (# 0.9224 759:20 2.24,)
&rst
ixpk= 0, nxpk= 0, iat= -1,1762, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr1=1768,1769,1770,
&end
#
# 138 TRP HB2 121 LEU HG 3.00 (# 0.0000 761:20 2.00,)
&rst
ixpk= 0, nxpk= 0, iat=2026,1762, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 121 LEU QD1 121 LEU HG 3.00 (# 0.9834 762:20 2.24,)
&rst
ixpk= 0, nxpk= 0, iat= -1,1762, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr1=1764,1765,1766,
&end
#
# 121 LEU HB3 121 LEU HG 3.50 (# 0.9650 764:20 2.61,)
&rst
ixpk= 0, nxpk= 0, iat=1760,1762, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 88 ILE QD1 88 ILE HG12 3.50 (# 0.0000 781:20 2.20,)
&rst
ixpk= 0, nxpk= 0, iat= -1,1284, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
igr1=1287,1288,1289,
&end
#
# 51 LEU HB2 51 LEU QD1 4.00 (# 0.9412 782:20 2.19,)
&rst
ixpk= 0, nxpk= 0, iat= 733, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2= 738, 739, 740,
&end
#
# 51 LEU HG 51 LEU QD1 3.00 (# 0.9381 784:20 2.21,)
&rst
ixpk= 0, nxpk= 0, iat= 736, -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr2= 738, 739, 740,
&end
#
# 147 LYS HD2 147 LYS HG2 3.20 (# 0.9992 789:20 2.22,)
&rst
ixpk= 0, nxpk= 0, iat=2185,2182, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 146 LEU QD1 146 LEU HG 3.20 (# 0.0000 791:20 2.24,)
&rst
ixpk= 0, nxpk= 0, iat= -1,2163, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
igr1=2165,2166,2167,
&end
#
# 88 ILE QD1 88 ILE HG12 3.20 (# 0.9024 792:20 2.20,)
&rst
ixpk= 0, nxpk= 0, iat= -1,1284, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
igr1=1287,1288,1289,
&end
#
# 109 LEU HG 109 LEU QD2 3.00 (# 0.0000 795:20 2.22,)
&rst
ixpk= 0, nxpk= 0, iat=1590, -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr2=1596,1597,1598,
&end
#
# 109 LEU HB2 109 LEU QD2 4.00 (# 0.9618 796:20 2.10,)
&rst
ixpk= 0, nxpk= 0, iat=1587, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2=1596,1597,1598,
&end
#
# 109 LEU HB3 109 LEU QD2 4.00 (# 0.0000 799:20 2.10,)
&rst
ixpk= 0, nxpk= 0, iat=1588, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2=1596,1597,1598,
&end
#
# 146 LEU QD2 146 LEU HG 3.00 (# 0.0000 801:20 2.24,)
&rst
ixpk= 0, nxpk= 0, iat= -1,2163, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr1=2169,2170,2171,
&end
#
# 109 LEU HG 109 LEU QD1 3.00 (# 0.0000 806:20 2.22,)
&rst
ixpk= 0, nxpk= 0, iat=1590, -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr2=1592,1593,1594,
&end
#
# 109 LEU HB2 109 LEU QD1 4.00 (# 0.9618 807:20 2.10,)
&rst
ixpk= 0, nxpk= 0, iat=1587, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2=1592,1593,1594,
&end
#
# 146 LEU HB3 146 LEU QD2 4.00 (# 0.9692 812:20 1.99,)
&rst
ixpk= 0, nxpk= 0, iat=2161, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2=2169,2170,2171,
&end
#
# 77 LYS HD3 77 LYS HG2 3.00 (# 0.0000 815:20 2.24,)
&rst
ixpk= 0, nxpk= 0, iat=1120,1116, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 77 LYS HD3 77 LYS HG3 3.00 (# 0.0000 816:20 2.24,)
&rst
ixpk= 0, nxpk= 0, iat=1120,1117, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 73 LEU HA 73 LEU QD1 4.20 (# 0.9347 818:20 2.00,)
&rst
ixpk= 0, nxpk= 0, iat=1043, -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr2=1050,1051,1052,
&end
#
# 73 LEU HB3 73 LEU QD1 4.00 (# 0.0000 820:20 2.24,)
&rst
ixpk= 0, nxpk= 0, iat=1046, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2=1050,1051,1052,
&end
#
# 143 VAL HA 146 LEU QD2 4.50 (# 0.0000 824:20 1.97,)
&rst
ixpk= 0, nxpk= 0, iat=2109, -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr2=2169,2170,2171,
&end
#
# 77 LYS HB2 77 LYS HG2 3.00 (# 0.9932 825:20 2.21,)
&rst
ixpk= 0, nxpk= 0, iat=1113,1116, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 77 LYS HB2 77 LYS HG3 3.50 (# 0.9932 826:20 2.21,)
&rst
ixpk= 0, nxpk= 0, iat=1113,1117, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 73 LEU HB2 73 LEU QD1 4.00 (# 0.9503 827:20 2.24,)
&rst
ixpk= 0, nxpk= 0, iat=1045, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2=1050,1051,1052,
&end
#
# 73 LEU HG 73 LEU QD1 3.20 (# 0.9585 828:20 2.23,)
&rst
ixpk= 0, nxpk= 0, iat=1048, -1, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
igr2=1050,1051,1052,
&end
#
# 146 LEU HB2 146 LEU QD2 4.00 (# 0.0000 833:20 1.99,)
&rst
ixpk= 0, nxpk= 0, iat=2160, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2=2169,2170,2171,
&end
#
# 70 TYR HB3 105 LEU QD2 6.50 (# 0.0000 838:20 2.36,)
&rst
ixpk= 0, nxpk= 0, iat=1000, -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr2=1537,1538,1539,
&end
#
# 105 LEU HG 105 LEU QD2 3.00 (# 0.9775 839:20 2.23,)
&rst
ixpk= 0, nxpk= 0, iat=1531, -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr2=1537,1538,1539,
&end
#
# 105 LEU HB3 105 LEU QD2 4.00 (# 0.0000 840:20 2.15,)
&rst
ixpk= 0, nxpk= 0, iat=1529, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2=1537,1538,1539,
&end
#
# 25 LYS HA 25 LYS HG2 4.00 (# 0.9988 844:20 2.45,)
&rst
ixpk= 0, nxpk= 0, iat= 340, 345, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 25 LYS HB3 25 LYS HG3 3.00 (# 0.9987 845:20 2.32,)
&rst
ixpk= 0, nxpk= 0, iat= 343, 346, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 45 PRO HD2 44 LEU QD1 5.00 (# 0.0000 846:20 2.34,)
&rst
ixpk= 0, nxpk= 0, iat= 645, -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr2= 634, 635, 636,
&end
#
# 25 LYS HD2 25 LYS HG3 3.00 (# 0.0000 850:20 2.41,)
&rst
ixpk= 0, nxpk= 0, iat= 348, 346, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 45 PRO HD3 44 LEU QD1 5.00 (# 0.0000 855:20 2.34,)
&rst
ixpk= 0, nxpk= 0, iat= 646, -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr2= 634, 635, 636,
&end
#
# 44 LEU HG 44 LEU QD1 3.30 (# 0.0000 857:20 2.26,)
&rst
ixpk= 0, nxpk= 0, iat= 632, -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
igr2= 634, 635, 636,
&end
#
# 44 LEU HB3 44 LEU QD1 4.00 (# 0.0000 858:20 2.36,)
&rst
ixpk= 0, nxpk= 0, iat= 630, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2= 634, 635, 636,
&end
#
# 41 LEU HG 41 LEU QD2 3.00 (# 0.9843 865:20 2.22,)
&rst
ixpk= 0, nxpk= 0, iat= 586, -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr2= 592, 593, 594,
&end
#
# 12 LEU HG 12 LEU QD2 3.00 (# 0.9129 869:20 2.21,)
&rst
ixpk= 0, nxpk= 0, iat= 164, -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr2= 170, 171, 172,
&end
#
# 41 LEU HB2 41 LEU QD2 3.50 (# 0.9991 870:20 1.96,)
&rst
ixpk= 0, nxpk= 0, iat= 583, -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
igr2= 592, 593, 594,
&end
#
# 34 GLU HG3 36 LEU QD2 6.50 (# 0.9098 876:20 3.03,)
&rst
ixpk= 0, nxpk= 0, iat= 482, -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr2= 516, 517, 518,
&end
#
# 36 LEU HB2 36 LEU QD2 4.00 (# 0.0000 878:20 1.99,)
&rst
ixpk= 0, nxpk= 0, iat= 507, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2= 516, 517, 518,
&end
#
# 36 LEU HG 36 LEU QD2 3.00 (# 0.9349 879:20 2.22,)
&rst
ixpk= 0, nxpk= 0, iat= 510, -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr2= 516, 517, 518,
&end
#
# 36 LEU HB3 36 LEU QD2 4.00 (# 0.9071 880:20 1.99,)
&rst
ixpk= 0, nxpk= 0, iat= 508, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2= 516, 517, 518,
&end
#
# 120 THR HB 120 THR QG2 3.00 (# 0.9934 883:20 2.23,)
&rst
ixpk= 0, nxpk= 0, iat=1745, -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr2=1747,1748,1749,
&end
#
# 93 ARG HG2 120 THR QG2 6.00 (# 0.9176 886:20 3.08,)
&rst
ixpk= 0, nxpk= 0, iat=1344, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr2=1747,1748,1749,
&end
#
# 18 VAL HA 18 VAL QG1 4.00 (# 0.0000 887:20 1.99,)
&rst
ixpk= 0, nxpk= 0, iat= 238, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2= 242, 243, 244,
&end
#
# 33 THR HB 33 THR QG2 3.00 (# 0.9991 891:20 2.23,)
&rst
ixpk= 0, nxpk= 0, iat= 464, -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr2= 466, 467, 468,
&end
#
# 26 LEU HB2 33 THR QG2 4.00 (# 0.9987 893:20 1.99,)
&rst
ixpk= 0, nxpk= 0, iat= 364, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2= 466, 467, 468,
&end
#
# 4 ILE HB 33 THR QG2 3.50 (# 0.9988 894:20 2.01,)
&rst
ixpk= 0, nxpk= 0, iat= 47, -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
igr2= 466, 467, 468,
&end
#
# 117 THR HB 117 THR QG2 3.00 (# 0.0000 896:20 2.29,)
&rst
ixpk= 0, nxpk= 0, iat=1709, -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr2=1711,1712,1713,
&end
#
# 40 LEU HB2 40 LEU QD2 4.00 (# 0.9952 904:20 2.06,)
&rst
ixpk= 0, nxpk= 0, iat= 564, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2= 573, 574, 575,
&end
#
# 51 LEU HG 51 LEU QD2 3.00 (# 0.0000 907:20 2.21,)
&rst
ixpk= 0, nxpk= 0, iat= 736, -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr2= 742, 743, 744,
&end
#
# 51 LEU HB2 51 LEU QD2 4.00 (# 0.9412 911:20 2.19,)
&rst
ixpk= 0, nxpk= 0, iat= 733, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2= 742, 743, 744,
&end
#
# 147 LYS HD2 143 VAL QG2 6.00 (# 0.9560 915:20 2.02,)
&rst
ixpk= 0, nxpk= 0, iat=2185, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr2=2117,2118,2119,
&end
#
# 143 VAL HA 143 VAL QG2 4.00 (# 0.0000 916:20 2.12,)
&rst
ixpk= 0, nxpk= 0, iat=2109, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2=2117,2118,2119,
&end
#
# 143 VAL HB 143 VAL QG2 3.00 (# 0.9987 917:20 2.22,)
&rst
ixpk= 0, nxpk= 0, iat=2111, -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr2=2117,2118,2119,
&end
#
# 138 TRP HB2 121 LEU QD1 4.50 (# 0.9224 929:20 2.00,)
&rst
ixpk= 0, nxpk= 0, iat=2026, -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr2=1764,1765,1766,
&end
#
# 143 VAL HA 143 VAL QG1 4.00 (# 0.0000 938:20 2.12,)
&rst
ixpk= 0, nxpk= 0, iat=2109, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2=2113,2114,2115,
&end
#
# 143 VAL HB 143 VAL QG1 3.00 (# 0.9987 939:20 2.22,)
&rst
ixpk= 0, nxpk= 0, iat=2111, -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr2=2113,2114,2115,
&end
#
# 29 ALA QB 143 VAL QG1 4.50 (# 0.9988 940:20 1.96,)
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
igr1= 413, 414, 415,
igr2=2113,2114,2115,
&end
#
# 20 GLU HG2 35 THR QG2 6.00 (# 0.0000 944:20 3.52,)
&rst
ixpk= 0, nxpk= 0, iat= 269, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr2= 495, 496, 497,
&end
#
# 78 PRO HB3 80 LEU QD1 5.00 (# 0.9827 950:20 2.00,)
&rst
ixpk= 0, nxpk= 0, iat=1139, -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr2=1166,1167,1168,
&end
#
# 35 THR HB 35 THR QG2 3.00 (# 0.9194 951:20 2.23,)
&rst
ixpk= 0, nxpk= 0, iat= 493, -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr2= 495, 496, 497,
&end
#
# 6 LEU HB2 35 THR QG2 5.00 (# 0.9580 952:20 3.08,)
&rst
ixpk= 0, nxpk= 0, iat= 80, -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr2= 495, 496, 497,
&end
#
# 78 PRO HG2 80 LEU QD1 4.20 (# 0.0000 957:20 2.00,)
&rst
ixpk= 0, nxpk= 0, iat=1135, -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr2=1166,1167,1168,
&end
#
# 80 LEU HB2 80 LEU QD1 4.00 (# 0.0000 959:20 2.10,)
&rst
ixpk= 0, nxpk= 0, iat=1161, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2=1166,1167,1168,
&end
#
# 52 VAL HB 52 VAL QG2 3.00 (# 0.9960 963:20 2.25,)
&rst
ixpk= 0, nxpk= 0, iat= 752, -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr2= 758, 759, 760,
&end
#
# 52 VAL HB 52 VAL QG1 3.30 (# 0.0000 965:20 2.25,)
&rst
ixpk= 0, nxpk= 0, iat= 752, -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
igr2= 754, 755, 756,
&end
#
# 18 VAL HB 18 VAL QG2 3.00 (# 0.0000 969:20 2.22,)
&rst
ixpk= 0, nxpk= 0, iat= 240, -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr2= 246, 247, 248,
&end
#
# 146 LEU HB2 146 LEU QD1 4.00 (# 0.0000 973:20 1.99,)
&rst
ixpk= 0, nxpk= 0, iat=2160, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2=2165,2166,2167,
&end
#
# 18 VAL HA 18 VAL QG2 4.00 (# 0.0000 976:20 1.99,)
&rst
ixpk= 0, nxpk= 0, iat= 238, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2= 246, 247, 248,
&end
#
# 83 VAL HB 83 VAL QG1 3.00 (# 0.9584 977:20 2.22,)
&rst
ixpk= 0, nxpk= 0, iat=1201, -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr2=1203,1204,1205,
&end
#
# 146 LEU HB3 146 LEU QD1 4.00 (# 0.9030 981:20 1.99,)
&rst
ixpk= 0, nxpk= 0, iat=2161, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2=2165,2166,2167,
&end
#
# 2 ALA HA 2 ALA QB 3.00 (# 0.9963 990:20 2.22,)
&rst
ixpk= 0, nxpk= 0, iat= 23, -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr2= 25, 26, 27,
&end
#
# 49 ILE HB 49 ILE QG2 3.00 (# 0.0000 992:20 2.22,)
&rst
ixpk= 0, nxpk= 0, iat= 690, -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr2= 692, 693, 694,
&end
#
# 49 ILE HG12 49 ILE QG2 4.00 (# 0.9240 993:20 2.41,)
&rst
ixpk= 0, nxpk= 0, iat= 696, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2= 692, 693, 694,
&end
#
# 34 GLU HG2 2 ALA QB 4.00 (# 0.9993 998:20 2.00,)
&rst
ixpk= 0, nxpk= 0, iat= 481, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2= 25, 26, 27,
&end
#
# 80 LEU QD1 83 VAL QG2 6.00 (# 0.9570 1001:20 1.97,)
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.65, r4= 9.15,
igr1=1166,1167,1168,
igr2=1207,1208,1209,
&end
#
# 83 VAL HB 83 VAL QG2 3.00 (# 0.9702 1010:20 2.22,)
&rst
ixpk= 0, nxpk= 0, iat=1201, -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr2=1207,1208,1209,
&end
#
# 131 PRO HD3 130 ILE QG2 4.00 (# 0.0000 1034:20 1.94,)
&rst
ixpk= 0, nxpk= 0, iat=1929, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2=1914,1915,1916,
&end
#
# 130 ILE HG12 130 ILE QG2 4.00 (# 0.9935 1035:20 2.39,)
&rst
ixpk= 0, nxpk= 0, iat=1918, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2=1914,1915,1916,
&end
#
# 19 ALA HA 19 ALA QB 3.00 (# 0.9645 1038:20 2.22,)
&rst
ixpk= 0, nxpk= 0, iat= 254, -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr2= 256, 257, 258,
&end
#
# 130 ILE HB 130 ILE QG2 3.00 (# 0.0000 1041:20 2.31,)
&rst
ixpk= 0, nxpk= 0, iat=1912, -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr2=1914,1915,1916,
&end
#
# 130 ILE HG12 130 ILE QG2 4.00 (# 0.0000 1042:20 2.39,)
&rst
ixpk= 0, nxpk= 0, iat=1918, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2=1914,1915,1916,
&end
#
# 53 ILE HB 53 ILE QG2 3.00 (# 0.0000 1050:20 2.22,)
&rst
ixpk= 0, nxpk= 0, iat= 768, -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr2= 770, 771, 772,
&end
#
# 88 ILE QG2 53 ILE QG2 4.00 (# 0.9997 1053:20 1.98,)
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,
igr1=1280,1281,1282,
igr2= 770, 771, 772,
&end
#
# 4 ILE HG12 4 ILE QG2 4.00 (# 0.9649 1054:20 2.60,)
&rst
ixpk= 0, nxpk= 0, iat= 53, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2= 49, 50, 51,
&end
#
# 123 ILE HG12 123 ILE QG2 3.50 (# 0.9977 1056:20 2.22,)
&rst
ixpk= 0, nxpk= 0, iat=1806, -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
igr2=1802,1803,1804,
&end
#
# 123 ILE HB 123 ILE QG2 3.00 (# 0.9912 1061:20 2.22,)
&rst
ixpk= 0, nxpk= 0, iat=1800, -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr2=1802,1803,1804,
&end
#
# 7 ILE HB 7 ILE QG2 3.00 (# 0.9991 1062:20 2.22,)
&rst
ixpk= 0, nxpk= 0, iat= 99, -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr2= 101, 102, 103,
&end
#
# 53 ILE HB 53 ILE QD1 3.50 (# 0.0000 1076:20 2.06,)
&rst
ixpk= 0, nxpk= 0, iat= 768, -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
igr2= 777, 778, 779,
&end
#
# 22 LEU HB2 53 ILE QD1 5.00 (# 0.9499 1078:20 3.23,)
&rst
ixpk= 0, nxpk= 0, iat= 298, -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr2= 777, 778, 779,
&end
#
# 7 ILE HB 7 ILE QD1 3.50 (# 0.9942 1083:20 2.08,)
&rst
ixpk= 0, nxpk= 0, iat= 99, -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
igr2= 108, 109, 110,
&end
#
# 90 ILE HB 90 ILE QD1 4.20 (# 0.9639 1087:20 2.53,)
&rst
ixpk= 0, nxpk= 0, iat=1304, -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr2=1313,1314,1315,
&end
#
# 88 ILE HG12 88 ILE QD1 3.00 (# 0.9684 1091:20 2.20,)
&rst
ixpk= 0, nxpk= 0, iat=1284, -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr2=1287,1288,1289,
&end
#
# 53 ILE HG12 88 ILE QD1 4.00 (# 0.9971 1098:20 1.99,)
&rst
ixpk= 0, nxpk= 0, iat= 774, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2=1287,1288,1289,
&end
#
# 123 ILE HB 123 ILE QD1 4.00 (# 0.9938 1104:20 2.22,)
&rst
ixpk= 0, nxpk= 0, iat=1800, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2=1809,1810,1811,
&end
#
# 4 ILE HG12 4 ILE QD1 3.20 (# 0.9982 1109:20 2.23,)
&rst
ixpk= 0, nxpk= 0, iat= 53, -1, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
igr2= 56, 57, 58,
&end
#
# 31 PHE HB2 4 ILE QD1 5.00 (# 0.0000 1110:20 3.20,)
&rst
ixpk= 0, nxpk= 0, iat= 430, -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr2= 56, 57, 58,
&end
#
# 130 ILE HG12 130 ILE QD1 3.00 (# 0.0000 1112:20 2.20,)
&rst
ixpk= 0, nxpk= 0, iat=1918, -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr2=1921,1922,1923,
&end
#
# 130 ILE HG12 130 ILE QD1 3.00 (# 0.0000 1113:20 2.20,)
&rst
ixpk= 0, nxpk= 0, iat=1918, -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr2=1921,1922,1923,
&end
#
# 117 THR HA 117 THR HB 3.50 (# 0.0000 1115:20 2.61,)
&rst
ixpk= 0, nxpk= 0, iat=1707,1709, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 117 THR HN 117 THR HB 3.00 (# 0.0000 1116:20 2.30,)
&rst
ixpk= 0, nxpk= 0, iat=1705,1709, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 84 ARG HE 117 THR HB 3.00 (# 0.0000 1117:20 1.99,)
&rst
ixpk= 0, nxpk= 0, iat=1226,1709, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 143 VAL HN 143 VAL HA 3.20 (# 0.0000 1118:20 2.74,)
&rst
ixpk= 0, nxpk= 0, iat=2107,2109, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 73 LEU HN 73 LEU HA 3.50 (# 0.9808 1121:20 2.74,)
&rst
ixpk= 0, nxpk= 0, iat=1041,1043, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 117 THR HN 116 GLN HA 2.80 (# 0.0000 1122:20 2.14,)
&rst
ixpk= 0, nxpk= 0, iat=1705,1690, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30, &end
#
# 77 LYS HN 78 PRO HD3 3.50 (# 0.0000 1124:20 2.63,)
&rst
ixpk= 0, nxpk= 0, iat=1109,1133, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 67 SER HN 68 PRO HD3 3.00 (# 0.9983 1126:20 1.66,)
&rst
ixpk= 0, nxpk= 0, iat= 950, 963, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 44 LEU HA 45 PRO HD3 3.00 (# 0.9915 1127:20 2.32,)
&rst
ixpk= 0, nxpk= 0, iat= 627, 646, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 85 PHE HA 85 PHE HB2 3.20 (# 0.9956 1133:20 2.25,)
&rst
ixpk= 0, nxpk= 0, iat=1239,1241, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 85 PHE HA 85 PHE HB3 3.20 (# 0.9956 1137:20 2.25,)
&rst
ixpk= 0, nxpk= 0, iat=1239,1242, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 146 LEU HN 146 LEU HB3 3.50 (# 0.9977 1144:20 2.10,)
&rst
ixpk= 0, nxpk= 0, iat=2156,2161, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 139 LEU HN 139 LEU HB3 3.50 (# 0.9674 1145:20 2.04,)
&rst
ixpk= 0, nxpk= 0, iat=2046,2051, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 146 LEU HN 146 LEU HB2 3.50 (# 0.9977 1146:20 2.10,)
&rst
ixpk= 0, nxpk= 0, iat=2156,2160, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 32 THR HN 3 ASP HB2 3.50 (# 0.0000 1149:20 2.62,)
&rst
ixpk= 0, nxpk= 0, iat= 446, 35, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 42 GLU HN 41 LEU HB2 4.50 (# 0.9843 1152:20 3.54,)
&rst
ixpk= 0, nxpk= 0, iat= 598, 583, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 145 LEU HN 145 LEU HB3 3.50 (# 0.9843 1153:20 2.06,)
&rst
ixpk= 0, nxpk= 0, iat=2137,2142, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 145 LEU HA 145 LEU HB2 3.50 (# 0.9244 1155:20 2.60,)
&rst
ixpk= 0, nxpk= 0, iat=2139,2141, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 3 ASP HA 3 ASP HB2 3.50 (# 0.0000 1156:20 2.70,)
&rst
ixpk= 0, nxpk= 0, iat= 33, 35, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 4 ILE HN 3 ASP HB2 4.00 (# 0.0000 1157:20 3.27,)
&rst
ixpk= 0, nxpk= 0, iat= 43, 35, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 3 ASP HA 3 ASP HB3 3.50 (# 0.9028 1158:20 2.70,)
&rst
ixpk= 0, nxpk= 0, iat= 33, 36, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 41 LEU HN 41 LEU HB2 4.00 (# 0.9344 1160:20 2.14,)
&rst
ixpk= 0, nxpk= 0, iat= 579, 583, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 44 LEU HA 44 LEU HB2 3.50 (# 0.9820 1161:20 2.50,)
&rst
ixpk= 0, nxpk= 0, iat= 627, 629, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 44 LEU HN 44 LEU HB2 3.50 (# 0.9992 1162:20 2.35,)
&rst
ixpk= 0, nxpk= 0, iat= 625, 629, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 12 LEU HA 12 LEU HB2 3.50 (# 0.9912 1163:20 2.49,)
&rst
ixpk= 0, nxpk= 0, iat= 159, 161, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 41 LEU HN 41 LEU HB3 4.00 (# 0.0000 1166:20 2.14,)
&rst
ixpk= 0, nxpk= 0, iat= 579, 584, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 44 LEU HA 44 LEU HB3 3.50 (# 0.9820 1168:20 2.50,)
&rst
ixpk= 0, nxpk= 0, iat= 627, 630, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 43 ASP HA 43 ASP HB2 3.50 (# 0.9881 1169:20 2.73,)
&rst
ixpk= 0, nxpk= 0, iat= 615, 617, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 40 LEU HN 40 LEU HB2 4.00 (# 0.0000 1171:20 2.47,)
&rst
ixpk= 0, nxpk= 0, iat= 560, 564, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 43 ASP HN 43 ASP HB2 3.20 (# 0.0000 1172:20 2.07,)
&rst
ixpk= 0, nxpk= 0, iat= 613, 617, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 52 VAL HA 7 ILE HB 3.00 (# 0.0000 1175:20 2.13,)
&rst
ixpk= 0, nxpk= 0, iat= 750, 99, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 96 ASP HA 96 ASP HB2 3.20 (# 0.0000 1176:20 2.28,)
&rst
ixpk= 0, nxpk= 0, iat=1399,1401, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 31 PHE HA 31 PHE HB2 3.00 (# 0.9906 1177:20 2.28,)
&rst
ixpk= 0, nxpk= 0, iat= 428, 430, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 64 ASP HA 64 ASP HB2 3.20 (# 0.9973 1180:20 2.25,)
&rst
ixpk= 0, nxpk= 0, iat= 907, 909, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 80 LEU HA 80 LEU HB2 3.20 (# 0.9764 1182:20 2.41,)
&rst
ixpk= 0, nxpk= 0, iat=1159,1161, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 70 TYR QD 70 TYR HB3 3.50 (# 0.0000 1184:20 2.30,)
&rst
ixpk= 0, nxpk= 0, iat= -1,1000, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
igr1=1003,1012,
&end
#
# 70 TYR HN 70 TYR HB3 3.00 (# 0.9996 1185:20 2.07,)
&rst
ixpk= 0, nxpk= 0, iat= 995,1000, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 79 ASP HN 79 ASP HB2 3.20 (# 0.9981 1186:20 2.49,)
&rst
ixpk= 0, nxpk= 0, iat=1145,1149, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 79 ASP HN 79 ASP HB3 3.20 (# 0.0000 1187:20 2.49,)
&rst
ixpk= 0, nxpk= 0, iat=1145,1150, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 79 ASP HA 79 ASP HB3 3.20 (# 0.9973 1188:20 2.47,)
&rst
ixpk= 0, nxpk= 0, iat=1147,1150, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 70 TYR QD 70 TYR HB2 3.80 (# 0.0000 1189:20 2.30,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 999, r1= 1.30, r2= 1.80, r3= 4.27, r4= 4.77,
igr1=1003,1012,
&end
#
# 79 ASP HN 79 ASP HB3 3.20 (# 0.0000 1191:20 2.49,)
&rst
ixpk= 0, nxpk= 0, iat=1145,1150, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 49 ILE HN 49 ILE HB 3.50 (# 0.9928 1193:20 2.87,)
&rst
ixpk= 0, nxpk= 0, iat= 686, 690, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 70 TYR HN 70 TYR HB2 3.20 (# 0.9996 1194:20 2.07,)
&rst
ixpk= 0, nxpk= 0, iat= 995, 999, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 4 ILE HA 49 ILE HB 4.00 (# 0.9926 1196:20 3.07,)
&rst
ixpk= 0, nxpk= 0, iat= 45, 690, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 69 PHE HA 69 PHE HB2 3.50 (# 0.9958 1197:20 2.43,)
&rst
ixpk= 0, nxpk= 0, iat= 977, 979, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 69 PHE HN 69 PHE HB3 3.50 (# 0.0000 1198:20 2.14,)
&rst
ixpk= 0, nxpk= 0, iat= 975, 980, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 70 TYR HN 69 PHE HB3 3.50 (# 0.0000 1199:20 1.90,)
&rst
ixpk= 0, nxpk= 0, iat= 995, 980, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 111 ASN HN 111 ASN HB3 3.20 (# 0.0000 1205:20 2.10,)
&rst
ixpk= 0, nxpk= 0, iat=1624,1629, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 111 ASN HN 111 ASN HB2 3.00 (# 0.0000 1207:20 2.10,)
&rst
ixpk= 0, nxpk= 0, iat=1624,1628, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 108 GLU HA 111 ASN HB2 4.00 (# 0.0000 1209:20 2.27,)
&rst
ixpk= 0, nxpk= 0, iat=1570,1628, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 112 SER HN 111 ASN HB3 4.50 (# 0.9894 1211:20 3.29,)
&rst
ixpk= 0, nxpk= 0, iat=1638,1629, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 108 GLU HA 111 ASN HB3 4.20 (# 0.0000 1212:20 2.27,)
&rst
ixpk= 0, nxpk= 0, iat=1570,1629, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 71 GLU HN 71 GLU HG2 3.50 (# 0.0000 1216:20 2.17,)
&rst
ixpk= 0, nxpk= 0, iat=1016,1023, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 65 ASN HA 65 ASN HB3 3.50 (# 0.0000 1217:20 2.39,)
&rst
ixpk= 0, nxpk= 0, iat= 919, 922, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 65 ASN HA 65 ASN HB2 3.50 (# 0.0000 1219:20 2.39,)
&rst
ixpk= 0, nxpk= 0, iat= 919, 921, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 27 GLU HA 27 GLU HG3 3.50 (# 0.9979 1220:20 2.13,)
&rst
ixpk= 0, nxpk= 0, iat= 381, 387, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 27 GLU HN 27 GLU HG2 4.00 (# 0.0000 1222:20 2.82,)
&rst
ixpk= 0, nxpk= 0, iat= 379, 386, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 27 GLU HA 27 GLU HG2 3.50 (# 0.9979 1223:20 2.13,)
&rst
ixpk= 0, nxpk= 0, iat= 381, 386, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 28 GLU HN 28 GLU HG2 4.00 (# 0.0000 1225:20 2.14,)
&rst
ixpk= 0, nxpk= 0, iat= 394, 401, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 108 GLU HN 108 GLU HG2 4.00 (# 0.9942 1226:20 2.15,)
&rst
ixpk= 0, nxpk= 0, iat=1568,1575, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 74 GLN HE21 108 GLU HG2 4.00 (# 0.0000 1227:20 2.25,)
&rst
ixpk= 0, nxpk= 0, iat=1072,1575, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 74 GLN HE21 108 GLU HG3 4.00 (# 0.0000 1229:20 2.25,)
&rst
ixpk= 0, nxpk= 0, iat=1072,1576, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 108 GLU HA 108 GLU HG2 4.00 (# 0.9975 1231:20 2.82,)
&rst
ixpk= 0, nxpk= 0, iat=1570,1575, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 119 GLU HN 119 GLU HG2 3.50 (# 0.0000 1232:20 1.94,)
&rst
ixpk= 0, nxpk= 0, iat=1726,1733, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 75 GLU HN 75 GLU HG3 5.00 (# 0.0000 1236:20 3.68,)
&rst
ixpk= 0, nxpk= 0, iat=1077,1085, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 34 GLU HA 34 GLU HG3 3.50 (# 0.9849 1239:20 2.02,)
&rst
ixpk= 0, nxpk= 0, iat= 476, 482, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 34 GLU HA 34 GLU HG2 3.50 (# 0.9940 1240:20 2.02,)
&rst
ixpk= 0, nxpk= 0, iat= 476, 481, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 76 GLN HE22 76 GLN HG2 3.50 (# 0.0000 1242:20 2.39,)
&rst
ixpk= 0, nxpk= 0, iat=1105,1099, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 76 GLN HN 76 GLN HG2 3.50 (# 0.0000 1243:20 1.79,)
&rst
ixpk= 0, nxpk= 0, iat=1092,1099, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 76 GLN HE22 76 GLN HG3 3.50 (# 0.0000 1246:20 2.39,)
&rst
ixpk= 0, nxpk= 0, iat=1105,1100, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 76 GLN HN 76 GLN HG3 3.50 (# 0.0000 1247:20 1.79,)
&rst
ixpk= 0, nxpk= 0, iat=1092,1100, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 74 GLN HN 74 GLN HG3 3.00 (# 0.0000 1248:20 1.89,)
&rst
ixpk= 0, nxpk= 0, iat=1060,1068, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 115 LYS HA 115 LYS HB2 3.00 (# 0.9912 1250:20 2.27,)
&rst
ixpk= 0, nxpk= 0, iat=1668,1670, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 147 LYS HN 147 LYS HB2 3.20 (# 0.0000 1251:20 2.07,)
&rst
ixpk= 0, nxpk= 0, iat=2175,2179, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 84 ARG HA 84 ARG HB2 3.00 (# 0.0000 1252:20 2.25,)
&rst
ixpk= 0, nxpk= 0, iat=1215,1217, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 34 GLU HA 34 GLU HB3 3.20 (# 0.9851 1253:20 2.61,)
&rst
ixpk= 0, nxpk= 0, iat= 476, 479, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 34 GLU HA 34 GLU HB2 3.50 (# 0.9930 1254:20 2.61,)
&rst
ixpk= 0, nxpk= 0, iat= 476, 478, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 85 PHE HA 50 TRP HB2 3.50 (# 0.9332 1255:20 2.10,)
&rst
ixpk= 0, nxpk= 0, iat=1239, 709, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 85 PHE HA 50 TRP HB3 3.50 (# 0.9332 1256:20 2.10,)
&rst
ixpk= 0, nxpk= 0, iat=1239, 710, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 52 VAL HN 52 VAL HB 4.00 (# 0.0000 1257:20 3.09,)
&rst
ixpk= 0, nxpk= 0, iat= 748, 752, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 78 PRO HA 78 PRO HB3 3.00 (# 0.9996 1259:20 2.30,)
&rst
ixpk= 0, nxpk= 0, iat=1141,1139, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 119 GLU HA 119 GLU HB2 3.00 (# 0.9961 1261:20 2.27,)
&rst
ixpk= 0, nxpk= 0, iat=1728,1730, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 39 PRO HA 39 PRO HB2 3.20 (# 0.0000 1266:20 2.30,)
&rst
ixpk= 0, nxpk= 0, iat= 556, 553, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 119 GLU HN 119 GLU HB3 4.00 (# 0.0000 1269:20 2.75,)
&rst
ixpk= 0, nxpk= 0, iat=1726,1731, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 39 PRO HA 39 PRO HB2 3.00 (# 0.0000 1270:20 2.30,)
&rst
ixpk= 0, nxpk= 0, iat= 556, 553, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 45 PRO HA 45 PRO HB2 3.00 (# 0.9988 1273:20 2.30,)
&rst
ixpk= 0, nxpk= 0, iat= 654, 651, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 45 PRO HA 45 PRO HB3 3.00 (# 0.9988 1274:20 2.30,)
&rst
ixpk= 0, nxpk= 0, iat= 654, 652, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 143 VAL HN 143 VAL HB 3.00 (# 0.0000 1276:20 2.22,)
&rst
ixpk= 0, nxpk= 0, iat=2107,2111, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 142 TRP HE3 143 VAL HB 4.50 (# 0.9192 1277:20 3.66,)
&rst
ixpk= 0, nxpk= 0, iat=2102,2111, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 72 ALA HA 75 GLU HB3 3.00 (# 0.9990 1278:20 1.91,)
&rst
ixpk= 0, nxpk= 0, iat=1033,1082, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 76 GLN HN 75 GLU HB3 4.00 (# 0.0000 1281:20 2.45,)
&rst
ixpk= 0, nxpk= 0, iat=1092,1082, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 75 GLU HN 75 GLU HB3 3.20 (# 0.9954 1282:20 2.20,)
&rst
ixpk= 0, nxpk= 0, iat=1077,1082, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 76 GLN HN 75 GLU HB2 4.00 (# 0.0000 1283:20 2.45,)
&rst
ixpk= 0, nxpk= 0, iat=1092,1081, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 75 GLU HN 75 GLU HB2 3.20 (# 0.9258 1284:20 2.20,)
&rst
ixpk= 0, nxpk= 0, iat=1077,1081, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 72 ALA HA 75 GLU HB2 3.00 (# 0.9990 1285:20 1.91,)
&rst
ixpk= 0, nxpk= 0, iat=1033,1081, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 18 VAL HN 18 VAL HB 3.00 (# 0.9885 1287:20 2.30,)
&rst
ixpk= 0, nxpk= 0, iat= 236, 240, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 68 PRO HA 68 PRO HB2 3.20 (# 0.9813 1288:20 2.30,)
&rst
ixpk= 0, nxpk= 0, iat= 971, 968, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 138 TRP HA 138 TRP HB2 3.50 (# 0.9884 1289:20 2.74,)
&rst
ixpk= 0, nxpk= 0, iat=2024,2026, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 77 LYS HA 77 LYS HB2 3.50 (# 0.9971 1290:20 2.40,)
&rst
ixpk= 0, nxpk= 0, iat=1111,1113, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 138 TRP HN 138 TRP HB2 3.50 (# 0.9894 1291:20 2.07,)
&rst
ixpk= 0, nxpk= 0, iat=2022,2026, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 106 GLU HN 106 GLU HB2 3.50 (# 0.0000 1293:20 2.19,)
&rst
ixpk= 0, nxpk= 0, iat=1543,1547, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 107 ALA HN 106 GLU HB2 4.00 (# 0.0000 1294:20 2.81,)
&rst
ixpk= 0, nxpk= 0, iat=1558,1547, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 74 GLN HN 74 GLN HB3 4.00 (# 0.9840 1296:20 2.68,)
&rst
ixpk= 0, nxpk= 0, iat=1060,1065, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 94 GLU HN 93 ARG HB3 4.00 (# 0.9221 1297:20 2.22,)
&rst
ixpk= 0, nxpk= 0, iat=1361,1342, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 21 HIS HA 24 GLU HB3 4.00 (# 0.9217 1299:20 2.77,)
&rst
ixpk= 0, nxpk= 0, iat= 279, 328, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 28 GLU HN 28 GLU HB3 3.50 (# 0.9988 1300:20 2.21,)
&rst
ixpk= 0, nxpk= 0, iat= 394, 399, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 25 LYS HN 24 GLU HB3 3.50 (# 0.9475 1301:20 1.95,)
&rst
ixpk= 0, nxpk= 0, iat= 338, 328, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 24 GLU HN 24 GLU HB2 3.00 (# 0.0000 1304:20 2.27,)
&rst
ixpk= 0, nxpk= 0, iat= 323, 327, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 25 LYS HN 24 GLU HB2 3.50 (# 0.0000 1305:20 1.95,)
&rst
ixpk= 0, nxpk= 0, iat= 338, 327, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 108 GLU HN 108 GLU HB3 3.50 (# 0.9832 1306:20 2.16,)
&rst
ixpk= 0, nxpk= 0, iat=1568,1573, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 108 GLU HA 108 GLU HB3 3.50 (# 0.0000 1307:20 2.46,)
&rst
ixpk= 0, nxpk= 0, iat=1570,1573, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 108 GLU HN 108 GLU HB2 3.50 (# 0.9867 1308:20 2.16,)
&rst
ixpk= 0, nxpk= 0, iat=1568,1572, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 108 GLU HA 108 GLU HB2 3.50 (# 0.9787 1309:20 2.46,)
&rst
ixpk= 0, nxpk= 0, iat=1570,1572, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 28 GLU HN 28 GLU HB3 3.50 (# 0.9988 1310:20 2.21,)
&rst
ixpk= 0, nxpk= 0, iat= 394, 399, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 24 GLU HN 24 GLU HB3 3.00 (# 0.9986 1311:20 2.27,)
&rst
ixpk= 0, nxpk= 0, iat= 323, 328, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 72 ALA HN 71 GLU HB2 3.50 (# 0.9818 1312:20 2.23,)
&rst
ixpk= 0, nxpk= 0, iat=1031,1020, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 21 HIS HN 21 HIS HB3 3.50 (# 0.0000 1315:20 2.37,)
&rst
ixpk= 0, nxpk= 0, iat= 277, 282, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 76 GLN HN 76 GLN HB2 4.00 (# 0.9967 1316:20 2.70,)
&rst
ixpk= 0, nxpk= 0, iat=1092,1096, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 6 LEU HA 6 LEU QD1 3.50 (# 0.9988 1317:20 1.99,)
&rst
ixpk= 0, nxpk= 0, iat= 78, -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
igr2= 85, 86, 87,
&end
#
# 76 GLN HN 76 GLN HB3 4.00 (# 0.0000 1320:20 2.70,)
&rst
ixpk= 0, nxpk= 0, iat=1092,1097, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 76 GLN HA 76 GLN HB3 3.00 (# 0.9322 1321:20 2.35,)
&rst
ixpk= 0, nxpk= 0, iat=1094,1097, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 112 SER HA 77 LYS HD2 4.50 (# 0.0000 1322:20 2.95,)
&rst
ixpk= 0, nxpk= 0, iat=1640,1119, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 27 GLU HN 27 GLU HB3 3.50 (# 0.0000 1324:20 2.20,)
&rst
ixpk= 0, nxpk= 0, iat= 379, 384, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 27 GLU HA 27 GLU HB3 3.50 (# 0.9959 1325:20 2.60,)
&rst
ixpk= 0, nxpk= 0, iat= 381, 384, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 27 GLU HN 27 GLU HB2 3.50 (# 0.0000 1327:20 2.20,)
&rst
ixpk= 0, nxpk= 0, iat= 379, 383, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 116 GLN HN 116 GLN HB2 3.00 (# 0.0000 1328:20 2.34,)
&rst
ixpk= 0, nxpk= 0, iat=1688,1692, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 143 VAL HN 142 TRP HB2 4.00 (# 0.0000 1330:20 2.37,)
&rst
ixpk= 0, nxpk= 0, iat=2107,2087, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 142 TRP HE3 142 TRP HB2 4.00 (# 0.9931 1331:20 2.43,)
&rst
ixpk= 0, nxpk= 0, iat=2102,2087, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 142 TRP HN 142 TRP HB3 3.00 (# 0.0000 1332:20 2.24,)
&rst
ixpk= 0, nxpk= 0, iat=2083,2088, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 40 LEU HN 40 LEU HG 3.50 (# 0.0000 1334:20 2.95,)
&rst
ixpk= 0, nxpk= 0, iat= 560, 567, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 110 LYS HA 110 LYS HG2 3.50 (# 0.9944 1335:20 2.69,)
&rst
ixpk= 0, nxpk= 0, iat=1604,1609, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 145 LEU HA 145 LEU HG 3.00 (# 0.9720 1338:20 2.39,)
&rst
ixpk= 0, nxpk= 0, iat=2139,2144, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 12 LEU HA 12 LEU QD1 4.50 (# 0.9916 1350:20 2.06,)
&rst
ixpk= 0, nxpk= 0, iat= 159, -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr2= 166, 167, 168,
&end
#
# 115 LYS HA 115 LYS HG3 4.50 (# 0.9778 1351:20 3.57,)
&rst
ixpk= 0, nxpk= 0, iat=1668,1674, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 115 LYS HA 115 LYS HG2 4.50 (# 0.9778 1353:20 3.57,)
&rst
ixpk= 0, nxpk= 0, iat=1668,1673, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 77 LYS HA 77 LYS HG2 3.50 (# 0.9985 1357:20 2.24,)
&rst
ixpk= 0, nxpk= 0, iat=1111,1116, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 77 LYS HA 77 LYS HG2 3.50 (# 0.0000 1358:20 2.24,)
&rst
ixpk= 0, nxpk= 0, iat=1111,1116, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 25 LYS HN 25 LYS HG2 3.50 (# 0.0000 1364:20 1.96,)
&rst
ixpk= 0, nxpk= 0, iat= 338, 345, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 91 GLY HA2 120 THR QG2 6.00 (# 0.9844 1376:20 2.03,)
&rst
ixpk= 0, nxpk= 0, iat=1321, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr2=1747,1748,1749,
&end
#
# 33 THR HA 33 THR QG2 4.00 (# 0.0000 1377:20 2.53,)
&rst
ixpk= 0, nxpk= 0, iat= 462, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2= 466, 467, 468,
&end
#
# 33 THR HN 33 THR QG2 4.00 (# 0.0000 1382:20 2.78,)
&rst
ixpk= 0, nxpk= 0, iat= 460, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2= 466, 467, 468,
&end
#
# 118 GLY HN 117 THR QG2 3.80 (# 0.0000 1383:20 1.95,)
&rst
ixpk= 0, nxpk= 0, iat=1719, -1, r1= 1.30, r2= 1.80, r3= 4.56, r4= 5.06,
igr2=1711,1712,1713,
&end
#
# 33 THR HN 32 THR QG2 5.00 (# 0.0000 1385:20 3.69,)
&rst
ixpk= 0, nxpk= 0, iat= 460, -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr2= 452, 453, 454,
&end
#
# 51 LEU HA 51 LEU QD2 4.00 (# 0.0000 1395:20 1.95,)
&rst
ixpk= 0, nxpk= 0, iat= 731, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2= 742, 743, 744,
&end
#
# 87 ALA HN 87 ALA QB 3.50 (# 0.0000 1398:20 2.18,)
&rst
ixpk= 0, nxpk= 0, iat=1264, -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
igr2=1268,1269,1270,
&end
#
# 87 ALA HA 87 ALA QB 3.20 (# 0.0000 1400:20 2.22,)
&rst
ixpk= 0, nxpk= 0, iat=1266, -1, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
igr2=1268,1269,1270,
&end
#
# 11 THR HA 11 THR QG2 4.00 (# 0.0000 1401:20 1.99,)
&rst
ixpk= 0, nxpk= 0, iat= 145, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2= 149, 150, 151,
&end
#
# 56 THR HA 56 THR QG2 4.00 (# 0.0000 1402:20 2.21,)
&rst
ixpk= 0, nxpk= 0, iat= 807, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2= 811, 812, 813,
&end
#
# 88 ILE HN 87 ALA QB 4.50 (# 0.9202 1406:20 3.55,)
&rst
ixpk= 0, nxpk= 0, iat=1274, -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr2=1268,1269,1270,
&end
#
# 120 THR HA 87 ALA QB 4.50 (# 0.9862 1407:20 2.46,)
&rst
ixpk= 0, nxpk= 0, iat=1743, -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr2=1268,1269,1270,
&end
#
# 144 ASN HN 143 VAL QG1 5.00 (# 0.0000 1411:20 2.58,)
&rst
ixpk= 0, nxpk= 0, iat=2123, -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr2=2113,2114,2115,
&end
#
# 36 LEU HN 35 THR QG2 4.50 (# 0.0000 1414:20 2.40,)
&rst
ixpk= 0, nxpk= 0, iat= 503, -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr2= 495, 496, 497,
&end
#
# 97 THR HA 97 THR QG2 4.00 (# 0.0000 1416:20 2.04,)
&rst
ixpk= 0, nxpk= 0, iat=1411, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2=1415,1416,1417,
&end
#
# 114 ALA HN 80 LEU QD1 5.50 (# 0.9717 1420:20 2.47,)
&rst
ixpk= 0, nxpk= 0, iat=1656, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2=1166,1167,1168,
&end
#
# 50 TRP HD1 5 THR QG2 4.00 (# 0.9710 1423:20 2.47,)
&rst
ixpk= 0, nxpk= 0, iat= 713, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2= 68, 69, 70,
&end
#
# 52 VAL HA 52 VAL QG2 4.00 (# 0.9775 1424:20 2.39,)
&rst
ixpk= 0, nxpk= 0, iat= 750, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2= 758, 759, 760,
&end
#
# 52 VAL HA 52 VAL QG1 4.00 (# 0.0000 1427:20 2.39,)
&rst
ixpk= 0, nxpk= 0, iat= 750, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2= 754, 755, 756,
&end
#
# 34 GLU HN 2 ALA QB 4.50 (# 0.0000 1436:20 3.06,)
&rst
ixpk= 0, nxpk= 0, iat= 474, -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr2= 25, 26, 27,
&end
#
# 33 THR HA 2 ALA QB 4.00 (# 0.0000 1437:20 2.19,)
&rst
ixpk= 0, nxpk= 0, iat= 462, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2= 25, 26, 27,
&end
#
# 3 ASP HN 2 ALA QB 3.50 (# 0.9977 1439:20 1.99,)
&rst
ixpk= 0, nxpk= 0, iat= 31, -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
igr2= 25, 26, 27,
&end
#
# 4 ILE HN 2 ALA QB 4.00 (# 0.0000 1440:20 2.36,)
&rst
ixpk= 0, nxpk= 0, iat= 43, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2= 25, 26, 27,
&end
#
# 32 THR HB 2 ALA QB 4.00 (# 0.9608 1442:20 2.00,)
&rst
ixpk= 0, nxpk= 0, iat= 450, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2= 25, 26, 27,
&end
#
# 49 ILE HA 49 ILE QG2 3.50 (# 0.0000 1444:20 2.10,)
&rst
ixpk= 0, nxpk= 0, iat= 688, -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
igr2= 692, 693, 694,
&end
#
# 115 LYS HN 114 ALA QB 4.00 (# 0.9671 1447:20 2.00,)
&rst
ixpk= 0, nxpk= 0, iat=1666, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2=1660,1661,1662,
&end
#
# 114 ALA HA 114 ALA QB 3.00 (# 0.9750 1450:20 2.22,)
&rst
ixpk= 0, nxpk= 0, iat=1658, -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr2=1660,1661,1662,
&end
#
# 31 PHE HN 29 ALA QB 4.50 (# 0.0000 1457:20 3.01,)
&rst
ixpk= 0, nxpk= 0, iat= 426, -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr2= 413, 414, 415,
&end
#
# 90 ILE HA 90 ILE QG2 4.00 (# 0.9995 1459:20 2.06,)
&rst
ixpk= 0, nxpk= 0, iat=1302, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2=1306,1307,1308,
&end
#
# 26 LEU HA 29 ALA QB 4.00 (# 0.0000 1464:20 2.42,)
&rst
ixpk= 0, nxpk= 0, iat= 362, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2= 413, 414, 415,
&end
#
# 91 GLY HN 90 ILE QG2 4.50 (# 0.9528 1466:20 2.27,)
&rst
ixpk= 0, nxpk= 0, iat=1319, -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr2=1306,1307,1308,
&end
#
# 82 ALA HA 82 ALA QB 3.00 (# 0.9739 1469:20 2.22,)
&rst
ixpk= 0, nxpk= 0, iat=1189, -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr2=1191,1192,1193,
&end
#
# 108 GLU HN 107 ALA QB 4.00 (# 0.0000 1472:20 2.55,)
&rst
ixpk= 0, nxpk= 0, iat=1568, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2=1562,1563,1564,
&end
#
# 130 ILE HA 130 ILE QG2 4.00 (# 0.9788 1476:20 2.73,)
&rst
ixpk= 0, nxpk= 0, iat=1910, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2=1914,1915,1916,
&end
#
# 80 LEU HA 46 ALA QB 4.20 (# 0.9841 1478:20 2.13,)
&rst
ixpk= 0, nxpk= 0, iat=1159, -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr2= 662, 663, 664,
&end
#
# 46 ALA HA 46 ALA QB 3.00 (# 0.9983 1479:20 2.26,)
&rst
ixpk= 0, nxpk= 0, iat= 660, -1, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr2= 662, 663, 664,
&end
#
# 24 GLU HN 23 ALA QB 4.00 (# 0.0000 1481:20 2.47,)
&rst
ixpk= 0, nxpk= 0, iat= 323, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2= 317, 318, 319,
&end
#
# 53 ILE HA 53 ILE QG2 3.50 (# 0.9997 1483:20 2.07,)
&rst
ixpk= 0, nxpk= 0, iat= 766, -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
igr2= 770, 771, 772,
&end
#
# 5 THR HN 4 ILE QG2 4.00 (# 0.0000 1484:20 2.31,)
&rst
ixpk= 0, nxpk= 0, iat= 62, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2= 49, 50, 51,
&end
#
# 4 ILE HA 4 ILE QG2 4.00 (# 0.9030 1486:20 2.56,)
&rst
ixpk= 0, nxpk= 0, iat= 45, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2= 49, 50, 51,
&end
#
# 123 ILE HA 123 ILE QG2 3.50 (# 0.0000 1488:20 2.01,)
&rst
ixpk= 0, nxpk= 0, iat=1798, -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
igr2=1802,1803,1804,
&end
#
# 7 ILE HA 7 ILE QG2 3.50 (# 0.9972 1489:20 2.10,)
&rst
ixpk= 0, nxpk= 0, iat= 97, -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
igr2= 101, 102, 103,
&end
#
# 88 ILE HA 88 ILE QG2 3.50 (# 0.0000 1492:20 2.36,)
&rst
ixpk= 0, nxpk= 0, iat=1276, -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
igr2=1280,1281,1282,
&end
#
# 49 ILE HA 49 ILE QD1 4.00 (# 0.0000 1496:20 2.04,)
&rst
ixpk= 0, nxpk= 0, iat= 688, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2= 699, 700, 701,
&end
#
# 34 GLU HN 33 THR HB 3.00 (# 0.9983 1501:20 2.42,)
&rst
ixpk= 0, nxpk= 0, iat= 474, 464, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 33 THR HN 32 THR HB 3.20 (# 0.0000 1502:20 2.83,)
&rst
ixpk= 0, nxpk= 0, iat= 460, 450, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 5 THR HN 5 THR HB 3.20 (# 0.9974 1503:20 2.66,)
&rst
ixpk= 0, nxpk= 0, iat= 62, 66, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 120 THR HN 120 THR HB 3.00 (# 0.0000 1504:20 2.38,)
&rst
ixpk= 0, nxpk= 0, iat=1741,1745, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 35 THR HN 35 THR HB 3.50 (# 0.0000 1505:20 2.78,)
&rst
ixpk= 0, nxpk= 0, iat= 489, 493, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 112 SER HN 112 SER HB2 4.00 (# 0.9412 1509:20 2.46,)
&rst
ixpk= 0, nxpk= 0, iat=1638,1642, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 112 SER HN 112 SER HB3 4.00 (# 0.9412 1510:20 2.46,)
&rst
ixpk= 0, nxpk= 0, iat=1638,1643, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 121 LEU HN 120 THR HA 2.80 (# 0.9949 1512:20 2.14,)
&rst
ixpk= 0, nxpk= 0, iat=1755,1743, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30, &end
#
# 132 GLU HN 131 PRO HA 4.00 (# 0.0000 1513:20 3.42,)
&rst
ixpk= 0, nxpk= 0, iat=1941,1937, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 81 SER HN 81 SER HB3 3.20 (# 0.9995 1515:20 2.13,)
&rst
ixpk= 0, nxpk= 0, iat=1176,1181, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 141 SER HN 141 SER HB3 3.20 (# 0.0000 1516:20 2.09,)
&rst
ixpk= 0, nxpk= 0, iat=2072,2077, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 141 SER HN 141 SER HB2 3.20 (# 0.0000 1517:20 2.09,)
&rst
ixpk= 0, nxpk= 0, iat=2072,2076, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 142 TRP HN 142 TRP HA 3.50 (# 0.0000 1518:20 2.74,)
&rst
ixpk= 0, nxpk= 0, iat=2083,2085, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 79 ASP HN 78 PRO HA 3.20 (# 0.0000 1519:20 2.33,)
&rst
ixpk= 0, nxpk= 0, iat=1145,1141, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 118 GLY HN 117 THR HA 3.00 (# 0.0000 1520:20 2.16,)
&rst
ixpk= 0, nxpk= 0, iat=1719,1707, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 48 GLY HN 83 VAL HA 2.80 (# 0.9226 1521:20 1.93,)
&rst
ixpk= 0, nxpk= 0, iat= 679,1199, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30, &end
#
# 84 ARG HN 83 VAL HA 2.80 (# 0.9968 1522:20 2.17,)
&rst
ixpk= 0, nxpk= 0, iat=1213,1199, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30, &end
#
# 53 ILE HN 52 VAL HA 2.80 (# 0.9997 1523:20 2.14,)
&rst
ixpk= 0, nxpk= 0, iat= 764, 750, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30, &end
#
# 7 ILE HN 52 VAL HA 3.50 (# 0.9972 1524:20 2.57,)
&rst
ixpk= 0, nxpk= 0, iat= 95, 750, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 138 TRP HN 138 TRP HA 3.50 (# 0.9808 1525:20 2.74,)
&rst
ixpk= 0, nxpk= 0, iat=2022,2024, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 70 TYR QD 70 TYR HA 4.10 (# 0.9992 1528:20 2.17,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 997, r1= 1.30, r2= 1.80, r3= 4.60, r4= 5.10,
igr1=1003,1012,
&end
#
# 124 ASN HN 123 ILE HA 2.80 (# 0.9865 1529:20 2.18,)
&rst
ixpk= 0, nxpk= 0, iat=1815,1798, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30, &end
#
# 141 SER HN 141 SER HA 3.50 (# 0.0000 1530:20 2.76,)
&rst
ixpk= 0, nxpk= 0, iat=2072,2074, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 8 SER HN 7 ILE HA 2.80 (# 0.0000 1531:20 2.15,)
&rst
ixpk= 0, nxpk= 0, iat= 114, 97, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30, &end
#
# 106 GLU HN 106 GLU HA 3.50 (# 0.9967 1532:20 2.76,)
&rst
ixpk= 0, nxpk= 0, iat=1543,1545, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 110 LYS HN 110 LYS HA 3.50 (# 0.9408 1533:20 2.89,)
&rst
ixpk= 0, nxpk= 0, iat=1602,1604, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 104 LYS HN 104 LYS HA 3.50 (# 0.0000 1534:20 2.72,)
&rst
ixpk= 0, nxpk= 0, iat=1502,1504, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 28 GLU HN 28 GLU HA 3.50 (# 0.0000 1537:20 2.82,)
&rst
ixpk= 0, nxpk= 0, iat= 394, 396, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 71 GLU HN 71 GLU HA 3.50 (# 0.0000 1538:20 2.74,)
&rst
ixpk= 0, nxpk= 0, iat=1016,1018, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 29 ALA HN 28 GLU HA 4.00 (# 0.0000 1539:20 3.31,)
&rst
ixpk= 0, nxpk= 0, iat= 409, 396, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 21 HIS HN 21 HIS HA 3.50 (# 0.0000 1540:20 2.80,)
&rst
ixpk= 0, nxpk= 0, iat= 277, 279, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 75 GLU HN 74 GLN HA 4.00 (# 0.0000 1543:20 3.32,)
&rst
ixpk= 0, nxpk= 0, iat=1077,1062, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 42 GLU HN 42 GLU HA 3.50 (# 0.9984 1544:20 2.74,)
&rst
ixpk= 0, nxpk= 0, iat= 598, 600, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 75 GLU HN 75 GLU HA 3.50 (# 0.9766 1545:20 2.88,)
&rst
ixpk= 0, nxpk= 0, iat=1077,1079, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 43 ASP HN 42 GLU HA 3.00 (# 0.9368 1546:20 2.17,)
&rst
ixpk= 0, nxpk= 0, iat= 613, 600, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 142 TRP HE3 139 LEU HA 3.00 (# 0.9995 1547:20 2.26,)
&rst
ixpk= 0, nxpk= 0, iat=2102,2048, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 108 GLU HN 108 GLU HA 3.50 (# 0.9910 1548:20 2.82,)
&rst
ixpk= 0, nxpk= 0, iat=1568,1570, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 111 ASN HD22 108 GLU HA 3.50 (# 0.0000 1549:20 1.91,)
&rst
ixpk= 0, nxpk= 0, iat=1634,1570, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 147 LYS HN 147 LYS HA 3.50 (# 0.0000 1550:20 2.75,)
&rst
ixpk= 0, nxpk= 0, iat=2175,2177, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 111 ASN HN 108 GLU HA 4.00 (# 0.0000 1551:20 3.17,)
&rst
ixpk= 0, nxpk= 0, iat=1624,1570, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 3 ASP HN 3 ASP HA 3.50 (# 0.0000 1552:20 2.94,)
&rst
ixpk= 0, nxpk= 0, iat= 31, 33, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 4 ILE HN 3 ASP HA 4.00 (# 0.0000 1553:20 3.36,)
&rst
ixpk= 0, nxpk= 0, iat= 43, 33, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 25 LYS HN 25 LYS HA 3.50 (# 0.0000 1554:20 2.75,)
&rst
ixpk= 0, nxpk= 0, iat= 338, 340, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 95 TYR HN 94 GLU HA 3.50 (# 0.9988 1555:20 2.35,)
&rst
ixpk= 0, nxpk= 0, iat=1376,1363, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 76 GLN HN 76 GLN HA 3.50 (# 0.0000 1556:20 2.90,)
&rst
ixpk= 0, nxpk= 0, iat=1092,1094, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 47 SER HN 47 SER HA 3.50 (# 0.0000 1557:20 2.85,)
&rst
ixpk= 0, nxpk= 0, iat= 668, 670, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 48 GLY HN 47 SER HA 2.80 (# 0.9625 1558:20 2.15,)
&rst
ixpk= 0, nxpk= 0, iat= 679, 670, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30, &end
#
# 77 LYS HN 77 LYS HA 3.00 (# 0.0000 1559:20 2.29,)
&rst
ixpk= 0, nxpk= 0, iat=1109,1111, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 35 THR HN 34 GLU HA 2.80 (# 0.9984 1560:20 2.15,)
&rst
ixpk= 0, nxpk= 0, iat= 489, 476, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30, &end
#
# 144 ASN HN 144 ASN HA 3.50 (# 0.0000 1564:20 2.76,)
&rst
ixpk= 0, nxpk= 0, iat=2123,2125, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 130 ILE HN 129 ASP HA 4.00 (# 0.0000 1565:20 2.14,)
&rst
ixpk= 0, nxpk= 0, iat=1908,1898, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 107 ALA HN 107 ALA HA 3.50 (# 0.0000 1567:20 2.75,)
&rst
ixpk= 0, nxpk= 0, iat=1558,1560, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 43 ASP HN 43 ASP HA 3.50 (# 0.0000 1568:20 2.75,)
&rst
ixpk= 0, nxpk= 0, iat= 613, 615, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 146 LEU HN 146 LEU HA 3.50 (# 0.9986 1570:20 2.82,)
&rst
ixpk= 0, nxpk= 0, iat=2156,2158, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 122 LYS HN 121 LEU HA 3.00 (# 0.9995 1573:20 2.24,)
&rst
ixpk= 0, nxpk= 0, iat=1774,1757, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 41 LEU HN 40 LEU HA 4.00 (# 0.0000 1574:20 2.70,)
&rst
ixpk= 0, nxpk= 0, iat= 579, 562, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 40 LEU HN 40 LEU HA 3.50 (# 0.0000 1575:20 2.94,)
&rst
ixpk= 0, nxpk= 0, iat= 560, 562, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 37 HIS HN 36 LEU HA 3.00 (# 0.0000 1576:20 2.25,)
&rst
ixpk= 0, nxpk= 0, iat= 522, 505, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 114 ALA HN 114 ALA HA 3.50 (# 0.9940 1578:20 2.88,)
&rst
ixpk= 0, nxpk= 0, iat=1656,1658, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 29 ALA HN 29 ALA HA 3.50 (# 0.9764 1579:20 2.79,)
&rst
ixpk= 0, nxpk= 0, iat= 409, 411, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 46 ALA HN 46 ALA HA 3.50 (# 0.0000 1581:20 2.88,)
&rst
ixpk= 0, nxpk= 0, iat= 658, 660, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 47 SER HN 46 ALA HA 3.20 (# 0.0000 1583:20 2.62,)
&rst
ixpk= 0, nxpk= 0, iat= 668, 660, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 3 ASP HN 2 ALA HA 3.20 (# 0.9989 1584:20 2.53,)
&rst
ixpk= 0, nxpk= 0, iat= 31, 23, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 77 LYS HN 78 PRO HD2 3.80 (# 0.0000 1585:20 2.63,)
&rst
ixpk= 0, nxpk= 0, iat=1109,1132, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30, &end
#
# 67 SER HN 68 PRO HD2 3.00 (# 0.9981 1586:20 1.66,)
&rst
ixpk= 0, nxpk= 0, iat= 950, 962, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 140 GLY HN 140 GLY HA2 3.00 (# 0.0000 1588:20 2.29,)
&rst
ixpk= 0, nxpk= 0, iat=2065,2067, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 140 GLY HN 140 GLY HA3 3.00 (# 0.0000 1589:20 2.29,)
&rst
ixpk= 0, nxpk= 0, iat=2065,2068, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 30 GLY HN 30 GLY HA2 3.50 (# 0.0000 1592:20 2.57,)
&rst
ixpk= 0, nxpk= 0, iat= 419, 421, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 113 GLY HN 113 GLY HA2 3.50 (# 0.9908 1594:20 2.54,)
&rst
ixpk= 0, nxpk= 0, iat=1649,1651, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 118 GLY HN 118 GLY HA2 3.20 (# 0.0000 1595:20 2.30,)
&rst
ixpk= 0, nxpk= 0, iat=1719,1721, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 119 GLU HN 118 GLY HA3 3.20 (# 0.0000 1596:20 2.20,)
&rst
ixpk= 0, nxpk= 0, iat=1726,1722, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 119 GLU HN 118 GLY HA2 3.50 (# 0.0000 1597:20 2.20,)
&rst
ixpk= 0, nxpk= 0, iat=1726,1721, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 118 GLY HN 118 GLY HA3 3.10 (# 0.0000 1598:20 2.30,)
&rst
ixpk= 0, nxpk= 0, iat=1719,1722, r1= 1.30, r2= 1.80, r3= 3.10, r4= 3.60, &end
#
# 69 PHE HN 69 PHE HB2 3.20 (# 0.0000 1599:20 2.14,)
&rst
ixpk= 0, nxpk= 0, iat= 975, 979, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 89 GLY HN 89 GLY HA3 3.50 (# 0.0000 1600:20 2.30,)
&rst
ixpk= 0, nxpk= 0, iat=1293,1296, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 50 TRP HN 49 ILE QG2 4.00 (# 0.0000 1604:20 2.14,)
&rst
ixpk= 0, nxpk= 0, iat= 705, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2= 692, 693, 694,
&end
#
# 89 GLY HN 88 ILE QG2 4.00 (# 0.0000 1605:20 2.50,)
&rst
ixpk= 0, nxpk= 0, iat=1293, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2=1280,1281,1282,
&end
#
# 84 ARG HG2 49 ILE HA 5.00 (# 0.9847 1611:20 1.97,)
&rst
ixpk= 0, nxpk= 0, iat=1220, 688, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 33 THR HB 33 THR HA 3.00 (# 0.0000 1612:20 2.31,)
&rst
ixpk= 0, nxpk= 0, iat= 464, 462, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 49 ILE QD1 49 ILE HA 4.00 (# 0.9237 1614:20 2.04,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 688, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1= 699, 700, 701,
&end
#
# 85 PHE HB2 85 PHE HA 3.50 (# 0.9656 1616:20 2.25,)
&rst
ixpk= 0, nxpk= 0, iat=1241,1239, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 85 PHE HB3 85 PHE HA 3.50 (# 0.0000 1617:20 2.25,)
&rst
ixpk= 0, nxpk= 0, iat=1242,1239, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 84 ARG HB2 84 ARG HA 3.00 (# 0.9745 1618:20 2.25,)
&rst
ixpk= 0, nxpk= 0, iat=1217,1215, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 50 TRP HB2 50 TRP HA 3.50 (# 0.0000 1620:20 2.53,)
&rst
ixpk= 0, nxpk= 0, iat= 709, 707, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 50 TRP HB3 50 TRP HA 3.50 (# 0.9932 1621:20 2.53,)
&rst
ixpk= 0, nxpk= 0, iat= 710, 707, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 4 ILE HN 33 THR HA 3.00 (# 0.0000 1628:20 2.18,)
&rst
ixpk= 0, nxpk= 0, iat= 43, 462, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 34 GLU HN 33 THR HA 3.00 (# 0.9989 1629:20 2.25,)
&rst
ixpk= 0, nxpk= 0, iat= 474, 462, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 86 GLY HN 85 PHE HA 3.00 (# 0.0000 1632:20 2.19,)
&rst
ixpk= 0, nxpk= 0, iat=1257,1239, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 51 LEU HN 50 TRP HA 3.00 (# 0.0000 1635:20 2.14,)
&rst
ixpk= 0, nxpk= 0, iat= 729, 707, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 50 TRP HD1 50 TRP HA 3.20 (# 0.0000 1636:20 2.47,)
&rst
ixpk= 0, nxpk= 0, iat= 713, 707, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 5 THR HN 50 TRP HA 4.00 (# 0.0000 1637:20 3.17,)
&rst
ixpk= 0, nxpk= 0, iat= 62, 707, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 52 VAL HN 87 ALA HA 4.50 (# 0.0000 1638:20 3.77,)
&rst
ixpk= 0, nxpk= 0, iat= 748,1266, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 88 ILE HN 87 ALA HA 3.00 (# 0.9987 1640:20 2.14,)
&rst
ixpk= 0, nxpk= 0, iat=1274,1266, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 33 THR HA 33 THR HB 3.00 (# 0.0000 1644:20 2.31,)
&rst
ixpk= 0, nxpk= 0, iat= 462, 464, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 56 THR HA 56 THR HB 3.00 (# 0.9992 1645:20 2.32,)
&rst
ixpk= 0, nxpk= 0, iat= 807, 809, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 32 THR HA 32 THR HB 3.20 (# 0.0000 1647:20 2.58,)
&rst
ixpk= 0, nxpk= 0, iat= 448, 450, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 50 TRP HA 5 THR HB 5.00 (# 0.0000 1653:20 4.37,)
&rst
ixpk= 0, nxpk= 0, iat= 707, 66, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 11 THR HA 11 THR HB 3.20 (# 0.0000 1656:20 2.38,)
&rst
ixpk= 0, nxpk= 0, iat= 145, 147, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 35 THR HA 35 THR HB 3.50 (# 0.0000 1659:20 2.40,)
&rst
ixpk= 0, nxpk= 0, iat= 491, 493, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 18 VAL HN 18 VAL HA 3.50 (# 0.0000 1660:20 2.90,)
&rst
ixpk= 0, nxpk= 0, iat= 236, 238, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 146 LEU HG 143 VAL HA 4.00 (# 0.9885 1662:20 2.62,)
&rst
ixpk= 0, nxpk= 0, iat=2163,2109, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 92 SER HA 92 SER HB3 3.00 (# 0.0000 1667:20 2.24,)
&rst
ixpk= 0, nxpk= 0, iat=1328,1331, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 47 SER HA 47 SER HB3 3.00 (# 0.9791 1668:20 2.24,)
&rst
ixpk= 0, nxpk= 0, iat= 670, 673, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 47 SER HA 47 SER HB2 3.00 (# 0.9935 1669:20 2.24,)
&rst
ixpk= 0, nxpk= 0, iat= 670, 672, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 92 SER HA 92 SER HB2 3.00 (# 0.0000 1671:20 2.24,)
&rst
ixpk= 0, nxpk= 0, iat=1328,1330, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 47 SER HN 47 SER HB2 4.50 (# 0.0000 1672:20 3.59,)
&rst
ixpk= 0, nxpk= 0, iat= 668, 672, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 112 SER HA 112 SER HB3 3.00 (# 0.9573 1674:20 2.34,)
&rst
ixpk= 0, nxpk= 0, iat=1640,1643, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 109 LEU HA 112 SER HB2 5.00 (# 0.0000 1679:20 3.30,)
&rst
ixpk= 0, nxpk= 0, iat=1585,1642, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 112 SER HA 112 SER HB2 3.00 (# 0.9947 1680:20 2.34,)
&rst
ixpk= 0, nxpk= 0, iat=1640,1642, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 131 PRO HB2 131 PRO HA 3.00 (# 0.9570 1685:20 2.30,)
&rst
ixpk= 0, nxpk= 0, iat=1934,1937, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 81 SER HA 81 SER HB2 3.50 (# 0.9980 1692:20 2.36,)
&rst
ixpk= 0, nxpk= 0, iat=1178,1180, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 142 TRP HB2 142 TRP HA 3.20 (# 0.0000 1694:20 2.29,)
&rst
ixpk= 0, nxpk= 0, iat=2087,2085, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 11 THR HB 11 THR HA 3.20 (# 0.9976 1695:20 2.38,)
&rst
ixpk= 0, nxpk= 0, iat= 147, 145, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 142 TRP HD1 142 TRP HA 4.00 (# 0.0000 1697:20 2.97,)
&rst
ixpk= 0, nxpk= 0, iat=2091,2085, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 117 THR HN 117 THR HA 3.50 (# 0.0000 1700:20 2.89,)
&rst
ixpk= 0, nxpk= 0, iat=1705,1707, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 117 THR HB 117 THR HA 3.50 (# 0.9539 1702:20 2.61,)
&rst
ixpk= 0, nxpk= 0, iat=1709,1707, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 118 GLY HA2 117 THR HA 5.00 (# 0.0000 1703:20 4.41,)
&rst
ixpk= 0, nxpk= 0, iat=1721,1707, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 78 PRO HB3 78 PRO HA 3.20 (# 0.9747 1704:20 2.30,)
&rst
ixpk= 0, nxpk= 0, iat=1139,1141, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 113 GLY HA3 81 SER HA 5.00 (# 0.0000 1712:20 3.03,)
&rst
ixpk= 0, nxpk= 0, iat=1652,1178, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 82 ALA HN 81 SER HA 4.00 (# 0.0000 1715:20 2.70,)
&rst
ixpk= 0, nxpk= 0, iat=1187,1178, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 70 TYR HB2 70 TYR HA 3.20 (# 0.9507 1716:20 2.24,)
&rst
ixpk= 0, nxpk= 0, iat= 999, 997, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 70 TYR HN 70 TYR HA 3.50 (# 0.9934 1718:20 2.73,)
&rst
ixpk= 0, nxpk= 0, iat= 995, 997, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 73 LEU HB2 70 TYR HA 3.50 (# 0.9905 1719:20 2.47,)
&rst
ixpk= 0, nxpk= 0, iat=1045, 997, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 72 ALA HN 69 PHE HA 5.00 (# 0.0000 1723:20 3.83,)
&rst
ixpk= 0, nxpk= 0, iat=1031, 977, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 124 ASN HN 123 ILE HA 2.80 (# 0.9970 1724:20 2.18,)
&rst
ixpk= 0, nxpk= 0, iat=1815,1798, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30, &end
#
# 144 ASN HN 141 SER HA 4.00 (# 0.0000 1726:20 3.37,)
&rst
ixpk= 0, nxpk= 0, iat=2123,2074, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 139 LEU QD2 136 GLU HA 5.00 (# 0.9950 1730:20 1.96,)
&rst
ixpk= 0, nxpk= 0, iat= -1,1994, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr1=2059,2060,2061,
&end
#
# 84 ARG HN 49 ILE HA 3.50 (# 0.9964 1732:20 2.60,)
&rst
ixpk= 0, nxpk= 0, iat=1213, 688, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 50 TRP HN 49 ILE HA 3.00 (# 0.0000 1733:20 2.14,)
&rst
ixpk= 0, nxpk= 0, iat= 705, 688, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 33 THR HN 33 THR HA 4.00 (# 0.0000 1735:20 2.93,)
&rst
ixpk= 0, nxpk= 0, iat= 460, 462, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 7 ILE HB 7 ILE HA 4.00 (# 0.9983 1736:20 2.98,)
&rst
ixpk= 0, nxpk= 0, iat= 99, 97, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 89 GLY HN 88 ILE HA 2.80 (# 0.0000 1741:20 2.14,)
&rst
ixpk= 0, nxpk= 0, iat=1293,1276, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30, &end
#
# 104 LYS HN 104 LYS HA 3.50 (# 0.0000 1743:20 2.72,)
&rst
ixpk= 0, nxpk= 0, iat=1502,1504, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 74 GLN HN 71 GLU HA 4.50 (# 0.0000 1749:20 3.49,)
&rst
ixpk= 0, nxpk= 0, iat=1060,1018, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 21 HIS HD2 21 HIS HA 4.00 (# 0.0000 1752:20 2.61,)
&rst
ixpk= 0, nxpk= 0, iat= 290, 279, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 24 GLU HB3 21 HIS HA 4.00 (# 0.9977 1754:20 2.77,)
&rst
ixpk= 0, nxpk= 0, iat= 328, 279, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 105 LEU QD1 105 LEU HA 4.00 (# 0.9948 1755:20 2.00,)
&rst
ixpk= 0, nxpk= 0, iat= -1,1526, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1=1533,1534,1535,
&end
#
# 41 LEU HB3 41 LEU HA 3.50 (# 0.9366 1756:20 2.70,)
&rst
ixpk= 0, nxpk= 0, iat= 584, 581, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 41 LEU HN 41 LEU HA 5.50 (# 0.0000 1757:20 2.27,)
&rst
ixpk= 0, nxpk= 0, iat= 579, 581, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 109 LEU HG 109 LEU HA 4.00 (# 0.0000 1762:20 3.20,)
&rst
ixpk= 0, nxpk= 0, iat=1590,1585, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 112 SER HB3 109 LEU HA 5.00 (# 0.9823 1763:20 3.30,)
&rst
ixpk= 0, nxpk= 0, iat=1643,1585, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 109 LEU HN 109 LEU HA 4.00 (# 0.9953 1764:20 2.78,)
&rst
ixpk= 0, nxpk= 0, iat=1583,1585, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 44 LEU HN 42 GLU HA 4.00 (# 0.0000 1766:20 3.26,)
&rst
ixpk= 0, nxpk= 0, iat= 625, 600, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 73 LEU QD2 73 LEU HA 4.50 (# 0.0000 1769:20 2.00,)
&rst
ixpk= 0, nxpk= 0, iat= -1,1043, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr1=1054,1055,1056,
&end
#
# 73 LEU HB2 73 LEU HA 3.50 (# 0.9698 1770:20 2.52,)
&rst
ixpk= 0, nxpk= 0, iat=1045,1043, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 74 GLN HN 73 LEU HA 4.00 (# 0.0000 1772:20 3.54,)
&rst
ixpk= 0, nxpk= 0, iat=1060,1043, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 73 LEU HG 73 LEU HA 3.50 (# 0.9809 1773:20 2.67,)
&rst
ixpk= 0, nxpk= 0, iat=1048,1043, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 147 LYS HB2 147 LYS HA 3.50 (# 0.9977 1774:20 2.67,)
&rst
ixpk= 0, nxpk= 0, iat=2179,2177, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 147 LYS HG2 147 LYS HA 3.00 (# 0.0000 1775:20 2.12,)
&rst
ixpk= 0, nxpk= 0, iat=2182,2177, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 56 THR HN 55 SER HA 2.80 (# 0.0000 1776:20 2.14,)
&rst
ixpk= 0, nxpk= 0, iat= 805, 796, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30, &end
#
# 22 LEU HN 22 LEU HA 3.20 (# 0.0000 1778:20 2.75,)
&rst
ixpk= 0, nxpk= 0, iat= 294, 296, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 28 GLU HN 25 LYS HA 4.00 (# 0.9953 1779:20 3.41,)
&rst
ixpk= 0, nxpk= 0, iat= 394, 340, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 77 LYS HN 76 GLN HA 4.00 (# 0.0000 1781:20 3.49,)
&rst
ixpk= 0, nxpk= 0, iat=1109,1094, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 78 PRO HD3 77 LYS HA 3.00 (# 0.0000 1783:20 2.00,)
&rst
ixpk= 0, nxpk= 0, iat=1133,1111, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 97 THR HN 96 ASP HA 3.20 (# 0.0000 1784:20 2.22,)
&rst
ixpk= 0, nxpk= 0, iat=1409,1399, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 116 GLN HG2 116 GLN HA 3.50 (# 0.9958 1786:20 2.39,)
&rst
ixpk= 0, nxpk= 0, iat=1695,1690, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 145 LEU HN 145 LEU HA 3.50 (# 0.0000 1787:20 2.80,)
&rst
ixpk= 0, nxpk= 0, iat=2137,2139, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 144 ASN HD21 144 ASN HA 5.00 (# 0.9322 1789:20 2.20,)
&rst
ixpk= 0, nxpk= 0, iat=2132,2125, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 110 LYS HN 107 ALA HA 4.50 (# 0.0000 1792:20 3.67,)
&rst
ixpk= 0, nxpk= 0, iat=1602,1560, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 83 VAL QG2 85 PHE HA 6.50 (# 0.0000 1794:20 4.47,)
&rst
ixpk= 0, nxpk= 0, iat= -1,1239, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr1=1207,1208,1209,
&end
#
# 50 TRP HN 85 PHE HA 3.50 (# 0.0000 1796:20 2.29,)
&rst
ixpk= 0, nxpk= 0, iat= 705,1239, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 75 GLU HG2 72 ALA HA 5.00 (# 0.0000 1798:20 2.98,)
&rst
ixpk= 0, nxpk= 0, iat=1084,1033, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 13 GLY HA2 12 LEU HA 5.00 (# 0.9327 1800:20 4.30,)
&rst
ixpk= 0, nxpk= 0, iat= 178, 159, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 75 GLU HN 72 ALA HA 4.00 (# 0.9910 1802:20 3.22,)
&rst
ixpk= 0, nxpk= 0, iat=1077,1033, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 13 GLY HN 12 LEU HA 3.50 (# 0.0000 1803:20 2.25,)
&rst
ixpk= 0, nxpk= 0, iat= 176, 159, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 76 GLN HN 72 ALA HA 4.50 (# 0.0000 1805:20 3.54,)
&rst
ixpk= 0, nxpk= 0, iat=1092,1033, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 60 GLY HA3 65 ASN HA 4.50 (# 0.9824 1810:20 2.22,)
&rst
ixpk= 0, nxpk= 0, iat= 856, 919, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 83 VAL QG2 84 ARG HA 6.00 (# 0.0000 1814:20 4.05,)
&rst
ixpk= 0, nxpk= 0, iat= -1,1215, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr1=1207,1208,1209,
&end
#
# 121 LEU HB3 121 LEU HA 3.50 (# 0.9807 1815:20 2.56,)
&rst
ixpk= 0, nxpk= 0, iat=1760,1757, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 80 LEU HB3 80 LEU HA 3.50 (# 0.0000 1817:20 2.41,)
&rst
ixpk= 0, nxpk= 0, iat=1162,1159, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 5 THR HB 50 TRP HA 5.50 (# 0.9103 1823:20 4.37,)
&rst
ixpk= 0, nxpk= 0, iat= 66, 707, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 50 TRP HD1 50 TRP HA 3.50 (# 0.0000 1824:20 2.47,)
&rst
ixpk= 0, nxpk= 0, iat= 713, 707, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 50 TRP HN 50 TRP HA 3.50 (# 0.9850 1825:20 2.94,)
&rst
ixpk= 0, nxpk= 0, iat= 705, 707, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 5 THR HB 50 TRP HA 5.50 (# 0.0000 1826:20 4.37,)
&rst
ixpk= 0, nxpk= 0, iat= 66, 707, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 81 SER HA 114 ALA HA 4.50 (# 0.9570 1832:20 3.30,)
&rst
ixpk= 0, nxpk= 0, iat=1178,1658, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 45 PRO HD3 44 LEU HA 3.00 (# 0.0000 1833:20 2.32,)
&rst
ixpk= 0, nxpk= 0, iat= 646, 627, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 30 GLY HN 29 ALA HA 4.00 (# 0.0000 1835:20 3.48,)
&rst
ixpk= 0, nxpk= 0, iat= 419, 411, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 114 ALA QB 114 ALA HA 3.00 (# 0.0000 1836:20 2.22,)
&rst
ixpk= 0, nxpk= 0, iat= -1,1658, r1= 1.30, r2= 1.80, r3= 3.60, r4= 4.10,
igr1=1660,1661,1662,
&end
#
# 44 LEU QD1 44 LEU HA 4.00 (# 0.0000 1837:20 1.99,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 627, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1= 634, 635, 636,
&end
#
# 83 VAL HN 82 ALA HA 4.00 (# 0.9340 1841:20 3.28,)
&rst
ixpk= 0, nxpk= 0, iat=1197,1189, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 82 ALA HN 82 ALA HA 3.50 (# 0.9976 1842:20 2.80,)
&rst
ixpk= 0, nxpk= 0, iat=1187,1189, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 32 THR HB 2 ALA HA 3.00 (# 0.9985 1847:20 1.99,)
&rst
ixpk= 0, nxpk= 0, iat= 450, 23, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 52 VAL QG1 87 ALA HA 5.00 (# 0.0000 1853:20 2.12,)
&rst
ixpk= 0, nxpk= 0, iat= -1,1266, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr1= 754, 755, 756,
&end
#
# 130 ILE QG2 131 PRO HD2 4.20 (# 0.9987 1855:20 1.94,)
&rst
ixpk= 0, nxpk= 0, iat= -1,1928, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr1=1914,1915,1916,
&end
#
# 73 LEU HA 78 PRO HD3 4.50 (# 0.9903 1861:20 3.06,)
&rst
ixpk= 0, nxpk= 0, iat=1043,1133, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 77 LYS HA 78 PRO HD3 3.00 (# 0.9992 1862:20 2.00,)
&rst
ixpk= 0, nxpk= 0, iat=1111,1133, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 44 LEU HA 45 PRO HD2 3.00 (# 0.9901 1865:20 2.32,)
&rst
ixpk= 0, nxpk= 0, iat= 627, 645, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 77 LYS HN 78 PRO HD2 3.50 (# 0.0000 1866:20 2.63,)
&rst
ixpk= 0, nxpk= 0, iat=1109,1132, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 68 PRO HG2 68 PRO HD3 3.20 (# 0.9989 1867:20 2.30,)
&rst
ixpk= 0, nxpk= 0, iat= 965, 963, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 44 LEU QD1 45 PRO HD2 5.00 (# 0.0000 1869:20 2.34,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 645, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr1= 634, 635, 636,
&end
#
# 44 LEU HB2 45 PRO HD3 5.00 (# 0.9997 1870:20 1.80,)
&rst
ixpk= 0, nxpk= 0, iat= 629, 646, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 68 PRO HG3 68 PRO HD3 3.20 (# 0.9989 1871:20 2.30,)
&rst
ixpk= 0, nxpk= 0, iat= 966, 963, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 143 VAL HB 140 GLY HA3 4.50 (# 0.9590 1878:20 2.84,)
&rst
ixpk= 0, nxpk= 0, iat=2111,2068, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 141 SER HN 140 GLY HA3 3.50 (# 0.0000 1879:20 2.51,)
&rst
ixpk= 0, nxpk= 0, iat=2072,2068, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 114 ALA HN 113 GLY HA3 4.00 (# 0.9224 1893:20 2.93,)
&rst
ixpk= 0, nxpk= 0, iat=1656,1652, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 114 ALA HN 113 GLY HA2 4.00 (# 0.9609 1894:20 2.93,)
&rst
ixpk= 0, nxpk= 0, iat=1656,1651, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 142 TRP HD1 118 GLY HA2 4.50 (# 0.0000 1903:20 2.37,)
&rst
ixpk= 0, nxpk= 0, iat=2091,1721, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 142 TRP HD1 118 GLY HA3 4.50 (# 0.0000 1907:20 2.37,)
&rst
ixpk= 0, nxpk= 0, iat=2091,1722, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 51 LEU HA 51 LEU HB2 3.50 (# 0.0000 1918:20 2.40,)
&rst
ixpk= 0, nxpk= 0, iat= 731, 733, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 6 LEU HA 51 LEU HB2 4.00 (# 0.9827 1919:20 2.23,)
&rst
ixpk= 0, nxpk= 0, iat= 78, 733, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 51 LEU HN 51 LEU HB2 4.00 (# 0.0000 1920:20 2.23,)
&rst
ixpk= 0, nxpk= 0, iat= 729, 733, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 51 LEU QD2 51 LEU HB3 4.00 (# 0.9782 1921:20 2.19,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 734, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1= 742, 743, 744,
&end
#
# 51 LEU QD1 51 LEU HB3 4.00 (# 0.0000 1922:20 2.19,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 734, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1= 738, 739, 740,
&end
#
# 51 LEU HA 51 LEU HB3 3.50 (# 0.0000 1923:20 2.40,)
&rst
ixpk= 0, nxpk= 0, iat= 731, 734, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 90 ILE HA 89 GLY HA2 5.00 (# 0.0000 1933:20 4.46,)
&rst
ixpk= 0, nxpk= 0, iat=1302,1295, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 36 LEU QD2 36 LEU HB2 4.00 (# 0.9996 1942:20 1.99,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 507, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1= 516, 517, 518,
&end
#
# 36 LEU QD2 36 LEU HB3 4.00 (# 0.9996 1943:20 1.99,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 508, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1= 516, 517, 518,
&end
#
# 36 LEU QD1 36 LEU HB3 4.00 (# 0.9982 1944:20 1.99,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 508, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1= 512, 513, 514,
&end
#
# 36 LEU HN 36 LEU HB2 4.50 (# 0.9580 1947:20 3.01,)
&rst
ixpk= 0, nxpk= 0, iat= 503, 507, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 51 LEU HA 86 GLY HA3 5.00 (# 0.0000 1949:20 2.79,)
&rst
ixpk= 0, nxpk= 0, iat= 731,1260, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 86 GLY HN 86 GLY HA3 3.20 (# 0.9985 1951:20 2.49,)
&rst
ixpk= 0, nxpk= 0, iat=1257,1260, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 116 GLN HB3 110 LYS HE3 4.50 (# 0.0000 1955:20 2.18,)
&rst
ixpk= 0, nxpk= 0, iat=1693,1616, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 87 ALA HN 86 GLY HA2 3.20 (# 0.0000 1958:20 2.14,)
&rst
ixpk= 0, nxpk= 0, iat=1264,1259, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 51 LEU HA 86 GLY HA2 5.00 (# 0.0000 1960:20 2.79,)
&rst
ixpk= 0, nxpk= 0, iat= 731,1259, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 116 GLN HB3 110 LYS HE2 4.50 (# 0.0000 1963:20 2.18,)
&rst
ixpk= 0, nxpk= 0, iat=1693,1615, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 139 LEU QD2 139 LEU HB3 4.00 (# 0.9026 1966:20 2.09,)
&rst
ixpk= 0, nxpk= 0, iat= -1,2051, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1=2059,2060,2061,
&end
#
# 139 LEU HN 139 LEU HB2 3.50 (# 0.9674 1967:20 2.04,)
&rst
ixpk= 0, nxpk= 0, iat=2046,2050, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 146 LEU HA 146 LEU HB3 3.00 (# 0.0000 1969:20 2.22,)
&rst
ixpk= 0, nxpk= 0, iat=2158,2161, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 146 LEU QD2 146 LEU HB2 4.00 (# 0.0000 1971:20 1.99,)
&rst
ixpk= 0, nxpk= 0, iat= -1,2160, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1=2169,2170,2171,
&end
#
# 146 LEU QD1 146 LEU HB2 4.00 (# 0.0000 1972:20 1.99,)
&rst
ixpk= 0, nxpk= 0, iat= -1,2160, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1=2165,2166,2167,
&end
#
# 146 LEU QD1 146 LEU HB3 4.00 (# 0.0000 1973:20 1.99,)
&rst
ixpk= 0, nxpk= 0, iat= -1,2161, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1=2165,2166,2167,
&end
#
# 146 LEU QD1 146 LEU HB2 4.00 (# 0.0000 1974:20 1.99,)
&rst
ixpk= 0, nxpk= 0, iat= -1,2160, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1=2165,2166,2167,
&end
#
# 25 LYS HD2 25 LYS HE3 3.50 (# 0.0000 1977:20 2.22,)
&rst
ixpk= 0, nxpk= 0, iat= 348, 352, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 70 TYR HB3 105 LEU HB2 6.50 (# 0.0000 1982:20 3.65,)
&rst
ixpk= 0, nxpk= 0, iat=1000,1528, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00, &end
#
# 3 ASP HA 3 ASP HB3 3.50 (# 0.9028 1985:20 2.70,)
&rst
ixpk= 0, nxpk= 0, iat= 33, 36, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 145 LEU HN 145 LEU HB2 3.50 (# 0.9943 1990:20 2.06,)
&rst
ixpk= 0, nxpk= 0, iat=2137,2141, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 105 LEU HN 105 LEU HB3 3.50 (# 0.0000 1991:20 2.20,)
&rst
ixpk= 0, nxpk= 0, iat=1524,1529, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 105 LEU HN 105 LEU HB3 3.50 (# 0.9885 1992:20 2.20,)
&rst
ixpk= 0, nxpk= 0, iat=1524,1529, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 73 LEU HN 73 LEU HB3 3.50 (# 0.9883 1993:20 2.22,)
&rst
ixpk= 0, nxpk= 0, iat=1041,1046, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 73 LEU QD1 73 LEU HB2 4.00 (# 0.0000 1997:20 2.24,)
&rst
ixpk= 0, nxpk= 0, iat= -1,1045, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1=1050,1051,1052,
&end
#
# 73 LEU HA 73 LEU HB2 3.50 (# 0.9834 1999:20 2.52,)
&rst
ixpk= 0, nxpk= 0, iat=1043,1045, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 74 GLN HN 73 LEU HB2 3.50 (# 0.0000 2000:20 2.26,)
&rst
ixpk= 0, nxpk= 0, iat=1060,1045, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 73 LEU HN 73 LEU HB2 3.50 (# 0.9883 2001:20 2.22,)
&rst
ixpk= 0, nxpk= 0, iat=1041,1045, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 145 LEU HN 145 LEU HB3 3.50 (# 0.9827 2002:20 2.06,)
&rst
ixpk= 0, nxpk= 0, iat=2137,2142, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 32 THR HN 3 ASP HB2 4.00 (# 0.0000 2004:20 2.62,)
&rst
ixpk= 0, nxpk= 0, iat= 446, 35, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 4 ILE HN 3 ASP HB2 4.00 (# 0.0000 2005:20 3.27,)
&rst
ixpk= 0, nxpk= 0, iat= 43, 35, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 3 ASP HN 3 ASP HB2 3.50 (# 0.0000 2007:20 2.35,)
&rst
ixpk= 0, nxpk= 0, iat= 31, 35, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 4 ILE HN 3 ASP HB3 4.00 (# 0.0000 2008:20 3.27,)
&rst
ixpk= 0, nxpk= 0, iat= 43, 36, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 3 ASP HN 3 ASP HB3 3.50 (# 0.0000 2009:20 2.35,)
&rst
ixpk= 0, nxpk= 0, iat= 31, 36, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 32 THR HN 3 ASP HB3 4.00 (# 0.0000 2010:20 2.62,)
&rst
ixpk= 0, nxpk= 0, iat= 446, 36, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 73 LEU HA 73 LEU HB3 3.50 (# 0.0000 2014:20 2.52,)
&rst
ixpk= 0, nxpk= 0, iat=1043,1046, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 41 LEU HA 41 LEU HB3 3.50 (# 0.9572 2016:20 2.70,)
&rst
ixpk= 0, nxpk= 0, iat= 581, 584, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 74 GLN HN 73 LEU HB3 3.50 (# 0.0000 2017:20 2.26,)
&rst
ixpk= 0, nxpk= 0, iat=1060,1046, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 74 GLN HN 73 LEU HB3 3.50 (# 0.0000 2018:20 2.26,)
&rst
ixpk= 0, nxpk= 0, iat=1060,1046, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 73 LEU HG 73 LEU HB3 3.50 (# 0.9977 2020:20 2.47,)
&rst
ixpk= 0, nxpk= 0, iat=1048,1046, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 44 LEU QD1 44 LEU HB3 4.00 (# 0.0000 2021:20 2.36,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 630, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1= 634, 635, 636,
&end
#
# 44 LEU QD1 44 LEU HB3 4.00 (# 0.0000 2022:20 2.36,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 630, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1= 634, 635, 636,
&end
#
# 44 LEU QD2 44 LEU HB2 4.00 (# 0.9913 2024:20 2.36,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 629, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1= 638, 639, 640,
&end
#
# 105 LEU QD2 105 LEU HB2 4.00 (# 0.0000 2028:20 2.15,)
&rst
ixpk= 0, nxpk= 0, iat= -1,1528, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1=1537,1538,1539,
&end
#
# 6 LEU QD1 6 LEU HB2 4.00 (# 0.9820 2029:20 2.29,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 80, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1= 85, 86, 87,
&end
#
# 6 LEU HA 6 LEU HB2 3.50 (# 0.9985 2030:20 2.67,)
&rst
ixpk= 0, nxpk= 0, iat= 78, 80, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 145 LEU HA 145 LEU HB3 3.50 (# 0.9979 2031:20 2.60,)
&rst
ixpk= 0, nxpk= 0, iat=2139,2142, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 44 LEU HN 43 ASP HB2 4.00 (# 0.0000 2033:20 2.97,)
&rst
ixpk= 0, nxpk= 0, iat= 625, 617, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 26 LEU HG 26 LEU HB2 3.00 (# 0.9840 2035:20 2.23,)
&rst
ixpk= 0, nxpk= 0, iat= 367, 364, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 26 LEU HN 26 LEU HB2 3.50 (# 0.9860 2037:20 2.17,)
&rst
ixpk= 0, nxpk= 0, iat= 360, 364, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 41 LEU QD1 41 LEU HB3 4.00 (# 0.9972 2043:20 1.96,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 584, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1= 588, 589, 590,
&end
#
# 7 ILE QG2 7 ILE HB 4.00 (# 0.9965 2048:20 2.22,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 99, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1= 101, 102, 103,
&end
#
# 7 ILE QD1 7 ILE HB 3.50 (# 0.0000 2049:20 2.08,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 99, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
igr1= 108, 109, 110,
&end
#
# 88 ILE QD1 88 ILE HB 4.00 (# 0.9943 2050:20 2.09,)
&rst
ixpk= 0, nxpk= 0, iat= -1,1278, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1=1287,1288,1289,
&end
#
# 109 LEU QD1 109 LEU HB2 4.00 (# 0.9879 2051:20 2.10,)
&rst
ixpk= 0, nxpk= 0, iat= -1,1587, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1=1592,1593,1594,
&end
#
# 33 THR QG2 4 ILE HB 3.50 (# 0.9942 2054:20 2.01,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 47, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
igr1= 466, 467, 468,
&end
#
# 109 LEU QD1 109 LEU HB3 4.00 (# 0.9950 2055:20 2.10,)
&rst
ixpk= 0, nxpk= 0, iat= -1,1588, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1=1592,1593,1594,
&end
#
# 88 ILE HG12 121 LEU HB2 4.00 (# 0.9932 2064:20 1.99,)
&rst
ixpk= 0, nxpk= 0, iat=1284,1759, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 121 LEU HA 121 LEU HB3 3.50 (# 0.9925 2066:20 2.56,)
&rst
ixpk= 0, nxpk= 0, iat=1757,1760, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 121 LEU HA 121 LEU HB3 3.50 (# 0.9925 2067:20 2.56,)
&rst
ixpk= 0, nxpk= 0, iat=1757,1760, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 31 PHE HA 31 PHE HB2 3.50 (# 0.9906 2068:20 2.28,)
&rst
ixpk= 0, nxpk= 0, iat= 428, 430, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 3 ASP HB2 31 PHE HB2 4.50 (# 0.9696 2070:20 2.73,)
&rst
ixpk= 0, nxpk= 0, iat= 35, 430, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 123 ILE HG12 123 ILE HB 3.50 (# 0.0000 2074:20 2.48,)
&rst
ixpk= 0, nxpk= 0, iat=1806,1800, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 123 ILE HG12 123 ILE HB 3.50 (# 0.0000 2075:20 2.48,)
&rst
ixpk= 0, nxpk= 0, iat=1806,1800, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 31 PHE HA 31 PHE HB3 3.20 (# 0.9906 2080:20 2.28,)
&rst
ixpk= 0, nxpk= 0, iat= 428, 431, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 31 PHE HN 31 PHE HB3 4.00 (# 0.9937 2081:20 3.32,)
&rst
ixpk= 0, nxpk= 0, iat= 426, 431, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 31 PHE HN 31 PHE HB2 4.00 (# 0.9937 2082:20 3.32,)
&rst
ixpk= 0, nxpk= 0, iat= 426, 430, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 4 ILE QD1 31 PHE HB3 5.20 (# 0.0000 2083:20 3.20,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 431, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
igr1= 56, 57, 58,
&end
#
# 4 ILE QD1 31 PHE HB2 5.20 (# 0.0000 2084:20 3.20,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 430, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
igr1= 56, 57, 58,
&end
#
# 64 ASP HN 64 ASP HB2 4.50 (# 0.0000 2086:20 2.79,)
&rst
ixpk= 0, nxpk= 0, iat= 905, 909, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 22 LEU HA 22 LEU HB2 3.50 (# 0.9122 2089:20 2.62,)
&rst
ixpk= 0, nxpk= 0, iat= 296, 298, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 22 LEU HG 22 LEU HB3 3.50 (# 0.9969 2090:20 2.37,)
&rst
ixpk= 0, nxpk= 0, iat= 301, 299, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 22 LEU HA 22 LEU HB3 3.50 (# 0.9906 2091:20 2.62,)
&rst
ixpk= 0, nxpk= 0, iat= 296, 299, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 79 ASP HA 79 ASP HB2 3.50 (# 0.0000 2094:20 2.47,)
&rst
ixpk= 0, nxpk= 0, iat=1147,1149, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 80 LEU HA 80 LEU HB3 3.50 (# 0.9764 2096:20 2.41,)
&rst
ixpk= 0, nxpk= 0, iat=1159,1162, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 80 LEU HA 80 LEU HB3 3.50 (# 0.9764 2098:20 2.41,)
&rst
ixpk= 0, nxpk= 0, iat=1159,1162, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 114 ALA QB 80 LEU HB2 4.00 (# 0.0000 2101:20 1.89,)
&rst
ixpk= 0, nxpk= 0, iat= -1,1161, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1=1660,1661,1662,
&end
#
# 114 ALA QB 80 LEU HB3 4.00 (# 0.0000 2102:20 1.89,)
&rst
ixpk= 0, nxpk= 0, iat= -1,1162, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1=1660,1661,1662,
&end
#
# 70 TYR HA 70 TYR HB2 3.50 (# 0.9777 2107:20 2.24,)
&rst
ixpk= 0, nxpk= 0, iat= 997, 999, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 70 TYR HN 70 TYR HB2 3.20 (# 0.9996 2116:20 2.07,)
&rst
ixpk= 0, nxpk= 0, iat= 995, 999, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 4 ILE HG12 49 ILE HB 4.00 (# 0.9993 2121:20 1.97,)
&rst
ixpk= 0, nxpk= 0, iat= 53, 690, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 49 ILE HG12 49 ILE HB 3.20 (# 0.9968 2122:20 2.32,)
&rst
ixpk= 0, nxpk= 0, iat= 696, 690, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 49 ILE HA 49 ILE HB 3.50 (# 0.0000 2124:20 2.68,)
&rst
ixpk= 0, nxpk= 0, iat= 688, 690, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 95 TYR HA 95 TYR HB3 3.50 (# 0.0000 2128:20 2.40,)
&rst
ixpk= 0, nxpk= 0, iat=1378,1381, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 70 TYR HN 69 PHE HB2 3.50 (# 0.0000 2134:20 1.90,)
&rst
ixpk= 0, nxpk= 0, iat= 995, 979, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 69 PHE HA 69 PHE HB2 3.50 (# 0.9958 2135:20 2.43,)
&rst
ixpk= 0, nxpk= 0, iat= 977, 979, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 69 PHE HA 69 PHE HB3 3.50 (# 0.9958 2138:20 2.43,)
&rst
ixpk= 0, nxpk= 0, iat= 977, 980, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 66 LEU QD1 69 PHE HB3 5.00 (# 0.9928 2139:20 1.96,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 980, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr1= 940, 941, 942,
&end
#
# 130 ILE HG12 130 ILE HB 3.00 (# 0.0000 2155:20 2.42,)
&rst
ixpk= 0, nxpk= 0, iat=1918,1912, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 130 ILE HA 130 ILE HB 3.50 (# 0.9045 2158:20 2.97,)
&rst
ixpk= 0, nxpk= 0, iat=1910,1912, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 130 ILE HN 130 ILE HB 3.00 (# 0.0000 2160:20 2.21,)
&rst
ixpk= 0, nxpk= 0, iat=1908,1912, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 111 ASN HD21 111 ASN HB2 4.00 (# 0.0000 2163:20 2.12,)
&rst
ixpk= 0, nxpk= 0, iat=1633,1628, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 111 ASN HD21 111 ASN HB3 4.00 (# 0.0000 2164:20 2.12,)
&rst
ixpk= 0, nxpk= 0, iat=1633,1629, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 112 SER HN 111 ASN HB2 4.50 (# 0.9894 2167:20 3.29,)
&rst
ixpk= 0, nxpk= 0, iat=1638,1628, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 35 THR QG2 20 GLU HG2 6.00 (# 0.0000 2178:20 3.52,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 269, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr1= 495, 496, 497,
&end
#
# 136 GLU HA 136 GLU HG2 4.20 (# 0.9931 2180:20 2.08,)
&rst
ixpk= 0, nxpk= 0, iat=1994,1999, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 20 GLU HN 20 GLU HG2 5.00 (# 0.9667 2185:20 3.69,)
&rst
ixpk= 0, nxpk= 0, iat= 262, 269, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 137 GLU HN 136 GLU HG2 4.00 (# 0.9719 2186:20 2.15,)
&rst
ixpk= 0, nxpk= 0, iat=2007,1999, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 70 TYR QD 71 GLU HG3 5.50 (# 0.0000 2188:20 1.99,)
&rst
ixpk= 0, nxpk= 0, iat= -1,1024, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
igr1=1003,1012,
&end
#
# 71 GLU HN 71 GLU HG3 3.50 (# 0.0000 2192:20 2.17,)
&rst
ixpk= 0, nxpk= 0, iat=1016,1024, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 65 ASN HD21 65 ASN HB3 4.00 (# 0.0000 2195:20 2.12,)
&rst
ixpk= 0, nxpk= 0, iat= 926, 922, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 65 ASN HD21 65 ASN HB2 4.00 (# 0.0000 2196:20 2.12,)
&rst
ixpk= 0, nxpk= 0, iat= 926, 921, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 66 LEU HN 65 ASN HB3 4.00 (# 0.9991 2197:20 1.86,)
&rst
ixpk= 0, nxpk= 0, iat= 931, 922, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 120 THR HN 119 GLU HG2 5.00 (# 0.0000 2203:20 2.82,)
&rst
ixpk= 0, nxpk= 0, iat=1741,1733, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 27 GLU HN 28 GLU HG2 6.00 (# 0.0000 2207:20 4.08,)
&rst
ixpk= 0, nxpk= 0, iat= 379, 401, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 108 GLU HN 108 GLU HG3 4.00 (# 0.9942 2208:20 2.15,)
&rst
ixpk= 0, nxpk= 0, iat=1568,1576, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 108 GLU HA 108 GLU HG2 4.50 (# 0.0000 2210:20 2.82,)
&rst
ixpk= 0, nxpk= 0, iat=1570,1575, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 71 GLU HA 71 GLU HG3 4.00 (# 0.9663 2216:20 2.12,)
&rst
ixpk= 0, nxpk= 0, iat=1018,1024, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 94 GLU HA 94 GLU HG3 4.20 (# 0.0000 2222:20 2.06,)
&rst
ixpk= 0, nxpk= 0, iat=1363,1369, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 94 GLU HA 94 GLU HG2 4.20 (# 0.0000 2223:20 2.06,)
&rst
ixpk= 0, nxpk= 0, iat=1363,1368, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 16 GLU HA 16 GLU HG2 4.00 (# 0.0000 2230:20 2.04,)
&rst
ixpk= 0, nxpk= 0, iat= 202, 207, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 122 LYS HA 122 LYS HB2 3.50 (# 0.9981 2239:20 2.30,)
&rst
ixpk= 0, nxpk= 0, iat=1776,1778, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 74 GLN HE21 74 GLN HG2 4.00 (# 0.0000 2243:20 2.27,)
&rst
ixpk= 0, nxpk= 0, iat=1072,1067, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 147 LYS HN 147 LYS HB3 3.50 (# 0.0000 2244:20 2.07,)
&rst
ixpk= 0, nxpk= 0, iat=2175,2180, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 74 GLN HN 74 GLN HG2 3.20 (# 0.0000 2245:20 1.89,)
&rst
ixpk= 0, nxpk= 0, iat=1060,1067, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 74 GLN HN 74 GLN HG2 3.20 (# 0.0000 2246:20 1.89,)
&rst
ixpk= 0, nxpk= 0, iat=1060,1067, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 75 GLU HN 74 GLN HG3 4.20 (# 0.9888 2247:20 2.98,)
&rst
ixpk= 0, nxpk= 0, iat=1077,1068, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 147 LYS HA 147 LYS HB2 3.50 (# 0.0000 2249:20 2.67,)
&rst
ixpk= 0, nxpk= 0, iat=2177,2179, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 74 GLN HN 74 GLN HG3 3.20 (# 0.0000 2250:20 1.89,)
&rst
ixpk= 0, nxpk= 0, iat=1060,1068, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 5 THR HA 34 GLU HB3 4.00 (# 0.9950 2251:20 2.38,)
&rst
ixpk= 0, nxpk= 0, iat= 64, 479, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 34 GLU HN 34 GLU HB3 3.50 (# 0.0000 2253:20 2.30,)
&rst
ixpk= 0, nxpk= 0, iat= 474, 479, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 36 LEU QD2 34 GLU HB3 5.00 (# 0.9986 2254:20 1.98,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 479, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr1= 516, 517, 518,
&end
#
# 7 ILE QD1 50 TRP HB2 6.00 (# 0.0000 2256:20 3.11,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 709, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr1= 108, 109, 110,
&end
#
# 83 VAL QG2 50 TRP HB2 6.50 (# 0.0000 2258:20 3.12,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 709, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr1=1207,1208,1209,
&end
#
# 85 PHE HB3 50 TRP HB2 6.00 (# 0.0000 2259:20 2.34,)
&rst
ixpk= 0, nxpk= 0, iat=1242, 709, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 85 PHE HB3 50 TRP HB3 6.00 (# 0.0000 2260:20 2.34,)
&rst
ixpk= 0, nxpk= 0, iat=1242, 710, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 50 TRP HA 50 TRP HB2 3.50 (# 0.0000 2261:20 2.53,)
&rst
ixpk= 0, nxpk= 0, iat= 707, 709, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 50 TRP HA 50 TRP HB3 3.50 (# 0.0000 2262:20 2.53,)
&rst
ixpk= 0, nxpk= 0, iat= 707, 710, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 51 LEU HN 50 TRP HB2 5.00 (# 0.0000 2263:20 3.55,)
&rst
ixpk= 0, nxpk= 0, iat= 729, 709, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 51 LEU HN 50 TRP HB3 5.00 (# 0.0000 2264:20 3.55,)
&rst
ixpk= 0, nxpk= 0, iat= 729, 710, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 116 GLN HB2 116 GLN HG2 3.50 (# 0.9796 2266:20 2.21,)
&rst
ixpk= 0, nxpk= 0, iat=1692,1695, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 116 GLN HB2 116 GLN HG2 3.50 (# 0.9783 2267:20 2.21,)
&rst
ixpk= 0, nxpk= 0, iat=1692,1695, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 117 THR HN 116 GLN HG2 4.00 (# 0.0000 2269:20 2.50,)
&rst
ixpk= 0, nxpk= 0, iat=1705,1695, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 116 GLN HB3 116 GLN HG3 3.50 (# 0.0000 2270:20 2.21,)
&rst
ixpk= 0, nxpk= 0, iat=1693,1696, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 131 PRO HA 131 PRO HB2 3.20 (# 0.9765 2274:20 2.30,)
&rst
ixpk= 0, nxpk= 0, iat=1937,1934, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 79 ASP HN 78 PRO HB3 3.50 (# 0.9993 2276:20 1.96,)
&rst
ixpk= 0, nxpk= 0, iat=1145,1139, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 79 ASP HN 78 PRO HB2 3.50 (# 0.9996 2277:20 1.96,)
&rst
ixpk= 0, nxpk= 0, iat=1145,1138, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 78 PRO HD2 78 PRO HB2 4.50 (# 0.0000 2278:20 2.98,)
&rst
ixpk= 0, nxpk= 0, iat=1132,1138, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 40 LEU HN 39 PRO HB2 4.00 (# 0.0000 2279:20 2.85,)
&rst
ixpk= 0, nxpk= 0, iat= 560, 553, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 131 PRO HA 131 PRO HB3 3.20 (# 0.9814 2280:20 2.30,)
&rst
ixpk= 0, nxpk= 0, iat=1937,1935, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 46 ALA HN 45 PRO HB3 3.50 (# 0.0000 2284:20 2.03,)
&rst
ixpk= 0, nxpk= 0, iat= 658, 652, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 80 LEU HN 78 PRO HB2 6.00 (# 0.0000 2285:20 4.10,)
&rst
ixpk= 0, nxpk= 0, iat=1157,1138, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 120 THR HN 119 GLU HB2 4.00 (# 0.0000 2286:20 2.27,)
&rst
ixpk= 0, nxpk= 0, iat=1741,1730, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 140 GLY HA3 143 VAL HB 4.50 (# 0.9926 2291:20 2.84,)
&rst
ixpk= 0, nxpk= 0, iat=2068,2111, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 120 THR HN 119 GLU HB3 4.00 (# 0.0000 2292:20 2.27,)
&rst
ixpk= 0, nxpk= 0, iat=1741,1731, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 45 PRO HD2 45 PRO HB3 4.50 (# 0.0000 2294:20 2.98,)
&rst
ixpk= 0, nxpk= 0, iat= 645, 652, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 45 PRO HD2 45 PRO HB2 4.50 (# 0.0000 2295:20 2.98,)
&rst
ixpk= 0, nxpk= 0, iat= 645, 651, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 46 ALA HA 45 PRO HB3 6.00 (# 0.0000 2296:20 4.41,)
&rst
ixpk= 0, nxpk= 0, iat= 660, 652, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50, &end
#
# 47 SER HN 45 PRO HB3 5.20 (# 0.0000 2299:20 3.53,)
&rst
ixpk= 0, nxpk= 0, iat= 668, 652, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70, &end
#
# 47 SER HN 45 PRO HB3 5.20 (# 0.0000 2300:20 3.53,)
&rst
ixpk= 0, nxpk= 0, iat= 668, 652, r1= 1.30, r2= 1.80, r3= 5.20, r4= 5.70, &end
#
# 45 PRO HD3 45 PRO HB3 4.50 (# 0.0000 2301:20 2.98,)
&rst
ixpk= 0, nxpk= 0, iat= 646, 652, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 45 PRO HD3 45 PRO HB2 4.50 (# 0.0000 2302:20 2.98,)
&rst
ixpk= 0, nxpk= 0, iat= 646, 651, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 46 ALA HN 45 PRO HB2 3.50 (# 0.0000 2303:20 2.03,)
&rst
ixpk= 0, nxpk= 0, iat= 658, 651, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 144 ASN HN 143 VAL HB 3.20 (# 0.0000 2306:20 2.30,)
&rst
ixpk= 0, nxpk= 0, iat=2123,2111, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 25 LYS HG2 25 LYS HB3 3.20 (# 0.0000 2308:20 2.32,)
&rst
ixpk= 0, nxpk= 0, iat= 345, 343, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 25 LYS HG2 25 LYS HB2 3.20 (# 0.9766 2309:20 2.32,)
&rst
ixpk= 0, nxpk= 0, iat= 345, 342, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 25 LYS HG3 25 LYS HB3 3.20 (# 0.0000 2311:20 2.32,)
&rst
ixpk= 0, nxpk= 0, iat= 346, 343, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 139 LEU QD2 25 LYS HB3 5.20 (# 0.9969 2312:20 1.98,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 343, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
igr1=2059,2060,2061,
&end
#
# 139 LEU QD2 25 LYS HB2 5.20 (# 0.9981 2313:20 1.98,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 342, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
igr1=2059,2060,2061,
&end
#
# 128 HIS HA 128 HIS HB2 3.50 (# 0.0000 2322:20 2.39,)
&rst
ixpk= 0, nxpk= 0, iat=1881,1883, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 69 PHE HN 68 PRO HB2 4.50 (# 0.0000 2325:20 2.93,)
&rst
ixpk= 0, nxpk= 0, iat= 975, 968, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 121 LEU QD1 138 TRP HB2 5.00 (# 0.9971 2328:20 2.00,)
&rst
ixpk= 0, nxpk= 0, iat= -1,2026, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr1=1764,1765,1766,
&end
#
# 138 TRP HN 138 TRP HB2 3.50 (# 0.9894 2332:20 2.07,)
&rst
ixpk= 0, nxpk= 0, iat=2022,2026, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 94 GLU HN 94 GLU HB2 4.20 (# 0.0000 2335:20 2.52,)
&rst
ixpk= 0, nxpk= 0, iat=1361,1365, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 94 GLU HA 94 GLU HB2 3.20 (# 0.0000 2337:20 2.29,)
&rst
ixpk= 0, nxpk= 0, iat=1363,1365, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 74 GLN HA 74 GLN HB2 3.20 (# 0.9752 2338:20 2.36,)
&rst
ixpk= 0, nxpk= 0, iat=1062,1064, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 77 LYS HA 77 LYS HB2 3.50 (# 0.9964 2340:20 2.40,)
&rst
ixpk= 0, nxpk= 0, iat=1111,1113, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 136 GLU HA 136 GLU HB2 3.20 (# 0.9721 2347:20 2.37,)
&rst
ixpk= 0, nxpk= 0, iat=1994,1996, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 21 HIS HA 24 GLU HB2 4.20 (# 0.0000 2352:20 2.77,)
&rst
ixpk= 0, nxpk= 0, iat= 279, 327, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 73 LEU QD2 108 GLU HB3 5.20 (# 0.0000 2353:20 2.36,)
&rst
ixpk= 0, nxpk= 0, iat= -1,1573, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
igr1=1054,1055,1056,
&end
#
# 73 LEU QD2 108 GLU HB2 5.20 (# 0.9951 2356:20 2.36,)
&rst
ixpk= 0, nxpk= 0, iat= -1,1572, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
igr1=1054,1055,1056,
&end
#
# 74 GLN HE21 74 GLN HB2 4.20 (# 0.9936 2359:20 1.93,)
&rst
ixpk= 0, nxpk= 0, iat=1072,1064, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 24 GLU HN 24 GLU HB3 3.20 (# 0.9482 2361:20 2.27,)
&rst
ixpk= 0, nxpk= 0, iat= 323, 328, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 73 LEU QD2 108 GLU HB3 5.20 (# 0.0000 2362:20 2.36,)
&rst
ixpk= 0, nxpk= 0, iat= -1,1573, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
igr1=1054,1055,1056,
&end
#
# 109 LEU HN 108 GLU HB3 4.20 (# 0.0000 2368:20 2.64,)
&rst
ixpk= 0, nxpk= 0, iat=1583,1573, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 109 LEU HN 108 GLU HB3 4.20 (# 0.0000 2369:20 2.64,)
&rst
ixpk= 0, nxpk= 0, iat=1583,1573, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 20 GLU HN 20 GLU HB2 3.20 (# 0.9913 2370:20 2.07,)
&rst
ixpk= 0, nxpk= 0, iat= 262, 266, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 106 GLU HN 106 GLU HB2 4.20 (# 0.9992 2372:20 2.19,)
&rst
ixpk= 0, nxpk= 0, iat=1543,1547, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 18 VAL HA 21 HIS HB2 4.20 (# 0.0000 2374:20 2.55,)
&rst
ixpk= 0, nxpk= 0, iat= 238, 281, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 18 VAL HA 21 HIS HB3 4.20 (# 0.0000 2375:20 2.55,)
&rst
ixpk= 0, nxpk= 0, iat= 238, 282, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 21 HIS HA 21 HIS HB2 3.50 (# 0.0000 2376:20 2.38,)
&rst
ixpk= 0, nxpk= 0, iat= 279, 281, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 21 HIS HA 21 HIS HB3 3.50 (# 0.0000 2377:20 2.38,)
&rst
ixpk= 0, nxpk= 0, iat= 279, 282, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 21 HIS HN 21 HIS HB2 3.50 (# 0.0000 2378:20 2.37,)
&rst
ixpk= 0, nxpk= 0, iat= 277, 281, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 24 GLU HA 24 GLU HB3 3.50 (# 0.9590 2379:20 2.37,)
&rst
ixpk= 0, nxpk= 0, iat= 325, 328, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 20 GLU HN 20 GLU HB3 3.50 (# 0.9838 2382:20 2.07,)
&rst
ixpk= 0, nxpk= 0, iat= 262, 267, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 78 PRO HD3 76 GLN HB3 5.50 (# 0.0000 2383:20 2.11,)
&rst
ixpk= 0, nxpk= 0, iat=1133,1097, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 78 PRO HD3 76 GLN HB2 5.50 (# 0.9994 2384:20 2.11,)
&rst
ixpk= 0, nxpk= 0, iat=1133,1096, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 35 THR HA 6 LEU QD1 5.80 (# 0.0000 2388:20 4.21,)
&rst
ixpk= 0, nxpk= 0, iat= 491, -1, r1= 1.30, r2= 1.80, r3= 6.97, r4= 7.47,
igr2= 85, 86, 87,
&end
#
# 23 ALA HN 6 LEU QD1 6.00 (# 0.9500 2389:20 3.50,)
&rst
ixpk= 0, nxpk= 0, iat= 313, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr2= 85, 86, 87,
&end
#
# 27 GLU HA 27 GLU HB2 3.50 (# 0.9959 2396:20 2.60,)
&rst
ixpk= 0, nxpk= 0, iat= 381, 383, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 116 GLN HG2 116 GLN HB3 3.50 (# 0.0000 2398:20 2.21,)
&rst
ixpk= 0, nxpk= 0, iat=1695,1693, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 110 LYS HE3 116 GLN HB3 4.50 (# 0.9970 2399:20 2.18,)
&rst
ixpk= 0, nxpk= 0, iat=1616,1693, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 116 GLN HG3 116 GLN HB2 3.50 (# 0.9944 2403:20 2.21,)
&rst
ixpk= 0, nxpk= 0, iat=1696,1692, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 142 TRP HA 142 TRP HB3 3.50 (# 0.0000 2407:20 2.29,)
&rst
ixpk= 0, nxpk= 0, iat=2085,2088, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 41 LEU HA 41 LEU HG 3.00 (# 0.9993 2408:20 2.12,)
&rst
ixpk= 0, nxpk= 0, iat= 581, 586, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 142 TRP HA 142 TRP HB2 3.00 (# 0.0000 2411:20 2.29,)
&rst
ixpk= 0, nxpk= 0, iat=2085,2087, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50, &end
#
# 142 TRP HE3 142 TRP HB2 4.20 (# 0.9931 2412:20 2.43,)
&rst
ixpk= 0, nxpk= 0, iat=2102,2087, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 143 VAL HN 142 TRP HB2 4.50 (# 0.0000 2413:20 2.37,)
&rst
ixpk= 0, nxpk= 0, iat=2107,2087, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 49 ILE HN 49 ILE HG12 4.20 (# 0.9783 2416:20 2.08,)
&rst
ixpk= 0, nxpk= 0, iat= 686, 696, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 51 LEU QD2 51 LEU HG 3.20 (# 0.9410 2417:20 2.21,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 736, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
igr1= 742, 743, 744,
&end
#
# 49 ILE HB 4 ILE HG12 4.20 (# 0.0000 2419:20 1.97,)
&rst
ixpk= 0, nxpk= 0, iat= 690, 53, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 49 ILE HN 49 ILE HG12 4.20 (# 0.9860 2420:20 2.08,)
&rst
ixpk= 0, nxpk= 0, iat= 686, 696, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 4 ILE QD1 4 ILE HG12 3.20 (# 0.9505 2421:20 2.23,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 53, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
igr1= 56, 57, 58,
&end
#
# 123 ILE QG2 123 ILE HG12 4.00 (# 0.9372 2422:20 2.22,)
&rst
ixpk= 0, nxpk= 0, iat= -1,1806, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1=1802,1803,1804,
&end
#
# 4 ILE HA 4 ILE HG12 3.20 (# 0.9787 2424:20 2.37,)
&rst
ixpk= 0, nxpk= 0, iat= 45, 53, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 3 ASP HB3 4 ILE HG12 5.00 (# 0.0000 2425:20 2.68,)
&rst
ixpk= 0, nxpk= 0, iat= 36, 53, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 49 ILE HB 49 ILE HG12 3.20 (# 0.0000 2427:20 2.32,)
&rst
ixpk= 0, nxpk= 0, iat= 690, 696, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 49 ILE HA 49 ILE HG12 4.20 (# 0.0000 2428:20 3.11,)
&rst
ixpk= 0, nxpk= 0, iat= 688, 696, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 25 LYS HE3 25 LYS HD2 3.20 (# 0.0000 2429:20 2.22,)
&rst
ixpk= 0, nxpk= 0, iat= 352, 348, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 25 LYS HA 25 LYS HD2 4.00 (# 0.9993 2431:20 2.15,)
&rst
ixpk= 0, nxpk= 0, iat= 340, 348, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 88 ILE QD1 53 ILE HG12 4.00 (# 0.9975 2437:20 1.99,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 774, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1=1287,1288,1289,
&end
#
# 51 LEU QD1 51 LEU HG 3.20 (# 0.9978 2438:20 2.21,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 736, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
igr1= 738, 739, 740,
&end
#
# 51 LEU HB2 51 LEU HG 3.20 (# 0.9992 2439:20 2.27,)
&rst
ixpk= 0, nxpk= 0, iat= 733, 736, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 51 LEU HB2 51 LEU HG 3.20 (# 0.9992 2440:20 2.27,)
&rst
ixpk= 0, nxpk= 0, iat= 733, 736, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 84 ARG HA 84 ARG HG3 4.50 (# 0.0000 2448:20 2.99,)
&rst
ixpk= 0, nxpk= 0, iat=1215,1221, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 25 LYS HN 25 LYS HD2 4.00 (# 0.0000 2449:20 2.14,)
&rst
ixpk= 0, nxpk= 0, iat= 338, 348, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 123 ILE HA 123 ILE HG12 4.50 (# 0.0000 2451:20 3.41,)
&rst
ixpk= 0, nxpk= 0, iat=1798,1806, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 36 LEU HN 36 LEU HG 3.20 (# 0.9573 2452:20 2.36,)
&rst
ixpk= 0, nxpk= 0, iat= 503, 510, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 78 PRO HD3 78 PRO HG2 3.20 (# 0.0000 2455:20 2.30,)
&rst
ixpk= 0, nxpk= 0, iat=1133,1135, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 40 LEU HA 40 LEU HG 3.50 (# 0.9730 2458:20 2.78,)
&rst
ixpk= 0, nxpk= 0, iat= 562, 567, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 123 ILE HA 123 ILE HG12 4.50 (# 0.0000 2461:20 3.41,)
&rst
ixpk= 0, nxpk= 0, iat=1798,1806, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 130 ILE HB 130 ILE HG12 3.20 (# 0.9371 2463:20 2.42,)
&rst
ixpk= 0, nxpk= 0, iat=1912,1918, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 84 ARG HD3 84 ARG HG3 3.20 (# 0.0000 2464:20 2.23,)
&rst
ixpk= 0, nxpk= 0, iat=1224,1221, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 130 ILE HA 130 ILE HG12 4.00 (# 0.9278 2465:20 2.62,)
&rst
ixpk= 0, nxpk= 0, iat=1910,1918, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 130 ILE HN 130 ILE HG12 4.50 (# 0.9960 2467:20 2.98,)
&rst
ixpk= 0, nxpk= 0, iat=1908,1918, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 130 ILE HN 130 ILE HG12 4.50 (# 0.0000 2469:20 2.98,)
&rst
ixpk= 0, nxpk= 0, iat=1908,1918, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 105 LEU HG 105 LEU QD1 3.20 (# 0.9775 2472:20 2.23,)
&rst
ixpk= 0, nxpk= 0, iat=1531, -1, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
igr2=1533,1534,1535,
&end
#
# 121 LEU HN 121 LEU QD2 5.80 (# 0.0000 2479:20 2.31,)
&rst
ixpk= 0, nxpk= 0, iat=1755, -1, r1= 1.30, r2= 1.80, r3= 6.97, r4= 7.47,
igr2=1768,1769,1770,
&end
#
# 142 TRP HE3 139 LEU QD2 6.50 (# 0.9861 2480:20 2.09,)
&rst
ixpk= 0, nxpk= 0, iat=2102, -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr2=2059,2060,2061,
&end
#
# 145 LEU HN 145 LEU HG 5.00 (# 0.9782 2483:20 3.77,)
&rst
ixpk= 0, nxpk= 0, iat=2137,2144, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50, &end
#
# 44 LEU QD1 44 LEU HG 3.50 (# 0.0000 2485:20 2.26,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 632, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
igr1= 634, 635, 636,
&end
#
# 73 LEU QD2 109 LEU HG 5.00 (# 0.0000 2487:20 2.60,)
&rst
ixpk= 0, nxpk= 0, iat= -1,1590, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr1=1054,1055,1056,
&end
#
# 109 LEU HN 109 LEU HG 3.50 (# 0.9821 2490:20 2.42,)
&rst
ixpk= 0, nxpk= 0, iat=1583,1590, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 104 LYS HN 104 LYS HG2 3.50 (# 0.0000 2494:20 1.93,)
&rst
ixpk= 0, nxpk= 0, iat=1502,1509, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 104 LYS HN 104 LYS HG3 3.50 (# 0.0000 2497:20 1.93,)
&rst
ixpk= 0, nxpk= 0, iat=1502,1510, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 73 LEU HN 73 LEU HG 3.50 (# 0.9848 2498:20 2.27,)
&rst
ixpk= 0, nxpk= 0, iat=1041,1048, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 104 LYS HA 104 LYS HG3 4.00 (# 0.9921 2499:20 2.36,)
&rst
ixpk= 0, nxpk= 0, iat=1504,1510, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 36 LEU HG 36 LEU QD1 3.50 (# 0.9301 2501:20 2.22,)
&rst
ixpk= 0, nxpk= 0, iat= 510, -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
igr2= 512, 513, 514,
&end
#
# 69 PHE HB2 41 LEU QD1 6.00 (# 0.9655 2509:20 2.00,)
&rst
ixpk= 0, nxpk= 0, iat= 979, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr2= 588, 589, 590,
&end
#
# 26 LEU HA 26 LEU QD2 4.20 (# 0.9930 2511:20 1.92,)
&rst
ixpk= 0, nxpk= 0, iat= 362, -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr2= 373, 374, 375,
&end
#
# 108 GLU HB3 73 LEU QD2 5.50 (# 0.9030 2516:20 2.36,)
&rst
ixpk= 0, nxpk= 0, iat=1573, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2=1054,1055,1056,
&end
#
# 73 LEU HN 73 LEU QD2 5.50 (# 0.9320 2518:20 3.43,)
&rst
ixpk= 0, nxpk= 0, iat=1041, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2=1054,1055,1056,
&end
#
# 6 LEU HA 6 LEU QD2 4.00 (# 0.9988 2523:20 1.99,)
&rst
ixpk= 0, nxpk= 0, iat= 78, -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr2= 89, 90, 91,
&end
#
# 147 LYS HN 147 LYS HG2 4.50 (# 0.0000 2527:20 2.85,)
&rst
ixpk= 0, nxpk= 0, iat=2175,2182, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 147 LYS HN 147 LYS HG3 4.50 (# 0.0000 2528:20 2.85,)
&rst
ixpk= 0, nxpk= 0, iat=2175,2183, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 88 ILE QG2 88 ILE HG12 4.50 (# 0.9932 2531:20 1.98,)
&rst
ixpk= 0, nxpk= 0, iat= -1,1284, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr1=1280,1281,1282,
&end
#
# 77 LYS HE2 77 LYS HG3 3.50 (# 0.9988 2547:20 2.03,)
&rst
ixpk= 0, nxpk= 0, iat=1122,1117, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 77 LYS HA 77 LYS HG3 3.80 (# 0.0000 2548:20 2.24,)
&rst
ixpk= 0, nxpk= 0, iat=1111,1117, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30, &end
#
# 77 LYS HN 77 LYS HG3 3.80 (# 0.0000 2549:20 2.28,)
&rst
ixpk= 0, nxpk= 0, iat=1109,1117, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30, &end
#
# 77 LYS HN 77 LYS HG2 3.80 (# 0.0000 2550:20 2.28,)
&rst
ixpk= 0, nxpk= 0, iat=1109,1116, r1= 1.30, r2= 1.80, r3= 3.80, r4= 4.30, &end
#
# 111 ASN HD22 77 LYS HG3 6.20 (# 0.9042 2552:20 4.13,)
&rst
ixpk= 0, nxpk= 0, iat=1634,1117, r1= 1.30, r2= 1.80, r3= 6.20, r4= 6.70, &end
#
# 109 LEU HA 73 LEU QD1 5.20 (# 0.9595 2553:20 2.92,)
&rst
ixpk= 0, nxpk= 0, iat=1585, -1, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
igr2=1050,1051,1052,
&end
#
# 73 LEU HN 73 LEU QD1 5.50 (# 0.9320 2556:20 3.43,)
&rst
ixpk= 0, nxpk= 0, iat=1041, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2=1050,1051,1052,
&end
#
# 143 VAL HA 146 LEU QD2 5.00 (# 0.0000 2557:20 1.97,)
&rst
ixpk= 0, nxpk= 0, iat=2109, -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr2=2169,2170,2171,
&end
#
# 105 LEU HB2 105 LEU QD2 4.50 (# 0.9694 2565:20 2.15,)
&rst
ixpk= 0, nxpk= 0, iat=1528, -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr2=1537,1538,1539,
&end
#
# 25 LYS HB2 25 LYS HG2 3.20 (# 0.9875 2568:20 2.32,)
&rst
ixpk= 0, nxpk= 0, iat= 342, 345, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 25 LYS HD2 25 LYS HG2 3.20 (# 0.0000 2570:20 2.41,)
&rst
ixpk= 0, nxpk= 0, iat= 348, 345, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 115 LYS HB2 115 LYS HG2 3.20 (# 0.0000 2571:20 2.21,)
&rst
ixpk= 0, nxpk= 0, iat=1670,1673, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 22 LEU HA 25 LYS HG2 4.50 (# 0.9429 2572:20 2.49,)
&rst
ixpk= 0, nxpk= 0, iat= 296, 345, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 22 LEU HA 25 LYS HG3 4.50 (# 0.9480 2573:20 2.49,)
&rst
ixpk= 0, nxpk= 0, iat= 296, 346, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 25 LYS HA 25 LYS HG3 4.00 (# 0.9948 2574:20 2.45,)
&rst
ixpk= 0, nxpk= 0, iat= 340, 346, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 25 LYS HN 25 LYS HG3 3.50 (# 0.0000 2575:20 1.96,)
&rst
ixpk= 0, nxpk= 0, iat= 338, 346, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 44 LEU HN 44 LEU QD1 5.50 (# 0.0000 2594:20 3.59,)
&rst
ixpk= 0, nxpk= 0, iat= 625, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2= 634, 635, 636,
&end
#
# 73 LEU HA 41 LEU QD2 6.50 (# 0.9784 2596:20 3.49,)
&rst
ixpk= 0, nxpk= 0, iat=1043, -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr2= 592, 593, 594,
&end
#
# 26 LEU HB2 26 LEU QD1 4.50 (# 0.9306 2604:20 1.95,)
&rst
ixpk= 0, nxpk= 0, iat= 364, -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr2= 369, 370, 371,
&end
#
# 120 THR HN 120 THR QG2 4.50 (# 0.0000 2611:20 1.95,)
&rst
ixpk= 0, nxpk= 0, iat=1741, -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr2=1747,1748,1749,
&end
#
# 118 GLY HN 117 THR QG2 4.20 (# 0.0000 2612:20 1.95,)
&rst
ixpk= 0, nxpk= 0, iat=1719, -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr2=1711,1712,1713,
&end
#
# 120 THR HB 120 THR QG2 3.20 (# 0.9950 2613:20 2.23,)
&rst
ixpk= 0, nxpk= 0, iat=1745, -1, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
igr2=1747,1748,1749,
&end
#
# 18 VAL HN 18 VAL QG1 5.00 (# 0.9791 2614:20 2.63,)
&rst
ixpk= 0, nxpk= 0, iat= 236, -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr2= 242, 243, 244,
&end
#
# 27 GLU HA 33 THR QG2 4.20 (# 0.9942 2617:20 2.40,)
&rst
ixpk= 0, nxpk= 0, iat= 381, -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr2= 466, 467, 468,
&end
#
# 116 GLN HE21 87 ALA QB 4.50 (# 0.9748 2631:20 2.12,)
&rst
ixpk= 0, nxpk= 0, iat=1700, -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr2=1268,1269,1270,
&end
#
# 116 GLN HE22 87 ALA QB 4.50 (# 0.0000 2632:20 2.12,)
&rst
ixpk= 0, nxpk= 0, iat=1701, -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr2=1268,1269,1270,
&end
#
# 97 THR HN 97 THR QG2 4.20 (# 0.0000 2636:20 1.99,)
&rst
ixpk= 0, nxpk= 0, iat=1409, -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr2=1415,1416,1417,
&end
#
# 23 ALA QB 35 THR QG2 4.50 (# 0.9862 2644:20 2.01,)
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
igr1= 317, 318, 319,
igr2= 495, 496, 497,
&end
#
# 80 LEU HN 80 LEU QD1 4.20 (# 0.0000 2648:20 2.03,)
&rst
ixpk= 0, nxpk= 0, iat=1157, -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr2=1166,1167,1168,
&end
#
# 20 GLU HA 35 THR QG2 4.20 (# 0.9985 2649:20 2.03,)
&rst
ixpk= 0, nxpk= 0, iat= 264, -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr2= 495, 496, 497,
&end
#
# 19 ALA HN 18 VAL QG2 5.20 (# 0.9829 2661:20 2.16,)
&rst
ixpk= 0, nxpk= 0, iat= 252, -1, r1= 1.30, r2= 1.80, r3= 6.24, r4= 6.74,
igr2= 246, 247, 248,
&end
#
# 50 TRP HD1 83 VAL QG1 4.60 (# 0.9760 2663:20 2.16,)
&rst
ixpk= 0, nxpk= 0, iat= 713, -1, r1= 1.30, r2= 1.80, r3= 5.52, r4= 6.02,
igr2=1203,1204,1205,
&end
#
# 47 SER HN 83 VAL QG1 5.50 (# 0.0000 2664:20 3.21,)
&rst
ixpk= 0, nxpk= 0, iat= 668, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2=1203,1204,1205,
&end
#
# 84 ARG HN 83 VAL QG1 4.50 (# 0.9857 2665:20 1.92,)
&rst
ixpk= 0, nxpk= 0, iat=1213, -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr2=1203,1204,1205,
&end
#
# 83 VAL HB 83 VAL QG1 3.30 (# 0.9584 2666:20 2.22,)
&rst
ixpk= 0, nxpk= 0, iat=1201, -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
igr2=1203,1204,1205,
&end
#
# 82 ALA HN 83 VAL QG1 6.50 (# 0.9034 2667:20 3.23,)
&rst
ixpk= 0, nxpk= 0, iat=1187, -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr2=1203,1204,1205,
&end
#
# 50 TRP HE1 83 VAL QG1 4.80 (# 0.0000 2668:20 2.36,)
&rst
ixpk= 0, nxpk= 0, iat= 715, -1, r1= 1.30, r2= 1.80, r3= 5.76, r4= 6.26,
igr2=1203,1204,1205,
&end
#
# 76 GLN HE21 72 ALA QB 5.00 (# 0.9994 2677:20 2.10,)
&rst
ixpk= 0, nxpk= 0, iat=1104, -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr2=1035,1036,1037,
&end
#
# 76 GLN HE22 72 ALA QB 5.00 (# 0.0000 2678:20 2.10,)
&rst
ixpk= 0, nxpk= 0, iat=1105, -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr2=1035,1036,1037,
&end
#
# 4 ILE HB 2 ALA QB 6.00 (# 0.0000 2679:20 4.38,)
&rst
ixpk= 0, nxpk= 0, iat= 47, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr2= 25, 26, 27,
&end
#
# 33 THR HN 2 ALA QB 5.00 (# 0.0000 2681:20 2.75,)
&rst
ixpk= 0, nxpk= 0, iat= 460, -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr2= 25, 26, 27,
&end
#
# 49 ILE HA 83 VAL QG2 6.00 (# 0.0000 2685:20 2.21,)
&rst
ixpk= 0, nxpk= 0, iat= 688, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr2=1207,1208,1209,
&end
#
# 30 GLY HN 29 ALA QB 4.50 (# 0.0000 2690:20 2.92,)
&rst
ixpk= 0, nxpk= 0, iat= 419, -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr2= 413, 414, 415,
&end
#
# 55 SER HA 90 ILE QG2 6.50 (# 0.0000 2694:20 2.02,)
&rst
ixpk= 0, nxpk= 0, iat= 796, -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr2=1306,1307,1308,
&end
#
# 130 ILE HA 130 ILE QG2 4.20 (# 0.9788 2698:20 2.73,)
&rst
ixpk= 0, nxpk= 0, iat=1910, -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr2=1914,1915,1916,
&end
#
# 6 LEU HB2 23 ALA QB 5.50 (# 0.9151 2704:20 3.65,)
&rst
ixpk= 0, nxpk= 0, iat= 80, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2= 317, 318, 319,
&end
#
# 50 TRP HA 4 ILE QG2 5.30 (# 0.0000 2709:20 3.67,)
&rst
ixpk= 0, nxpk= 0, iat= 707, -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
igr2= 49, 50, 51,
&end
#
# 88 ILE QG2 123 ILE QG2 4.20 (# 0.9952 2710:20 1.99,)
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 6.06, r4= 6.56,
igr1=1280,1281,1282,
igr2=1802,1803,1804,
&end
#
# 122 LYS HA 123 ILE QG2 6.50 (# 0.0000 2711:20 4.12,)
&rst
ixpk= 0, nxpk= 0, iat=1776, -1, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr2=1802,1803,1804,
&end
#
# 124 ASN HN 123 ILE QG2 5.80 (# 0.0000 2712:20 3.42,)
&rst
ixpk= 0, nxpk= 0, iat=1815, -1, r1= 1.30, r2= 1.80, r3= 6.97, r4= 7.47,
igr2=1802,1803,1804,
&end
#
# 8 SER HN 7 ILE QG2 5.00 (# 0.0000 2715:20 2.95,)
&rst
ixpk= 0, nxpk= 0, iat= 114, -1, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr2= 101, 102, 103,
&end
#
# 121 LEU QD2 88 ILE QG2 6.00 (# 0.9922 2722:20 1.99,)
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.65, r4= 9.15,
igr1=1768,1769,1770,
igr2=1280,1281,1282,
&end
#
# 7 ILE HG12 7 ILE QD1 3.20 (# 0.9974 2725:20 2.21,)
&rst
ixpk= 0, nxpk= 0, iat= 105, -1, r1= 1.30, r2= 1.80, r3= 3.84, r4= 4.34,
igr2= 108, 109, 110,
&end
#
# 90 ILE HA 90 ILE QD1 4.20 (# 0.9976 2734:20 1.99,)
&rst
ixpk= 0, nxpk= 0, iat=1302, -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr2=1313,1314,1315,
&end
#
# 49 ILE HA 49 ILE QD1 4.20 (# 0.0000 2740:20 2.04,)
&rst
ixpk= 0, nxpk= 0, iat= 688, -1, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr2= 699, 700, 701,
&end
#
# 4 ILE HG12 4 ILE QD1 3.30 (# 0.9963 2750:20 2.23,)
&rst
ixpk= 0, nxpk= 0, iat= 53, -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
igr2= 56, 57, 58,
&end
#
# 49 ILE HB 4 ILE QD1 4.50 (# 0.0000 2751:20 2.31,)
&rst
ixpk= 0, nxpk= 0, iat= 690, -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr2= 56, 57, 58,
&end
#
# 4 ILE HA 4 ILE QD1 5.50 (# 0.9593 2752:20 4.25,)
&rst
ixpk= 0, nxpk= 0, iat= 45, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2= 56, 57, 58,
&end
#
# 110 LYS HG2 110 LYS HA 3.50 (# 0.9566 2759:20 2.69,)
&rst
ixpk= 0, nxpk= 0, iat=1609,1604, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 46 ALA HN 45 PRO HA 3.20 (# 0.0000 2760:20 2.50,)
&rst
ixpk= 0, nxpk= 0, iat= 658, 654, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 45 PRO HB3 45 PRO HA 3.20 (# 0.9907 2761:20 2.30,)
&rst
ixpk= 0, nxpk= 0, iat= 652, 654, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 45 PRO HB2 45 PRO HA 3.20 (# 0.0000 2762:20 2.30,)
&rst
ixpk= 0, nxpk= 0, iat= 651, 654, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 4 ILE HN 3 ASP HB3 4.50 (# 0.0000 2778:20 3.27,)
&rst
ixpk= 0, nxpk= 0, iat= 43, 36, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 3 ASP HN 3 ASP HB3 3.50 (# 0.0000 2779:20 2.35,)
&rst
ixpk= 0, nxpk= 0, iat= 31, 36, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 4 ILE QD1 4 ILE HB 4.20 (# 0.9355 2782:20 2.42,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 47, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr1= 56, 57, 58,
&end
#
# 4 ILE HG12 4 ILE HB 3.50 (# 0.9984 2783:20 2.42,)
&rst
ixpk= 0, nxpk= 0, iat= 53, 47, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 4 ILE HG12 4 ILE HB 3.50 (# 0.9687 2784:20 2.42,)
&rst
ixpk= 0, nxpk= 0, iat= 53, 47, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 4 ILE HA 4 ILE HB 4.00 (# 0.9480 2785:20 3.01,)
&rst
ixpk= 0, nxpk= 0, iat= 45, 47, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 4 ILE HN 4 ILE HB 3.50 (# 0.0000 2786:20 2.60,)
&rst
ixpk= 0, nxpk= 0, iat= 43, 47, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 33 THR HA 4 ILE HB 3.50 (# 0.0000 2787:20 2.03,)
&rst
ixpk= 0, nxpk= 0, iat= 462, 47, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 4 ILE HA 4 ILE HG12 3.50 (# 0.9974 2794:20 2.37,)
&rst
ixpk= 0, nxpk= 0, iat= 45, 53, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 4 ILE HN 4 ILE HG12 4.50 (# 0.9935 2796:20 3.07,)
&rst
ixpk= 0, nxpk= 0, iat= 43, 53, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 31 PHE HB3 4 ILE QD1 6.00 (# 0.9400 2799:20 3.20,)
&rst
ixpk= 0, nxpk= 0, iat= 431, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr2= 56, 57, 58,
&end
#
# 4 ILE HN 4 ILE QD1 6.00 (# 0.0000 2800:20 4.66,)
&rst
ixpk= 0, nxpk= 0, iat= 43, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr2= 56, 57, 58,
&end
#
# 4 ILE HN 4 ILE QG2 5.50 (# 0.9729 2807:20 4.25,)
&rst
ixpk= 0, nxpk= 0, iat= 43, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2= 49, 50, 51,
&end
#
# 51 LEU QD1 4 ILE QG2 5.50 (# 0.0000 2808:20 1.98,)
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
igr1= 738, 739, 740,
igr2= 49, 50, 51,
&end
#
# 6 LEU HB2 6 LEU HA 3.50 (# 0.9270 2815:20 2.67,)
&rst
ixpk= 0, nxpk= 0, iat= 80, 78, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 6 LEU QD2 6 LEU HA 4.00 (# 0.9996 2816:20 1.99,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 78, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1= 89, 90, 91,
&end
#
# 6 LEU HB3 6 LEU HA 3.50 (# 0.9585 2817:20 2.67,)
&rst
ixpk= 0, nxpk= 0, iat= 81, 78, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 6 LEU HG 6 LEU HB2 3.20 (# 0.9962 2820:20 2.36,)
&rst
ixpk= 0, nxpk= 0, iat= 83, 80, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 6 LEU HB3 6 LEU HG 3.20 (# 0.9785 2824:20 2.36,)
&rst
ixpk= 0, nxpk= 0, iat= 81, 83, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 6 LEU HB2 6 LEU HG 3.20 (# 0.9740 2826:20 2.36,)
&rst
ixpk= 0, nxpk= 0, iat= 80, 83, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 51 LEU QD1 6 LEU QD2 6.00 (# 0.9729 2835:20 1.98,)
&rst
ixpk= 0, nxpk= 0, iat= -1, -1, r1= 1.30, r2= 1.80, r3= 8.65, r4= 9.15,
igr1= 738, 739, 740,
igr2= 89, 90, 91,
&end
#
# 7 ILE HG12 7 ILE HA 4.00 (# 0.9871 2838:20 2.44,)
&rst
ixpk= 0, nxpk= 0, iat= 105, 97, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 53 ILE QD1 7 ILE HA 6.00 (# 0.9044 2839:20 4.59,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 97, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr1= 777, 778, 779,
&end
#
# 8 SER HN 7 ILE HA 2.80 (# 0.0000 2843:20 2.15,)
&rst
ixpk= 0, nxpk= 0, iat= 114, 97, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30, &end
#
# 7 ILE HB 7 ILE HG12 3.50 (# 0.9704 2853:20 2.47,)
&rst
ixpk= 0, nxpk= 0, iat= 99, 105, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 7 ILE HA 7 ILE HG12 4.00 (# 0.0000 2857:20 2.44,)
&rst
ixpk= 0, nxpk= 0, iat= 97, 105, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 7 ILE HB 7 ILE HG12 3.50 (# 0.9704 2861:20 2.47,)
&rst
ixpk= 0, nxpk= 0, iat= 99, 105, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 7 ILE HA 7 ILE HG12 4.00 (# 0.0000 2862:20 2.44,)
&rst
ixpk= 0, nxpk= 0, iat= 97, 105, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 51 LEU HN 7 ILE QD1 5.50 (# 0.0000 2866:20 2.95,)
&rst
ixpk= 0, nxpk= 0, iat= 729, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr2= 108, 109, 110,
&end
#
# 41 LEU HN 7 ILE QG2 6.00 (# 0.9673 2871:20 3.36,)
&rst
ixpk= 0, nxpk= 0, iat= 579, -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr2= 101, 102, 103,
&end
#
# 10 SER HA 10 SER HB3 3.20 (# 0.0000 2886:20 2.27,)
&rst
ixpk= 0, nxpk= 0, iat= 134, 137, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 66 LEU HN 10 SER HB3 6.50 (# 0.9596 2887:20 3.27,)
&rst
ixpk= 0, nxpk= 0, iat= 931, 137, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00, &end
#
# 12 LEU HA 12 LEU HB2 3.50 (# 0.9912 2895:20 2.49,)
&rst
ixpk= 0, nxpk= 0, iat= 159, 161, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 41 LEU HN 40 LEU HB3 4.50 (# 0.0000 2897:20 1.90,)
&rst
ixpk= 0, nxpk= 0, iat= 579, 565, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 12 LEU HA 12 LEU HG 3.50 (# 0.0000 2900:20 2.23,)
&rst
ixpk= 0, nxpk= 0, iat= 159, 164, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 12 LEU HG 12 LEU QD1 3.30 (# 0.9958 2902:20 2.21,)
&rst
ixpk= 0, nxpk= 0, iat= 164, -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
igr2= 166, 167, 168,
&end
#
# 146 LEU HB2 146 LEU HG 3.50 (# 0.9874 2904:20 2.46,)
&rst
ixpk= 0, nxpk= 0, iat=2160,2163, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 13 GLY HN 13 GLY HA3 3.50 (# 0.9320 2907:20 2.35,)
&rst
ixpk= 0, nxpk= 0, iat= 176, 179, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 137 GLU HA 140 GLY HA3 5.50 (# 0.9493 2909:20 3.89,)
&rst
ixpk= 0, nxpk= 0, iat=2009,2068, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 16 GLU HG2 16 GLU HA 4.50 (# 0.9994 2920:20 2.04,)
&rst
ixpk= 0, nxpk= 0, iat= 207, 202, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 16 GLU HB3 16 GLU HG2 3.50 (# 0.0000 2925:20 2.21,)
&rst
ixpk= 0, nxpk= 0, iat= 205, 207, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 16 GLU HA 16 GLU HB2 3.50 (# 0.9891 2926:20 2.36,)
&rst
ixpk= 0, nxpk= 0, iat= 202, 204, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 16 GLU HA 16 GLU HB3 3.50 (# 0.0000 2927:20 2.36,)
&rst
ixpk= 0, nxpk= 0, iat= 202, 205, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 17 TYR HB3 17 TYR HA 3.50 (# 0.9920 2928:20 2.46,)
&rst
ixpk= 0, nxpk= 0, iat= 220, 217, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 18 VAL HN 17 TYR HA 4.50 (# 0.9842 2930:20 3.48,)
&rst
ixpk= 0, nxpk= 0, iat= 236, 217, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 18 VAL HB 18 VAL HA 3.50 (# 0.9896 2933:20 2.67,)
&rst
ixpk= 0, nxpk= 0, iat= 240, 238, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 21 HIS HB3 18 VAL HA 4.20 (# 0.0000 2934:20 2.55,)
&rst
ixpk= 0, nxpk= 0, iat= 282, 238, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 21 HIS HB2 18 VAL HA 4.20 (# 0.0000 2935:20 2.55,)
&rst
ixpk= 0, nxpk= 0, iat= 281, 238, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 17 TYR HN 18 VAL HA 6.50 (# 0.0000 2937:20 5.14,)
&rst
ixpk= 0, nxpk= 0, iat= 215, 238, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00, &end
#
# 19 ALA HA 18 VAL HA 5.80 (# 0.0000 2938:20 4.76,)
&rst
ixpk= 0, nxpk= 0, iat= 254, 238, r1= 1.30, r2= 1.80, r3= 5.80, r4= 6.30, &end
#
# 18 VAL HN 18 VAL HB 3.20 (# 0.9885 2939:20 2.30,)
&rst
ixpk= 0, nxpk= 0, iat= 236, 240, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 19 ALA HA 18 VAL QG2 5.80 (# 0.0000 2947:20 3.17,)
&rst
ixpk= 0, nxpk= 0, iat= 254, -1, r1= 1.30, r2= 1.80, r3= 6.97, r4= 7.47,
igr2= 246, 247, 248,
&end
#
# 22 LEU HB3 19 ALA HA 4.50 (# 0.9773 2954:20 2.81,)
&rst
ixpk= 0, nxpk= 0, iat= 299, 254, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 35 THR HA 19 ALA QB 4.50 (# 0.9443 2957:20 3.82,)
&rst
ixpk= 0, nxpk= 0, iat= 491, -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr2= 256, 257, 258,
&end
#
# 19 ALA QB 20 GLU HA 5.50 (# 0.9908 2962:20 3.72,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 264, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
igr1= 256, 257, 258,
&end
#
# 35 THR QG2 20 GLU HA 4.20 (# 0.9981 2964:20 2.03,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 264, r1= 1.30, r2= 1.80, r3= 5.04, r4= 5.54,
igr1= 495, 496, 497,
&end
#
# 21 HIS HN 20 GLU HA 4.20 (# 0.9842 2965:20 3.54,)
&rst
ixpk= 0, nxpk= 0, iat= 277, 264, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 20 GLU HN 20 GLU HA 3.30 (# 0.9813 2966:20 2.74,)
&rst
ixpk= 0, nxpk= 0, iat= 262, 264, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80, &end
#
# 20 GLU HN 20 GLU HA 3.30 (# 0.9813 2967:20 2.74,)
&rst
ixpk= 0, nxpk= 0, iat= 262, 264, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80, &end
#
# 100 GLY HN 99 CYS HA 3.30 (# 0.9542 2969:20 2.18,)
&rst
ixpk= 0, nxpk= 0, iat=1454,1445, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80, &end
#
# 35 THR QG2 20 GLU HG2 6.50 (# 0.0000 2971:20 3.52,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 269, r1= 1.30, r2= 1.80, r3= 7.81, r4= 8.31,
igr1= 495, 496, 497,
&end
#
# 21 HIS HB3 21 HIS HA 3.50 (# 0.0000 2972:20 2.38,)
&rst
ixpk= 0, nxpk= 0, iat= 282, 279, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 24 GLU HB3 21 HIS HA 4.20 (# 0.9977 2973:20 2.77,)
&rst
ixpk= 0, nxpk= 0, iat= 328, 279, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 18 VAL HN 21 HIS HB2 6.50 (# 0.0000 2977:20 5.08,)
&rst
ixpk= 0, nxpk= 0, iat= 236, 281, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00, &end
#
# 22 LEU HB2 22 LEU HA 3.50 (# 0.9895 2978:20 2.62,)
&rst
ixpk= 0, nxpk= 0, iat= 298, 296, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 22 LEU HB2 22 LEU HA 3.50 (# 0.9987 2979:20 2.62,)
&rst
ixpk= 0, nxpk= 0, iat= 298, 296, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 25 LYS HN 22 LEU HA 4.50 (# 0.0000 2982:20 3.46,)
&rst
ixpk= 0, nxpk= 0, iat= 338, 296, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 82 ALA HA 82 ALA QB 3.30 (# 0.9757 2992:20 2.22,)
&rst
ixpk= 0, nxpk= 0, iat=1189, -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
igr2=1191,1192,1193,
&end
#
# 25 LYS HN 24 GLU HA 4.50 (# 0.9763 2995:20 3.55,)
&rst
ixpk= 0, nxpk= 0, iat= 338, 325, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 21 HIS HA 24 GLU HB3 4.20 (# 0.9935 2996:20 2.77,)
&rst
ixpk= 0, nxpk= 0, iat= 279, 328, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 25 LYS HB3 25 LYS HA 3.50 (# 0.9708 2997:20 2.37,)
&rst
ixpk= 0, nxpk= 0, iat= 343, 340, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 25 LYS HN 25 LYS HA 3.50 (# 0.0000 3000:20 2.75,)
&rst
ixpk= 0, nxpk= 0, iat= 338, 340, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 25 LYS HN 25 LYS HB3 4.00 (# 0.0000 3002:20 2.33,)
&rst
ixpk= 0, nxpk= 0, iat= 338, 343, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 25 LYS HN 25 LYS HB2 4.00 (# 0.0000 3003:20 2.33,)
&rst
ixpk= 0, nxpk= 0, iat= 338, 342, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 26 LEU HN 25 LYS HB2 4.00 (# 0.9961 3004:20 2.14,)
&rst
ixpk= 0, nxpk= 0, iat= 360, 342, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 26 LEU HN 25 LYS HB3 4.00 (# 0.0000 3005:20 2.14,)
&rst
ixpk= 0, nxpk= 0, iat= 360, 343, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 25 LYS HB3 25 LYS HG2 3.20 (# 0.9987 3006:20 2.32,)
&rst
ixpk= 0, nxpk= 0, iat= 343, 345, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 25 LYS HG2 25 LYS HE3 4.20 (# 0.9752 3009:20 2.33,)
&rst
ixpk= 0, nxpk= 0, iat= 345, 352, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 26 LEU HN 26 LEU HA 3.50 (# 0.9950 3014:20 2.75,)
&rst
ixpk= 0, nxpk= 0, iat= 360, 362, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 26 LEU QD2 26 LEU HA 4.00 (# 0.9967 3015:20 1.92,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 362, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
igr1= 373, 374, 375,
&end
#
# 27 GLU HN 26 LEU HB2 4.00 (# 0.0000 3018:20 2.52,)
&rst
ixpk= 0, nxpk= 0, iat= 379, 364, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 78 PRO HA 78 PRO HG2 4.50 (# 0.0000 3021:20 3.85,)
&rst
ixpk= 0, nxpk= 0, iat=1141,1135, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 26 LEU HN 26 LEU QD2 4.50 (# 0.9950 3026:20 2.00,)
&rst
ixpk= 0, nxpk= 0, iat= 360, -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
igr2= 373, 374, 375,
&end
#
# 27 GLU HN 27 GLU HA 3.50 (# 0.0000 3030:20 2.79,)
&rst
ixpk= 0, nxpk= 0, iat= 379, 381, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 28 GLU HN 27 GLU HB3 4.00 (# 0.9842 3031:20 2.70,)
&rst
ixpk= 0, nxpk= 0, iat= 394, 384, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 30 GLY HN 28 GLU HA 4.50 (# 0.0000 3034:20 3.64,)
&rst
ixpk= 0, nxpk= 0, iat= 419, 396, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 28 GLU HG2 28 GLU HB3 3.20 (# 0.9690 3036:20 2.27,)
&rst
ixpk= 0, nxpk= 0, iat= 401, 399, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 29 ALA HN 28 GLU HB3 4.50 (# 0.0000 3038:20 3.23,)
&rst
ixpk= 0, nxpk= 0, iat= 409, 399, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 107 ALA HN 106 GLU HB2 4.00 (# 0.0000 3039:20 2.81,)
&rst
ixpk= 0, nxpk= 0, iat=1558,1547, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end
#
# 31 PHE HN 30 GLY HA2 4.50 (# 0.9889 3053:20 3.10,)
&rst
ixpk= 0, nxpk= 0, iat= 426, 421, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 31 PHE HN 30 GLY HA3 4.50 (# 0.9889 3054:20 3.10,)
&rst
ixpk= 0, nxpk= 0, iat= 426, 422, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 32 THR HN 32 THR HA 3.50 (# 0.0000 3059:20 2.93,)
&rst
ixpk= 0, nxpk= 0, iat= 446, 448, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 33 THR HN 32 THR HA 2.80 (# 0.0000 3061:20 2.22,)
&rst
ixpk= 0, nxpk= 0, iat= 460, 448, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30, &end
#
# 32 THR HB 32 THR HA 3.20 (# 0.9973 3062:20 2.58,)
&rst
ixpk= 0, nxpk= 0, iat= 450, 448, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 32 THR QG2 32 THR HA 3.50 (# 0.0000 3063:20 2.26,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 448, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
igr1= 452, 453, 454,
&end
#
# 3 ASP HN 33 THR HA 4.50 (# 0.9725 3068:20 3.03,)
&rst
ixpk= 0, nxpk= 0, iat= 31, 462, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 4 ILE HB 33 THR HA 3.20 (# 0.0000 3069:20 2.03,)
&rst
ixpk= 0, nxpk= 0, iat= 47, 462, r1= 1.30, r2= 1.80, r3= 3.20, r4= 3.70, &end
#
# 23 ALA QB 33 THR HB 6.00 (# 0.0000 3070:20 3.59,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 464, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
igr1= 317, 318, 319,
&end
#
# 33 THR HN 33 THR HB 4.50 (# 0.0000 3072:20 3.86,)
&rst
ixpk= 0, nxpk= 0, iat= 460, 464, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 35 THR HA 33 THR HB 6.50 (# 0.0000 3073:20 5.16,)
&rst
ixpk= 0, nxpk= 0, iat= 491, 464, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00, &end
#
# 34 GLU HA 33 THR HB 5.50 (# 0.0000 3074:20 4.62,)
&rst
ixpk= 0, nxpk= 0, iat= 476, 464, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 26 LEU HB2 33 THR HB 5.50 (# 0.9114 3075:20 3.62,)
&rst
ixpk= 0, nxpk= 0, iat= 364, 464, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 34 GLU HN 34 GLU HA 3.50 (# 0.0000 3080:20 2.94,)
&rst
ixpk= 0, nxpk= 0, iat= 474, 476, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 113 GLY HN 111 ASN HA 4.50 (# 0.9797 3081:20 3.66,)
&rst
ixpk= 0, nxpk= 0, iat=1649,1626, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, &end
#
# 34 GLU HG2 34 GLU HA 3.50 (# 0.9994 3083:20 2.02,)
&rst
ixpk= 0, nxpk= 0, iat= 481, 476, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
#
# 36 LEU QD2 34 GLU HB2 5.00 (# 0.9986 3086:20 1.98,)
&rst
ixpk= 0, nxpk= 0, iat= -1, 478, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,
igr1= 516, 517, 518,
&end
#
# 34 GLU HG3 34 GLU HB3 3.30 (# 0.0000 3087:20 2.21,)
&rst
ixpk= 0, nxpk= 0, iat= 482, 479, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80, &end
#
# 34 GLU HG3 34 GLU HB2 3.30 (# 0.0000 3088:20 2.21,)
&rst
ixpk= 0, nxpk= 0, iat= 482, 478, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80, &end
#
# 74 GLN HE22 74 GLN HG3 4.20 (# 0.0000 3091:20 2.27,)
&rst
ixpk= 0, nxpk= 0, iat=1073,1068, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70, &end
#
# 35 THR HN 34 GLU HG2 5.50 (# 0.0000 3097:20 3.63,)
&rst
ixpk= 0, nxpk= 0, iat= 489, 481, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end
#
# 5 THR HA 34 GLU HG2 6.50 (# 0.9332 3100:20 4.24,)
&rst
ixpk= 0, nxpk= 0, iat= 64, 481, r1= 1.30, r2= 1.80, r3= 6.50, r4= 7.00, &end
#
# 34 GLU HA 34 GLU HG3 3.50 (# 0.9939 3101:20 2.02,)
&rst
ixpk= 0, nxpk= 0, iat= 476, 482, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end
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