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