NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
534745 | 2li7 | 17882 | cing | 1-original | 1 | AMBER | distance | NOE | simple |
# # 40 TYR QE 47 TRP HE1 5.47 &rst ixpk= 0, nxpk= 0, iat= -1, 705, r1= 1.30, r2= 1.80, r3= 6.14, r4= 6.64, rk2=20.0, rk3=20.0, ir6=1, ialtd=0, igr1= 603, 610, &end # # 2 GLU HA 47 TRP HE1 5.50 &rst ixpk= 0, nxpk= 0, iat= 28, 705, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end # # 2 GLU HB2 47 TRP HE1 3.41 &rst ixpk= 0, nxpk= 0, iat= 30, 705, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91, &end # # 2 GLU HB3 47 TRP HE1 3.41 &rst ixpk= 0, nxpk= 0, iat= 31, 705, r1= 1.30, r2= 1.80, r3= 3.41, r4= 3.91, &end # # 6 VAL QG2 58 TRP HE1 5.47 &rst ixpk= 0, nxpk= 0, iat= -1, 884, r1= 1.30, r2= 1.80, r3= 6.57, r4= 7.07, igr1= 98, 99, 100, &end # # 46 CYSS HA 47 TRP HN 2.57 &rst ixpk= 0, nxpk= 0, iat= 687, 695, r1= 1.30, r2= 1.80, r3= 2.57, r4= 3.07, &end # # 41 CYSS HA 47 TRP HN 4.09 &rst ixpk= 0, nxpk= 0, iat= 616, 695, r1= 1.30, r2= 1.80, r3= 4.09, r4= 4.59, &end # # 47 TRP HN 47 TRP HB2 3.62 &rst ixpk= 0, nxpk= 0, iat= 695, 699, r1= 1.30, r2= 1.80, r3= 3.62, r4= 4.12, &end # # 42 TYR HB3 47 TRP HN 5.50 &rst ixpk= 0, nxpk= 0, iat= 629, 695, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end # # 47 TRP HN 47 TRP HB3 3.42 &rst ixpk= 0, nxpk= 0, iat= 695, 700, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92, &end # # 42 TYR HN 45 ALA HN 5.30 &rst ixpk= 0, nxpk= 0, iat= 624, 675, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80, &end # # 4 TYR QE 42 TYR HN 5.50 &rst ixpk= 0, nxpk= 0, iat= -1, 624, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67, igr1= 58, 65, &end # # 42 TYR HN 42 TYR HB3 3.43 &rst ixpk= 0, nxpk= 0, iat= 624, 629, r1= 1.30, r2= 1.80, r3= 3.43, r4= 3.93, &end # # 42 TYR HN 47 TRP HB3 5.50 &rst ixpk= 0, nxpk= 0, iat= 624, 700, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end # # 20 GLY HN 41 CYSS HN 5.50 &rst ixpk= 0, nxpk= 0, iat= 307, 614, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end # # 14 TYR HN 46 CYSS HN 5.50 &rst ixpk= 0, nxpk= 0, iat= 201, 685, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end # # 41 CYSS HN 41 CYSS HB3 3.72 &rst ixpk= 0, nxpk= 0, iat= 614, 619, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22, &end # # 41 CYSS HN 41 CYSS HB2 3.72 &rst ixpk= 0, nxpk= 0, iat= 614, 618, r1= 1.30, r2= 1.80, r3= 3.72, r4= 4.22, &end # # 14 TYR HN 14 TYR QB 3.12 &rst ixpk= 0, nxpk= 0, iat= 201, -1, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, igr2= 205, 206, &end # # 13 LYS HB3 14 TYR HN 3.11 &rst ixpk= 0, nxpk= 0, iat= 184, 201, r1= 1.30, r2= 1.80, r3= 3.11, r4= 3.61, &end # # 7 SER HA 8 LYS HN 2.59 &rst ixpk= 0, nxpk= 0, iat= 106, 115, r1= 1.30, r2= 1.80, r3= 2.59, r4= 3.09, &end # # 8 LYS HN 8 LYS HB2 3.50 &rst ixpk= 0, nxpk= 0, iat= 115, 119, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00, &end # # 8 LYS HN 8 LYS QD 4.87 &rst ixpk= 0, nxpk= 0, iat= 115, -1, r1= 1.30, r2= 1.80, r3= 5.47, r4= 5.97, igr2= 125, 126, &end # # 4 TYR HN 4 TYR QD 4.58 &rst ixpk= 0, nxpk= 0, iat= 48, -1, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64, igr2= 56, 65, &end # # 4 TYR HN 57 VAL HB 4.17 &rst ixpk= 0, nxpk= 0, iat= 48, 862, r1= 1.30, r2= 1.80, r3= 4.17, r4= 4.67, &end # # 3 GLY HA2 4 TYR HN 3.44 &rst ixpk= 0, nxpk= 0, iat= 43, 48, r1= 1.30, r2= 1.80, r3= 3.44, r4= 3.94, &end # # 4 TYR HN 4 TYR HB3 3.39 &rst ixpk= 0, nxpk= 0, iat= 48, 53, r1= 1.30, r2= 1.80, r3= 3.39, r4= 3.89, &end # # 21 ASP HA 22 ASN HN 2.73 &rst ixpk= 0, nxpk= 0, iat= 316, 326, r1= 1.30, r2= 1.80, r3= 2.73, r4= 3.23, &end # # 21 ASP HN 22 ASN HN 5.50 &rst ixpk= 0, nxpk= 0, iat= 314, 326, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end # # 19 LEU HA 20 GLY HN 2.84 &rst ixpk= 0, nxpk= 0, iat= 290, 307, r1= 1.30, r2= 1.80, r3= 2.84, r4= 3.34, &end # # 19 LEU QD1 20 GLY HN 5.50 &rst ixpk= 0, nxpk= 0, iat= -1, 307, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11, igr1= 297, 298, 299, &end # # 19 LEU HG 20 GLY HN 5.02 &rst ixpk= 0, nxpk= 0, iat= 295, 307, r1= 1.30, r2= 1.80, r3= 5.02, r4= 5.52, &end # # 22 ASN HA 23 ASP HN 2.90 &rst ixpk= 0, nxpk= 0, iat= 328, 340, r1= 1.30, r2= 1.80, r3= 2.90, r4= 3.40, &end # # 23 ASP HN 24 TYR HN 4.35 &rst ixpk= 0, nxpk= 0, iat= 340, 352, r1= 1.30, r2= 1.80, r3= 4.35, r4= 4.85, &end # # 43 ALA HN 43 ALA QB 3.42 &rst ixpk= 0, nxpk= 0, iat= 645, -1, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61, igr2= 649, 650, 651, &end # # 40 TYR HN 47 TRP HN 3.67 &rst ixpk= 0, nxpk= 0, iat= 593, 695, r1= 1.30, r2= 1.80, r3= 3.67, r4= 4.17, &end # # 40 TYR HN 40 TYR QD 3.97 &rst ixpk= 0, nxpk= 0, iat= 593, -1, r1= 1.30, r2= 1.80, r3= 4.46, r4= 4.96, igr2= 601, 610, &end # # 39 GLY HA2 40 TYR HN 2.72 &rst ixpk= 0, nxpk= 0, iat= 588, 593, r1= 1.30, r2= 1.80, r3= 2.72, r4= 3.22, &end # # 40 TYR HN 48 CYSS HA 4.69 &rst ixpk= 0, nxpk= 0, iat= 593, 721, r1= 1.30, r2= 1.80, r3= 4.69, r4= 5.19, &end # # 40 TYR HN 46 CYSS HA 5.50 &rst ixpk= 0, nxpk= 0, iat= 593, 687, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end # # 40 TYR HN 47 TRP HB2 5.50 &rst ixpk= 0, nxpk= 0, iat= 593, 699, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end # # 40 TYR HN 47 TRP HB3 5.50 &rst ixpk= 0, nxpk= 0, iat= 593, 700, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end # # 49 THR HA 50 HIS HN 2.71 &rst ixpk= 0, nxpk= 0, iat= 731, 743, r1= 1.30, r2= 1.80, r3= 2.71, r4= 3.21, &end # # 50 HIS HN 50 HIS HA 2.64 &rst ixpk= 0, nxpk= 0, iat= 743, 745, r1= 1.30, r2= 1.80, r3= 2.64, r4= 3.14, &end # # 64 THR HA 65 CYSS HN 2.80 &rst ixpk= 0, nxpk= 0, iat= 983, 995, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30, &end # # 65 CYSS HN 65 CYSS HB3 3.75 &rst ixpk= 0, nxpk= 0, iat= 995,1000, r1= 1.30, r2= 1.80, r3= 3.75, r4= 4.25, &end # # 46 CYSS HN 47 TRP HN 5.50 &rst ixpk= 0, nxpk= 0, iat= 685, 695, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end # # 45 ALA HA 46 CYSS HN 2.88 &rst ixpk= 0, nxpk= 0, iat= 677, 685, r1= 1.30, r2= 1.80, r3= 2.88, r4= 3.38, &end # # 15 GLU HA 46 CYSS HN 4.75 &rst ixpk= 0, nxpk= 0, iat= 224, 685, r1= 1.30, r2= 1.80, r3= 4.75, r4= 5.25, &end # # 46 CYSS HN 46 CYSS HB2 3.44 &rst ixpk= 0, nxpk= 0, iat= 685, 689, r1= 1.30, r2= 1.80, r3= 3.44, r4= 3.94, &end # # 45 ALA QB 46 CYSS HN 3.11 &rst ixpk= 0, nxpk= 0, iat= -1, 685, r1= 1.30, r2= 1.80, r3= 3.73, r4= 4.23, igr1= 679, 680, 681, &end # # 46 CYSS HN 46 CYSS HB3 3.44 &rst ixpk= 0, nxpk= 0, iat= 685, 690, r1= 1.30, r2= 1.80, r3= 3.44, r4= 3.94, &end # # 16 CYSS HN 46 CYSS HN 5.50 &rst ixpk= 0, nxpk= 0, iat= 237, 685, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end # # 26 LEU HA 29 CYSS HN 5.50 &rst ixpk= 0, nxpk= 0, iat= 385, 441, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end # # 28 GLU HB2 29 CYSS HN 4.00 &rst ixpk= 0, nxpk= 0, iat= 430, 441, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end # # 28 GLU HB3 29 CYSS HN 4.00 &rst ixpk= 0, nxpk= 0, iat= 431, 441, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, &end # # 5 LEU QD2 29 CYSS HN 5.50 &rst ixpk= 0, nxpk= 0, iat= -1, 441, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11, igr1= 82, 83, 84, &end # # 53 GLU HN 54 GLN HN 3.71 &rst ixpk= 0, nxpk= 0, iat= 800, 815, r1= 1.30, r2= 1.80, r3= 3.71, r4= 4.21, &end # # 52 TYR HA 53 GLU HN 3.11 &rst ixpk= 0, nxpk= 0, iat= 781, 800, r1= 1.30, r2= 1.80, r3= 3.11, r4= 3.61, &end # # 52 TYR HB3 53 GLU HN 3.81 &rst ixpk= 0, nxpk= 0, iat= 784, 800, r1= 1.30, r2= 1.80, r3= 3.81, r4= 4.31, &end # # 65 CYSS HB2 66 ASN HN 4.76 &rst ixpk= 0, nxpk= 0, iat= 999,1005, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26, &end # # 53 GLU HN 53 GLU QG 3.44 &rst ixpk= 0, nxpk= 0, iat= 800, -1, r1= 1.30, r2= 1.80, r3= 3.86, r4= 4.36, igr2= 807, 808, &end # # 53 GLU HN 53 GLU QB 2.82 &rst ixpk= 0, nxpk= 0, iat= 800, -1, r1= 1.30, r2= 1.80, r3= 3.17, r4= 3.67, igr2= 804, 805, &end # # 66 ASN HN 66 ASN QB 3.08 &rst ixpk= 0, nxpk= 0, iat=1005, -1, r1= 1.30, r2= 1.80, r3= 3.46, r4= 3.96, igr2=1009,1010, &end # # 48 CYSS HN 48 CYSS HB2 3.56 &rst ixpk= 0, nxpk= 0, iat= 719, 723, r1= 1.30, r2= 1.80, r3= 3.56, r4= 4.06, &end # # 47 TRP HA 48 CYSS HN 3.17 &rst ixpk= 0, nxpk= 0, iat= 697, 719, r1= 1.30, r2= 1.80, r3= 3.17, r4= 3.67, &end # # 34 GLY HA3 35 LYS HN 3.02 &rst ixpk= 0, nxpk= 0, iat= 531, 535, r1= 1.30, r2= 1.80, r3= 3.02, r4= 3.52, &end # # 34 GLY HA2 35 LYS HN 3.02 &rst ixpk= 0, nxpk= 0, iat= 530, 535, r1= 1.30, r2= 1.80, r3= 3.02, r4= 3.52, &end # # 35 LYS HN 35 LYS QB 2.81 &rst ixpk= 0, nxpk= 0, iat= 535, -1, r1= 1.30, r2= 1.80, r3= 3.15, r4= 3.65, igr2= 539, 540, &end # # 35 LYS HN 35 LYS QG 3.24 &rst ixpk= 0, nxpk= 0, iat= 535, -1, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14, igr2= 542, 543, &end # # 56 VAL HN 57 VAL HN 5.50 &rst ixpk= 0, nxpk= 0, iat= 842, 858, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end # # 55 ALA QB 56 VAL HN 3.66 &rst ixpk= 0, nxpk= 0, iat= -1, 842, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90, igr1= 836, 837, 838, &end # # 56 VAL HN 57 VAL QG2 5.50 &rst ixpk= 0, nxpk= 0, iat= 842, -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11, igr2= 868, 869, 870, &end # # 56 VAL HN 56 VAL HB 3.19 &rst ixpk= 0, nxpk= 0, iat= 842, 846, r1= 1.30, r2= 1.80, r3= 3.19, r4= 3.69, &end # # 6 VAL QG2 58 TRP HN 5.50 &rst ixpk= 0, nxpk= 0, iat= -1, 874, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11, igr1= 98, 99, 100, &end # # 57 VAL QG2 58 TRP HN 4.71 &rst ixpk= 0, nxpk= 0, iat= -1, 874, r1= 1.30, r2= 1.80, r3= 5.66, r4= 6.16, igr1= 868, 869, 870, &end # # 57 VAL HA 58 TRP HN 3.32 &rst ixpk= 0, nxpk= 0, iat= 860, 874, r1= 1.30, r2= 1.80, r3= 3.32, r4= 3.82, &end # # 58 TRP HN 58 TRP HB3 3.42 &rst ixpk= 0, nxpk= 0, iat= 874, 879, r1= 1.30, r2= 1.80, r3= 3.42, r4= 3.92, &end # # 58 TRP HN 58 TRP HB2 2.97 &rst ixpk= 0, nxpk= 0, iat= 874, 878, r1= 1.30, r2= 1.80, r3= 2.97, r4= 3.47, &end # # 21 ASP HN 21 ASP HB2 3.77 &rst ixpk= 0, nxpk= 0, iat= 314, 318, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27, &end # # 6 VAL QG1 58 TRP HN 4.05 &rst ixpk= 0, nxpk= 0, iat= -1, 874, r1= 1.30, r2= 1.80, r3= 4.86, r4= 5.36, igr1= 94, 95, 96, &end # # 16 CYSS HA 17 LEU HN 3.09 &rst ixpk= 0, nxpk= 0, iat= 239, 247, r1= 1.30, r2= 1.80, r3= 3.09, r4= 3.59, &end # # 63 LYS HA 64 THR HN 2.57 &rst ixpk= 0, nxpk= 0, iat= 961, 981, r1= 1.30, r2= 1.80, r3= 2.57, r4= 3.07, &end # # 63 LYS QG 64 THR HN 4.26 &rst ixpk= 0, nxpk= 0, iat= -1, 981, r1= 1.30, r2= 1.80, r3= 4.78, r4= 5.28, igr1= 966, 967, &end # # 64 THR HN 64 THR QG2 4.64 &rst ixpk= 0, nxpk= 0, iat= 981, -1, r1= 1.30, r2= 1.80, r3= 5.57, r4= 6.07, igr2= 987, 988, 989, &end # # 64 THR HN 64 THR HB 3.51 &rst ixpk= 0, nxpk= 0, iat= 981, 985, r1= 1.30, r2= 1.80, r3= 3.51, r4= 4.01, &end # # 16 CYSS HA 18 LYS HN 5.50 &rst ixpk= 0, nxpk= 0, iat= 239, 266, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end # # 35 LYS QG 36 SER HN 3.65 &rst ixpk= 0, nxpk= 0, iat= -1, 557, r1= 1.30, r2= 1.80, r3= 4.10, r4= 4.60, igr1= 542, 543, &end # # 35 LYS HN 36 SER HN 3.29 &rst ixpk= 0, nxpk= 0, iat= 535, 557, r1= 1.30, r2= 1.80, r3= 3.29, r4= 3.79, &end # # 35 LYS QB 36 SER HN 3.90 &rst ixpk= 0, nxpk= 0, iat= -1, 557, r1= 1.30, r2= 1.80, r3= 4.38, r4= 4.88, igr1= 539, 540, &end # # 36 SER HN 36 SER HB3 3.64 &rst ixpk= 0, nxpk= 0, iat= 557, 562, r1= 1.30, r2= 1.80, r3= 3.64, r4= 4.14, &end # # 10 THR HN 11 GLY HN 3.21 &rst ixpk= 0, nxpk= 0, iat= 148, 162, r1= 1.30, r2= 1.80, r3= 3.21, r4= 3.71, &end # # 6 VAL QG2 11 GLY HN 5.28 &rst ixpk= 0, nxpk= 0, iat= -1, 162, r1= 1.30, r2= 1.80, r3= 6.34, r4= 6.84, igr1= 98, 99, 100, &end # # 10 THR QG2 11 GLY HN 5.50 &rst ixpk= 0, nxpk= 0, iat= -1, 162, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11, igr1= 154, 155, 156, &end # # 7 SER HB2 11 GLY HN 5.50 &rst ixpk= 0, nxpk= 0, iat= 108, 162, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, &end # # 28 GLU HN 29 CYSS HN 3.18 &rst ixpk= 0, nxpk= 0, iat= 426, 441, r1= 1.30, r2= 1.80, r3= 3.18, r4= 3.68, &end # 1020 atoms read from pdb file csii.amb.pdb.
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