NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
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11724 |
1rxr   |
4153 | cing | 1-original | 1 | AMBER | dihedral angle |
# 1354 atoms read from pdb file rxrad.pdb.
# 2 THR PHI: (1 PHE C) - (2 THR N) - (2 THR CA) - (2 THR C) -160.0 -80.0
&rst iat = 19, 21, 23, 33,
r1 = -170.0, r2 = -160.0, r3 = -80.0, r4 = -70.0, &end
# 6 CYS PHI: (5 ILE C) - (6 CYS N) - (6 CYS CA) - (6 CYS C) -90.0 -40.0
&rst iat = 91, 93, 95, 101,
r1 = -100.0, r2 = -90.0, r3 = -40.0, r4 = -30.0,
rk2 = 32.0, rk3 = 32.0, &end
# 7 ALA PHI: (6 CYS C) - (7 ALA N) - (7 ALA CA) - (7 ALA C) -90.0 -40.0
&rst iat = 101, 103, 105, 111,
r1 = -100.0, r2 = -90.0, r3 = -40.0, r4 = -30.0, &end
# 9 CYS PHI: (8 ILE C) - (9 CYS N) - (9 CYS CA) - (9 CYS C) -160.0 -80.0
&rst iat = 130, 132, 134, 140,
r1 = -170.0, r2 = -160.0, r3 = -80.0, r4 = -70.0, &end
# 11 ASP PHI: (10 GLY C) - (11 ASP N) - (11 ASP CA) - (11 ASP C) -90.0 -40.0
&rst iat = 147, 149, 151, 159,
r1 = -100.0, r2 = -90.0, r3 = -40.0, r4 = -30.0, &end
# 12 ARG PHI: (11 ASP C) - (12 ARG N) - (12 ARG CA) - (12 ARG C) -90.0 -40.0
&rst iat = 159, 161, 163, 183,
r1 = -100.0, r2 = -90.0, r3 = -40.0, r4 = -30.0, &end
# 14 SER PHI: (13 SER C) - (14 SER N) - (14 SER CA) - (14 SER C) -160.0 -80.0
&rst iat = 194, 196, 198, 205,
r1 = -170.0, r2 = -160.0, r3 = -80.0, r4 = -70.0, &end
# 17 HIS PHI: (16 LYS C) - (17 HIS N) - (17 HIS CA) - (17 HIS C) -160.0 -80.0
&rst iat = 234, 236, 238, 251,
r1 = -170.0, r2 = -160.0, r3 = -80.0, r4 = -70.0, &end
# 20 VAL PHI: (19 GLY C) - (20 VAL N) - (20 VAL CA) - (20 VAL C) -160.0 -80.0
&rst iat = 279, 281, 283, 295,
r1 = -170.0, r2 = -160.0, r3 = -80.0, r4 = -70.0, &end
# 21 TYR PHI: (20 VAL C) - (21 TYR N) - (21 TYR CA) - (21 TYR C) -90.0 -40.0
&rst iat = 295, 297, 299, 316,
r1 = -100.0, r2 = -90.0, r3 = -40.0, r4 = -30.0, &end
# 22 SER PHI: (21 TYR C) - (22 SER N) - (22 SER CA) - (22 SER C) -160.0 -80.0
&rst iat = 316, 318, 320, 327,
r1 = -170.0, r2 = -160.0, r3 = -80.0, r4 = -70.0, &end
# 26 CYS PHI: (25 GLY C) - (26 CYS N) - (26 CYS CA) - (26 CYS C) -90.0 -40.0
&rst iat = 359, 361, 363, 369,
r1 = -100.0, r2 = -90.0, r3 = -40.0, r4 = -30.0, &end
# 27 LYS PHI: (26 CYS C) - (27 LYS N) - (27 LYS CA) - (27 LYS C) -90.0 -40.0
&rst iat = 369, 371, 373, 391,
r1 = -100.0, r2 = -90.0, r3 = -40.0, r4 = -30.0, &end
# 29 PHE PHI: (28 GLY C) - (29 PHE N) - (29 PHE CA) - (29 PHE C) -90.0 -40.0
&rst iat = 398, 400, 402, 418,
r1 = -100.0, r2 = -90.0, r3 = -40.0, r4 = -30.0, &end
# 30 PHE PHI: (29 PHE C) - (30 PHE N) - (30 PHE CA) - (30 PHE C) -90.0 -40.0
&rst iat = 418, 420, 422, 438,
r1 = -100.0, r2 = -90.0, r3 = -40.0, r4 = -30.0, &end
# 32 ARG PHI: (31 LYS C) - (32 ARG N) - (32 ARG CA) - (32 ARG C) -90.0 -40.0
&rst iat = 460, 462, 464, 484,
r1 = -100.0, r2 = -90.0, r3 = -40.0, r4 = -30.0, &end
# 33 THR PHI: (32 ARG C) - (33 THR N) - (33 THR CA) - (33 THR C) -90.0 -40.0
&rst iat = 484, 486, 488, 498,
r1 = -100.0, r2 = -90.0, r3 = -40.0, r4 = -30.0, &end
# 35 ARG PHI: (34 VAL C) - (35 ARG N) - (35 ARG CA) - (35 ARG C) -90.0 -40.0
&rst iat = 514, 516, 518, 538,
r1 = -100.0, r2 = -90.0, r3 = -40.0, r4 = -30.0, &end
# 38 LYS PHI: (37 ASP C) - (38 LEU N) - (38 LEU CA) - (38 LEU C) -90.0 -40.0
&rst iat = 572, 574, 576, 591,
r1 = -100.0, r2 = -90.0, r3 = -40.0, r4 = -30.0, &end
# 40 TYR PHI: (39 THR C) - (40 TYR N) - (40 TYR CA) - (40 TYR C) -160.0 -80.0
&rst iat = 605, 607, 609, 626,
r1 = -170.0, r2 = -160.0, r3 = -80.0, r4 = -70.0, &end
# 41 THR PHI: (40 TYR C) - (41 THR N) - (41 THR CA) - (41 THR C) -160.0 -80.0
&rst iat = 626, 628, 630, 640,
r1 = -170.0, r2 = -160.0, r3 = -80.0, r4 = -70.0, &end
# 42 CYS PHI: (41 THR C) - (42 CYS N) - (42 CYS CA) - (42 CYS C) -160.0 -80.0
&rst iat = 640, 642, 644, 650,
r1 = -170.0, r2 = -160.0, r3 = -80.0, r4 = -70.0, &end
# 44 ASP PHI: (43 ARG C) - (44 ASP N) - (44 ASP CA) - (44 ASP C) -160.0 -80.0
&rst iat = 674, 676, 678, 686,
r1 = -170.0, r2 = -160.0, r3 = -80.0, r4 = -70.0, &end
# 45 ASN PHI: (44 ASP C) - (45 ASN N) - (45 ASN CA) - (45 ASN C) -160.0 -80.0
&rst iat = 686, 688, 690, 700,
r1 = -170.0, r2 = -160.0, r3 = -80.0, r4 = -70.0, &end
# 47 ASP PHI: (46 LYS C) - (47 ASP N) - (47 ASP CA) - (47 ASP C) -160.0 -80.0
&rst iat = 722, 724, 726, 734,
r1 = -170.0, r2 = -160.0, r3 = -80.0, r4 = -70.0, &end
# 52 LYS PHI: (51 ASP C) - (52 LYS N) - (52 LYS CA) - (52 LYS C) -90.0 -40.0
&rst iat = 794, 796, 798, 816,
r1 = -100.0, r2 = -90.0, r3 = -40.0, r4 = -30.0, &end
# 60 TYR PHI: (59 GLN C) - (60 TYR N) - (60 TYR CA) - (60 TYR C) -90.0 -40.0
&rst iat = 946, 948, 950, 967,
r1 = -100.0, r2 = -90.0, r3 = -40.0, r4 = -30.0, &end
# 61 CYS PHI: (60 TYR C) - (61 CYS N) - (61 CYS CA) - (61 CYS C) -90.0 -40.0
&rst iat = 967, 969, 971, 977,
r1 = -100.0, r2 = -90.0, r3 = -40.0, r4 = -30.0, &end
# 62 ARG PHI: (61 CYS C) - (62 ARG N) - (62 ARG CA) - (62 ARG C) -90.0 -40.0
&rst iat = 977, 979, 981, 1001,
r1 = -100.0, r2 = -90.0, r3 = -40.0, r4 = -30.0, &end
# 63 TYR PHI: (62 ARG C) - (63 TYR N) - (63 TYR CA) - (63 TYR C) -90.0 -40.0
&rst iat = 1001, 1003, 1005, 1022,
r1 = -100.0, r2 = -90.0, r3 = -40.0, r4 = -30.0, &end
# 64 GLN PHI: (63 TYR C) - (64 GLN N) - (64 GLN CA) - (64 GLN C) -90.0 -40.0
&rst iat = 1022, 1024, 1026, 1039,
r1 = -100.0, r2 = -90.0, r3 = -40.0, r4 = -30.0, &end
# 65 LYS PHI: (64 GLN C) - (65 LYS N) - (65 LYS CA) - (65 LYS C) -90.0 -40.0
&rst iat = 1039, 1041, 1043, 1061,
r1 = -100.0, r2 = -90.0, r3 = -40.0, r4 = -30.0, &end
# 66 ALA PHI: (65 LYS C) - (66 ALA N) - (66 ALA CA) - (66 ALA C) -90.0 -40.0
&rst iat = 1061, 1063, 1065, 1071,
r1 = -100.0, r2 = -90.0, r3 = -40.0, r4 = -30.0, &end
# 67 LYS PHI: (66 ALA C) - (67 LEU N) - (67 LEU CA) - (67 LEU C) -90.0 -40.0
&rst iat = 1071, 1073, 1075, 1090,
r1 = -100.0, r2 = -90.0, r3 = -40.0, r4 = -30.0, &end
# 68 ALA PHI: (67 LEU C) - (68 ALA N) - (68 ALA CA) - (68 ALA C) -90.0 -40.0
&rst iat = 1090, 1092, 1094, 1100,
r1 = -100.0, r2 = -90.0, r3 = -40.0, r4 = -30.0, &end
# 71 MET PHI: (70 GLY C) - (71 MET N) - (71 MET CA) - (71 MET C) -90.0 -40.0
&rst iat = 1126, 1128, 1130, 1145,
r1 = -100.0, r2 = -90.0, r3 = -40.0, r4 = -30.0, &end
# 74 GLU PHI: (73 ARG C) - (74 GLU N) - (74 GLU CA) - (74 GLU C) -90.0 -40.0
&rst iat = 1191, 1193, 1195, 1206,
r1 = -100.0, r2 = -90.0, r3 = -40.0, r4 = -30.0, &end
# 77 GLN PHI: (76 VAL C) - (77 GLN N) - (77 GLN CA) - (77 GLN C) -90.0 -40.0
&rst iat = 1232, 1234, 1236, 1249,
r1 = -100.0, r2 = -90.0, r3 = -40.0, r4 = -30.0, &end
# 78 GLU PHI: (77 GLN C) - (78 GLU N) - (78 GLU CA) - (78 GLU C) -90.0 -40.0
&rst iat = 1249, 1251, 1253, 1264,
r1 = -100.0, r2 = -90.0, r3 = -40.0, r4 = -30.0, &end
# 79 GLU PHI: (78 GLU C) - (79 GLU N) - (79 GLU CA) - (79 GLU C) -90.0 -40.0
&rst iat = 1264, 1266, 1268, 1279,
r1 = -100.0, r2 = -90.0, r3 = -40.0, r4 = -30.0, &end
# 82 ARG PHI: (81 GLN C) - (82 ARG N) - (82 ARG CA) - (82 ARG C) -90.0 -40.0
&rst iat = 1320, 1322, 1324, 1344,
r1 = -100.0, r2 = -90.0, r3 = -40.0, r4 = -30.0, &end
# 82 ARG PHI: (81 GLN C) - (82 ARG N) - (82 ARG CA) - (82 ARG C) -90.0 -40.0
&rst iat = 1320, 1322, 1324, 1344,
r1 = -100.0, r2 = -90.0, r3 = -40.0, r4 = -30.0, &end
# 1354 atoms read from pdb file rxr.pdb.
# 6 CYS CHI1: (6 CYS N) - (6 CYS CA) - (6 CYS CB) - (6 CYS SG) 150.0 210.0
&rst iat = 93, 95, 97, 100,
r1 = 140.0, r2 = 150.0, r3 = 210.0, r4 = 220.0, &end
# 8 ILE CHI1: (8 ILE N) - (8 ILE CA) - (8 ILE CB) - (8 ILE CG1) -90.0 -30.0
&rst iat = 113, 115, 117, 123,
r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0,
rk2 = 32.0, rk3 = 32.0, &end
# 11 ASP CHI1: (11 ASP N) - (11 ASP CA) - (11 ASP CB) - (11 ASP CG) -90.0 -30.0
&rst iat = 149, 151, 153, 156,
r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0, &end
# 17 HIS CHI1: (17 HIS N) - (17 HIS CA) - (17 HIS CB) - (17 HIS CG) -90.0 -30.0
&rst iat = 236, 238, 240, 243,
r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0, &end
# 18 TYR CHI1: (18 TYR N) - (18 TYR CA) - (18 TYR CB) - (18 TYR CG) -90.0 -30.0
&rst iat = 253, 255, 257, 260,
r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0, &end
# 26 CYS CHI1: (26 CYS N) - (26 CYS CA) - (26 CYS CB) - (26 CYS SG) -90.0 -30.0
&rst iat = 361, 363, 365, 368,
r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0, &end
# 32 ARG CHI1: (32 ARG N) - (32 ARG CA) - (32 ARG CB) - (32 ARG CG) -90.0 -30.0
&rst iat = 462, 464, 466, 469,
r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0, &end
# 34 VAL CHI1: (34 VAL N) - (34 VAL CA) - (34 VAL CB) - (34 VAL CG1) 150.0 210.0
&rst iat = 500, 502, 504, 506,
r1 = 140.0, r2 = 150.0, r3 = 210.0, r4 = 220.0, &end
# 35 ARG CHI1: (35 ARG N) - (35 ARG CA) - (35 ARG CB) - (35 ARG CG) -90.0 -30.0
&rst iat = 516, 518, 520, 523,
r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0, &end
# 36 LYS CHI1: (36 LYS N) - (36 LYS CA) - (36 LYS CB) - (36 LYS CG) -90.0 -30.0
&rst iat = 540, 542, 544, 547,
r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0, &end
# 40 TYR CHI1: (40 TYR N) - (40 TYR CA) - (40 TYR CB) - (40 TYR CG) -90.0 -30.0
# &rst iat = 607, 609, 611, 614,
# r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0, &end
# 42 CYS CHI1: (42 CYS N) - (42 CYS CA) - (42 CYS CB) - (42 CYS SG) 150.0 210.0
&rst iat = 642, 644, 646, 649,
r1 = 140.0, r2 = 150.0, r3 = 210.0, r4 = 220.0, &end
# 43 ARG CHI1: (43 ARG N) - (43 ARG CA) - (43 ARG CB) - (43 ARG CG) -90.0 -30.0
&rst iat = 652, 654, 656, 659,
r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0, &end
# 44 ASP CHI1: (44 ASP N) - (44 ASP CA) - (44 ASP CB) - (44 ASP CG) -90.0 -30.0
&rst iat = 676, 678, 680, 683,
r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0, &end
# 45 ASN CHI1: (45 ASN N) - (45 ASN CA) - (45 ASN CB) - (45 ASN CG) -90.0 -30.0
&rst iat = 688, 690, 692, 695,
r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0, &end
# 48 CYS CHI1: (48 CYS N) - (48 CYS CA) - (48 CYS CB) - (48 CYS SG) 150.0 210.0
&rst iat = 736, 738, 740, 743,
r1 = 140.0, r2 = 150.0, r3 = 210.0, r4 = 220.0, &end
# 50 ILE CHI1: (50 ILE N) - (50 ILE CA) - (50 ILE CB) - (50 ILE CG1) -90.0 -30.0
&rst iat = 765, 767, 769, 775,
r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0, &end
# 51 ASP CHI1: (51 ASP N) - (51 ASP CA) - (51 ASP CB) - (51 ASP CG) -90.0 -30.0
&rst iat = 784, 786, 788, 791,
r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0, &end
# 58 CYS CHI1: (58 CYS N) - (58 CYS CA) - (58 CYS CB) - (58 CYS SG) 150.0 210.0
&rst iat = 921, 923, 925, 928,
r1 = 140.0, r2 = 150.0, r3 = 210.0, r4 = 220.0, &end
# 59 GLN CHI1: (59 GLN N) - (59 GLN CA) - (59 GLN CB) - (59 GLN CG) -90.0 -30.0
&rst iat = 931, 933, 935, 938,
r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0, &end
# 60 TYR CHI1: (60 TYR N) - (60 TYR CA) - (60 TYR CB) - (60 TYR CG) 150.0 210.0
&rst iat = 948, 950, 952, 955,
r1 = 140.0, r2 = 150.0, r3 = 210.0, r4 = 220.0, &end
# 61 CYS CHI1: (61 CYS N) - (61 CYS CA) - (61 CYS CB) - (61 CYS SG) -90.0 -30.0
&rst iat = 969, 971, 973, 976,
r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0, &end
# 64 GLN CHI1: (64 GLN N) - (64 GLN CA) - (64 GLN CB) - (64 GLN CG) -90.0 -30.0
&rst iat = 1024, 1026, 1028, 1031,
r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0, &end
# 67 LEU CHI1: (67 LEU N) - (67 LEU CA) - (67 LEU CB) - (67 LEU CG) -90.0 -30.0
&rst iat = 1073, 1075, 1077, 1080,
r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0, &end
# 71 MET CHI1: (71 MET N) - (71 MET CA) - (71 MET CB) - (71 MET CG) -90.0 -30.0
&rst iat = 1128, 1130, 1132, 1135,
r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0, &end
# 72 LYS CHI1: (72 LYS N) - (72 LYS CA) - (72 LYS CB) - (72 LYS CG) -90.0 -30.0
&rst iat = 1147, 1149, 1151, 1154,
r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0, &end
# 76 VAL CHI1: (76 VAL N) - (76 VAL CA) - (76 VAL CB) - (76 VAL CG1) 150.0 210.0
&rst iat = 1218, 1220, 1222, 1224,
r1 = 140.0, r2 = 150.0, r3 = 210.0, r4 = 220.0, &end
# 81 GLN CHI1: (81 GLN N) - (81 GLN CA) - (81 GLN CB) - (81 GLN CG) -90.0 -30.0
&rst iat = 1305, 1307, 1309, 1312,
r1 = -100.0, r2 = -90.0, r3 = -30.0, r4 = -20.0, &end
#
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