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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21049 |
2gzz   |
7109 | cing | 1-original | 4 | AMBER | dihedral angle |
# trans-omega constraint for residue 2 &rst iat=22,20,18,5, r1=150., r2=170., r3=190., r4=210., rk2 = 50., rk3=50., &end # # trans-omega constraint for residue 3 &rst iat=32,30,28,22, &end # # trans-omega constraint for residue 4 &rst iat=51,49,47,32, &end # # trans-omega constraint for residue 5 &rst iat=67,65,63,51, &end # # trans-omega constraint for residue 6 &rst iat=89,87,85,67, &end # # trans-omega constraint for residue 7 &rst iat=99,97,95,89, &end # # trans-omega constraint for residue 8 &rst iat=113,111,109,99, &end # # trans-omega constraint for residue 9 &rst iat=125,123,121,113, &end # # trans-omega constraint for residue 10 &rst iat=142,140,138,125, &end # # trans-omega constraint for residue 11 &rst iat=153,151,149,142, &end # # trans-omega constraint for residue 12 &rst iat=173,171,169,153, &end # # trans-omega constraint for residue 13 &rst iat=184,182,180,173, &end # # trans-omega constraint for residue 14 &rst iat=194,192,190,184, &end # # trans-omega constraint for residue 15 &rst iat=209,207,205,194, &end # # trans-omega constraint for residue 16 &rst iat=223,221,219,209, &end # # trans-omega constraint for residue 17 &rst iat=234,232,230,223, &end # # trans-omega constraint for residue 18 &rst iat=249,247,245,234, &end # # trans-omega constraint for residue 19 &rst iat=256,254,252,249, &end # # trans-omega constraint for residue 20 &rst iat=272,270,268,256, &end # # trans-omega constraint for residue 21 &rst iat=288,286,284,272, &end # # trans-omega constraint for residue 22 &rst iat=307,305,303,288, &end # # trans-omega constraint for residue 23 &rst iat=317,315,313,307, &end # # trans-omega constraint for residue 24 &rst iat=329,327,325,317, &end # # trans-omega constraint for residue 25 &rst iat=349,347,345,329, &end # # trans-omega constraint for residue 26 &rst iat=373,371,369,349, &end # # trans-omega constraint for residue 27 &rst iat=391,381,379,373, &end # # trans-omega constraint for residue 28 &rst iat=397,395,393,391, &end # # trans-omega constraint for residue 29 &rst iat=421,419,417,397, &end # # trans-omega constraint for residue 30 &rst iat=431,429,427,421, &end # # trans-omega constraint for residue 31 &rst iat=446,436,434,431, &end # # trans-omega constraint for residue 32 &rst iat=452,450,448,446, &end # # trans-omega constraint for residue 33 &rst iat=462,460,458,452, &end # # trans-omega constraint for residue 34 &rst iat=484,482,480,462, &end # # trans-omega constraint for residue 35 &rst iat=501,499,497,484, &end # # trans-omega constraint for residue 36 &rst iat=520,518,516,501, &end # # trans-omega constraint for residue 37 &rst iat=538,528,526,520, &end # # trans-omega constraint for residue 38 &rst iat=544,542,540,538, &end # # trans-omega constraint for residue 39 &rst iat=560,558,556,544, &end # # trans-omega constraint for residue 40 &rst iat=579,577,575,560, &end # # trans-omega constraint for residue 41 &rst iat=594,592,590,579, &end # # trans-omega constraint for residue 42 &rst iat=609,607,605,594, &end # # trans-omega constraint for residue 43 &rst iat=628,626,624,609, &end # # trans-omega constraint for residue 44 &rst iat=640,638,636,628, &end # # trans-omega constraint for residue 45 &rst iat=657,655,653,640, &end # # trans-omega constraint for residue 46 &rst iat=672,670,668,657, &end # # trans-omega constraint for residue 47 &rst iat=689,687,685,672, &end # # trans-omega constraint for residue 48 &rst iat=696,694,692,689, &end # # trans-omega constraint for residue 49 &rst iat=708,706,704,696, &end # # trans-omega constraint for residue 50 &rst iat=730,728,726,708, &end # # trans-omega constraint for residue 51 &rst iat=749,747,745,730, &end # # trans-omega constraint for residue 52 &rst iat=771,769,767,749, &end # # trans-omega constraint for residue 53 &rst iat=790,788,786,771, &end # # trans-omega constraint for residue 54 &rst iat=806,804,802,790, &end # # trans-omega constraint for residue 55 &rst iat=828,826,824,806, &end # # trans-omega constraint for residue 56 &rst iat=847,845,843,828, &end # # trans-omega constraint for residue 57 &rst iat=859,857,855,847, &end # # trans-omega constraint for residue 58 &rst iat=875,873,871,859, &end # # trans-omega constraint for residue 59 &rst iat=887,885,883,875, &end # # trans-omega constraint for residue 60 &rst iat=902,900,898,887, &end # # trans-omega constraint for residue 61 &rst iat=916,914,912,902, &end # # trans-omega constraint for residue 62 &rst iat=933,931,929,916, &end # # trans-omega constraint for residue 63 &rst iat=948,946,944,933, &end # # trans-omega constraint for residue 64 &rst iat=962,960,958,948, &end # # trans-omega constraint for residue 65 &rst iat=972,970,968,962, &end # # trans-omega constraint for residue 66 &rst iat=979,977,975,972, &end # # trans-omega constraint for residue 67 &rst iat=1001,999,997,979, &end # # trans-omega constraint for residue 68 &rst iat=1022,1020,1018,1001, &end # # trans-omega constraint for residue 69 &rst iat=1029,1027,1025,1022, &end # # trans-omega constraint for residue 70 &rst iat=1045,1043,1041,1029, &end # # trans-omega constraint for residue 71 &rst iat=1062,1060,1058,1045, &end # # trans-omega constraint for residue 72 &rst iat=1073,1071,1069,1062, &end # # cis-omega constraint for residue 73 &rst iat=1100,1090,1088,1073, r1=-30., r2=-10., r3=10., r4=30., rk2 = 50., rk3=50., &end # # trans-omega constraint for residue 74 &rst iat=1106,1104,1102,1100, r1=150., r2=170., r3=190., r4=210., rk2 = 50., rk3=50., &end # # trans-omega constraint for residue 75 &rst iat=1120,1118,1116,1106, &end # # trans-omega constraint for residue 76 &rst iat=1139,1137,1135,1120, &end # # trans-omega constraint for residue 77 &rst iat=1158,1156,1154,1139, &end # # trans-omega constraint for residue 78 &rst iat=1174,1172,1170,1158, &end # # trans-omega constraint for residue 79 &rst iat=1193,1191,1189,1174, &end # # trans-omega constraint for residue 80 &rst iat=1215,1213,1211,1193, &end # # trans-omega constraint for residue 81 &rst iat=1227,1225,1223,1215, &end # # trans-omega constraint for residue 82 &rst iat=1234,1232,1230,1227, &end # # trans-omega constraint for residue 83 &rst iat=1249,1247,1245,1234, &end # # trans-omega constraint for residue 84 &rst iat=1265,1263,1261,1249, &end # # trans-omega constraint for residue 85 &rst iat=1281,1279,1277,1265, &end # # trans-omega constraint for residue 86 &rst iat=1296,1294,1292,1281, &end # # trans-omega constraint for residue 87 &rst iat=1310,1308,1306,1296, &end # # trans-omega constraint for residue 88 &rst iat=1321,1319,1317,1310, &end # # trans-omega constraint for residue 89 &rst iat=1337,1335,1333,1321, &end # # trans-omega constraint for residue 90 &rst iat=1344,1342,1340,1337, &end # # trans-omega constraint for residue 91 &rst iat=1364,1362,1360,1344, &end # # trans-omega constraint for residue 92 &rst iat=1394,1384,1382,1364, &end # # trans-omega constraint for residue 93 &rst iat=1400,1398,1396,1394, &end # # trans-omega constraint for residue 94 &rst iat=1422,1420,1418,1400, &end # # trans-omega constraint for residue 95 &rst iat=1437,1435,1433,1422, &end # # trans-omega constraint for residue 96 &rst iat=1447,1445,1443,1437, &end # # trans-omega constraint for residue 97 &rst iat=1466,1464,1462,1447, &end # # trans-omega constraint for residue 98 &rst iat=1483,1481,1479,1466, &end # # trans-omega constraint for residue 99 &rst iat=1498,1496,1494,1483, &end # # trans-omega constraint for residue 100 &rst iat=1517,1515,1513,1498, &end # # trans-omega constraint for residue 101 &rst iat=1533,1531,1529,1517, &end # # trans-omega constraint for residue 102 &rst iat=1547,1545,1543,1533, &end # # trans-omega constraint for residue 103 &rst iat=1569,1567,1565,1547, &end # # trans-omega constraint for residue 104 &rst iat=1586,1584,1582,1569, &end # 1603 atoms read from pdb file prm1.pdb. # 3 ILE PHI: (2 ALA C)-(3 ILE N)-(3 ILE CA)-(3 ILE C) -136.2 -76.2 &rst iat = 28, 30, 32, 47, r1 = -137.2, r2 = -136.2, r3 = -76.2, r4 = -75.2, rk2 = 50.0, rk3 = 50.0, &end # 3 ILE PSI: (3 ILE N)-(3 ILE CA)-(3 ILE C)-(4 VAL N) 93.5 153.5 &rst iat = 30, 32, 47, 49, r1 = 92.5, r2 = 93.5, r3 = 153.5, r4 = 154.5, &end # 4 VAL PHI: (3 ILE C)-(4 VAL N)-(4 VAL CA)-(4 VAL C) -147.5 -87.5 &rst iat = 47, 49, 51, 63, r1 = -148.5, r2 = -147.5, r3 = -87.5, r4 = -86.5, &end # 4 VAL PSI: (4 VAL N)-(4 VAL CA)-(4 VAL C)-(5 LYS N) 103.5 163.5 &rst iat = 49, 51, 63, 65, r1 = 102.5, r2 = 103.5, r3 = 163.5, r4 = 164.5, &end # 5 LYS PHI: (4 VAL C)-(5 LYS N)-(5 LYS CA)-(5 LYS C) -128.9 -68.9 &rst iat = 63, 65, 67, 85, r1 = -129.9, r2 = -128.9, r3 = -68.9, r4 = -67.9, &end # 5 LYS PSI: (5 LYS N)-(5 LYS CA)-(5 LYS C)-(6 ALA N) 99.2 159.2 &rst iat = 65, 67, 85, 87, r1 = 98.2, r2 = 99.2, r3 = 159.2, r4 = 160.2, &end # 6 ALA PHI: (5 LYS C)-(6 ALA N)-(6 ALA CA)-(6 ALA C) -168.8 -108.8 &rst iat = 85, 87, 89, 95, r1 = -169.8, r2 = -168.8, r3 = -108.8, r4 = -107.8, &end # 6 ALA PSI: (6 ALA N)-(6 ALA CA)-(6 ALA C)-(7 THR N) 122.9 182.9 &rst iat = 87, 89, 95, 97, r1 = 121.9, r2 = 122.9, r3 = 182.9, r4 = 183.9, &end # 7 THR PHI: (6 ALA C)-(7 THR N)-(7 THR CA)-(7 THR C) -131.6 -71.6 &rst iat = 95, 97, 99, 109, r1 = -132.6, r2 = -131.6, r3 = -71.6, r4 = -70.6, &end # 7 THR PSI: (7 THR N)-(7 THR CA)-(7 THR C)-(8 ASP N) 129.9 189.9 &rst iat = 97, 99, 109, 111, r1 = 128.9, r2 = 129.9, r3 = 189.9, r4 = 190.9, &end # 8 ASP PHI: (7 THR C)-(8 ASP N)-(8 ASP CA)-(8 ASP C) -92.1 -32.1 &rst iat = 109, 111, 113, 121, r1 = -93.1, r2 = -92.1, r3 = -32.1, r4 = -31.1, &end # 8 ASP PSI: (8 ASP N)-(8 ASP CA)-(8 ASP C)-(9 GLN N) -60.6 -0.6 &rst iat = 111, 113, 121, 123, r1 = -61.6, r2 = -60.6, r3 = -0.6, r4 = 0.4, &end # 11 PHE PHI: (10 SER C)-(11 PHE N)-(11 PHE CA)-(11 PHE C) -91.7 -31.7 &rst iat = 149, 151, 153, 169, r1 = -92.7, r2 = -91.7, r3 = -31.7, r4 = -30.7, &end # 11 PHE PSI: (11 PHE N)-(11 PHE CA)-(11 PHE C)-(12 SER N) -69.0 -9.0 &rst iat = 151, 153, 169, 171, r1 = -70.0, r2 = -69.0, r3 = -9.0, r4 = -8.0, &end # 12 SER PHI: (11 PHE C)-(12 SER N)-(12 SER CA)-(12 SER C) -97.0 -37.0 &rst iat = 169, 171, 173, 180, r1 = -98.0, r2 = -97.0, r3 = -37.0, r4 = -36.0, &end # 12 SER PSI: (12 SER N)-(12 SER CA)-(12 SER C)-(13 ALA N) -67.4 -7.4 &rst iat = 171, 173, 180, 182, r1 = -68.4, r2 = -67.4, r3 = -7.4, r4 = -6.4, &end # 13 ALA PHI: (12 SER C)-(13 ALA N)-(13 ALA CA)-(13 ALA C) -95.3 -35.3 &rst iat = 180, 182, 184, 190, r1 = -96.3, r2 = -95.3, r3 = -35.3, r4 = -34.3, &end # 13 ALA PSI: (13 ALA N)-(13 ALA CA)-(13 ALA C)-(14 GLU N) -72.0 -12.0 &rst iat = 182, 184, 190, 192, r1 = -73.0, r2 = -72.0, r3 = -12.0, r4 = -11.0, &end # 15 THR PHI: (14 GLU C)-(15 THR N)-(15 THR CA)-(15 THR C) -127.7 -67.7 &rst iat = 205, 207, 209, 219, r1 = -128.7, r2 = -127.7, r3 = -67.7, r4 = -66.7, &end # 15 THR PSI: (15 THR N)-(15 THR CA)-(15 THR C)-(16 SER N) -34.9 25.1 &rst iat = 207, 209, 219, 221, r1 = -35.9, r2 = -34.9, r3 = 25.1, r4 = 26.1, &end # 19 VAL PHI: (18 GLY C)-(19 VAL N)-(19 VAL CA)-(19 VAL C) -125.4 -65.4 &rst iat = 252, 254, 256, 268, r1 = -126.4, r2 = -125.4, r3 = -65.4, r4 = -64.4, &end # 19 VAL PSI: (19 VAL N)-(19 VAL CA)-(19 VAL C)-(20 VAL N) 93.4 153.4 &rst iat = 254, 256, 268, 270, r1 = 92.4, r2 = 93.4, r3 = 153.4, r4 = 154.4, &end # 20 VAL PHI: (19 VAL C)-(20 VAL N)-(20 VAL CA)-(20 VAL C) -154.9 -94.9 &rst iat = 268, 270, 272, 284, r1 = -155.9, r2 = -154.9, r3 = -94.9, r4 = -93.9, &end # 20 VAL PSI: (20 VAL N)-(20 VAL CA)-(20 VAL C)-(21 LEU N) 104.9 164.9 &rst iat = 270, 272, 284, 286, r1 = 103.9, r2 = 104.9, r3 = 164.9, r4 = 165.9, &end # 21 LEU PHI: (20 VAL C)-(21 LEU N)-(21 LEU CA)-(21 LEU C) -150.7 -90.7 &rst iat = 284, 286, 288, 303, r1 = -151.7, r2 = -150.7, r3 = -90.7, r4 = -89.7, &end # 21 LEU PSI: (21 LEU N)-(21 LEU CA)-(21 LEU C)-(22 ALA N) 99.4 159.4 &rst iat = 286, 288, 303, 305, r1 = 98.4, r2 = 99.4, r3 = 159.4, r4 = 160.4, &end # 22 ALA PHI: (21 LEU C)-(22 ALA N)-(22 ALA CA)-(22 ALA C) -136.3 -76.3 &rst iat = 303, 305, 307, 313, r1 = -137.3, r2 = -136.3, r3 = -76.3, r4 = -75.3, &end # 22 ALA PSI: (22 ALA N)-(22 ALA CA)-(22 ALA C)-(23 ASP N) 102.2 162.2 &rst iat = 305, 307, 313, 315, r1 = 101.2, r2 = 102.2, r3 = 162.2, r4 = 163.2, &end # 23 ASP PHI: (22 ALA C)-(23 ASP N)-(23 ASP CA)-(23 ASP C) -144.9 -84.9 &rst iat = 313, 315, 317, 325, r1 = -145.9, r2 = -144.9, r3 = -84.9, r4 = -83.9, &end # 23 ASP PSI: (23 ASP N)-(23 ASP CA)-(23 ASP C)-(24 PHE N) 94.4 154.4 &rst iat = 315, 317, 325, 327, r1 = 93.4, r2 = 94.4, r3 = 154.4, r4 = 155.4, &end # 24 PHE PHI: (23 ASP C)-(24 PHE N)-(24 PHE CA)-(24 PHE C) -129.9 -70.0 &rst iat = 325, 327, 329, 345, r1 = -130.9, r2 = -129.9, r3 = -70.0, r4 = -69.0, &end # 24 PHE PSI: (24 PHE N)-(24 PHE CA)-(24 PHE C)-(25 TRP N) 99.0 159.0 &rst iat = 327, 329, 345, 347, r1 = 98.0, r2 = 99.0, r3 = 159.0, r4 = 160.0, &end # 32 CYS PHI: (31 PRO C)-(32 CYS N)-(32 CYS CA)-(32 CYS C) -98.4 -38.4 &rst iat = 448, 450, 452, 458, r1 = -99.4, r2 = -98.4, r3 = -38.4, r4 = -37.4, &end # 32 CYS PSI: (32 CYS N)-(32 CYS CA)-(32 CYS C)-(33 LYS N) -65.6 -5.6 &rst iat = 450, 452, 458, 460, r1 = -66.6, r2 = -65.6, r3 = -5.6, r4 = -4.6, &end # 33 LYS PHI: (32 CYS C)-(33 LYS N)-(33 LYS CA)-(33 LYS C) -99.1 -39.1 &rst iat = 458, 460, 462, 480, r1 = -100.1, r2 = -99.1, r3 = -39.1, r4 = -38.1, &end # 33 LYS PSI: (33 LYS N)-(33 LYS CA)-(33 LYS C)-(34 MET N) -67.0 -7.0 &rst iat = 460, 462, 480, 482, r1 = -68.0, r2 = -67.0, r3 = -7.0, r4 = -6.0, &end # 35 ILE PHI: (34 MET C)-(35 ILE N)-(35 ILE CA)-(35 ILE C) -100.0 -40.0 &rst iat = 497, 499, 501, 516, r1 = -101.0, r2 = -100.0, r3 = -40.0, r4 = -39.0, &end # 35 ILE PSI: (35 ILE N)-(35 ILE CA)-(35 ILE C)-(36 ALA N) -63.4 -3.4 &rst iat = 499, 501, 516, 518, r1 = -64.4, r2 = -63.4, r3 = -3.4, r4 = -2.4, &end # 36 ALA PHI: (35 ILE C)-(36 ALA N)-(36 ALA CA)-(36 ALA C) -91.6 -31.6 &rst iat = 516, 518, 520, 526, r1 = -92.6, r2 = -91.6, r3 = -31.6, r4 = -30.6, &end # 36 ALA PSI: (36 ALA N)-(36 ALA CA)-(36 ALA C)-(37 PRO N) -72.2 -12.2 &rst iat = 518, 520, 526, 528, r1 = -73.2, r2 = -72.2, r3 = -12.2, r4 = -11.2, &end # 38 VAL PHI: (37 PRO C)-(38 VAL N)-(38 VAL CA)-(38 VAL C) -99.3 -39.3 &rst iat = 540, 542, 544, 556, r1 = -100.3, r2 = -99.3, r3 = -39.3, r4 = -38.3, &end # 38 VAL PSI: (38 VAL N)-(38 VAL CA)-(38 VAL C)-(39 LEU N) -68.9 -8.9 &rst iat = 542, 544, 556, 558, r1 = -69.9, r2 = -68.9, r3 = -8.9, r4 = -7.9, &end # 39 LEU PHI: (38 VAL C)-(39 LEU N)-(39 LEU CA)-(39 LEU C) -97.1 -37.1 &rst iat = 556, 558, 560, 575, r1 = -98.1, r2 = -97.1, r3 = -37.1, r4 = -36.1, &end # 39 LEU PSI: (39 LEU N)-(39 LEU CA)-(39 LEU C)-(40 GLU N) -64.6 -4.6 &rst iat = 558, 560, 575, 577, r1 = -65.6, r2 = -64.6, r3 = -4.6, r4 = -3.6, &end # 40 GLU PHI: (39 LEU C)-(40 GLU N)-(40 GLU CA)-(40 GLU C) -94.1 -34.1 &rst iat = 575, 577, 579, 590, r1 = -95.1, r2 = -94.1, r3 = -34.1, r4 = -33.1, &end # 40 GLU PSI: (40 GLU N)-(40 GLU CA)-(40 GLU C)-(41 GLU N) -73.0 -13.0 &rst iat = 577, 579, 590, 592, r1 = -74.0, r2 = -73.0, r3 = -13.0, r4 = -12.0, &end # 41 GLU PHI: (40 GLU C)-(41 GLU N)-(41 GLU CA)-(41 GLU C) -93.0 -33.0 &rst iat = 590, 592, 594, 605, r1 = -94.0, r2 = -93.0, r3 = -33.0, r4 = -32.0, &end # 41 GLU PSI: (41 GLU N)-(41 GLU CA)-(41 GLU C)-(42 LEU N) -72.3 -12.3 &rst iat = 592, 594, 605, 607, r1 = -73.3, r2 = -72.3, r3 = -12.3, r4 = -11.3, &end # 42 LEU PHI: (41 GLU C)-(42 LEU N)-(42 LEU CA)-(42 LEU C) -93.0 -33.0 &rst iat = 605, 607, 609, 624, r1 = -94.0, r2 = -93.0, r3 = -33.0, r4 = -32.0, &end # 42 LEU PSI: (42 LEU N)-(42 LEU CA)-(42 LEU C)-(43 ASP N) -69.3 -9.3 &rst iat = 607, 609, 624, 626, r1 = -70.3, r2 = -69.3, r3 = -9.3, r4 = -8.3, &end # 43 ASP PHI: (42 LEU C)-(43 ASP N)-(43 ASP CA)-(43 ASP C) -95.8 -35.8 &rst iat = 624, 626, 628, 636, r1 = -96.8, r2 = -95.8, r3 = -35.8, r4 = -34.8, &end # 43 ASP PSI: (43 ASP N)-(43 ASP CA)-(43 ASP C)-(44 GLN N) -69.5 -9.5 &rst iat = 626, 628, 636, 638, r1 = -70.5, r2 = -69.5, r3 = -9.5, r4 = -8.5, &end # 44 GLN PHI: (43 ASP C)-(44 GLN N)-(44 GLN CA)-(44 GLN C) -95.6 -35.6 &rst iat = 636, 638, 640, 653, r1 = -96.6, r2 = -95.6, r3 = -35.6, r4 = -34.6, &end # 44 GLN PSI: (44 GLN N)-(44 GLN CA)-(44 GLN C)-(45 GLU N) -71.1 -11.1 &rst iat = 638, 640, 653, 655, r1 = -72.1, r2 = -71.1, r3 = -11.1, r4 = -10.1, &end # 51 LYS PHI: (50 LEU C)-(51 LYS N)-(51 LYS CA)-(51 LYS C) -140.7 -80.7 &rst iat = 745, 747, 749, 767, r1 = -141.7, r2 = -140.7, r3 = -80.7, r4 = -79.7, &end # 51 LYS PSI: (51 LYS N)-(51 LYS CA)-(51 LYS C)-(52 ILE N) 84.7 144.7 &rst iat = 747, 749, 767, 769, r1 = 83.7, r2 = 84.7, r3 = 144.7, r4 = 145.7, &end # 52 ILE PHI: (51 LYS C)-(52 ILE N)-(52 ILE CA)-(52 ILE C) -144.7 -84.7 &rst iat = 767, 769, 771, 786, r1 = -145.7, r2 = -144.7, r3 = -84.7, r4 = -83.7, &end # 52 ILE PSI: (52 ILE N)-(52 ILE CA)-(52 ILE C)-(53 VAL N) 102.5 162.5 &rst iat = 769, 771, 786, 788, r1 = 101.5, r2 = 102.5, r3 = 162.5, r4 = 163.5, &end # 53 VAL PHI: (52 ILE C)-(53 VAL N)-(53 VAL CA)-(53 VAL C) -157.2 -77.2 &rst iat = 786, 788, 790, 802, r1 = -158.2, r2 = -157.2, r3 = -77.2, r4 = -76.2, &end # 53 VAL PSI: (53 VAL N)-(53 VAL CA)-(53 VAL C)-(54 LYS N) 99.3 179.3 &rst iat = 788, 790, 802, 804, r1 = 98.3, r2 = 99.3, r3 = 179.3, r4 = 180.3, &end # 54 LYS PHI: (53 VAL C)-(54 LYS N)-(54 LYS CA)-(54 LYS C) -154.9 -74.9 &rst iat = 802, 804, 806, 824, r1 = -155.9, r2 = -154.9, r3 = -74.9, r4 = -73.9, &end # 54 LYS PSI: (54 LYS N)-(54 LYS CA)-(54 LYS C)-(55 ILE N) 93.9 173.9 &rst iat = 804, 806, 824, 826, r1 = 92.9, r2 = 93.9, r3 = 173.9, r4 = 174.9, &end # 55 ILE PHI: (54 LYS C)-(55 ILE N)-(55 ILE CA)-(55 ILE C) -155.4 -95.5 &rst iat = 824, 826, 828, 843, r1 = -156.4, r2 = -155.4, r3 = -95.5, r4 = -94.5, &end # 55 ILE PSI: (55 ILE N)-(55 ILE CA)-(55 ILE C)-(56 ASP N) 108.5 168.5 &rst iat = 826, 828, 843, 845, r1 = 107.5, r2 = 108.5, r3 = 168.5, r4 = 169.5, &end # 58 ASP PHI: (57 VAL C)-(58 ASP N)-(58 ASP CA)-(58 ASP C) -107.7 -47.7 &rst iat = 871, 873, 875, 883, r1 = -108.7, r2 = -107.7, r3 = -47.7, r4 = -46.7, &end # 58 ASP PSI: (58 ASP N)-(58 ASP CA)-(58 ASP C)-(59 GLU N) -55.6 4.4 &rst iat = 873, 875, 883, 885, r1 = -56.6, r2 = -55.6, r3 = 4.4, r4 = 5.4, &end # 62 GLU PHI: (61 GLN C)-(62 GLU N)-(62 GLU CA)-(62 GLU C) -92.8 -32.8 &rst iat = 929, 931, 933, 944, r1 = -93.8, r2 = -92.8, r3 = -32.8, r4 = -31.8, &end # 62 GLU PSI: (62 GLU N)-(62 GLU CA)-(62 GLU C)-(63 THR N) -70.5 -10.5 &rst iat = 931, 933, 944, 946, r1 = -71.5, r2 = -70.5, r3 = -10.5, r4 = -9.5, &end # 63 THR PHI: (62 GLU C)-(63 THR N)-(63 THR CA)-(63 THR C) -98.8 -38.8 &rst iat = 944, 946, 948, 958, r1 = -99.8, r2 = -98.8, r3 = -38.8, r4 = -37.8, &end # 63 THR PSI: (63 THR N)-(63 THR CA)-(63 THR C)-(64 ALA N) -72.0 -12.0 &rst iat = 946, 948, 958, 960, r1 = -73.0, r2 = -72.0, r3 = -12.0, r4 = -11.0, &end # 64 ALA PHI: (63 THR C)-(64 ALA N)-(64 ALA CA)-(64 ALA C) -90.9 -30.9 &rst iat = 958, 960, 962, 968, r1 = -91.9, r2 = -90.9, r3 = -30.9, r4 = -29.9, &end # 64 ALA PSI: (64 ALA N)-(64 ALA CA)-(64 ALA C)-(65 GLY N) -73.3 -13.3 &rst iat = 960, 962, 968, 970, r1 = -74.3, r2 = -73.3, r3 = -13.3, r4 = -12.3, &end # 65 GLY PHI: (64 ALA C)-(65 GLY N)-(65 GLY CA)-(65 GLY C) -93.0 -33.0 &rst iat = 968, 970, 972, 975, r1 = -94.0, r2 = -93.0, r3 = -33.0, r4 = -32.0, &end # 65 GLY PSI: (65 GLY N)-(65 GLY CA)-(65 GLY C)-(66 LYS N) -70.9 -10.9 &rst iat = 970, 972, 975, 977, r1 = -71.9, r2 = -70.9, r3 = -10.9, r4 = -9.9, &end # 66 LYS PHI: (65 GLY C)-(66 LYS N)-(66 LYS CA)-(66 LYS C) -95.6 -35.6 &rst iat = 975, 977, 979, 997, r1 = -96.6, r2 = -95.6, r3 = -35.6, r4 = -34.6, &end # 66 LYS PSI: (66 LYS N)-(66 LYS CA)-(66 LYS C)-(67 TYR N) -56.8 3.2 &rst iat = 977, 979, 997, 999, r1 = -57.8, r2 = -56.8, r3 = 3.2, r4 = 4.2, &end # 69 VAL PHI: (68 GLY C)-(69 VAL N)-(69 VAL CA)-(69 VAL C) -110.9 -50.9 &rst iat = 1025, 1027, 1029, 1041, r1 = -111.9, r2 = -110.9, r3 = -50.9, r4 = -49.9, &end # 69 VAL PSI: (69 VAL N)-(69 VAL CA)-(69 VAL C)-(70 MET N) 94.2 154.2 &rst iat = 1027, 1029, 1041, 1043, r1 = 93.2, r2 = 94.2, r3 = 154.2, r4 = 155.2, &end # 71 SER PHI: (70 MET C)-(71 SER N)-(71 SER CA)-(71 SER C) -146.9 -86.9 &rst iat = 1058, 1060, 1062, 1069, r1 = -147.9, r2 = -146.9, r3 = -86.9, r4 = -85.9, &end # 71 SER PSI: (71 SER N)-(71 SER CA)-(71 SER C)-(72 ILE N) 124.1 184.1 &rst iat = 1060, 1062, 1069, 1071, r1 = 123.1, r2 = 124.1, r3 = 184.1, r4 = 185.1, &end # 72 ILE PHI: (71 SER C)-(72 ILE N)-(72 ILE CA)-(72 ILE C) -155.5 -95.5 &rst iat = 1069, 1071, 1073, 1088, r1 = -156.5, r2 = -155.5, r3 = -95.5, r4 = -94.5, &end # 72 ILE PSI: (72 ILE N)-(72 ILE CA)-(72 ILE C)-(73 PRO N) 93.5 153.5 &rst iat = 1071, 1073, 1088, 1090, r1 = 92.5, r2 = 93.5, r3 = 153.5, r4 = 154.5, &end # 74 THR PHI: (73 PRO C)-(74 THR N)-(74 THR CA)-(74 THR C) -152.1 -92.1 &rst iat = 1102, 1104, 1106, 1116, r1 = -153.1, r2 = -152.1, r3 = -92.1, r4 = -91.1, &end # 74 THR PSI: (74 THR N)-(74 THR CA)-(74 THR C)-(75 LEU N) 98.5 158.5 &rst iat = 1104, 1106, 1116, 1118, r1 = 97.5, r2 = 98.5, r3 = 158.5, r4 = 159.5, &end # 75 LEU PHI: (74 THR C)-(75 LEU N)-(75 LEU CA)-(75 LEU C) -141.8 -81.8 &rst iat = 1116, 1118, 1120, 1135, r1 = -142.8, r2 = -141.8, r3 = -81.8, r4 = -80.8, &end # 75 LEU PSI: (75 LEU N)-(75 LEU CA)-(75 LEU C)-(76 LEU N) 106.1 166.1 &rst iat = 1118, 1120, 1135, 1137, r1 = 105.1, r2 = 106.1, r3 = 166.1, r4 = 167.1, &end # 76 LEU PHI: (75 LEU C)-(76 LEU N)-(76 LEU CA)-(76 LEU C) -154.7 -94.7 &rst iat = 1135, 1137, 1139, 1154, r1 = -155.7, r2 = -154.7, r3 = -94.7, r4 = -93.7, &end # 76 LEU PSI: (76 LEU N)-(76 LEU CA)-(76 LEU C)-(77 VAL N) 110.6 170.6 &rst iat = 1137, 1139, 1154, 1156, r1 = 109.6, r2 = 110.6, r3 = 170.6, r4 = 171.6, &end # 77 VAL PHI: (76 LEU C)-(77 VAL N)-(77 VAL CA)-(77 VAL C) -143.3 -83.3 &rst iat = 1154, 1156, 1158, 1170, r1 = -144.3, r2 = -143.3, r3 = -83.3, r4 = -82.3, &end # 77 VAL PSI: (77 VAL N)-(77 VAL CA)-(77 VAL C)-(78 LEU N) 91.3 151.3 &rst iat = 1156, 1158, 1170, 1172, r1 = 90.3, r2 = 91.3, r3 = 151.3, r4 = 152.3, &end # 78 LEU PHI: (77 VAL C)-(78 LEU N)-(78 LEU CA)-(78 LEU C) -145.8 -85.8 &rst iat = 1170, 1172, 1174, 1189, r1 = -146.8, r2 = -145.8, r3 = -85.8, r4 = -84.8, &end # 78 LEU PSI: (78 LEU N)-(78 LEU CA)-(78 LEU C)-(79 LYS N) 114.8 174.8 &rst iat = 1172, 1174, 1189, 1191, r1 = 113.8, r2 = 114.8, r3 = 174.8, r4 = 175.8, &end # 79 LYS PHI: (78 LEU C)-(79 LYS N)-(79 LYS CA)-(79 LYS C) -153.3 -93.3 &rst iat = 1189, 1191, 1193, 1211, r1 = -154.3, r2 = -153.3, r3 = -93.3, r4 = -92.3, &end # 79 LYS PSI: (79 LYS N)-(79 LYS CA)-(79 LYS C)-(80 ASP N) 90.4 150.4 &rst iat = 1191, 1193, 1211, 1213, r1 = 89.4, r2 = 90.4, r3 = 150.4, r4 = 151.4, &end # 85 GLU PHI: (84 VAL C)-(85 GLU N)-(85 GLU CA)-(85 GLU C) -169.7 -109.7 &rst iat = 1277, 1279, 1281, 1292, r1 = -170.7, r2 = -169.7, r3 = -109.7, r4 = -108.7, &end # 85 GLU PSI: (85 GLU N)-(85 GLU CA)-(85 GLU C)-(86 THR N) 111.6 171.6 &rst iat = 1279, 1281, 1292, 1294, r1 = 110.6, r2 = 111.6, r3 = 171.6, r4 = 172.6, &end # 86 THR PHI: (85 GLU C)-(86 THR N)-(86 THR CA)-(86 THR C) -141.8 -81.8 &rst iat = 1292, 1294, 1296, 1306, r1 = -142.8, r2 = -141.8, r3 = -81.8, r4 = -80.8, &end # 86 THR PSI: (86 THR N)-(86 THR CA)-(86 THR C)-(87 SER N) 90.4 150.4 &rst iat = 1294, 1296, 1306, 1308, r1 = 89.4, r2 = 90.4, r3 = 150.4, r4 = 151.4, &end # 87 SER PHI: (86 THR C)-(87 SER N)-(87 SER CA)-(87 SER C) -144.4 -84.4 &rst iat = 1306, 1308, 1310, 1317, r1 = -145.4, r2 = -144.4, r3 = -84.4, r4 = -83.4, &end # 87 SER PSI: (87 SER N)-(87 SER CA)-(87 SER C)-(88 VAL N) 91.4 151.4 &rst iat = 1308, 1310, 1317, 1319, r1 = 90.4, r2 = 91.4, r3 = 151.4, r4 = 152.4, &end # 88 VAL PHI: (87 SER C)-(88 VAL N)-(88 VAL CA)-(88 VAL C) -132.9 -72.9 &rst iat = 1317, 1319, 1321, 1333, r1 = -133.9, r2 = -132.9, r3 = -72.9, r4 = -71.9, &end # 88 VAL PSI: (88 VAL N)-(88 VAL CA)-(88 VAL C)-(89 GLY N) 96.7 156.7 &rst iat = 1319, 1321, 1333, 1335, r1 = 95.7, r2 = 96.7, r3 = 156.7, r4 = 157.7, &end # 91 LYS PHI: (90 PHE C)-(91 LYS N)-(91 LYS CA)-(91 LYS C) -148.8 -88.8 &rst iat = 1360, 1362, 1364, 1382, r1 = -149.8, r2 = -148.8, r3 = -88.8, r4 = -87.8, &end # 91 LYS PSI: (91 LYS N)-(91 LYS CA)-(91 LYS C)-(92 PRO N) 103.1 163.1 &rst iat = 1362, 1364, 1382, 1384, r1 = 102.1, r2 = 103.1, r3 = 163.1, r4 = 164.1, &end # 93 LYS PHI: (92 PRO C)-(93 LYS N)-(93 LYS CA)-(93 LYS C) -92.5 -32.5 &rst iat = 1396, 1398, 1400, 1418, r1 = -93.5, r2 = -92.5, r3 = -32.5, r4 = -31.5, &end # 93 LYS PSI: (93 LYS N)-(93 LYS CA)-(93 LYS C)-(94 GLU N) -66.2 -6.2 &rst iat = 1398, 1400, 1418, 1420, r1 = -67.2, r2 = -66.2, r3 = -6.2, r4 = -5.2, &end # 94 GLU PHI: (93 LYS C)-(94 GLU N)-(94 GLU CA)-(94 GLU C) -93.6 -33.6 &rst iat = 1418, 1420, 1422, 1433, r1 = -94.6, r2 = -93.6, r3 = -33.6, r4 = -32.6, &end # 94 GLU PSI: (94 GLU N)-(94 GLU CA)-(94 GLU C)-(95 ALA N) -64.2 -4.2 &rst iat = 1420, 1422, 1433, 1435, r1 = -65.2, r2 = -64.2, r3 = -4.2, r4 = -3.2, &end # 95 ALA PHI: (94 GLU C)-(95 ALA N)-(95 ALA CA)-(95 ALA C) -94.9 -34.9 &rst iat = 1433, 1435, 1437, 1443, r1 = -95.9, r2 = -94.9, r3 = -34.9, r4 = -33.9, &end # 95 ALA PSI: (95 ALA N)-(95 ALA CA)-(95 ALA C)-(96 LEU N) -74.4 -14.4 &rst iat = 1435, 1437, 1443, 1445, r1 = -75.4, r2 = -74.4, r3 = -14.4, r4 = -13.4, &end # 96 LEU PHI: (95 ALA C)-(96 LEU N)-(96 LEU CA)-(96 LEU C) -94.2 -34.2 &rst iat = 1443, 1445, 1447, 1462, r1 = -95.2, r2 = -94.2, r3 = -34.2, r4 = -33.2, &end # 96 LEU PSI: (96 LEU N)-(96 LEU CA)-(96 LEU C)-(97 GLN N) -69.5 -9.5 &rst iat = 1445, 1447, 1462, 1464, r1 = -70.5, r2 = -69.5, r3 = -9.5, r4 = -8.5, &end # 97 GLN PHI: (96 LEU C)-(97 GLN N)-(97 GLN CA)-(97 GLN C) -94.9 -34.9 &rst iat = 1462, 1464, 1466, 1479, r1 = -95.9, r2 = -94.9, r3 = -34.9, r4 = -33.9, &end # 97 GLN PSI: (97 GLN N)-(97 GLN CA)-(97 GLN C)-(98 GLU N) -71.3 -11.3 &rst iat = 1464, 1466, 1479, 1481, r1 = -72.3, r2 = -71.3, r3 = -11.3, r4 = -10.3, &end # 98 GLU PHI: (97 GLN C)-(98 GLU N)-(98 GLU CA)-(98 GLU C) -95.1 -35.1 &rst iat = 1479, 1481, 1483, 1494, r1 = -96.1, r2 = -95.1, r3 = -35.1, r4 = -34.1, &end # 98 GLU PSI: (98 GLU N)-(98 GLU CA)-(98 GLU C)-(99 LEU N) -66.2 -6.2 &rst iat = 1481, 1483, 1494, 1496, r1 = -67.2, r2 = -66.2, r3 = -6.2, r4 = -5.2, &end # 99 LEU PHI: (98 GLU C)-(99 LEU N)-(99 LEU CA)-(99 LEU C) -94.3 -34.3 &rst iat = 1494, 1496, 1498, 1513, r1 = -95.3, r2 = -94.3, r3 = -34.3, r4 = -33.3, &end # 99 LEU PSI: (99 LEU N)-(99 LEU CA)-(99 LEU C)-(100 VAL N) -68.8 -8.8 &rst iat = 1496, 1498, 1513, 1515, r1 = -69.8, r2 = -68.8, r3 = -8.8, r4 = -7.8, &end # 100 VAL PHI: (99 LEU C)-(100 VAL N)-(100 VAL CA)-(100 VAL C) -97.9 -37.9 &rst iat = 1513, 1515, 1517, 1529, r1 = -98.9, r2 = -97.9, r3 = -37.9, r4 = -36.9, &end # 100 VAL PSI: (100 VAL N)-(100 VAL CA)-(100 VAL C)-(101 ASN N) -72.7 -12.7 &rst iat = 1515, 1517, 1529, 1531, r1 = -73.7, r2 = -72.7, r3 = -12.7, r4 = -11.7, &end # 101 ASN PHI: (100 VAL C)-(101 ASN N)-(101 ASN CA)-(101 ASN C) -96.0 -36.0 &rst iat = 1529, 1531, 1533, 1543, r1 = -97.0, r2 = -96.0, r3 = -36.0, r4 = -35.0, &end # 101 ASN PSI: (101 ASN N)-(101 ASN CA)-(101 ASN C)-(102 LYS N) -67.2 -7.2 &rst iat = 1531, 1533, 1543, 1545, r1 = -68.2, r2 = -67.2, r3 = -7.2, r4 = -6.2, &end # 32 CYS CHI1: (32 CYS N)-(32 CYS CA)-(32 CYS CB)-(32 CYS SG) -90.0 -30.0 &rst iat = 450, 452, 454, 457, r1 = -91.0, r2 = -90.0, r3 = -30.0, r4 = -29.0, &end
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