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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|
8833 |
1mx8   |
5578 | cing | 1-original | 4 | TINKER | dihedral angle |
################### # holo_crbp1.key # ################### parameters /usr/local/tinker/params/protein trial-distance pairwise 5 trial-distribution 0.61 # # Backbone Torsional Constraints # restrain-dihedral 2 3 17 18 175.0 185.0 1.0 [ 1 Omega] restrain-dihedral 18 19 33 34 175.0 185.0 1.0 [ 2 Omega] restrain-dihedral 34 35 45 46 175.0 185.0 1.0 [ 3 Omega] restrain-dihedral 46 47 65 66 175.0 185.0 1.0 [ 4 Omega] restrain-dihedral 66 67 79 80 175.0 185.0 1.0 [ 5 Omega] restrain-dihedral 80 81 86 87 175.0 185.0 1.0 [ 6 Omega] restrain-dihedral 87 88 107 108 175.0 185.0 1.0 [ 7 Omega] restrain-dihedral 108 109 131 132 175.0 185.0 1.0 [ 8 Omega] restrain-dihedral 132 133 153 154 175.0 185.0 1.0 [ 9 Omega] restrain-dihedral 154 155 170 171 175.0 185.0 1.0 [ 10 Omega] restrain-dihedral 171 172 189 190 175.0 185.0 1.0 [ 11 Omega] restrain-dihedral 190 191 200 201 175.0 185.0 1.0 [ 12 Omega] restrain-dihedral 201 202 214 215 175.0 185.0 1.0 [ 13 Omega] restrain-dihedral 215 216 229 230 175.0 185.0 1.0 [ 14 Omega] restrain-dihedral 230 231 243 244 175.0 185.0 1.0 [ 15 Omega] restrain-dihedral 231 243 244 245 -80.0 -40.0 1.0 [ 16 Phi ] restrain-dihedral 243 244 245 263 -60.0 -20.0 1.0 [ 16 Psi ] restrain-dihedral 244 245 263 264 175.0 185.0 1.0 [ 16 Omega] restrain-dihedral 245 263 264 265 -80.0 -40.0 1.0 [ 17 Phi ] restrain-dihedral 263 264 265 278 -60.0 -20.0 1.0 [ 17 Psi ] restrain-dihedral 264 265 278 279 175.0 185.0 1.0 [ 17 Omega] restrain-dihedral 265 278 279 280 -80.0 -40.0 1.0 [ 18 Phi ] restrain-dihedral 278 279 280 293 -60.0 -20.0 1.0 [ 18 Psi ] restrain-dihedral 279 280 293 294 175.0 185.0 1.0 [ 18 Omega] restrain-dihedral 280 293 294 295 -80.0 -40.0 1.0 [ 19 Phi ] restrain-dihedral 293 294 295 314 -60.0 -20.0 1.0 [ 19 Psi ] restrain-dihedral 294 295 314 315 175.0 185.0 1.0 [ 19 Omega] restrain-dihedral 295 314 315 316 -80.0 -40.0 1.0 [ 20 Phi ] restrain-dihedral 314 315 316 333 -60.0 -20.0 1.0 [ 20 Psi ] restrain-dihedral 315 316 333 334 175.0 185.0 1.0 [ 20 Omega] restrain-dihedral 316 333 334 335 -80.0 -40.0 1.0 [ 21 Phi ] restrain-dihedral 333 334 335 357 -60.0 -20.0 1.0 [ 21 Psi ] restrain-dihedral 334 335 357 358 175.0 185.0 1.0 [ 21 Omega] restrain-dihedral 335 357 358 359 -80.0 -40.0 1.0 [ 22 Phi ] restrain-dihedral 357 358 359 367 -60.0 -20.0 1.0 [ 22 Psi ] restrain-dihedral 358 359 367 368 175.0 185.0 1.0 [ 22 Omega] restrain-dihedral 368 369 386 387 175.0 185.0 1.0 [ 23 Omega] restrain-dihedral 387 388 398 399 175.0 185.0 1.0 [ 24 Omega] restrain-dihedral 399 400 414 415 175.0 185.0 1.0 [ 25 Omega] restrain-dihedral 415 416 428 429 175.0 185.0 1.0 [ 26 Omega] restrain-dihedral 416 428 429 430 -80.0 -40.0 1.0 [ 27 Phi ] restrain-dihedral 428 429 430 444 -60.0 -20.0 1.0 [ 27 Psi ] restrain-dihedral 429 430 444 445 175.0 185.0 1.0 [ 27 Omega] restrain-dihedral 430 444 445 446 -80.0 -40.0 1.0 [ 28 Phi ] restrain-dihedral 444 445 446 454 -60.0 -20.0 1.0 [ 28 Psi ] restrain-dihedral 445 446 454 455 175.0 185.0 1.0 [ 28 Omega] restrain-dihedral 446 454 455 456 -80.0 -40.0 1.0 [ 29 Phi ] restrain-dihedral 454 455 456 473 -60.0 -20.0 1.0 [ 29 Psi ] restrain-dihedral 455 456 473 474 175.0 185.0 1.0 [ 29 Omega] restrain-dihedral 456 473 474 475 -80.0 -40.0 1.0 [ 30 Phi ] restrain-dihedral 473 474 475 497 -60.0 -20.0 1.0 [ 30 Psi ] restrain-dihedral 474 475 497 498 175.0 185.0 1.0 [ 30 Omega] restrain-dihedral 475 497 498 499 -80.0 -40.0 1.0 [ 31 Phi ] restrain-dihedral 497 498 499 519 -60.0 -20.0 1.0 [ 31 Psi ] restrain-dihedral 498 499 519 520 175.0 185.0 1.0 [ 31 Omega] restrain-dihedral 499 519 520 521 -80.0 -40.0 1.0 [ 32 Phi ] restrain-dihedral 519 520 521 538 -60.0 -20.0 1.0 [ 32 Psi ] restrain-dihedral 520 521 538 539 175.0 185.0 1.0 [ 32 Omega] restrain-dihedral 521 538 539 540 -80.0 -40.0 1.0 [ 33 Phi ] restrain-dihedral 538 539 540 548 -60.0 -20.0 1.0 [ 33 Psi ] restrain-dihedral 539 540 548 549 175.0 185.0 1.0 [ 33 Omega] restrain-dihedral 540 548 549 550 -80.0 -40.0 1.0 [ 34 Phi ] restrain-dihedral 548 549 550 562 -60.0 -20.0 1.0 [ 34 Psi ] restrain-dihedral 549 550 562 563 175.0 185.0 1.0 [ 34 Omega] restrain-dihedral 563 564 581 582 175.0 185.0 1.0 [ 35 Omega] restrain-dihedral 582 583 600 601 175.0 185.0 1.0 [ 36 Omega] restrain-dihedral 601 602 622 623 175.0 185.0 1.0 [ 37 Omega] restrain-dihedral 623 624 636 637 175.0 185.0 1.0 [ 38 Omega] restrain-dihedral 637 638 648 649 175.0 185.0 1.0 [ 39 Omega] restrain-dihedral 649 650 670 671 175.0 185.0 1.0 [ 40 Omega] restrain-dihedral 671 672 685 686 175.0 185.0 1.0 [ 41 Omega] restrain-dihedral 686 687 704 705 175.0 185.0 1.0 [ 42 Omega] restrain-dihedral 705 706 720 721 175.0 185.0 1.0 [ 43 Omega] restrain-dihedral 721 722 737 738 175.0 185.0 1.0 [ 44 Omega] restrain-dihedral 738 739 749 750 175.0 185.0 1.0 [ 45 Omega] restrain-dihedral 750 751 756 757 175.0 185.0 1.0 [ 46 Omega] restrain-dihedral 757 758 768 769 175.0 185.0 1.0 [ 47 Omega] restrain-dihedral 769 770 786 787 175.0 185.0 1.0 [ 48 Omega] restrain-dihedral 787 788 803 804 175.0 185.0 1.0 [ 49 Omega] restrain-dihedral 804 805 822 823 175.0 185.0 1.0 [ 50 Omega] restrain-dihedral 823 824 841 842 175.0 185.0 1.0 [ 51 Omega] restrain-dihedral 842 843 865 866 175.0 185.0 1.0 [ 52 Omega] restrain-dihedral 866 867 879 880 175.0 185.0 1.0 [ 53 Omega] restrain-dihedral 880 881 898 899 175.0 185.0 1.0 [ 54 Omega] restrain-dihedral 899 900 909 910 175.0 185.0 1.0 [ 55 Omega] restrain-dihedral 910 911 923 924 175.0 185.0 1.0 [ 56 Omega] restrain-dihedral 924 925 943 944 175.0 185.0 1.0 [ 57 Omega] restrain-dihedral 944 945 967 968 175.0 185.0 1.0 [ 58 Omega] restrain-dihedral 968 969 981 982 175.0 185.0 1.0 [ 59 Omega] restrain-dihedral 982 983 1002 1003 175.0 185.0 1.0 [ 60 Omega] restrain-dihedral 1003 1004 1021 1022 175.0 185.0 1.0 [ 61 Omega] restrain-dihedral 1022 1023 1038 1039 175.0 185.0 1.0 [ 62 Omega] restrain-dihedral 1039 1040 1050 1051 175.0 185.0 1.0 [ 63 Omega] restrain-dihedral 1051 1052 1070 1071 175.0 185.0 1.0 [ 64 Omega] restrain-dihedral 1071 1072 1087 1088 175.0 185.0 1.0 [ 65 Omega] restrain-dihedral 1088 1089 1103 1104 175.0 185.0 1.0 [ 66 Omega] restrain-dihedral 1104 1105 1110 1111 175.0 185.0 1.0 [ 67 Omega] restrain-dihedral 1111 1112 1132 1133 175.0 185.0 1.0 [ 68 Omega] restrain-dihedral 1133 1134 1147 1148 175.0 185.0 1.0 [ 69 Omega] restrain-dihedral 1148 1149 1167 1168 175.0 185.0 1.0 [ 70 Omega] restrain-dihedral 1168 1169 1182 1183 175.0 185.0 1.0 [ 71 Omega] restrain-dihedral 1183 1184 1197 1198 175.0 185.0 1.0 [ 72 Omega] restrain-dihedral 1198 1199 1209 1210 175.0 185.0 1.0 [ 73 Omega] restrain-dihedral 1210 1211 1228 1229 175.0 185.0 1.0 [ 74 Omega] restrain-dihedral 1229 1230 1242 1243 175.0 185.0 1.0 [ 75 Omega] restrain-dihedral 1243 1244 1249 1250 175.0 185.0 1.0 [ 76 Omega] restrain-dihedral 1250 1251 1268 1269 175.0 185.0 1.0 [ 77 Omega] restrain-dihedral 1269 1270 1280 1281 175.0 185.0 1.0 [ 78 Omega] restrain-dihedral 1281 1282 1292 1293 175.0 185.0 1.0 [ 79 Omega] restrain-dihedral 1293 1294 1316 1317 175.0 185.0 1.0 [ 80 Omega] restrain-dihedral 1317 1318 1338 1339 175.0 185.0 1.0 [ 81 Omega] restrain-dihedral 1339 1340 1349 1350 175.0 185.0 1.0 [ 82 Omega] restrain-dihedral 1350 1351 1366 1367 175.0 185.0 1.0 [ 83 Omega] restrain-dihedral 1367 1368 1380 1381 175.0 185.0 1.0 [ 84 Omega] restrain-dihedral 1381 1382 1394 1395 175.0 185.0 1.0 [ 85 Omega] restrain-dihedral 1395 1396 1410 1411 175.0 185.0 1.0 [ 86 Omega] restrain-dihedral 1411 1412 1421 1422 175.0 185.0 1.0 [ 87 Omega] restrain-dihedral 1422 1423 1445 1446 175.0 185.0 1.0 [ 88 Omega] restrain-dihedral 1446 1447 1457 1458 175.0 185.0 1.0 [ 89 Omega] restrain-dihedral 1458 1459 1464 1465 175.0 185.0 1.0 [ 90 Omega] restrain-dihedral 1465 1466 1476 1477 175.0 185.0 1.0 [ 91 Omega] restrain-dihedral 1477 1478 1498 1499 175.0 185.0 1.0 [ 92 Omega] restrain-dihedral 1499 1500 1517 1518 175.0 185.0 1.0 [ 93 Omega] restrain-dihedral 1518 1519 1534 1535 175.0 185.0 1.0 [ 94 Omega] restrain-dihedral 1535 1536 1545 1546 175.0 185.0 1.0 [ 95 Omega] restrain-dihedral 1546 1547 1561 1562 175.0 185.0 1.0 [ 96 Omega] restrain-dihedral 1562 1563 1578 1579 175.0 185.0 1.0 [ 97 Omega] restrain-dihedral 1579 1580 1600 1601 175.0 185.0 1.0 [ 98 Omega] restrain-dihedral 1601 1602 1607 1608 175.0 185.0 1.0 [ 99 Omega] restrain-dihedral 1608 1609 1622 1623 175.0 185.0 1.0 [ 100 Omega] restrain-dihedral 1623 1624 1644 1645 175.0 185.0 1.0 [ 101 Omega] restrain-dihedral 1645 1646 1659 1660 175.0 185.0 1.0 [ 102 Omega] restrain-dihedral 1660 1661 1666 1667 175.0 185.0 1.0 [ 103 Omega] restrain-dihedral 1667 1668 1690 1691 175.0 185.0 1.0 [ 104 Omega] restrain-dihedral 1691 1692 1697 1698 175.0 185.0 1.0 [ 105 Omega] restrain-dihedral 1698 1699 1721 1722 175.0 185.0 1.0 [ 106 Omega] restrain-dihedral 1722 1723 1735 1736 175.0 185.0 1.0 [ 107 Omega] restrain-dihedral 1736 1737 1752 1753 175.0 185.0 1.0 [ 108 Omega] restrain-dihedral 1753 1754 1776 1777 175.0 185.0 1.0 [ 109 Omega] restrain-dihedral 1777 1778 1795 1796 175.0 185.0 1.0 [ 110 Omega] restrain-dihedral 1796 1797 1810 1811 175.0 185.0 1.0 [ 111 Omega] restrain-dihedral 1811 1812 1817 1818 175.0 185.0 1.0 [ 112 Omega] restrain-dihedral 1818 1819 1829 1830 175.0 185.0 1.0 [ 113 Omega] restrain-dihedral 1830 1831 1844 1845 175.0 185.0 1.0 [ 114 Omega] restrain-dihedral 1845 1846 1863 1864 175.0 185.0 1.0 [ 115 Omega] restrain-dihedral 1864 1865 1881 1882 175.0 185.0 1.0 [ 116 Omega] restrain-dihedral 1882 1883 1900 1901 175.0 185.0 1.0 [ 117 Omega] restrain-dihedral 1901 1902 1915 1916 175.0 185.0 1.0 [ 118 Omega] restrain-dihedral 1916 1917 1932 1933 175.0 185.0 1.0 [ 119 Omega] restrain-dihedral 1933 1934 1956 1957 175.0 185.0 1.0 [ 120 Omega] restrain-dihedral 1957 1958 1966 1967 175.0 185.0 1.0 [ 121 Omega] restrain-dihedral 1967 1968 1981 1982 175.0 185.0 1.0 [ 122 Omega] restrain-dihedral 1982 1983 1988 1989 175.0 185.0 1.0 [ 123 Omega] restrain-dihedral 1989 1990 2004 2005 175.0 185.0 1.0 [ 124 Omega] restrain-dihedral 2005 2006 2018 2019 175.0 185.0 1.0 [ 125 Omega] restrain-dihedral 2019 2020 2029 2030 175.0 185.0 1.0 [ 126 Omega] restrain-dihedral 2030 2031 2051 2052 175.0 185.0 1.0 [ 127 Omega] restrain-dihedral 2052 2053 2068 2069 175.0 185.0 1.0 [ 128 Omega] restrain-dihedral 2069 2070 2084 2085 175.0 185.0 1.0 [ 129 Omega] restrain-dihedral 2085 2086 2104 2105 175.0 185.0 1.0 [ 130 Omega] restrain-dihedral 2105 2106 2126 2127 175.0 185.0 1.0 [ 131 Omega] restrain-dihedral 2127 2128 2148 2149 175.0 185.0 1.0 [ 132 Omega] restrain-dihedral 2149 2150 2164 2165 175.0 185.0 1.0 [ 133 Omega] restrain-dihedral 2183 2188 2187 2186 -5.0 5.0 1.0 [ 135 5,6d] restrain-dihedral 2209 2189 2190 2210 175.0 185.0 1.0 [ 135 7d] restrain-dihedral 2201 2191 2192 2211 175.0 185.0 1.0 [ 135 9d] restrain-dihedral 2212 2193 2194 2213 175.0 185.0 1.0 [ 135 11d] restrain-dihedral 2202 2195 2196 2214 175.0 185.0 1.0 [ 135 13d] restrain-dihedral 2187 2188 2189 2190 120.0 240.0 1.0 [ 135 6s] restrain-dihedral 2189 2190 2191 2192 120.0 240.0 1.0 [ 135 8s] restrain-dihedral 2191 2192 2193 2194 120.0 240.0 1.0 [ 135 10s] restrain-dihedral 2193 2194 2195 2196 120.0 240.0 1.0 [ 135 12s]
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