NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | cing | stage | program | type | subtype |
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394474 |
1r9u   |
cing | 3-converted-DOCR | XPLOR/CNS | coordinate | ensemble |
ATOM 1 C ACE A 1 -9.617 2.852 4.049 1.00 0.00 A ATOM 2 CH3 ACE A 1 -11.005 2.533 4.489 1.00 0.00 A ATOM 3 H1 ACE A 1 -10.990 2.195 5.525 1.00 0.00 A ATOM 4 H2 ACE A 1 -11.626 3.425 4.407 1.00 0.00 A ATOM 5 H3 ACE A 1 -11.415 1.746 3.856 1.00 0.00 A ATOM 6 O ACE A 1 -9.098 2.233 3.121 1.00 0.00 A ATOM 7 C TRP A 2 -6.725 3.099 4.822 1.00 0.00 A ATOM 8 CA TRP A 2 -7.667 4.234 4.414 1.00 0.00 A ATOM 9 CB TRP A 2 -7.326 5.564 5.089 1.00 0.00 A ATOM 10 CD1 TRP A 2 -8.131 5.645 7.539 1.00 0.00 A ATOM 11 CD2 TRP A 2 -5.974 5.178 7.342 1.00 0.00 A ATOM 12 CE2 TRP A 2 -6.271 5.190 8.688 1.00 0.00 A ATOM 13 CE3 TRP A 2 -4.673 4.910 6.881 1.00 0.00 A ATOM 14 CG TRP A 2 -7.181 5.472 6.608 1.00 0.00 A ATOM 15 CH2 TRP A 2 -4.018 4.672 9.250 1.00 0.00 A ATOM 16 CZ2 TRP A 2 -5.320 4.941 9.686 1.00 0.00 A ATOM 17 CZ3 TRP A 2 -3.734 4.664 7.890 1.00 0.00 A ATOM 18 HN TRP A 2 -9.457 4.329 5.474 1.00 0.00 A ATOM 19 HA TRP A 2 -7.607 4.399 3.338 1.00 0.00 A ATOM 20 HB2 TRP A 2 -6.396 5.945 4.668 1.00 0.00 A ATOM 21 HB1 TRP A 2 -8.104 6.290 4.850 1.00 0.00 A ATOM 22 HD1 TRP A 2 -9.171 5.882 7.318 1.00 0.00 A ATOM 23 HE1 TRP A 2 -8.183 5.568 9.745 1.00 0.00 A ATOM 24 HE3 TRP A 2 -4.412 4.895 5.822 1.00 0.00 A ATOM 25 HH2 TRP A 2 -3.229 4.470 9.975 1.00 0.00 A ATOM 26 HZ2 TRP A 2 -5.581 4.956 10.744 1.00 0.00 A ATOM 27 HZ3 TRP A 2 -2.709 4.450 7.587 1.00 0.00 A ATOM 28 N TRP A 2 -9.025 3.825 4.726 1.00 0.00 A ATOM 29 NE1 TRP A 2 -7.625 5.482 8.813 1.00 0.00 A ATOM 30 O TRP A 2 -5.714 2.860 4.164 1.00 0.00 A ATOM 31 C ILE A 3 -6.318 0.158 5.502 1.00 0.00 A ATOM 32 CA ILE A 3 -6.263 1.364 6.441 1.00 0.00 A ATOM 33 CB ILE A 3 -6.671 1.041 7.880 1.00 0.00 A ATOM 34 CD1 ILE A 3 -4.289 0.896 8.695 1.00 0.00 A ATOM 35 CG1 ILE A 3 -5.624 0.158 8.562 1.00 0.00 A ATOM 36 CG2 ILE A 3 -8.066 0.414 7.928 1.00 0.00 A ATOM 37 HN ILE A 3 -7.936 2.604 6.411 1.00 0.00 A ATOM 38 HA ILE A 3 -5.238 1.731 6.472 1.00 0.00 A ATOM 39 HB ILE A 3 -6.719 1.975 8.439 1.00 0.00 A ATOM 40 HD11 ILE A 3 -4.475 1.953 8.882 1.00 0.00 A ATOM 41 HD12 ILE A 3 -3.723 0.473 9.526 1.00 0.00 A ATOM 42 HD13 ILE A 3 -3.719 0.784 7.774 1.00 0.00 A ATOM 43 HG12 ILE A 3 -5.980 -0.138 9.549 1.00 0.00 A ATOM 44 HG11 ILE A 3 -5.482 -0.756 7.987 1.00 0.00 A ATOM 45 HG21 ILE A 3 -8.071 -0.507 7.343 1.00 0.00 A ATOM 46 HG22 ILE A 3 -8.329 0.191 8.961 1.00 0.00 A ATOM 47 HG23 ILE A 3 -8.792 1.113 7.510 1.00 0.00 A ATOM 48 N ILE A 3 -7.091 2.430 5.905 1.00 0.00 A ATOM 49 O ILE A 3 -5.394 -0.653 5.471 1.00 0.00 A ATOM 50 C GLN A 4 -6.728 -0.545 2.489 1.00 0.00 A ATOM 51 CA GLN A 4 -7.540 -0.937 3.724 1.00 0.00 A ATOM 52 CB GLN A 4 -9.010 -1.168 3.364 1.00 0.00 A ATOM 53 CD GLN A 4 -11.182 -2.135 4.203 1.00 0.00 A ATOM 54 CG GLN A 4 -9.657 -2.172 4.320 1.00 0.00 A ATOM 55 HN GLN A 4 -8.196 0.689 4.849 1.00 0.00 A ATOM 56 HA GLN A 4 -7.133 -1.849 4.161 1.00 0.00 A ATOM 57 HB2 GLN A 4 -9.550 -0.222 3.403 1.00 0.00 A ATOM 58 HB1 GLN A 4 -9.083 -1.535 2.340 1.00 0.00 A ATOM 59 HE21 GLN A 4 -11.039 -3.315 2.563 1.00 0.00 A ATOM 60 HE22 GLN A 4 -12.650 -2.865 3.015 1.00 0.00 A ATOM 61 HG2 GLN A 4 -9.296 -3.176 4.097 1.00 0.00 A ATOM 62 HG1 GLN A 4 -9.362 -1.947 5.344 1.00 0.00 A ATOM 63 N GLN A 4 -7.410 0.078 4.756 1.00 0.00 A ATOM 64 NE2 GLN A 4 -11.663 -2.829 3.175 1.00 0.00 A ATOM 65 O GLN A 4 -5.926 -1.335 1.993 1.00 0.00 A ATOM 66 OE1 GLN A 4 -11.876 -1.515 4.992 1.00 0.00 A ATOM 67 C Div A 5 -4.658 1.039 1.164 1.00 0.00 A ATOM 68 CA Div A 5 -6.160 1.237 0.955 1.00 0.00 A ATOM 69 CB1 Div A 5 -6.543 0.582 -0.372 1.00 0.00 A ATOM 70 CB2 Div A 5 -6.435 2.740 0.898 1.00 0.00 A ATOM 71 CG1 Div A 5 -8.003 0.825 -0.760 1.00 0.00 A ATOM 72 H Div A 5 -7.683 1.275 2.376 1.00 0.00 A ATOM 73 HB11 Div A 5 -6.393 -0.495 -0.302 1.00 0.00 A ATOM 74 HB12 Div A 5 -5.917 0.983 -1.170 1.00 0.00 A ATOM 75 HB21 Div A 5 -7.512 2.911 0.893 1.00 0.00 A ATOM 76 HB22 Div A 5 -5.997 3.223 1.772 1.00 0.00 A ATOM 77 HB23 Div A 5 -5.996 3.157 -0.008 1.00 0.00 A ATOM 78 HG11 Div A 5 -8.136 1.870 -1.040 1.00 0.00 A ATOM 79 HG12 Div A 5 -8.266 0.188 -1.604 1.00 0.00 A ATOM 80 HG13 Div A 5 -8.648 0.592 0.087 1.00 0.00 A ATOM 81 N Div A 5 -6.962 0.675 2.028 1.00 0.00 A ATOM 82 O Div A 5 -3.950 0.623 0.250 1.00 0.00 A ATOM 83 C ILE A 6 -2.235 -0.010 2.765 1.00 0.00 A ATOM 84 CA ILE A 6 -2.793 1.411 2.660 1.00 0.00 A ATOM 85 CB ILE A 6 -2.532 2.268 3.900 1.00 0.00 A ATOM 86 CD1 ILE A 6 -0.964 3.948 4.937 1.00 0.00 A ATOM 87 CG1 ILE A 6 -1.127 2.873 3.862 1.00 0.00 A ATOM 88 CG2 ILE A 6 -2.777 1.468 5.180 1.00 0.00 A ATOM 89 HN ILE A 6 -4.812 1.550 3.152 1.00 0.00 A ATOM 90 HA ILE A 6 -2.314 1.908 1.817 1.00 0.00 A ATOM 91 HB ILE A 6 -3.240 3.097 3.897 1.00 0.00 A ATOM 92 HD11 ILE A 6 -0.010 4.458 4.801 1.00 0.00 A ATOM 93 HD12 ILE A 6 -1.777 4.671 4.855 1.00 0.00 A ATOM 94 HD13 ILE A 6 -0.990 3.483 5.923 1.00 0.00 A ATOM 95 HG12 ILE A 6 -0.385 2.088 4.011 1.00 0.00 A ATOM 96 HG11 ILE A 6 -0.940 3.305 2.879 1.00 0.00 A ATOM 97 HG21 ILE A 6 -2.840 2.151 6.028 1.00 0.00 A ATOM 98 HG22 ILE A 6 -3.713 0.915 5.090 1.00 0.00 A ATOM 99 HG23 ILE A 6 -1.955 0.770 5.336 1.00 0.00 A ATOM 100 N ILE A 6 -4.217 1.347 2.376 1.00 0.00 A ATOM 101 O ILE A 6 -1.090 -0.260 2.393 1.00 0.00 A ATOM 102 C THR A 7 -2.540 -2.950 2.038 1.00 0.00 A ATOM 103 CA THR A 7 -2.682 -2.297 3.414 1.00 0.00 A ATOM 104 CB THR A 7 -3.712 -2.988 4.311 1.00 0.00 A ATOM 105 CG2 THR A 7 -3.476 -4.495 4.419 1.00 0.00 A ATOM 106 HN THR A 7 -3.995 -0.688 3.591 1.00 0.00 A ATOM 107 HA THR A 7 -1.702 -2.335 3.889 1.00 0.00 A ATOM 108 HB THR A 7 -4.726 -2.774 3.974 1.00 0.00 A ATOM 109 HG1 THR A 7 -3.918 -1.645 5.780 1.00 0.00 A ATOM 110 HG21 THR A 7 -4.158 -4.917 5.157 1.00 0.00 A ATOM 111 HG22 THR A 7 -3.655 -4.961 3.450 1.00 0.00 A ATOM 112 HG23 THR A 7 -2.447 -4.682 4.728 1.00 0.00 A ATOM 113 N THR A 7 -3.070 -0.903 3.276 1.00 0.00 A ATOM 114 O THR A 7 -1.603 -3.710 1.802 1.00 0.00 A ATOM 115 OG1 THR A 7 -3.419 -2.495 5.616 1.00 0.00 A ATOM 116 C ABA A 8 -2.239 -2.606 -0.988 1.00 0.00 A ATOM 117 CA ABA A 8 -3.442 -3.127 -0.199 1.00 0.00 A ATOM 118 H ABA A 8 -4.267 -2.044 1.378 1.00 0.00 A ATOM 119 N ABA A 8 -3.484 -2.630 1.165 1.00 0.00 A ATOM 120 O ABA A 8 -1.660 -3.331 -1.795 1.00 0.00 A ATOM 121 C LEU A 9 0.495 -0.945 -0.865 1.00 0.00 A ATOM 122 CA LEU A 9 -0.870 -0.679 -1.500 1.00 0.00 A ATOM 123 CB LEU A 9 -1.200 0.807 -1.651 1.00 0.00 A ATOM 124 CD1 LEU A 9 -2.880 2.585 -2.265 1.00 0.00 A ATOM 125 CD2 LEU A 9 -2.182 0.845 -3.973 1.00 0.00 A ATOM 126 CG LEU A 9 -2.432 1.140 -2.494 1.00 0.00 A ATOM 127 HN LEU A 9 -2.314 -0.800 -0.004 1.00 0.00 A ATOM 128 HA LEU A 9 -0.877 -1.113 -2.499 1.00 0.00 A ATOM 129 HB2 LEU A 9 -1.338 1.231 -0.656 1.00 0.00 A ATOM 130 HB1 LEU A 9 -0.337 1.307 -2.092 1.00 0.00 A ATOM 131 HD11 LEU A 9 -2.074 3.264 -2.546 1.00 0.00 A ATOM 132 HD12 LEU A 9 -3.759 2.794 -2.874 1.00 0.00 A ATOM 133 HD13 LEU A 9 -3.124 2.728 -1.212 1.00 0.00 A ATOM 134 HD21 LEU A 9 -3.000 1.248 -4.569 1.00 0.00 A ATOM 135 HD22 LEU A 9 -1.244 1.309 -4.283 1.00 0.00 A ATOM 136 HD23 LEU A 9 -2.120 -0.233 -4.123 1.00 0.00 A ATOM 137 HG LEU A 9 -3.251 0.496 -2.170 1.00 0.00 A ATOM 138 N LEU A 9 -1.900 -1.352 -0.727 1.00 0.00 A ATOM 139 O LEU A 9 1.527 -0.793 -1.516 1.00 0.00 A ATOM 140 C ABA A 10 2.808 -2.147 0.464 1.00 0.00 A ATOM 141 CA ABA A 10 1.671 -1.429 1.193 1.00 0.00 A ATOM 142 H ABA A 10 -0.382 -1.591 0.883 1.00 0.00 A ATOM 143 N ABA A 10 0.457 -1.338 0.400 1.00 0.00 A ATOM 144 O ABA A 10 3.907 -1.608 0.334 1.00 0.00 A ATOM 145 C HYP A 11 3.959 -3.802 -1.939 1.00 0.00 A ATOM 146 CA HYP A 11 3.525 -4.260 -0.545 1.00 0.00 A ATOM 147 CB HYP A 11 2.901 -5.646 -0.544 1.00 0.00 A ATOM 148 CD2 HYP A 11 1.166 -3.982 -0.038 1.00 0.00 A ATOM 149 CG HYP A 11 1.400 -5.428 -0.443 1.00 0.00 A ATOM 150 HA HYP A 11 4.418 -4.218 0.077 1.00 0.00 A ATOM 151 HB2 HYP A 11 3.156 -6.191 -1.453 1.00 0.00 A ATOM 152 HB3 HYP A 11 3.266 -6.238 0.295 1.00 0.00 A ATOM 153 HD1 HYP A 11 1.382 -5.944 1.550 1.00 0.00 A ATOM 154 HD22 HYP A 11 0.519 -3.470 -0.750 1.00 0.00 A ATOM 155 HD23 HYP A 11 0.680 -3.917 0.936 1.00 0.00 A ATOM 156 HG HYP A 11 0.885 -5.682 -1.369 1.00 0.00 A ATOM 157 N HYP A 11 2.498 -3.385 -0.006 1.00 0.00 A ATOM 158 O HYP A 11 4.988 -4.243 -2.448 1.00 0.00 A ATOM 159 OD1 HYP A 11 0.940 -6.255 0.708 1.00 0.00 A ATOM 160 C GLN A 12 4.325 -1.305 -3.932 1.00 0.00 A ATOM 161 CA GLN A 12 3.369 -2.499 -3.889 1.00 0.00 A ATOM 162 CB GLN A 12 2.043 -2.164 -4.574 1.00 0.00 A ATOM 163 CD GLN A 12 -0.184 -3.072 -5.336 1.00 0.00 A ATOM 164 CG GLN A 12 1.091 -3.363 -4.542 1.00 0.00 A ATOM 165 HN GLN A 12 2.367 -2.503 -2.062 1.00 0.00 A ATOM 166 HA GLN A 12 3.824 -3.355 -4.388 1.00 0.00 A ATOM 167 HB2 GLN A 12 1.578 -1.313 -4.079 1.00 0.00 A ATOM 168 HB1 GLN A 12 2.227 -1.870 -5.608 1.00 0.00 A ATOM 169 HE21 GLN A 12 0.769 -3.708 -7.006 1.00 0.00 A ATOM 170 HE22 GLN A 12 -0.867 -3.189 -7.238 1.00 0.00 A ATOM 171 HG2 GLN A 12 1.591 -4.239 -4.955 1.00 0.00 A ATOM 172 HG1 GLN A 12 0.835 -3.599 -3.509 1.00 0.00 A ATOM 173 N GLN A 12 3.154 -2.923 -2.516 1.00 0.00 A ATOM 174 NE2 GLN A 12 -0.086 -3.346 -6.634 1.00 0.00 A ATOM 175 O GLN A 12 5.090 -1.151 -4.884 1.00 0.00 A ATOM 176 OE1 GLN A 12 -1.188 -2.629 -4.806 1.00 0.00 A ATOM 177 C ABA A 13 6.383 0.733 -3.273 1.00 0.00 A ATOM 178 CA ABA A 13 4.898 0.811 -2.909 1.00 0.00 A ATOM 179 H ABA A 13 3.759 -0.705 -2.046 1.00 0.00 A ATOM 180 N ABA A 13 4.249 -0.490 -2.891 1.00 0.00 A ATOM 181 O ABA A 13 6.842 1.432 -4.174 1.00 0.00 A ATOM 182 C HYP A 14 9.049 -0.795 -3.898 1.00 0.00 A ATOM 183 CA HYP A 14 8.562 -0.156 -2.596 1.00 0.00 A ATOM 184 CB HYP A 14 9.003 -0.920 -1.358 1.00 0.00 A ATOM 185 CD2 HYP A 14 6.572 -1.150 -1.621 1.00 0.00 A ATOM 186 CG HYP A 14 7.787 -1.706 -0.896 1.00 0.00 A ATOM 187 HA HYP A 14 8.944 0.864 -2.600 1.00 0.00 A ATOM 188 HB2 HYP A 14 9.836 -1.586 -1.586 1.00 0.00 A ATOM 189 HB3 HYP A 14 9.346 -0.237 -0.580 1.00 0.00 A ATOM 190 HD1 HYP A 14 6.913 -1.966 0.948 1.00 0.00 A ATOM 191 HD22 HYP A 14 6.042 -1.934 -2.162 1.00 0.00 A ATOM 192 HD23 HYP A 14 5.861 -0.710 -0.921 1.00 0.00 A ATOM 193 HG HYP A 14 7.906 -2.777 -1.056 1.00 0.00 A ATOM 194 N HYP A 14 7.109 -0.147 -2.533 1.00 0.00 A ATOM 195 O HYP A 14 10.126 -0.462 -4.391 1.00 0.00 A ATOM 196 OD1 HYP A 14 7.599 -1.363 0.541 1.00 0.00 A ATOM 197 C ABA A 15 9.543 -2.100 -6.495 1.00 0.00 A ATOM 198 CA ABA A 15 8.723 -2.700 -5.352 1.00 0.00 A ATOM 199 H ABA A 15 7.257 -1.757 -4.211 1.00 0.00 A ATOM 200 N ABA A 15 8.233 -1.701 -4.417 1.00 0.00 A ATOM 201 O ABA A 15 10.678 -2.513 -6.734 1.00 0.00 A ATOM 202 C PRO A 16 10.689 0.308 -8.145 1.00 0.00 A ATOM 203 CA PRO A 16 9.486 -0.594 -8.424 1.00 0.00 A ATOM 204 CB PRO A 16 8.340 0.137 -9.104 1.00 0.00 A ATOM 205 CD PRO A 16 7.672 -0.455 -6.815 1.00 0.00 A ATOM 206 CG PRO A 16 7.312 0.404 -8.018 1.00 0.00 A ATOM 207 HA PRO A 16 9.832 -1.345 -8.987 1.00 0.00 A ATOM 208 HB2 PRO A 16 8.684 1.069 -9.554 1.00 0.00 A ATOM 209 HB1 PRO A 16 7.914 -0.465 -9.907 1.00 0.00 A ATOM 210 HD2 PRO A 16 7.794 0.153 -5.918 1.00 0.00 A ATOM 211 HD1 PRO A 16 6.891 -1.184 -6.601 1.00 0.00 A ATOM 212 HG2 PRO A 16 7.308 1.459 -7.746 1.00 0.00 A ATOM 213 HG1 PRO A 16 6.310 0.162 -8.372 1.00 0.00 A ATOM 214 N PRO A 16 8.923 -1.109 -7.189 1.00 0.00 A ATOM 215 O PRO A 16 11.450 0.634 -9.054 1.00 0.00 A ATOM 216 C PHL A 17 13.006 0.625 -5.750 1.00 0.00 A ATOM 217 CA PHL A 17 11.959 1.488 -6.457 1.00 0.00 A ATOM 218 CB PHL A 17 11.426 2.533 -5.475 1.00 0.00 A ATOM 219 CD1 PHL A 17 9.135 3.327 -6.100 1.00 0.00 A ATOM 220 CD2 PHL A 17 10.973 4.687 -6.669 1.00 0.00 A ATOM 221 CE1 PHL A 17 8.253 4.273 -6.685 1.00 0.00 A ATOM 222 CE2 PHL A 17 10.091 5.633 -7.254 1.00 0.00 A ATOM 223 CG PHL A 17 10.477 3.554 -6.105 1.00 0.00 A ATOM 224 CZ PHL A 17 8.750 5.408 -7.250 1.00 0.00 A ATOM 225 H2 PHL A 17 10.175 0.455 -6.157 1.00 0.00 A ATOM 226 HA PHL A 17 12.398 1.926 -7.354 1.00 0.00 A ATOM 227 HB2 PHL A 17 10.908 2.022 -4.663 1.00 0.00 A ATOM 228 HB3 PHL A 17 12.269 3.063 -5.031 1.00 0.00 A ATOM 229 HC1 PHL A 17 13.312 -0.180 -6.417 1.00 0.00 A ATOM 230 HC2 PHL A 17 12.567 0.212 -4.842 1.00 0.00 A ATOM 231 HD1 PHL A 17 8.738 2.419 -5.648 1.00 0.00 A ATOM 232 HD2 PHL A 17 12.048 4.868 -6.673 1.00 0.00 A ATOM 233 HE1 PHL A 17 7.179 4.093 -6.682 1.00 0.00 A ATOM 234 HE2 PHL A 17 10.489 6.542 -7.707 1.00 0.00 A ATOM 235 HO PHL A 17 14.686 0.887 -4.694 1.00 0.00 A ATOM 236 HZ PHL A 17 8.073 6.134 -7.698 1.00 0.00 A ATOM 237 N PHL A 17 10.824 0.687 -6.882 1.00 0.00 A ATOM 238 O PHL A 17 14.162 1.376 -5.390 1.00 0.00 A END
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