NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | stage | program | type | subtype |
391325 | 1pan | cing | 3-converted-DOCR | XPLOR/CNS | coordinate | ensemble |
ATOM 1 C ACE A 127 -10.330 0.899 2.799 1.00 0.00 A ATOM 2 CH3 ACE A 127 -10.993 -0.245 3.566 1.00 0.00 A ATOM 3 H1 ACE A 127 -12.045 -0.013 3.814 1.00 0.00 A ATOM 4 H2 ACE A 127 -10.996 -1.178 2.971 1.00 0.00 A ATOM 5 H3 ACE A 127 -10.461 -0.462 4.511 1.00 0.00 A ATOM 6 O ACE A 127 -9.876 0.711 1.667 1.00 0.00 A ATOM 7 C ALA A 128 -8.210 3.440 3.352 1.00 0.00 A ATOM 8 CA ALA A 128 -9.674 3.296 2.854 1.00 0.00 A ATOM 9 CB ALA A 128 -10.540 4.515 3.233 1.00 0.00 A ATOM 10 HN ALA A 128 -10.677 2.065 4.390 1.00 0.00 A ATOM 11 HA ALA A 128 -9.692 3.243 1.746 1.00 0.00 A ATOM 12 HB1 ALA A 128 -10.613 4.660 4.328 1.00 0.00 A ATOM 13 HB2 ALA A 128 -10.126 5.449 2.809 1.00 0.00 A ATOM 14 HB3 ALA A 128 -11.571 4.421 2.845 1.00 0.00 A ATOM 15 N ALA A 128 -10.284 2.076 3.443 1.00 0.00 A ATOM 16 O ALA A 128 -7.956 3.920 4.462 1.00 0.00 A ATOM 17 C CYS A 129 -5.053 4.061 1.985 1.00 0.00 A ATOM 18 CA CYS A 129 -5.808 2.994 2.833 1.00 0.00 A ATOM 19 CB CYS A 129 -5.271 1.565 2.595 1.00 0.00 A ATOM 20 HN CYS A 129 -7.612 2.610 1.626 1.00 0.00 A ATOM 21 HA CYS A 129 -5.661 3.213 3.910 1.00 0.00 A ATOM 22 HB2 CYS A 129 -5.945 0.802 3.031 1.00 0.00 A ATOM 23 HB1 CYS A 129 -5.192 1.334 1.516 1.00 0.00 A ATOM 24 N CYS A 129 -7.260 2.987 2.513 1.00 0.00 A ATOM 25 O CYS A 129 -5.451 4.399 0.864 1.00 0.00 A ATOM 26 SG CYS A 129 -3.668 1.371 3.394 1.00 0.00 A ATOM 27 C LYS A 130 -2.236 4.965 0.714 1.00 0.00 A ATOM 28 CA LYS A 130 -3.087 5.599 1.857 1.00 0.00 A ATOM 29 CB LYS A 130 -2.195 6.276 2.939 1.00 0.00 A ATOM 30 CD LYS A 130 -1.921 8.656 1.892 1.00 0.00 A ATOM 31 CE LYS A 130 -0.950 9.732 1.364 1.00 0.00 A ATOM 32 CG LYS A 130 -1.235 7.398 2.472 1.00 0.00 A ATOM 33 HN LYS A 130 -3.702 4.207 3.462 1.00 0.00 A ATOM 34 HA LYS A 130 -3.759 6.377 1.442 1.00 0.00 A ATOM 35 HB2 LYS A 130 -2.839 6.691 3.739 1.00 0.00 A ATOM 36 HB1 LYS A 130 -1.582 5.505 3.445 1.00 0.00 A ATOM 37 HD2 LYS A 130 -2.570 8.354 1.049 1.00 0.00 A ATOM 38 HD1 LYS A 130 -2.606 9.096 2.641 1.00 0.00 A ATOM 39 HE2 LYS A 130 -0.241 9.289 0.640 1.00 0.00 A ATOM 40 HE1 LYS A 130 -1.521 10.489 0.796 1.00 0.00 A ATOM 41 HG2 LYS A 130 -0.608 7.695 3.334 1.00 0.00 A ATOM 42 HG1 LYS A 130 -0.524 6.987 1.732 1.00 0.00 A ATOM 43 HZ1 LYS A 130 -0.827 10.886 3.096 1.00 0.00 A ATOM 44 HZ2 LYS A 130 0.380 9.765 2.969 1.00 0.00 A ATOM 45 HZ3 LYS A 130 0.427 11.137 2.051 1.00 0.00 A ATOM 46 N LYS A 130 -3.931 4.572 2.531 1.00 0.00 A ATOM 47 NZ LYS A 130 -0.199 10.420 2.432 1.00 0.00 A ATOM 48 O LYS A 130 -1.534 3.971 0.925 1.00 0.00 A ATOM 49 C SER A 131 -0.125 5.666 -1.719 1.00 0.00 A ATOM 50 CA SER A 131 -1.570 5.093 -1.688 1.00 0.00 A ATOM 51 CB SER A 131 -2.384 5.444 -2.960 1.00 0.00 A ATOM 52 HN SER A 131 -2.913 6.397 -0.519 1.00 0.00 A ATOM 53 HA SER A 131 -1.516 3.986 -1.665 1.00 0.00 A ATOM 54 HB2 SER A 131 -1.860 5.055 -3.852 1.00 0.00 A ATOM 55 HB1 SER A 131 -3.367 4.939 -2.938 1.00 0.00 A ATOM 56 HG SER A 131 -3.079 6.955 -3.930 1.00 0.00 A ATOM 57 N SER A 131 -2.303 5.574 -0.486 1.00 0.00 A ATOM 58 O SER A 131 0.110 6.798 -2.155 1.00 0.00 A ATOM 59 OG SER A 131 -2.578 6.847 -3.119 1.00 0.00 A ATOM 60 C THR A 132 3.059 3.910 -1.380 1.00 0.00 A ATOM 61 CA THR A 132 2.271 5.237 -1.164 1.00 0.00 A ATOM 62 CB THR A 132 2.572 5.966 0.190 1.00 0.00 A ATOM 63 CG2 THR A 132 4.043 6.365 0.386 1.00 0.00 A ATOM 64 HN THR A 132 0.493 3.959 -0.872 1.00 0.00 A ATOM 65 HA THR A 132 2.522 5.930 -1.992 1.00 0.00 A ATOM 66 HB THR A 132 2.275 5.310 1.031 1.00 0.00 A ATOM 67 HG1 THR A 132 0.894 6.911 0.197 1.00 0.00 A ATOM 68 HG21 THR A 132 4.419 6.976 -0.455 1.00 0.00 A ATOM 69 HG22 THR A 132 4.177 6.951 1.313 1.00 0.00 A ATOM 70 HG23 THR A 132 4.694 5.477 0.476 1.00 0.00 A ATOM 71 N THR A 132 0.831 4.862 -1.221 1.00 0.00 A ATOM 72 O THR A 132 3.509 3.291 -0.413 1.00 0.00 A ATOM 73 OG1 THR A 132 1.815 7.171 0.275 1.00 0.00 A ATOM 74 C GLN A 133 5.403 2.265 -2.980 1.00 0.00 A ATOM 75 CA GLN A 133 3.850 2.158 -2.974 1.00 0.00 A ATOM 76 CB GLN A 133 3.288 1.613 -4.317 1.00 0.00 A ATOM 77 CD GLN A 133 1.272 0.537 -5.524 1.00 0.00 A ATOM 78 CG GLN A 133 1.816 1.140 -4.220 1.00 0.00 A ATOM 79 HN GLN A 133 2.821 4.078 -3.371 1.00 0.00 A ATOM 80 HA GLN A 133 3.551 1.420 -2.205 1.00 0.00 A ATOM 81 HB2 GLN A 133 3.379 2.387 -5.104 1.00 0.00 A ATOM 82 HB1 GLN A 133 3.903 0.756 -4.658 1.00 0.00 A ATOM 83 HE21 GLN A 133 0.309 2.245 -5.949 1.00 0.00 A ATOM 84 HE22 GLN A 133 0.137 0.864 -7.146 1.00 0.00 A ATOM 85 HG2 GLN A 133 1.733 0.368 -3.433 1.00 0.00 A ATOM 86 HG1 GLN A 133 1.168 1.969 -3.871 1.00 0.00 A ATOM 87 N GLN A 133 3.236 3.479 -2.649 1.00 0.00 A ATOM 88 NE2 GLN A 133 0.493 1.292 -6.284 1.00 0.00 A ATOM 89 O GLN A 133 6.014 2.785 -3.919 1.00 0.00 A ATOM 90 OE1 GLN A 133 1.535 -0.620 -5.852 1.00 0.00 A ATOM 91 C ASP A 134 8.015 0.441 -1.135 1.00 0.00 A ATOM 92 CA ASP A 134 7.471 1.838 -1.617 1.00 0.00 A ATOM 93 CB ASP A 134 7.739 2.939 -0.545 1.00 0.00 A ATOM 94 CG ASP A 134 7.687 4.372 -1.097 1.00 0.00 A ATOM 95 HN ASP A 134 5.356 1.394 -1.182 1.00 0.00 A ATOM 96 HA ASP A 134 8.004 2.098 -2.552 1.00 0.00 A ATOM 97 HB2 ASP A 134 7.045 2.829 0.312 1.00 0.00 A ATOM 98 HB1 ASP A 134 8.745 2.803 -0.106 1.00 0.00 A ATOM 99 N ASP A 134 6.002 1.786 -1.875 1.00 0.00 A ATOM 100 O ASP A 134 7.213 -0.422 -0.755 1.00 0.00 A ATOM 101 OD1 ASP A 134 6.578 4.934 -1.227 1.00 0.00 A ATOM 102 OD2 ASP A 134 8.758 4.937 -1.413 1.00 0.00 A ATOM 103 C PRO A 135 9.530 -1.565 0.885 1.00 0.00 A ATOM 104 CA PRO A 135 9.919 -1.120 -0.561 1.00 0.00 A ATOM 105 CB PRO A 135 11.440 -0.927 -0.719 1.00 0.00 A ATOM 106 CD PRO A 135 10.403 1.014 -1.694 1.00 0.00 A ATOM 107 CG PRO A 135 11.598 0.074 -1.861 1.00 0.00 A ATOM 108 HA PRO A 135 9.579 -1.923 -1.242 1.00 0.00 A ATOM 109 HB2 PRO A 135 11.901 -0.510 0.198 1.00 0.00 A ATOM 110 HB1 PRO A 135 11.961 -1.880 -0.926 1.00 0.00 A ATOM 111 HD2 PRO A 135 10.653 1.863 -1.032 1.00 0.00 A ATOM 112 HD1 PRO A 135 10.102 1.433 -2.672 1.00 0.00 A ATOM 113 HG2 PRO A 135 12.565 0.608 -1.829 1.00 0.00 A ATOM 114 HG1 PRO A 135 11.544 -0.447 -2.837 1.00 0.00 A ATOM 115 N PRO A 135 9.359 0.163 -1.085 1.00 0.00 A ATOM 116 O PRO A 135 9.262 -2.753 1.087 1.00 0.00 A ATOM 117 C MET A 136 7.386 -1.065 3.340 1.00 0.00 A ATOM 118 CA MET A 136 8.951 -0.935 3.235 1.00 0.00 A ATOM 119 CB MET A 136 9.507 0.173 4.175 1.00 0.00 A ATOM 120 CE MET A 136 11.877 -1.160 6.304 1.00 0.00 A ATOM 121 CG MET A 136 9.353 -0.084 5.687 1.00 0.00 A ATOM 122 HN MET A 136 9.697 0.320 1.565 1.00 0.00 A ATOM 123 HA MET A 136 9.373 -1.904 3.553 1.00 0.00 A ATOM 124 HB2 MET A 136 10.587 0.322 3.984 1.00 0.00 A ATOM 125 HB1 MET A 136 9.039 1.146 3.930 1.00 0.00 A ATOM 126 HE1 MET A 136 12.008 -0.333 7.025 1.00 0.00 A ATOM 127 HE2 MET A 136 12.488 -2.014 6.649 1.00 0.00 A ATOM 128 HE3 MET A 136 12.271 -0.834 5.325 1.00 0.00 A ATOM 129 HG2 MET A 136 9.786 0.752 6.267 1.00 0.00 A ATOM 130 HG1 MET A 136 8.284 -0.122 5.967 1.00 0.00 A ATOM 131 N MET A 136 9.461 -0.634 1.860 1.00 0.00 A ATOM 132 O MET A 136 6.898 -1.720 4.265 1.00 0.00 A ATOM 133 SD MET A 136 10.140 -1.638 6.178 1.00 0.00 A ATOM 134 C PHE A 137 4.790 -2.002 1.616 1.00 0.00 A ATOM 135 CA PHE A 137 5.145 -0.641 2.293 1.00 0.00 A ATOM 136 CB PHE A 137 4.644 0.584 1.474 1.00 0.00 A ATOM 137 CD1 PHE A 137 2.577 0.187 0.041 1.00 0.00 A ATOM 138 CD2 PHE A 137 2.346 1.553 2.020 1.00 0.00 A ATOM 139 CE1 PHE A 137 1.271 0.499 -0.327 1.00 0.00 A ATOM 140 CE2 PHE A 137 1.040 1.864 1.648 1.00 0.00 A ATOM 141 CG PHE A 137 3.133 0.729 1.207 1.00 0.00 A ATOM 142 CZ PHE A 137 0.512 1.350 0.466 1.00 0.00 A ATOM 143 HN PHE A 137 7.179 -0.113 1.616 1.00 0.00 A ATOM 144 HA PHE A 137 4.700 -0.591 3.308 1.00 0.00 A ATOM 145 HB2 PHE A 137 4.998 1.514 1.965 1.00 0.00 A ATOM 146 HB1 PHE A 137 5.164 0.606 0.498 1.00 0.00 A ATOM 147 HD1 PHE A 137 3.171 -0.436 -0.613 1.00 0.00 A ATOM 148 HD2 PHE A 137 2.760 2.000 2.913 1.00 0.00 A ATOM 149 HE1 PHE A 137 0.857 0.111 -1.245 1.00 0.00 A ATOM 150 HE2 PHE A 137 0.447 2.527 2.261 1.00 0.00 A ATOM 151 HZ PHE A 137 -0.483 1.624 0.152 1.00 0.00 A ATOM 152 N PHE A 137 6.621 -0.485 2.394 1.00 0.00 A ATOM 153 O PHE A 137 5.534 -2.511 0.770 1.00 0.00 A ATOM 154 C THR A 138 1.880 -3.444 0.484 1.00 0.00 A ATOM 155 CA THR A 138 3.092 -3.819 1.405 1.00 0.00 A ATOM 156 CB THR A 138 2.693 -4.861 2.498 1.00 0.00 A ATOM 157 CG2 THR A 138 3.899 -5.458 3.244 1.00 0.00 A ATOM 158 HN THR A 138 3.106 -2.033 2.706 1.00 0.00 A ATOM 159 HA THR A 138 3.864 -4.322 0.791 1.00 0.00 A ATOM 160 HB THR A 138 2.166 -5.696 1.999 1.00 0.00 A ATOM 161 HG1 THR A 138 2.304 -3.584 3.887 1.00 0.00 A ATOM 162 HG21 THR A 138 4.604 -5.950 2.548 1.00 0.00 A ATOM 163 HG22 THR A 138 4.465 -4.688 3.800 1.00 0.00 A ATOM 164 HG23 THR A 138 3.578 -6.223 3.975 1.00 0.00 A ATOM 165 N THR A 138 3.627 -2.561 1.998 1.00 0.00 A ATOM 166 O THR A 138 0.808 -3.150 1.028 1.00 0.00 A ATOM 167 OG1 THR A 138 1.812 -4.293 3.466 1.00 0.00 A ATOM 168 C PRO A 139 -0.447 -4.066 -1.657 1.00 0.00 A ATOM 169 CA PRO A 139 0.813 -3.159 -1.781 1.00 0.00 A ATOM 170 CB PRO A 139 1.441 -3.203 -3.190 1.00 0.00 A ATOM 171 CD PRO A 139 3.237 -3.554 -1.633 1.00 0.00 A ATOM 172 CG PRO A 139 2.922 -2.905 -2.979 1.00 0.00 A ATOM 173 HA PRO A 139 0.482 -2.131 -1.572 1.00 0.00 A ATOM 174 HB2 PRO A 139 1.328 -4.200 -3.660 1.00 0.00 A ATOM 175 HB1 PRO A 139 0.978 -2.472 -3.875 1.00 0.00 A ATOM 176 HD2 PRO A 139 3.526 -4.616 -1.749 1.00 0.00 A ATOM 177 HD1 PRO A 139 4.073 -3.025 -1.148 1.00 0.00 A ATOM 178 HG2 PRO A 139 3.556 -3.293 -3.797 1.00 0.00 A ATOM 179 HG1 PRO A 139 3.087 -1.811 -2.927 1.00 0.00 A ATOM 180 N PRO A 139 1.968 -3.451 -0.884 1.00 0.00 A ATOM 181 O PRO A 139 -1.567 -3.550 -1.673 1.00 0.00 A ATOM 182 C LYS A 140 -1.984 -6.195 0.105 1.00 0.00 A ATOM 183 CA LYS A 140 -1.378 -6.361 -1.324 1.00 0.00 A ATOM 184 CB LYS A 140 -0.839 -7.792 -1.593 1.00 0.00 A ATOM 185 CD LYS A 140 -1.416 -10.300 -1.995 1.00 0.00 A ATOM 186 CE LYS A 140 -0.905 -10.492 -3.437 1.00 0.00 A ATOM 187 CG LYS A 140 -1.934 -8.881 -1.685 1.00 0.00 A ATOM 188 HN LYS A 140 0.725 -5.655 -1.453 1.00 0.00 A ATOM 189 HA LYS A 140 -2.146 -6.150 -2.097 1.00 0.00 A ATOM 190 HB2 LYS A 140 -0.278 -7.791 -2.547 1.00 0.00 A ATOM 191 HB1 LYS A 140 -0.098 -8.075 -0.820 1.00 0.00 A ATOM 192 HD2 LYS A 140 -0.627 -10.573 -1.267 1.00 0.00 A ATOM 193 HD1 LYS A 140 -2.242 -11.012 -1.808 1.00 0.00 A ATOM 194 HE2 LYS A 140 -1.692 -10.222 -4.165 1.00 0.00 A ATOM 195 HE1 LYS A 140 -0.050 -9.822 -3.643 1.00 0.00 A ATOM 196 HG2 LYS A 140 -2.481 -8.918 -0.724 1.00 0.00 A ATOM 197 HG1 LYS A 140 -2.693 -8.591 -2.437 1.00 0.00 A ATOM 198 HZ1 LYS A 140 -1.259 -12.542 -3.537 1.00 0.00 A ATOM 199 HZ2 LYS A 140 -0.146 -12.015 -4.638 1.00 0.00 A ATOM 200 HZ3 LYS A 140 0.273 -12.165 -3.048 1.00 0.00 A ATOM 201 N LYS A 140 -0.264 -5.393 -1.510 1.00 0.00 A ATOM 202 NZ LYS A 140 -0.485 -11.884 -3.679 1.00 0.00 A ATOM 203 O LYS A 140 -1.309 -6.432 1.113 1.00 0.00 A ATOM 204 C GLY A 141 -4.133 -3.875 1.677 1.00 0.00 A ATOM 205 CA GLY A 141 -3.949 -5.395 1.411 1.00 0.00 A ATOM 206 HN GLY A 141 -3.665 -5.552 -0.769 1.00 0.00 A ATOM 207 HA2 GLY A 141 -4.946 -5.873 1.406 1.00 0.00 A ATOM 208 HA1 GLY A 141 -3.423 -5.816 2.288 1.00 0.00 A ATOM 209 N GLY A 141 -3.252 -5.755 0.148 1.00 0.00 A ATOM 210 O GLY A 141 -5.075 -3.526 2.393 1.00 0.00 A ATOM 211 C CYS A 142 -3.807 -0.952 -0.144 1.00 0.00 A ATOM 212 CA CYS A 142 -3.422 -1.514 1.254 1.00 0.00 A ATOM 213 CB CYS A 142 -2.148 -0.922 1.904 1.00 0.00 A ATOM 214 HN CYS A 142 -2.556 -3.408 0.527 1.00 0.00 A ATOM 215 HA CYS A 142 -4.250 -1.260 1.944 1.00 0.00 A ATOM 216 HB2 CYS A 142 -1.983 -1.349 2.911 1.00 0.00 A ATOM 217 HB1 CYS A 142 -1.249 -1.155 1.303 1.00 0.00 A ATOM 218 N CYS A 142 -3.277 -2.986 1.124 1.00 0.00 A ATOM 219 O CYS A 142 -5.005 -0.799 -0.400 1.00 0.00 A ATOM 220 SG CYS A 142 -2.293 0.872 2.038 1.00 0.00 A ATOM 221 C ASP A 143 -2.217 -0.928 -3.387 1.00 0.00 A ATOM 222 CA ASP A 143 -3.116 -0.135 -2.405 1.00 0.00 A ATOM 223 CB ASP A 143 -2.864 1.394 -2.508 1.00 0.00 A ATOM 224 CG ASP A 143 -3.904 2.239 -1.758 1.00 0.00 A ATOM 225 HN ASP A 143 -1.879 -0.809 -0.702 1.00 0.00 A ATOM 226 HA ASP A 143 -4.179 -0.310 -2.676 1.00 0.00 A ATOM 227 HB2 ASP A 143 -1.846 1.643 -2.151 1.00 0.00 A ATOM 228 HB1 ASP A 143 -2.888 1.699 -3.572 1.00 0.00 A ATOM 229 N ASP A 143 -2.836 -0.644 -1.033 1.00 0.00 A ATOM 230 O ASP A 143 -1.001 -0.712 -3.440 1.00 0.00 A ATOM 231 OD1 ASP A 143 -3.747 2.428 -0.533 1.00 0.00 A ATOM 232 OD2 ASP A 143 -4.881 2.706 -2.383 1.00 0.00 A ATOM 233 C ASN A 144 -2.205 -2.113 -6.526 1.00 0.00 A ATOM 234 CA ASN A 144 -2.110 -2.726 -5.110 1.00 0.00 A ATOM 235 CB ASN A 144 -2.695 -4.163 -5.009 1.00 0.00 A ATOM 236 CG ASN A 144 -1.899 -5.242 -5.771 1.00 0.00 A ATOM 237 HN ASN A 144 -3.845 -1.925 -4.008 1.00 0.00 A ATOM 238 HA ASN A 144 -1.041 -2.790 -4.833 1.00 0.00 A ATOM 239 HB2 ASN A 144 -2.776 -4.467 -3.945 1.00 0.00 A ATOM 240 HB1 ASN A 144 -3.742 -4.175 -5.371 1.00 0.00 A ATOM 241 HD21 ASN A 144 -0.762 -5.598 -4.156 1.00 0.00 A ATOM 242 HD22 ASN A 144 -0.413 -6.585 -5.663 1.00 0.00 A ATOM 243 N ASN A 144 -2.832 -1.848 -4.154 1.00 0.00 A ATOM 244 ND2 ASN A 144 -0.925 -5.873 -5.131 1.00 0.00 A ATOM 245 OT1 ASN A 144 -1.164 -1.651 -7.044 1.00 0.00 A ATOM 246 OT2 ASN A 144 -3.305 -2.092 -7.126 1.00 0.00 A ATOM 247 OD1 ASN A 144 -2.157 -5.515 -6.943 1.00 0.00 A END
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