NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | in_recoord | stage | position | program | type |
9846 | 1or5 | cing | recoord | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name 1 H SER 1 HN SER 1 1.884 0.000 0.829 2 HA SER 1 HA SER 1 2.661 0.918 -1.229 3 1HB SER 1 2HB SER 1 3.534 -1.197 -2.281 4 2HB SER 1 3HB SER 1 3.773 -1.123 -0.547 5 HG SER 1 HG SER 1 2.738 -2.986 -0.453 6 H ALA 2 HN ALA 2 0.799 2.025 -2.240 7 HA ALA 2 HA ALA 2 -1.043 0.504 -3.798 8 1HB ALA 2 1HB ALA 2 -2.174 2.452 -3.766 9 2HB ALA 2 2HB ALA 2 -0.881 3.087 -2.720 10 3HB ALA 2 3HB ALA 2 -0.804 3.336 -4.481 11 H LEU 3 HN LEU 3 1.547 2.915 -4.661 12 HA LEU 3 HA LEU 3 1.728 1.548 -7.251 13 1HB LEU 3 2HB LEU 3 1.068 3.812 -7.508 14 2HB LEU 3 3HB LEU 3 2.300 4.380 -6.399 15 HG LEU 3 HG LEU 3 3.360 2.924 -8.736 16 1HD1 LEU 3 1HD1 LEU 3 2.264 5.680 -9.264 17 2HD1 LEU 3 2HD1 LEU 3 2.859 4.462 -10.417 18 3HD1 LEU 3 3HD1 LEU 3 1.304 4.216 -9.587 19 1HD2 LEU 3 1HD2 LEU 3 4.297 5.636 -8.339 20 2HD2 LEU 3 2HD2 LEU 3 4.288 4.727 -6.808 21 3HD2 LEU 3 3HD2 LEU 3 5.176 4.092 -8.215 22 H THR 4 HN THR 4 3.706 0.754 -7.985 23 HA THR 4 HA THR 4 5.954 1.034 -6.107 24 HB THR 4 HB THR 4 5.020 -1.152 -5.658 25 HG1 THR 4 HG1 THR 4 7.012 -2.032 -6.088 26 1HG2 THR 4 1HG2 THR 4 4.426 -2.756 -7.372 27 2HG2 THR 4 2HG2 THR 4 3.627 -1.235 -7.841 28 3HG2 THR 4 3HG2 THR 4 5.127 -1.741 -8.655 29 H VAL 5 HN VAL 5 8.064 0.227 -7.213 30 HA VAL 5 HA VAL 5 8.459 1.901 -9.426 31 HB VAL 5 HB VAL 5 10.041 0.896 -7.569 32 1HG1 VAL 5 1HG1 VAL 5 10.041 -1.399 -8.066 33 2HG1 VAL 5 2HG1 VAL 5 10.184 -1.116 -9.817 34 3HG1 VAL 5 3HG1 VAL 5 11.575 -0.810 -8.750 35 1HG2 VAL 5 1HG2 VAL 5 10.627 1.829 -10.354 36 2HG2 VAL 5 2HG2 VAL 5 10.974 2.605 -8.790 37 3HG2 VAL 5 3HG2 VAL 5 11.975 1.244 -9.349 38 H ASP 6 HN ASP 6 6.977 -1.172 -9.155 39 HA ASP 6 HA ASP 6 7.878 -2.192 -11.635 40 1HB ASP 6 2HB ASP 6 6.479 -3.170 -9.402 41 2HB ASP 6 3HB ASP 6 5.265 -3.176 -10.665 42 HD2 ASP 6 HD2 ASP 6 6.852 -5.638 -9.496 43 H ASP 7 HN ASP 7 4.744 -0.840 -10.344 44 HA ASP 7 HA ASP 7 3.511 -0.812 -12.850 45 1HB ASP 7 2HB ASP 7 2.922 0.014 -10.098 46 2HB ASP 7 3HB ASP 7 2.309 1.194 -11.239 47 HD2 ASP 7 HD2 ASP 7 0.113 0.007 -12.569 48 H LEU 8 HN LEU 8 5.666 1.366 -11.061 49 HA LEU 8 HA LEU 8 5.027 3.680 -12.627 50 1HB LEU 8 2HB LEU 8 5.714 3.812 -10.279 51 2HB LEU 8 3HB LEU 8 7.274 3.125 -10.685 52 HG LEU 8 HG LEU 8 7.191 5.631 -10.350 53 1HD1 LEU 8 1HD1 LEU 8 8.812 6.088 -12.061 54 2HD1 LEU 8 2HD1 LEU 8 9.033 4.412 -11.503 55 3HD1 LEU 8 3HD1 LEU 8 8.220 4.734 -13.054 56 1HD2 LEU 8 1HD2 LEU 8 5.031 5.937 -11.589 57 2HD2 LEU 8 2HD2 LEU 8 6.333 7.056 -12.060 58 3HD2 LEU 8 3HD2 LEU 8 5.931 5.670 -13.102 59 H LYS 9 HN LYS 9 7.652 1.206 -12.478 60 HA LYS 9 HA LYS 9 9.337 2.309 -14.346 61 1HB LYS 9 2HB LYS 9 10.123 0.483 -13.099 62 2HB LYS 9 3HB LYS 9 8.745 -0.522 -13.501 63 1HG LYS 9 2HG LYS 9 9.487 -0.606 -15.883 64 2HG LYS 9 3HG LYS 9 10.852 0.425 -15.501 65 1HD LYS 9 2HD LYS 9 12.041 -1.437 -14.995 66 2HD LYS 9 3HD LYS 9 11.004 -1.665 -13.601 67 1HE LYS 9 2HE LYS 9 9.344 -2.790 -15.323 68 2HE LYS 9 3HE LYS 9 10.751 -2.907 -16.359 69 1HZ LYS 9 1HZ LYS 9 10.439 -4.104 -13.666 70 2HZ LYS 9 2HZ LYS 9 10.670 -4.892 -15.072 71 H LYS 10 HN LYS 10 6.619 -0.039 -14.899 72 HA LYS 10 HA LYS 10 6.848 -0.162 -17.637 73 1HB LYS 10 2HB LYS 10 4.928 -1.367 -17.546 74 2HB LYS 10 3HB LYS 10 5.306 -1.382 -15.835 75 1HG LYS 10 2HG LYS 10 3.817 0.562 -15.452 76 2HG LYS 10 3HG LYS 10 3.495 0.685 -17.171 77 1HD LYS 10 2HD LYS 10 2.907 -1.873 -15.627 78 2HD LYS 10 3HD LYS 10 1.747 -0.562 -15.695 79 1HE LYS 10 2HE LYS 10 1.842 -0.662 -18.224 80 2HE LYS 10 3HE LYS 10 2.913 -2.043 -18.100 81 1HZ LYS 10 1HZ LYS 10 0.954 -3.172 -18.119 82 2HZ LYS 10 2HZ LYS 10 0.888 -2.827 -16.529 83 H LEU 11 HN LEU 11 5.401 2.344 -15.542 84 HA LEU 11 HA LEU 11 4.149 3.706 -17.705 85 1HB LEU 11 2HB LEU 11 3.987 3.731 -14.950 86 2HB LEU 11 3HB LEU 11 4.762 5.262 -15.307 87 HG LEU 11 HG LEU 11 2.183 4.361 -16.611 88 1HD1 LEU 11 1HD1 LEU 11 1.712 6.470 -14.772 89 2HD1 LEU 11 2HD1 LEU 11 1.081 4.806 -14.742 90 3HD1 LEU 11 3HD1 LEU 11 2.605 5.196 -13.909 91 1HD2 LEU 11 1HD2 LEU 11 2.070 6.384 -17.636 92 2HD2 LEU 11 2HD2 LEU 11 2.953 7.224 -16.339 93 3HD2 LEU 11 3HD2 LEU 11 3.841 6.241 -17.528 94 H LEU 12 HN LEU 12 7.359 3.666 -16.198 95 HA LEU 12 HA LEU 12 8.202 6.153 -17.232 96 1HB LEU 12 2HB LEU 12 9.457 3.780 -15.953 97 2HB LEU 12 3HB LEU 12 10.503 4.846 -16.870 98 HG LEU 12 HG LEU 12 8.685 5.801 -14.644 99 1HD1 LEU 12 1HD1 LEU 12 11.505 4.757 -14.563 100 2HD1 LEU 12 2HD1 LEU 12 10.944 5.976 -13.394 101 3HD1 LEU 12 3HD1 LEU 12 10.131 4.396 -13.491 102 1HD2 LEU 12 1HD2 LEU 12 9.583 7.379 -16.505 103 2HD2 LEU 12 2HD2 LEU 12 9.716 7.868 -14.798 104 3HD2 LEU 12 3HD2 LEU 12 11.137 7.217 -15.651 105 H ALA 13 HN ALA 13 8.522 2.731 -18.367 106 HA ALA 13 HA ALA 13 9.995 3.377 -20.664 107 1HB ALA 13 1HB ALA 13 8.117 1.029 -20.558 108 2HB ALA 13 2HB ALA 13 9.793 1.117 -21.149 109 3HB ALA 13 3HB ALA 13 9.466 1.105 -19.400 110 H GLU 14 HN GLU 14 6.496 2.402 -20.392 111 HA GLU 14 HA GLU 14 5.674 2.817 -22.847 112 1HB GLU 14 2HB GLU 14 4.437 2.588 -20.384 113 2HB GLU 14 3HB GLU 14 3.892 4.173 -20.895 114 1HG GLU 14 2HG GLU 14 3.574 2.736 -23.234 115 2HG GLU 14 3HG GLU 14 3.263 1.492 -22.038 116 HE2 GLU 14 HE2 GLU 14 1.258 1.781 -23.128 117 H THR 15 HN THR 15 6.308 5.443 -20.451 118 HA THR 15 HA THR 15 5.567 7.491 -22.336 119 HB THR 15 HB THR 15 6.493 7.271 -19.472 120 HG1 THR 15 HG1 THR 15 4.267 7.501 -19.783 121 1HG2 THR 15 1HG2 THR 15 7.859 9.139 -19.861 122 2HG2 THR 15 2HG2 THR 15 6.944 9.628 -21.307 123 3HG2 THR 15 3HG2 THR 15 6.285 9.951 -19.685 124 H ALA 16 HN ALA 16 8.679 6.647 -20.663 125 HA ALA 16 HA ALA 16 10.232 8.299 -22.269 126 1HB ALA 16 1HB ALA 16 10.832 7.234 -20.055 127 2HB ALA 16 2HB ALA 16 11.075 5.702 -20.929 128 3HB ALA 16 3HB ALA 16 12.096 7.112 -21.302 129 H GLY 17 HN GLY 17 10.330 4.674 -22.383 130 1HA GLY 17 1HA GLY 17 9.651 3.624 -24.502 131 2HA GLY 17 2HA GLY 17 10.520 4.902 -25.328 132 H GLU 18 HN GLU 18 11.190 2.634 -22.555 133 HA GLU 18 HA GLU 18 13.683 2.001 -23.933 134 1HB GLU 18 2HB GLU 18 13.161 2.447 -20.973 135 2HB GLU 18 3HB GLU 18 14.566 1.561 -21.531 136 1HG GLU 18 2HG GLU 18 14.860 3.695 -23.134 137 2HG GLU 18 3HG GLU 18 13.891 4.480 -21.903 138 HE2 GLU 18 HE2 GLU 18 17.570 4.441 -21.244 139 H ASP 19 HN ASP 19 12.253 0.287 -24.937 140 HA ASP 19 HA ASP 19 11.617 -1.819 -23.048 141 1HB ASP 19 2HB ASP 19 10.482 -2.830 -25.135 142 2HB ASP 19 3HB ASP 19 9.760 -1.379 -24.470 143 HD2 ASP 19 HD2 ASP 19 9.752 -0.287 -27.746 144 H ASP 20 HN ASP 20 14.234 -1.869 -23.088 145 HA ASP 20 HA ASP 20 14.890 -3.983 -24.942 146 1HB ASP 20 2HB ASP 20 16.309 -1.319 -24.688 147 2HB ASP 20 3HB ASP 20 17.246 -2.746 -25.083 148 HD2 ASP 20 HD2 ASP 20 17.615 -2.787 -26.985 149 H SER 21 HN SER 21 15.916 -1.802 -22.226 150 HA SER 21 HA SER 21 16.516 -4.059 -20.622 151 1HB SER 21 2HB SER 21 18.634 -3.096 -22.203 152 2HB SER 21 3HB SER 21 18.913 -2.354 -20.640 153 HG SER 21 HG SER 21 18.291 -5.156 -20.804 154 H VAL 22 HN VAL 22 14.572 -2.334 -20.077 155 HA VAL 22 HA VAL 22 15.675 -0.161 -18.473 156 HB VAL 22 HB VAL 22 13.920 0.353 -20.082 157 1HG1 VAL 22 1HG1 VAL 22 11.592 -0.489 -19.671 158 2HG1 VAL 22 2HG1 VAL 22 12.736 -1.736 -20.226 159 3HG1 VAL 22 3HG1 VAL 22 12.273 -1.652 -18.509 160 1HG2 VAL 22 1HG2 VAL 22 12.378 1.531 -18.567 161 2HG2 VAL 22 2HG2 VAL 22 12.973 0.555 -17.203 162 3HG2 VAL 22 3HG2 VAL 22 14.068 1.686 -18.033 163 H ASP 23 HN ASP 23 16.507 -2.374 -17.283 164 HA ASP 23 HA ASP 23 14.493 -3.418 -15.556 165 1HB ASP 23 2HB ASP 23 17.249 -4.047 -16.325 166 2HB ASP 23 3HB ASP 23 17.073 -4.122 -14.584 167 HD2 ASP 23 HD2 ASP 23 15.133 -4.931 -17.227 168 H LEU 24 HN LEU 24 13.813 -1.622 -14.226 169 HA LEU 24 HA LEU 24 15.678 0.131 -13.024 170 1HB LEU 24 2HB LEU 24 12.746 -0.379 -12.858 171 2HB LEU 24 3HB LEU 24 13.499 0.529 -11.561 172 HG LEU 24 HG LEU 24 14.393 2.134 -13.256 173 1HD1 LEU 24 1HD1 LEU 24 13.372 0.131 -15.083 174 2HD1 LEU 24 2HD1 LEU 24 12.680 1.734 -15.431 175 3HD1 LEU 24 3HD1 LEU 24 14.447 1.517 -15.389 176 1HD2 LEU 24 1HD2 LEU 24 12.630 3.313 -12.615 177 2HD2 LEU 24 2HD2 LEU 24 11.678 2.570 -13.922 178 3HD2 LEU 24 3HD2 LEU 24 11.705 1.824 -12.306 179 H ALA 25 HN ALA 25 13.975 -2.866 -11.996 180 HA ALA 25 HA ALA 25 14.501 -2.871 -9.335 181 1HB ALA 25 1HB ALA 25 13.605 -4.672 -11.266 182 2HB ALA 25 2HB ALA 25 15.048 -5.466 -10.590 183 3HB ALA 25 3HB ALA 25 13.714 -4.978 -9.516 184 H GLY 26 HN GLY 26 16.776 -3.109 -12.024 185 1HA GLY 26 1HA GLY 26 18.947 -3.712 -10.110 186 2HA GLY 26 2HA GLY 26 18.967 -4.092 -11.821 187 H GLU 27 HN GLU 27 17.773 -1.040 -10.310 188 HA GLU 27 HA GLU 27 20.006 0.463 -10.481 189 1HB GLU 27 2HB GLU 27 18.952 -0.129 -13.148 190 2HB GLU 27 3HB GLU 27 18.949 1.597 -12.845 191 1HG GLU 27 2HG GLU 27 21.216 1.721 -12.991 192 2HG GLU 27 3HG GLU 27 21.433 0.392 -11.869 193 HE2 GLU 27 HE2 GLU 27 23.130 -0.284 -14.404 194 H LEU 28 HN LEU 28 18.833 1.253 -8.628 195 HA LEU 28 HA LEU 28 16.562 2.968 -9.362 196 1HB LEU 28 2HB LEU 28 17.071 1.574 -6.731 197 2HB LEU 28 3HB LEU 28 15.717 2.624 -7.102 198 HG LEU 28 HG LEU 28 16.106 0.261 -8.876 199 1HD1 LEU 28 1HD1 LEU 28 15.184 -1.326 -7.370 200 2HD1 LEU 28 2HD1 LEU 28 16.553 -0.556 -6.532 201 3HD1 LEU 28 3HD1 LEU 28 14.885 -0.083 -6.130 202 1HD2 LEU 28 1HD2 LEU 28 13.457 0.674 -7.797 203 2HD2 LEU 28 2HD2 LEU 28 14.122 2.195 -8.439 204 3HD2 LEU 28 3HD2 LEU 28 14.028 0.754 -9.481 205 H ASP 29 HN ASP 29 19.209 2.549 -6.904 206 HA ASP 29 HA ASP 29 19.189 5.060 -5.930 207 1HB ASP 29 2HB ASP 29 20.865 2.815 -5.785 208 2HB ASP 29 3HB ASP 29 21.929 4.056 -6.415 209 HD2 ASP 29 HD2 ASP 29 22.355 3.988 -2.990 210 H THR 30 HN THR 30 20.569 3.784 -8.986 211 HA THR 30 HA THR 30 22.125 6.043 -9.647 212 HB THR 30 HB THR 30 20.900 3.709 -11.190 213 HG1 THR 30 HG1 THR 30 23.206 3.149 -11.076 214 1HG2 THR 30 1HG2 THR 30 23.034 5.653 -12.196 215 2HG2 THR 30 2HG2 THR 30 22.276 4.316 -13.094 216 3HG2 THR 30 3HG2 THR 30 21.328 5.768 -12.691 217 HA PRO 31 HA PRO 31 18.973 8.776 -10.755 218 1HB PRO 31 2HB PRO 31 20.545 10.832 -11.632 219 2HB PRO 31 3HB PRO 31 20.158 10.575 -9.942 220 1HG PRO 31 2HG PRO 31 22.691 10.032 -11.367 221 2HG PRO 31 3HG PRO 31 22.412 10.188 -9.643 222 1HD PRO 31 2HD PRO 31 22.799 7.751 -11.106 223 2HD PRO 31 3HD PRO 31 22.405 7.901 -9.405 224 H PHE 32 HN PHE 32 17.682 9.294 -12.479 225 HA PHE 32 HA PHE 32 17.904 7.836 -14.721 226 1HB PHE 32 2HB PHE 32 16.921 10.707 -14.241 227 2HB PHE 32 3HB PHE 32 16.585 9.861 -15.738 228 HD1 PHE 32 HD1 PHE 32 15.436 7.505 -15.453 229 HD2 PHE 32 HD2 PHE 32 15.389 10.566 -12.513 230 HE1 PHE 32 HE1 PHE 32 13.397 6.476 -14.413 231 HE2 PHE 32 HE2 PHE 32 13.350 9.536 -11.474 232 HZ PHE 32 HZ PHE 32 12.378 7.504 -12.436 233 H VAL 33 HN VAL 33 19.232 11.181 -14.251 234 HA VAL 33 HA VAL 33 20.197 11.602 -16.769 235 HB VAL 33 HB VAL 33 20.151 13.265 -15.012 236 1HG1 VAL 33 1HG1 VAL 33 22.611 12.534 -13.630 237 2HG1 VAL 33 2HG1 VAL 33 21.023 12.992 -12.970 238 3HG1 VAL 33 3HG1 VAL 33 21.343 11.302 -13.426 239 1HG2 VAL 33 1HG2 VAL 33 22.195 12.914 -16.886 240 2HG2 VAL 33 2HG2 VAL 33 21.767 14.421 -16.040 241 3HG2 VAL 33 3HG2 VAL 33 23.039 13.362 -15.384 242 H ASP 34 HN ASP 34 21.464 9.502 -14.177 243 HA ASP 34 HA ASP 34 23.969 9.126 -15.358 244 1HB ASP 34 2HB ASP 34 22.727 8.407 -12.977 245 2HB ASP 34 3HB ASP 34 22.841 6.861 -13.793 246 HD2 ASP 34 HD2 ASP 34 24.909 5.892 -13.676 247 H LEU 35 HN LEU 35 20.920 7.131 -15.214 248 HA LEU 35 HA LEU 35 21.831 5.073 -16.856 249 1HB LEU 35 2HB LEU 35 19.026 6.068 -16.334 250 2HB LEU 35 3HB LEU 35 19.427 4.547 -17.107 251 HG LEU 35 HG LEU 35 20.860 4.495 -14.703 252 1HD1 LEU 35 1HD1 LEU 35 18.992 4.857 -13.031 253 2HD1 LEU 35 2HD1 LEU 35 19.722 6.323 -13.727 254 3HD1 LEU 35 3HD1 LEU 35 18.141 5.753 -14.311 255 1HD2 LEU 35 1HD2 LEU 35 18.984 2.941 -16.111 256 2HD2 LEU 35 2HD2 LEU 35 19.974 2.462 -14.711 257 3HD2 LEU 35 3HD2 LEU 35 18.339 3.120 -14.461 258 H GLY 36 HN GLY 36 19.069 7.053 -17.979 259 1HA GLY 36 1HA GLY 36 20.537 8.104 -20.236 260 2HA GLY 36 2HA GLY 36 19.444 6.794 -20.638 261 H TYR 37 HN TYR 37 17.296 7.206 -18.863 262 HA TYR 37 HA TYR 37 15.610 8.814 -20.112 263 1HB TYR 37 2HB TYR 37 16.145 8.020 -17.242 264 2HB TYR 37 3HB TYR 37 14.964 9.297 -17.450 265 HD1 TYR 37 HD1 TYR 37 12.810 8.485 -17.212 266 HD2 TYR 37 HD2 TYR 37 15.680 6.112 -19.317 267 HE1 TYR 37 HE1 TYR 37 11.022 6.745 -17.702 268 HE2 TYR 37 HE2 TYR 37 13.883 4.380 -19.800 269 HH TYR 37 HH TYR 37 11.666 3.704 -18.593 270 H ASP 38 HN ASP 38 15.004 10.982 -20.254 271 HA ASP 38 HA ASP 38 16.956 12.800 -19.089 272 1HB ASP 38 2HB ASP 38 15.432 12.711 -21.657 273 2HB ASP 38 3HB ASP 38 15.560 14.302 -20.934 274 HD2 ASP 38 HD2 ASP 38 17.979 13.017 -23.323 275 H SER 39 HN SER 39 16.053 14.924 -18.277 276 HA SER 39 HA SER 39 14.037 14.646 -16.532 277 1HB SER 39 2HB SER 39 13.846 17.203 -16.671 278 2HB SER 39 3HB SER 39 15.443 16.559 -16.348 279 HG SER 39 HG SER 39 16.123 17.566 -18.099 280 H LEU 40 HN LEU 40 13.849 15.671 -19.982 281 HA LEU 40 HA LEU 40 11.262 16.544 -20.087 282 1HB LEU 40 2HB LEU 40 12.853 16.710 -21.908 283 2HB LEU 40 3HB LEU 40 12.844 14.971 -22.122 284 HG LEU 40 HG LEU 40 10.270 15.307 -22.534 285 1HD1 LEU 40 1HD1 LEU 40 10.241 17.628 -23.907 286 2HD1 LEU 40 2HD1 LEU 40 9.691 17.465 -22.222 287 3HD1 LEU 40 3HD1 LEU 40 11.327 18.074 -22.569 288 1HD2 LEU 40 1HD2 LEU 40 11.162 14.457 -24.403 289 2HD2 LEU 40 2HD2 LEU 40 11.126 16.134 -24.999 290 3HD2 LEU 40 3HD2 LEU 40 12.619 15.473 -24.291 291 H ALA 41 HN ALA 41 12.359 13.151 -20.813 292 HA ALA 41 HA ALA 41 9.970 11.958 -21.097 293 1HB ALA 41 1HB ALA 41 11.539 10.229 -19.459 294 2HB ALA 41 2HB ALA 41 11.406 10.237 -21.234 295 3HB ALA 41 3HB ALA 41 12.669 11.201 -20.432 296 H LEU 42 HN LEU 42 11.598 12.763 -17.966 297 HA LEU 42 HA LEU 42 9.701 11.597 -16.312 298 1HB LEU 42 2HB LEU 42 11.890 13.548 -16.085 299 2HB LEU 42 3HB LEU 42 10.632 13.731 -14.877 300 HG LEU 42 HG LEU 42 12.459 12.329 -14.070 301 1HD1 LEU 42 1HD1 LEU 42 10.137 11.952 -13.278 302 2HD1 LEU 42 2HD1 LEU 42 9.962 10.668 -14.499 303 3HD1 LEU 42 3HD1 LEU 42 11.161 10.498 -13.194 304 1HD2 LEU 42 1HD2 LEU 42 13.067 10.236 -15.029 305 2HD2 LEU 42 2HD2 LEU 42 11.728 10.308 -16.200 306 3HD2 LEU 42 3HD2 LEU 42 13.093 11.443 -16.337 307 H LEU 43 HN LEU 43 9.966 15.034 -17.462 308 HA LEU 43 HA LEU 43 7.721 16.006 -16.249 309 1HB LEU 43 2HB LEU 43 9.302 16.681 -18.665 310 2HB LEU 43 3HB LEU 43 7.706 17.395 -18.551 311 HG LEU 43 HG LEU 43 9.380 18.911 -17.678 312 1HD1 LEU 43 1HD1 LEU 43 8.068 18.041 -15.151 313 2HD1 LEU 43 2HD1 LEU 43 8.158 19.648 -15.911 314 3HD1 LEU 43 3HD1 LEU 43 7.019 18.432 -16.535 315 1HD2 LEU 43 1HD2 LEU 43 10.036 16.873 -15.540 316 2HD2 LEU 43 2HD2 LEU 43 11.003 17.105 -17.016 317 3HD2 LEU 43 3HD2 LEU 43 10.826 18.438 -15.850 318 H GLU 44 HN GLU 44 8.018 13.905 -19.114 319 HA GLU 44 HA GLU 44 5.402 14.274 -20.002 320 1HB GLU 44 2HB GLU 44 7.698 12.586 -20.638 321 2HB GLU 44 3HB GLU 44 6.217 11.652 -20.720 322 1HG GLU 44 2HG GLU 44 5.605 14.146 -21.951 323 2HG GLU 44 3HG GLU 44 7.195 13.713 -22.547 324 HE2 GLU 44 HE2 GLU 44 4.341 13.508 -23.641 325 H THR 45 HN THR 45 6.842 11.366 -18.341 326 HA THR 45 HA THR 45 4.361 10.227 -17.723 327 HB THR 45 HB THR 45 6.687 9.141 -17.820 328 HG1 THR 45 HG1 THR 45 5.544 7.663 -16.634 329 1HG2 THR 45 1HG2 THR 45 6.889 10.730 -15.251 330 2HG2 THR 45 2HG2 THR 45 7.588 9.094 -15.295 331 3HG2 THR 45 3HG2 THR 45 8.164 10.338 -16.430 332 H ALA 46 HN ALA 46 6.049 12.934 -16.323 333 HA ALA 46 HA ALA 46 5.120 12.760 -13.704 334 1HB ALA 46 1HB ALA 46 6.641 14.438 -13.804 335 2HB ALA 46 2HB ALA 46 6.296 14.773 -15.518 336 3HB ALA 46 3HB ALA 46 5.255 15.462 -14.250 337 H ALA 47 HN ALA 47 3.732 14.483 -16.589 338 HA ALA 47 HA ALA 47 1.440 15.370 -15.269 339 1HB ALA 47 1HB ALA 47 1.184 16.396 -17.251 340 2HB ALA 47 2HB ALA 47 2.612 15.514 -17.842 341 3HB ALA 47 3HB ALA 47 0.985 14.835 -18.081 342 H VAL 48 HN VAL 48 2.016 12.457 -17.361 343 HA VAL 48 HA VAL 48 -0.538 11.428 -17.206 344 HB VAL 48 HB VAL 48 2.140 10.037 -17.408 345 1HG1 VAL 48 1HG1 VAL 48 -0.475 8.920 -17.095 346 2HG1 VAL 48 2HG1 VAL 48 0.070 8.611 -18.761 347 3HG1 VAL 48 3HG1 VAL 48 1.069 8.083 -17.385 348 1HG2 VAL 48 1HG2 VAL 48 1.296 11.856 -19.131 349 2HG2 VAL 48 2HG2 VAL 48 2.073 10.355 -19.688 350 3HG2 VAL 48 3HG2 VAL 48 0.300 10.508 -19.729 351 H LEU 49 HN LEU 49 2.107 11.464 -14.834 352 HA LEU 49 HA LEU 49 1.060 9.418 -13.196 353 1HB LEU 49 2HB LEU 49 3.413 10.226 -13.244 354 2HB LEU 49 3HB LEU 49 2.890 11.711 -12.473 355 HG LEU 49 HG LEU 49 2.023 10.280 -10.556 356 1HD1 LEU 49 1HD1 LEU 49 3.552 8.165 -12.082 357 2HD1 LEU 49 2HD1 LEU 49 3.188 8.044 -10.344 358 3HD1 LEU 49 3HD1 LEU 49 1.861 8.127 -11.527 359 1HD2 LEU 49 1HD2 LEU 49 4.688 11.153 -11.206 360 2HD2 LEU 49 2HD2 LEU 49 3.857 11.117 -9.632 361 3HD2 LEU 49 3HD2 LEU 49 4.755 9.688 -10.197 362 H GLN 50 HN GLN 50 0.925 13.043 -13.001 363 HA GLN 50 HA GLN 50 -0.847 12.941 -10.816 364 1HB GLN 50 2HB GLN 50 -0.987 15.377 -11.101 365 2HB GLN 50 3HB GLN 50 0.679 14.851 -11.237 366 1HG GLN 50 2HG GLN 50 0.416 14.835 -13.760 367 2HG GLN 50 3HG GLN 50 -1.198 15.488 -13.562 368 1HE2 GLN 50 1HE2 GLN 50 2.132 16.053 -12.431 369 2HE2 GLN 50 2HE2 GLN 50 2.115 17.781 -12.551 370 H GLN 51 HN GLN 51 -1.209 12.503 -14.226 371 HA GLN 51 HA GLN 51 -3.755 13.608 -14.531 372 1HB GLN 51 2HB GLN 51 -2.158 11.529 -16.061 373 2HB GLN 51 3HB GLN 51 -3.796 11.929 -16.539 374 1HG GLN 51 2HG GLN 51 -2.393 14.407 -16.077 375 2HG GLN 51 3HG GLN 51 -1.366 13.395 -17.074 376 1HE2 GLN 51 1HE2 GLN 51 -2.864 15.840 -17.689 377 2HE2 GLN 51 2HE2 GLN 51 -3.892 15.484 -19.037 378 H ARG 52 HN ARG 52 -2.585 10.731 -12.954 379 HA ARG 52 HA ARG 52 -5.117 9.404 -13.216 380 1HB ARG 52 2HB ARG 52 -2.383 8.701 -12.188 381 2HB ARG 52 3HB ARG 52 -3.723 7.865 -11.429 382 1HG ARG 52 2HG ARG 52 -4.114 6.582 -13.274 383 2HG ARG 52 3HG ARG 52 -4.026 7.958 -14.356 384 1HD ARG 52 2HD ARG 52 -2.168 6.655 -15.025 385 2HD ARG 52 3HD ARG 52 -1.436 7.850 -13.972 386 HE ARG 52 HE ARG 52 -1.133 6.186 -12.284 387 1HH1 ARG 52 HH1 ARG 52 -1.391 2.738 -12.614 388 1HH2 ARG 52 1HH2 ARG 52 -2.576 3.221 -14.641 389 2HH2 ARG 52 2HH2 ARG 52 -2.820 4.871 -15.108 390 H TYR 53 HN TYR 53 -2.934 10.554 -10.531 391 HA TYR 53 HA TYR 53 -5.208 10.502 -8.713 392 1HB TYR 53 2HB TYR 53 -2.165 10.828 -8.623 393 2HB TYR 53 3HB TYR 53 -3.107 11.291 -7.220 394 HD1 TYR 53 HD1 TYR 53 -3.849 9.668 -5.663 395 HD2 TYR 53 HD2 TYR 53 -2.337 8.415 -9.463 396 HE1 TYR 53 HE1 TYR 53 -3.845 7.252 -4.872 397 HE2 TYR 53 HE2 TYR 53 -2.337 6.003 -8.660 398 HH TYR 53 HH TYR 53 -2.315 4.758 -6.708 399 H GLY 54 HN GLY 54 -2.439 12.816 -8.956 400 1HA GLY 54 1HA GLY 54 -3.389 15.045 -9.973 401 2HA GLY 54 2HA GLY 54 -4.322 15.006 -8.490 402 H ILE 55 HN ILE 55 -0.879 14.325 -9.472 403 HA ILE 55 HA ILE 55 -0.065 15.849 -7.099 404 HB ILE 55 HB ILE 55 1.496 13.777 -8.643 405 1HG1 ILE 55 2HG1 ILE 55 0.203 13.383 -5.941 406 2HG1 ILE 55 3HG1 ILE 55 -0.621 12.973 -7.432 407 1HG2 ILE 55 1HG2 ILE 55 3.087 15.097 -7.597 408 2HG2 ILE 55 2HG2 ILE 55 2.048 15.422 -6.189 409 3HG2 ILE 55 3HG2 ILE 55 2.794 13.819 -6.393 410 1HD1 ILE 55 1HD1 ILE 55 1.377 11.540 -8.072 411 2HD1 ILE 55 2HD1 ILE 55 2.040 11.852 -6.450 412 3HD1 ILE 55 3HD1 ILE 55 0.501 10.975 -6.628 413 H ALA 56 HN ALA 56 2.259 16.867 -7.488 414 HA ALA 56 HA ALA 56 2.259 18.067 -10.169 415 1HB ALA 56 1HB ALA 56 1.761 19.322 -7.608 416 2HB ALA 56 2HB ALA 56 3.265 19.961 -8.314 417 3HB ALA 56 3HB ALA 56 1.744 20.044 -9.235 418 H LEU 57 HN LEU 57 3.765 15.932 -10.038 419 HA LEU 57 HA LEU 57 6.352 16.614 -8.911 420 1HB LEU 57 2HB LEU 57 5.022 14.306 -8.942 421 2HB LEU 57 3HB LEU 57 5.866 14.124 -10.468 422 HG LEU 57 HG LEU 57 7.423 14.881 -8.014 423 1HD1 LEU 57 1HD1 LEU 57 7.702 12.585 -7.357 424 2HD1 LEU 57 2HD1 LEU 57 5.964 12.970 -7.375 425 3HD1 LEU 57 3HD1 LEU 57 6.680 12.026 -8.704 426 1HD2 LEU 57 1HD2 LEU 57 9.113 14.687 -9.433 427 2HD2 LEU 57 2HD2 LEU 57 8.727 12.962 -9.637 428 3HD2 LEU 57 3HD2 LEU 57 8.007 14.170 -10.728 429 H THR 58 HN THR 58 6.248 18.566 -10.505 430 HA THR 58 HA THR 58 7.097 17.722 -13.183 431 HB THR 58 HB THR 58 6.381 19.906 -13.870 432 HG1 THR 58 HG1 THR 58 6.680 21.568 -12.417 433 1HG2 THR 58 1HG2 THR 58 4.160 20.257 -12.900 434 2HG2 THR 58 2HG2 THR 58 4.423 18.500 -13.012 435 3HG2 THR 58 3HG2 THR 58 4.601 19.330 -11.447 436 H ASP 59 HN ASP 59 8.690 19.712 -14.042 437 HA ASP 59 HA ASP 59 11.124 19.025 -13.314 438 1HB ASP 59 2HB ASP 59 10.025 21.045 -14.853 439 2HB ASP 59 3HB ASP 59 10.839 21.979 -13.614 440 HD2 ASP 59 HD2 ASP 59 12.195 22.397 -15.961 441 H GLU 60 HN GLU 60 8.942 21.337 -11.633 442 HA GLU 60 HA GLU 60 10.516 22.690 -10.006 443 1HB GLU 60 2HB GLU 60 8.069 22.844 -9.949 444 2HB GLU 60 3HB GLU 60 7.941 21.242 -9.251 445 1HG GLU 60 2HG GLU 60 8.198 22.087 -7.164 446 2HG GLU 60 3HG GLU 60 9.745 22.784 -7.603 447 HE2 GLU 60 HE2 GLU 60 8.971 24.301 -6.184 448 H THR 61 HN THR 61 9.088 19.551 -8.840 449 HA THR 61 HA THR 61 11.241 19.298 -6.933 450 HB THR 61 HB THR 61 8.890 18.763 -6.332 451 HG1 THR 61 HG1 THR 61 9.475 16.434 -5.748 452 1HG2 THR 61 1HG2 THR 61 8.066 17.927 -8.538 453 2HG2 THR 61 2HG2 THR 61 9.202 16.560 -8.441 454 3HG2 THR 61 3HG2 THR 61 7.858 16.686 -7.280 455 H VAL 62 HN VAL 62 10.235 17.836 -10.039 456 HA VAL 62 HA VAL 62 11.931 15.649 -9.988 457 HB VAL 62 HB VAL 62 10.862 17.360 -12.233 458 1HG1 VAL 62 1HG1 VAL 62 12.874 16.262 -13.048 459 2HG1 VAL 62 2HG1 VAL 62 12.312 14.697 -12.413 460 3HG1 VAL 62 3HG1 VAL 62 11.434 15.483 -13.747 461 1HG2 VAL 62 1HG2 VAL 62 10.024 14.602 -11.281 462 2HG2 VAL 62 2HG2 VAL 62 9.227 16.121 -10.805 463 3HG2 VAL 62 3HG2 VAL 62 9.222 15.610 -12.510 464 H GLY 63 HN GLY 63 12.650 19.033 -10.049 465 1HA GLY 63 1HA GLY 63 15.128 18.867 -11.480 466 2HA GLY 63 2HA GLY 63 14.525 20.210 -10.529 467 H ARG 64 HN ARG 64 14.134 19.045 -7.991 468 HA ARG 64 HA ARG 64 16.780 19.031 -7.092 469 1HB ARG 64 2HB ARG 64 15.689 18.491 -4.847 470 2HB ARG 64 3HB ARG 64 15.051 19.916 -5.641 471 1HG ARG 64 2HG ARG 64 13.049 18.811 -6.307 472 2HG ARG 64 3HG ARG 64 13.750 17.217 -6.117 473 1HD ARG 64 2HD ARG 64 12.334 17.463 -4.213 474 2HD ARG 64 3HD ARG 64 13.945 17.758 -3.588 475 HE ARG 64 HE ARG 64 13.221 20.289 -4.212 476 1HH1 ARG 64 HH1 ARG 64 10.796 21.223 -1.908 477 1HH2 ARG 64 1HH2 ARG 64 10.419 18.870 -1.650 478 2HH2 ARG 64 2HH2 ARG 64 11.363 17.753 -2.577 479 H LEU 65 HN LEU 65 14.370 16.526 -7.884 480 HA LEU 65 HA LEU 65 16.164 14.467 -6.839 481 1HB LEU 65 2HB LEU 65 13.245 14.662 -7.364 482 2HB LEU 65 3HB LEU 65 13.998 13.098 -7.601 483 HG LEU 65 HG LEU 65 13.098 13.178 -5.389 484 1HD1 LEU 65 1HD1 LEU 65 15.443 12.198 -5.838 485 2HD1 LEU 65 2HD1 LEU 65 16.041 13.599 -4.917 486 3HD1 LEU 65 3HD1 LEU 65 14.926 12.441 -4.152 487 1HD2 LEU 65 1HD2 LEU 65 13.926 14.863 -3.715 488 2HD2 LEU 65 2HD2 LEU 65 14.627 15.770 -5.077 489 3HD2 LEU 65 3HD2 LEU 65 12.868 15.512 -4.991 490 H GLY 66 HN GLY 66 16.334 12.441 -8.276 491 1HA GLY 66 1HA GLY 66 16.054 12.870 -11.114 492 2HA GLY 66 2HA GLY 66 17.713 12.945 -10.554 493 H THR 67 HN THR 67 15.360 10.950 -8.802 494 HA THR 67 HA THR 67 16.519 8.555 -10.064 495 HB THR 67 HB THR 67 16.494 7.558 -7.746 496 HG1 THR 67 HG1 THR 67 15.982 10.361 -7.058 497 1HG2 THR 67 1HG2 THR 67 17.915 10.206 -7.413 498 2HG2 THR 67 2HG2 THR 67 18.480 8.569 -7.001 499 3HG2 THR 67 3HG2 THR 67 18.477 9.109 -8.697 500 HA PRO 68 HA PRO 68 12.479 7.184 -10.500 501 1HB PRO 68 2HB PRO 68 12.747 4.467 -10.382 502 2HB PRO 68 3HB PRO 68 13.131 5.406 -11.811 503 1HG PRO 68 2HG PRO 68 14.972 4.157 -9.863 504 2HG PRO 68 3HG PRO 68 15.309 4.720 -11.488 505 1HD PRO 68 2HD PRO 68 15.996 6.042 -9.037 506 2HD PRO 68 3HD PRO 68 16.230 6.658 -10.661 507 H ARG 69 HN ARG 69 14.047 5.401 -7.886 508 HA ARG 69 HA ARG 69 11.803 4.639 -6.600 509 1HB ARG 69 2HB ARG 69 13.242 4.724 -4.490 510 2HB ARG 69 3HB ARG 69 13.972 3.874 -5.838 511 1HG ARG 69 2HG ARG 69 15.374 5.787 -6.395 512 2HG ARG 69 3HG ARG 69 14.505 6.826 -5.282 513 1HD ARG 69 2HD ARG 69 15.313 5.489 -3.352 514 2HD ARG 69 3HD ARG 69 16.111 4.365 -4.434 515 HE ARG 69 HE ARG 69 17.287 6.666 -5.223 516 1HH1 ARG 69 HH1 ARG 69 19.390 7.652 -2.640 517 1HH2 ARG 69 1HH2 ARG 69 17.966 6.326 -1.241 518 2HH2 ARG 69 2HH2 ARG 69 16.619 5.496 -1.946 519 H GLU 70 HN GLU 70 13.390 7.843 -6.672 520 HA GLU 70 HA GLU 70 11.894 8.879 -4.518 521 1HB GLU 70 2HB GLU 70 13.715 10.024 -6.637 522 2HB GLU 70 3HB GLU 70 12.726 11.121 -5.694 523 1HG GLU 70 2HG GLU 70 14.433 8.993 -4.347 524 2HG GLU 70 3HG GLU 70 15.112 10.543 -4.802 525 HE2 GLU 70 HE2 GLU 70 14.754 9.516 -2.300 526 H LEU 71 HN LEU 71 11.252 8.245 -7.879 527 HA LEU 71 HA LEU 71 9.253 10.289 -8.149 528 1HB LEU 71 2HB LEU 71 10.712 8.506 -9.844 529 2HB LEU 71 3HB LEU 71 8.999 8.267 -10.127 530 HG LEU 71 HG LEU 71 10.036 9.920 -11.649 531 1HD1 LEU 71 1HD1 LEU 71 7.811 10.783 -9.807 532 2HD1 LEU 71 2HD1 LEU 71 8.331 11.783 -11.185 533 3HD1 LEU 71 3HD1 LEU 71 7.716 10.136 -11.462 534 1HD2 LEU 71 1HD2 LEU 71 11.655 10.810 -9.940 535 2HD2 LEU 71 2HD2 LEU 71 10.822 12.042 -10.918 536 3HD2 LEU 71 3HD2 LEU 71 10.303 11.735 -9.244 537 H LEU 72 HN LEU 72 9.468 6.867 -7.192 538 HA LEU 72 HA LEU 72 6.595 6.581 -7.253 539 1HB LEU 72 2HB LEU 72 6.941 4.348 -6.956 540 2HB LEU 72 3HB LEU 72 8.388 4.816 -7.827 541 HG LEU 72 HG LEU 72 9.411 5.053 -5.403 542 1HD1 LEU 72 1HD1 LEU 72 7.668 2.764 -4.692 543 2HD1 LEU 72 2HD1 LEU 72 8.398 4.024 -3.668 544 3HD1 LEU 72 3HD1 LEU 72 6.926 4.380 -4.603 545 1HD2 LEU 72 1HD2 LEU 72 9.076 2.204 -6.183 546 2HD2 LEU 72 2HD2 LEU 72 9.741 3.310 -7.409 547 3HD2 LEU 72 3HD2 LEU 72 10.548 3.140 -5.832 548 H ASP 73 HN ASP 73 9.270 6.915 -4.858 549 HA ASP 73 HA ASP 73 7.775 6.514 -2.608 550 1HB ASP 73 2HB ASP 73 10.306 6.834 -2.827 551 2HB ASP 73 3HB ASP 73 10.019 8.559 -2.928 552 HD2 ASP 73 HD2 ASP 73 9.705 6.165 0.071 553 H GLU 74 HN GLU 74 8.432 9.507 -4.545 554 HA GLU 74 HA GLU 74 7.315 11.356 -2.907 555 1HB GLU 74 2HB GLU 74 8.545 11.731 -5.100 556 2HB GLU 74 3HB GLU 74 7.065 11.325 -5.945 557 1HG GLU 74 2HG GLU 74 7.066 13.715 -5.791 558 2HG GLU 74 3HG GLU 74 5.907 13.177 -4.591 559 HE2 GLU 74 HE2 GLU 74 8.541 15.603 -3.537 560 H VAL 75 HN VAL 75 5.658 9.467 -5.537 561 HA VAL 75 HA VAL 75 3.110 10.518 -4.916 562 HB VAL 75 HB VAL 75 3.940 8.027 -6.418 563 1HG1 VAL 75 1HG1 VAL 75 1.717 7.599 -6.232 564 2HG1 VAL 75 2HG1 VAL 75 1.304 9.297 -5.891 565 3HG1 VAL 75 3HG1 VAL 75 1.611 8.774 -7.565 566 1HG2 VAL 75 1HG2 VAL 75 3.172 10.707 -7.597 567 2HG2 VAL 75 2HG2 VAL 75 4.856 10.274 -7.214 568 3HG2 VAL 75 3HG2 VAL 75 3.939 9.318 -8.403 569 H ASN 76 HN ASN 76 5.076 7.803 -3.733 570 HA ASN 76 HA ASN 76 2.801 6.735 -2.333 571 1HB ASN 76 2HB ASN 76 5.630 5.861 -2.896 572 2HB ASN 76 3HB ASN 76 4.904 5.246 -1.425 573 1HD2 ASN 76 1HD2 ASN 76 5.013 5.123 -4.843 574 2HD2 ASN 76 2HD2 ASN 76 3.840 3.877 -5.115 575 H THR 77 HN THR 77 3.940 9.474 -1.739 576 HA THR 77 HA THR 77 4.572 9.008 1.091 577 HB THR 77 HB THR 77 6.070 10.668 -0.977 578 HG1 THR 77 HG1 THR 77 7.475 9.049 -0.427 579 1HG2 THR 77 1HG2 THR 77 6.477 12.289 0.584 580 2HG2 THR 77 2HG2 THR 77 5.489 11.428 1.788 581 3HG2 THR 77 3HG2 THR 77 7.215 11.034 1.608 582 H THR 78 HN THR 78 3.870 11.672 -1.276 583 HA THR 78 HA THR 78 2.739 13.440 0.440 584 HB THR 78 HB THR 78 2.038 12.678 -2.439 585 HG1 THR 78 HG1 THR 78 3.522 14.823 -1.088 586 1HG2 THR 78 1HG2 THR 78 1.156 15.020 -2.605 587 2HG2 THR 78 2HG2 THR 78 0.166 14.035 -1.501 588 3HG2 THR 78 3HG2 THR 78 1.340 15.201 -0.844 589 HA PRO 79 HA PRO 79 -0.609 11.018 1.924 590 1HB PRO 79 2HB PRO 79 -0.933 12.371 4.276 591 2HB PRO 79 3HB PRO 79 0.147 11.002 4.099 592 1HG PRO 79 2HG PRO 79 0.814 13.876 4.287 593 2HG PRO 79 3HG PRO 79 1.855 12.489 4.536 594 1HD PRO 79 2HD PRO 79 1.777 14.185 2.223 595 2HD PRO 79 3HD PRO 79 2.735 12.731 2.425 596 H ALA 80 HN ALA 80 -2.848 11.664 2.989 597 HA ALA 80 HA ALA 80 -3.710 14.231 2.009 598 1HB ALA 80 1HB ALA 80 -4.166 11.707 0.522 599 2HB ALA 80 2HB ALA 80 -5.629 12.679 0.812 600 3HB ALA 80 3HB ALA 80 -4.239 13.396 -0.037 601 H THR 81 HN THR 81 -3.661 13.919 4.551 602 HA THR 81 HA THR 81 -6.413 13.304 5.284 603 HB THR 81 HB THR 81 -3.912 11.946 6.384 604 HG1 THR 81 HG1 THR 81 -5.024 10.719 4.828 605 1HG2 THR 81 1HG2 THR 81 -6.457 12.663 7.778 606 2HG2 THR 81 2HG2 THR 81 -6.029 10.936 7.841 607 3HG2 THR 81 3HG2 THR 81 -4.896 12.157 8.467 608 H ALA 82 HN ALA 82 -3.205 14.249 6.702 609 HA ALA 82 HA ALA 82 -2.667 15.893 8.085 610 1HB ALA 82 1HB ALA 82 -4.287 18.042 7.557 611 2HB ALA 82 2HB ALA 82 -2.872 17.583 6.578 612 3HB ALA 82 3HB ALA 82 -4.503 17.073 6.079
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