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NMR Restraints Grid |
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Result table
(Save to zip file containing files for each block)
image | mrblock_id | pdb_id | cing | stage | position | program | type |
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7642 |
1ksm ![]() ![]() |
cing | 1-original | 22 | MR format | nomenclature mapping |
1 H LYS 1 HN LYS 1 1.884 0.000 0.829 2 HA LYS 1 HA LYS 1 2.866 0.742 -1.150 3 1HB LYS 1 2HB LYS 1 3.092 -1.432 -2.497 4 2HB LYS 1 3HB LYS 1 3.629 -1.435 -0.829 5 1HG LYS 1 2HG LYS 1 2.288 -3.458 -1.309 6 2HG LYS 1 3HG LYS 1 1.487 -2.463 -0.110 7 1HD LYS 1 2HD LYS 1 -0.056 -1.561 -1.774 8 2HD LYS 1 3HD LYS 1 0.842 -2.296 -3.087 9 1HE LYS 1 2HE LYS 1 0.234 -4.547 -2.341 10 2HE LYS 1 3HE LYS 1 -0.470 -3.924 -0.862 11 1HZ LYS 1 1HZ LYS 1 -2.153 -4.357 -2.484 12 2HZ LYS 1 2HZ LYS 1 -2.087 -2.747 -2.216 13 3HZ LYS 1 3HZ LYS 1 -1.445 -3.376 -3.580 14 H SER 2 HN SER 2 -0.345 0.914 -1.064 15 HA SER 2 HA SER 2 -0.972 0.555 -3.801 16 1HB SER 2 2HB SER 2 -2.370 1.230 -1.316 17 2HB SER 2 3HB SER 2 -2.927 2.233 -2.640 18 HG SER 2 HG SER 2 -2.638 -0.457 -3.357 19 HA PRO 3 HA PRO 3 -0.073 4.563 -5.241 20 1HB PRO 3 2HB PRO 3 -2.076 5.108 -7.019 21 2HB PRO 3 3HB PRO 3 -0.717 4.067 -7.396 22 1HG PRO 3 2HG PRO 3 -3.513 3.320 -6.790 23 2HG PRO 3 3HG PRO 3 -2.266 2.367 -7.570 24 1HD PRO 3 2HD PRO 3 -3.180 2.110 -4.864 25 2HD PRO 3 3HD PRO 3 -1.856 1.238 -5.610 26 H GLU 4 HN GLU 4 -3.450 4.306 -4.304 27 HA GLU 4 HA GLU 4 -3.846 7.016 -4.006 28 1HB GLU 4 2HB GLU 4 -5.317 4.641 -3.598 29 2HB GLU 4 3HB GLU 4 -5.322 5.429 -2.033 30 1HG GLU 4 2HG GLU 4 -5.805 7.275 -4.316 31 2HG GLU 4 3HG GLU 4 -7.036 6.042 -4.127 32 H GLU 5 HN GLU 5 -2.338 4.587 -1.872 33 HA GLU 5 HA GLU 5 -2.394 6.194 0.425 34 1HB GLU 5 2HB GLU 5 -1.198 3.615 -0.420 35 2HB GLU 5 3HB GLU 5 -0.254 4.466 0.788 36 1HG GLU 5 2HG GLU 5 -2.825 4.774 1.785 37 2HG GLU 5 3HG GLU 5 -2.934 3.196 1.030 38 H LEU 6 HN LEU 6 -0.223 5.899 -2.377 39 HA LEU 6 HA LEU 6 2.015 7.145 -1.256 40 1HB LEU 6 2HB LEU 6 0.998 6.726 -4.049 41 2HB LEU 6 3HB LEU 6 2.429 7.695 -3.757 42 HG LEU 6 HG LEU 6 2.134 4.843 -2.785 43 1HD1 LEU 6 1HD1 LEU 6 2.148 4.337 -4.986 44 2HD1 LEU 6 2HD1 LEU 6 2.847 5.904 -5.461 45 3HD1 LEU 6 3HD1 LEU 6 3.896 4.622 -4.809 46 1HD2 LEU 6 1HD2 LEU 6 4.525 4.905 -2.476 47 2HD2 LEU 6 2HD2 LEU 6 4.612 6.547 -3.157 48 3HD2 LEU 6 3HD2 LEU 6 3.785 6.270 -1.605 49 H LYS 7 HN LYS 7 -0.908 8.422 -2.938 50 HA LYS 7 HA LYS 7 0.000 11.092 -2.948 51 1HB LYS 7 2HB LYS 7 -2.005 9.731 -4.177 52 2HB LYS 7 3HB LYS 7 -2.918 10.556 -2.930 53 1HG LYS 7 2HG LYS 7 -1.593 12.699 -3.661 54 2HG LYS 7 3HG LYS 7 -1.172 11.784 -5.095 55 1HD LYS 7 2HD LYS 7 -3.209 12.178 -6.008 56 2HD LYS 7 3HD LYS 7 -4.013 11.476 -4.618 57 1HE LYS 7 2HE LYS 7 -3.036 14.034 -3.775 58 2HE LYS 7 3HE LYS 7 -3.766 14.279 -5.349 59 1HZ LYS 7 1HZ LYS 7 -5.015 13.174 -2.947 60 2HZ LYS 7 2HZ LYS 7 -5.490 14.455 -3.841 61 3HZ LYS 7 3HZ LYS 7 -5.674 12.940 -4.423 62 H GLY 8 HN GLY 8 -2.179 9.209 -0.751 63 1HA GLY 8 1HA GLY 8 -2.852 11.265 0.987 64 2HA GLY 8 2HA GLY 8 -2.775 9.560 1.386 65 H ILE 9 HN ILE 9 -0.289 8.727 1.500 66 HA ILE 9 HA ILE 9 0.794 9.885 3.752 67 HB ILE 9 HB ILE 9 1.892 8.054 1.638 68 1HG1 ILE 9 2HG1 ILE 9 1.007 7.655 4.510 69 2HG1 ILE 9 3HG1 ILE 9 0.149 7.143 3.070 70 1HG2 ILE 9 1HG2 ILE 9 3.543 7.866 3.906 71 2HG2 ILE 9 2HG2 ILE 9 3.976 8.455 2.283 72 3HG2 ILE 9 3HG2 ILE 9 3.425 9.602 3.528 73 1HD1 ILE 9 1HD1 ILE 9 1.394 5.255 2.902 74 2HD1 ILE 9 2HD1 ILE 9 2.912 6.177 3.018 75 3HD1 ILE 9 3HD1 ILE 9 2.072 5.657 4.498 76 H PHE 10 HN PHE 10 1.600 10.392 0.267 77 HA PHE 10 HA PHE 10 3.801 11.973 0.557 78 1HB PHE 10 2HB PHE 10 3.071 11.328 -1.645 79 2HB PHE 10 3HB PHE 10 1.416 11.814 -1.333 80 HD1 PHE 10 HD1 PHE 10 4.700 12.908 -2.442 81 HD2 PHE 10 HD2 PHE 10 0.775 14.189 -1.464 82 HE1 PHE 10 HE1 PHE 10 5.123 15.091 -3.606 83 HE2 PHE 10 HE2 PHE 10 1.197 16.372 -2.628 84 HZ PHE 10 HZ PHE 10 3.366 16.797 -3.685 85 H GLU 11 HN GLU 11 0.350 13.108 0.324 86 HA GLU 11 HA GLU 11 0.997 15.765 0.769 87 1HB GLU 11 2HB GLU 11 -1.380 14.160 0.404 88 2HB GLU 11 3HB GLU 11 -1.652 15.251 1.748 89 1HG GLU 11 2HG GLU 11 -0.407 16.932 -0.070 90 2HG GLU 11 3HG GLU 11 -1.290 15.864 -1.141 91 H LYS 12 HN LYS 12 0.364 13.029 2.969 92 HA LYS 12 HA LYS 12 -0.108 14.487 5.293 93 1HB LYS 12 2HB LYS 12 -0.408 11.975 4.793 94 2HB LYS 12 3HB LYS 12 1.288 11.811 5.199 95 1HG LYS 12 2HG LYS 12 0.077 13.447 7.236 96 2HG LYS 12 3HG LYS 12 -0.973 12.066 6.986 97 1HD LYS 12 2HD LYS 12 1.202 10.623 7.104 98 2HD LYS 12 3HD LYS 12 1.971 12.057 7.754 99 1HE LYS 12 2HE LYS 12 0.325 12.143 9.606 100 2HE LYS 12 3HE LYS 12 -0.544 10.779 8.931 101 1HZ LYS 12 1HZ LYS 12 1.077 10.258 10.719 102 2HZ LYS 12 2HZ LYS 12 1.269 9.382 9.355 103 3HZ LYS 12 3HZ LYS 12 2.286 10.617 9.681 104 H TYR 13 HN TYR 13 2.856 13.760 3.485 105 HA TYR 13 HA TYR 13 4.484 14.764 5.685 106 1HB TYR 13 2HB TYR 13 4.811 13.353 2.997 107 2HB TYR 13 3HB TYR 13 6.201 14.189 3.659 108 HD1 TYR 13 HD1 TYR 13 7.701 12.881 4.838 109 HD2 TYR 13 HD2 TYR 13 3.559 11.813 4.894 110 HE1 TYR 13 HE1 TYR 13 8.238 10.846 6.264 111 HE2 TYR 13 HE2 TYR 13 4.109 9.782 6.320 112 HH TYR 13 HH TYR 13 6.127 8.326 6.672 113 H ALA 14 HN ALA 14 3.422 15.563 2.346 114 HA ALA 14 HA ALA 14 5.154 17.764 2.037 115 1HB ALA 14 1HB ALA 14 2.450 17.436 0.711 116 2HB ALA 14 2HB ALA 14 3.938 18.155 0.049 117 3HB ALA 14 3HB ALA 14 3.829 16.394 0.283 118 H ALA 15 HN ALA 15 2.107 17.234 3.740 119 HA ALA 15 HA ALA 15 1.529 20.053 3.913 120 1HB ALA 15 1HB ALA 15 -0.457 19.360 5.008 121 2HB ALA 15 2HB ALA 15 -0.153 18.101 3.787 122 3HB ALA 15 3HB ALA 15 0.254 17.802 5.494 123 H LYS 16 HN LYS 16 3.462 17.666 5.562 124 HA LYS 16 HA LYS 16 3.359 18.552 8.167 125 1HB LYS 16 2HB LYS 16 4.831 16.705 6.673 126 2HB LYS 16 3HB LYS 16 6.044 17.787 7.326 127 1HG LYS 16 2HG LYS 16 4.839 17.524 9.608 128 2HG LYS 16 3HG LYS 16 3.948 16.206 8.872 129 1HD LYS 16 2HD LYS 16 5.840 14.835 8.682 130 2HD LYS 16 3HD LYS 16 6.950 16.189 8.591 131 1HE LYS 16 2HE LYS 16 6.572 16.675 11.011 132 2HE LYS 16 3HE LYS 16 5.433 15.347 11.109 133 1HZ LYS 16 1HZ LYS 16 7.326 14.325 11.741 134 2HZ LYS 16 2HZ LYS 16 7.455 14.053 10.136 135 3HZ LYS 16 3HZ LYS 16 8.313 15.257 10.832 136 H GLU 17 HN GLU 17 5.883 19.478 5.714 137 HA GLU 17 HA GLU 17 6.024 22.021 7.140 138 1HB GLU 17 2HB GLU 17 8.167 20.319 5.843 139 2HB GLU 17 3HB GLU 17 8.413 22.045 6.024 140 1HG GLU 17 2HG GLU 17 7.427 21.211 8.541 141 2HG GLU 17 3HG GLU 17 8.523 19.931 8.059 142 H GLY 18 HN GLY 18 5.594 23.870 5.977 143 1HA GLY 18 1HA GLY 18 5.130 25.211 4.235 144 2HA GLY 18 2HA GLY 18 6.148 24.191 3.238 145 H ASP 19 HN ASP 19 4.161 25.076 1.795 146 HA ASP 19 HA ASP 19 1.681 23.971 2.073 147 1HB ASP 19 2HB ASP 19 2.790 25.688 0.325 148 2HB ASP 19 3HB ASP 19 2.899 24.254 -0.676 149 HA PRO 20 HA PRO 20 2.497 19.787 0.991 150 1HB PRO 20 2HB PRO 20 -0.065 18.882 0.699 151 2HB PRO 20 3HB PRO 20 0.726 19.034 2.256 152 1HG PRO 20 2HG PRO 20 -1.353 20.760 1.058 153 2HG PRO 20 3HG PRO 20 -0.864 20.634 2.736 154 1HD PRO 20 2HD PRO 20 -0.177 22.729 0.900 155 2HD PRO 20 3HD PRO 20 0.406 22.541 2.542 156 H ASN 21 HN ASN 21 1.514 22.102 -1.079 157 HA ASN 21 HA ASN 21 1.017 20.285 -3.244 158 1HB ASN 21 2HB ASN 21 1.039 23.311 -2.918 159 2HB ASN 21 3HB ASN 21 1.038 22.613 -4.526 160 1HD2 ASN 21 1HD2 ASN 21 -0.774 23.402 -1.758 161 2HD2 ASN 21 2HD2 ASN 21 -2.314 22.765 -2.230 162 H GLN 22 HN GLN 22 3.720 21.000 -1.606 163 HA GLN 22 HA GLN 22 5.372 20.689 -3.910 164 1HB GLN 22 2HB GLN 22 6.876 22.659 -3.104 165 2HB GLN 22 3HB GLN 22 5.447 23.037 -4.046 166 1HG GLN 22 2HG GLN 22 4.256 23.188 -1.676 167 2HG GLN 22 3HG GLN 22 5.890 23.370 -1.067 168 1HE2 GLN 22 1HE2 GLN 22 4.902 25.454 -0.410 169 2HE2 GLN 22 2HE2 GLN 22 5.006 26.802 -1.494 170 H LEU 23 HN LEU 23 7.175 19.452 -3.400 171 HA LEU 23 HA LEU 23 7.411 18.722 -0.592 172 1HB LEU 23 2HB LEU 23 8.294 17.477 -3.182 173 2HB LEU 23 3HB LEU 23 8.963 16.955 -1.649 174 HG LEU 23 HG LEU 23 6.784 15.862 -2.830 175 1HD1 LEU 23 1HD1 LEU 23 7.158 14.452 -1.162 176 2HD1 LEU 23 2HD1 LEU 23 8.138 15.685 -0.333 177 3HD1 LEU 23 3HD1 LEU 23 6.389 15.580 -0.019 178 1HD2 LEU 23 1HD2 LEU 23 5.684 17.853 -0.827 179 2HD2 LEU 23 2HD2 LEU 23 5.417 17.865 -2.587 180 3HD2 LEU 23 3HD2 LEU 23 4.772 16.533 -1.597 181 H SER 24 HN SER 24 9.622 18.493 0.360 182 HA SER 24 HA SER 24 11.525 20.287 -0.893 183 1HB SER 24 2HB SER 24 10.618 20.456 2.016 184 2HB SER 24 3HB SER 24 11.993 21.323 1.360 185 HG SER 24 HG SER 24 9.745 21.718 -0.206 186 H LYS 25 HN LYS 25 13.722 20.144 0.482 187 HA LYS 25 HA LYS 25 14.553 17.495 0.370 188 1HB LYS 25 2HB LYS 25 15.927 19.633 0.183 189 2HB LYS 25 3HB LYS 25 15.901 19.708 1.933 190 1HG LYS 25 2HG LYS 25 16.668 17.116 1.648 191 2HG LYS 25 3HG LYS 25 17.289 17.741 0.133 192 1HD LYS 25 2HD LYS 25 18.023 19.676 2.078 193 2HD LYS 25 3HD LYS 25 18.313 18.129 2.849 194 1HE LYS 25 2HE LYS 25 19.670 17.392 0.887 195 2HE LYS 25 3HE LYS 25 19.360 18.921 0.088 196 1HZ LYS 25 1HZ LYS 25 20.655 18.718 2.715 197 2HZ LYS 25 2HZ LYS 25 21.479 18.803 1.308 198 3HZ LYS 25 3HZ LYS 25 20.534 20.050 1.778 199 H GLU 26 HN GLU 26 13.927 19.597 3.270 200 HA GLU 26 HA GLU 26 14.329 17.550 5.085 201 1HB GLU 26 2HB GLU 26 13.563 20.313 5.124 202 2HB GLU 26 3HB GLU 26 12.393 19.445 6.099 203 1HG GLU 26 2HG GLU 26 14.925 18.334 6.785 204 2HG GLU 26 3HG GLU 26 15.182 20.066 6.699 205 H GLU 27 HN GLU 27 11.375 18.717 3.383 206 HA GLU 27 HA GLU 27 9.581 17.174 4.820 207 1HB GLU 27 2HB GLU 27 9.593 18.692 2.262 208 2HB GLU 27 3HB GLU 27 8.405 17.406 2.335 209 1HG GLU 27 2HG GLU 27 8.003 18.489 4.801 210 2HG GLU 27 3HG GLU 27 8.596 19.915 3.973 211 H LEU 28 HN LEU 28 10.987 16.583 1.511 212 HA LEU 28 HA LEU 28 9.944 14.037 1.217 213 1HB LEU 28 2HB LEU 28 11.190 15.708 -0.395 214 2HB LEU 28 3HB LEU 28 12.600 14.772 0.059 215 HG LEU 28 HG LEU 28 11.873 12.865 -1.015 216 1HD1 LEU 28 1HD1 LEU 28 9.802 12.447 0.028 217 2HD1 LEU 28 2HD1 LEU 28 9.061 13.911 -0.663 218 3HD1 LEU 28 3HD1 LEU 28 9.453 12.529 -1.715 219 1HD2 LEU 28 1HD2 LEU 28 11.106 15.339 -2.474 220 2HD2 LEU 28 2HD2 LEU 28 12.299 14.083 -2.879 221 3HD2 LEU 28 3HD2 LEU 28 10.567 13.789 -3.162 222 H LYS 29 HN LYS 29 13.035 15.166 2.697 223 HA LYS 29 HA LYS 29 14.343 12.852 3.071 224 1HB LYS 29 2HB LYS 29 15.180 15.034 3.767 225 2HB LYS 29 3HB LYS 29 13.999 15.117 5.058 226 1HG LYS 29 2HG LYS 29 15.084 13.501 6.357 227 2HG LYS 29 3HG LYS 29 15.774 12.686 4.968 228 1HD LYS 29 2HD LYS 29 17.672 13.942 5.046 229 2HD LYS 29 3HD LYS 29 16.770 15.440 5.167 230 1HE LYS 29 2HE LYS 29 16.481 15.132 7.595 231 2HE LYS 29 3HE LYS 29 17.217 13.544 7.521 232 1HZ LYS 29 1HZ LYS 29 19.050 14.690 7.985 233 2HZ LYS 29 2HZ LYS 29 19.087 15.050 6.392 234 3HZ LYS 29 3HZ LYS 29 18.463 16.119 7.457 235 H LEU 30 HN LEU 30 11.728 14.123 5.249 236 HA LEU 30 HA LEU 30 11.690 11.997 6.993 237 1HB LEU 30 2HB LEU 30 9.382 13.709 6.058 238 2HB LEU 30 3HB LEU 30 9.396 12.710 7.498 239 HG LEU 30 HG LEU 30 10.855 15.278 6.957 240 1HD1 LEU 30 1HD1 LEU 30 9.772 16.083 8.843 241 2HD1 LEU 30 2HD1 LEU 30 8.548 15.018 8.110 242 3HD1 LEU 30 3HD1 LEU 30 9.495 14.456 9.509 243 1HD2 LEU 30 1HD2 LEU 30 11.646 13.229 9.044 244 2HD2 LEU 30 2HD2 LEU 30 12.628 13.803 7.675 245 3HD2 LEU 30 3HD2 LEU 30 12.208 14.917 8.998 246 H LEU 31 HN LEU 31 9.624 12.479 4.040 247 HA LEU 31 HA LEU 31 8.327 10.067 4.141 248 1HB LEU 31 2HB LEU 31 8.049 12.130 2.614 249 2HB LEU 31 3HB LEU 31 9.206 11.337 1.563 250 HG LEU 31 HG LEU 31 7.099 9.493 2.322 251 1HD1 LEU 31 1HD1 LEU 31 5.899 11.746 2.522 252 2HD1 LEU 31 2HD1 LEU 31 6.093 11.867 0.756 253 3HD1 LEU 31 3HD1 LEU 31 5.174 10.515 1.460 254 1HD2 LEU 31 1HD2 LEU 31 7.981 8.747 0.410 255 2HD2 LEU 31 2HD2 LEU 31 6.906 9.919 -0.389 256 3HD2 LEU 31 3HD2 LEU 31 8.598 10.354 -0.045 257 H LEU 32 HN LEU 32 11.283 10.803 2.149 258 HA LEU 32 HA LEU 32 11.779 8.255 1.318 259 1HB LEU 32 2HB LEU 32 13.826 10.347 2.068 260 2HB LEU 32 3HB LEU 32 14.084 8.974 1.009 261 HG LEU 32 HG LEU 32 12.097 11.188 0.439 262 1HD1 LEU 32 1HD1 LEU 32 13.713 12.496 -0.337 263 2HD1 LEU 32 2HD1 LEU 32 14.892 11.386 0.402 264 3HD1 LEU 32 3HD1 LEU 32 14.409 11.168 -1.297 265 1HD2 LEU 32 1HD2 LEU 32 11.371 9.887 -1.200 266 2HD2 LEU 32 2HD2 LEU 32 13.004 9.871 -1.907 267 3HD2 LEU 32 3HD2 LEU 32 12.529 8.618 -0.735 268 H GLN 33 HN GLN 33 11.989 9.581 4.548 269 HA GLN 33 HA GLN 33 13.864 7.732 5.521 270 1HB GLN 33 2HB GLN 33 12.702 10.035 6.481 271 2HB GLN 33 3HB GLN 33 11.853 8.827 7.425 272 1HG GLN 33 2HG GLN 33 14.108 7.813 8.034 273 2HG GLN 33 3HG GLN 33 14.882 9.155 7.213 274 1HE2 GLN 33 1HE2 GLN 33 14.419 11.325 7.937 275 2HE2 GLN 33 2HE2 GLN 33 14.071 11.638 9.604 276 H THR 34 HN THR 34 10.273 7.990 6.092 277 HA THR 34 HA THR 34 10.206 5.239 6.961 278 HB THR 34 HB THR 34 8.494 7.670 7.015 279 HG1 THR 34 HG1 THR 34 9.132 6.891 9.012 280 1HG2 THR 34 1HG2 THR 34 7.371 4.923 6.404 281 2HG2 THR 34 2HG2 THR 34 6.528 5.949 7.589 282 3HG2 THR 34 3HG2 THR 34 6.751 6.519 5.918 283 H GLU 35 HN GLU 35 8.889 7.159 4.189 284 HA GLU 35 HA GLU 35 7.544 5.193 2.945 285 1HB GLU 35 2HB GLU 35 7.551 7.491 2.133 286 2HB GLU 35 3HB GLU 35 9.257 7.406 1.740 287 1HG GLU 35 2HG GLU 35 8.557 6.844 -0.358 288 2HG GLU 35 3HG GLU 35 8.286 5.248 0.312 289 H PHE 36 HN PHE 36 11.021 6.046 2.262 290 HA PHE 36 HA PHE 36 11.599 3.232 1.961 291 1HB PHE 36 2HB PHE 36 11.729 5.379 -0.227 292 2HB PHE 36 3HB PHE 36 12.729 3.943 -0.326 293 HD1 PHE 36 HD1 PHE 36 9.759 5.330 -1.408 294 HD2 PHE 36 HD2 PHE 36 11.300 1.677 0.104 295 HE1 PHE 36 HE1 PHE 36 7.864 4.085 -2.485 296 HE2 PHE 36 HE2 PHE 36 9.405 0.432 -0.973 297 HZ PHE 36 HZ PHE 36 7.710 1.650 -2.254 298 HA PRO 37 HA PRO 37 14.994 5.490 3.808 299 1HB PRO 37 2HB PRO 37 15.613 3.630 5.711 300 2HB PRO 37 3HB PRO 37 14.500 4.954 5.992 301 1HG PRO 37 2HG PRO 37 13.903 2.092 5.551 302 2HG PRO 37 3HG PRO 37 12.878 3.334 6.243 303 1HD PRO 37 2HD PRO 37 12.707 2.244 3.595 304 2HD PRO 37 3HD PRO 37 11.758 3.565 4.248 305 H SER 38 HN SER 38 14.693 2.453 2.325 306 HA SER 38 HA SER 38 17.438 1.840 2.395 307 1HB SER 38 2HB SER 38 15.084 0.523 1.661 308 2HB SER 38 3HB SER 38 15.907 0.727 0.127 309 HG SER 38 HG SER 38 17.077 -0.964 0.709 310 H LEU 39 HN LEU 39 15.310 3.789 0.324 311 HA LEU 39 HA LEU 39 17.063 3.896 -1.897 312 1HB LEU 39 2HB LEU 39 14.461 4.805 -1.181 313 2HB LEU 39 3HB LEU 39 15.374 6.189 -1.749 314 HG LEU 39 HG LEU 39 13.986 4.825 -3.440 315 1HD1 LEU 39 1HD1 LEU 39 16.137 6.484 -3.704 316 2HD1 LEU 39 2HD1 LEU 39 16.691 5.039 -4.584 317 3HD1 LEU 39 3HD1 LEU 39 15.171 5.838 -5.052 318 1HD2 LEU 39 1HD2 LEU 39 15.198 2.662 -2.513 319 2HD2 LEU 39 2HD2 LEU 39 14.698 2.799 -4.216 320 3HD2 LEU 39 3HD2 LEU 39 16.394 3.088 -3.760 321 H LEU 40 HN LEU 40 17.021 5.364 1.264 322 HA LEU 40 HA LEU 40 18.485 7.695 0.515 323 1HB LEU 40 2HB LEU 40 17.883 6.390 3.169 324 2HB LEU 40 3HB LEU 40 18.787 7.882 3.005 325 HG LEU 40 HG LEU 40 15.984 7.553 1.919 326 1HD1 LEU 40 1HD1 LEU 40 16.847 7.771 4.686 327 2HD1 LEU 40 2HD1 LEU 40 15.816 9.138 4.202 328 3HD1 LEU 40 3HD1 LEU 40 15.229 7.469 4.009 329 1HD2 LEU 40 1HD2 LEU 40 17.099 9.390 0.903 330 2HD2 LEU 40 2HD2 LEU 40 16.007 10.063 2.137 331 3HD2 LEU 40 3HD2 LEU 40 17.753 9.946 2.462 332 H LYS 41 HN LYS 41 19.215 4.333 1.293 333 HA LYS 41 HA LYS 41 21.905 4.749 2.038 334 1HB LYS 41 2HB LYS 41 20.639 2.251 0.879 335 2HB LYS 41 3HB LYS 41 22.112 2.348 1.823 336 1HG LYS 41 2HG LYS 41 20.548 3.514 3.630 337 2HG LYS 41 3HG LYS 41 19.251 2.748 2.735 338 1HD LYS 41 2HD LYS 41 20.279 0.527 3.054 339 2HD LYS 41 3HD LYS 41 21.679 1.247 3.823 340 1HE LYS 41 2HE LYS 41 20.449 1.877 5.768 341 2HE LYS 41 3HE LYS 41 18.904 1.747 4.951 342 1HZ LYS 41 1HZ LYS 41 19.219 -0.138 6.322 343 2HZ LYS 41 2HZ LYS 41 19.327 -0.651 4.775 344 3HZ LYS 41 3HZ LYS 41 20.679 -0.478 5.675 345 H GLY 42 HN GLY 42 20.172 4.489 -1.053 346 1HA GLY 42 1HA GLY 42 22.035 3.763 -2.856 347 2HA GLY 42 2HA GLY 42 20.883 5.056 -3.125 348 H MET 43 HN MET 43 23.356 5.172 -4.394 349 HA MET 43 HA MET 43 25.218 6.611 -2.835 350 1HB MET 43 2HB MET 43 24.893 6.273 -5.869 351 2HB MET 43 3HB MET 43 26.318 6.951 -5.107 352 1HG MET 43 2HG MET 43 26.970 4.882 -4.162 353 2HG MET 43 3HG MET 43 25.346 4.228 -4.209 354 1HE MET 43 1HE MET 43 27.615 2.735 -4.795 355 2HE MET 43 2HE MET 43 26.511 1.769 -5.802 356 3HE MET 43 3HE MET 43 28.046 2.361 -6.481 357 H SER 44 HN SER 44 22.199 7.486 -3.970 358 HA SER 44 HA SER 44 22.997 10.150 -4.743 359 1HB SER 44 2HB SER 44 20.283 8.760 -4.686 360 2HB SER 44 3HB SER 44 20.509 10.425 -5.184 361 HG SER 44 HG SER 44 20.489 8.736 -6.932 362 H THR 45 HN THR 45 23.587 11.303 -2.893 363 HA THR 45 HA THR 45 22.377 10.947 -0.382 364 HB THR 45 HB THR 45 23.715 12.949 0.184 365 HG1 THR 45 HG1 THR 45 24.620 14.108 -1.705 366 1HG2 THR 45 1HG2 THR 45 25.702 11.856 -0.113 367 2HG2 THR 45 2HG2 THR 45 24.819 10.657 -1.087 368 3HG2 THR 45 3HG2 THR 45 25.593 12.050 -1.879 369 H LEU 46 HN LEU 46 21.336 12.884 0.833 370 HA LEU 46 HA LEU 46 18.806 13.222 -0.165 371 1HB LEU 46 2HB LEU 46 20.046 13.707 2.172 372 2HB LEU 46 3HB LEU 46 19.890 15.352 1.588 373 HG LEU 46 HG LEU 46 17.958 15.161 2.788 374 1HD1 LEU 46 1HD1 LEU 46 16.995 13.982 0.171 375 2HD1 LEU 46 2HD1 LEU 46 16.075 14.984 1.319 376 3HD1 LEU 46 3HD1 LEU 46 17.428 15.692 0.406 377 1HD2 LEU 46 1HD2 LEU 46 17.326 12.360 1.894 378 2HD2 LEU 46 2HD2 LEU 46 18.486 12.660 3.210 379 3HD2 LEU 46 3HD2 LEU 46 16.805 13.229 3.357 380 H ASP 47 HN ASP 47 21.384 15.788 -0.040 381 HA ASP 47 HA ASP 47 20.098 17.664 -1.452 382 1HB ASP 47 2HB ASP 47 22.804 17.077 -0.702 383 2HB ASP 47 3HB ASP 47 22.848 17.532 -2.393 384 H GLU 48 HN GLU 48 22.145 14.934 -2.706 385 HA GLU 48 HA GLU 48 22.054 15.579 -5.358 386 1HB GLU 48 2HB GLU 48 22.762 13.279 -3.726 387 2HB GLU 48 3HB GLU 48 21.956 12.736 -5.184 388 1HG GLU 48 2HG GLU 48 23.587 14.564 -6.323 389 2HG GLU 48 3HG GLU 48 24.548 14.242 -4.893 390 H LEU 49 HN LEU 49 19.737 13.638 -3.376 391 HA LEU 49 HA LEU 49 18.085 12.941 -5.544 392 1HB LEU 49 2HB LEU 49 18.322 12.248 -2.901 393 2HB LEU 49 3HB LEU 49 16.828 13.164 -2.901 394 HG LEU 49 HG LEU 49 16.860 11.295 -5.116 395 1HD1 LEU 49 1HD1 LEU 49 17.573 10.222 -2.397 396 2HD1 LEU 49 2HD1 LEU 49 16.620 9.255 -3.548 397 3HD1 LEU 49 3HD1 LEU 49 18.252 9.812 -3.990 398 1HD2 LEU 49 1HD2 LEU 49 14.695 11.475 -4.685 399 2HD2 LEU 49 2HD2 LEU 49 14.925 10.622 -3.139 400 3HD2 LEU 49 3HD2 LEU 49 15.054 12.396 -3.205 401 H PHE 50 HN PHE 50 18.079 15.668 -3.181 402 HA PHE 50 HA PHE 50 15.661 16.774 -3.907 403 1HB PHE 50 2HB PHE 50 17.205 17.391 -1.979 404 2HB PHE 50 3HB PHE 50 18.338 18.078 -3.125 405 HD1 PHE 50 HD1 PHE 50 15.022 18.499 -1.584 406 HD2 PHE 50 HD2 PHE 50 17.992 20.256 -4.053 407 HE1 PHE 50 HE1 PHE 50 13.858 20.716 -1.406 408 HE2 PHE 50 HE2 PHE 50 16.829 22.473 -3.875 409 HZ PHE 50 HZ PHE 50 14.776 22.677 -2.554 410 H GLU 51 HN GLU 51 18.984 17.545 -5.168 411 HA GLU 51 HA GLU 51 17.992 19.367 -7.047 412 1HB GLU 51 2HB GLU 51 20.519 18.541 -6.082 413 2HB GLU 51 3HB GLU 51 20.557 18.176 -7.796 414 1HG GLU 51 2HG GLU 51 19.546 20.598 -8.090 415 2HG GLU 51 3HG GLU 51 20.110 20.860 -6.452 416 H GLU 52 HN GLU 52 18.684 15.857 -7.078 417 HA GLU 52 HA GLU 52 18.597 15.539 -9.833 418 1HB GLU 52 2HB GLU 52 19.498 13.838 -8.279 419 2HB GLU 52 3HB GLU 52 17.903 13.576 -7.603 420 1HG GLU 52 2HG GLU 52 17.063 12.741 -9.760 421 2HG GLU 52 3HG GLU 52 18.571 13.153 -10.553 422 H LEU 53 HN LEU 53 16.033 15.096 -7.295 423 HA LEU 53 HA LEU 53 13.988 14.345 -8.967 424 1HB LEU 53 2HB LEU 53 13.878 16.000 -6.442 425 2HB LEU 53 3HB LEU 53 12.503 15.219 -7.196 426 HG LEU 53 HG LEU 53 14.864 13.531 -6.461 427 1HD1 LEU 53 1HD1 LEU 53 13.544 13.246 -4.192 428 2HD1 LEU 53 2HD1 LEU 53 14.784 14.506 -4.393 429 3HD1 LEU 53 3HD1 LEU 53 13.060 14.926 -4.528 430 1HD2 LEU 53 1HD2 LEU 53 12.132 12.630 -5.860 431 2HD2 LEU 53 2HD2 LEU 53 12.422 12.993 -7.579 432 3HD2 LEU 53 3HD2 LEU 53 13.453 11.814 -6.731 433 H ASP 54 HN ASP 54 14.803 17.705 -7.843 434 HA ASP 54 HA ASP 54 12.913 18.847 -9.565 435 1HB ASP 54 2HB ASP 54 13.764 19.966 -7.517 436 2HB ASP 54 3HB ASP 54 15.376 20.031 -8.200 437 H LYS 55 HN LYS 55 13.247 18.374 -11.786 438 HA LYS 55 HA LYS 55 15.927 18.969 -12.831 439 1HB LYS 55 2HB LYS 55 14.879 16.586 -12.987 440 2HB LYS 55 3HB LYS 55 13.886 17.274 -14.256 441 1HG LYS 55 2HG LYS 55 16.300 18.220 -15.070 442 2HG LYS 55 3HG LYS 55 16.853 16.797 -14.209 443 1HD LYS 55 2HD LYS 55 15.658 15.309 -15.625 444 2HD LYS 55 3HD LYS 55 14.555 16.556 -16.172 445 1HE LYS 55 2HE LYS 55 15.972 17.263 -17.829 446 2HE LYS 55 3HE LYS 55 17.384 17.175 -16.794 447 1HZ LYS 55 1HZ LYS 55 17.466 14.832 -17.132 448 2HZ LYS 55 2HZ LYS 55 16.071 14.830 -17.981 449 3HZ LYS 55 3HZ LYS 55 17.399 15.554 -18.595 450 H ASN 56 HN ASN 56 13.195 20.550 -12.242 451 HA ASN 56 HA ASN 56 12.949 21.619 -14.932 452 1HB ASN 56 2HB ASN 56 11.078 22.802 -13.050 453 2HB ASN 56 3HB ASN 56 10.723 21.809 -14.450 454 1HD2 ASN 56 1HD2 ASN 56 9.645 20.048 -14.054 455 2HD2 ASN 56 2HD2 ASN 56 9.673 19.092 -12.610 456 H GLY 57 HN GLY 57 13.241 22.528 -11.421 457 1HA GLY 57 1HA GLY 57 14.902 24.112 -10.755 458 2HA GLY 57 2HA GLY 57 14.646 24.990 -12.250 459 H ASP 58 HN ASP 58 12.287 23.612 -9.855 460 HA ASP 58 HA ASP 58 11.186 26.304 -9.683 461 1HB ASP 58 2HB ASP 58 9.614 23.956 -8.691 462 2HB ASP 58 3HB ASP 58 9.058 25.383 -9.543 463 H GLY 59 HN GLY 59 12.447 23.436 -7.988 464 1HA GLY 59 1HA GLY 59 13.492 23.576 -5.900 465 2HA GLY 59 2HA GLY 59 12.503 24.960 -5.480 466 H GLU 60 HN GLU 60 10.153 23.264 -6.837 467 HA GLU 60 HA GLU 60 9.539 21.919 -4.340 468 1HB GLU 60 2HB GLU 60 7.616 22.518 -6.621 469 2HB GLU 60 3HB GLU 60 7.212 22.109 -4.966 470 1HG GLU 60 2HG GLU 60 8.550 24.670 -5.947 471 2HG GLU 60 3HG GLU 60 6.949 24.519 -5.250 472 H VAL 61 HN VAL 61 9.411 19.703 -4.211 473 HA VAL 61 HA VAL 61 9.881 18.251 -6.695 474 HB VAL 61 HB VAL 61 10.176 17.597 -3.767 475 1HG1 VAL 61 1HG1 VAL 61 9.750 15.451 -4.241 476 2HG1 VAL 61 2HG1 VAL 61 9.703 15.768 -5.992 477 3HG1 VAL 61 3HG1 VAL 61 11.260 15.459 -5.185 478 1HG2 VAL 61 1HG2 VAL 61 12.261 18.311 -4.104 479 2HG2 VAL 61 2HG2 VAL 61 12.495 16.991 -5.276 480 3HG2 VAL 61 3HG2 VAL 61 11.927 18.584 -5.831 481 H SER 62 HN SER 62 7.422 19.183 -6.937 482 HA SER 62 HA SER 62 5.361 18.093 -5.606 483 1HB SER 62 2HB SER 62 4.454 18.051 -8.240 484 2HB SER 62 3HB SER 62 4.418 19.435 -7.166 485 HG SER 62 HG SER 62 6.629 18.761 -8.916 486 H PHE 63 HN PHE 63 3.793 16.303 -6.342 487 HA PHE 63 HA PHE 63 4.971 13.860 -6.226 488 1HB PHE 63 2HB PHE 63 2.473 14.719 -6.092 489 2HB PHE 63 3HB PHE 63 2.440 14.518 -7.832 490 HD1 PHE 63 HD1 PHE 63 4.001 12.354 -5.230 491 HD2 PHE 63 HD2 PHE 63 1.010 12.732 -8.216 492 HE1 PHE 63 HE1 PHE 63 3.404 9.933 -4.939 493 HE2 PHE 63 HE2 PHE 63 0.413 10.311 -7.926 494 HZ PHE 63 HZ PHE 63 1.618 8.941 -6.291 495 H GLU 64 HN GLU 64 4.562 15.965 -9.047 496 HA GLU 64 HA GLU 64 4.688 14.089 -11.037 497 1HB GLU 64 2HB GLU 64 5.869 16.078 -12.307 498 2HB GLU 64 3HB GLU 64 4.202 16.239 -11.793 499 1HG GLU 64 2HG GLU 64 4.719 17.971 -10.420 500 2HG GLU 64 3HG GLU 64 5.956 17.029 -9.610 501 H GLU 65 HN GLU 65 7.415 15.938 -9.494 502 HA GLU 65 HA GLU 65 9.378 14.563 -10.918 503 1HB GLU 65 2HB GLU 65 9.531 16.084 -8.279 504 2HB GLU 65 3HB GLU 65 10.931 15.546 -9.186 505 1HG GLU 65 2HG GLU 65 10.684 17.168 -10.804 506 2HG GLU 65 3HG GLU 65 8.934 17.067 -10.793 507 H PHE 66 HN PHE 66 7.610 13.902 -7.906 508 HA PHE 66 HA PHE 66 9.350 12.073 -6.764 509 1HB PHE 66 2HB PHE 66 7.171 13.176 -5.884 510 2HB PHE 66 3HB PHE 66 6.276 12.040 -6.873 511 HD1 PHE 66 HD1 PHE 66 8.040 12.538 -3.773 512 HD2 PHE 66 HD2 PHE 66 6.439 9.586 -6.367 513 HE1 PHE 66 HE1 PHE 66 8.101 10.863 -1.904 514 HE2 PHE 66 HE2 PHE 66 6.500 7.911 -4.498 515 HZ PHE 66 HZ PHE 66 7.330 8.570 -2.289 516 H GLN 67 HN GLN 67 6.752 11.650 -9.237 517 HA GLN 67 HA GLN 67 6.682 8.934 -9.279 518 1HB GLN 67 2HB GLN 67 6.487 10.751 -11.720 519 2HB GLN 67 3HB GLN 67 5.789 9.152 -11.557 520 1HG GLN 67 2HG GLN 67 4.772 10.453 -9.315 521 2HG GLN 67 3HG GLN 67 4.823 11.750 -10.493 522 1HE2 GLN 67 1HE2 GLN 67 2.626 10.142 -9.238 523 2HE2 GLN 67 2HE2 GLN 67 1.649 9.566 -10.547 524 H VAL 68 HN VAL 68 9.285 11.057 -10.185 525 HA VAL 68 HA VAL 68 10.508 9.339 -12.086 526 HB VAL 68 HB VAL 68 11.735 11.523 -10.396 527 1HG1 VAL 68 1HG1 VAL 68 13.610 10.969 -11.474 528 2HG1 VAL 68 2HG1 VAL 68 12.745 9.794 -12.494 529 3HG1 VAL 68 3HG1 VAL 68 12.831 11.503 -12.983 530 1HG2 VAL 68 1HG2 VAL 68 10.683 13.104 -11.585 531 2HG2 VAL 68 2HG2 VAL 68 10.963 12.251 -13.122 532 3HG2 VAL 68 3HG2 VAL 68 9.568 11.817 -12.105 533 H LEU 69 HN LEU 69 10.498 9.655 -8.542 534 HA LEU 69 HA LEU 69 12.796 7.993 -8.198 535 1HB LEU 69 2HB LEU 69 11.661 9.846 -6.675 536 2HB LEU 69 3HB LEU 69 10.795 8.462 -6.038 537 HG LEU 69 HG LEU 69 12.953 7.370 -5.496 538 1HD1 LEU 69 1HD1 LEU 69 14.118 9.941 -6.582 539 2HD1 LEU 69 2HD1 LEU 69 15.009 8.842 -5.501 540 3HD1 LEU 69 3HD1 LEU 69 14.455 8.269 -7.093 541 1HD2 LEU 69 1HD2 LEU 69 12.930 10.114 -4.249 542 2HD2 LEU 69 2HD2 LEU 69 11.636 8.932 -3.937 543 3HD2 LEU 69 3HD2 LEU 69 13.319 8.543 -3.509 544 H VAL 70 HN VAL 70 9.238 7.585 -8.303 545 HA VAL 70 HA VAL 70 9.013 5.073 -7.246 546 HB VAL 70 HB VAL 70 7.566 6.576 -9.403 547 1HG1 VAL 70 1HG1 VAL 70 6.890 4.600 -10.266 548 2HG1 VAL 70 2HG1 VAL 70 7.381 3.681 -8.823 549 3HG1 VAL 70 3HG1 VAL 70 5.828 4.552 -8.838 550 1HG2 VAL 70 1HG2 VAL 70 7.033 5.816 -6.530 551 2HG2 VAL 70 2HG2 VAL 70 7.063 7.431 -7.279 552 3HG2 VAL 70 3HG2 VAL 70 5.716 6.317 -7.617 553 H LYS 71 HN LYS 71 10.560 6.114 -10.229 554 HA LYS 71 HA LYS 71 10.434 3.603 -11.535 555 1HB LYS 71 2HB LYS 71 10.910 6.047 -12.421 556 2HB LYS 71 3HB LYS 71 12.578 5.629 -12.084 557 1HG LYS 71 2HG LYS 71 11.596 3.339 -13.378 558 2HG LYS 71 3HG LYS 71 10.798 4.649 -14.226 559 1HD LYS 71 2HD LYS 71 13.025 5.766 -14.566 560 2HD LYS 71 3HD LYS 71 13.809 4.425 -13.755 561 1HE LYS 71 2HE LYS 71 14.025 3.817 -16.020 562 2HE LYS 71 3HE LYS 71 12.600 2.917 -15.538 563 1HZ LYS 71 1HZ LYS 71 12.327 4.165 -17.604 564 2HZ LYS 71 2HZ LYS 71 11.232 4.602 -16.474 565 3HZ LYS 71 3HZ LYS 71 12.507 5.572 -16.794 566 H LYS 72 HN LYS 72 12.896 5.278 -9.481 567 HA LYS 72 HA LYS 72 14.735 3.132 -9.655 568 1HB LYS 72 2HB LYS 72 14.517 5.487 -7.759 569 2HB LYS 72 3HB LYS 72 15.857 4.359 -7.771 570 1HG LYS 72 2HG LYS 72 14.960 6.017 -10.177 571 2HG LYS 72 3HG LYS 72 16.306 6.425 -9.132 572 1HD LYS 72 2HD LYS 72 17.001 3.859 -9.756 573 2HD LYS 72 3HD LYS 72 16.090 4.262 -11.198 574 1HE LYS 72 2HE LYS 72 17.550 6.500 -11.129 575 2HE LYS 72 3HE LYS 72 18.626 5.531 -10.143 576 1HZ LYS 72 1HZ LYS 72 18.055 5.319 -12.932 577 2HZ LYS 72 2HZ LYS 72 19.386 4.861 -12.104 578 3HZ LYS 72 3HZ LYS 72 18.081 3.880 -12.160 579 H ILE 73 HN ILE 73 11.983 3.962 -7.551 580 HA ILE 73 HA ILE 73 12.655 2.009 -5.583 581 HB ILE 73 HB ILE 73 10.256 3.732 -6.143 582 1HG1 ILE 73 2HG1 ILE 73 11.897 3.731 -3.631 583 2HG1 ILE 73 3HG1 ILE 73 12.545 4.490 -5.071 584 1HG2 ILE 73 1HG2 ILE 73 9.235 2.902 -4.085 585 2HG2 ILE 73 2HG2 ILE 73 9.415 1.600 -5.286 586 3HG2 ILE 73 3HG2 ILE 73 10.539 1.703 -3.909 587 1HD1 ILE 73 1HD1 ILE 73 11.251 6.308 -4.710 588 2HD1 ILE 73 2HD1 ILE 73 9.788 5.299 -4.819 589 3HD1 ILE 73 3HD1 ILE 73 10.592 5.536 -3.248 590 H SER 74 HN SER 74 11.531 1.841 -8.786 591 HA SER 74 HA SER 74 9.865 -0.450 -8.290 592 1HB SER 74 2HB SER 74 10.075 1.530 -10.343 593 2HB SER 74 3HB SER 74 10.439 -0.008 -11.099 594 HG SER 74 HG SER 74 8.391 -0.625 -10.896 595 H GLN 75 HN GLN 75 13.009 0.431 -9.840 596 HA GLN 75 HA GLN 75 13.546 -2.191 -10.683 597 1HB GLN 75 2HB GLN 75 14.672 0.369 -11.048 598 2HB GLN 75 3HB GLN 75 15.931 -0.542 -10.237 599 1HG GLN 75 2HG GLN 75 16.436 -1.364 -12.303 600 2HG GLN 75 3HG GLN 75 15.032 -2.392 -12.097 601 1HE2 GLN 75 1HE2 GLN 75 13.035 -0.400 -12.181 602 2HE2 GLN 75 2HE2 GLN 75 12.912 0.215 -13.795
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