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*** ***elNémo ID: 2404260252012842258Job options:ID = 2404260252012842258 JOBID = USERID = unknown PRIVAT = 0 NMODES = 10 DQMIN = -100 DQMAX = 100 DQSTEP = 20 DOGRAPHS = on DOPROJMODS = 0 DORMSD = 0 NRBL = -1 CUTOFF = 10 CAONLY = 0 Input data for this run:CRYST1 0.000 0.000 0.000 90.00 90.00 90.00 P 1 1 ATOM 1 CA SER A 96 113.448 74.730 -36.600 1.00 29.47 C ATOM 2 CA VAL A 97 111.763 77.601 -34.796 1.00 21.09 C ATOM 3 CA PRO A 98 109.115 79.948 -36.207 1.00 21.30 C ATOM 4 CA SER A 99 110.138 83.600 -36.298 1.00 19.35 C ATOM 5 CA GLN A 100 108.391 85.866 -33.789 1.00 17.16 C ATOM 6 CA LYS A 101 109.532 89.146 -35.331 1.00 18.29 C ATOM 7 CA THR A 102 106.784 91.766 -35.510 1.00 14.74 C ATOM 8 CA TYR A 103 106.251 92.742 -39.149 1.00 15.54 C ATOM 9 CA GLN A 104 103.374 94.963 -40.252 1.00 13.94 C ATOM 10 CA GLY A 105 104.126 94.423 -43.938 1.00 15.46 C ATOM 11 CA SER A 106 102.568 96.217 -46.909 1.00 18.11 C ATOM 12 CA TYR A 107 99.055 96.076 -45.462 1.00 14.04 C ATOM 13 CA GLY A 108 99.907 97.508 -42.025 1.00 13.18 C ATOM 14 CA PHE A 109 98.896 94.350 -40.179 1.00 9.18 C ATOM 15 CA ARG A 110 98.747 94.360 -36.349 1.00 10.16 C ATOM 16 CA LEU A 111 96.636 92.866 -33.568 1.00 9.68 C ATOM 17 CA GLY A 112 94.235 94.553 -31.176 1.00 9.36 C ATOM 18 CA PHE A 113 92.815 93.470 -27.806 1.00 10.12 C ATOM 19 CA LEU A 114 89.703 94.495 -25.850 1.00 14.22 C ATOM 20 CA HIS A 115 89.972 96.246 -22.476 1.00 15.43 C ATOM 21 CA SER A 116 88.366 93.695 -20.182 1.00 18.40 C ATOM 22 CA GLY A 117 89.786 94.733 -16.815 1.00 18.62 C ATOM 23 CA THR A 118 91.199 92.617 -13.995 1.00 18.30 C ATOM 24 CA ALA A 119 88.164 91.745 -11.861 1.00 23.58 C ATOM 25 CA LYS A 120 88.539 88.291 -10.279 1.00 29.22 C ATOM 26 CA SER A 121 85.703 87.025 -12.475 1.00 26.90 C ATOM 27 CA VAL A 122 87.205 88.068 -15.819 1.00 19.57 C ATOM 28 CA THR A 123 87.654 85.189 -18.304 1.00 10.98 C ATOM 29 CA CYS A 124 90.096 86.819 -20.721 1.00 12.60 C ATOM 30 CA THR A 125 92.231 89.908 -20.213 1.00 9.61 C ATOM 31 CA TYR A 126 95.148 91.477 -22.055 1.00 7.87 C ATOM 32 CA SER A 127 98.120 93.276 -20.533 1.00 10.26 C ATOM 33 CA PRO A 128 99.710 95.810 -22.891 1.00 11.34 C ATOM 34 CA ALA A 129 102.568 96.332 -20.403 1.00 13.45 C ATOM 35 CA LEU A 130 103.485 92.640 -20.535 1.00 12.09 C ATOM 36 CA ASN A 131 102.185 92.018 -24.125 1.00 8.60 C ATOM 37 CA LYS A 132 100.450 89.067 -22.490 1.00 7.96 C ATOM 38 CA MET A 133 96.987 87.549 -22.695 1.00 0.00 C ATOM 39 CA PHE A 134 95.603 85.807 -19.591 1.00 6.97 C ATOM 40 CA CYS A 135 92.617 83.540 -20.098 1.00 11.47 C ATOM 41 CA GLN A 136 90.650 80.681 -18.599 1.00 12.10 C ATOM 42 CA LEU A 137 90.586 77.209 -20.137 1.00 9.52 C ATOM 43 CA ALA A 138 88.537 77.008 -23.329 1.00 12.08 C ATOM 44 CA LYS A 139 87.024 80.476 -22.974 1.00 12.99 C ATOM 45 CA THR A 140 86.635 82.988 -25.769 1.00 10.01 C ATOM 46 CA CYS A 141 89.696 85.111 -26.552 1.00 8.44 C ATOM 47 CA PRO A 142 88.737 87.951 -28.899 1.00 10.32 C ATOM 48 CA VAL A 143 91.695 89.049 -30.996 1.00 9.10 C ATOM 49 CA GLN A 144 91.223 91.983 -33.360 1.00 10.61 C ATOM 50 CA LEU A 145 92.950 92.116 -36.737 1.00 11.43 C ATOM 51 CA TRP A 146 93.794 95.617 -37.988 1.00 11.98 C ATOM 52 CA VAL A 147 95.042 96.567 -41.443 1.00 13.56 C ATOM 53 CA ASP A 148 95.664 99.907 -43.168 1.00 15.80 C ATOM 54 CA SER A 149 94.577 98.473 -46.494 1.00 23.22 C ATOM 55 CA THR A 150 92.604 95.451 -47.634 1.00 17.47 C ATOM 56 CA PRO A 151 94.799 92.473 -48.492 1.00 15.37 C ATOM 57 CA PRO A 152 94.123 90.410 -51.653 1.00 14.68 C ATOM 58 CA PRO A 153 91.349 87.798 -51.939 1.00 16.85 C ATOM 59 CA GLY A 154 92.776 84.533 -50.623 1.00 15.96 C ATOM 60 CA THR A 155 94.783 86.106 -47.795 1.00 12.04 C ATOM 61 CA ARG A 156 94.615 84.057 -44.591 1.00 10.58 C ATOM 62 CA VAL A 157 95.414 84.461 -40.883 1.00 9.61 C ATOM 63 CA ARG A 158 97.270 81.692 -39.037 1.00 9.16 C ATOM 64 CA ALA A 159 97.792 81.183 -35.287 1.00 7.88 C ATOM 65 CA MET A 160 100.542 78.948 -33.854 1.00 6.86 C ATOM 66 CA ALA A 161 101.944 78.531 -30.348 1.00 9.36 C ATOM 67 CA ILE A 162 105.610 78.171 -29.459 1.00 7.66 C ATOM 68 CA TYR A 163 107.370 78.010 -26.107 1.00 11.43 C ATOM 69 CA LYS A 164 108.689 81.431 -25.046 1.00 11.65 C ATOM 70 CA GLN A 165 111.883 80.138 -23.379 1.00 15.57 C ATOM 71 CA ASER A 166 114.639 79.505 -25.926 0.50 16.32 C ATOM 72 CA BSER A 166 114.653 79.512 -25.917 0.50 15.81 C ATOM 73 CA GLN A 167 115.624 76.214 -24.296 1.00 16.15 C ATOM 74 CA HIS A 168 112.130 74.891 -25.099 1.00 14.93 C ATOM 75 CA MET A 169 111.495 76.554 -28.456 1.00 15.15 C ATOM 76 CA THR A 170 112.085 73.483 -30.599 1.00 15.74 C ATOM 77 CA GLU A 171 109.474 71.445 -28.699 1.00 13.13 C ATOM 78 CA VAL A 172 106.053 71.363 -30.332 1.00 10.24 C ATOM 79 CA VAL A 173 103.388 73.000 -28.145 1.00 10.06 C ATOM 80 CA ARG A 174 100.504 70.516 -27.841 1.00 9.81 C ATOM 81 CA ARG A 175 97.729 69.562 -25.456 1.00 7.23 C ATOM 82 CA CYS A 176 98.690 67.410 -22.457 1.00 9.39 C ATOM 83 CA PRO A 177 98.196 63.638 -22.127 1.00 11.82 C ATOM 84 CA HIS A 178 94.913 64.223 -20.357 1.00 12.46 C ATOM 85 CA HIS A 179 93.303 66.885 -22.506 1.00 11.34 C ATOM 86 CA GLU A 180 94.221 65.313 -25.849 1.00 8.95 C ATOM 87 CA ARG A 181 92.040 62.360 -24.740 1.00 15.09 C ATOM 88 CA ACYS A 182 89.047 64.090 -23.185 0.70 21.05 C ATOM 89 CA BCYS A 182 89.067 64.262 -23.247 0.30 21.85 C ATOM 90 CA SER A 183 86.850 63.872 -26.319 1.00 27.44 C ATOM 91 CA ASP A 184 85.994 67.578 -26.349 1.00 22.52 C ATOM 92 CA SER A 185 86.559 68.198 -30.057 1.00 29.31 C ATOM 93 CA ASP A 186 84.116 70.439 -31.907 1.00 31.96 C ATOM 94 CA GLY A 187 84.302 68.091 -34.880 1.00 31.99 C ATOM 95 CA LEU A 188 86.931 70.131 -36.728 1.00 23.82 C ATOM 96 CA ALA A 189 89.874 70.702 -34.402 1.00 14.74 C ATOM 97 CA PRO A 190 92.156 67.678 -33.892 1.00 13.09 C ATOM 98 CA PRO A 191 92.129 66.818 -30.158 1.00 13.16 C ATOM 99 CA GLN A 192 95.891 67.436 -29.892 1.00 11.20 C ATOM 100 CA HIS A 193 95.684 71.109 -30.892 1.00 9.69 C ATOM 101 CA LEU A 194 96.032 73.737 -28.211 1.00 6.66 C ATOM 102 CA ILE A 195 94.568 76.606 -30.212 1.00 7.58 C ATOM 103 CA ARG A 196 91.101 76.492 -31.733 1.00 10.05 C ATOM 104 CA VAL A 197 89.046 79.055 -33.616 1.00 9.36 C ATOM 105 CA GLU A 198 85.399 79.451 -32.531 1.00 13.93 C ATOM 106 CA GLY A 199 82.399 79.884 -34.793 1.00 20.46 C ATOM 107 CA ASN A 200 84.096 79.659 -38.171 1.00 19.00 C ATOM 108 CA LEU A 201 83.329 76.668 -40.373 1.00 22.46 C ATOM 109 CA ARG A 202 86.150 77.703 -42.721 1.00 19.51 C ATOM 110 CA VAL A 203 88.851 77.197 -40.128 1.00 0.00 C ATOM 111 CA AGLU A 204 91.537 74.758 -41.166 0.60 14.47 C ATOM 112 CA BGLU A 204 91.568 74.780 -41.195 0.40 14.15 C ATOM 113 CA TYR A 205 93.823 72.848 -38.814 1.00 11.34 C ATOM 114 CA LEU A 206 97.300 71.974 -39.950 1.00 14.30 C ATOM 115 CA ASP A 207 99.802 69.441 -38.663 1.00 17.24 C ATOM 116 CA ASP A 208 103.004 70.404 -40.449 1.00 19.50 C ATOM 117 CA ARG A 209 104.437 67.347 -42.196 1.00 28.23 C ATOM 118 CA ASN A 210 107.961 68.700 -41.728 1.00 29.14 C ATOM 119 CA THR A 211 108.041 70.531 -38.382 1.00 22.15 C ATOM 120 CA PHE A 212 105.145 68.638 -36.783 1.00 15.71 C ATOM 121 CA ARG A 213 103.864 71.935 -35.424 1.00 13.97 C ATOM 122 CA HIS A 214 100.140 72.650 -35.110 1.00 10.09 C ATOM 123 CA SER A 215 98.305 75.720 -36.364 1.00 8.84 C ATOM 124 CA VAL A 216 94.831 76.953 -37.229 1.00 7.90 C ATOM 125 CA VAL A 217 94.210 79.217 -40.185 1.00 8.86 C ATOM 126 CA VAL A 218 91.174 81.128 -41.446 1.00 11.39 C ATOM 127 CA PRO A 219 90.403 83.375 -44.411 1.00 14.95 C ATOM 128 CA TYR A 220 91.095 87.038 -43.733 1.00 0.00 C ATOM 129 CA GLU A 221 87.664 88.640 -43.435 1.00 30.83 C ATOM 130 CA PRO A 222 86.979 92.322 -44.128 1.00 28.99 C ATOM 131 CA PRO A 223 85.215 94.317 -41.393 1.00 29.34 C ATOM 132 CA GLU A 224 81.412 94.357 -41.482 1.00 29.50 C ATOM 133 CA VAL A 225 79.803 97.624 -42.552 1.00 29.87 C ATOM 134 CA GLY A 226 80.232 100.028 -39.652 1.00 33.36 C ATOM 135 CA SER A 227 83.222 98.162 -38.238 1.00 32.16 C ATOM 136 CA ASP A 228 86.863 99.219 -38.494 1.00 23.80 C ATOM 137 CA CYS A 229 88.407 95.816 -37.846 1.00 18.41 C ATOM 138 CA ATHR A 230 87.598 92.134 -37.812 0.70 15.51 C ATOM 139 CA BTHR A 230 87.652 92.103 -37.852 0.30 16.61 C ATOM 140 CA THR A 231 87.891 89.760 -34.864 1.00 14.23 C ATOM 141 CA ILE A 232 88.900 86.110 -34.566 1.00 11.40 C ATOM 142 CA HIS A 233 87.734 84.244 -31.467 1.00 10.09 C ATOM 143 CA TYR A 234 90.353 81.815 -30.181 1.00 9.37 C ATOM 144 CA ASN A 235 90.162 79.149 -27.478 1.00 11.04 C ATOM 145 CA TYR A 236 93.176 77.706 -25.617 1.00 9.23 C ATOM 146 CA MET A 237 92.525 74.087 -24.679 1.00 10.55 C ATOM 147 CA CYS A 238 95.029 73.371 -21.912 1.00 10.87 C ATOM 148 CA ASN A 239 96.194 75.205 -18.810 1.00 0.00 C ATOM 149 CA SER A 240 99.722 76.584 -18.788 1.00 10.64 C ATOM 150 CA SER A 241 100.202 74.305 -15.757 1.00 11.80 C ATOM 151 CA CYS A 242 99.051 71.059 -17.393 1.00 12.32 C ATOM 152 CA MET A 243 101.447 68.269 -16.489 1.00 15.25 C ATOM 153 CA GLY A 244 103.021 66.476 -19.443 1.00 16.27 C ATOM 154 CA GLY A 245 101.957 69.383 -21.639 1.00 14.73 C ATOM 155 CA MET A 246 102.975 73.019 -21.255 1.00 11.80 C ATOM 156 CA ASN A 247 103.939 72.112 -17.667 1.00 15.72 C ATOM 157 CA ARG A 248 104.135 75.703 -16.354 1.00 15.16 C ATOM 158 CA ARG A 249 106.233 76.901 -19.317 1.00 11.60 C ATOM 159 CA PRO A 250 105.077 80.180 -20.874 1.00 12.33 C ATOM 160 CA ILE A 251 104.079 80.190 -24.520 1.00 7.90 C ATOM 161 CA LEU A 252 103.762 82.779 -27.257 1.00 8.25 C ATOM 162 CA THR A 253 101.023 82.821 -29.847 1.00 6.79 C ATOM 163 CA ILE A 254 102.298 83.964 -33.248 1.00 8.37 C ATOM 164 CA ILE A 255 99.674 85.347 -35.642 1.00 8.99 C ATOM 165 CA THR A 256 100.726 85.554 -39.264 1.00 10.85 C ATOM 166 CA LEU A 257 98.987 87.206 -42.210 1.00 10.92 C ATOM 167 CA GLU A 258 99.806 85.059 -45.244 1.00 14.56 C ATOM 168 CA ASP A 259 99.076 84.931 -48.937 1.00 11.63 C ATOM 169 CA SER A 260 97.257 82.065 -50.652 1.00 13.66 C ATOM 170 CA SER A 261 100.536 80.081 -50.920 1.00 16.82 C ATOM 171 CA GLY A 262 101.373 80.589 -47.256 1.00 14.17 C ATOM 172 CA ASN A 263 104.029 83.255 -47.851 1.00 16.24 C ATOM 173 CA LEU A 264 104.474 85.863 -45.097 1.00 15.01 C ATOM 174 CA LEU A 265 102.624 89.198 -45.412 1.00 11.93 C ATOM 175 CA GLY A 266 102.607 90.269 -41.777 1.00 10.51 C ATOM 176 CA ARG A 267 103.291 89.008 -38.262 1.00 9.86 C ATOM 177 CA ASN A 268 102.450 89.805 -34.655 1.00 0.00 C ATOM 178 CA SER A 269 102.623 87.915 -31.375 1.00 7.01 C ATOM 179 CA PHE A 270 101.785 87.892 -27.683 1.00 7.24 C ATOM 180 CA GLU A 271 102.507 85.793 -24.619 1.00 7.41 C ATOM 181 CA VAL A 272 99.652 83.671 -23.223 1.00 8.75 C ATOM 182 CA ARG A 273 98.978 82.296 -19.757 1.00 8.29 C ATOM 183 CA VAL A 274 95.969 79.950 -19.504 1.00 9.56 C ATOM 184 CA CYS A 275 94.967 79.925 -15.850 1.00 12.31 C ATOM 185 CA ALA A 276 92.152 79.712 -13.347 1.00 19.46 C ATOM 186 CA ACYS A 277 92.066 83.414 -12.398 0.60 17.74 C ATOM 187 CA BCYS A 277 92.073 83.414 -12.386 0.40 18.70 C ATOM 188 CA PRO A 278 93.296 85.663 -15.254 1.00 15.16 C ATOM 189 CA GLY A 279 92.329 88.845 -13.432 1.00 17.16 C ATOM 190 CA ARG A 280 94.403 88.137 -10.342 1.00 17.48 C ATOM 191 CA ASP A 281 97.335 86.757 -12.286 1.00 16.27 C ATOM 192 CA ARG A 282 97.457 89.799 -14.581 1.00 12.65 C ATOM 193 CA ARG A 283 97.347 92.121 -11.543 1.00 19.71 C ATOM 194 CA THR A 284 100.103 90.109 -9.843 1.00 19.26 C ATOM 195 CA GLU A 285 102.390 90.065 -12.868 1.00 19.63 C ATOM 196 CA GLU A 286 101.917 93.763 -13.597 1.00 18.48 C ATOM 197 CA GLU A 287 102.717 94.547 -9.954 1.00 29.70 C ATOM 198 CA ASN A 288 105.847 92.408 -10.089 1.00 31.93 C ATOM 199 CA LEU A 289 106.872 94.341 -13.215 1.00 31.23 C ATOM 200 CA ARG A 290 106.213 97.636 -11.419 1.00 37.35 C ATOM 201 ZN ZN A 313 95.871 69.973 -20.438 1.00 18.47 ZN END If you find results from this site helpful for your research, please cite one of our papers:
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