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*** ***elNémo ID: 2404140041004088628Job options:ID = 2404140041004088628 JOBID = USERID = unknown PRIVAT = 0 NMODES = 10 DQMIN = -100 DQMAX = 100 DQSTEP = 20 DOGRAPHS = on DOPROJMODS = 0 DORMSD = 0 NRBL = -1 CUTOFF = 8 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 VAL A 97 -6.411 8.590 -2.131 1.00 29.58 C ATOM 2 CA PRO A 98 -4.811 12.061 -2.300 1.00 26.91 C ATOM 3 CA SER A 99 -7.106 14.802 -3.588 1.00 29.22 C ATOM 4 CA GLN A 100 -6.727 16.128 -7.121 1.00 28.04 C ATOM 5 CA LYS A 101 -8.930 19.164 -6.451 1.00 19.30 C ATOM 6 CA THR A 102 -7.596 22.423 -7.897 1.00 15.49 C ATOM 7 CA TYR A 103 -6.781 24.803 -5.045 1.00 13.47 C ATOM 8 CA GLN A 104 -5.184 28.041 -6.178 1.00 16.71 C ATOM 9 CA GLY A 105 -4.851 29.074 -2.534 1.00 17.85 C ATOM 10 CA ASER A 106 -3.610 32.349 -1.074 0.50 18.70 C ATOM 11 CA BSER A 106 -3.637 32.359 -1.098 0.50 20.00 C ATOM 12 CA TYR A 107 -0.671 32.603 -3.489 1.00 18.12 C ATOM 13 CA GLY A 108 -2.659 32.180 -6.732 1.00 18.81 C ATOM 14 CA PHE A 109 -0.874 28.972 -7.685 1.00 15.80 C ATOM 15 CA AARG A 110 -1.292 27.563 -11.162 0.50 19.75 C ATOM 16 CA BARG A 110 -1.291 27.757 -11.281 0.50 13.92 C ATOM 17 CA LEU A 111 0.586 25.506 -13.717 1.00 13.16 C ATOM 18 CA GLY A 112 1.860 26.310 -17.165 1.00 14.78 C ATOM 19 CA PHE A 113 3.310 24.229 -19.953 1.00 17.38 C ATOM 20 CA LEU A 114 5.455 25.043 -22.994 1.00 27.17 C ATOM 21 CA VAL A 122 8.211 15.790 -30.004 1.00 30.48 C ATOM 22 CA THR A 123 9.460 14.641 -26.589 1.00 24.75 C ATOM 23 CA ACYS A 124 6.810 16.468 -24.510 0.70 18.76 C ATOM 24 CA BCYS A 124 6.802 16.457 -24.525 0.30 22.61 C ATOM 25 CA THR A 125 3.596 18.207 -25.622 1.00 17.63 C ATOM 26 CA TYR A 126 0.662 19.578 -23.642 1.00 15.48 C ATOM 27 CA SER A 127 -2.997 19.814 -24.653 1.00 16.64 C ATOM 28 CA PRO A 128 -4.856 22.617 -22.866 1.00 18.89 C ATOM 29 CA ALA A 129 -8.171 21.249 -24.227 1.00 21.63 C ATOM 30 CA LEU A 130 -7.542 17.878 -22.558 1.00 17.21 C ATOM 31 CA ASN A 131 -5.457 19.267 -19.643 1.00 15.88 C ATOM 32 CA LYS A 132 -3.103 16.489 -20.643 1.00 12.96 C ATOM 33 CA AMET A 133 0.629 16.101 -21.100 0.70 13.21 C ATOM 34 CA BMET A 133 0.631 16.106 -21.097 0.30 14.09 C ATOM 35 CA PHE A 134 1.939 13.621 -23.672 1.00 14.44 C ATOM 36 CA ACYS A 135 5.599 12.715 -23.185 0.80 15.14 C ATOM 37 CA BCYS A 135 5.599 12.717 -23.124 0.20 16.39 C ATOM 38 CA GLN A 136 8.261 10.110 -23.914 1.00 16.16 C ATOM 39 CA LEU A 137 9.757 7.879 -21.223 1.00 16.91 C ATOM 40 CA ALA A 138 12.725 9.488 -19.401 1.00 18.69 C ATOM 41 CA LYS A 139 12.565 12.699 -21.452 1.00 16.51 C ATOM 42 CA THR A 140 12.445 16.223 -20.053 1.00 17.15 C ATOM 43 CA ACYS A 141 8.929 17.359 -19.134 0.70 14.70 C ATOM 44 CA BCYS A 141 8.921 17.326 -19.130 0.30 15.74 C ATOM 45 CA PRO A 142 8.930 21.041 -18.235 1.00 15.20 C ATOM 46 CA VAL A 143 6.212 22.062 -15.811 1.00 12.68 C ATOM 47 CA GLN A 144 5.887 25.754 -14.939 1.00 13.16 C ATOM 48 CA LEU A 145 4.836 27.068 -11.565 1.00 12.67 C ATOM 49 CA TRP A 146 3.091 30.431 -11.590 1.00 14.97 C ATOM 50 CA VAL A 147 2.219 32.364 -8.426 1.00 16.21 C ATOM 51 CA ASP A 148 0.670 35.800 -7.817 1.00 20.85 C ATOM 52 CA ASER A 149 2.638 36.328 -4.588 0.50 25.24 C ATOM 53 CA BSER A 149 2.592 36.312 -4.541 0.50 25.32 C ATOM 54 CA THR A 150 5.817 34.914 -3.029 1.00 28.19 C ATOM 55 CA PRO A 151 5.261 31.693 -1.015 1.00 24.52 C ATOM 56 CA PRO A 152 6.733 31.579 2.532 1.00 24.39 C ATOM 57 CA PRO A 153 10.340 30.555 3.293 1.00 24.02 C ATOM 58 CA GLY A 154 10.923 26.835 2.947 1.00 20.30 C ATOM 59 CA THR A 155 7.986 26.228 0.606 1.00 15.13 C ATOM 60 CA ARG A 156 8.206 22.896 -1.193 1.00 14.33 C ATOM 61 CA VAL A 157 6.795 21.475 -4.416 1.00 11.15 C ATOM 62 CA ARG A 158 5.523 17.876 -4.461 1.00 10.93 C ATOM 63 CA ALA A 159 4.598 15.744 -7.470 1.00 10.85 C ATOM 64 CA AMET A 160 2.576 12.543 -7.151 0.50 12.73 C ATOM 65 CA BMET A 160 2.602 12.523 -7.178 0.50 10.50 C ATOM 66 CA ALA A 161 0.762 10.318 -9.648 1.00 11.30 C ATOM 67 CA ILE A 162 -2.699 8.798 -9.116 1.00 12.78 C ATOM 68 CA TYR A 163 -5.026 6.898 -11.418 1.00 12.86 C ATOM 69 CA LYS A 164 -7.638 9.136 -13.044 1.00 17.26 C ATOM 70 CA GLN A 165 -10.464 6.581 -12.924 1.00 18.60 C ATOM 71 CA ASER A 166 -12.284 6.387 -9.590 0.50 20.94 C ATOM 72 CA BSER A 166 -12.282 6.387 -9.590 0.50 21.82 C ATOM 73 CA AGLN A 167 -12.383 2.582 -9.811 0.50 19.20 C ATOM 74 CA BGLN A 167 -12.382 2.581 -9.821 0.50 18.86 C ATOM 75 CA HIS A 168 -8.558 2.404 -9.774 1.00 16.15 C ATOM 76 CA MET A 169 -7.790 5.367 -7.540 1.00 17.35 C ATOM 77 CA THR A 170 -6.872 3.321 -4.469 1.00 19.89 C ATOM 78 CA GLU A 171 -4.136 1.598 -6.494 1.00 16.86 C ATOM 79 CA VAL A 172 -0.661 3.066 -6.030 1.00 13.92 C ATOM 80 CA VAL A 173 0.966 4.224 -9.262 1.00 13.02 C ATOM 81 CA ARG A 174 4.397 2.618 -9.542 1.00 15.82 C ATOM 82 CA AARG A 175 6.776 1.338 -12.189 0.60 16.04 C ATOM 83 CA BARG A 175 6.767 1.339 -12.194 0.40 16.21 C ATOM 84 CA CYS A 176 6.101 -2.014 -13.843 1.00 16.55 C ATOM 85 CA PRO A 177 8.169 -5.060 -12.809 1.00 21.19 C ATOM 86 CA HIS A 178 10.433 -4.796 -15.874 1.00 20.14 C ATOM 87 CA HIS A 179 11.304 -1.128 -15.354 1.00 20.36 C ATOM 88 CA GLU A 180 11.638 -1.467 -11.566 1.00 21.32 C ATOM 89 CA ARG A 181 14.340 -4.092 -12.220 1.00 27.19 C ATOM 90 CA LEU A 188 18.913 9.170 -6.117 1.00 24.27 C ATOM 91 CA ALA A 189 15.522 7.823 -7.177 1.00 21.87 C ATOM 92 CA PRO A 190 14.194 4.570 -5.748 1.00 21.25 C ATOM 93 CA PRO A 191 13.655 2.152 -8.665 1.00 20.28 C ATOM 94 CA GLN A 192 9.899 1.898 -8.002 1.00 17.45 C ATOM 95 CA HIS A 193 9.181 5.610 -8.477 1.00 13.90 C ATOM 96 CA LEU A 194 7.456 6.666 -11.692 1.00 12.50 C ATOM 97 CA ILE A 195 8.267 10.387 -11.420 1.00 11.72 C ATOM 98 CA ARG A 196 11.793 11.769 -11.161 1.00 12.51 C ATOM 99 CA VAL A 197 13.167 15.304 -11.209 1.00 12.93 C ATOM 100 CA GLU A 198 16.242 16.212 -13.223 1.00 17.10 C ATOM 101 CA GLY A 199 18.423 19.328 -12.935 1.00 18.44 C ATOM 102 CA ASN A 200 17.828 19.842 -9.214 1.00 16.13 C ATOM 103 CA LEU A 201 20.296 19.317 -6.362 1.00 15.56 C ATOM 104 CA ARG A 202 17.689 19.072 -3.597 1.00 15.43 C ATOM 105 CA VAL A 203 15.359 16.301 -4.733 1.00 14.28 C ATOM 106 CA GLU A 204 13.612 14.185 -2.105 1.00 14.45 C ATOM 107 CA TYR A 205 12.066 10.847 -2.968 1.00 14.41 C ATOM 108 CA LEU A 206 9.347 10.036 -0.491 1.00 15.47 C ATOM 109 CA ASP A 207 7.329 6.930 0.285 1.00 19.61 C ATOM 110 CA ASP A 208 4.196 7.543 2.375 1.00 23.20 C ATOM 111 CA ARG A 209 4.269 5.328 5.488 1.00 27.51 C ATOM 112 CA ASN A 210 0.489 4.708 5.465 1.00 32.92 C ATOM 113 CA THR A 211 -0.550 4.822 1.789 1.00 24.88 C ATOM 114 CA PHE A 212 2.762 3.639 0.256 1.00 17.13 C ATOM 115 CA ARG A 213 2.338 6.306 -2.404 1.00 14.67 C ATOM 116 CA HIS A 214 5.443 7.767 -3.978 1.00 12.92 C ATOM 117 CA SER A 215 6.199 11.404 -4.431 1.00 12.87 C ATOM 118 CA VAL A 216 9.084 13.604 -5.424 1.00 12.07 C ATOM 119 CA VAL A 217 9.719 16.944 -3.753 1.00 11.42 C ATOM 120 CA VAL A 218 11.952 19.924 -4.508 1.00 12.49 C ATOM 121 CA PRO A 219 12.225 23.305 -2.813 1.00 13.12 C ATOM 122 CA TYR A 220 10.161 26.063 -4.351 1.00 13.76 C ATOM 123 CA GLU A 221 12.453 28.601 -6.017 1.00 15.83 C ATOM 124 CA APRO A 222 11.278 31.916 -7.448 0.50 15.12 C ATOM 125 CA BPRO A 222 11.246 31.939 -7.423 0.50 20.89 C ATOM 126 CA PRO A 223 11.663 32.525 -11.197 1.00 17.62 C ATOM 127 CA GLU A 224 15.209 33.137 -12.394 1.00 18.58 C ATOM 128 CA VAL A 225 16.076 36.689 -13.404 1.00 17.51 C ATOM 129 CA GLY A 226 14.596 37.108 -16.917 1.00 21.52 C ATOM 130 CA SER A 227 11.703 34.695 -16.276 1.00 17.60 C ATOM 131 CA ASP A 228 8.075 34.967 -15.077 1.00 17.80 C ATOM 132 CA CYS A 229 7.704 31.406 -13.803 1.00 15.46 C ATOM 133 CA THR A 230 9.575 28.577 -12.159 1.00 14.21 C ATOM 134 CA THR A 231 10.240 25.489 -14.242 1.00 14.46 C ATOM 135 CA ILE A 232 10.709 21.976 -12.910 1.00 13.33 C ATOM 136 CA HIS A 233 11.933 19.235 -15.239 1.00 13.85 C ATOM 137 CA TYR A 234 10.079 16.007 -14.533 1.00 12.34 C ATOM 138 CA ASN A 235 10.889 12.612 -16.020 1.00 13.00 C ATOM 139 CA TYR A 236 8.377 9.740 -16.230 1.00 13.00 C ATOM 140 CA MET A 237 10.092 6.385 -16.017 1.00 15.20 C ATOM 141 CA ACYS A 238 7.384 3.986 -17.215 0.50 17.98 C ATOM 142 CA BCYS A 238 7.433 3.987 -17.301 0.50 14.12 C ATOM 143 CA AASN A 239 5.096 4.070 -20.280 0.50 17.17 C ATOM 144 CA BASN A 239 5.096 4.060 -20.286 0.50 17.56 C ATOM 145 CA SER A 240 1.324 4.335 -19.824 1.00 16.37 C ATOM 146 CA SER A 241 1.088 1.061 -21.750 1.00 19.83 C ATOM 147 CA CYS A 242 3.389 -0.863 -19.399 1.00 19.30 C ATOM 148 CA MET A 243 1.487 -3.998 -18.403 1.00 21.53 C ATOM 149 CA GLY A 244 1.790 -4.971 -14.739 1.00 26.23 C ATOM 150 CA GLY A 245 1.819 -1.232 -14.081 1.00 25.39 C ATOM 151 CA MET A 246 -0.400 1.503 -15.489 1.00 20.40 C ATOM 152 CA ASN A 247 -1.951 -0.983 -17.943 1.00 21.15 C ATOM 153 CA ARG A 248 -2.937 1.756 -20.455 1.00 22.84 C ATOM 154 CA ARG A 249 -5.046 3.429 -17.733 1.00 0.00 C ATOM 155 CA APRO A 250 -4.822 7.238 -17.509 0.50 17.99 C ATOM 156 CA BPRO A 250 -4.794 7.226 -17.510 0.50 17.79 C ATOM 157 CA ILE A 251 -2.939 8.864 -14.664 1.00 13.11 C ATOM 158 CA LEU A 252 -2.970 12.321 -13.167 1.00 13.25 C ATOM 159 CA THR A 253 0.048 14.149 -11.856 1.00 10.67 C ATOM 160 CA AILE A 254 -0.825 16.211 -8.788 0.50 10.82 C ATOM 161 CA BILE A 254 -0.827 16.213 -8.790 0.50 11.21 C ATOM 162 CA ILE A 255 1.447 19.175 -8.056 1.00 10.71 C ATOM 163 CA ATHR A 256 1.199 20.518 -4.512 0.50 11.72 C ATOM 164 CA BTHR A 256 1.184 20.605 -4.571 0.50 12.80 C ATOM 165 CA LEU A 257 2.726 23.680 -3.093 1.00 12.08 C ATOM 166 CA GLU A 258 3.409 23.021 0.591 1.00 13.77 C ATOM 167 CA ASP A 259 4.843 25.055 3.444 1.00 16.74 C ATOM 168 CA SER A 260 7.916 23.943 5.421 1.00 21.39 C ATOM 169 CA ASER A 261 5.672 22.012 7.847 0.70 22.47 C ATOM 170 CA BSER A 261 5.698 21.994 7.843 0.30 23.52 C ATOM 171 CA GLY A 262 3.956 20.165 4.978 1.00 20.37 C ATOM 172 CA ASN A 263 0.710 22.144 5.019 1.00 16.26 C ATOM 173 CA LEU A 264 -1.167 22.607 1.781 1.00 14.00 C ATOM 174 CA LEU A 265 -0.710 25.990 0.100 1.00 13.69 C ATOM 175 CA GLY A 266 -1.944 25.155 -3.393 1.00 12.81 C ATOM 176 CA AARG A 267 -2.773 22.289 -5.731 0.50 11.43 C ATOM 177 CA BARG A 267 -2.723 22.268 -5.731 0.50 12.75 C ATOM 178 CA ASN A 268 -3.069 21.701 -9.459 1.00 11.33 C ATOM 179 CA SER A 269 -3.114 18.597 -11.634 1.00 13.31 C ATOM 180 CA PHE A 270 -2.837 17.401 -15.191 1.00 12.07 C ATOM 181 CA GLU A 271 -3.410 14.107 -16.937 1.00 12.29 C ATOM 182 CA AVAL A 272 -0.306 12.382 -18.353 0.50 11.69 C ATOM 183 CA BVAL A 272 -0.351 12.429 -18.419 0.50 13.48 C ATOM 184 CA ARG A 273 0.240 9.837 -21.108 1.00 13.76 C ATOM 185 CA VAL A 274 3.757 8.498 -21.370 1.00 16.12 C ATOM 186 CA CYS A 275 4.079 7.203 -24.908 1.00 18.83 C ATOM 187 CA ALA A 276 6.433 6.693 -27.852 1.00 22.16 C ATOM 188 CA ACYS A 277 4.822 9.300 -30.109 0.50 19.76 C ATOM 189 CA BCYS A 277 4.831 9.321 -30.094 0.50 21.92 C ATOM 190 CA PRO A 278 3.423 12.208 -27.993 1.00 19.04 C ATOM 191 CA GLY A 279 2.523 14.444 -30.950 1.00 21.74 C ATOM 192 CA ARG A 280 0.625 11.682 -32.704 1.00 22.12 C ATOM 193 CA ASP A 281 -1.227 10.547 -29.590 1.00 18.76 C ATOM 194 CA AARG A 282 -2.182 14.122 -28.685 0.50 16.62 C ATOM 195 CA BARG A 282 -2.180 14.126 -28.684 0.50 19.89 C ATOM 196 CA ARG A 283 -3.607 14.600 -32.174 1.00 23.93 C ATOM 197 CA THR A 284 -5.544 11.315 -31.925 1.00 25.20 C ATOM 198 CA GLU A 285 -6.957 12.062 -28.451 1.00 23.16 C ATOM 199 CA GLU A 286 -7.874 15.597 -29.565 1.00 25.35 C ATOM 200 CA GLU A 287 -9.616 14.270 -32.692 1.00 34.99 C ATOM 201 CA ASN A 288 -11.555 11.828 -30.479 1.00 39.17 C END If you find results from this site helpful for your research, please cite one of our papers:
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