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*** caopen ***elNémo ID: 23040514022989441Job options:ID = 23040514022989441 JOBID = caopen USERID = unknown PRIVAT = 0 NMODES = 5 DQMIN = -100 DQMAX = 100 DQSTEP = 20 DOGRAPHS = on DOPROJMODS = 0 DORMSD = 0 NRBL = -1 CUTOFF = 10 CAONLY = 0 Input data for this run:HEADER caopen CRYST1 36.250 78.520 102.180 90.00 90.00 90.00 P 1 1 ATOM 1 CA ALA A 1 50.955 44.766 8.768 1.00 53.06 C ATOM 2 CA LEU A 2 47.580 46.528 8.769 1.00 49.38 C ATOM 3 CA PRO A 3 44.455 44.250 8.616 1.00 45.78 C ATOM 4 CA GLN A 4 43.029 44.060 5.087 1.00 46.45 C ATOM 5 CA THR A 5 39.653 44.771 6.594 1.00 40.11 C ATOM 6 CA VAL A 6 39.393 46.107 10.193 1.00 29.27 C ATOM 7 CA ARG A 7 36.323 44.651 12.059 1.00 22.99 C ATOM 8 CA ILE A 8 35.204 47.178 14.635 1.00 22.87 C ATOM 9 CA GLY A 9 32.823 46.073 17.377 1.00 19.68 C ATOM 10 CA THR A 10 30.341 48.509 18.821 1.00 24.40 C ATOM 11 CA ASP A 11 27.295 48.270 21.084 1.00 24.50 C ATOM 12 CA THR A 12 24.471 49.998 19.169 1.00 27.66 C ATOM 13 CA THR A 13 22.276 50.871 22.099 1.00 26.54 C ATOM 14 CA TYR A 14 23.948 54.240 22.921 1.00 32.43 C ATOM 15 CA ALA A 15 22.695 57.227 20.989 1.00 28.02 C ATOM 16 CA PRO A 16 24.140 59.693 20.144 1.00 27.18 C ATOM 17 CA PHE A 17 27.356 57.640 19.911 1.00 23.93 C ATOM 18 CA SER A 18 26.237 54.299 18.425 1.00 24.18 C ATOM 19 CA SER A 19 22.728 53.318 17.344 1.00 28.24 C ATOM 20 CA LYS A 20 20.855 51.849 14.383 1.00 30.56 C ATOM 21 CA ASP A 21 18.525 53.813 12.242 1.00 33.49 C ATOM 22 CA ALA A 22 15.284 52.706 10.539 1.00 34.60 C ATOM 23 CA LYS A 23 17.296 51.111 7.700 1.00 39.55 C ATOM 24 CA GLY A 24 19.528 49.072 10.118 1.00 34.95 C ATOM 25 CA GLU A 25 22.585 51.339 9.308 1.00 31.38 C ATOM 26 CA PHE A 26 24.902 52.136 12.249 1.00 25.24 C ATOM 27 CA ILE A 27 24.701 55.846 13.010 1.00 22.54 C ATOM 28 CA GLY A 28 26.222 58.132 15.630 1.00 23.44 C ATOM 29 CA PHE A 29 29.292 60.080 16.595 1.00 23.61 C ATOM 30 CA ASP A 30 31.505 56.992 17.229 1.00 19.33 C ATOM 31 CA ILE A 31 30.444 55.689 13.814 1.00 23.29 C ATOM 32 CA ASP A 32 31.297 59.003 12.137 1.00 23.95 C ATOM 33 CA LEU A 33 34.674 59.198 13.862 1.00 24.21 C ATOM 34 CA GLY A 34 35.295 55.504 13.010 1.00 22.57 C ATOM 35 CA ASN A 35 34.407 55.793 9.342 1.00 23.24 C ATOM 36 CA GLU A 36 36.400 58.960 8.841 1.00 26.49 C ATOM 37 CA MET A 37 39.523 57.425 10.466 1.00 25.46 C ATOM 38 CA CYS A 38 39.184 54.297 8.195 1.00 27.94 C ATOM 39 CA LYS A 39 38.967 56.650 5.229 1.00 32.46 C ATOM 40 CA ARG A 40 42.207 58.442 6.151 1.00 32.21 C ATOM 41 CA MET A 41 43.885 55.106 7.060 1.00 30.91 C ATOM 42 CA GLN A 42 42.806 53.806 3.670 1.00 34.53 C ATOM 43 CA VAL A 43 41.490 50.443 4.943 1.00 35.59 C ATOM 44 CA LYS A 44 38.089 48.752 4.731 1.00 33.40 C ATOM 45 CA CYS A 45 36.335 48.687 8.133 1.00 32.20 C ATOM 46 CA THR A 46 33.305 46.642 8.963 1.00 29.49 C ATOM 47 CA TRP A 47 31.031 47.339 11.931 1.00 26.78 C ATOM 48 CA VAL A 48 30.024 44.411 14.078 1.00 25.37 C ATOM 49 CA ALA A 49 27.178 44.960 16.554 1.00 27.12 C ATOM 50 CA SER A 50 27.864 43.427 19.887 1.00 31.54 C ATOM 51 CA ASP A 51 26.914 43.632 23.493 1.00 34.29 C ATOM 52 CA PHE A 52 29.296 45.833 25.434 1.00 30.64 C ATOM 53 CA ASP A 53 30.415 43.124 27.823 1.00 38.09 C ATOM 54 CA ALA A 54 31.481 40.869 24.920 1.00 26.94 C ATOM 55 CA LEU A 55 33.606 43.508 23.247 1.00 24.52 C ATOM 56 CA ILE A 56 36.967 43.136 25.067 1.00 28.70 C ATOM 57 CA PRO A 57 36.528 39.242 24.990 1.00 29.99 C ATOM 58 CA SER A 58 35.905 39.444 21.267 1.00 26.97 C ATOM 59 CA LEU A 59 38.946 41.704 20.803 1.00 25.37 C ATOM 60 CA LYS A 60 41.250 39.422 22.739 1.00 25.85 C ATOM 61 CA ALA A 61 39.921 36.383 20.836 1.00 23.52 C ATOM 62 CA LYS A 62 40.510 38.231 17.507 1.00 24.30 C ATOM 63 CA LYS A 63 36.875 38.091 16.529 1.00 25.14 C ATOM 64 CA ILE A 64 37.142 41.884 15.992 1.00 21.04 C ATOM 65 CA ASP A 65 40.197 44.181 15.511 1.00 21.61 C ATOM 66 CA ALA A 66 39.054 47.357 17.298 1.00 22.68 C ATOM 67 CA ILE A 67 36.388 48.529 19.686 1.00 21.07 C ATOM 68 CA ILE A 68 34.771 51.962 19.172 1.00 21.28 C ATOM 69 CA SER A 69 31.941 52.049 21.629 1.00 22.46 C ATOM 70 CA SER A 70 32.486 55.013 24.051 1.00 21.21 C ATOM 71 CA LEU A 71 35.037 52.838 25.809 1.00 23.19 C ATOM 72 CA SER A 72 36.771 54.953 28.453 1.00 25.12 C ATOM 73 CA ILE A 73 40.470 54.719 28.933 1.00 26.87 C ATOM 74 CA THR A 74 40.711 53.444 32.466 1.00 32.96 C ATOM 75 CA ASP A 75 43.803 52.109 34.185 1.00 44.06 C ATOM 76 CA LYS A 76 42.187 48.690 34.639 1.00 43.86 C ATOM 77 CA ARG A 77 41.508 48.334 30.875 1.00 36.26 C ATOM 78 CA GLN A 78 45.037 49.582 30.046 1.00 36.70 C ATOM 79 CA GLN A 79 46.223 46.534 31.990 1.00 44.98 C ATOM 80 CA GLU A 80 44.464 44.425 29.308 1.00 41.83 C ATOM 81 CA ILE A 81 44.290 46.305 25.975 1.00 29.05 C ATOM 82 CA ALA A 82 45.763 49.291 24.219 1.00 24.57 C ATOM 83 CA PHE A 83 43.895 52.530 23.290 1.00 24.86 C ATOM 84 CA SER A 84 44.224 55.118 20.556 1.00 23.81 C ATOM 85 CA ASP A 85 44.524 58.725 21.567 1.00 23.67 C ATOM 86 CA LYS A 86 41.312 60.126 23.118 1.00 26.19 C ATOM 87 CA LEU A 87 38.301 60.486 20.829 1.00 25.00 C ATOM 88 CA TYR A 88 36.277 62.681 23.271 1.00 25.06 C ATOM 89 CA ALA A 89 35.852 63.130 27.001 1.00 24.18 C ATOM 90 CA ALA A 90 33.540 61.112 29.280 1.00 25.10 C ATOM 91 CA ASP A 91 33.363 63.309 32.419 1.00 22.36 C ATOM 92 CA SER A 92 30.650 63.924 34.973 1.00 24.17 C ATOM 93 CA ARG A 93 29.080 67.253 35.965 1.00 20.46 C ATOM 94 CA LEU A 94 26.640 68.597 38.551 1.00 25.34 C ATOM 95 CA ILE A 95 23.082 69.470 37.493 1.00 27.75 C ATOM 96 CA ALA A 96 21.119 71.962 39.604 1.00 25.04 C ATOM 97 CA ALA A 97 18.309 74.533 39.255 1.00 26.76 C ATOM 98 CA LYS A 98 18.972 77.314 36.671 1.00 31.33 C ATOM 99 CA GLY A 99 20.840 80.091 38.372 1.00 32.59 C ATOM 100 CA SER A 100 22.202 77.961 41.263 1.00 32.14 C ATOM 101 CA PRO A 101 25.537 79.247 42.660 1.00 30.11 C ATOM 102 CA ILE A 102 26.557 75.563 43.373 1.00 29.39 C ATOM 103 CA GLN A 103 30.043 74.528 42.295 1.00 28.46 C ATOM 104 CA PRO A 104 31.788 71.070 42.399 1.00 27.04 C ATOM 105 CA THR A 105 34.031 72.132 45.337 1.00 29.73 C ATOM 106 CA LEU A 106 33.933 70.919 48.857 1.00 34.61 C ATOM 107 CA GLU A 107 33.475 74.542 49.933 1.00 41.86 C ATOM 108 CA SER A 108 30.388 74.945 47.845 1.00 33.65 C ATOM 109 CA LEU A 109 28.830 71.526 48.547 1.00 31.28 C ATOM 110 CA LYS A 110 29.034 71.384 52.315 1.00 46.08 C ATOM 111 CA GLY A 111 25.485 71.560 53.452 1.00 47.54 C ATOM 112 CA LYS A 112 23.997 70.449 50.181 1.00 40.46 C ATOM 113 CA HIS A 113 22.337 67.111 49.331 1.00 33.76 C ATOM 114 CA VAL A 114 23.799 65.626 46.196 1.00 27.17 C ATOM 115 CA GLY A 115 22.147 62.638 44.575 1.00 21.40 C ATOM 116 CA VAL A 116 24.115 59.976 42.892 1.00 26.58 C ATOM 117 CA LEU A 117 23.089 56.711 41.161 1.00 31.66 C ATOM 118 CA GLN A 118 23.904 53.717 43.336 1.00 32.63 C ATOM 119 CA GLY A 119 26.825 51.633 42.136 1.00 33.87 C ATOM 120 CA SER A 120 28.044 54.049 39.460 1.00 32.03 C ATOM 121 CA THR A 121 31.469 55.705 38.991 1.00 28.77 C ATOM 122 CA GLN A 122 29.813 58.931 40.098 1.00 26.25 C ATOM 123 CA GLU A 123 28.978 57.453 43.593 1.00 27.20 C ATOM 124 CA ALA A 124 32.547 56.210 43.872 1.00 25.89 C ATOM 125 CA TYR A 125 33.906 59.690 43.126 1.00 27.11 C ATOM 126 CA ALA A 126 31.313 61.411 45.314 1.00 30.61 C ATOM 127 CA ASN A 127 31.834 58.978 48.201 1.00 35.20 C ATOM 128 CA ASP A 128 35.668 59.331 48.328 1.00 38.76 C ATOM 129 CA ASN A 129 35.921 63.014 47.506 1.00 35.89 C ATOM 130 CA TRP A 130 32.786 64.434 49.110 1.00 29.40 C ATOM 131 CA ARG A 131 30.795 62.166 51.427 1.00 28.43 C ATOM 132 CA THR A 132 33.890 61.320 53.572 1.00 28.40 C ATOM 133 CA LYS A 133 34.337 65.080 53.972 1.00 29.76 C ATOM 134 CA GLY A 134 30.771 65.698 55.185 1.00 36.64 C ATOM 135 CA VAL A 135 28.817 66.486 51.980 1.00 32.75 C ATOM 136 CA ASP A 136 25.460 64.611 52.261 1.00 29.93 C ATOM 137 CA VAL A 137 25.632 62.320 49.284 1.00 27.98 C ATOM 138 CA VAL A 138 22.477 60.224 48.700 1.00 28.42 C ATOM 139 CA ALA A 139 22.563 57.161 46.463 1.00 27.22 C ATOM 140 CA TYR A 140 19.517 56.246 44.395 1.00 30.32 C ATOM 141 CA ALA A 141 18.444 52.917 42.972 1.00 32.78 C ATOM 142 CA ASN A 142 17.039 54.636 39.966 1.00 40.84 C ATOM 143 CA GLN A 143 17.721 57.640 37.773 1.00 43.98 C ATOM 144 CA ASP A 144 14.015 58.614 37.625 1.00 44.71 C ATOM 145 CA LEU A 145 13.877 59.173 41.341 1.00 37.24 C ATOM 146 CA ILE A 146 16.986 61.382 41.185 1.00 34.85 C ATOM 147 CA TYR A 147 15.355 63.630 38.632 1.00 32.92 C ATOM 148 CA SER A 148 12.058 63.792 40.531 1.00 38.60 C ATOM 149 CA ASP A 149 13.809 64.602 43.803 1.00 34.74 C ATOM 150 CA LEU A 150 15.832 67.383 42.139 1.00 35.69 C ATOM 151 CA THR A 151 12.608 68.640 40.549 1.00 40.47 C ATOM 152 CA ALA A 152 10.864 68.407 43.925 1.00 40.44 C ATOM 153 CA GLY A 153 13.627 70.355 45.675 1.00 35.16 C ATOM 154 CA ARG A 154 14.649 67.326 47.742 1.00 39.45 C ATOM 155 CA LEU A 155 18.157 67.401 46.294 1.00 29.78 C ATOM 156 CA ASP A 156 20.369 70.399 45.704 1.00 29.30 C ATOM 157 CA ALA A 157 22.319 68.830 42.806 1.00 25.68 C ATOM 158 CA ALA A 158 22.900 65.555 41.074 1.00 24.18 C ATOM 159 CA LEU A 159 26.298 64.325 39.836 1.00 23.30 C ATOM 160 CA GLN A 160 25.766 62.665 36.482 1.00 27.98 C ATOM 161 CA ASP A 161 27.594 61.743 33.321 1.00 22.81 C ATOM 162 CA GLU A 162 27.693 65.023 31.302 1.00 25.07 C ATOM 163 CA VAL A 163 26.566 63.784 27.910 1.00 26.27 C ATOM 164 CA ALA A 164 23.920 61.571 29.495 1.00 30.47 C ATOM 165 CA ALA A 165 22.520 64.473 31.516 1.00 28.38 C ATOM 166 CA SER A 166 22.553 66.654 28.370 1.00 36.41 C ATOM 167 CA GLU A 167 20.799 64.293 26.066 1.00 41.21 C ATOM 168 CA GLY A 168 18.559 62.705 28.586 1.00 42.68 C ATOM 169 CA PHE A 169 17.248 65.400 30.923 1.00 33.75 C ATOM 170 CA LEU A 170 18.404 68.918 30.220 1.00 35.06 C ATOM 171 CA LYS A 171 17.045 68.446 26.691 1.00 45.86 C ATOM 172 CA GLN A 172 13.795 66.889 27.964 1.00 52.39 C ATOM 173 CA PRO A 173 10.769 69.068 28.987 1.00 51.71 C ATOM 174 CA ALA A 174 11.488 68.185 32.577 1.00 49.18 C ATOM 175 CA GLY A 175 14.986 69.713 32.466 1.00 42.99 C ATOM 176 CA LYS A 176 14.106 73.151 31.025 1.00 41.82 C ATOM 177 CA GLU A 177 14.540 74.898 34.382 1.00 36.65 C ATOM 178 CA TYR A 178 17.826 73.103 35.164 1.00 30.48 C ATOM 179 CA ALA A 179 21.405 73.461 34.063 1.00 23.47 C ATOM 180 CA PHE A 180 24.938 72.287 34.582 1.00 22.60 C ATOM 181 CA ALA A 181 26.304 73.847 37.719 1.00 21.55 C ATOM 182 CA GLY A 182 29.982 74.689 37.241 1.00 21.36 C ATOM 183 CA PRO A 183 32.506 72.925 34.965 1.00 20.99 C ATOM 184 CA SER A 184 32.754 69.151 34.470 1.00 26.86 C ATOM 185 CA VAL A 185 34.606 67.026 36.970 1.00 32.49 C ATOM 186 CA LYS A 186 37.528 65.252 35.456 1.00 36.63 C ATOM 187 CA ASP A 187 39.171 62.425 37.355 1.00 39.69 C ATOM 188 CA LYS A 188 41.042 59.621 35.464 1.00 38.22 C ATOM 189 CA LYS A 189 40.719 57.328 38.440 1.00 34.44 C ATOM 190 CA TYR A 190 36.906 57.223 38.345 1.00 32.90 C ATOM 191 CA PHE A 191 35.974 58.441 34.901 1.00 27.58 C ATOM 192 CA GLY A 192 39.017 57.394 32.869 1.00 28.78 C ATOM 193 CA ASP A 193 40.838 59.610 30.409 1.00 32.50 C ATOM 194 CA GLY A 194 38.248 60.123 27.712 1.00 24.42 C ATOM 195 CA THR A 195 37.226 57.277 25.438 1.00 21.33 C ATOM 196 CA GLY A 196 39.458 55.712 22.769 1.00 17.92 C ATOM 197 CA VAL A 197 39.555 53.019 20.086 1.00 18.01 C ATOM 198 CA GLY A 198 40.253 49.738 22.044 1.00 19.78 C ATOM 199 CA LEU A 199 42.969 47.687 20.314 1.00 22.17 C ATOM 200 CA ARG A 200 45.104 44.537 21.071 1.00 25.89 C ATOM 201 CA LYS A 201 48.257 45.532 22.976 1.00 29.67 C ATOM 202 CA ASP A 202 50.323 43.894 20.236 1.00 34.40 C ATOM 203 CA ASP A 203 48.818 45.752 17.334 1.00 32.56 C ATOM 204 CA THR A 204 51.051 48.729 17.302 1.00 30.61 C ATOM 205 CA GLU A 205 50.872 49.538 13.519 1.00 31.15 C ATOM 206 CA LEU A 206 47.058 49.594 13.790 1.00 28.25 C ATOM 207 CA LYS A 207 47.286 51.974 16.807 1.00 28.59 C ATOM 208 CA ALA A 208 49.702 54.194 14.861 1.00 25.77 C ATOM 209 CA ALA A 209 47.358 54.194 11.911 1.00 23.16 C ATOM 210 CA PHE A 210 44.320 55.207 14.103 1.00 25.09 C ATOM 211 CA ASP A 211 46.385 57.852 15.954 1.00 27.15 C ATOM 212 CA LYS A 212 47.686 59.410 12.717 1.00 30.60 C ATOM 213 CA ALA A 213 44.211 59.547 11.205 1.00 27.40 C ATOM 214 CA LEU A 214 42.655 61.045 14.338 1.00 25.91 C ATOM 215 CA THR A 215 45.282 63.915 14.485 1.00 33.15 C ATOM 216 CA GLU A 216 44.709 64.652 10.817 1.00 36.33 C ATOM 217 CA LEU A 217 40.945 64.912 11.007 1.00 30.91 C ATOM 218 CA ARG A 218 41.262 67.026 14.133 1.00 33.81 C ATOM 219 CA GLN A 219 43.769 69.400 12.471 1.00 43.39 C ATOM 220 CA ASP A 220 41.816 70.003 9.245 1.00 37.10 C ATOM 221 CA GLY A 221 38.577 70.714 11.195 1.00 36.83 C ATOM 222 CA THR A 222 36.604 67.568 10.226 1.00 33.27 C ATOM 223 CA TYR A 223 36.321 66.674 13.950 1.00 29.54 C ATOM 224 CA ASP A 224 34.455 69.915 14.688 1.00 34.77 C ATOM 225 CA LYS A 225 32.129 69.658 11.692 1.00 33.66 C ATOM 226 CA MET A 226 31.304 66.115 12.768 1.00 33.44 C ATOM 227 CA ALA A 227 30.771 67.002 16.443 1.00 32.81 C ATOM 228 CA LYS A 228 28.497 69.912 15.423 1.00 40.99 C ATOM 229 CA LYS A 229 25.763 67.437 14.356 1.00 37.64 C ATOM 230 CA TYR A 230 25.287 66.159 17.872 1.00 31.38 C ATOM 231 CA PHE A 231 26.844 68.424 20.401 1.00 34.98 C ATOM 232 CA ASP A 232 26.546 72.104 20.940 1.00 44.43 C ATOM 233 CA PHE A 233 29.469 71.937 23.393 1.00 37.52 C ATOM 234 CA ASN A 234 33.141 70.908 23.199 1.00 32.53 C ATOM 235 CA VAL A 235 32.803 67.135 23.546 1.00 28.29 C ATOM 236 CA TYR A 236 36.536 66.773 23.147 1.00 24.60 C ATOM 237 CA GLY A 237 37.302 68.436 26.516 1.00 35.43 C ATOM 238 CA ASP A 238 40.936 69.454 27.040 1.00 53.26 C END If you find results from this site helpful for your research, please cite one of our papers:
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