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*** open ***elNémo ID: 2604281148222846743Job options:ID = 2604281148222846743 JOBID = open USERID = unknown PRIVAT = 0 NMODES = 10 DQMIN = -100 DQMAX = 100 DQSTEP = 20 DOGRAPHS = on DOPROJMODS = on DORMSD = on NRBL = 0 CUTOFF = 0 CAONLY = 0 Input data for this run:HEADER open CRYST1 70.870 59.450 78.150 90.00 95.80 90.00 P 1 1 ATOM 1 CA GLU A 2 1.146 -0.578 25.666 1.00 38.88 C ATOM 2 CA LEU A 3 4.753 0.418 24.969 1.00 31.97 C ATOM 3 CA VAL A 4 6.750 0.853 28.198 1.00 25.29 C ATOM 4 CA SER A 5 10.537 1.416 28.707 1.00 17.37 C ATOM 5 CA VAL A 6 12.891 -0.020 31.283 1.00 14.48 C ATOM 6 CA ALA A 7 16.139 1.682 32.019 1.00 10.17 C ATOM 7 CA ALA A 8 18.684 2.533 34.763 1.00 11.55 C ATOM 8 CA LEU A 9 20.446 5.828 34.715 1.00 19.77 C ATOM 9 CA ALA A 10 22.551 7.956 37.145 1.00 33.14 C ATOM 10 CA GLU A 11 21.927 11.693 37.631 1.00 39.99 C ATOM 11 CA ASN A 12 22.762 13.467 34.292 1.00 35.67 C ATOM 12 CA ARG A 13 20.536 10.724 32.761 1.00 26.89 C ATOM 13 CA VAL A 14 23.712 8.779 31.853 1.00 14.60 C ATOM 14 CA ILE A 15 23.048 5.125 31.027 1.00 12.60 C ATOM 15 CA GLY A 16 26.584 4.204 29.927 1.00 16.04 C ATOM 16 CA ARG A 17 30.173 4.825 29.086 1.00 28.48 C ATOM 17 CA ASP A 18 31.647 3.470 25.810 1.00 43.04 C ATOM 18 CA GLY A 19 30.601 -0.159 26.372 1.00 44.15 C ATOM 19 CA GLU A 20 29.057 -0.834 29.786 1.00 43.85 C ATOM 20 CA LEU A 21 27.425 0.520 32.954 1.00 33.58 C ATOM 21 CA PRO A 22 29.531 3.402 34.520 1.00 28.16 C ATOM 22 CA TRP A 23 28.306 2.521 38.055 1.00 35.78 C ATOM 23 CA PRO A 24 29.302 -0.890 39.511 1.00 40.51 C ATOM 24 CA SER A 25 27.227 -3.486 41.416 1.00 42.41 C ATOM 25 CA ILE A 26 23.451 -3.502 41.972 1.00 39.38 C ATOM 26 CA PRO A 27 22.066 -7.058 41.356 1.00 30.04 C ATOM 27 CA ALA A 28 18.752 -6.086 42.921 1.00 23.14 C ATOM 28 CA ASP A 29 18.432 -3.849 39.825 1.00 20.93 C ATOM 29 CA LYS A 30 19.220 -6.690 37.426 1.00 24.72 C ATOM 30 CA LYS A 31 16.971 -9.257 39.190 1.00 28.79 C ATOM 31 CA GLN A 32 13.921 -6.895 39.174 1.00 26.96 C ATOM 32 CA TYR A 33 14.624 -5.673 35.552 1.00 24.38 C ATOM 33 CA ARG A 34 15.175 -9.193 34.058 1.00 21.36 C ATOM 34 CA SER A 35 12.122 -10.572 35.890 1.00 26.52 C ATOM 35 CA ARG A 36 10.037 -7.551 34.861 1.00 26.32 C ATOM 36 CA ILE A 37 10.405 -8.244 31.185 1.00 27.19 C ATOM 37 CA ALA A 38 10.513 -12.014 31.542 1.00 31.53 C ATOM 38 CA ASP A 39 7.698 -13.175 29.383 1.00 34.10 C ATOM 39 CA ASP A 40 6.552 -10.218 27.297 1.00 27.79 C ATOM 40 CA PRO A 41 8.322 -9.098 24.060 1.00 21.03 C ATOM 41 CA VAL A 42 11.367 -6.897 24.330 1.00 15.44 C ATOM 42 CA VAL A 43 12.170 -4.112 21.889 1.00 12.14 C ATOM 43 CA LEU A 44 16.024 -3.722 21.684 1.00 17.94 C ATOM 44 CA GLY A 45 18.928 -2.868 19.388 1.00 18.03 C ATOM 45 CA ARG A 46 20.857 -5.240 17.259 1.00 23.04 C ATOM 46 CA THR A 47 24.176 -4.718 19.152 1.00 29.96 C ATOM 47 CA THR A 48 22.462 -5.047 22.531 1.00 24.28 C ATOM 48 CA PHE A 49 20.878 -8.279 21.279 1.00 31.88 C ATOM 49 CA GLU A 50 24.239 -9.524 19.876 1.00 31.74 C ATOM 50 CA SER A 51 25.908 -8.911 23.245 1.00 33.54 C ATOM 51 CA MET A 52 23.145 -10.552 25.204 1.00 31.16 C ATOM 52 CA ARG A 53 23.260 -13.817 23.043 1.00 35.98 C ATOM 53 CA ASP A 54 24.248 -16.098 26.036 1.00 38.38 C ATOM 54 CA ASP A 55 21.368 -14.822 28.178 1.00 32.22 C ATOM 55 CA LEU A 56 18.254 -13.085 26.429 1.00 26.93 C ATOM 56 CA PRO A 57 15.595 -11.039 28.172 1.00 28.17 C ATOM 57 CA GLY A 58 11.932 -11.837 27.295 1.00 32.18 C ATOM 58 CA SER A 59 9.731 -14.336 25.413 1.00 37.90 C ATOM 59 CA ALA A 60 10.604 -12.973 21.994 1.00 27.91 C ATOM 60 CA GLN A 61 12.971 -10.241 21.026 1.00 24.84 C ATOM 61 CA ILE A 62 11.985 -7.531 18.445 1.00 13.77 C ATOM 62 CA VAL A 63 15.435 -6.544 17.178 1.00 11.53 C ATOM 63 CA MET A 64 15.563 -2.930 15.849 1.00 11.75 C ATOM 64 CA SER A 65 17.942 -2.700 12.888 1.00 11.82 C ATOM 65 CA ARG A 66 18.566 -1.037 9.494 1.00 15.63 C ATOM 66 CA SER A 67 19.778 -4.239 7.718 1.00 13.95 C ATOM 67 CA GLU A 68 17.237 -7.028 6.876 1.00 19.15 C ATOM 68 CA ARG A 69 18.835 -9.928 8.792 1.00 30.32 C ATOM 69 CA SER A 70 18.635 -13.628 9.143 1.00 41.11 C ATOM 70 CA PHE A 71 18.467 -14.598 12.813 1.00 39.26 C ATOM 71 CA SER A 72 18.961 -18.194 13.744 1.00 44.95 C ATOM 72 CA VAL A 73 17.169 -17.943 17.053 1.00 40.49 C ATOM 73 CA ASP A 74 13.579 -19.313 16.632 1.00 46.35 C ATOM 74 CA THR A 75 11.953 -16.212 17.982 1.00 45.55 C ATOM 75 CA ALA A 76 13.867 -12.971 17.625 1.00 42.61 C ATOM 76 CA HIS A 77 12.176 -10.833 14.979 1.00 35.25 C ATOM 77 CA ARG A 78 13.521 -7.793 12.946 1.00 25.65 C ATOM 78 CA ALA A 79 12.122 -4.262 12.817 1.00 20.53 C ATOM 79 CA ALA A 80 12.681 -1.133 10.734 1.00 18.21 C ATOM 80 CA SER A 81 10.469 1.291 12.745 1.00 14.48 C ATOM 81 CA VAL A 82 8.321 1.853 15.853 1.00 18.63 C ATOM 82 CA GLU A 83 5.275 0.897 13.776 1.00 26.29 C ATOM 83 CA GLU A 84 6.593 -2.467 12.505 1.00 17.42 C ATOM 84 CA ALA A 85 7.795 -3.139 16.094 1.00 16.44 C ATOM 85 CA VAL A 86 4.281 -2.579 17.490 1.00 13.69 C ATOM 86 CA ASP A 87 2.691 -4.737 14.677 1.00 22.28 C ATOM 87 CA ILE A 88 4.935 -7.752 15.527 1.00 17.83 C ATOM 88 CA ALA A 89 4.059 -7.555 19.258 1.00 23.54 C ATOM 89 CA ALA A 90 0.406 -7.129 18.272 1.00 36.73 C ATOM 90 CA SER A 91 0.914 -10.354 16.302 1.00 42.38 C ATOM 91 CA LEU A 92 2.381 -12.174 19.354 1.00 40.98 C ATOM 92 CA ASP A 93 -0.779 -11.279 21.353 1.00 51.16 C ATOM 93 CA ALA A 94 1.313 -9.421 23.911 1.00 50.13 C ATOM 94 CA GLU A 95 -0.076 -7.046 26.446 1.00 49.78 C ATOM 95 CA THR A 96 3.083 -5.050 27.057 1.00 40.78 C ATOM 96 CA ALA A 97 6.163 -4.320 24.993 1.00 27.15 C ATOM 97 CA TYR A 98 9.361 -3.136 26.728 1.00 19.08 C ATOM 98 CA VAL A 99 12.195 -0.984 25.375 1.00 15.18 C ATOM 99 CA ILE A 100 15.554 -2.322 26.737 1.00 17.22 C ATOM 100 CA GLY A 101 17.529 0.049 24.427 1.00 14.68 C ATOM 101 CA GLY A 102 20.340 1.156 23.737 1.00 20.63 C ATOM 102 CA ALA A 103 20.343 4.954 23.667 1.00 17.32 C ATOM 103 CA ALA A 104 19.120 5.426 20.014 1.00 5.50 C ATOM 104 CA ILE A 105 16.325 2.986 20.518 1.00 6.09 C ATOM 105 CA TYR A 106 15.165 4.757 23.830 1.00 16.06 C ATOM 106 CA ALA A 107 15.078 7.992 21.772 1.00 14.87 C ATOM 107 CA LEU A 108 13.096 6.405 18.900 1.00 6.87 C ATOM 108 CA PHE A 109 10.533 4.994 21.409 1.00 6.84 C ATOM 109 CA GLN A 110 10.189 7.982 23.726 1.00 11.85 C ATOM 110 CA PRO A 111 7.279 9.879 21.925 1.00 13.45 C ATOM 111 CA HIS A 112 5.356 6.549 21.801 1.00 22.81 C ATOM 112 CA LEU A 113 5.895 5.401 25.391 1.00 23.63 C ATOM 113 CA ASP A 114 2.996 4.766 27.678 1.00 27.99 C ATOM 114 CA ARG A 115 5.096 4.052 30.771 1.00 29.92 C ATOM 115 CA MET A 116 8.677 4.395 31.950 1.00 19.23 C ATOM 116 CA VAL A 117 10.172 2.101 34.541 1.00 14.01 C ATOM 117 CA LEU A 118 13.311 3.884 35.649 1.00 13.64 C ATOM 118 CA SER A 119 15.961 2.887 38.276 1.00 15.14 C ATOM 119 CA ARG A 120 17.615 6.014 39.638 1.00 17.04 C ATOM 120 CA VAL A 121 21.173 5.053 40.460 1.00 25.03 C ATOM 121 CA PRO A 122 22.122 7.723 42.940 1.00 26.17 C ATOM 122 CA GLY A 123 25.422 9.481 42.123 1.00 27.18 C ATOM 123 CA GLU A 124 26.724 11.517 39.180 1.00 29.19 C ATOM 124 CA TYR A 125 28.741 9.544 36.699 1.00 32.23 C ATOM 125 CA GLU A 126 30.618 10.072 33.421 1.00 37.45 C ATOM 126 CA GLY A 127 29.302 8.745 30.191 1.00 37.31 C ATOM 127 CA ASP A 128 28.256 9.380 26.645 1.00 36.33 C ATOM 128 CA THR A 129 25.043 7.457 26.159 1.00 25.00 C ATOM 129 CA TYR A 130 22.005 9.012 27.779 1.00 20.15 C ATOM 130 CA TYR A 131 18.374 8.099 28.440 1.00 17.31 C ATOM 131 CA PRO A 132 16.112 10.774 26.781 1.00 20.22 C ATOM 132 CA GLU A 133 14.715 13.862 28.452 1.00 24.43 C ATOM 133 CA TRP A 134 11.059 14.118 29.143 1.00 20.54 C ATOM 134 CA ASP A 135 8.665 16.952 29.826 1.00 30.73 C ATOM 135 CA ALA A 136 7.401 17.383 33.396 1.00 31.20 C ATOM 136 CA ALA A 137 3.933 18.450 32.195 1.00 34.39 C ATOM 137 CA GLU A 138 3.397 15.294 30.154 1.00 34.13 C ATOM 138 CA TRP A 139 4.340 12.641 32.814 1.00 26.77 C ATOM 139 CA GLU A 140 2.829 11.604 36.144 1.00 28.30 C ATOM 140 CA LEU A 141 4.778 9.490 38.684 1.00 29.12 C ATOM 141 CA ASP A 142 2.827 6.348 39.329 1.00 29.36 C ATOM 142 CA ALA A 143 5.046 5.004 42.118 1.00 19.65 C ATOM 143 CA GLU A 144 8.522 5.327 43.678 1.00 27.73 C ATOM 144 CA THR A 145 10.443 2.874 45.894 1.00 21.69 C ATOM 145 CA ASP A 146 13.686 2.776 47.684 1.00 24.80 C ATOM 146 CA HIS A 147 15.846 -0.343 47.435 1.00 18.44 C ATOM 147 CA GLU A 148 19.582 -0.848 48.110 1.00 25.85 C ATOM 148 CA GLY A 149 21.779 1.204 45.704 1.00 23.49 C ATOM 149 CA PHE A 150 18.905 2.597 43.568 1.00 23.57 C ATOM 150 CA THR A 151 15.232 3.648 43.657 1.00 20.79 C ATOM 151 CA LEU A 152 12.761 2.348 41.073 1.00 19.74 C ATOM 152 CA GLN A 153 10.284 4.803 39.641 1.00 21.51 C ATOM 153 CA GLU A 154 7.218 4.032 37.600 1.00 25.47 C ATOM 154 CA TRP A 155 6.117 6.994 35.500 1.00 28.71 C ATOM 155 CA VAL A 156 2.786 6.789 33.698 1.00 31.86 C ATOM 156 CA ARG A 157 1.924 9.510 31.129 1.00 34.95 C ATOM 157 CA SER A 158 -0.310 12.349 32.467 1.00 47.81 C ATOM 158 CA GLU B 2 25.888 23.130 15.722 1.00 23.60 C ATOM 159 CA LEU B 3 22.946 20.719 15.255 1.00 11.84 C ATOM 160 CA VAL B 4 19.573 22.533 15.104 1.00 9.56 C ATOM 161 CA SER B 5 16.039 21.373 14.160 1.00 16.33 C ATOM 162 CA VAL B 6 13.327 23.294 12.337 1.00 10.29 C ATOM 163 CA ALA B 7 9.797 21.949 13.039 1.00 8.54 C ATOM 164 CA ALA B 8 6.212 23.318 13.041 1.00 10.93 C ATOM 165 CA LEU B 9 4.098 21.700 15.740 1.00 13.91 C ATOM 166 CA ALA B 10 0.737 22.130 17.454 1.00 18.22 C ATOM 167 CA GLU B 11 0.066 22.353 21.225 1.00 26.73 C ATOM 168 CA ASN B 12 -0.165 18.562 21.555 1.00 28.99 C ATOM 169 CA ARG B 13 3.169 18.282 19.787 1.00 19.05 C ATOM 170 CA VAL B 14 1.627 16.990 16.552 1.00 14.11 C ATOM 171 CA ILE B 15 3.654 17.474 13.420 1.00 15.85 C ATOM 172 CA GLY B 16 1.675 15.208 11.047 1.00 24.88 C ATOM 173 CA ARG B 17 -1.627 13.461 10.492 1.00 35.61 C ATOM 174 CA ASP B 18 -1.757 10.791 7.873 1.00 38.68 C ATOM 175 CA GLY B 19 1.094 12.084 5.806 1.00 44.45 C ATOM 176 CA GLU B 20 1.403 15.791 6.492 1.00 44.54 C ATOM 177 CA LEU B 21 -0.058 18.841 8.326 1.00 30.38 C ATOM 178 CA PRO B 22 -3.140 18.779 10.488 1.00 25.17 C ATOM 179 CA TRP B 23 -3.295 22.563 9.830 1.00 31.55 C ATOM 180 CA PRO B 24 -3.866 24.424 6.504 1.00 45.16 C ATOM 181 CA SER B 25 -2.268 27.504 4.816 1.00 53.62 C ATOM 182 CA ILE B 26 0.749 29.042 6.688 1.00 43.25 C ATOM 183 CA PRO B 27 2.959 30.475 3.883 1.00 32.62 C ATOM 184 CA ALA B 28 4.415 32.747 6.557 1.00 26.19 C ATOM 185 CA ASP B 29 5.830 29.536 8.076 1.00 20.30 C ATOM 186 CA LYS B 30 6.972 28.106 4.779 1.00 20.98 C ATOM 187 CA LYS B 31 8.921 31.231 3.755 1.00 23.75 C ATOM 188 CA GLN B 32 10.592 31.358 7.180 1.00 24.18 C ATOM 189 CA TYR B 33 12.059 27.823 7.487 1.00 16.27 C ATOM 190 CA ARG B 34 13.102 27.639 3.873 1.00 19.52 C ATOM 191 CA SER B 35 15.079 30.856 4.217 1.00 27.15 C ATOM 192 CA ARG B 36 16.592 29.633 7.469 1.00 13.18 C ATOM 193 CA ILE B 37 18.097 26.451 6.020 1.00 10.14 C ATOM 194 CA ALA B 38 18.853 27.757 2.532 1.00 12.14 C ATOM 195 CA ASP B 39 22.673 27.915 2.713 1.00 20.34 C ATOM 196 CA ASP B 40 23.595 25.215 5.241 1.00 18.47 C ATOM 197 CA PRO B 41 23.384 21.309 5.155 1.00 11.40 C ATOM 198 CA VAL B 42 20.024 19.712 5.690 1.00 9.91 C ATOM 199 CA VAL B 43 19.309 16.320 7.379 1.00 8.64 C ATOM 200 CA LEU B 44 16.174 14.618 6.243 1.00 10.18 C ATOM 201 CA GLY B 45 14.325 11.333 5.756 1.00 15.82 C ATOM 202 CA ARG B 46 14.632 9.604 2.363 1.00 23.53 C ATOM 203 CA THR B 47 10.928 9.979 1.529 1.00 29.55 C ATOM 204 CA THR B 48 10.863 13.746 2.420 1.00 27.06 C ATOM 205 CA PHE B 49 13.914 14.080 0.081 1.00 18.43 C ATOM 206 CA GLU B 50 12.103 12.487 -2.835 1.00 29.83 C ATOM 207 CA SER B 51 8.940 14.479 -1.796 1.00 32.11 C ATOM 208 CA MET B 52 10.980 17.611 -2.569 1.00 24.75 C ATOM 209 CA ARG B 53 12.796 16.567 -5.840 1.00 21.65 C ATOM 210 CA ASP B 54 11.622 19.769 -7.570 1.00 26.16 C ATOM 211 CA ASP B 55 13.026 22.143 -4.910 1.00 19.90 C ATOM 212 CA LEU B 56 15.833 20.758 -2.782 1.00 14.18 C ATOM 213 CA PRO B 57 16.267 22.073 0.784 1.00 18.51 C ATOM 214 CA GLY B 58 19.761 23.606 1.469 1.00 16.71 C ATOM 215 CA SER B 59 23.494 23.709 0.805 1.00 20.67 C ATOM 216 CA ALA B 60 23.427 19.986 0.752 1.00 14.10 C ATOM 217 CA GLN B 61 21.287 17.136 1.953 1.00 20.11 C ATOM 218 CA ILE B 62 22.376 14.407 4.329 1.00 15.52 C ATOM 219 CA VAL B 63 19.684 11.794 3.758 1.00 13.10 C ATOM 220 CA MET B 64 18.757 9.340 6.411 1.00 18.60 C ATOM 221 CA SER B 65 18.223 5.980 4.914 1.00 18.52 C ATOM 222 CA ARG B 66 18.080 2.592 6.561 1.00 12.57 C ATOM 223 CA SER B 67 19.292 1.388 3.103 1.00 13.78 C ATOM 224 CA GLU B 68 22.446 2.139 1.016 1.00 16.10 C ATOM 225 CA ARG B 69 21.631 4.806 -1.644 1.00 16.48 C ATOM 226 CA SER B 70 23.315 6.499 -4.508 1.00 20.75 C ATOM 227 CA PHE B 71 21.528 9.705 -5.544 1.00 22.78 C ATOM 228 CA SER B 72 20.982 11.768 -8.665 1.00 32.77 C ATOM 229 CA VAL B 73 21.811 15.098 -7.078 1.00 35.52 C ATOM 230 CA ASP B 74 25.470 16.002 -6.535 1.00 38.76 C ATOM 231 CA THR B 75 24.635 17.587 -3.168 1.00 26.50 C ATOM 232 CA ALA B 76 22.957 14.513 -1.759 1.00 23.36 C ATOM 233 CA HIS B 77 24.630 12.280 0.700 1.00 22.76 C ATOM 234 CA ARG B 78 23.608 9.113 2.536 1.00 21.30 C ATOM 235 CA ALA B 79 24.034 8.707 6.254 1.00 14.14 C ATOM 236 CA ALA B 80 22.952 5.621 8.181 1.00 17.20 C ATOM 237 CA SER B 81 23.453 7.126 11.678 1.00 17.97 C ATOM 238 CA VAL B 82 23.438 10.436 13.639 1.00 18.32 C ATOM 239 CA GLU B 83 27.244 10.115 13.869 1.00 24.86 C ATOM 240 CA GLU B 84 27.756 9.573 10.171 1.00 18.07 C ATOM 241 CA ALA B 85 25.546 12.581 9.330 1.00 17.85 C ATOM 242 CA VAL B 86 27.511 14.867 11.585 1.00 23.82 C ATOM 243 CA ASP B 87 30.783 13.618 9.946 1.00 30.83 C ATOM 244 CA ILE B 88 29.431 14.397 6.467 1.00 24.46 C ATOM 245 CA ALA B 89 28.417 17.927 7.464 1.00 22.49 C ATOM 246 CA ALA B 90 31.821 18.402 9.138 1.00 23.73 C ATOM 247 CA SER B 91 33.518 17.384 5.866 1.00 26.45 C ATOM 248 CA LEU B 92 31.329 20.001 4.172 1.00 29.41 C ATOM 249 CA ASP B 93 32.894 22.703 6.444 1.00 32.43 C ATOM 250 CA ALA B 94 29.395 23.326 7.794 1.00 23.51 C ATOM 251 CA GLU B 95 29.035 25.857 10.570 1.00 24.00 C ATOM 252 CA THR B 96 25.579 24.580 11.323 1.00 19.05 C ATOM 253 CA ALA B 97 23.327 21.794 9.967 1.00 14.43 C ATOM 254 CA TYR B 98 19.509 21.696 10.170 1.00 9.81 C ATOM 255 CA VAL B 99 17.207 18.739 10.910 1.00 7.46 C ATOM 256 CA ILE B 100 13.987 19.331 8.968 1.00 10.37 C ATOM 257 CA GLY B 101 11.996 16.004 9.118 1.00 9.53 C ATOM 258 CA GLY B 102 10.286 13.613 9.526 1.00 7.36 C ATOM 259 CA ALA B 103 9.254 12.274 12.941 1.00 8.04 C ATOM 260 CA ALA B 104 11.733 9.385 13.327 1.00 10.88 C ATOM 261 CA ILE B 105 14.597 11.697 12.348 1.00 11.33 C ATOM 262 CA TYR B 106 13.504 14.257 14.957 1.00 14.45 C ATOM 263 CA ALA B 107 13.336 11.722 17.853 1.00 10.63 C ATOM 264 CA LEU B 108 16.675 10.351 16.759 1.00 14.15 C ATOM 265 CA PHE B 109 18.553 13.694 16.681 1.00 17.66 C ATOM 266 CA GLN B 110 16.833 15.405 19.629 1.00 19.02 C ATOM 267 CA PRO B 111 19.399 14.093 22.280 1.00 20.21 C ATOM 268 CA HIS B 112 22.227 15.688 20.230 1.00 11.35 C ATOM 269 CA LEU B 113 20.388 18.978 19.467 1.00 9.30 C ATOM 270 CA ASP B 114 21.920 22.297 20.370 1.00 14.19 C ATOM 271 CA ARG B 115 18.972 24.508 19.290 1.00 15.74 C ATOM 272 CA MET B 116 15.268 24.173 18.262 1.00 10.52 C ATOM 273 CA VAL B 117 13.492 26.492 15.849 1.00 8.65 C ATOM 274 CA LEU B 118 9.886 25.557 16.667 1.00 12.01 C ATOM 275 CA SER B 119 6.807 27.233 15.039 1.00 10.50 C ATOM 276 CA ARG B 120 4.187 26.950 17.690 1.00 12.82 C ATOM 277 CA VAL B 121 0.856 26.309 15.876 1.00 20.48 C ATOM 278 CA PRO B 122 -2.109 26.931 18.318 1.00 21.47 C ATOM 279 CA GLU B 126 -5.678 15.658 15.920 1.00 42.17 C ATOM 280 CA GLY B 127 -2.798 13.469 14.462 1.00 35.48 C ATOM 281 CA ASP B 128 -0.369 10.490 14.576 1.00 35.31 C ATOM 282 CA THR B 129 3.250 11.775 14.095 1.00 25.84 C ATOM 283 CA TYR B 130 4.991 13.861 16.797 1.00 19.62 C ATOM 284 CA TYR B 131 7.827 16.259 17.629 1.00 12.72 C ATOM 285 CA PRO B 132 9.810 14.847 20.620 1.00 10.01 C ATOM 286 CA GLU B 133 9.110 16.201 24.099 1.00 21.57 C ATOM 287 CA TRP B 134 11.957 18.326 25.526 1.00 30.07 C ATOM 288 CA ASP B 135 12.695 19.463 29.110 1.00 39.24 C ATOM 289 CA ALA B 136 11.423 23.048 29.550 1.00 38.78 C ATOM 290 CA ALA B 137 13.690 23.718 32.525 1.00 36.68 C ATOM 291 CA GLU B 138 16.806 22.495 30.697 1.00 37.33 C ATOM 292 CA TRP B 139 16.377 24.727 27.610 1.00 26.07 C ATOM 293 CA GLU B 140 16.294 28.542 27.647 1.00 24.23 C ATOM 294 CA LEU B 141 13.914 30.287 25.344 1.00 17.82 C ATOM 295 CA ASP B 142 16.344 32.310 23.354 1.00 21.86 C ATOM 296 CA ALA B 143 13.786 34.171 21.180 1.00 19.47 C ATOM 297 CA GLU B 144 10.043 34.335 20.731 1.00 25.73 C ATOM 298 CA THR B 145 8.744 36.377 17.803 1.00 25.34 C ATOM 299 CA ASP B 146 5.059 36.543 17.261 1.00 34.90 C ATOM 300 CA HIS B 147 4.120 35.846 13.625 1.00 34.20 C ATOM 301 CA GLU B 148 1.229 35.242 11.233 1.00 37.88 C ATOM 302 CA GLY B 149 -0.420 31.902 11.928 1.00 35.23 C ATOM 303 CA PHE B 150 2.104 30.751 14.543 1.00 26.81 C ATOM 304 CA THR B 151 4.803 31.954 16.973 1.00 24.73 C ATOM 305 CA LEU B 152 8.426 31.175 16.131 1.00 19.09 C ATOM 306 CA GLN B 153 10.637 30.079 19.098 1.00 9.25 C ATOM 307 CA GLU B 154 14.473 29.455 19.067 1.00 10.82 C ATOM 308 CA TRP B 155 15.332 27.273 22.140 1.00 14.88 C ATOM 309 CA VAL B 156 18.912 26.808 23.191 1.00 13.49 C ATOM 310 CA ARG B 157 20.361 24.239 25.622 1.00 30.19 C ATOM 311 CA SER B 158 20.721 26.089 28.957 1.00 38.28 C END A second structure was input as follows:CRYST1 68.178 135.920 168.652 90.00 90.00 90.00 P 1 1 ATOM 1 CA MET A 1 20.724 -37.995 -23.365 1.00 29.25 C ATOM 2 CA ILE A 2 18.977 -39.218 -20.210 1.00 21.63 C ATOM 3 CA VAL A 3 16.595 -36.648 -18.759 1.00 16.28 C ATOM 4 CA SER A 4 16.253 -37.299 -15.026 1.00 17.57 C ATOM 5 CA PHE A 5 14.043 -35.731 -12.362 1.00 20.66 C ATOM 6 CA MET A 6 15.757 -35.324 -8.996 1.00 20.68 C ATOM 7 CA VAL A 7 13.259 -34.670 -6.238 1.00 13.02 C ATOM 8 CA ALA A 8 12.663 -34.911 -2.517 1.00 14.93 C ATOM 9 CA MET A 9 9.032 -34.702 -1.422 1.00 16.06 C ATOM 10 CA ASP A 10 6.753 -35.518 1.494 1.00 19.61 C ATOM 11 CA GLU A 11 3.578 -37.626 1.766 1.00 24.03 C ATOM 12 CA ASN A 12 1.573 -34.953 -0.040 1.00 19.11 C ATOM 13 CA ARG A 13 4.242 -34.114 -2.640 1.00 16.04 C ATOM 14 CA VAL A 14 5.377 -30.990 -0.856 1.00 20.33 C ATOM 15 CA ILE A 15 8.758 -29.935 -2.227 1.00 20.66 C ATOM 16 CA GLY A 16 8.961 -26.478 -0.663 1.00 22.47 C ATOM 17 CA LYS A 17 7.722 -23.950 1.881 1.00 34.95 C ATOM 18 CA ASP A 18 8.404 -20.217 1.690 1.00 70.06 C ATOM 19 CA ASN A 19 11.043 -21.276 -0.837 1.00 70.42 C ATOM 20 CA ASN A 20 13.132 -23.511 1.404 1.00 48.45 C ATOM 21 CA LEU A 21 12.926 -27.169 2.385 1.00 29.87 C ATOM 22 CA PRO A 22 10.489 -27.785 5.266 1.00 28.18 C ATOM 23 CA TRP A 23 12.919 -30.432 6.474 1.00 26.47 C ATOM 24 CA ARG A 24 16.630 -30.669 7.144 1.00 19.18 C ATOM 25 CA LEU A 25 18.150 -33.943 6.043 1.00 19.62 C ATOM 26 CA PRO A 26 21.922 -33.522 5.450 1.00 16.26 C ATOM 27 CA SER A 27 22.182 -37.205 4.532 1.00 13.94 C ATOM 28 CA GLU A 28 19.531 -36.770 1.800 1.00 20.40 C ATOM 29 CA LEU A 29 21.514 -33.860 0.312 1.00 17.79 C ATOM 30 CA GLN A 30 24.658 -36.015 0.394 1.00 20.49 C ATOM 31 CA TYR A 31 22.733 -38.570 -1.650 1.00 22.00 C ATOM 32 CA VAL A 32 21.851 -35.822 -4.124 1.00 20.73 C ATOM 33 CA LYS A 33 25.532 -34.840 -4.323 1.00 24.89 C ATOM 34 CA LYS A 34 26.676 -38.427 -4.842 1.00 21.41 C ATOM 35 CA THR A 35 24.068 -39.168 -7.490 1.00 20.54 C ATOM 36 CA THR A 36 24.454 -36.007 -9.602 1.00 24.39 C ATOM 37 CA MET A 37 28.261 -35.968 -9.590 1.00 34.87 C ATOM 38 CA GLY A 38 29.633 -35.034 -13.019 1.00 37.75 C ATOM 39 CA HIS A 39 26.216 -34.264 -14.488 1.00 23.15 C ATOM 40 CA PRO A 40 24.435 -30.964 -15.126 1.00 22.06 C ATOM 41 CA LEU A 41 21.939 -29.650 -12.583 1.00 21.77 C ATOM 42 CA ILE A 42 18.986 -27.907 -14.182 1.00 19.76 C ATOM 43 CA MET A 43 17.023 -25.553 -11.941 1.00 25.38 C ATOM 44 CA GLY A 44 14.671 -22.594 -12.033 1.00 26.54 C ATOM 45 CA ARG A 45 15.858 -19.209 -10.784 1.00 29.71 C ATOM 46 CA LYS A 46 13.810 -19.291 -7.551 1.00 34.34 C ATOM 47 CA ASN A 47 15.127 -22.775 -6.823 1.00 32.17 C ATOM 48 CA TYR A 48 18.717 -21.682 -7.395 1.00 34.50 C ATOM 49 CA GLU A 49 18.291 -18.634 -5.181 1.00 39.41 C ATOM 50 CA ALA A 50 16.827 -20.790 -2.399 1.00 38.91 C ATOM 51 CA ILE A 51 20.052 -22.836 -2.425 1.00 50.35 C ATOM 52 CA GLY A 52 22.244 -19.724 -2.354 1.00 60.76 C ATOM 53 CA ARG A 53 25.394 -20.924 -4.118 1.00 58.84 C ATOM 54 CA PRO A 54 26.539 -22.848 -7.194 1.00 51.52 C ATOM 55 CA LEU A 55 26.774 -26.491 -6.214 1.00 46.74 C ATOM 56 CA PRO A 56 30.457 -27.265 -6.895 1.00 50.72 C ATOM 57 CA GLY A 57 31.529 -30.022 -9.281 1.00 48.93 C ATOM 58 CA ARG A 58 28.573 -29.687 -11.650 1.00 51.82 C ATOM 59 CA ARG A 59 27.384 -27.542 -14.523 1.00 34.89 C ATOM 60 CA ASN A 60 24.764 -25.455 -12.790 1.00 22.46 C ATOM 61 CA ILE A 61 22.262 -24.421 -15.441 1.00 22.68 C ATOM 62 CA ILE A 62 19.664 -21.879 -14.369 1.00 21.61 C ATOM 63 CA VAL A 63 16.423 -21.674 -16.323 1.00 19.87 C ATOM 64 CA THR A 64 14.741 -18.270 -16.600 1.00 31.25 C ATOM 65 CA ARG A 65 12.655 -16.300 -19.087 1.00 35.63 C ATOM 66 CA ASN A 66 14.741 -13.229 -18.196 1.00 42.11 C ATOM 67 CA GLU A 67 17.217 -12.651 -21.052 1.00 44.29 C ATOM 68 CA GLY A 68 19.309 -10.352 -18.857 1.00 44.39 C ATOM 69 CA TYR A 69 19.775 -12.736 -15.945 1.00 37.33 C ATOM 70 CA HIS A 70 23.365 -13.729 -15.224 1.00 41.59 C ATOM 71 CA VAL A 71 25.170 -15.285 -12.267 1.00 37.84 C ATOM 72 CA GLU A 72 28.813 -16.120 -11.629 1.00 45.05 C ATOM 73 CA GLY A 73 29.799 -19.758 -12.067 1.00 44.95 C ATOM 74 CA CYS A 74 26.457 -20.669 -13.651 1.00 38.53 C ATOM 75 CA GLU A 75 25.145 -20.961 -17.182 1.00 32.23 C ATOM 76 CA VAL A 76 21.722 -19.558 -18.053 1.00 28.67 C ATOM 77 CA ALA A 77 19.093 -21.001 -20.390 1.00 29.94 C ATOM 78 CA HIS A 78 15.771 -19.424 -21.310 1.00 25.92 C ATOM 79 CA SER A 79 13.905 -22.445 -22.671 1.00 26.35 C ATOM 80 CA VAL A 80 13.878 -26.222 -22.903 1.00 20.44 C ATOM 81 CA GLU A 81 15.354 -25.897 -26.393 1.00 27.25 C ATOM 82 CA GLU A 82 18.290 -23.921 -25.006 1.00 27.05 C ATOM 83 CA VAL A 83 18.835 -26.446 -22.212 1.00 19.31 C ATOM 84 CA PHE A 84 18.977 -29.345 -24.673 1.00 20.25 C ATOM 85 CA GLU A 85 21.346 -27.319 -26.858 1.00 29.65 C ATOM 86 CA LEU A 86 23.619 -26.597 -23.901 1.00 24.40 C ATOM 87 CA CYS A 87 23.610 -30.274 -22.827 1.00 20.64 C ATOM 88 CA LYS A 88 24.033 -31.431 -26.429 1.00 27.88 C ATOM 89 CA ASN A 89 26.748 -33.919 -25.484 1.00 30.67 C ATOM 90 CA GLU A 90 25.681 -34.885 -21.946 1.00 29.13 C ATOM 91 CA GLU A 91 25.010 -38.487 -20.967 1.00 29.74 C ATOM 92 CA GLU A 92 22.469 -37.513 -18.269 1.00 25.20 C ATOM 93 CA ILE A 93 21.006 -34.318 -16.801 1.00 20.96 C ATOM 94 CA PHE A 94 19.105 -33.724 -13.573 1.00 15.27 C ATOM 95 CA ILE A 95 16.070 -31.496 -13.489 1.00 16.19 C ATOM 96 CA PHE A 96 16.503 -30.165 -9.985 1.00 24.10 C ATOM 97 CA GLY A 97 13.158 -28.548 -9.632 1.00 13.56 C ATOM 98 CA GLY A 98 10.935 -25.677 -9.417 1.00 23.23 C ATOM 99 CA ALA A 99 7.490 -27.256 -9.832 1.00 22.54 C ATOM 100 CA GLN A 100 7.218 -25.294 -13.099 1.00 19.62 C ATOM 101 CA ILE A 101 10.627 -26.557 -14.243 1.00 17.65 C ATOM 102 CA TYR A 102 9.465 -30.158 -13.731 1.00 18.09 C ATOM 103 CA ASP A 103 6.391 -29.330 -15.813 1.00 22.50 C ATOM 104 CA LEU A 104 8.562 -27.994 -18.639 1.00 20.00 C ATOM 105 CA PHE A 105 10.628 -31.182 -18.824 1.00 17.72 C ATOM 106 CA LEU A 106 7.784 -33.650 -18.253 1.00 17.73 C ATOM 107 CA PRO A 107 7.443 -34.524 -21.963 1.00 18.34 C ATOM 108 CA TYR A 108 11.088 -35.596 -22.077 1.00 18.97 C ATOM 109 CA VAL A 109 11.693 -37.263 -18.708 1.00 16.82 C ATOM 110 CA ASP A 110 13.316 -40.726 -18.798 1.00 20.27 C ATOM 111 CA LYS A 111 14.255 -41.441 -15.205 1.00 17.71 C ATOM 112 CA LEU A 112 12.906 -40.498 -11.771 1.00 15.16 C ATOM 113 CA TYR A 113 15.023 -40.127 -8.641 1.00 12.76 C ATOM 114 CA ILE A 114 12.435 -39.538 -5.944 1.00 13.06 C ATOM 115 CA THR A 115 13.086 -39.281 -2.216 1.00 12.38 C ATOM 116 CA LYS A 116 9.837 -39.910 -0.350 1.00 11.55 C ATOM 117 CA ILE A 117 9.754 -38.461 3.170 1.00 13.49 C ATOM 118 CA HIS A 118 7.241 -40.228 5.425 1.00 23.56 C ATOM 119 CA HIS A 119 5.809 -37.123 7.095 1.00 23.78 C ATOM 120 CA ALA A 120 3.353 -34.319 6.386 1.00 27.16 C ATOM 121 CA PHE A 121 4.919 -30.860 6.370 1.00 21.11 C ATOM 122 CA GLU A 122 3.577 -27.392 5.804 1.00 40.11 C ATOM 123 CA GLY A 123 4.268 -26.529 2.162 1.00 33.44 C ATOM 124 CA ASP A 124 3.219 -24.195 -0.647 1.00 41.14 C ATOM 125 CA THR A 125 4.740 -25.881 -3.695 1.00 29.54 C ATOM 126 CA PHE A 126 4.325 -29.439 -4.966 1.00 23.59 C ATOM 127 CA PHE A 127 5.793 -32.139 -7.181 1.00 22.50 C ATOM 128 CA PRO A 128 3.255 -32.418 -10.023 1.00 27.84 C ATOM 129 CA GLU A 129 1.144 -35.576 -10.183 1.00 28.18 C ATOM 130 CA MET A 130 2.469 -38.382 -12.391 1.00 28.56 C ATOM 131 CA ASP A 131 0.904 -41.553 -13.754 1.00 37.28 C ATOM 132 CA MET A 132 3.236 -44.096 -12.182 1.00 30.30 C ATOM 133 CA THR A 133 1.777 -47.054 -14.090 1.00 36.94 C ATOM 134 CA ASN A 134 4.122 -45.972 -16.882 1.00 37.80 C ATOM 135 CA TRP A 135 7.048 -46.307 -14.485 1.00 25.90 C ATOM 136 CA LYS A 136 9.025 -49.214 -13.048 1.00 26.49 C ATOM 137 CA GLU A 137 11.023 -49.199 -9.817 1.00 19.77 C ATOM 138 CA VAL A 138 14.630 -50.263 -10.407 1.00 13.28 C ATOM 139 CA PHE A 139 16.082 -49.294 -7.015 1.00 12.97 C ATOM 140 CA VAL A 140 14.929 -48.506 -3.509 1.00 12.48 C ATOM 141 CA GLU A 141 16.822 -47.757 -0.277 1.00 18.47 C ATOM 142 CA LYS A 142 15.829 -46.601 3.205 1.00 13.15 C ATOM 143 CA GLY A 143 17.497 -43.339 4.072 1.00 15.00 C ATOM 144 CA LEU A 144 19.561 -42.822 7.195 1.00 18.10 C ATOM 145 CA THR A 145 17.371 -41.652 10.080 1.00 18.46 C ATOM 146 CA ASP A 146 19.210 -40.293 13.155 1.00 18.54 C ATOM 147 CA GLU A 147 19.879 -37.200 15.329 1.00 19.63 C ATOM 148 CA LYS A 148 20.756 -35.049 12.305 1.00 24.61 C ATOM 149 CA ASN A 149 18.128 -36.622 10.006 1.00 17.11 C ATOM 150 CA PRO A 150 15.013 -36.853 12.156 1.00 21.37 C ATOM 151 CA TYR A 151 12.502 -38.108 9.603 1.00 11.44 C ATOM 152 CA THR A 152 11.983 -41.458 7.938 1.00 10.86 C ATOM 153 CA TYR A 153 12.502 -41.404 4.187 1.00 12.66 C ATOM 154 CA TYR A 154 13.360 -43.572 1.194 1.00 14.69 C ATOM 155 CA TYR A 155 15.331 -43.167 -2.074 1.00 14.63 C ATOM 156 CA HIS A 156 13.384 -44.473 -5.054 1.00 13.31 C ATOM 157 CA VAL A 157 14.483 -44.699 -8.695 1.00 13.23 C ATOM 158 CA TYR A 158 12.101 -45.302 -11.595 1.00 12.66 C ATOM 159 CA GLU A 159 12.577 -46.049 -15.297 1.00 16.87 C ATOM 160 CA LYS A 160 9.909 -46.220 -18.012 1.00 26.01 C ATOM 161 CA GLN A 161 7.613 -49.238 -18.157 1.00 32.84 C ATOM 162 CA GLN A 162 8.421 -50.905 -21.464 1.00 43.70 C ATOM 163 CA LEU A 163 4.978 -52.222 -22.591 1.00 49.71 C ATOM 164 CA VAL A 164 4.227 -55.602 -24.202 1.00 40.31 C ATOM 165 CA PRO A 165 2.639 -55.342 -27.700 1.00 40.92 C ATOM 166 CA ARG A 166 -0.818 -56.740 -28.466 1.00 46.97 C ATOM 167 CA MET B 1 17.263 3.837 22.546 1.00 25.14 C ATOM 168 CA ILE B 2 15.640 5.104 19.372 1.00 21.89 C ATOM 169 CA VAL B 3 13.179 2.561 17.990 1.00 14.28 C ATOM 170 CA SER B 4 12.852 3.140 14.234 1.00 17.19 C ATOM 171 CA PHE B 5 10.586 1.585 11.638 1.00 16.23 C ATOM 172 CA MET B 6 12.298 1.031 8.280 1.00 16.24 C ATOM 173 CA VAL B 7 9.770 0.399 5.550 1.00 14.07 C ATOM 174 CA ALA B 8 9.179 0.542 1.818 1.00 17.05 C ATOM 175 CA MET B 9 5.551 0.447 0.677 1.00 13.77 C ATOM 176 CA ASP B 10 3.302 1.295 -2.236 1.00 18.27 C ATOM 177 CA GLU B 11 0.221 3.526 -2.566 1.00 25.50 C ATOM 178 CA ASN B 12 -1.875 0.980 -0.696 1.00 22.74 C ATOM 179 CA ARG B 13 0.751 0.089 1.936 1.00 21.53 C ATOM 180 CA VAL B 14 1.753 -3.108 0.216 1.00 21.91 C ATOM 181 CA ILE B 15 5.079 -4.282 1.646 1.00 20.03 C ATOM 182 CA GLY B 16 5.171 -7.767 0.177 1.00 24.83 C ATOM 183 CA LYS B 17 3.822 -10.247 -2.318 1.00 38.25 C ATOM 184 CA ASP B 18 3.951 -13.899 -1.450 1.00 56.78 C ATOM 185 CA ASN B 19 7.184 -13.260 0.434 1.00 66.42 C ATOM 186 CA ASN B 20 9.186 -10.956 -1.773 1.00 45.49 C ATOM 187 CA LEU B 21 9.126 -7.319 -2.861 1.00 30.65 C ATOM 188 CA PRO B 22 6.721 -6.698 -5.775 1.00 29.73 C ATOM 189 CA TRP B 23 9.244 -4.165 -7.087 1.00 25.70 C ATOM 190 CA ARG B 24 12.967 -4.115 -7.743 1.00 22.48 C ATOM 191 CA LEU B 25 14.616 -0.891 -6.686 1.00 21.51 C ATOM 192 CA PRO B 26 18.371 -1.434 -6.121 1.00 19.35 C ATOM 193 CA SER B 27 18.775 2.230 -5.290 1.00 18.92 C ATOM 194 CA GLU B 28 16.112 1.999 -2.540 1.00 20.07 C ATOM 195 CA LEU B 29 17.980 -0.945 -0.965 1.00 19.99 C ATOM 196 CA GLN B 30 21.205 1.083 -1.119 1.00 20.52 C ATOM 197 CA TYR B 31 19.386 3.759 0.864 1.00 23.80 C ATOM 198 CA VAL B 32 18.396 1.120 3.402 1.00 28.43 C ATOM 199 CA LYS B 33 22.030 0.007 3.630 1.00 24.99 C ATOM 200 CA LYS B 34 23.335 3.538 4.073 1.00 20.66 C ATOM 201 CA THR B 35 20.723 4.456 6.681 1.00 23.16 C ATOM 202 CA THR B 36 21.020 1.327 8.844 1.00 22.61 C ATOM 203 CA MET B 37 24.825 1.034 8.864 1.00 39.41 C ATOM 204 CA GLY B 38 26.138 0.285 12.344 1.00 39.42 C ATOM 205 CA HIS B 39 22.688 -0.316 13.809 1.00 26.24 C ATOM 206 CA PRO B 40 20.744 -3.512 14.559 1.00 20.17 C ATOM 207 CA LEU B 41 18.220 -4.798 12.041 1.00 21.02 C ATOM 208 CA ILE B 42 15.201 -6.374 13.698 1.00 18.59 C ATOM 209 CA MET B 43 13.154 -8.716 11.506 1.00 26.85 C ATOM 210 CA GLY B 44 10.690 -11.575 11.689 1.00 23.99 C ATOM 211 CA ARG B 45 11.740 -15.035 10.546 1.00 28.60 C ATOM 212 CA LYS B 46 9.693 -14.984 7.288 1.00 32.34 C ATOM 213 CA ASN B 47 11.150 -11.566 6.442 1.00 29.89 C ATOM 214 CA TYR B 48 14.695 -12.776 7.063 1.00 31.48 C ATOM 215 CA GLU B 49 14.168 -15.885 4.952 1.00 40.41 C ATOM 216 CA ALA B 50 12.782 -13.735 2.108 1.00 42.78 C ATOM 217 CA ILE B 51 16.085 -11.829 2.090 1.00 49.89 C ATOM 218 CA GLY B 52 18.132 -15.031 2.112 1.00 59.76 C ATOM 219 CA ARG B 53 21.333 -13.906 3.836 1.00 59.38 C ATOM 220 CA PRO B 54 22.546 -11.936 6.853 1.00 53.37 C ATOM 221 CA LEU B 55 22.948 -8.325 5.765 1.00 47.15 C ATOM 222 CA PRO B 56 26.652 -7.690 6.439 1.00 45.02 C ATOM 223 CA GLY B 57 27.825 -4.911 8.743 1.00 40.12 C ATOM 224 CA ARG B 58 24.858 -5.048 11.113 1.00 46.35 C ATOM 225 CA ARG B 59 23.580 -7.073 14.046 1.00 34.89 C ATOM 226 CA ASN B 60 20.876 -9.122 12.387 1.00 23.45 C ATOM 227 CA ILE B 61 18.333 -9.970 15.069 1.00 19.64 C ATOM 228 CA ILE B 62 15.633 -12.428 14.059 1.00 15.66 C ATOM 229 CA VAL B 63 12.379 -12.452 16.004 1.00 20.71 C ATOM 230 CA THR B 64 10.544 -15.758 16.355 1.00 28.21 C ATOM 231 CA ARG B 65 8.409 -17.574 18.910 1.00 31.42 C ATOM 232 CA ASN B 66 10.341 -20.773 18.116 1.00 35.49 C ATOM 233 CA GLU B 67 12.816 -21.380 20.979 1.00 40.75 C ATOM 234 CA GLY B 68 14.819 -23.820 18.875 1.00 37.07 C ATOM 235 CA TYR B 69 15.362 -21.509 15.897 1.00 37.28 C ATOM 236 CA HIS B 70 19.004 -20.683 15.135 1.00 38.40 C ATOM 237 CA VAL B 71 20.866 -19.300 12.131 1.00 36.24 C ATOM 238 CA GLU B 72 24.581 -18.633 11.756 1.00 35.61 C ATOM 239 CA GLY B 73 25.686 -15.001 11.839 1.00 39.05 C ATOM 240 CA CYS B 74 22.364 -13.929 13.359 1.00 38.77 C ATOM 241 CA GLU B 75 21.068 -13.455 16.882 1.00 33.36 C ATOM 242 CA VAL B 76 17.609 -14.701 17.814 1.00 28.24 C ATOM 243 CA ALA B 77 15.016 -13.079 20.066 1.00 25.87 C ATOM 244 CA HIS B 78 11.653 -14.522 21.081 1.00 28.06 C ATOM 245 CA SER B 79 9.909 -11.400 22.349 1.00 25.40 C ATOM 246 CA VAL B 80 10.013 -7.616 22.474 1.00 23.35 C ATOM 247 CA GLU B 81 11.519 -7.895 25.945 1.00 26.51 C ATOM 248 CA GLU B 82 14.376 -10.041 24.621 1.00 24.53 C ATOM 249 CA VAL B 83 14.993 -7.609 21.761 1.00 20.22 C ATOM 250 CA PHE B 84 15.230 -4.677 24.166 1.00 23.87 C ATOM 251 CA GLU B 85 17.545 -6.716 26.387 1.00 26.44 C ATOM 252 CA LEU B 86 19.752 -7.604 23.436 1.00 28.75 C ATOM 253 CA CYS B 87 19.873 -3.968 22.261 1.00 20.72 C ATOM 254 CA LYS B 88 20.396 -2.719 25.813 1.00 27.49 C ATOM 255 CA ASN B 89 23.212 -0.401 24.782 1.00 33.96 C ATOM 256 CA GLU B 90 22.163 0.528 21.246 1.00 27.13 C ATOM 257 CA GLU B 91 21.649 4.140 20.187 1.00 27.76 C ATOM 258 CA GLU B 92 19.089 3.198 17.493 1.00 25.96 C ATOM 259 CA ILE B 93 17.467 0.030 16.130 1.00 19.49 C ATOM 260 CA PHE B 94 15.557 -0.585 12.916 1.00 16.75 C ATOM 261 CA ILE B 95 12.434 -2.694 12.865 1.00 15.82 C ATOM 262 CA PHE B 96 12.822 -4.133 9.406 1.00 19.03 C ATOM 263 CA GLY B 97 9.423 -5.643 9.075 1.00 13.28 C ATOM 264 CA GLY B 98 7.063 -8.410 8.938 1.00 22.93 C ATOM 265 CA ALA B 99 3.710 -6.678 9.329 1.00 22.89 C ATOM 266 CA GLN B 100 3.354 -8.558 12.629 1.00 22.88 C ATOM 267 CA ILE B 101 6.786 -7.389 13.782 1.00 13.45 C ATOM 268 CA TYR B 102 5.781 -3.774 13.136 1.00 19.36 C ATOM 269 CA ASP B 103 2.679 -4.394 15.239 1.00 21.41 C ATOM 270 CA LEU B 104 4.783 -5.745 18.106 1.00 19.92 C ATOM 271 CA PHE B 105 6.977 -2.638 18.207 1.00 16.66 C ATOM 272 CA LEU B 106 4.220 -0.074 17.578 1.00 17.68 C ATOM 273 CA PRO B 107 3.944 0.914 21.261 1.00 18.61 C ATOM 274 CA TYR B 108 7.639 1.832 21.314 1.00 17.33 C ATOM 275 CA VAL B 109 8.302 3.392 17.940 1.00 17.50 C ATOM 276 CA ASP B 110 10.075 6.773 17.919 1.00 20.24 C ATOM 277 CA LYS B 111 11.016 7.364 14.294 1.00 18.37 C ATOM 278 CA LEU B 112 9.642 6.389 10.882 1.00 17.01 C ATOM 279 CA TYR B 113 11.755 5.822 7.781 1.00 10.54 C ATOM 280 CA ILE B 114 9.173 5.264 5.078 1.00 11.19 C ATOM 281 CA THR B 115 9.805 4.880 1.357 1.00 11.48 C ATOM 282 CA LYS B 116 6.579 5.591 -0.528 1.00 10.99 C ATOM 283 CA ILE B 117 6.430 4.076 -3.996 1.00 14.04 C ATOM 284 CA HIS B 118 3.971 5.858 -6.299 1.00 22.75 C ATOM 285 CA HIS B 119 2.443 2.774 -7.899 1.00 25.48 C ATOM 286 CA ALA B 120 -0.144 0.081 -7.103 1.00 26.75 C ATOM 287 CA PHE B 121 1.282 -3.429 -6.994 1.00 22.22 C ATOM 288 CA GLU B 122 -0.206 -6.827 -6.317 1.00 40.54 C ATOM 289 CA GLY B 123 0.464 -7.605 -2.647 1.00 34.36 C ATOM 290 CA ASP B 124 -0.672 -9.817 0.227 1.00 43.17 C ATOM 291 CA THR B 125 0.910 -8.105 3.220 1.00 30.29 C ATOM 292 CA PHE B 126 0.622 -4.497 4.402 1.00 22.17 C ATOM 293 CA PHE B 127 2.199 -1.814 6.534 1.00 22.10 C ATOM 294 CA PRO B 128 -0.330 -1.347 9.361 1.00 31.97 C ATOM 295 CA GLU B 129 -2.304 1.899 9.455 1.00 32.26 C ATOM 296 CA MET B 130 -0.859 4.732 11.541 1.00 27.84 C ATOM 297 CA ASP B 131 -2.287 7.978 12.828 1.00 33.35 C ATOM 298 CA MET B 132 0.145 10.380 11.186 1.00 28.22 C ATOM 299 CA THR B 133 -1.199 13.442 13.004 1.00 40.84 C ATOM 300 CA ASN B 134 1.101 12.341 15.825 1.00 35.94 C ATOM 301 CA TRP B 135 4.038 12.508 13.449 1.00 21.00 C ATOM 302 CA LYS B 136 6.171 15.268 11.930 1.00 24.29 C ATOM 303 CA GLU B 137 8.143 15.085 8.684 1.00 18.73 C ATOM 304 CA VAL B 138 11.786 16.025 9.244 1.00 14.54 C ATOM 305 CA PHE B 139 13.209 14.891 5.917 1.00 12.30 C ATOM 306 CA VAL B 140 12.022 14.046 2.415 1.00 10.94 C ATOM 307 CA GLU B 141 13.846 13.139 -0.789 1.00 15.94 C ATOM 308 CA LYS B 142 12.820 11.953 -4.243 1.00 12.91 C ATOM 309 CA GLY B 143 14.339 8.597 -5.035 1.00 15.33 C ATOM 310 CA LEU B 144 16.385 7.863 -8.140 1.00 15.93 C ATOM 311 CA THR B 145 14.159 6.748 -10.992 1.00 19.85 C END If you find results from this site helpful for your research, please cite one of our papers:
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