EXPDTA T0348TS746_1-scwrl MODEL 1 REMARK 44 REMARK 44 model 1 is called T0348TS746_1-scwrl ATOM 1 N MET 1 3.325 1.548 0.000 1.00 0.00 ATOM 2 CA MET 1 3.970 2.846 0.000 1.00 0.00 ATOM 3 CB MET 1 3.567 3.645 1.241 1.00 0.00 ATOM 4 CG MET 1 4.110 5.064 1.269 1.00 0.00 ATOM 5 SD MET 1 3.453 6.087 -0.061 1.00 0.00 ATOM 6 CE MET 1 1.836 6.496 0.593 1.00 0.00 ATOM 7 O MET 1 6.146 3.068 -0.971 1.00 0.00 ATOM 8 C MET 1 5.485 2.705 0.000 1.00 0.00 ATOM 9 N ASP 2 6.037 2.176 1.094 1.00 0.00 ATOM 10 CA ASP 2 7.468 1.989 1.217 1.00 0.00 ATOM 11 CB ASP 2 7.977 1.027 0.141 1.00 0.00 ATOM 12 CG ASP 2 7.543 -0.404 0.387 1.00 0.00 ATOM 13 OD1 ASP 2 7.072 -0.698 1.506 1.00 0.00 ATOM 14 OD2 ASP 2 7.675 -1.232 -0.539 1.00 0.00 ATOM 15 O ASP 2 9.066 3.645 1.874 1.00 0.00 ATOM 16 C ASP 2 8.208 3.310 1.060 1.00 0.00 ATOM 17 N ALA 3 7.874 4.061 0.008 1.00 0.00 ATOM 18 CA ALA 3 8.505 5.339 -0.251 1.00 0.00 ATOM 19 CB ALA 3 7.593 6.220 -1.090 1.00 0.00 ATOM 20 O ALA 3 9.865 6.691 1.181 1.00 0.00 ATOM 21 C ALA 3 8.811 6.073 1.046 1.00 0.00 ATOM 22 N LYS 4 7.884 6.004 2.005 1.00 0.00 ATOM 23 CA LYS 4 8.056 6.660 3.285 1.00 0.00 ATOM 24 CB LYS 4 6.787 6.528 4.129 1.00 0.00 ATOM 25 CG LYS 4 6.856 7.243 5.469 1.00 0.00 ATOM 26 CD LYS 4 5.534 7.150 6.213 1.00 0.00 ATOM 27 CE LYS 4 5.610 7.844 7.563 1.00 0.00 ATOM 28 NZ LYS 4 4.328 7.743 8.313 1.00 0.00 ATOM 29 O LYS 4 9.928 6.746 4.774 1.00 0.00 ATOM 30 C LYS 4 9.210 6.045 4.066 1.00 0.00 ATOM 31 N PHE 5 9.387 4.729 3.933 1.00 0.00 ATOM 32 CA PHE 5 10.448 4.024 4.623 1.00 0.00 ATOM 33 CB PHE 5 11.459 3.464 3.621 1.00 0.00 ATOM 34 CG PHE 5 12.580 2.692 4.257 1.00 0.00 ATOM 35 CD1 PHE 5 12.384 1.393 4.693 1.00 0.00 ATOM 36 CD2 PHE 5 13.829 3.265 4.420 1.00 0.00 ATOM 37 CE1 PHE 5 13.415 0.683 5.279 1.00 0.00 ATOM 38 CE2 PHE 5 14.860 2.554 5.006 1.00 0.00 ATOM 39 CZ PHE 5 14.657 1.269 5.434 1.00 0.00 ATOM 40 O PHE 5 12.366 4.740 5.862 1.00 0.00 ATOM 41 C PHE 5 11.189 4.950 5.577 1.00 0.00 ATOM 42 N LEU 6 10.497 5.979 6.071 1.00 0.00 ATOM 43 CA LEU 6 11.089 6.931 6.988 1.00 0.00 ATOM 44 CB LEU 6 12.202 6.269 7.803 1.00 0.00 ATOM 45 CG LEU 6 11.799 5.054 8.640 1.00 0.00 ATOM 46 CD1 LEU 6 13.016 4.435 9.310 1.00 0.00 ATOM 47 CD2 LEU 6 10.810 5.452 9.724 1.00 0.00 ATOM 48 O LEU 6 12.365 8.949 6.834 1.00 0.00 ATOM 49 C LEU 6 11.689 8.113 6.239 1.00 0.00 ATOM 50 N GLU 7 11.440 8.179 4.929 1.00 0.00 ATOM 51 CA GLU 7 11.955 9.254 4.106 1.00 0.00 ATOM 52 CB GLU 7 10.816 10.160 3.633 1.00 0.00 ATOM 53 CG GLU 7 10.106 10.900 4.755 1.00 0.00 ATOM 54 CD GLU 7 8.945 11.738 4.256 1.00 0.00 ATOM 55 OE1 GLU 7 8.676 11.714 3.036 1.00 0.00 ATOM 56 OE2 GLU 7 8.304 12.418 5.084 1.00 0.00 ATOM 57 O GLU 7 12.899 11.335 4.817 1.00 0.00 ATOM 58 C GLU 7 12.949 10.109 4.879 1.00 0.00 ATOM 59 N ILE 8 13.857 9.457 5.610 1.00 0.00 ATOM 60 CA ILE 8 14.858 10.156 6.391 1.00 0.00 ATOM 61 CB ILE 8 15.391 11.395 5.647 1.00 0.00 ATOM 62 CG1 ILE 8 16.128 10.976 4.374 1.00 0.00 ATOM 63 CG2 ILE 8 16.356 12.172 6.529 1.00 0.00 ATOM 64 CD1 ILE 8 16.467 12.130 3.456 1.00 0.00 ATOM 65 O ILE 8 15.016 10.796 8.691 1.00 0.00 ATOM 66 C ILE 8 14.284 10.628 7.718 1.00 0.00 ATOM 67 N LEU 9 12.967 10.845 7.758 1.00 0.00 ATOM 68 CA LEU 9 12.300 11.297 8.963 1.00 0.00 ATOM 69 CB LEU 9 11.791 10.103 9.774 1.00 0.00 ATOM 70 CG LEU 9 12.855 9.262 10.481 1.00 0.00 ATOM 71 CD1 LEU 9 12.220 8.365 11.533 1.00 0.00 ATOM 72 CD2 LEU 9 13.592 8.378 9.486 1.00 0.00 ATOM 73 O LEU 9 12.874 13.148 10.367 1.00 0.00 ATOM 74 C LEU 9 13.247 12.099 9.844 1.00 0.00 ATOM 75 N VAL 10 14.476 11.606 10.006 1.00 0.00 ATOM 76 CA VAL 10 15.470 12.276 10.821 1.00 0.00 ATOM 77 CB VAL 10 16.691 11.374 11.077 1.00 0.00 ATOM 78 CG1 VAL 10 17.553 11.276 9.827 1.00 0.00 ATOM 79 CG2 VAL 10 17.543 11.937 12.205 1.00 0.00 ATOM 80 O VAL 10 16.817 14.247 10.683 1.00 0.00 ATOM 81 C VAL 10 15.969 13.545 10.143 1.00 0.00 ATOM 82 N CYS 11 15.439 13.833 8.952 1.00 0.00 ATOM 83 CA CYS 11 15.830 15.012 8.205 1.00 0.00 ATOM 84 CB CYS 11 14.789 15.336 7.131 1.00 0.00 ATOM 85 SG CYS 11 13.164 15.791 7.780 1.00 0.00 ATOM 86 O CYS 11 15.204 16.363 10.076 1.00 0.00 ATOM 87 C CYS 11 15.959 16.222 9.118 1.00 0.00 ATOM 88 N PRO 12 16.920 17.103 8.826 1.00 0.00 ATOM 89 CA PRO 12 17.048 18.336 9.580 1.00 0.00 ATOM 90 CB PRO 12 16.602 19.420 8.596 1.00 0.00 ATOM 91 CG PRO 12 16.857 18.829 7.250 1.00 0.00 ATOM 92 CD PRO 12 16.541 17.365 7.370 1.00 0.00 ATOM 93 O PRO 12 15.834 19.360 11.370 1.00 0.00 ATOM 94 C PRO 12 16.165 18.312 10.820 1.00 0.00 ATOM 95 N LEU 13 15.784 17.110 11.261 1.00 0.00 ATOM 96 CA LEU 13 14.943 16.954 12.430 1.00 0.00 ATOM 97 CB LEU 13 13.719 16.097 12.099 1.00 0.00 ATOM 98 CG LEU 13 12.779 16.644 11.023 1.00 0.00 ATOM 99 CD1 LEU 13 11.680 15.641 10.709 1.00 0.00 ATOM 100 CD2 LEU 13 12.125 17.936 11.487 1.00 0.00 ATOM 101 O LEU 13 15.139 16.025 14.626 1.00 0.00 ATOM 102 C LEU 13 15.701 16.279 13.564 1.00 0.00 ATOM 103 N CYS 14 16.984 15.987 13.335 1.00 0.00 ATOM 104 CA CYS 14 17.813 15.344 14.335 1.00 0.00 ATOM 105 CB CYS 14 18.251 16.354 15.398 1.00 0.00 ATOM 106 SG CYS 14 19.340 15.673 16.670 1.00 0.00 ATOM 107 O CYS 14 17.439 13.056 14.928 1.00 0.00 ATOM 108 C CYS 14 17.058 14.221 15.031 1.00 0.00 ATOM 109 N LYS 15 15.987 14.574 15.742 1.00 0.00 ATOM 110 CA LYS 15 15.183 13.596 16.451 1.00 0.00 ATOM 111 CB LYS 15 14.064 14.287 17.232 1.00 0.00 ATOM 112 CG LYS 15 14.554 15.170 18.369 1.00 0.00 ATOM 113 CD LYS 15 13.393 15.812 19.110 1.00 0.00 ATOM 114 CE LYS 15 13.884 16.708 20.235 1.00 0.00 ATOM 115 NZ LYS 15 12.755 17.305 21.002 1.00 0.00 ATOM 116 O LYS 15 13.687 11.819 15.881 1.00 0.00 ATOM 117 C LYS 15 14.544 12.607 15.489 1.00 0.00 ATOM 118 N GLY 16 14.964 12.649 14.221 1.00 0.00 ATOM 119 CA GLY 16 14.434 11.761 13.209 1.00 0.00 ATOM 120 O GLY 16 13.586 9.532 13.399 1.00 0.00 ATOM 121 C GLY 16 14.485 10.318 13.690 1.00 0.00 ATOM 122 N PRO 17 15.539 9.963 14.432 1.00 0.00 ATOM 123 CA PRO 17 15.616 8.637 15.019 1.00 0.00 ATOM 124 CB PRO 17 16.922 8.063 14.466 1.00 0.00 ATOM 125 CG PRO 17 17.824 9.244 14.336 1.00 0.00 ATOM 126 CD PRO 17 16.943 10.401 13.956 1.00 0.00 ATOM 127 O PRO 17 16.551 8.185 17.174 1.00 0.00 ATOM 128 C PRO 17 15.640 8.711 16.538 1.00 0.00 ATOM 129 N LEU 18 14.634 9.367 17.121 1.00 0.00 ATOM 130 CA LEU 18 14.543 9.508 18.560 1.00 0.00 ATOM 131 CB LEU 18 14.018 8.218 19.193 1.00 0.00 ATOM 132 CG LEU 18 13.882 8.216 20.717 1.00 0.00 ATOM 133 CD1 LEU 18 12.856 9.245 21.166 1.00 0.00 ATOM 134 CD2 LEU 18 13.437 6.850 21.215 1.00 0.00 ATOM 135 O LEU 18 16.067 10.813 19.864 1.00 0.00 ATOM 136 C LEU 18 15.906 9.813 19.169 1.00 0.00 ATOM 137 N VAL 19 16.885 8.945 18.902 1.00 0.00 ATOM 138 CA VAL 19 18.227 9.125 19.423 1.00 0.00 ATOM 139 CB VAL 19 18.249 9.056 20.961 1.00 0.00 ATOM 140 CG1 VAL 19 17.785 7.689 21.440 1.00 0.00 ATOM 141 CG2 VAL 19 19.657 9.296 21.485 1.00 0.00 ATOM 142 O VAL 19 18.928 6.859 19.108 1.00 0.00 ATOM 143 C VAL 19 19.166 8.047 18.900 1.00 0.00 ATOM 144 N PHE 20 20.234 8.465 18.219 1.00 0.00 ATOM 145 CA PHE 20 21.202 7.536 17.669 1.00 0.00 ATOM 146 CB PHE 20 21.338 7.736 16.158 1.00 0.00 ATOM 147 CG PHE 20 20.066 7.491 15.398 1.00 0.00 ATOM 148 CD1 PHE 20 19.299 8.551 14.945 1.00 0.00 ATOM 149 CD2 PHE 20 19.637 6.202 15.135 1.00 0.00 ATOM 150 CE1 PHE 20 18.129 8.326 14.245 1.00 0.00 ATOM 151 CE2 PHE 20 18.467 5.977 14.435 1.00 0.00 ATOM 152 CZ PHE 20 17.713 7.032 13.990 1.00 0.00 ATOM 153 O PHE 20 23.565 7.906 17.595 1.00 0.00 ATOM 154 C PHE 20 22.573 7.738 18.299 1.00 0.00 ATOM 155 N ASP 21 22.625 7.721 19.633 1.00 0.00 ATOM 156 CA ASP 21 23.870 7.901 20.353 1.00 0.00 ATOM 157 CB ASP 21 24.812 6.723 20.097 1.00 0.00 ATOM 158 CG ASP 21 25.206 6.598 18.639 1.00 0.00 ATOM 159 OD1 ASP 21 24.767 7.443 17.830 1.00 0.00 ATOM 160 OD2 ASP 21 25.955 5.656 18.304 1.00 0.00 ATOM 161 O ASP 21 23.928 10.156 19.553 1.00 0.00 ATOM 162 C ASP 21 24.577 9.176 19.915 1.00 0.00 ATOM 163 N LYS 22 25.911 9.163 19.949 1.00 0.00 ATOM 164 CA LYS 22 26.700 10.314 19.557 1.00 0.00 ATOM 165 CB LYS 22 28.043 9.870 18.973 1.00 0.00 ATOM 166 CG LYS 22 28.954 11.017 18.569 1.00 0.00 ATOM 167 CD LYS 22 30.285 10.506 18.042 1.00 0.00 ATOM 168 CE LYS 22 31.168 11.649 17.570 1.00 0.00 ATOM 169 NZ LYS 22 32.475 11.163 17.048 1.00 0.00 ATOM 170 O LYS 22 25.832 12.351 18.652 1.00 0.00 ATOM 171 C LYS 22 25.976 11.139 18.505 1.00 0.00 ATOM 172 N SER 23 25.516 10.478 17.439 1.00 0.00 ATOM 173 CA SER 23 24.808 11.149 16.369 1.00 0.00 ATOM 174 CB SER 23 23.487 10.437 16.072 1.00 0.00 ATOM 175 OG SER 23 22.603 10.519 17.177 1.00 0.00 ATOM 176 O SER 23 24.138 13.394 15.878 1.00 0.00 ATOM 177 C SER 23 24.495 12.592 16.739 1.00 0.00 ATOM 178 N LYS 24 24.627 12.922 18.027 1.00 0.00 ATOM 179 CA LYS 24 24.357 14.262 18.505 1.00 0.00 ATOM 180 CB LYS 24 25.553 14.802 19.291 1.00 0.00 ATOM 181 CG LYS 24 26.802 15.017 18.451 1.00 0.00 ATOM 182 CD LYS 24 27.952 15.541 19.296 1.00 0.00 ATOM 183 CE LYS 24 29.197 15.767 18.454 1.00 0.00 ATOM 184 NZ LYS 24 30.332 16.283 19.268 1.00 0.00 ATOM 185 O LYS 24 23.499 16.276 17.542 1.00 0.00 ATOM 186 C LYS 24 24.084 15.212 17.349 1.00 0.00 ATOM 187 N ASP 25 24.509 14.827 16.144 1.00 0.00 ATOM 188 CA ASP 25 24.307 15.642 14.965 1.00 0.00 ATOM 189 CB ASP 25 23.597 14.839 13.874 1.00 0.00 ATOM 190 CG ASP 25 24.495 13.794 13.242 1.00 0.00 ATOM 191 OD1 ASP 25 25.721 13.847 13.471 1.00 0.00 ATOM 192 OD2 ASP 25 23.972 12.921 12.517 1.00 0.00 ATOM 193 O ASP 25 23.532 17.873 14.583 1.00 0.00 ATOM 194 C ASP 25 23.457 16.864 15.281 1.00 0.00 ATOM 195 N GLU 26 22.648 16.772 16.338 1.00 0.00 ATOM 196 CA GLU 26 21.789 17.866 16.742 1.00 0.00 ATOM 197 CB GLU 26 22.018 18.211 18.215 1.00 0.00 ATOM 198 CG GLU 26 23.410 18.742 18.519 1.00 0.00 ATOM 199 CD GLU 26 23.620 19.014 19.995 1.00 0.00 ATOM 200 OE1 GLU 26 22.688 18.756 20.785 1.00 0.00 ATOM 201 OE2 GLU 26 24.718 19.484 20.362 1.00 0.00 ATOM 202 O GLU 26 21.677 20.215 16.301 1.00 0.00 ATOM 203 C GLU 26 22.065 19.113 15.915 1.00 0.00 ATOM 204 N LEU 27 22.735 18.938 14.776 1.00 0.00 ATOM 205 CA LEU 27 23.062 20.047 13.901 1.00 0.00 ATOM 206 CB LEU 27 22.540 19.786 12.487 1.00 0.00 ATOM 207 CG LEU 27 21.024 19.869 12.297 1.00 0.00 ATOM 208 CD1 LEU 27 20.672 19.968 10.821 1.00 0.00 ATOM 209 CD2 LEU 27 20.343 18.634 12.867 1.00 0.00 ATOM 210 O LEU 27 22.556 22.382 13.757 1.00 0.00 ATOM 211 C LEU 27 22.440 21.343 14.403 1.00 0.00 ATOM 212 N ILE 28 21.781 21.279 15.562 1.00 0.00 ATOM 213 CA ILE 28 21.146 22.443 16.147 1.00 0.00 ATOM 214 CB ILE 28 21.871 22.898 17.427 1.00 0.00 ATOM 215 CG1 ILE 28 23.318 23.283 17.113 1.00 0.00 ATOM 216 CG2 ILE 28 21.884 21.780 18.458 1.00 0.00 ATOM 217 CD1 ILE 28 24.039 23.944 18.267 1.00 0.00 ATOM 218 O ILE 28 21.284 24.765 15.587 1.00 0.00 ATOM 219 C ILE 28 21.149 23.615 15.176 1.00 0.00 ATOM 220 N CYS 29 21.000 23.319 13.882 1.00 0.00 ATOM 221 CA CYS 29 20.987 24.345 12.859 1.00 0.00 ATOM 222 CB CYS 29 19.733 25.212 12.986 1.00 0.00 ATOM 223 SG CYS 29 19.627 26.152 14.527 1.00 0.00 ATOM 224 O CYS 29 22.924 25.459 12.003 1.00 0.00 ATOM 225 C CYS 29 22.204 25.252 12.978 1.00 0.00 ATOM 226 N LYS 30 22.431 25.794 14.176 1.00 0.00 ATOM 227 CA LYS 30 23.557 26.675 14.417 1.00 0.00 ATOM 228 CB LYS 30 23.901 26.709 15.907 1.00 0.00 ATOM 229 CG LYS 30 25.021 27.673 16.264 1.00 0.00 ATOM 230 CD LYS 30 25.254 27.718 17.765 1.00 0.00 ATOM 231 CE LYS 30 26.393 28.660 18.119 1.00 0.00 ATOM 232 NZ LYS 30 26.619 28.730 19.589 1.00 0.00 ATOM 233 O LYS 30 24.982 26.568 12.497 1.00 0.00 ATOM 234 C LYS 30 24.790 26.208 13.657 1.00 0.00 ATOM 235 N GLY 31 25.629 25.404 14.314 1.00 0.00 ATOM 236 CA GLY 31 26.837 24.892 13.701 1.00 0.00 ATOM 237 O GLY 31 27.069 23.882 11.546 1.00 0.00 ATOM 238 C GLY 31 26.496 23.865 12.631 1.00 0.00 ATOM 239 N ASP 32 25.557 22.969 12.941 1.00 0.00 ATOM 240 CA ASP 32 25.142 21.940 12.009 1.00 0.00 ATOM 241 CB ASP 32 23.974 21.136 12.584 1.00 0.00 ATOM 242 CG ASP 32 24.399 20.222 13.717 1.00 0.00 ATOM 243 OD1 ASP 32 25.619 20.024 13.895 1.00 0.00 ATOM 244 OD2 ASP 32 23.511 19.703 14.426 1.00 0.00 ATOM 245 O ASP 32 23.940 21.927 9.941 1.00 0.00 ATOM 246 C ASP 32 24.693 22.547 10.687 1.00 0.00 ATOM 247 N ARG 33 25.159 23.764 10.399 1.00 0.00 ATOM 248 CA ARG 33 24.806 24.449 9.173 1.00 0.00 ATOM 249 CB ARG 33 25.418 23.736 7.965 1.00 0.00 ATOM 250 CG ARG 33 26.934 23.814 7.901 1.00 0.00 ATOM 251 CD ARG 33 27.475 23.064 6.695 1.00 0.00 ATOM 252 NE ARG 33 28.934 23.111 6.629 1.00 0.00 ATOM 253 CZ ARG 33 29.661 22.480 5.714 1.00 0.00 ATOM 254 NH1 ARG 33 30.983 22.581 5.733 1.00 0.00 ATOM 255 NH2 ARG 33 29.066 21.748 4.783 1.00 0.00 ATOM 256 O ARG 33 22.658 25.501 9.269 1.00 0.00 ATOM 257 C ARG 33 23.295 24.490 8.984 1.00 0.00 ATOM 258 N LEU 34 22.725 23.385 8.500 1.00 0.00 ATOM 259 CA LEU 34 21.296 23.297 8.274 1.00 0.00 ATOM 260 CB LEU 34 20.906 21.877 7.859 1.00 0.00 ATOM 261 CG LEU 34 21.463 21.384 6.522 1.00 0.00 ATOM 262 CD1 LEU 34 21.107 19.923 6.297 1.00 0.00 ATOM 263 CD2 LEU 34 20.893 22.196 5.369 1.00 0.00 ATOM 264 O LEU 34 19.294 23.739 9.508 1.00 0.00 ATOM 265 C LEU 34 20.519 23.652 9.534 1.00 0.00 ATOM 266 N ALA 35 21.236 23.858 10.641 1.00 0.00 ATOM 267 CA ALA 35 20.616 24.201 11.904 1.00 0.00 ATOM 268 CB ALA 35 20.514 25.711 12.052 1.00 0.00 ATOM 269 O ALA 35 18.435 24.005 12.870 1.00 0.00 ATOM 270 C ALA 35 19.213 23.619 12.001 1.00 0.00 ATOM 271 N PHE 36 18.891 22.684 11.104 1.00 0.00 ATOM 272 CA PHE 36 17.587 22.053 11.091 1.00 0.00 ATOM 273 CB PHE 36 17.726 20.540 10.909 1.00 0.00 ATOM 274 CG PHE 36 16.424 19.840 10.640 1.00 0.00 ATOM 275 CD1 PHE 36 15.832 19.905 9.391 1.00 0.00 ATOM 276 CD2 PHE 36 15.792 19.117 11.636 1.00 0.00 ATOM 277 CE1 PHE 36 14.634 19.261 9.144 1.00 0.00 ATOM 278 CE2 PHE 36 14.594 18.473 11.389 1.00 0.00 ATOM 279 CZ PHE 36 14.015 18.543 10.149 1.00 0.00 ATOM 280 O PHE 36 16.054 23.244 12.491 1.00 0.00 ATOM 281 C PHE 36 16.842 22.307 12.396 1.00 0.00 ATOM 282 N PRO 37 17.089 21.469 13.407 1.00 0.00 ATOM 283 CA PRO 37 16.503 21.697 14.715 1.00 0.00 ATOM 284 CB PRO 37 17.380 20.875 15.662 1.00 0.00 ATOM 285 CG PRO 37 18.706 20.812 14.982 1.00 0.00 ATOM 286 CD PRO 37 18.417 20.748 13.508 1.00 0.00 ATOM 287 O PRO 37 16.341 23.539 16.234 1.00 0.00 ATOM 288 C PRO 37 16.529 23.176 15.074 1.00 0.00 ATOM 289 N ILE 38 16.762 24.031 14.076 1.00 0.00 ATOM 290 CA ILE 38 16.811 25.463 14.290 1.00 0.00 ATOM 291 CB ILE 38 16.649 26.237 12.969 1.00 0.00 ATOM 292 CG1 ILE 38 17.862 26.008 12.064 1.00 0.00 ATOM 293 CG2 ILE 38 16.524 27.729 13.237 1.00 0.00 ATOM 294 CD1 ILE 38 17.695 26.564 10.667 1.00 0.00 ATOM 295 O ILE 38 15.937 26.697 16.146 1.00 0.00 ATOM 296 C ILE 38 15.700 25.916 15.227 1.00 0.00 ATOM 297 N LYS 39 14.482 25.421 14.992 1.00 0.00 ATOM 298 CA LYS 39 13.341 25.775 15.812 1.00 0.00 ATOM 299 CB LYS 39 12.673 24.518 16.372 1.00 0.00 ATOM 300 CG LYS 39 11.399 24.788 17.156 1.00 0.00 ATOM 301 CD LYS 39 10.807 23.502 17.709 1.00 0.00 ATOM 302 CE LYS 39 10.217 22.645 16.601 1.00 0.00 ATOM 303 NZ LYS 39 9.051 23.304 15.951 1.00 0.00 ATOM 304 O LYS 39 12.946 27.395 17.528 1.00 0.00 ATOM 305 C LYS 39 13.758 26.651 16.985 1.00 0.00 ATOM 306 N ASP 40 15.033 26.561 17.374 1.00 0.00 ATOM 307 CA ASP 40 15.554 27.342 18.477 1.00 0.00 ATOM 308 CB ASP 40 14.921 28.735 18.494 1.00 0.00 ATOM 309 CG ASP 40 15.413 29.612 17.359 1.00 0.00 ATOM 310 OD1 ASP 40 16.421 29.245 16.719 1.00 0.00 ATOM 311 OD2 ASP 40 14.790 30.666 17.110 1.00 0.00 ATOM 312 O ASP 40 16.094 26.678 20.711 1.00 0.00 ATOM 313 C ASP 40 15.258 26.672 19.811 1.00 0.00 ATOM 314 N GLY 41 14.063 26.090 19.936 1.00 0.00 ATOM 315 CA GLY 41 13.662 25.420 21.156 1.00 0.00 ATOM 316 O GLY 41 13.414 23.074 21.559 1.00 0.00 ATOM 317 C GLY 41 14.143 23.975 21.151 1.00 0.00 ATOM 318 N ILE 42 15.374 23.758 20.684 1.00 0.00 ATOM 319 CA ILE 42 15.948 22.428 20.626 1.00 0.00 ATOM 320 CB ILE 42 15.576 21.598 21.869 1.00 0.00 ATOM 321 CG1 ILE 42 16.136 22.252 23.134 1.00 0.00 ATOM 322 CG2 ILE 42 16.146 20.192 21.761 1.00 0.00 ATOM 323 CD1 ILE 42 15.635 21.627 24.417 1.00 0.00 ATOM 324 O ILE 42 16.051 21.758 18.332 1.00 0.00 ATOM 325 C ILE 42 15.452 21.671 19.402 1.00 0.00 ATOM 326 N PRO 43 14.353 20.924 19.554 1.00 0.00 ATOM 327 CA PRO 43 13.754 20.254 18.416 1.00 0.00 ATOM 328 CB PRO 43 12.323 20.793 18.380 1.00 0.00 ATOM 329 CG PRO 43 12.043 21.205 19.787 1.00 0.00 ATOM 330 CD PRO 43 13.333 21.762 20.322 1.00 0.00 ATOM 331 O PRO 43 14.245 19.979 16.089 1.00 0.00 ATOM 332 C PRO 43 14.502 20.578 17.130 1.00 0.00 ATOM 333 N MET 44 15.433 21.532 17.207 1.00 0.00 ATOM 334 CA MET 44 16.214 21.934 16.054 1.00 0.00 ATOM 335 CB MET 44 17.683 21.549 16.241 1.00 0.00 ATOM 336 CG MET 44 17.927 20.051 16.317 1.00 0.00 ATOM 337 SD MET 44 19.662 19.642 16.590 1.00 0.00 ATOM 338 CE MET 44 19.830 20.021 18.332 1.00 0.00 ATOM 339 O MET 44 15.502 21.920 13.769 1.00 0.00 ATOM 340 C MET 44 15.707 21.261 14.786 1.00 0.00 ATOM 341 N MET 45 15.504 19.942 14.850 1.00 0.00 ATOM 342 CA MET 45 15.023 19.186 13.712 1.00 0.00 ATOM 343 CB MET 45 14.861 17.710 14.079 1.00 0.00 ATOM 344 CG MET 45 14.407 16.829 12.926 1.00 0.00 ATOM 345 SD MET 45 14.254 15.095 13.393 1.00 0.00 ATOM 346 CE MET 45 12.785 15.148 14.417 1.00 0.00 ATOM 347 O MET 45 13.609 20.555 12.352 1.00 0.00 ATOM 348 C MET 45 13.673 19.707 13.240 1.00 0.00 ATOM 349 N LEU 46 12.593 19.196 13.837 1.00 0.00 ATOM 350 CA LEU 46 11.252 19.610 13.476 1.00 0.00 ATOM 351 CB LEU 46 10.231 19.038 14.461 1.00 0.00 ATOM 352 CG LEU 46 10.076 17.516 14.469 1.00 0.00 ATOM 353 CD1 LEU 46 9.118 17.079 15.567 1.00 0.00 ATOM 354 CD2 LEU 46 9.529 17.024 13.138 1.00 0.00 ATOM 355 O LEU 46 10.042 21.662 13.260 1.00 0.00 ATOM 356 C LEU 46 11.125 21.126 13.490 1.00 0.00 ATOM 357 N GLU 47 12.234 21.817 13.761 1.00 0.00 ATOM 358 CA GLU 47 12.241 23.266 13.806 1.00 0.00 ATOM 359 CB GLU 47 13.276 23.827 12.829 1.00 0.00 ATOM 360 CG GLU 47 12.974 23.534 11.369 1.00 0.00 ATOM 361 CD GLU 47 14.052 24.050 10.436 1.00 0.00 ATOM 362 OE1 GLU 47 15.051 24.609 10.934 1.00 0.00 ATOM 363 OE2 GLU 47 13.897 23.896 9.206 1.00 0.00 ATOM 364 O GLU 47 10.322 24.649 14.159 1.00 0.00 ATOM 365 C GLU 47 10.880 23.833 13.430 1.00 0.00 ATOM 366 N SER 48 10.346 23.398 12.286 1.00 0.00 ATOM 367 CA SER 48 9.055 23.861 11.818 1.00 0.00 ATOM 368 CB SER 48 8.169 22.676 11.430 1.00 0.00 ATOM 369 OG SER 48 6.895 23.113 10.992 1.00 0.00 ATOM 370 O SER 48 7.107 24.695 12.931 1.00 0.00 ATOM 371 C SER 48 8.335 24.657 12.898 1.00 0.00 ATOM 372 N GLU 49 9.104 25.295 13.783 1.00 0.00 ATOM 373 CA GLU 49 8.540 26.086 14.858 1.00 0.00 ATOM 374 CB GLU 49 7.738 27.261 14.295 1.00 0.00 ATOM 375 CG GLU 49 8.584 28.310 13.592 1.00 0.00 ATOM 376 CD GLU 49 7.754 29.449 13.033 1.00 0.00 ATOM 377 OE1 GLU 49 6.516 29.418 13.196 1.00 0.00 ATOM 378 OE2 GLU 49 8.342 30.373 12.433 1.00 0.00 ATOM 379 O GLU 49 7.928 24.943 16.871 1.00 0.00 ATOM 380 C GLU 49 7.609 25.250 15.724 1.00 0.00 ATOM 381 N ALA 50 6.452 24.878 15.170 1.00 0.00 ATOM 382 CA ALA 50 5.479 24.080 15.890 1.00 0.00 ATOM 383 CB ALA 50 4.945 22.966 15.002 1.00 0.00 ATOM 384 O ALA 50 5.743 23.790 18.251 1.00 0.00 ATOM 385 C ALA 50 6.100 23.445 17.128 1.00 0.00 ATOM 386 N ARG 51 7.033 22.513 16.916 1.00 0.00 ATOM 387 CA ARG 51 7.698 21.835 18.010 1.00 0.00 ATOM 388 CB ARG 51 9.094 21.375 17.586 1.00 0.00 ATOM 389 CG ARG 51 9.843 20.597 18.655 1.00 0.00 ATOM 390 CD ARG 51 9.182 19.255 18.927 1.00 0.00 ATOM 391 NE ARG 51 9.931 18.463 19.899 1.00 0.00 ATOM 392 CZ ARG 51 9.487 17.335 20.444 1.00 0.00 ATOM 393 NH1 ARG 51 10.239 16.681 21.319 1.00 0.00 ATOM 394 NH2 ARG 51 8.293 16.863 20.112 1.00 0.00 ATOM 395 O ARG 51 7.609 22.342 20.347 1.00 0.00 ATOM 396 C ARG 51 7.848 22.753 19.213 1.00 0.00 ATOM 397 N GLU 52 8.247 24.004 18.966 1.00 0.00 ATOM 398 CA GLU 52 8.427 24.974 20.027 1.00 0.00 ATOM 399 CB GLU 52 8.208 26.393 19.498 1.00 0.00 ATOM 400 CG GLU 52 6.790 26.667 19.024 1.00 0.00 ATOM 401 CD GLU 52 6.627 28.061 18.450 1.00 0.00 ATOM 402 OE1 GLU 52 7.632 28.801 18.393 1.00 0.00 ATOM 403 OE2 GLU 52 5.495 28.412 18.056 1.00 0.00 ATOM 404 O GLU 52 7.115 25.656 21.908 1.00 0.00 ATOM 405 C GLU 52 7.442 24.736 21.162 1.00 0.00 ATOM 406 N LEU 53 6.968 23.494 21.291 1.00 0.00 ATOM 407 CA LEU 53 6.024 23.139 22.331 1.00 0.00 ATOM 408 CB LEU 53 6.051 24.176 23.456 1.00 0.00 ATOM 409 CG LEU 53 7.335 24.243 24.285 1.00 0.00 ATOM 410 CD1 LEU 53 7.289 25.415 25.253 1.00 0.00 ATOM 411 CD2 LEU 53 7.523 22.967 25.091 1.00 0.00 ATOM 412 O LEU 53 3.950 22.036 21.877 1.00 0.00 ATOM 413 C LEU 53 4.606 23.072 21.783 1.00 0.00 ATOM 414 N ALA 54 4.132 24.180 21.211 1.00 0.00 ATOM 415 CA ALA 54 2.797 24.243 20.652 1.00 0.00 ATOM 416 CB ALA 54 2.594 25.555 19.910 1.00 0.00 ATOM 417 O ALA 54 1.568 23.102 18.945 1.00 0.00 ATOM 418 C ALA 54 2.558 23.103 19.673 1.00 0.00 ATOM 419 N PRO 55 3.467 22.122 19.650 1.00 0.00 ATOM 420 CA PRO 55 3.265 20.947 18.823 1.00 0.00 ATOM 421 CB PRO 55 2.618 19.934 19.770 1.00 0.00 ATOM 422 CG PRO 55 1.916 20.770 20.787 1.00 0.00 ATOM 423 CD PRO 55 2.769 21.991 20.985 1.00 0.00 ATOM 424 O PRO 55 1.753 20.358 17.065 1.00 0.00 ATOM 425 C PRO 55 2.360 21.259 17.640 1.00 0.00 ATOM 426 N GLU 56 2.269 22.540 17.278 1.00 0.00 ATOM 427 CA GLU 56 1.440 22.965 16.168 1.00 0.00 ATOM 428 CB GLU 56 2.271 23.066 14.887 1.00 0.00 ATOM 429 CG GLU 56 3.303 24.182 14.903 1.00 0.00 ATOM 430 CD GLU 56 2.677 25.553 15.068 1.00 0.00 ATOM 431 OE1 GLU 56 1.757 25.883 14.291 1.00 0.00 ATOM 432 OE2 GLU 56 3.106 26.297 15.975 1.00 0.00 ATOM 433 O GLU 56 -0.343 22.025 14.879 1.00 0.00 ATOM 434 C GLU 56 0.308 21.979 15.921 1.00 0.00 ATOM 435 N GLU 57 0.073 21.085 16.884 1.00 0.00 ATOM 436 CA GLU 57 -0.977 20.094 16.768 1.00 0.00 ATOM 437 CB GLU 57 -2.322 20.768 16.490 1.00 0.00 ATOM 438 CG GLU 57 -2.818 21.653 17.623 1.00 0.00 ATOM 439 CD GLU 57 -4.143 22.319 17.304 1.00 0.00 ATOM 440 OE1 GLU 57 -4.661 22.106 16.188 1.00 0.00 ATOM 441 OE2 GLU 57 -4.662 23.053 18.171 1.00 0.00 ATOM 442 O GLU 57 -1.244 18.025 15.594 1.00 0.00 ATOM 443 C GLU 57 -0.692 19.122 15.631 1.00 0.00 ATOM 444 N GLU 58 0.175 19.530 14.702 1.00 0.00 ATOM 445 CA GLU 58 0.531 18.697 13.570 1.00 0.00 ATOM 446 CB GLU 58 1.783 17.874 13.883 1.00 0.00 ATOM 447 CG GLU 58 3.038 18.707 14.087 1.00 0.00 ATOM 448 CD GLU 58 4.264 17.857 14.354 1.00 0.00 ATOM 449 OE1 GLU 58 4.226 17.039 15.298 1.00 0.00 ATOM 450 OE2 GLU 58 5.263 18.007 13.619 1.00 0.00 ATOM 451 O GLU 58 -0.553 17.071 12.189 1.00 0.00 ATOM 452 C GLU 58 -0.595 17.733 13.224 1.00 0.00 ATOM 453 N VAL 59 -1.604 17.655 14.094 1.00 0.00 ATOM 454 CA VAL 59 -2.734 16.775 13.878 1.00 0.00 ATOM 455 CB VAL 59 -3.852 17.476 13.084 1.00 0.00 ATOM 456 CG1 VAL 59 -4.387 18.670 13.859 1.00 0.00 ATOM 457 CG2 VAL 59 -3.325 17.970 11.745 1.00 0.00 ATOM 458 O VAL 59 -3.043 14.540 13.081 1.00 0.00 ATOM 459 C VAL 59 -2.323 15.536 13.096 1.00 0.00 ATOM 460 N LYS 60 -1.159 15.600 12.444 1.00 0.00 ATOM 461 CA LYS 60 -0.657 14.487 11.664 1.00 0.00 ATOM 462 CB LYS 60 -0.083 13.406 12.581 1.00 0.00 ATOM 463 CG LYS 60 1.331 13.687 13.063 1.00 0.00 ATOM 464 CD LYS 60 1.347 14.778 14.122 1.00 0.00 ATOM 465 CE LYS 60 2.764 15.089 14.573 1.00 0.00 ATOM 466 NZ LYS 60 2.799 16.191 15.574 1.00 0.00 ATOM 467 O LYS 60 -1.526 13.425 9.704 1.00 0.00 ATOM 468 C LYS 60 -1.764 13.859 10.828 1.00 0.00 ATOM 469 N LEU 61 -2.977 13.814 11.382 1.00 0.00 ATOM 470 CA LEU 61 -4.114 13.241 10.689 1.00 0.00 ATOM 471 CB LEU 61 -5.280 14.231 10.662 1.00 0.00 ATOM 472 CG LEU 61 -5.782 14.725 12.020 1.00 0.00 ATOM 473 CD1 LEU 61 -6.844 15.799 11.843 1.00 0.00 ATOM 474 CD2 LEU 61 -6.390 13.581 12.817 1.00 0.00 ATOM 475 O LEU 61 -4.096 11.808 8.773 1.00 0.00 ATOM 476 C LEU 61 -3.758 12.889 9.251 1.00 0.00 ATOM 477 N GLU 62 -3.074 13.806 8.563 1.00 0.00 ATOM 478 CA GLU 62 -2.676 13.589 7.187 1.00 0.00 ATOM 479 CB GLU 62 -1.151 13.590 7.064 1.00 0.00 ATOM 480 CG GLU 62 -0.643 13.431 5.640 1.00 0.00 ATOM 481 CD GLU 62 0.869 13.490 5.551 1.00 0.00 ATOM 482 OE1 GLU 62 1.520 13.657 6.603 1.00 0.00 ATOM 483 OE2 GLU 62 1.403 13.368 4.428 1.00 0.00 ATOM 484 O GLU 62 -2.730 11.762 5.643 1.00 0.00 ATOM 485 C GLU 62 -3.191 12.253 6.671 1.00 0.00 ATOM 486 N HIS 63 -4.149 11.663 7.390 1.00 0.00 ATOM 487 CA HIS 63 -4.722 10.390 7.004 1.00 0.00 ATOM 488 CB HIS 63 -4.464 10.114 5.522 1.00 0.00 ATOM 489 CG HIS 63 -5.117 11.097 4.601 1.00 0.00 ATOM 490 CD2 HIS 63 -4.659 12.192 3.758 1.00 0.00 ATOM 491 ND1 HIS 63 -6.476 11.117 4.376 1.00 0.00 ATOM 492 CE1 HIS 63 -6.761 12.105 3.508 1.00 0.00 ATOM 493 NE2 HIS 63 -5.676 12.754 3.133 1.00 0.00 ATOM 494 O HIS 63 -4.086 8.110 7.354 1.00 0.00 ATOM 495 C HIS 63 -4.116 9.251 7.811 1.00 0.00 ATOM 496 N HIS 64 -3.631 9.562 9.015 1.00 0.00 ATOM 497 CA HIS 64 -3.028 8.566 9.878 1.00 0.00 ATOM 498 CB HIS 64 -3.209 7.166 9.289 1.00 0.00 ATOM 499 CG HIS 64 -4.625 6.679 9.313 1.00 0.00 ATOM 500 CD2 HIS 64 -5.631 6.362 8.310 1.00 0.00 ATOM 501 ND1 HIS 64 -5.301 6.413 10.484 1.00 0.00 ATOM 502 CE1 HIS 64 -6.544 5.994 10.187 1.00 0.00 ATOM 503 NE2 HIS 64 -6.749 5.961 8.884 1.00 0.00 ATOM 504 O HIS 64 -0.981 8.581 11.118 1.00 0.00 ATOM 505 C HIS 64 -1.537 8.819 10.047 1.00 0.00 ATOM 506 N HIS 65 -0.888 9.300 8.985 1.00 0.00 ATOM 507 CA HIS 65 0.533 9.582 9.018 1.00 0.00 ATOM 508 CB HIS 65 1.104 9.623 7.599 1.00 0.00 ATOM 509 CG HIS 65 1.097 8.295 6.907 1.00 0.00 ATOM 510 CD2 HIS 65 0.336 7.696 5.820 1.00 0.00 ATOM 511 ND1 HIS 65 1.952 7.271 7.251 1.00 0.00 ATOM 512 CE1 HIS 65 1.709 6.213 6.458 1.00 0.00 ATOM 513 NE2 HIS 65 0.741 6.460 5.597 1.00 0.00 ATOM 514 O HIS 65 1.959 11.251 9.970 1.00 0.00 ATOM 515 C HIS 65 0.811 10.925 9.678 1.00 0.00 ATOM 516 N HIS 66 -0.247 11.706 9.911 1.00 0.00 ATOM 517 CA HIS 66 -0.115 13.008 10.534 1.00 0.00 ATOM 518 CB HIS 66 -0.805 13.021 11.900 1.00 0.00 ATOM 519 CG HIS 66 -0.169 12.114 12.906 1.00 0.00 ATOM 520 CD2 HIS 66 0.747 12.283 14.024 1.00 0.00 ATOM 521 ND1 HIS 66 -0.394 10.754 12.930 1.00 0.00 ATOM 522 CE1 HIS 66 0.309 10.212 13.940 1.00 0.00 ATOM 523 NE2 HIS 66 0.996 11.123 14.600 1.00 0.00 ATOM 524 O HIS 66 1.662 14.477 11.174 1.00 0.00 ATOM 525 C HIS 66 1.349 13.371 10.740 1.00 0.00 ATOM 526 N HIS 67 2.246 12.433 10.427 1.00 0.00 ATOM 527 CA HIS 67 3.670 12.657 10.577 1.00 0.00 ATOM 528 CB HIS 67 4.446 11.921 9.483 1.00 0.00 ATOM 529 CG HIS 67 5.932 12.064 9.596 1.00 0.00 ATOM 530 CD2 HIS 67 6.944 12.909 8.979 1.00 0.00 ATOM 531 ND1 HIS 67 6.692 11.288 10.444 1.00 0.00 ATOM 532 CE1 HIS 67 7.983 11.645 10.326 1.00 0.00 ATOM 533 NE2 HIS 67 8.142 12.617 9.448 1.00 0.00 ATOM 534 O HIS 67 4.898 14.622 11.174 1.00 0.00 ATOM 535 C HIS 67 4.007 14.138 10.480 1.00 0.00 ATOM 536 N HIS 68 3.289 14.858 9.614 1.00 0.00 ATOM 537 CA HIS 68 3.512 16.277 9.429 1.00 0.00 ATOM 538 CB HIS 68 2.228 17.062 9.706 1.00 0.00 ATOM 539 CG HIS 68 2.366 18.538 9.499 1.00 0.00 ATOM 540 CD2 HIS 68 2.415 19.708 10.364 1.00 0.00 ATOM 541 ND1 HIS 68 2.487 19.106 8.250 1.00 0.00 ATOM 542 CE1 HIS 68 2.593 20.441 8.384 1.00 0.00 ATOM 543 NE2 HIS 68 2.550 20.808 9.650 1.00 0.00 ATOM 544 O HIS 68 5.149 16.026 11.156 1.00 0.00 ATOM 545 C HIS 68 4.592 16.790 10.371 1.00 0.00 ENDMDL