EXPDTA T0348TS564_2-scwrl MODEL 1 REMARK 44 REMARK 44 model 1 is called T0348TS564_2-scwrl ATOM 1 N MET A 1 -7.311 -11.098 0.051 1.00 0.00 ATOM 2 CA MET A 1 -6.044 -10.566 -0.418 1.00 0.00 ATOM 3 CB MET A 1 -6.034 -9.039 -0.319 1.00 0.00 ATOM 4 CG MET A 1 -6.985 -8.349 -1.284 1.00 0.00 ATOM 5 SD MET A 1 -6.993 -6.556 -1.090 1.00 0.00 ATOM 6 CE MET A 1 -5.393 -6.135 -1.777 1.00 0.00 ATOM 7 O MET A 1 -5.114 -11.815 1.420 1.00 0.00 ATOM 8 C MET A 1 -4.898 -11.115 0.426 1.00 0.00 ATOM 9 N ASP A 2 -3.663 -10.805 0.021 1.00 0.00 ATOM 10 CA ASP A 2 -2.474 -11.153 0.786 1.00 0.00 ATOM 11 CB ASP A 2 -1.210 -10.844 -0.019 1.00 0.00 ATOM 12 CG ASP A 2 -0.993 -11.818 -1.160 1.00 0.00 ATOM 13 OD1 ASP A 2 -1.701 -12.846 -1.206 1.00 0.00 ATOM 14 OD2 ASP A 2 -0.116 -11.554 -2.009 1.00 0.00 ATOM 15 O ASP A 2 -2.804 -9.233 2.208 1.00 0.00 ATOM 16 C ASP A 2 -2.376 -10.382 2.101 1.00 0.00 ATOM 17 N ALA A 3 -1.766 -11.036 3.095 1.00 0.00 ATOM 18 CA ALA A 3 -1.591 -10.479 4.427 1.00 0.00 ATOM 19 CB ALA A 3 -0.970 -11.511 5.356 1.00 0.00 ATOM 20 O ALA A 3 -1.024 -8.281 5.155 1.00 0.00 ATOM 21 C ALA A 3 -0.689 -9.252 4.474 1.00 0.00 ATOM 22 N LYS A 4 0.433 -9.258 3.735 1.00 0.00 ATOM 23 CA LYS A 4 1.324 -8.102 3.675 1.00 0.00 ATOM 24 CB LYS A 4 2.592 -8.443 2.890 1.00 0.00 ATOM 25 CG LYS A 4 3.525 -9.407 3.605 1.00 0.00 ATOM 26 CD LYS A 4 4.763 -9.697 2.773 1.00 0.00 ATOM 27 CE LYS A 4 5.680 -10.687 3.474 1.00 0.00 ATOM 28 NZ LYS A 4 6.886 -10.999 2.659 1.00 0.00 ATOM 29 O LYS A 4 0.820 -5.772 3.414 1.00 0.00 ATOM 30 C LYS A 4 0.654 -6.918 2.992 1.00 0.00 ATOM 31 N PHE A 5 -0.130 -7.198 1.941 1.00 0.00 ATOM 32 CA PHE A 5 -0.946 -6.181 1.293 1.00 0.00 ATOM 33 CB PHE A 5 -1.670 -6.768 0.080 1.00 0.00 ATOM 34 CG PHE A 5 -0.798 -6.917 -1.133 1.00 0.00 ATOM 35 CD1 PHE A 5 -0.271 -8.150 -1.478 1.00 0.00 ATOM 36 CD2 PHE A 5 -0.504 -5.825 -1.931 1.00 0.00 ATOM 37 CE1 PHE A 5 0.532 -8.287 -2.594 1.00 0.00 ATOM 38 CE2 PHE A 5 0.299 -5.962 -3.047 1.00 0.00 ATOM 39 CZ PHE A 5 0.816 -7.187 -3.380 1.00 0.00 ATOM 40 O PHE A 5 -2.188 -4.411 2.292 1.00 0.00 ATOM 41 C PHE A 5 -1.999 -5.619 2.236 1.00 0.00 ATOM 42 N LEU A 6 -2.666 -6.467 3.023 1.00 0.00 ATOM 43 CA LEU A 6 -3.706 -6.018 3.939 1.00 0.00 ATOM 44 CB LEU A 6 -4.619 -7.183 4.326 1.00 0.00 ATOM 45 CG LEU A 6 -5.409 -7.832 3.188 1.00 0.00 ATOM 46 CD1 LEU A 6 -6.175 -9.047 3.689 1.00 0.00 ATOM 47 CD2 LEU A 6 -6.409 -6.850 2.599 1.00 0.00 ATOM 48 O LEU A 6 -4.051 -5.140 6.141 1.00 0.00 ATOM 49 C LEU A 6 -3.232 -5.421 5.260 1.00 0.00 ATOM 50 N GLU A 7 -1.920 -5.229 5.428 1.00 0.00 ATOM 51 CA GLU A 7 -1.387 -4.638 6.642 1.00 0.00 ATOM 52 CB GLU A 7 -0.114 -5.366 7.079 1.00 0.00 ATOM 53 CG GLU A 7 -0.339 -6.808 7.505 1.00 0.00 ATOM 54 CD GLU A 7 0.952 -7.520 7.856 1.00 0.00 ATOM 55 OE1 GLU A 7 2.027 -6.899 7.726 1.00 0.00 ATOM 56 OE2 GLU A 7 0.888 -8.700 8.261 1.00 0.00 ATOM 57 O GLU A 7 -1.967 -2.361 6.228 1.00 0.00 ATOM 58 C GLU A 7 -1.047 -3.162 6.413 1.00 0.00 ATOM 59 N ILE A 8 0.227 -2.738 6.413 1.00 0.00 ATOM 60 CA ILE A 8 0.593 -1.339 6.242 1.00 0.00 ATOM 61 CB ILE A 8 1.188 -0.749 7.534 1.00 0.00 ATOM 62 CG1 ILE A 8 0.170 -0.828 8.674 1.00 0.00 ATOM 63 CG2 ILE A 8 1.568 0.709 7.328 1.00 0.00 ATOM 64 CD1 ILE A 8 0.732 -0.433 10.022 1.00 0.00 ATOM 65 O ILE A 8 2.672 -1.927 5.184 1.00 0.00 ATOM 66 C ILE A 8 1.629 -1.272 5.128 1.00 0.00 ATOM 67 N LEU A 9 1.331 -0.483 4.097 1.00 0.00 ATOM 68 CA LEU A 9 2.294 -0.224 3.037 1.00 0.00 ATOM 69 CB LEU A 9 1.596 -0.191 1.676 1.00 0.00 ATOM 70 CG LEU A 9 0.855 -1.464 1.263 1.00 0.00 ATOM 71 CD1 LEU A 9 0.146 -1.266 -0.068 1.00 0.00 ATOM 72 CD2 LEU A 9 1.824 -2.627 1.117 1.00 0.00 ATOM 73 O LEU A 9 2.384 2.013 3.899 1.00 0.00 ATOM 74 C LEU A 9 2.967 1.121 3.282 1.00 0.00 ATOM 75 N VAL A 10 4.216 1.277 2.842 1.00 0.00 ATOM 76 CA VAL A 10 4.865 2.579 2.835 1.00 0.00 ATOM 77 CB VAL A 10 6.177 2.560 3.641 1.00 0.00 ATOM 78 CG1 VAL A 10 6.850 3.923 3.596 1.00 0.00 ATOM 79 CG2 VAL A 10 5.904 2.206 5.095 1.00 0.00 ATOM 80 O VAL A 10 5.915 2.195 0.712 1.00 0.00 ATOM 81 C VAL A 10 5.149 2.899 1.374 1.00 0.00 ATOM 82 N CYS A 11 4.503 3.944 0.853 1.00 0.00 ATOM 83 CA CYS A 11 4.704 4.334 -0.534 1.00 0.00 ATOM 84 CB CYS A 11 3.406 4.884 -1.129 1.00 0.00 ATOM 85 SG CYS A 11 3.537 5.399 -2.857 1.00 0.00 ATOM 86 O CYS A 11 5.648 6.469 -0.083 1.00 0.00 ATOM 87 C CYS A 11 5.763 5.410 -0.701 1.00 0.00 ATOM 88 N PRO A 12 6.814 5.192 -1.507 1.00 0.00 ATOM 89 CA PRO A 12 7.768 6.220 -1.918 1.00 0.00 ATOM 90 CB PRO A 12 8.781 5.462 -2.778 1.00 0.00 ATOM 91 CG PRO A 12 8.035 4.266 -3.267 1.00 0.00 ATOM 92 CD PRO A 12 7.109 3.868 -2.152 1.00 0.00 ATOM 93 O PRO A 12 7.720 8.466 -2.745 1.00 0.00 ATOM 94 C PRO A 12 7.161 7.368 -2.721 1.00 0.00 ATOM 95 N LEU A 13 6.016 7.133 -3.379 1.00 0.00 ATOM 96 CA LEU A 13 5.266 8.190 -4.046 1.00 0.00 ATOM 97 CB LEU A 13 4.107 7.599 -4.851 1.00 0.00 ATOM 98 CG LEU A 13 4.487 6.791 -6.094 1.00 0.00 ATOM 99 CD1 LEU A 13 3.264 6.109 -6.687 1.00 0.00 ATOM 100 CD2 LEU A 13 5.090 7.695 -7.158 1.00 0.00 ATOM 101 O LEU A 13 4.907 10.400 -3.185 1.00 0.00 ATOM 102 C LEU A 13 4.670 9.197 -3.067 1.00 0.00 ATOM 103 N CYS A 14 3.917 8.711 -2.073 1.00 0.00 ATOM 104 CA CYS A 14 3.304 9.577 -1.073 1.00 0.00 ATOM 105 CB CYS A 14 2.122 8.871 -0.405 1.00 0.00 ATOM 106 SG CYS A 14 0.721 8.557 -1.504 1.00 0.00 ATOM 107 O CYS A 14 4.016 11.005 0.721 1.00 0.00 ATOM 108 C CYS A 14 4.245 9.999 0.047 1.00 0.00 ATOM 109 N LYS A 15 5.310 9.206 0.237 1.00 0.00 ATOM 110 CA LYS A 15 6.283 9.347 1.317 1.00 0.00 ATOM 111 CB LYS A 15 6.965 10.715 1.248 1.00 0.00 ATOM 112 CG LYS A 15 7.793 10.933 -0.008 1.00 0.00 ATOM 113 CD LYS A 15 8.452 12.303 -0.003 1.00 0.00 ATOM 114 CE LYS A 15 9.252 12.535 -1.275 1.00 0.00 ATOM 115 NZ LYS A 15 9.815 13.912 -1.333 1.00 0.00 ATOM 116 O LYS A 15 5.945 9.990 3.633 1.00 0.00 ATOM 117 C LYS A 15 5.659 9.227 2.706 1.00 0.00 ATOM 118 N GLY A 16 4.796 8.215 2.846 1.00 0.00 ATOM 119 CA GLY A 16 4.070 7.996 4.086 1.00 0.00 ATOM 120 O GLY A 16 3.459 5.850 3.208 1.00 0.00 ATOM 121 C GLY A 16 3.444 6.607 4.183 1.00 0.00 ATOM 122 N PRO A 17 2.920 6.222 5.359 1.00 0.00 ATOM 123 CA PRO A 17 2.203 4.965 5.572 1.00 0.00 ATOM 124 CB PRO A 17 2.192 4.798 7.093 1.00 0.00 ATOM 125 CG PRO A 17 2.206 6.193 7.622 1.00 0.00 ATOM 126 CD PRO A 17 3.063 6.989 6.678 1.00 0.00 ATOM 127 O PRO A 17 0.073 5.935 4.951 1.00 0.00 ATOM 128 C PRO A 17 0.770 4.921 5.048 1.00 0.00 ATOM 129 N LEU A 18 0.346 3.701 4.708 1.00 0.00 ATOM 130 CA LEU A 18 -0.951 3.447 4.104 1.00 0.00 ATOM 131 CB LEU A 18 -0.784 2.921 2.677 1.00 0.00 ATOM 132 CG LEU A 18 -0.128 3.874 1.676 1.00 0.00 ATOM 133 CD1 LEU A 18 0.138 3.167 0.356 1.00 0.00 ATOM 134 CD2 LEU A 18 -1.028 5.069 1.402 1.00 0.00 ATOM 135 O LEU A 18 -1.246 1.316 5.172 1.00 0.00 ATOM 136 C LEU A 18 -1.732 2.416 4.898 1.00 0.00 ATOM 137 N VAL A 19 -2.962 2.785 5.261 1.00 0.00 ATOM 138 CA VAL A 19 -3.835 1.919 6.037 1.00 0.00 ATOM 139 CB VAL A 19 -4.565 2.700 7.146 1.00 0.00 ATOM 140 CG1 VAL A 19 -5.500 1.782 7.917 1.00 0.00 ATOM 141 CG2 VAL A 19 -3.564 3.298 8.123 1.00 0.00 ATOM 142 O VAL A 19 -5.647 1.999 4.450 1.00 0.00 ATOM 143 C VAL A 19 -4.875 1.301 5.112 1.00 0.00 ATOM 144 N PHE A 20 -4.879 -0.031 5.057 1.00 0.00 ATOM 145 CA PHE A 20 -5.844 -0.761 4.251 1.00 0.00 ATOM 146 CB PHE A 20 -5.251 -2.090 3.778 1.00 0.00 ATOM 147 CG PHE A 20 -4.116 -1.935 2.806 1.00 0.00 ATOM 148 CD1 PHE A 20 -2.804 -1.933 3.247 1.00 0.00 ATOM 149 CD2 PHE A 20 -4.359 -1.791 1.452 1.00 0.00 ATOM 150 CE1 PHE A 20 -1.759 -1.791 2.354 1.00 0.00 ATOM 151 CE2 PHE A 20 -3.315 -1.649 0.558 1.00 0.00 ATOM 152 CZ PHE A 20 -2.019 -1.648 1.004 1.00 0.00 ATOM 153 O PHE A 20 -7.158 -2.007 5.846 1.00 0.00 ATOM 154 C PHE A 20 -7.099 -1.054 5.063 1.00 0.00 ATOM 155 N ASP A 21 -8.107 -0.193 4.895 1.00 0.00 ATOM 156 CA ASP A 21 -9.374 -0.356 5.589 1.00 0.00 ATOM 157 CB ASP A 21 -10.167 0.952 5.571 1.00 0.00 ATOM 158 CG ASP A 21 -11.469 0.855 6.342 1.00 0.00 ATOM 159 OD1 ASP A 21 -11.792 -0.250 6.825 1.00 0.00 ATOM 160 OD2 ASP A 21 -12.166 1.884 6.462 1.00 0.00 ATOM 161 O ASP A 21 -10.645 -1.319 3.765 1.00 0.00 ATOM 162 C ASP A 21 -10.199 -1.438 4.908 1.00 0.00 ATOM 163 N LYS A 22 -10.412 -2.505 5.674 1.00 0.00 ATOM 164 CA LYS A 22 -11.098 -3.685 5.177 1.00 0.00 ATOM 165 CB LYS A 22 -10.753 -4.906 6.033 1.00 0.00 ATOM 166 CG LYS A 22 -9.302 -5.346 5.929 1.00 0.00 ATOM 167 CD LYS A 22 -9.027 -6.552 6.812 1.00 0.00 ATOM 168 CE LYS A 22 -7.582 -7.009 6.688 1.00 0.00 ATOM 169 NZ LYS A 22 -7.303 -8.204 7.532 1.00 0.00 ATOM 170 O LYS A 22 -13.283 -4.253 4.405 1.00 0.00 ATOM 171 C LYS A 22 -12.616 -3.569 5.180 1.00 0.00 ATOM 172 N SER A 23 -13.192 -2.701 6.022 1.00 0.00 ATOM 173 CA SER A 23 -14.642 -2.601 6.132 1.00 0.00 ATOM 174 CB SER A 23 -15.036 -1.967 7.468 1.00 0.00 ATOM 175 OG SER A 23 -14.589 -0.625 7.547 1.00 0.00 ATOM 176 O SER A 23 -16.411 -1.961 4.630 1.00 0.00 ATOM 177 C SER A 23 -15.266 -1.751 5.031 1.00 0.00 ATOM 178 N LYS A 24 -14.501 -0.765 4.554 1.00 0.00 ATOM 179 CA LYS A 24 -14.910 0.067 3.432 1.00 0.00 ATOM 180 CB LYS A 24 -14.409 1.501 3.617 1.00 0.00 ATOM 181 CG LYS A 24 -15.030 2.227 4.800 1.00 0.00 ATOM 182 CD LYS A 24 -14.458 3.627 4.949 1.00 0.00 ATOM 183 CE LYS A 24 -15.086 4.357 6.125 1.00 0.00 ATOM 184 NZ LYS A 24 -14.556 5.742 6.267 1.00 0.00 ATOM 185 O LYS A 24 -14.798 0.004 1.041 1.00 0.00 ATOM 186 C LYS A 24 -14.360 -0.443 2.104 1.00 0.00 ATOM 187 N ASP A 25 -13.398 -1.380 2.170 1.00 0.00 ATOM 188 CA ASP A 25 -12.573 -1.807 1.042 1.00 0.00 ATOM 189 CB ASP A 25 -13.442 -2.434 -0.050 1.00 0.00 ATOM 190 CG ASP A 25 -14.092 -3.730 0.394 1.00 0.00 ATOM 191 OD1 ASP A 25 -13.369 -4.614 0.899 1.00 0.00 ATOM 192 OD2 ASP A 25 -15.324 -3.860 0.237 1.00 0.00 ATOM 193 O ASP A 25 -11.728 -0.472 -0.806 1.00 0.00 ATOM 194 C ASP A 25 -11.810 -0.643 0.412 1.00 0.00 ATOM 195 N GLU A 26 -11.195 0.149 1.291 1.00 0.00 ATOM 196 CA GLU A 26 -10.600 1.421 0.922 1.00 0.00 ATOM 197 CB GLU A 26 -11.382 2.579 1.544 1.00 0.00 ATOM 198 CG GLU A 26 -10.845 3.955 1.186 1.00 0.00 ATOM 199 CD GLU A 26 -11.703 5.077 1.736 1.00 0.00 ATOM 200 OE1 GLU A 26 -12.690 4.780 2.440 1.00 0.00 ATOM 201 OE2 GLU A 26 -11.388 6.255 1.462 1.00 0.00 ATOM 202 O GLU A 26 -8.835 1.172 2.545 1.00 0.00 ATOM 203 C GLU A 26 -9.160 1.505 1.405 1.00 0.00 ATOM 204 N LEU A 27 -8.274 1.931 0.509 1.00 0.00 ATOM 205 CA LEU A 27 -6.911 2.248 0.882 1.00 0.00 ATOM 206 CB LEU A 27 -5.952 1.918 -0.263 1.00 0.00 ATOM 207 CG LEU A 27 -4.472 2.223 -0.017 1.00 0.00 ATOM 208 CD1 LEU A 27 -3.937 1.390 1.137 1.00 0.00 ATOM 209 CD2 LEU A 27 -3.646 1.907 -1.255 1.00 0.00 ATOM 210 O LEU A 27 -6.950 4.602 0.352 1.00 0.00 ATOM 211 C LEU A 27 -6.792 3.729 1.206 1.00 0.00 ATOM 212 N ILE A 28 -6.519 3.980 2.486 1.00 0.00 ATOM 213 CA ILE A 28 -6.330 5.328 2.995 1.00 0.00 ATOM 214 CB ILE A 28 -6.856 5.466 4.436 1.00 0.00 ATOM 215 CG1 ILE A 28 -8.352 5.149 4.490 1.00 0.00 ATOM 216 CG2 ILE A 28 -6.645 6.883 4.946 1.00 0.00 ATOM 217 CD1 ILE A 28 -8.904 5.052 5.896 1.00 0.00 ATOM 218 O ILE A 28 -4.053 5.057 3.739 1.00 0.00 ATOM 219 C ILE A 28 -4.834 5.627 2.971 1.00 0.00 ATOM 220 N CYS A 29 -4.423 6.510 2.060 1.00 0.00 ATOM 221 CA CYS A 29 -3.027 6.900 1.958 1.00 0.00 ATOM 222 CB CYS A 29 -2.505 6.658 0.540 1.00 0.00 ATOM 223 SG CYS A 29 -0.769 7.099 0.298 1.00 0.00 ATOM 224 O CYS A 29 -3.632 9.237 1.986 1.00 0.00 ATOM 225 C CYS A 29 -2.804 8.370 2.277 1.00 0.00 ATOM 226 N LYS A 30 -1.651 8.629 2.895 1.00 0.00 ATOM 227 CA LYS A 30 -1.248 9.974 3.279 1.00 0.00 ATOM 228 CB LYS A 30 -0.313 9.928 4.489 1.00 0.00 ATOM 229 CG LYS A 30 -0.972 9.429 5.764 1.00 0.00 ATOM 230 CD LYS A 30 -0.015 9.497 6.944 1.00 0.00 ATOM 231 CE LYS A 30 -0.666 8.973 8.213 1.00 0.00 ATOM 232 NZ LYS A 30 0.260 9.036 9.378 1.00 0.00 ATOM 233 O LYS A 30 -0.602 10.363 0.991 1.00 0.00 ATOM 234 C LYS A 30 -0.506 10.722 2.167 1.00 0.00 ATOM 235 N GLY A 31 0.205 11.805 2.512 1.00 0.00 ATOM 236 CA GLY A 31 1.082 12.505 1.584 1.00 0.00 ATOM 237 O GLY A 31 -0.339 14.316 0.892 1.00 0.00 ATOM 238 C GLY A 31 0.319 13.328 0.560 1.00 0.00 ATOM 239 N ASP A 32 0.385 12.876 -0.694 1.00 0.00 ATOM 240 CA ASP A 32 -0.266 13.548 -1.811 1.00 0.00 ATOM 241 CB ASP A 32 0.421 13.184 -3.129 1.00 0.00 ATOM 242 CG ASP A 32 1.792 13.816 -3.266 1.00 0.00 ATOM 243 OD1 ASP A 32 2.096 14.748 -2.491 1.00 0.00 ATOM 244 OD2 ASP A 32 2.562 13.380 -4.147 1.00 0.00 ATOM 245 O ASP A 32 -2.403 13.682 -2.903 1.00 0.00 ATOM 246 C ASP A 32 -1.745 13.195 -1.981 1.00 0.00 ATOM 247 N ARG A 33 -2.263 12.359 -1.065 1.00 0.00 ATOM 248 CA ARG A 33 -3.651 11.902 -1.000 1.00 0.00 ATOM 249 CB ARG A 33 -4.612 13.078 -1.186 1.00 0.00 ATOM 250 CG ARG A 33 -4.588 14.085 -0.048 1.00 0.00 ATOM 251 CD ARG A 33 -5.544 15.237 -0.310 1.00 0.00 ATOM 252 NE ARG A 33 -5.509 16.231 0.760 1.00 0.00 ATOM 253 CZ ARG A 33 -6.185 17.375 0.740 1.00 0.00 ATOM 254 NH1 ARG A 33 -6.093 18.219 1.759 1.00 0.00 ATOM 255 NH2 ARG A 33 -6.953 17.673 -0.300 1.00 0.00 ATOM 256 O ARG A 33 -4.645 11.145 -3.083 1.00 0.00 ATOM 257 C ARG A 33 -3.990 10.871 -2.073 1.00 0.00 ATOM 258 N LEU A 34 -3.514 9.647 -1.840 1.00 0.00 ATOM 259 CA LEU A 34 -3.839 8.525 -2.707 1.00 0.00 ATOM 260 CB LEU A 34 -2.616 7.627 -2.903 1.00 0.00 ATOM 261 CG LEU A 34 -1.382 8.288 -3.522 1.00 0.00 ATOM 262 CD1 LEU A 34 -0.222 7.307 -3.586 1.00 0.00 ATOM 263 CD2 LEU A 34 -1.680 8.765 -4.935 1.00 0.00 ATOM 264 O LEU A 34 -5.153 7.641 -0.894 1.00 0.00 ATOM 265 C LEU A 34 -4.957 7.678 -2.113 1.00 0.00 ATOM 266 N ALA A 35 -5.705 6.991 -2.980 1.00 0.00 ATOM 267 CA ALA A 35 -6.781 6.108 -2.554 1.00 0.00 ATOM 268 CB ALA A 35 -8.064 6.898 -2.346 1.00 0.00 ATOM 269 O ALA A 35 -7.036 5.297 -4.797 1.00 0.00 ATOM 270 C ALA A 35 -7.051 5.031 -3.593 1.00 0.00 ATOM 271 N PHE A 36 -7.289 3.802 -3.127 1.00 0.00 ATOM 272 CA PHE A 36 -7.574 2.682 -4.012 1.00 0.00 ATOM 273 CB PHE A 36 -6.289 1.920 -4.343 1.00 0.00 ATOM 274 CG PHE A 36 -6.491 0.774 -5.293 1.00 0.00 ATOM 275 CD1 PHE A 36 -6.558 0.991 -6.658 1.00 0.00 ATOM 276 CD2 PHE A 36 -6.615 -0.521 -4.821 1.00 0.00 ATOM 277 CE1 PHE A 36 -6.744 -0.063 -7.532 1.00 0.00 ATOM 278 CE2 PHE A 36 -6.802 -1.575 -5.695 1.00 0.00 ATOM 279 CZ PHE A 36 -6.866 -1.351 -7.045 1.00 0.00 ATOM 280 O PHE A 36 -8.329 1.254 -2.248 1.00 0.00 ATOM 281 C PHE A 36 -8.551 1.697 -3.375 1.00 0.00 ATOM 282 N PRO A 37 -9.657 1.338 -4.041 1.00 0.00 ATOM 283 CA PRO A 37 -10.555 0.270 -3.610 1.00 0.00 ATOM 284 CB PRO A 37 -11.706 0.326 -4.616 1.00 0.00 ATOM 285 CG PRO A 37 -11.712 1.737 -5.100 1.00 0.00 ATOM 286 CD PRO A 37 -10.269 2.142 -5.220 1.00 0.00 ATOM 287 O PRO A 37 -9.692 -1.718 -4.676 1.00 0.00 ATOM 288 C PRO A 37 -9.899 -1.107 -3.623 1.00 0.00 ATOM 289 N ILE A 38 -9.563 -1.600 -2.425 1.00 0.00 ATOM 290 CA ILE A 38 -8.862 -2.868 -2.276 1.00 0.00 ATOM 291 CB ILE A 38 -8.071 -2.924 -0.956 1.00 0.00 ATOM 292 CG1 ILE A 38 -7.063 -1.775 -0.889 1.00 0.00 ATOM 293 CG2 ILE A 38 -7.313 -4.238 -0.844 1.00 0.00 ATOM 294 CD1 ILE A 38 -6.037 -1.798 -2.001 1.00 0.00 ATOM 295 O ILE A 38 -9.842 -4.876 -1.320 1.00 0.00 ATOM 296 C ILE A 38 -9.770 -4.095 -2.268 1.00 0.00 ATOM 297 N LYS A 39 -10.444 -4.265 -3.407 1.00 0.00 ATOM 298 CA LYS A 39 -11.470 -5.283 -3.572 1.00 0.00 ATOM 299 CB LYS A 39 -12.669 -4.716 -4.334 1.00 0.00 ATOM 300 CG LYS A 39 -13.373 -3.573 -3.622 1.00 0.00 ATOM 301 CD LYS A 39 -14.581 -3.091 -4.410 1.00 0.00 ATOM 302 CE LYS A 39 -15.316 -1.984 -3.672 1.00 0.00 ATOM 303 NZ LYS A 39 -16.533 -1.541 -4.406 1.00 0.00 ATOM 304 O LYS A 39 -9.980 -6.477 -5.039 1.00 0.00 ATOM 305 C LYS A 39 -10.998 -6.507 -4.344 1.00 0.00 ATOM 306 N ASP A 40 -11.737 -7.611 -4.159 1.00 0.00 ATOM 307 CA ASP A 40 -11.631 -8.842 -4.946 1.00 0.00 ATOM 308 CB ASP A 40 -12.007 -8.579 -6.406 1.00 0.00 ATOM 309 CG ASP A 40 -13.415 -8.039 -6.556 1.00 0.00 ATOM 310 OD1 ASP A 40 -14.339 -8.607 -5.936 1.00 0.00 ATOM 311 OD2 ASP A 40 -13.596 -7.047 -7.294 1.00 0.00 ATOM 312 O ASP A 40 -10.107 -10.500 -5.803 1.00 0.00 ATOM 313 C ASP A 40 -10.277 -9.549 -5.037 1.00 0.00 ATOM 314 N GLY A 41 -9.297 -9.126 -4.234 1.00 0.00 ATOM 315 CA GLY A 41 -7.951 -9.674 -4.295 1.00 0.00 ATOM 316 O GLY A 41 -6.170 -9.686 -5.890 1.00 0.00 ATOM 317 C GLY A 41 -7.113 -9.059 -5.407 1.00 0.00 ATOM 318 N ILE A 42 -7.432 -7.826 -5.819 1.00 0.00 ATOM 319 CA ILE A 42 -6.742 -7.174 -6.924 1.00 0.00 ATOM 320 CB ILE A 42 -7.734 -6.663 -7.986 1.00 0.00 ATOM 321 CG1 ILE A 42 -8.551 -7.825 -8.555 1.00 0.00 ATOM 322 CG2 ILE A 42 -6.990 -5.992 -9.130 1.00 0.00 ATOM 323 CD1 ILE A 42 -9.689 -7.389 -9.452 1.00 0.00 ATOM 324 O ILE A 42 -6.513 -4.983 -5.976 1.00 0.00 ATOM 325 C ILE A 42 -5.934 -5.976 -6.422 1.00 0.00 ATOM 326 N PRO A 43 -4.594 -6.038 -6.417 1.00 0.00 ATOM 327 CA PRO A 43 -3.732 -4.878 -6.202 1.00 0.00 ATOM 328 CB PRO A 43 -2.420 -5.481 -5.695 1.00 0.00 ATOM 329 CG PRO A 43 -2.359 -6.830 -6.329 1.00 0.00 ATOM 330 CD PRO A 43 -3.775 -7.333 -6.376 1.00 0.00 ATOM 331 O PRO A 43 -3.504 -4.597 -8.583 1.00 0.00 ATOM 332 C PRO A 43 -3.491 -4.062 -7.472 1.00 0.00 ATOM 333 N MET A 44 -3.275 -2.751 -7.319 1.00 0.00 ATOM 334 CA MET A 44 -2.986 -1.882 -8.453 1.00 0.00 ATOM 335 CB MET A 44 -4.283 -1.334 -9.052 1.00 0.00 ATOM 336 CG MET A 44 -4.083 -0.500 -10.307 1.00 0.00 ATOM 337 SD MET A 44 -5.636 0.102 -10.997 1.00 0.00 ATOM 338 CE MET A 44 -6.324 -1.415 -11.656 1.00 0.00 ATOM 339 O MET A 44 -1.095 -0.446 -8.675 1.00 0.00 ATOM 340 C MET A 44 -2.123 -0.695 -8.048 1.00 0.00 ATOM 341 N MET A 45 -2.510 0.036 -6.992 1.00 0.00 ATOM 342 CA MET A 45 -1.776 1.211 -6.523 1.00 0.00 ATOM 343 CB MET A 45 -2.429 1.783 -5.263 1.00 0.00 ATOM 344 CG MET A 45 -1.787 3.065 -4.759 1.00 0.00 ATOM 345 SD MET A 45 -1.960 4.433 -5.921 1.00 0.00 ATOM 346 CE MET A 45 -3.691 4.840 -5.708 1.00 0.00 ATOM 347 O MET A 45 0.583 1.681 -6.527 1.00 0.00 ATOM 348 C MET A 45 -0.318 0.923 -6.172 1.00 0.00 ATOM 349 N LEU A 46 -0.088 -0.231 -5.538 1.00 0.00 ATOM 350 CA LEU A 46 1.242 -0.661 -5.131 1.00 0.00 ATOM 351 CB LEU A 46 1.149 -1.816 -4.132 1.00 0.00 ATOM 352 CG LEU A 46 0.510 -1.494 -2.780 1.00 0.00 ATOM 353 CD1 LEU A 46 0.353 -2.756 -1.946 1.00 0.00 ATOM 354 CD2 LEU A 46 1.369 -0.511 -2.000 1.00 0.00 ATOM 355 O LEU A 46 3.252 -1.695 -5.942 1.00 0.00 ATOM 356 C LEU A 46 2.177 -1.165 -6.233 1.00 0.00 ATOM 357 N GLU A 47 1.796 -0.997 -7.508 1.00 0.00 ATOM 358 CA GLU A 47 2.593 -1.419 -8.654 1.00 0.00 ATOM 359 CB GLU A 47 1.896 -1.037 -9.961 1.00 0.00 ATOM 360 CG GLU A 47 2.628 -1.495 -11.212 1.00 0.00 ATOM 361 CD GLU A 47 1.880 -1.150 -12.485 1.00 0.00 ATOM 362 OE1 GLU A 47 0.779 -0.569 -12.387 1.00 0.00 ATOM 363 OE2 GLU A 47 2.395 -1.461 -13.579 1.00 0.00 ATOM 364 O GLU A 47 4.947 -1.473 -9.114 1.00 0.00 ATOM 365 C GLU A 47 3.989 -0.804 -8.718 1.00 0.00 ATOM 366 N SER A 48 4.116 0.462 -8.307 1.00 0.00 ATOM 367 CA SER A 48 5.412 1.119 -8.232 1.00 0.00 ATOM 368 CB SER A 48 5.238 2.626 -8.033 1.00 0.00 ATOM 369 OG SER A 48 4.642 3.225 -9.171 1.00 0.00 ATOM 370 O SER A 48 7.273 -0.011 -7.220 1.00 0.00 ATOM 371 C SER A 48 6.185 0.538 -7.051 1.00 0.00 ATOM 372 N GLU A 49 5.548 0.558 -5.875 1.00 0.00 ATOM 373 CA GLU A 49 6.135 0.186 -4.592 1.00 0.00 ATOM 374 CB GLU A 49 5.068 0.184 -3.495 1.00 0.00 ATOM 375 CG GLU A 49 5.603 -0.143 -2.110 1.00 0.00 ATOM 376 CD GLU A 49 4.510 -0.188 -1.060 1.00 0.00 ATOM 377 OE1 GLU A 49 3.751 0.797 -0.950 1.00 0.00 ATOM 378 OE2 GLU A 49 4.413 -1.209 -0.347 1.00 0.00 ATOM 379 O GLU A 49 7.958 -1.319 -4.195 1.00 0.00 ATOM 380 C GLU A 49 6.783 -1.189 -4.540 1.00 0.00 ATOM 381 N ALA A 50 6.021 -2.213 -4.939 1.00 0.00 ATOM 382 CA ALA A 50 6.473 -3.599 -4.911 1.00 0.00 ATOM 383 CB ALA A 50 5.347 -4.532 -5.328 1.00 0.00 ATOM 384 O ALA A 50 8.322 -4.933 -5.671 1.00 0.00 ATOM 385 C ALA A 50 7.647 -3.915 -5.833 1.00 0.00 ATOM 386 N ARG A 51 7.890 -3.051 -6.823 1.00 0.00 ATOM 387 CA ARG A 51 9.020 -3.204 -7.726 1.00 0.00 ATOM 388 CB ARG A 51 8.587 -2.957 -9.173 1.00 0.00 ATOM 389 CG ARG A 51 7.573 -3.961 -9.697 1.00 0.00 ATOM 390 CD ARG A 51 7.111 -3.598 -11.099 1.00 0.00 ATOM 391 NE ARG A 51 6.096 -4.524 -11.597 1.00 0.00 ATOM 392 CZ ARG A 51 5.404 -4.341 -12.717 1.00 0.00 ATOM 393 NH1 ARG A 51 4.501 -5.236 -13.091 1.00 0.00 ATOM 394 NH2 ARG A 51 5.617 -3.263 -13.459 1.00 0.00 ATOM 395 O ARG A 51 11.301 -2.460 -7.790 1.00 0.00 ATOM 396 C ARG A 51 10.150 -2.228 -7.415 1.00 0.00 ATOM 397 N GLU A 52 9.831 -1.130 -6.722 1.00 0.00 ATOM 398 CA GLU A 52 10.789 -0.075 -6.428 1.00 0.00 ATOM 399 CB GLU A 52 10.066 1.249 -6.172 1.00 0.00 ATOM 400 CG GLU A 52 9.383 1.831 -7.399 1.00 0.00 ATOM 401 CD GLU A 52 8.626 3.108 -7.094 1.00 0.00 ATOM 402 OE1 GLU A 52 8.585 3.506 -5.910 1.00 0.00 ATOM 403 OE2 GLU A 52 8.074 3.711 -8.038 1.00 0.00 ATOM 404 O GLU A 52 12.837 -0.231 -5.186 1.00 0.00 ATOM 405 C GLU A 52 11.617 -0.404 -5.193 1.00 0.00 ATOM 406 N LEU A 53 10.954 -0.896 -4.141 1.00 0.00 ATOM 407 CA LEU A 53 11.618 -1.222 -2.889 1.00 0.00 ATOM 408 CB LEU A 53 10.593 -1.377 -1.763 1.00 0.00 ATOM 409 CG LEU A 53 9.796 -0.124 -1.395 1.00 0.00 ATOM 410 CD1 LEU A 53 8.735 -0.448 -0.355 1.00 0.00 ATOM 411 CD2 LEU A 53 10.712 0.947 -0.823 1.00 0.00 ATOM 412 O LEU A 53 11.886 -3.563 -3.388 1.00 0.00 ATOM 413 C LEU A 53 12.403 -2.522 -2.976 1.00 0.00 ATOM 414 N ALA A 54 13.683 -2.445 -2.605 1.00 0.00 ATOM 415 CA ALA A 54 14.535 -3.621 -2.487 1.00 0.00 ATOM 416 CB ALA A 54 15.987 -3.207 -2.303 1.00 0.00 ATOM 417 O ALA A 54 13.615 -3.898 -0.318 1.00 0.00 ATOM 418 C ALA A 54 14.119 -4.470 -1.285 1.00 0.00 ATOM 419 N PRO A 55 14.287 -5.806 -1.254 1.00 0.00 ATOM 420 CA PRO A 55 13.913 -6.673 -0.131 1.00 0.00 ATOM 421 CB PRO A 55 14.522 -8.029 -0.492 1.00 0.00 ATOM 422 CG PRO A 55 14.561 -8.037 -1.983 1.00 0.00 ATOM 423 CD PRO A 55 14.922 -6.638 -2.398 1.00 0.00 ATOM 424 O PRO A 55 13.720 -6.419 2.249 1.00 0.00 ATOM 425 C PRO A 55 14.415 -6.250 1.246 1.00 0.00 ATOM 426 N GLU A 56 15.618 -5.667 1.294 1.00 0.00 ATOM 427 CA GLU A 56 16.166 -5.086 2.513 1.00 0.00 ATOM 428 CB GLU A 56 17.593 -4.588 2.275 1.00 0.00 ATOM 429 CG GLU A 56 18.615 -5.697 2.088 1.00 0.00 ATOM 430 CD GLU A 56 19.990 -5.168 1.732 1.00 0.00 ATOM 431 OE1 GLU A 56 20.128 -3.939 1.559 1.00 0.00 ATOM 432 OE2 GLU A 56 20.931 -5.983 1.627 1.00 0.00 ATOM 433 O GLU A 56 15.051 -3.784 4.192 1.00 0.00 ATOM 434 C GLU A 56 15.336 -3.903 3.000 1.00 0.00 ATOM 435 N GLU A 57 14.910 -3.045 2.064 1.00 0.00 ATOM 436 CA GLU A 57 14.057 -1.903 2.367 1.00 0.00 ATOM 437 CB GLU A 57 13.967 -0.966 1.161 1.00 0.00 ATOM 438 CG GLU A 57 15.254 -0.215 0.861 1.00 0.00 ATOM 439 CD GLU A 57 15.156 0.631 -0.393 1.00 0.00 ATOM 440 OE1 GLU A 57 14.102 0.582 -1.062 1.00 0.00 ATOM 441 OE2 GLU A 57 16.132 1.344 -0.707 1.00 0.00 ATOM 442 O GLU A 57 12.017 -1.702 3.582 1.00 0.00 ATOM 443 C GLU A 57 12.641 -2.328 2.727 1.00 0.00 ATOM 444 N GLU A 58 12.131 -3.399 2.099 1.00 0.00 ATOM 445 CA GLU A 58 10.825 -3.967 2.414 1.00 0.00 ATOM 446 CB GLU A 58 10.549 -5.193 1.541 1.00 0.00 ATOM 447 CG GLU A 58 9.186 -5.824 1.771 1.00 0.00 ATOM 448 CD GLU A 58 8.935 -7.014 0.866 1.00 0.00 ATOM 449 OE1 GLU A 58 9.823 -7.337 0.049 1.00 0.00 ATOM 450 OE2 GLU A 58 7.850 -7.624 0.973 1.00 0.00 ATOM 451 O GLU A 58 9.929 -3.910 4.630 1.00 0.00 ATOM 452 C GLU A 58 10.773 -4.392 3.877 1.00 0.00 ATOM 453 N VAL A 59 11.727 -5.235 4.292 1.00 0.00 ATOM 454 CA VAL A 59 11.815 -5.719 5.667 1.00 0.00 ATOM 455 CB VAL A 59 12.950 -6.746 5.832 1.00 0.00 ATOM 456 CG1 VAL A 59 13.152 -7.085 7.301 1.00 0.00 ATOM 457 CG2 VAL A 59 12.621 -8.029 5.084 1.00 0.00 ATOM 458 O VAL A 59 11.563 -4.593 7.775 1.00 0.00 ATOM 459 C VAL A 59 12.087 -4.587 6.660 1.00 0.00 ATOM 460 N LYS A 60 12.876 -3.584 6.255 1.00 0.00 ATOM 461 CA LYS A 60 13.123 -2.392 7.060 1.00 0.00 ATOM 462 CB LYS A 60 14.145 -1.484 6.373 1.00 0.00 ATOM 463 CG LYS A 60 14.498 -0.236 7.166 1.00 0.00 ATOM 464 CD LYS A 60 15.573 0.578 6.464 1.00 0.00 ATOM 465 CE LYS A 60 15.904 1.841 7.242 1.00 0.00 ATOM 466 NZ LYS A 60 16.946 2.657 6.559 1.00 0.00 ATOM 467 O LYS A 60 11.680 -0.978 8.363 1.00 0.00 ATOM 468 C LYS A 60 11.862 -1.559 7.291 1.00 0.00 ATOM 469 N LEU A 61 10.981 -1.495 6.288 1.00 0.00 ATOM 470 CA LEU A 61 9.725 -0.764 6.397 1.00 0.00 ATOM 471 CB LEU A 61 9.349 -0.141 5.051 1.00 0.00 ATOM 472 CG LEU A 61 10.322 0.897 4.489 1.00 0.00 ATOM 473 CD1 LEU A 61 9.880 1.357 3.109 1.00 0.00 ATOM 474 CD2 LEU A 61 10.391 2.116 5.397 1.00 0.00 ATOM 475 O LEU A 61 7.421 -1.106 6.974 1.00 0.00 ATOM 476 C LEU A 61 8.533 -1.618 6.824 1.00 0.00 ATOM 477 N GLU 62 8.744 -2.921 7.044 1.00 0.00 ATOM 478 CA GLU 62 7.668 -3.855 7.352 1.00 0.00 ENDMDL